A0A077Z015_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z015, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 246 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	46.7	Very low	57.1	Low	224 Å²	224	106.9 Å²	106.9	100%	1.103	53%	0.526	S	S	*	.				0	3.4	0	-112.8	172.2	91.1	0	0	115.6
2	K	47.6	Very low	57.6	Low	195 Å²	195	98.7 Å²	98.7	85%	0.848	49%	0.485	S	S	*	.			trans	-100.4	-12.9	-177.3	-77.1	-176.6	176.5	178.7	0	116.1
3	S	57.3	Low	57.7	Low	79 Å²	79	101.9 Å²	101.9	55%	0.552	51%	0.506	S	S	*	.	S	Bend	trans	-84.5	-30.4	178.9	75.5	0	0	0	0	113.7	W5 I6 D7	S3-W5 VanDerWaalsContact C-N 3.33Å; S3-W5 PolarHBondContact O-N 2.97Å; S3-I6 PolarHBondContact O-N 3.02Å; S3-D7 WeakPolarHBondContact CB-OD2 3.32Å; S3-D7 WeakPolarHBondContact O-CB 3.36Å; S3-D7 VanDerWaalsContact O-CG 3.23Å; S3-D7 PolarHBondContact O-N 3.39Å; S3-D7 VanDerWaalsContact O-OD2 3.07Å; S3-D7 PolarHBondContact OG-OD2 2.73Å
4	H	59.1	Low	58.1	Low	136 Å²	136	100.4 Å²	100.4	63%	0.63	53%	0.53	S	S	*	.	H	α-helix	trans	-60.4	-35.6	-169.2	-162.2	-82.5	0	0	0	114.5	L8	H4-L8 VanDerWaalsContact O-CB 3.24Å; H4-L8 WeakPolarHBondContact O-CB 3.41Å; H4-L8 PolarHBondContact O-N 3.29Å
5	W	52.9	Low	58.6	Low	163 Å²	163	95.5 Å²	95.5	62%	0.617	50%	0.504	S	S	*	.	H	α-helix	trans	-75.8	-41.7	-180	-69.7	105.2	0	0	0	112.8	S3 D7 L8 F9	S3-W5 VanDerWaalsContact C-N 3.33Å; S3-W5 PolarHBondContact O-N 2.97Å; W5-D7 VanDerWaalsContact C-N 3.29Å; W5-L8 HydrophobicContact CE3-CD2 4.11Å; W5-L8 HydrophobicContact CZ3-CD2 4.11Å; W5-L8 PolarHBondContact O-N 3.37Å; W5-F9 HydrophobicContact CE3-CE2 4.2Å; W5-F9 WeakPolarHBondContact O-CD2 3.24Å; W5-F9 PolarHBondContact O-N 3.37Å
6	I	58	Low	59.2	Low	85 Å²	85	92.9 Å²	92.9	44%	0.436	50%	0.495	S	S	.	.	H	α-helix	trans	-66.1	-41.3	177.8	-60.8	172.3	0	0	0	109	S3 L8 F9 C10	S3-I6 PolarHBondContact O-N 3.02Å; I6-L8 VanDerWaalsContact C-N 3.35Å; I6-F9 PolarHBondContact O-N 3.07Å; I6-C10 WeakPolarHBondContact O-CB 3.47Å; I6-C10 PolarHBondContact O-N 3.45Å; I6-C10 PolarHBondContact O-SG 3.23Å
7	D	60.8	Low	60	Low	76 Å²	76	91.8 Å²	91.8	41%	0.406	49%	0.493	S	S	.	.	H	α-helix	trans	-66.8	-35.3	176	-63.8	-30.7	0	0	0	111.4	S3 W5 C10 S11	S3-D7 WeakPolarHBondContact CB-OD2 3.32Å; S3-D7 WeakPolarHBondContact O-CB 3.36Å; S3-D7 VanDerWaalsContact O-CG 3.23Å; S3-D7 PolarHBondContact O-N 3.39Å; S3-D7 VanDerWaalsContact O-OD2 3.07Å; S3-D7 PolarHBondContact OG-OD2 2.73Å; W5-D7 VanDerWaalsContact C-N 3.29Å; D7-C10 CarbonylContact O-C 3.5Å; D7-C10 PolarHBondContact O-N 3.46Å; D7-S11 VanDerWaalsContact O-CA 3.3Å; D7-S11 WeakPolarHBondContact O-CA 3.32Å; D7-S11 WeakPolarHBondContact O-CB 2.93Å; D7-S11 PolarHBondContact O-N 2.91Å
8	L	63	Low	60.5	Low	102 Å²	102	91.8 Å²	91.8	53%	0.534	49%	0.492	S	S	.	.	H	α-helix	trans	-65.1	-44.4	174.7	-171	73.1	0	0	0	112.4	H4 W5 I6 C10	H4-L8 VanDerWaalsContact O-CB 3.24Å; H4-L8 WeakPolarHBondContact O-CB 3.41Å; H4-L8 PolarHBondContact O-N 3.29Å; W5-L8 HydrophobicContact CE3-CD2 4.11Å; W5-L8 HydrophobicContact CZ3-CD2 4.11Å; W5-L8 PolarHBondContact O-N 3.37Å; I6-L8 VanDerWaalsContact C-N 3.35Å; L8-C10 VanDerWaalsContact C-N 3.33Å
9	F	59.9	Low	61.3	Low	58 Å²	58	89.9 Å²	89.9	25%	0.254	48%	0.482	S	S	.	.	H	α-helix	trans	-75.9	-22.5	177.8	-70.3	-63.4	0	0	0	113.1	W5 I6 F140 F141	W5-F9 HydrophobicContact CE3-CE2 4.2Å; W5-F9 WeakPolarHBondContact O-CD2 3.24Å; W5-F9 PolarHBondContact O-N 3.37Å; I6-F9 PolarHBondContact O-N 3.07Å; F9-F140 HydrophobicContact CB-CD1 4.24Å; F9-F140 HydrophobicContact CD1-CB 3.91Å; F9-F140 HydrophobicContact CD1-CD2 4.46Å; F9-F140 HydrophobicContact CD1-CG 4.09Å; F9-F141 HydrophobicContact CE1-CZ 4.47Å
10	C	61.8	Low	62.2	Low	4 Å²	4	94.7 Å²	94.7	3%	0.027	49%	0.493	C	S	.	.	H	α-helix	trans	-98.2	-13.9	179	-64.6	0	0	0	0	113.8	I6 D7 L8 M12 L27	I6-C10 WeakPolarHBondContact O-CB 3.47Å; I6-C10 PolarHBondContact O-N 3.45Å; I6-C10 PolarHBondContact O-SG 3.23Å; D7-C10 CarbonylContact O-C 3.5Å; D7-C10 PolarHBondContact O-N 3.46Å; L8-C10 VanDerWaalsContact C-N 3.33Å; C10-M12 PolarHBondContact O-N 2.93Å; C10-L27 HydrophobicContact CB-CD1 4.18Å
11	S	61.2	Low	63	Low	54 Å²	54	95.6 Å²	95.6	38%	0.378	50%	0.499	S	S	.	.			trans	-62.6	129.4	-176.9	174	0	0	0	0	109	D7 D13	D7-S11 VanDerWaalsContact O-CA 3.3Å; D7-S11 WeakPolarHBondContact O-CA 3.32Å; D7-S11 WeakPolarHBondContact O-CB 2.93Å; D7-S11 PolarHBondContact O-N 2.91Å; S11-D13 PolarHBondContact OG-N 3.19Å; S11-D13 PolarHBondContact OG-OD2 3.22Å
12	M	63	Low	64.5	Low	8 Å²	8	85.4 Å²	85.4	4%	0.039	45%	0.449	C	S	.	.			trans	-123	21	178.9	-80.3	-177	67.9	0	0	108.6	C10 G14 L15 Y23 T232 F235	C10-M12 PolarHBondContact O-N 2.93Å; M12-G14 PolarHBondContact O-N 3.42Å; M12-L15 HydrophobicContact CB-CD1 3.72Å; M12-L15 HydrophobicContact CB-CG 4.49Å; M12-L15 HydrophobicContact CE-CD1 3.5Å; M12-L15 HydrophobicContact CG-CD1 3.77Å; M12-L15 WeakPolarHBondContact O-CB 3.33Å; M12-L15 WeakPolarHBondContact O-CG 3.43Å; M12-L15 PolarHBondContact O-N 3.31Å; M12-Y23 HydrophobicContact CB-CE2 3.89Å; M12-Y23 WeakPolarHBondContact CB-OH 3.24Å; M12-Y23 HydrophobicContact CE-CD2 3.75Å; M12-Y23 HydrophobicContact CE-CE2 3.5Å; M12-Y23 HydrophobicContact SD-CD2 4.45Å; M12-Y23 HydrophobicContact SD-CE2 3.93Å; M12-T232 HydrophobicContact CE-CG2 3.45Å; M12-T232 VanDerWaalsContact CE-CG2 3.45Å; M12-F235 HydrophobicContact CE-CD2 4.24Å; M12-F235 HydrophobicContact CE-CE2 3.24Å; M12-F235 HydrophobicContact CE-CZ 3.65Å; M12-F235 HydrophobicContact SD-CE2 4.09Å; M12-F235 HydrophobicContact SD-CZ 4.17Å
13	D	58.6	Low	66	Low	141 Å²	141	78.2 Å²	78.2	75%	0.754	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	118.4	-172.7	-58.9	-36.1	0	0	0	109	S11	S11-D13 PolarHBondContact OG-N 3.19Å; S11-D13 PolarHBondContact OG-OD2 3.22Å
14	G	63.5	Low	67.1	Low	81 Å²	81	79.3 Å²	79.3	84%	0.835	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	111	-11.4	-176.1	0	0	0	0	0	114.9	M12	M12-G14 PolarHBondContact O-N 3.42Å
15	L	65.4	Low	68.2	Low	27 Å²	27	79.6 Å²	79.6	14%	0.141	41%	0.409	C	S	.	.			trans	-78	133.8	179.9	-62.9	177.2	0	0	0	112.3	M12 V17 T232 E234 F235	M12-L15 HydrophobicContact CB-CD1 3.72Å; M12-L15 HydrophobicContact CB-CG 4.49Å; M12-L15 HydrophobicContact CE-CD1 3.5Å; M12-L15 HydrophobicContact CG-CD1 3.77Å; M12-L15 WeakPolarHBondContact O-CB 3.33Å; M12-L15 WeakPolarHBondContact O-CG 3.43Å; M12-L15 PolarHBondContact O-N 3.31Å; L15-V17 PolarHBondContact O-N 3.47Å; L15-T232 HydrophobicContact CB-CG2 3.53Å; L15-T232 HydrophobicContact CD1-CG2 3.85Å; L15-T232 HydrophobicContact CG-CG2 4.26Å; L15-E234 HydrophobicContact CD2-CB 3.91Å; L15-E234 HydrophobicContact CD2-CG 3.63Å; L15-E234 VanDerWaalsContact CD2-OE1 3.24Å; L15-E234 WeakPolarHBondContact CD2-OE1 3.26Å; L15-E234 WeakPolarHBondContact CD2-OE2 3.4Å; L15-F235 HydrophobicContact CD1-CZ 4.29Å
16	S	69.3	Low	69.6	Low	53 Å²	53	72.1 Å²	72.1	37%	0.371	38%	0.381	S	S	.	.			trans	-66.3	105.7	171.2	56.7	0	0	0	0	110.1	L18 T232 Q233	S16-L18 PolarHBondContact O-N 3.34Å; S16-T232 VanDerWaalsContact O-CA 3.32Å; S16-T232 WeakPolarHBondContact O-CA 3.38Å; S16-Q233 PolarHBondContact O-N 2.8Å; S16-Q233 VanDerWaalsContact OG-CB 3.24Å; S16-Q233 WeakPolarHBondContact OG-CB 3.42Å; S16-Q233 PolarHBondContact OG-OE1 2.87Å
17	V	71.9	Confident	70.7	Confident	75 Å²	75	69.5 Å²	69.5	46%	0.455	37%	0.367	S	S	.	.	B	Isolated β-bridge	trans	-73	113.6	-179.9	-178.8	0	0	0	0	109	L15 Y23	L15-V17 PolarHBondContact O-N 3.47Å; V17-Y23 HydrophobicContact CG1-CD2 4.34Å; V17-Y23 HydrophobicContact CG1-CG 4.31Å; V17-Y23 HydrophobicContact CG2-CD2 3.95Å; V17-Y23 HydrophobicContact CG2-CE2 4.09Å; V17-Y23 HydrophobicContact CG2-CG 4.5Å
18	L	69.9	Low	71.8	Confident	92 Å²	92	73.7 Å²	73.7	48%	0.482	38%	0.378	S	S	.	.	S	Bend	trans	-82.2	-40.4	177.9	-131.5	91.5	0	0	0	111.3	S16 A231 Q233	S16-L18 PolarHBondContact O-N 3.34Å; L18-A231 PolarHBondContact N-O 2.79Å; L18-A231 VanDerWaalsContact N-O 3.12Å; L18-Q233 HydrophobicContact CD1-CB 4.39Å
19	N	75.1	Confident	72.9	Confident	56 Å²	56	71.1 Å²	71.1	30%	0.299	36%	0.361	S	S	.	.			trans	-144.9	117.2	-176.2	-177.3	-17.4	0	0	0	110.5	D21 S22 Y23	N19-D21 PolarHBondContact O-N 3.27Å; N19-D21 PolarHBondContact OD1-N 3.43Å; N19-D21 VanDerWaalsContact OD1-N 3.14Å; N19-S22 PolarHBondContact ND2-OG 3.28Å; N19-S22 PolarHBondContact O-N 2.92Å; N19-Y23 WeakPolarHBondContact O-CB 3.31Å; N19-Y23 PolarHBondContact O-N 3.07Å
20	R	78.8	Confident	74.1	Confident	185 Å²	185	69.4 Å²	69.4	70%	0.698	35%	0.353	S	S	*	.	H	α-helix	trans	-65.7	-37	-174.7	-166.4	174	-177.1	166.3	1.7	113.3	Y23 H24	R20-Y23 WeakPolarHBondContact O-CB 3.02Å; R20-Y23 PolarHBondContact O-N 3.48Å; R20-H24 PolarHBondContact O-CD2 3.42Å; R20-H24 VanDerWaalsContact O-CD2 3.25Å; R20-H24 PolarHBondContact O-N 3.36Å
21	D	80	Confident	75.3	Confident	114 Å²	114	75.1 Å²	75.1	61%	0.61	37%	0.374	S	S	*	.	H	α-helix	trans	-71.1	-38.4	179.4	-68.4	-19.7	0	0	0	111.5	N19 Y23 R25	N19-D21 PolarHBondContact O-N 3.27Å; N19-D21 PolarHBondContact OD1-N 3.43Å; N19-D21 VanDerWaalsContact OD1-N 3.14Å; D21-Y23 VanDerWaalsContact C-N 3.33Å; D21-R25 WeakPolarHBondContact O-CG 3.28Å; D21-R25 PolarHBondContact O-N 3.27Å; D21-R25 PolarHBondContact O-NE 3.3Å
22	S	77.6	Confident	76.6	Confident	10 Å²	10	75.6 Å²	75.6	7%	0.07	37%	0.371	C	S	.	.	H	α-helix	trans	-68.2	-35	172.9	-62.7	0	0	0	0	111.5	N19 R25 M26	N19-S22 PolarHBondContact ND2-OG 3.28Å; N19-S22 PolarHBondContact O-N 2.92Å; S22-R25 PolarHBondContact OG-NH2 3.26Å; S22-M26 WeakPolarHBondContact O-CB 2.98Å; S22-M26 PolarHBondContact O-N 3.48Å
23	Y	78.4	Confident	77.8	Confident	43 Å²	43	75.5 Å²	75.5	17%	0.169	37%	0.37	C	S	.	.	H	α-helix	trans	-61.9	-49.5	173.7	-177.6	-90.6	0	0	0	112.6	M12 V17 N19 R20 D21 R25 M26 L27 T232	M12-Y23 HydrophobicContact CB-CE2 3.89Å; M12-Y23 WeakPolarHBondContact CB-OH 3.24Å; M12-Y23 HydrophobicContact CE-CD2 3.75Å; M12-Y23 HydrophobicContact CE-CE2 3.5Å; M12-Y23 HydrophobicContact SD-CD2 4.45Å; M12-Y23 HydrophobicContact SD-CE2 3.93Å; V17-Y23 HydrophobicContact CG1-CD2 4.34Å; V17-Y23 HydrophobicContact CG1-CG 4.31Å; V17-Y23 HydrophobicContact CG2-CD2 3.95Å; V17-Y23 HydrophobicContact CG2-CE2 4.09Å; V17-Y23 HydrophobicContact CG2-CG 4.5Å; N19-Y23 WeakPolarHBondContact O-CB 3.31Å; N19-Y23 PolarHBondContact O-N 3.07Å; R20-Y23 WeakPolarHBondContact O-CB 3.02Å; R20-Y23 PolarHBondContact O-N 3.48Å; D21-Y23 VanDerWaalsContact C-N 3.33Å; Y23-R25 PolarHBondContact O-N 3.35Å; Y23-M26 WeakPolarHBondContact O-CB 3.42Å; Y23-M26 PolarHBondContact O-N 2.94Å; Y23-M26 VanDerWaalsContact O-N 3.14Å; Y23-L27 PolarHBondContact O-N 3.01Å; Y23-T232 HydrophobicContact CD2-CG2 4.24Å
24	H	81.1	Confident	79.3	Confident	103 Å²	103	69.3 Å²	69.3	48%	0.477	34%	0.339	S	S	.	.	H	α-helix	trans	-62.5	-42.2	177.8	-77.9	-65.4	0	0	0	112.6	R20 M26 L27 W28	R20-H24 PolarHBondContact O-CD2 3.42Å; R20-H24 VanDerWaalsContact O-CD2 3.25Å; R20-H24 PolarHBondContact O-N 3.36Å; H24-M26 VanDerWaalsContact C-N 3.28Å; H24-M26 PolarHBondContact O-N 3.2Å; H24-L27 PolarHBondContact O-N 3.23Å; H24-W28 PolarHBondContact O-N 3.12Å
25	R	82	Confident	80.6	Confident	141 Å²	141	70.5 Å²	70.5	53%	0.532	33%	0.325	S	S	.	.	H	α-helix	trans	-61.7	-38.2	174.2	-72.9	-176.3	-69.3	-164.9	2	111.8	D21 S22 Y23 W28 R29	D21-R25 WeakPolarHBondContact O-CG 3.28Å; D21-R25 PolarHBondContact O-N 3.27Å; D21-R25 PolarHBondContact O-NE 3.3Å; S22-R25 PolarHBondContact OG-NH2 3.26Å; Y23-R25 PolarHBondContact O-N 3.35Å; R25-W28 PolarHBondContact O-N 3.42Å; R25-R29 VanDerWaalsContact O-CG 3.31Å; R25-R29 WeakPolarHBondContact O-CG 3.26Å; R25-R29 PolarHBondContact O-N 3.03Å
26	M	81.3	Confident	81.9	Confident	6 Å²	6	69.6 Å²	69.6	3%	0.03	32%	0.321	C	S	.	.	H	α-helix	trans	-69.1	-43.1	179	-171.9	56.8	170.7	0	0	112.4	S22 Y23 H24 W28 R29 R30 H143 A231 F235	S22-M26 WeakPolarHBondContact O-CB 2.98Å; S22-M26 PolarHBondContact O-N 3.48Å; Y23-M26 WeakPolarHBondContact O-CB 3.42Å; Y23-M26 PolarHBondContact O-N 2.94Å; Y23-M26 VanDerWaalsContact O-N 3.14Å; H24-M26 VanDerWaalsContact C-N 3.28Å; H24-M26 PolarHBondContact O-N 3.2Å; M26-W28 VanDerWaalsContact C-N 3.31Å; M26-W28 PolarHBondContact O-N 3.14Å; M26-R29 PolarHBondContact O-N 3.37Å; M26-R30 PolarHBondContact O-N 3.25Å; M26-H143 WeakPolarHBondContact CE-NE2 3.44Å; M26-A231 HydrophobicContact CB-CB 3.93Å; M26-A231 HydrophobicContact CG-CB 4.21Å; M26-F235 HydrophobicContact CE-CD2 4.17Å; M26-F235 HydrophobicContact CE-CE2 3.85Å; M26-F235 HydrophobicContact CE-CZ 4.29Å; M26-F235 HydrophobicContact CG-CE2 4Å
27	L	82.5	Confident	82.9	Confident	30 Å²	30	67.3 Å²	67.3	16%	0.157	31%	0.305	C	S	.	.	H	α-helix	trans	-60.1	-43.5	175.3	-170.7	70.3	0	0	0	110.9	C10 Y23 H24 R29 R30 R31	C10-L27 HydrophobicContact CB-CD1 4.18Å; Y23-L27 PolarHBondContact O-N 3.01Å; H24-L27 PolarHBondContact O-N 3.23Å; L27-R29 PolarHBondContact O-N 3.21Å; L27-R30 PolarHBondContact O-N 3.38Å; L27-R31 WeakPolarHBondContact O-CG 3.37Å; L27-R31 PolarHBondContact O-N 3.24Å
28	W	83.7	Confident	83.9	Confident	165 Å²	165	68 Å²	68	63%	0.625	31%	0.31	S	S	*	.	H	α-helix	trans	-61.5	-44.1	175.9	-172.3	83.3	0	0	0	112.1	H24 R25 M26 R30 R31 M32	H24-W28 PolarHBondContact O-N 3.12Å; R25-W28 PolarHBondContact O-N 3.42Å; M26-W28 VanDerWaalsContact C-N 3.31Å; M26-W28 PolarHBondContact O-N 3.14Å; W28-R30 PolarHBondContact O-N 3.49Å; W28-R31 PolarHBondContact O-N 3.01Å; W28-M32 HydrophobicContact CD2-CG 4.14Å; W28-M32 HydrophobicContact CE3-CG 4.19Å; W28-M32 HydrophobicContact CH2-CG 4.04Å; W28-M32 HydrophobicContact CZ2-CG 3.98Å; W28-M32 HydrophobicContact CZ2-SD 4.15Å; W28-M32 HydrophobicContact CZ3-CG 4.14Å; W28-M32 WeakPolarHBondContact O-CG 3.41Å; W28-M32 PolarHBondContact O-N 3.03Å
29	R	85.8	Confident	85	Confident	47 Å²	47	66 Å²	66	18%	0.177	30%	0.301	C	S	.	.	H	α-helix	trans	-61.7	-42.1	175	-72.2	171.7	-177.2	-162.1	-2.9	112.6	R25 M26 L27 M32 M33	R25-R29 VanDerWaalsContact O-CG 3.31Å; R25-R29 WeakPolarHBondContact O-CG 3.26Å; R25-R29 PolarHBondContact O-N 3.03Å; M26-R29 PolarHBondContact O-N 3.37Å; L27-R29 PolarHBondContact O-N 3.21Å; R29-M32 PolarHBondContact O-N 3.27Å; R29-M33 WeakPolarHBondContact O-CG 3.46Å; R29-M33 PolarHBondContact O-N 3.3Å
30	R	84.3	Confident	86	Confident	22 Å²	22	63.3 Å²	63.3	8%	0.083	29%	0.287	C	S	.	.	H	α-helix	trans	-62.1	-42.6	175.9	-81.7	-175.2	157	-153.9	-8.2	111.9	M26 L27 W28 M33 A34 F235	M26-R30 PolarHBondContact O-N 3.25Å; L27-R30 PolarHBondContact O-N 3.38Å; W28-R30 PolarHBondContact O-N 3.49Å; R30-M33 HydrophobicContact CB-CE 4.48Å; R30-M33 HydrophobicContact CG-CE 4.02Å; R30-M33 PolarHBondContact O-N 3.3Å; R30-A34 WeakPolarHBondContact O-CB 3.2Å; R30-A34 PolarHBondContact O-N 3.36Å; R30-F235 VanDerWaalsContact NH2-CZ 3.35Å
31	R	87.2	Confident	86.7	Confident	125 Å²	125	57.2 Å²	57.2	47%	0.472	27%	0.272	S	S	.	.	H	α-helix	trans	-61.7	-43.3	174.7	-72.5	176.4	177.1	-173.8	-1.8	112.2	L27 W28 A34 L35	L27-R31 WeakPolarHBondContact O-CG 3.37Å; L27-R31 PolarHBondContact O-N 3.24Å; W28-R31 PolarHBondContact O-N 3.01Å; R31-A34 PolarHBondContact O-N 2.9Å; R31-L35 WeakPolarHBondContact O-CB 3.36Å; R31-L35 PolarHBondContact O-N 3.39Å
32	M	88.8	Confident	87.4	Confident	64 Å²	64	56.1 Å²	56.1	32%	0.315	27%	0.265	S	S	.	.	H	α-helix	trans	-62.7	-41.8	175.6	-70.4	-59.1	-64.2	0	0	112.1	W28 R29 L35 S36	W28-M32 HydrophobicContact CD2-CG 4.14Å; W28-M32 HydrophobicContact CE3-CG 4.19Å; W28-M32 HydrophobicContact CH2-CG 4.04Å; W28-M32 HydrophobicContact CZ2-CG 3.98Å; W28-M32 HydrophobicContact CZ2-SD 4.15Å; W28-M32 HydrophobicContact CZ3-CG 4.14Å; W28-M32 WeakPolarHBondContact O-CG 3.41Å; W28-M32 PolarHBondContact O-N 3.03Å; R29-M32 PolarHBondContact O-N 3.27Å; M32-L35 PolarHBondContact O-N 3.39Å; M32-S36 WeakPolarHBondContact O-CB 3.42Å; M32-S36 PolarHBondContact O-N 3.47Å; M32-S36 PolarHBondContact O-OG 3.32Å
33	M	89.2	Confident	88.1	Confident	5 Å²	5	55.7 Å²	55.7	3%	0.025	26%	0.262	C	S	.	.	H	α-helix	trans	-64.5	-42.3	175	-71	-175.8	-62.6	0	0	111.8	R29 R30 S36 T37 F140 K148 F218	R29-M33 WeakPolarHBondContact O-CG 3.46Å; R29-M33 PolarHBondContact O-N 3.3Å; R30-M33 HydrophobicContact CB-CE 4.48Å; R30-M33 HydrophobicContact CG-CE 4.02Å; R30-M33 PolarHBondContact O-N 3.3Å; M33-S36 WeakPolarHBondContact CA-OG 3.43Å; M33-S36 PolarHBondContact O-N 3.22Å; M33-S36 PolarHBondContact O-OG 3.49Å; M33-T37 PolarHBondContact O-N 2.88Å; M33-T37 PolarHBondContact O-OG1 3.14Å; M33-F140 HydrophobicContact CB-CE1 4.43Å; M33-F140 HydrophobicContact CB-CZ 4.14Å; M33-K148 HydrophobicContact CE-CD 4.4Å; M33-K148 HydrophobicContact SD-CD 4.07Å; M33-F218 HydrophobicContact CB-CE1 4.39Å; M33-F218 HydrophobicContact CB-CZ 4.28Å; M33-F218 HydrophobicContact CG-CD1 4.36Å; M33-F218 HydrophobicContact CG-CE1 4.34Å; M33-F218 HydrophobicContact SD-CD1 4.17Å; M33-F218 HydrophobicContact SD-CE1 4.26Å
34	A	89	Confident	88.9	Confident	11 Å²	11	55.3 Å²	55.3	9%	0.091	26%	0.264	C	S	.	.	H	α-helix	trans	-62.9	-45.8	177.5	0	0	0	0	0	111.3	R30 R31 S36 T37 V38 F140	R30-A34 WeakPolarHBondContact O-CB 3.2Å; R30-A34 PolarHBondContact O-N 3.36Å; R31-A34 PolarHBondContact O-N 2.9Å; A34-S36 VanDerWaalsContact C-N 3.35Å; A34-S36 PolarHBondContact O-N 3.04Å; A34-T37 PolarHBondContact O-N 2.97Å; A34-V38 WeakPolarHBondContact O-CG2 3.41Å; A34-V38 PolarHBondContact O-N 3.44Å; A34-V38 VanDerWaalsContact O-N 3.09Å; A34-F140 HydrophobicContact CB-CE1 4.17Å; A34-F140 HydrophobicContact CB-CZ 3.98Å
35	L	91.1	Very high	89.5	Confident	106 Å²	106	54.7 Å²	54.7	56%	0.555	27%	0.267	S	S	*	.	H	α-helix	trans	-58.1	-48.5	174.7	-174.6	69.4	0	0	0	110.8	R31 M32 T37 V38 T39	R31-L35 WeakPolarHBondContact O-CB 3.36Å; R31-L35 PolarHBondContact O-N 3.39Å; M32-L35 PolarHBondContact O-N 3.39Å; L35-T37 VanDerWaalsContact C-N 3.28Å; L35-T37 PolarHBondContact O-N 2.88Å; L35-V38 PolarHBondContact O-N 3.39Å; L35-T39 PolarHBondContact O-N 3.14Å; L35-T39 PolarHBondContact O-OG1 2.91Å
36	S	91.9	Very high	90	Very high	8 Å²	8	50.2 Å²	50.2	6%	0.056	25%	0.253	C	S	.	.	H	α-helix	trans	-61.5	-36.1	179.4	69.2	0	0	0	0	112.8	M32 M33 A34 T39 T40 F218	M32-S36 WeakPolarHBondContact O-CB 3.42Å; M32-S36 PolarHBondContact O-N 3.47Å; M32-S36 PolarHBondContact O-OG 3.32Å; M33-S36 WeakPolarHBondContact CA-OG 3.43Å; M33-S36 PolarHBondContact O-N 3.22Å; M33-S36 PolarHBondContact O-OG 3.49Å; A34-S36 VanDerWaalsContact C-N 3.35Å; A34-S36 PolarHBondContact O-N 3.04Å; S36-T39 PolarHBondContact O-N 3.37Å; S36-T40 WeakPolarHBondContact O-CG2 3.46Å; S36-T40 PolarHBondContact O-N 3.3Å; S36-T40 PolarHBondContact O-OG1 3.02Å; S36-F218 WeakPolarHBondContact OG-CE2 3.27Å
37	T	92.2	Very high	90.6	Very high	6 Å²	6	50 Å²	50	4%	0.037	25%	0.253	C	S	.	.	H	α-helix	trans	-66.2	-41.7	177.2	-53.1	0	0	0	0	111.1	M33 A34 L35 T39 T40 C41 A136 L137	M33-T37 PolarHBondContact O-N 2.88Å; M33-T37 PolarHBondContact O-OG1 3.14Å; A34-T37 PolarHBondContact O-N 2.97Å; L35-T37 VanDerWaalsContact C-N 3.28Å; L35-T37 PolarHBondContact O-N 2.88Å; T37-T39 VanDerWaalsContact C-N 3.32Å; T37-T39 PolarHBondContact O-N 3.22Å; T37-T40 WeakPolarHBondContact CA-OG1 3.22Å; T37-T40 PolarHBondContact O-N 2.91Å; T37-T40 PolarHBondContact O-OG1 3.25Å; T37-C41 PolarHBondContact O-N 2.88Å; T37-C41 PolarHBondContact O-SG 3.28Å; T37-A136 HydrophobicContact CG2-CB 3.82Å; T37-L137 HydrophobicContact CG2-CD2 4.24Å
38	V	92.5	Very high	91.1	Very high	90 Å²	90	51 Å²	51	55%	0.545	26%	0.262	S	S	.	.	H	α-helix	trans	-63	-42.4	174	175.3	0	0	0	0	110.4	A34 L35 C41 I42	A34-V38 WeakPolarHBondContact O-CG2 3.41Å; A34-V38 PolarHBondContact O-N 3.44Å; A34-V38 VanDerWaalsContact O-N 3.09Å; L35-V38 PolarHBondContact O-N 3.39Å; V38-C41 WeakPolarHBondContact O-CB 3.4Å; V38-C41 PolarHBondContact O-N 2.93Å; V38-I42 WeakPolarHBondContact O-CG1 3.5Å; V38-I42 PolarHBondContact O-N 3.29Å; V38-I42 VanDerWaalsContact O-N 3.14Å
39	T	93.5	Very high	91.5	Very high	49 Å²	49	47.3 Å²	47.3	30%	0.301	26%	0.257	S	S	.	.	H	α-helix	trans	-65.6	-38.5	177.5	-44.5	0	0	0	0	112.2	L35 S36 T37 I42 G43 I210	L35-T39 PolarHBondContact O-N 3.14Å; L35-T39 PolarHBondContact O-OG1 2.91Å; S36-T39 PolarHBondContact O-N 3.37Å; T37-T39 VanDerWaalsContact C-N 3.32Å; T37-T39 PolarHBondContact O-N 3.22Å; T39-I42 WeakPolarHBondContact O-CB 2.83Å; T39-I42 PolarHBondContact O-N 3.12Å; T39-G43 PolarHBondContact O-N 3.22Å; T39-I210 HydrophobicContact CG2-CB 4.34Å; T39-I210 HydrophobicContact CG2-CD1 4.18Å; T39-I210 HydrophobicContact CG2-CG1 3.9Å; T39-I210 HydrophobicContact CG2-CG2 3.61Å
40	T	94.6	Very high	91.8	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-69.4	-33	176.8	52.4	0	0	0	0	112.5	S36 T37 G43 V44 N133 M155 I210 Y211 A214	S36-T40 WeakPolarHBondContact O-CG2 3.46Å; S36-T40 PolarHBondContact O-N 3.3Å; S36-T40 PolarHBondContact O-OG1 3.02Å; T37-T40 WeakPolarHBondContact CA-OG1 3.22Å; T37-T40 PolarHBondContact O-N 2.91Å; T37-T40 PolarHBondContact O-OG1 3.25Å; T40-G43 CarbonylContact O-C 3.43Å; T40-G43 WeakPolarHBondContact O-CA 3.08Å; T40-G43 PolarHBondContact O-N 3.46Å; T40-G43 VanDerWaalsContact O-N 3.13Å; T40-V44 WeakPolarHBondContact O-CG2 3.31Å; T40-V44 PolarHBondContact O-N 3.4Å; T40-N133 PolarHBondContact OG1-OD1 2.69Å; T40-M155 HydrophobicContact CG2-CE 3.84Å; T40-M155 HydrophobicContact CG2-SD 4.19Å; T40-I210 HydrophobicContact CG2-CG2 4.31Å; T40-Y211 HydrophobicContact CG2-CD1 4.38Å; T40-Y211 HydrophobicContact CG2-CE1 4.15Å; T40-Y211 HydrophobicContact CG2-CE2 4.36Å; T40-Y211 PolarHBondContact O-OH 3.12Å; T40-Y211 VanDerWaalsContact O-OH 3.11Å; T40-A214 HydrophobicContact CG2-CB 3.44Å; T40-A214 VanDerWaalsContact CG2-CB 3.44Å
41	C	94	Very high	92.1	Very high	56 Å²	56	44.2 Å²	44.2	38%	0.378	25%	0.247	S	C	.	.	H	α-helix	trans	-60.9	-42.8	169.4	-72.7	0	0	0	0	111.8	T37 V38 G43 V44 V45 N133	T37-C41 PolarHBondContact O-N 2.88Å; T37-C41 PolarHBondContact O-SG 3.28Å; V38-C41 WeakPolarHBondContact O-CB 3.4Å; V38-C41 PolarHBondContact O-N 2.93Å; C41-G43 VanDerWaalsContact C-N 3.28Å; C41-G43 PolarHBondContact O-N 3.09Å; C41-V44 WeakPolarHBondContact O-CB 3.42Å; C41-V44 PolarHBondContact O-N 2.94Å; C41-V45 PolarHBondContact O-N 3.43Å; C41-N133 PolarHBondContact N-OD1 3.44Å; C41-N133 PolarHBondContact SG-OD1 2.97Å
42	I	93.9	Very high	92.3	Very high	92 Å²	92	42.2 Å²	42.2	47%	0.472	26%	0.257	S	S	.	.	H	α-helix	trans	-61.6	-41.4	172.2	-63.7	167.7	0	0	0	109.9	V38 T39 V44 V45 L46	V38-I42 WeakPolarHBondContact O-CG1 3.5Å; V38-I42 PolarHBondContact O-N 3.29Å; V38-I42 VanDerWaalsContact O-N 3.14Å; T39-I42 WeakPolarHBondContact O-CB 2.83Å; T39-I42 PolarHBondContact O-N 3.12Å; I42-V44 VanDerWaalsContact C-N 3.3Å; I42-V44 PolarHBondContact O-N 3.32Å; I42-V45 PolarHBondContact O-N 3.17Å; I42-V45 VanDerWaalsContact O-N 3.12Å; I42-L46 HydrophobicContact CG2-CD1 4Å; I42-L46 HydrophobicContact CG2-CG 4.19Å; I42-L46 WeakPolarHBondContact O-CG 3.4Å; I42-L46 PolarHBondContact O-N 2.75Å
43	G	93.5	Very high	92.4	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-56.6	-37.8	174.7	0	0	0	0	0	113.8	T39 T40 C41 V45 L46 L47 M129	T39-G43 PolarHBondContact O-N 3.22Å; T40-G43 CarbonylContact O-C 3.43Å; T40-G43 WeakPolarHBondContact O-CA 3.08Å; T40-G43 PolarHBondContact O-N 3.46Å; T40-G43 VanDerWaalsContact O-N 3.13Å; C41-G43 VanDerWaalsContact C-N 3.28Å; C41-G43 PolarHBondContact O-N 3.09Å; G43-V45 VanDerWaalsContact C-N 3.35Å; G43-V45 PolarHBondContact O-N 3.31Å; G43-L46 PolarHBondContact O-N 3.49Å; G43-L47 PolarHBondContact O-N 3.33Å; G43-M129 VanDerWaalsContact C-CE 3.45Å; G43-M129 VanDerWaalsContact O-CE 3.26Å; G43-M129 WeakPolarHBondContact O-CE 3.42Å
44	V	94.3	Very high	92.2	Very high	35 Å²	35	41.4 Å²	41.4	21%	0.212	26%	0.258	C	S	.	.	H	α-helix	trans	-59.1	-47.2	174.6	177.6	0	0	0	0	110.8	T40 C41 I42 L47 S48 M129 N133	T40-V44 WeakPolarHBondContact O-CG2 3.31Å; T40-V44 PolarHBondContact O-N 3.4Å; C41-V44 WeakPolarHBondContact O-CB 3.42Å; C41-V44 PolarHBondContact O-N 2.94Å; I42-V44 VanDerWaalsContact C-N 3.3Å; I42-V44 PolarHBondContact O-N 3.32Å; V44-L47 PolarHBondContact O-N 2.7Å; V44-S48 WeakPolarHBondContact O-CB 3.16Å; V44-S48 PolarHBondContact O-N 2.69Å; V44-S48 PolarHBondContact O-OG 3.01Å; V44-M129 HydrophobicContact CG2-CB 3.93Å; V44-M129 HydrophobicContact CG2-CE 4.33Å; V44-N133 WeakPolarHBondContact CG2-ND2 3.26Å
45	V	94	Very high	92.1	Very high	90 Å²	90	43 Å²	43	55%	0.545	27%	0.265	S	S	.	.	H	α-helix	trans	-66.9	-40.3	179.9	-179.7	0	0	0	0	110.8	C41 I42 G43 S48 V49	C41-V45 PolarHBondContact O-N 3.43Å; I42-V45 PolarHBondContact O-N 3.17Å; I42-V45 VanDerWaalsContact O-N 3.12Å; G43-V45 VanDerWaalsContact C-N 3.35Å; G43-V45 PolarHBondContact O-N 3.31Å; V45-S48 WeakPolarHBondContact CA-OG 3.44Å; V45-S48 PolarHBondContact O-N 3.32Å; V45-S48 PolarHBondContact O-OG 3.31Å; V45-V49 HydrophobicContact CG1-CG2 4.48Å; V45-V49 WeakPolarHBondContact O-CB 3.4Å; V45-V49 VanDerWaalsContact O-CG2 3.26Å; V45-V49 WeakPolarHBondContact O-CG2 3.34Å; V45-V49 PolarHBondContact O-N 2.91Å
46	L	93.1	Very high	92.1	Very high	47 Å²	47	38.1 Å²	38.1	25%	0.246	24%	0.239	C	C	.	.	H	α-helix	trans	-61.9	-49.5	176.6	-70.8	174.4	0	0	0	111.3	I42 G43 S48 V49 C50 L203 I210	I42-L46 HydrophobicContact CG2-CD1 4Å; I42-L46 HydrophobicContact CG2-CG 4.19Å; I42-L46 WeakPolarHBondContact O-CG 3.4Å; I42-L46 PolarHBondContact O-N 2.75Å; G43-L46 PolarHBondContact O-N 3.49Å; L46-S48 PolarHBondContact O-N 3.18Å; L46-V49 PolarHBondContact O-N 3.4Å; L46-C50 PolarHBondContact O-N 3.28Å; L46-C50 PolarHBondContact O-SG 2.89Å; L46-L203 HydrophobicContact CD2-CD2 4.44Å; L46-I210 HydrophobicContact CD1-CD1 4.09Å
47	L	92.6	Very high	91.8	Very high	3 Å²	3	37.7 Å²	37.7	2%	0.016	24%	0.236	C	C	.	.	H	α-helix	trans	-67.1	-36.1	-179.9	-168.1	67.6	0	0	0	112.1	G43 V44 C50 A51 A125 L126 M129 V162 T207	G43-L47 PolarHBondContact O-N 3.33Å; V44-L47 PolarHBondContact O-N 2.7Å; L47-C50 PolarHBondContact O-N 2.87Å; L47-A51 VanDerWaalsContact O-CB 3.23Å; L47-A51 WeakPolarHBondContact O-CB 3.46Å; L47-A51 PolarHBondContact O-N 2.9Å; L47-A125 HydrophobicContact CD2-CB 4.07Å; L47-L126 HydrophobicContact CB-CD2 4.33Å; L47-L126 HydrophobicContact CD2-CD2 4.07Å; L47-L126 HydrophobicContact CD2-CG 4.4Å; L47-L126 HydrophobicContact CG-CD2 4.24Å; L47-M129 HydrophobicContact CB-CE 3.82Å; L47-M129 HydrophobicContact CB-SD 4.07Å; L47-M129 HydrophobicContact CD2-CE 3.98Å; L47-M129 HydrophobicContact CD2-SD 3.36Å; L47-M129 WeakPolarHBondContact CD2-SD 3.16Å; L47-M129 HydrophobicContact CG-SD 4.33Å; L47-V162 HydrophobicContact CD1-CG1 4.3Å; L47-V162 HydrophobicContact CD1-CG2 4.15Å; L47-V162 HydrophobicContact CD2-CG2 3.84Å; L47-T207 HydrophobicContact CB-CG2 4.23Å
48	S	93.5	Very high	91.5	Very high	50 Å²	50	39.3 Å²	39.3	35%	0.35	24%	0.244	S	C	.	.	H	α-helix	trans	-65.6	-40.8	177.1	68.8	0	0	0	0	112	V44 V45 L46 A51 A52	V44-S48 WeakPolarHBondContact O-CB 3.16Å; V44-S48 PolarHBondContact O-N 2.69Å; V44-S48 PolarHBondContact O-OG 3.01Å; V45-S48 WeakPolarHBondContact CA-OG 3.44Å; V45-S48 PolarHBondContact O-N 3.32Å; V45-S48 PolarHBondContact O-OG 3.31Å; L46-S48 PolarHBondContact O-N 3.18Å; S48-A51 PolarHBondContact O-N 3.48Å; S48-A52 WeakPolarHBondContact O-CB 3.07Å; S48-A52 PolarHBondContact O-N 3.31Å
49	V	92.7	Very high	91	Very high	87 Å²	87	35 Å²	35	53%	0.527	22%	0.219	S	C	.	.	H	α-helix	trans	-64.5	-41.7	173.2	172.2	0	0	0	0	110.9	V45 L46 A52 S53	V45-V49 HydrophobicContact CG1-CG2 4.48Å; V45-V49 WeakPolarHBondContact O-CB 3.4Å; V45-V49 VanDerWaalsContact O-CG2 3.26Å; V45-V49 WeakPolarHBondContact O-CG2 3.34Å; V45-V49 PolarHBondContact O-N 2.91Å; L46-V49 PolarHBondContact O-N 3.4Å; V49-A52 PolarHBondContact O-N 2.89Å; V49-S53 VanDerWaalsContact O-CB 3.3Å; V49-S53 WeakPolarHBondContact O-CB 3.3Å; V49-S53 PolarHBondContact O-N 3.33Å
50	C	91.7	Very high	90.4	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.007	21%	0.214	C	C	.	.	H	α-helix	trans	-64.2	-44.3	175.7	-64.9	0	0	0	0	111.9	L46 L47 A52 S53 W56 A200 L203	L46-C50 PolarHBondContact O-N 3.28Å; L46-C50 PolarHBondContact O-SG 2.89Å; L47-C50 PolarHBondContact O-N 2.87Å; C50-A52 VanDerWaalsContact C-N 3.27Å; C50-A52 PolarHBondContact O-N 3.42Å; C50-S53 PolarHBondContact O-N 3.05Å; C50-S53 VanDerWaalsContact O-N 3.08Å; C50-W56 HydrophobicContact CB-CZ2 3.86Å; C50-W56 PolarHBondContact O-NE1 3.44Å; C50-A200 HydrophobicContact CB-CB 4.38Å; C50-L203 WeakPolarHBondContact SG-CB 3.24Å
51	A	91.6	Very high	89.5	Confident	4 Å²	4	35 Å²	35	3%	0.033	22%	0.215	C	C	.	.	H	α-helix	trans	-61.4	-37.3	178.8	0	0	0	0	0	111.8	L47 S48 I75 W76 T122 L126	L47-A51 VanDerWaalsContact O-CB 3.23Å; L47-A51 WeakPolarHBondContact O-CB 3.46Å; L47-A51 PolarHBondContact O-N 2.9Å; S48-A51 PolarHBondContact O-N 3.48Å; A51-I75 HydrophobicContact CB-CD1 4.47Å; A51-W76 PolarHBondContact O-NE1 2.97Å; A51-T122 HydrophobicContact CB-CG2 3.64Å; A51-L126 HydrophobicContact CB-CD1 4.46Å
52	A	90.6	Very high	88.3	Confident	83 Å²	83	34.1 Å²	34.1	69%	0.686	21%	0.209	S	C	*	.	H	α-helix	trans	-77	-22.9	175	0	0	0	0	0	113.3	S48 V49 C50	S48-A52 WeakPolarHBondContact O-CB 3.07Å; S48-A52 PolarHBondContact O-N 3.31Å; V49-A52 PolarHBondContact O-N 2.89Å; C50-A52 VanDerWaalsContact C-N 3.27Å; C50-A52 PolarHBondContact O-N 3.42Å
53	S	90.1	Very high	87.3	Confident	36 Å²	36	31.6 Å²	31.6	25%	0.252	20%	0.197	S	C	.	.			trans	-80.5	140.4	-178.1	-171.4	0	0	0	0	112.3	V49 C50 N55 W56	V49-S53 VanDerWaalsContact O-CB 3.3Å; V49-S53 WeakPolarHBondContact O-CB 3.3Å; V49-S53 PolarHBondContact O-N 3.33Å; C50-S53 PolarHBondContact O-N 3.05Å; C50-S53 VanDerWaalsContact O-N 3.08Å; S53-N55 VanDerWaalsContact C-N 3.31Å; S53-N55 PolarHBondContact OG-N 2.95Å; S53-W56 VanDerWaalsContact O-CD1 3.25Å; S53-W56 PolarHBondContact O-NE1 3.5Å
54	S	85.4	Confident	86	Confident	16 Å²	16	35.8 Å²	35.8	11%	0.112	22%	0.224	C	C	.	.	S	Bend	trans	-89.2	12.9	175.4	58.4	0	0	0	0	114.3	Q72 M73 G74 H79	S54-Q72 CarbonylContact O-C 3.51Å; S54-Q72 WeakPolarHBondContact O-CB 3.47Å; S54-M73 CarbonylContact C-O 3.57Å; S54-M73 CarbonylContact O-C 3.57Å; S54-M73 PolarHBondContact O-N 3.28Å; S54-G74 PolarHBondContact O-N 2.98Å; S54-H79 PolarHBondContact OG-CD2 3.27Å; S54-H79 VanDerWaalsContact OG-CD2 3.26Å
55	N	88	Confident	84.8	Confident	44 Å²	44	40.1 Å²	40.1	24%	0.235	25%	0.246	C	C	.	.			trans	-109.1	48.3	-170.6	-67	-23	0	0	0	112.5	S53 Q72 G198 P199 A200	S53-N55 VanDerWaalsContact C-N 3.31Å; S53-N55 PolarHBondContact OG-N 2.95Å; N55-Q72 VanDerWaalsContact OD1-CD 3.3Å; N55-Q72 PolarHBondContact OD1-OE1 3.23Å; N55-Q72 VanDerWaalsContact OD1-OE1 3.07Å; N55-G198 CarbonylContact O-C 3.12Å; N55-G198 VanDerWaalsContact O-C 3.31Å; N55-G198 VanDerWaalsContact O-CA 3.26Å; N55-G198 WeakPolarHBondContact O-CA 3.36Å; N55-P199 HydrophobicContact CB-CG 4Å; N55-P199 WeakPolarHBondContact O-CD 3.5Å; N55-A200 VanDerWaalsContact O-CB 3.27Å; N55-A200 WeakPolarHBondContact O-CB 3.17Å; N55-A200 PolarHBondContact O-N 3.5Å; N55-A200 VanDerWaalsContact O-N 3.09Å
56	W	90.2	Very high	83.7	Confident	3 Å²	3	43.1 Å²	43.1	1%	0.011	26%	0.259	C	S	.	.	S	Bend	trans	-84	-46.2	177.5	-72.3	70.3	0	0	0	112	C50 S53 M73 I75 V165 L169 G198 A200 T201 A204	C50-W56 HydrophobicContact CB-CZ2 3.86Å; C50-W56 PolarHBondContact O-NE1 3.44Å; S53-W56 VanDerWaalsContact O-CD1 3.25Å; S53-W56 PolarHBondContact O-NE1 3.5Å; W56-M73 VanDerWaalsContact CB-O 3.29Å; W56-M73 WeakPolarHBondContact CB-O 3.18Å; W56-M73 PolarHBondContact N-O 2.97Å; W56-I75 HydrophobicContact CD2-CD1 4.36Å; W56-I75 HydrophobicContact CD2-CG1 4.43Å; W56-I75 VanDerWaalsContact CE2-CD1 3.47Å; W56-I75 HydrophobicContact CH2-CD1 3.86Å; W56-I75 HydrophobicContact CZ2-CD1 3.19Å; W56-I75 HydrophobicContact CZ2-CG1 4.11Å; W56-V165 HydrophobicContact CH2-CG1 4.02Å; W56-V165 HydrophobicContact CZ3-CG1 3.94Å; W56-L169 HydrophobicContact CB-CD1 4.41Å; W56-L169 HydrophobicContact CB-CD2 3.75Å; W56-L169 HydrophobicContact CE3-CD2 3.97Å; W56-G198 WeakPolarHBondContact O-CA 3.39Å; W56-G198 PolarHBondContact O-N 3.05Å; W56-A200 HydrophobicContact CD2-CB 4.1Å; W56-A200 HydrophobicContact CG-CB 3.93Å; W56-T201 PolarHBondContact O-OG1 3.32Å; W56-A204 HydrophobicContact CH2-CB 3.84Å; W56-A204 HydrophobicContact CZ3-CB 3.75Å
57	A	86.7	Confident	82.7	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	136	173.8	0	0	0	0	0	109.3	M73 L169 V173 L195	A57-M73 HydrophobicContact CB-CB 4.28Å; A57-M73 HydrophobicContact CB-SD 4.47Å; A57-M73 PolarHBondContact N-O 3.04Å; A57-M73 PolarHBondContact O-N 3.4Å; A57-L169 HydrophobicContact CB-CD1 4.33Å; A57-V173 HydrophobicContact CB-CG2 4.21Å; A57-L195 HydrophobicContact CB-CD1 3.66Å
58	L	85.3	Confident	82	Confident	39 Å²	39	44.2 Å²	44.2	20%	0.204	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	127.8	169	-64.4	99.7	0	0	0	108	L71 Q72 R196 G198	L58-L71 WeakPolarHBondContact CA-O 3.4Å; L58-Q72 HydrophobicContact CD2-CG 4.01Å; L58-Q72 HydrophobicContact CG-CG 4.27Å; L58-R196 HydrophobicContact CB-CB 4.41Å; L58-R196 PolarHBondContact N-O 2.87Å; L58-R196 PolarHBondContact O-N 3.19Å; L58-G198 VanDerWaalsContact CD1-CA 3.45Å
59	V	82.2	Confident	81.3	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.006	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	127.6	173.5	-173.5	0	0	0	0	110.1	L71 M73 W176 Y191 L195	V59-L71 HydrophobicContact CB-CB 4.49Å; V59-L71 PolarHBondContact N-O 3.42Å; V59-L71 PolarHBondContact O-N 2.78Å; V59-M73 HydrophobicContact CG2-CE 4.08Å; V59-M73 HydrophobicContact CG2-SD 4.44Å; V59-W176 HydrophobicContact CB-CH2 4.19Å; V59-W176 HydrophobicContact CB-CZ3 3.61Å; V59-W176 HydrophobicContact CG1-CE3 4.33Å; V59-W176 HydrophobicContact CG1-CH2 3.64Å; V59-W176 HydrophobicContact CG1-CZ3 3.24Å; V59-W176 HydrophobicContact CG2-CE3 4.43Å; V59-W176 HydrophobicContact CG2-CZ3 3.77Å; V59-Y191 HydrophobicContact CG1-CD2 4.37Å; V59-Y191 HydrophobicContact CG1-CE2 3.59Å; V59-L195 HydrophobicContact CG2-CD1 4.38Å
60	E	80.1	Confident	80.9	Confident	44 Å²	44	40.4 Å²	40.4	21%	0.206	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	118.8	179.8	-76.2	173	-172.5	0	0	109.7	Q70 R193	E60-Q70 HydrophobicContact CG-CG 3.61Å; E60-Q70 PolarHBondContact OE1-NE2 2.88Å; E60-R193 HydrophobicContact CB-CB 4.02Å; E60-R193 PolarHBondContact O-N 2.96Å
61	L	75.3	Confident	80.6	Confident	5 Å²	5	40.4 Å²	40.4	3%	0.026	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	133.1	169.2	-59.9	164	0	0	0	107.4	I69 L71 W176 Y191	L61-I69 HydrophobicContact CB-CB 4.22Å; L61-I69 HydrophobicContact CD1-CG2 4.48Å; L61-I69 PolarHBondContact N-O 3.41Å; L61-I69 PolarHBondContact O-N 3.47Å; L61-L71 HydrophobicContact CD1-CD1 3.39Å; L61-L71 HydrophobicContact CD1-CG 4.39Å; L61-L71 HydrophobicContact CG-CD1 4.19Å; L61-W176 HydrophobicContact CD1-CH2 4.21Å; L61-W176 HydrophobicContact CD1-CZ2 4.33Å; L61-W176 HydrophobicContact CD2-CH2 3.86Å; L61-W176 HydrophobicContact CD2-CZ2 4.04Å; L61-W176 HydrophobicContact CG-CH2 4.19Å; L61-Y191 HydrophobicContact CD2-CD2 3.93Å
62	S	70.2	Confident	80.4	Confident	36 Å²	36	42.2 Å²	42.2	25%	0.252	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	122.1	169	65.2	0	0	0	0	108.8	D190 S192	S62-D190 PolarHBondContact N-O 2.96Å; S62-S192 WeakPolarHBondContact CB-OG 3.48Å; S62-S192 PolarHBondContact N-OG 3.45Å; S62-S192 VanDerWaalsContact N-OG 3.15Å; S62-S192 WeakPolarHBondContact OG-CB 3.44Å; S62-S192 PolarHBondContact OG-OG 3.23Å
63	L	71.4	Confident	80.2	Confident	40 Å²	40	38.8 Å²	38.8	21%	0.209	22%	0.216	C	C	.	.			trans	-80.8	156.5	169.7	-95.6	64.8	0	0	0	110.3	D65 N66 T67 I69 E189	L63-D65 PolarHBondContact O-N 2.94Å; L63-D65 VanDerWaalsContact O-N 3.13Å; L63-N66 PolarHBondContact O-N 3.46Å; L63-T67 WeakPolarHBondContact CB-OG1 3.31Å; L63-T67 PolarHBondContact N-O 3.47Å; L63-I69 HydrophobicContact CD1-CD1 3.57Å; L63-I69 HydrophobicContact CD1-CG1 4.21Å; L63-I69 HydrophobicContact CD2-CD1 4.33Å; L63-E189 HydrophobicContact CD1-CB 4.16Å; L63-E189 HydrophobicContact CD1-CG 3.9Å
64	P	67.8	Low	80.2	Confident	87 Å²	87	37.2 Å²	37.2	57%	0.565	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-23.3	175.1	22.4	-32.8	0	0	0	113.2	N66 V188	P64-N66 PolarHBondContact O-N 3.4Å; P64-N66 VanDerWaalsContact O-N 3.08Å; P64-V188 HydrophobicContact CG-CG1 4.19Å
65	D	69.4	Low	80.4	Confident	127 Å²	127	36.5 Å²	36.5	68%	0.679	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.4	20.7	-178.6	-61.9	-28.1	0	0	0	114.5	L63 T67	L63-D65 PolarHBondContact O-N 2.94Å; L63-D65 VanDerWaalsContact O-N 3.13Å; D65-T67 PolarHBondContact O-N 3Å; D65-T67 VanDerWaalsContact O-N 3.08Å
66	N	70	Confident	80.5	Confident	153 Å²	153	39.7 Å²	39.7	82%	0.818	21%	0.21	S	C	*	.	S	Bend	trans	58.2	19.5	-176.2	-155.6	39	0	0	0	114.1	L63 P64	L63-N66 PolarHBondContact O-N 3.46Å; P64-N66 PolarHBondContact O-N 3.4Å; P64-N66 VanDerWaalsContact O-N 3.08Å
67	T	72.7	Confident	80.4	Confident	17 Å²	17	39.6 Å²	39.6	10%	0.104	21%	0.209	C	C	.	.			trans	-95.7	133.4	172.8	54.5	0	0	0	0	109.5	L63 D65 N84	L63-T67 WeakPolarHBondContact CB-OG1 3.31Å; L63-T67 PolarHBondContact N-O 3.47Å; D65-T67 PolarHBondContact O-N 3Å; D65-T67 VanDerWaalsContact O-N 3.08Å; T67-N84 HydrophobicContact CG2-CB 4.06Å
68	T	76.8	Confident	80.5	Confident	56 Å²	56	39.7 Å²	39.7	34%	0.344	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	126.7	175.3	56.1	0	0	0	0	109.4	L83	T68-L83 PolarHBondContact N-O 2.87Å; T68-L83 WeakPolarHBondContact O-CB 3.48Å; T68-L83 PolarHBondContact O-N 3.22Å; T68-L83 WeakPolarHBondContact OG1-CB 3.39Å; T68-L83 WeakPolarHBondContact OG1-CD1 3.31Å
69	I	80.1	Confident	80.6	Confident	6 Å²	6	40.4 Å²	40.4	3%	0.031	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	113.7	176.2	-57.7	177.9	0	0	0	107	L61 L63 L71 K80 V81 I82	L61-I69 HydrophobicContact CB-CB 4.22Å; L61-I69 HydrophobicContact CD1-CG2 4.48Å; L61-I69 PolarHBondContact N-O 3.41Å; L61-I69 PolarHBondContact O-N 3.47Å; L63-I69 HydrophobicContact CD1-CD1 3.57Å; L63-I69 HydrophobicContact CD1-CG1 4.21Å; L63-I69 HydrophobicContact CD2-CD1 4.33Å; I69-L71 HydrophobicContact CG2-CG 4.28Å; I69-K80 HydrophobicContact CG2-CD 4.28Å; I69-K80 HydrophobicContact CG2-CG 3.78Å; I69-V81 WeakPolarHBondContact CA-O 3.3Å; I69-I82 HydrophobicContact CG1-CG1 4.38Å; I69-I82 HydrophobicContact CG1-CG2 4.42Å
70	Q	84.1	Confident	80.8	Confident	51 Å²	51	42.6 Å²	42.6	24%	0.238	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	118.4	172.4	-85	178.3	-7.9	0	0	109.5	E60 V81 L83	E60-Q70 HydrophobicContact CG-CG 3.61Å; E60-Q70 PolarHBondContact OE1-NE2 2.88Å; Q70-V81 HydrophobicContact CB-CB 4.15Å; Q70-V81 PolarHBondContact N-O 3.31Å; Q70-V81 PolarHBondContact O-N 3.49Å; Q70-L83 HydrophobicContact CG-CD1 4.24Å
71	L	84.1	Confident	81.1	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	111.1	175.3	-71.2	163.1	0	0	0	109.1	L58 V59 L61 I69 K80 W176	L58-L71 WeakPolarHBondContact CA-O 3.4Å; V59-L71 HydrophobicContact CB-CB 4.49Å; V59-L71 PolarHBondContact N-O 3.42Å; V59-L71 PolarHBondContact O-N 2.78Å; L61-L71 HydrophobicContact CD1-CD1 3.39Å; L61-L71 HydrophobicContact CD1-CG 4.39Å; L61-L71 HydrophobicContact CG-CD1 4.19Å; I69-L71 HydrophobicContact CG2-CG 4.28Å; L71-K80 HydrophobicContact CD2-CB 3.93Å; L71-K80 HydrophobicContact CD2-CG 3.97Å; L71-W176 HydrophobicContact CD1-CH2 3.77Å; L71-W176 HydrophobicContact CD1-CZ2 4.3Å
72	Q	88.4	Confident	81.6	Confident	42 Å²	42	43.5 Å²	43.5	20%	0.196	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	102.7	173.5	-66.1	177.6	-11.9	0	0	108.4	S54 N55 L58 E78 H79	S54-Q72 CarbonylContact O-C 3.51Å; S54-Q72 WeakPolarHBondContact O-CB 3.47Å; N55-Q72 VanDerWaalsContact OD1-CD 3.3Å; N55-Q72 PolarHBondContact OD1-OE1 3.23Å; N55-Q72 VanDerWaalsContact OD1-OE1 3.07Å; L58-Q72 HydrophobicContact CD2-CG 4.01Å; L58-Q72 HydrophobicContact CG-CG 4.27Å; Q72-E78 CarbonylContact O-C 3.58Å; Q72-E78 WeakPolarHBondContact O-CA 3.49Å; Q72-E78 WeakPolarHBondContact O-CB 3.46Å; Q72-H79 HydrophobicContact CB-CB 4.08Å; Q72-H79 PolarHBondContact N-O 3.02Å; Q72-H79 PolarHBondContact O-N 3.43Å
73	M	87.1	Confident	82.1	Confident	10 Å²	10	44.2 Å²	44.2	5%	0.049	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	127.4	-177.7	-61.1	-179.9	175.4	0	0	110.5	S54 W56 A57 V59 V173 W176	S54-M73 CarbonylContact C-O 3.57Å; S54-M73 CarbonylContact O-C 3.57Å; S54-M73 PolarHBondContact O-N 3.28Å; W56-M73 VanDerWaalsContact CB-O 3.29Å; W56-M73 WeakPolarHBondContact CB-O 3.18Å; W56-M73 PolarHBondContact N-O 2.97Å; A57-M73 HydrophobicContact CB-CB 4.28Å; A57-M73 HydrophobicContact CB-SD 4.47Å; A57-M73 PolarHBondContact N-O 3.04Å; A57-M73 PolarHBondContact O-N 3.4Å; V59-M73 HydrophobicContact CG2-CE 4.08Å; V59-M73 HydrophobicContact CG2-SD 4.44Å; M73-V173 HydrophobicContact SD-CG2 4.1Å; M73-W176 HydrophobicContact CE-CD2 4.41Å; M73-W176 HydrophobicContact CE-CE3 3.64Å; M73-W176 HydrophobicContact CE-CH2 4.39Å; M73-W176 HydrophobicContact CE-CZ3 3.56Å
74	G	89.3	Confident	82.4	Confident	3 Å²	3	47.3 Å²	47.3	3%	0.031	25%	0.245	C	C	.	.			trans	-109.8	-171.7	168.4	0	0	0	0	0	112.9	S54 G77 Y95	S54-G74 PolarHBondContact O-N 2.98Å; G74-G77 CarbonylContact C-O 3.08Å; G74-G77 WeakPolarHBondContact CA-O 3.43Å; G74-G77 PolarHBondContact N-O 3.12Å; G74-Y95 VanDerWaalsContact O-CE2 3.28Å; G74-Y95 WeakPolarHBondContact O-CE2 3.48Å
75	I	89.9	Confident	82.8	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.005	26%	0.256	C	S	.	.	S	Bend	trans	-80.2	-38.9	173.5	-70.2	160.6	0	0	0	111.6	A51 W56 Y95 A119 T122 V165	A51-I75 HydrophobicContact CB-CD1 4.47Å; W56-I75 HydrophobicContact CD2-CD1 4.36Å; W56-I75 HydrophobicContact CD2-CG1 4.43Å; W56-I75 VanDerWaalsContact CE2-CD1 3.47Å; W56-I75 HydrophobicContact CH2-CD1 3.86Å; W56-I75 HydrophobicContact CZ2-CD1 3.19Å; W56-I75 HydrophobicContact CZ2-CG1 4.11Å; I75-Y95 WeakPolarHBondContact O-CD2 3.41Å; I75-A119 HydrophobicContact CG2-CB 4.1Å; I75-T122 HydrophobicContact CD1-CG2 4.03Å; I75-T122 WeakPolarHBondContact CD1-OG1 3.38Å; I75-V165 HydrophobicContact CD1-CG1 4.44Å
76	W	89.6	Confident	83	Confident	112 Å²	112	46 Å²	46	42%	0.424	26%	0.26	S	S	.	.	S	Bend	trans	-94.6	-19	-174.1	-55.9	105.8	0	0	0	114	A51 Y95 F96 A119	A51-W76 PolarHBondContact O-NE1 2.97Å; W76-Y95 PolarHBondContact O-N 3.05Å; W76-F96 HydrophobicContact CE3-CD2 4.3Å; W76-F96 HydrophobicContact CE3-CE2 4.27Å; W76-A119 HydrophobicContact CE3-CB 4.47Å; W76-A119 HydrophobicContact CH2-CB 4.38Å; W76-A119 HydrophobicContact CZ3-CB 4.04Å
77	G	88.4	Confident	83.3	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.6	-175.8	-176.8	0	0	0	0	0	110.8	G74 I93	G74-G77 CarbonylContact C-O 3.08Å; G74-G77 WeakPolarHBondContact CA-O 3.43Å; G74-G77 PolarHBondContact N-O 3.12Å; G77-I93 CarbonylContact C-O 3.57Å; G77-I93 WeakPolarHBondContact CA-O 3.18Å
78	E	88.4	Confident	83.6	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.009	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	144	-179.2	59.8	-174.8	173.7	0	0	111.1	Q72 W92 I93 Y95 R105 L106	Q72-E78 CarbonylContact O-C 3.58Å; Q72-E78 WeakPolarHBondContact O-CA 3.49Å; Q72-E78 WeakPolarHBondContact O-CB 3.46Å; E78-W92 VanDerWaalsContact O-CE3 3.23Å; E78-I93 HydrophobicContact CG-CB 3.76Å; E78-I93 HydrophobicContact CG-CD1 4.12Å; E78-I93 HydrophobicContact CG-CG2 4.28Å; E78-I93 PolarHBondContact N-O 3.23Å; E78-I93 PolarHBondContact O-N 2.88Å; E78-Y95 HydrophobicContact CB-CE1 4.19Å; E78-Y95 HydrophobicContact CG-CE1 3.97Å; E78-R105 IonicContact OE1-CZ 3.67Å; E78-R105 VanDerWaalsContact OE1-CZ 3.23Å; E78-R105 IonicContact OE1-NH1 2.97Å; E78-R105 IonicContact OE1-NH2 3.52Å; E78-R105 PolarHBondContact OE1-NH2 2.86Å; E78-R105 IonicContact OE2-CZ 2.59Å; E78-R105 VanDerWaalsContact OE2-CZ 3.22Å; E78-R105 IonicContact OE2-NH1 3.23Å; E78-R105 PolarHBondContact OE2-NH1 3.44Å; E78-R105 IonicContact OE2-NH2 2.71Å; E78-R105 PolarHBondContact OE2-NH2 3.39Å; E78-L106 WeakPolarHBondContact OE1-CD1 3.49Å
79	H	88.3	Confident	84	Confident	54 Å²	54	49.1 Å²	49.1	25%	0.25	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	116.1	168.2	-90.6	-90.8	0	0	0	108.9	S54 Q72 S90 W92	S54-H79 PolarHBondContact OG-CD2 3.27Å; S54-H79 VanDerWaalsContact OG-CD2 3.26Å; Q72-H79 HydrophobicContact CB-CB 4.08Å; Q72-H79 PolarHBondContact N-O 3.02Å; Q72-H79 PolarHBondContact O-N 3.43Å; H79-S90 PolarHBondContact ND1-OG 2.92Å; H79-S90 VanDerWaalsContact ND1-OG 3.12Å; H79-W92 AromaticContact CD2-CE3 3.13Å; H79-W92 AromaticContact CD2-CZ3 3.43Å; H79-W92 VanDerWaalsContact CD2-CZ3 3.43Å; H79-W92 WeakPolarHBondContact CD2-CZ3 3.24Å; H79-W92 AromaticContact CG-CE3 3.83Å; H79-W92 AromaticContact NE2-CD2 3.97Å; H79-W92 AromaticContact NE2-CE3 3.31Å; H79-W92 VanDerWaalsContact NE2-CE3 3.31Å; H79-W92 AromaticContact NE2-CZ3 3.87Å
80	K	86.3	Confident	84.2	Confident	47 Å²	47	52.4 Å²	52.4	20%	0.204	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	111.3	170.2	-177	-179.6	-176.9	176	0	108.5	I69 L71 I82 S90 L91 I93	I69-K80 HydrophobicContact CG2-CD 4.28Å; I69-K80 HydrophobicContact CG2-CG 3.78Å; L71-K80 HydrophobicContact CD2-CB 3.93Å; L71-K80 HydrophobicContact CD2-CG 3.97Å; K80-I82 HydrophobicContact CD-CD1 4.4Å; K80-I82 HydrophobicContact CD-CG1 4.38Å; K80-I82 HydrophobicContact CG-CG1 4.16Å; K80-S90 CarbonylContact O-C 3.31Å; K80-S90 WeakPolarHBondContact O-CA 3.38Å; K80-L91 HydrophobicContact CB-CB 4.46Å; K80-L91 PolarHBondContact N-O 2.73Å; K80-L91 PolarHBondContact O-N 2.95Å; K80-I93 HydrophobicContact CB-CD1 3.91Å; K80-I93 HydrophobicContact CD-CD1 4.42Å
81	V	86.6	Confident	84.4	Confident	18 Å²	18	54.8 Å²	54.8	11%	0.109	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	111.8	175.9	-177	0	0	0	0	108.1	I69 Q70 L83 S88 T89	I69-V81 WeakPolarHBondContact CA-O 3.3Å; Q70-V81 HydrophobicContact CB-CB 4.15Å; Q70-V81 PolarHBondContact N-O 3.31Å; Q70-V81 PolarHBondContact O-N 3.49Å; V81-L83 HydrophobicContact CG1-CG 4.41Å; V81-S88 WeakPolarHBondContact CG1-OG 3.39Å; V81-T89 CarbonylContact C-O 3.5Å; V81-T89 WeakPolarHBondContact CA-O 3.09Å
82	I	84	Confident	84.5	Confident	51 Å²	51	59.9 Å²	59.9	26%	0.262	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	116.4	176.8	-52.5	172.9	0	0	0	107.5	I69 K80 S88 T89	I69-I82 HydrophobicContact CG1-CG1 4.38Å; I69-I82 HydrophobicContact CG1-CG2 4.42Å; K80-I82 HydrophobicContact CD-CD1 4.4Å; K80-I82 HydrophobicContact CD-CG1 4.38Å; K80-I82 HydrophobicContact CG-CG1 4.16Å; I82-S88 WeakPolarHBondContact O-CA 3.1Å; I82-T89 PolarHBondContact N-O 3.41Å; I82-T89 PolarHBondContact O-N 2.95Å
83	L	81	Confident	84.4	Confident	51 Å²	51	58 Å²	58	27%	0.267	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	105	175.9	-69	145.3	0	0	0	108.3	T68 Q70 V81	T68-L83 PolarHBondContact N-O 2.87Å; T68-L83 WeakPolarHBondContact O-CB 3.48Å; T68-L83 PolarHBondContact O-N 3.22Å; T68-L83 WeakPolarHBondContact OG1-CB 3.39Å; T68-L83 WeakPolarHBondContact OG1-CD1 3.31Å; Q70-L83 HydrophobicContact CG-CD1 4.24Å; V81-L83 HydrophobicContact CG1-CG 4.41Å
84	N	79.3	Confident	84.5	Confident	104 Å²	104	60 Å²	60	56%	0.556	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.8	86	172.9	-167.9	1.5	0	0	0	108.7	T67 S86 H87	T67-N84 HydrophobicContact CG2-CB 4.06Å; N84-S86 PolarHBondContact O-N 3.36Å; N84-H87 PolarHBondContact N-O 3.24Å; N84-H87 PolarHBondContact O-N 2.98Å
85	G	75.4	Confident	84.3	Confident	76 Å²	76	60.5 Å²	60.5	78%	0.784	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.7	-106.4	-174.9	0	0	0	0	0	112.4
86	S	73.2	Confident	84	Confident	110 Å²	110	64 Å²	64	77%	0.769	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-17.3	179.8	56.4	0	0	0	0	114.2	N84	N84-S86 PolarHBondContact O-N 3.36Å
87	H	75.5	Confident	83.4	Confident	136 Å²	136	65.1 Å²	65.1	63%	0.63	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.5	119.4	-177.5	-72.6	-86.9	0	0	0	110.3	N84	N84-H87 PolarHBondContact N-O 3.24Å; N84-H87 PolarHBondContact O-N 2.98Å
88	S	80.3	Confident	82.7	Confident	73 Å²	73	67 Å²	67	51%	0.51	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	119.3	170.2	-179.3	0	0	0	0	108.8	V81 I82	V81-S88 WeakPolarHBondContact CG1-OG 3.39Å; I82-S88 WeakPolarHBondContact O-CA 3.1Å
89	T	84	Confident	81.9	Confident	83 Å²	83	68.2 Å²	68.2	51%	0.509	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	125	172.5	52.4	0	0	0	0	108.6	V81 I82	V81-T89 CarbonylContact C-O 3.5Å; V81-T89 WeakPolarHBondContact CA-O 3.09Å; I82-T89 PolarHBondContact N-O 3.41Å; I82-T89 PolarHBondContact O-N 2.95Å
90	S	85	Confident	81.4	Confident	76 Å²	76	68 Å²	68	53%	0.531	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	117.4	177.6	164.8	0	0	0	0	109.5	H79 K80	H79-S90 PolarHBondContact ND1-OG 2.92Å; H79-S90 VanDerWaalsContact ND1-OG 3.12Å; K80-S90 CarbonylContact O-C 3.31Å; K80-S90 WeakPolarHBondContact O-CA 3.38Å
91	L	87.6	Confident	80.6	Confident	101 Å²	101	71.6 Å²	71.6	53%	0.529	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	125.5	174.2	-177.7	70.1	0	0	0	109.6	K80 I93	K80-L91 HydrophobicContact CB-CB 4.46Å; K80-L91 PolarHBondContact N-O 2.73Å; K80-L91 PolarHBondContact O-N 2.95Å; L91-I93 HydrophobicContact CD2-CD1 4.46Å; L91-I93 HydrophobicContact CD2-CG1 4.23Å; L91-I93 HydrophobicContact CG-CG1 4.29Å
92	W	87.5	Confident	79.8	Confident	108 Å²	108	78.8 Å²	78.8	41%	0.409	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	127.7	171.9	173	-114.3	0	0	0	110.4	E78 H79	E78-W92 VanDerWaalsContact O-CE3 3.23Å; H79-W92 AromaticContact CD2-CE3 3.13Å; H79-W92 AromaticContact CD2-CZ3 3.43Å; H79-W92 VanDerWaalsContact CD2-CZ3 3.43Å; H79-W92 WeakPolarHBondContact CD2-CZ3 3.24Å; H79-W92 AromaticContact CG-CE3 3.83Å; H79-W92 AromaticContact NE2-CD2 3.97Å; H79-W92 AromaticContact NE2-CE3 3.31Å; H79-W92 VanDerWaalsContact NE2-CE3 3.31Å; H79-W92 AromaticContact NE2-CZ3 3.87Å
93	I	86.5	Confident	79.2	Confident	3 Å²	3	78.1 Å²	78.1	2%	0.015	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	106.4	179.4	-59.5	156.2	0	0	0	108	G77 E78 K80 L91 P100 I103 L106	G77-I93 CarbonylContact C-O 3.57Å; G77-I93 WeakPolarHBondContact CA-O 3.18Å; E78-I93 HydrophobicContact CG-CB 3.76Å; E78-I93 HydrophobicContact CG-CD1 4.12Å; E78-I93 HydrophobicContact CG-CG2 4.28Å; E78-I93 PolarHBondContact N-O 3.23Å; E78-I93 PolarHBondContact O-N 2.88Å; K80-I93 HydrophobicContact CB-CD1 3.91Å; K80-I93 HydrophobicContact CD-CD1 4.42Å; L91-I93 HydrophobicContact CD2-CD1 4.46Å; L91-I93 HydrophobicContact CD2-CG1 4.23Å; L91-I93 HydrophobicContact CG-CG1 4.29Å; I93-P100 HydrophobicContact CG2-CG 4.39Å; I93-I103 HydrophobicContact CD1-CD1 3.62Å; I93-I103 HydrophobicContact CG1-CD1 4Å; I93-I103 HydrophobicContact CG2-CD1 3.92Å; I93-L106 HydrophobicContact CG2-CD2 4.4Å
94	P	87.9	Confident	78.5	Confident	52 Å²	52	81.2 Å²	81.2	34%	0.338	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	144.3	176.1	30.5	-33.6	0	0	0	111.5
95	Y	85.3	Confident	78	Confident	13 Å²	13	77.6 Å²	77.6	5%	0.051	46%	0.457	C	S	.	.			trans	-82.5	-23.4	174.8	-60.3	-32.3	0	0	0	113.4	G74 I75 W76 E78 L106 H115	G74-Y95 VanDerWaalsContact O-CE2 3.28Å; G74-Y95 WeakPolarHBondContact O-CE2 3.48Å; I75-Y95 WeakPolarHBondContact O-CD2 3.41Å; W76-Y95 PolarHBondContact O-N 3.05Å; E78-Y95 HydrophobicContact CB-CE1 4.19Å; E78-Y95 HydrophobicContact CG-CE1 3.97Å; Y95-L106 HydrophobicContact CD1-CD2 3.62Å; Y95-L106 HydrophobicContact CE1-CD2 3.79Å; Y95-H115 HydrophobicContact CD2-CB 3.92Å; Y95-H115 AromaticContact CD2-CG 3.77Å; Y95-H115 AromaticContact CD2-ND1 3.73Å; Y95-H115 HydrophobicContact CE2-CB 4.34Å; Y95-H115 AromaticContact CE2-CE1 3.62Å; Y95-H115 AromaticContact CE2-CG 3.77Å; Y95-H115 AromaticContact CE2-ND1 3.24Å; Y95-H115 WeakPolarHBondContact CE2-ND1 3.36Å; Y95-H115 HydrophobicContact CG-CB 4.36Å; Y95-H115 AromaticContact CZ-CE1 3.47Å; Y95-H115 VanDerWaalsContact CZ-CE1 3.47Å; Y95-H115 AromaticContact CZ-ND1 3.63Å; Y95-H115 AromaticContact CZ-NE2 3.94Å; Y95-H115 PolarHBondContact OH-CE1 2.93Å
96	F	83.1	Confident	77.8	Confident	73 Å²	73	74.3 Å²	74.3	32%	0.32	42%	0.422	S	S	.	.	S	Bend	trans	-120.3	141.1	-173.4	-57.4	-86.1	0	0	0	110.7	W76 G98 R116 A119	W76-F96 HydrophobicContact CE3-CD2 4.3Å; W76-F96 HydrophobicContact CE3-CE2 4.27Å; F96-G98 VanDerWaalsContact C-N 3.34Å; F96-R116 HydrophobicContact CE1-CG 3.79Å; F96-R116 HydrophobicContact CZ-CG 4.3Å; F96-A119 HydrophobicContact CE2-CB 3.89Å; F96-A119 HydrophobicContact CZ-CB 3.61Å
97	P	78	Confident	77.7	Confident	137 Å²	137	76.5 Å²	76.5	89%	0.89	42%	0.417	S	S	*	.	S	Bend	cis	-76.1	-12.6	3.6	31.1	-35.8	0	0	0	114.7
98	G	73.6	Confident	77.7	Confident	39 Å²	39	72.3 Å²	72.3	40%	0.402	40%	0.4	S	S	.	.			trans	-172.3	150.1	171.1	0	0	0	0	0	109.3	F96	F96-G98 VanDerWaalsContact C-N 3.34Å
99	P	72.6	Confident	77.7	Confident	27 Å²	27	75.4 Å²	75.4	18%	0.175	41%	0.408	C	S	.	.			trans	-66.9	151.3	179.4	29.9	-36	0	0	0	110.9	L106	P99-L106 HydrophobicContact CB-CB 3.54Å; P99-L106 HydrophobicContact CB-CD2 3.55Å; P99-L106 HydrophobicContact CB-CG 4.16Å; P99-L106 HydrophobicContact CG-CB 3.69Å; P99-L106 HydrophobicContact CG-CD2 4.35Å
100	P	75.9	Confident	77.6	Confident	49 Å²	49	76.9 Å²	76.9	32%	0.318	41%	0.409	S	S	.	.			trans	-53.3	136.3	174	-23.8	32.5	0	0	0	111.3	I93 E102 I103	I93-P100 HydrophobicContact CG2-CG 4.39Å; P100-E102 PolarHBondContact O-N 2.92Å; P100-E102 VanDerWaalsContact O-N 3.08Å; P100-I103 PolarHBondContact O-N 3.25Å
101	P	69.5	Low	77.5	Confident	124 Å²	124	73.8 Å²	73.8	81%	0.805	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-16.2	-172.7	26.7	-35.3	0	0	0	113.9	I103	P101-I103 VanDerWaalsContact C-N 3.26Å; P101-I103 PolarHBondContact O-N 3.35Å
102	E	69.9	Low	77.3	Confident	168 Å²	168	71.3 Å²	71.3	79%	0.785	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-23.6	179.6	-63.2	176.2	-177.3	0	0	112.8	P100 H104	P100-E102 PolarHBondContact O-N 2.92Å; P100-E102 VanDerWaalsContact O-N 3.08Å; E102-H104 PolarHBondContact O-N 3.16Å
103	I	71.4	Confident	77.4	Confident	38 Å²	38	70.9 Å²	70.9	20%	0.195	37%	0.374	C	S	.	.			trans	-99.3	91.6	-172	-54.5	172.7	0	0	0	110	I93 P100 P101 R105 L106	I93-I103 HydrophobicContact CD1-CD1 3.62Å; I93-I103 HydrophobicContact CG1-CD1 4Å; I93-I103 HydrophobicContact CG2-CD1 3.92Å; P100-I103 PolarHBondContact O-N 3.25Å; P101-I103 VanDerWaalsContact C-N 3.26Å; P101-I103 PolarHBondContact O-N 3.35Å; I103-R105 HydrophobicContact CG2-CG 3.7Å; I103-R105 PolarHBondContact O-N 2.89Å; I103-R105 VanDerWaalsContact O-N 3.15Å; I103-L106 HydrophobicContact CB-CD1 4.28Å; I103-L106 HydrophobicContact CG2-CD1 3.44Å; I103-L106 VanDerWaalsContact CG2-CD1 3.44Å; I103-L106 PolarHBondContact O-N 2.92Å; I103-L106 VanDerWaalsContact O-N 3.12Å
104	H	66.9	Low	77.5	Confident	115 Å²	115	73.2 Å²	73.2	53%	0.532	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-53.8	-35.3	-177.6	-67.9	-60.3	0	0	0	114.2	E102 L106 K107 Y187	E102-H104 PolarHBondContact O-N 3.16Å; H104-L106 VanDerWaalsContact C-N 3.3Å; H104-L106 PolarHBondContact O-N 3.42Å; H104-K107 VanDerWaalsContact O-CB 3.23Å; H104-K107 WeakPolarHBondContact O-CB 3.3Å; H104-K107 PolarHBondContact O-N 3.47Å; H104-Y187 HydrophobicContact CB-CE1 3.89Å
105	R	69.4	Low	77.5	Confident	28 Å²	28	71.4 Å²	71.4	11%	0.106	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-62.8	-32.4	-179.5	75.7	-168.9	166.8	114.7	-3.4	113.5	E78 I103 K107	E78-R105 IonicContact OE1-CZ 3.67Å; E78-R105 VanDerWaalsContact OE1-CZ 3.23Å; E78-R105 IonicContact OE1-NH1 2.97Å; E78-R105 IonicContact OE1-NH2 3.52Å; E78-R105 PolarHBondContact OE1-NH2 2.86Å; E78-R105 IonicContact OE2-CZ 2.59Å; E78-R105 VanDerWaalsContact OE2-CZ 3.22Å; E78-R105 IonicContact OE2-NH1 3.23Å; E78-R105 PolarHBondContact OE2-NH1 3.44Å; E78-R105 IonicContact OE2-NH2 2.71Å; E78-R105 PolarHBondContact OE2-NH2 3.39Å; I103-R105 HydrophobicContact CG2-CG 3.7Å; I103-R105 PolarHBondContact O-N 2.89Å; I103-R105 VanDerWaalsContact O-N 3.15Å; R105-K107 VanDerWaalsContact C-N 3.32Å
106	L	71.6	Confident	77.8	Confident	7 Å²	7	76.4 Å²	76.4	4%	0.037	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	-85.9	-4	178.3	-78.1	90.2	0	0	0	112.8	E78 I93 Y95 P99 I103 H104 N108 Q112	E78-L106 WeakPolarHBondContact OE1-CD1 3.49Å; I93-L106 HydrophobicContact CG2-CD2 4.4Å; Y95-L106 HydrophobicContact CD1-CD2 3.62Å; Y95-L106 HydrophobicContact CE1-CD2 3.79Å; P99-L106 HydrophobicContact CB-CB 3.54Å; P99-L106 HydrophobicContact CB-CD2 3.55Å; P99-L106 HydrophobicContact CB-CG 4.16Å; P99-L106 HydrophobicContact CG-CB 3.69Å; P99-L106 HydrophobicContact CG-CD2 4.35Å; I103-L106 HydrophobicContact CB-CD1 4.28Å; I103-L106 HydrophobicContact CG2-CD1 3.44Å; I103-L106 VanDerWaalsContact CG2-CD1 3.44Å; I103-L106 PolarHBondContact O-N 2.92Å; I103-L106 VanDerWaalsContact O-N 3.12Å; H104-L106 VanDerWaalsContact C-N 3.3Å; H104-L106 PolarHBondContact O-N 3.42Å; L106-N108 VanDerWaalsContact C-N 3.28Å; L106-Q112 WeakPolarHBondContact O-CG 3.39Å; L106-Q112 PolarHBondContact O-NE2 3.41Å
107	K	69.6	Low	78.3	Confident	156 Å²	156	74.5 Å²	74.5	68%	0.678	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-74.6	-20.7	174.4	-169	176.7	175.4	-178.6	0	112.2	H104 R105 M109	H104-K107 VanDerWaalsContact O-CB 3.23Å; H104-K107 WeakPolarHBondContact O-CB 3.3Å; H104-K107 PolarHBondContact O-N 3.47Å; R105-K107 VanDerWaalsContact C-N 3.32Å; K107-M109 PolarHBondContact O-N 2.99Å
108	N	76.4	Confident	79	Confident	49 Å²	49	68.1 Å²	68.1	26%	0.262	35%	0.346	S	S	.	.			trans	-61.7	119.4	179.8	-70.6	-21.2	0	0	0	110.7	L106 E110 L111 Q112	L106-N108 VanDerWaalsContact C-N 3.28Å; N108-E110 VanDerWaalsContact C-N 3.28Å; N108-E110 PolarHBondContact O-N 2.71Å; N108-L111 HydrophobicContact CB-CB 4.22Å; N108-L111 PolarHBondContact O-N 2.87Å; N108-L111 VanDerWaalsContact O-N 3.16Å; N108-Q112 PolarHBondContact O-N 2.89Å
109	M	80	Confident	79.9	Confident	137 Å²	137	66.6 Å²	66.6	68%	0.675	33%	0.33	S	S	*	.	H	α-helix	trans	-60.9	-38.2	-174.5	-158.5	174.1	74.7	0	0	111.7	K107 L111 Q112 H113	K107-M109 PolarHBondContact O-N 2.99Å; M109-L111 PolarHBondContact O-N 3.3Å; M109-Q112 PolarHBondContact O-N 2.91Å; M109-H113 PolarHBondContact O-CD2 3.38Å; M109-H113 PolarHBondContact O-N 3.21Å; M109-H113 VanDerWaalsContact O-N 3.1Å
110	E	82.4	Confident	80.9	Confident	114 Å²	114	69.2 Å²	69.2	53%	0.533	35%	0.346	S	S	.	.	H	α-helix	trans	-59.9	-45.5	176.2	-62.6	-170.4	171.8	0	0	112.3	N108 Q112 H113 F114 N175	N108-E110 VanDerWaalsContact C-N 3.28Å; N108-E110 PolarHBondContact O-N 2.71Å; E110-Q112 VanDerWaalsContact C-N 3.33Å; E110-Q112 PolarHBondContact O-N 3.48Å; E110-H113 WeakPolarHBondContact O-CB 3.49Å; E110-H113 PolarHBondContact O-N 3.22Å; E110-H113 VanDerWaalsContact O-N 3.11Å; E110-F114 WeakPolarHBondContact O-CD2 3.31Å; E110-F114 PolarHBondContact O-N 3.42Å; E110-F114 VanDerWaalsContact O-N 3.16Å; E110-N175 PolarHBondContact OE2-ND2 3.11Å
111	L	81.7	Confident	81.9	Confident	11 Å²	11	70.3 Å²	70.3	6%	0.058	35%	0.345	C	S	.	.	H	α-helix	trans	-65	-39.8	-179.1	-157.1	68.2	0	0	0	111.2	N108 M109 H113 F114 H115 S172 W176	N108-L111 HydrophobicContact CB-CB 4.22Å; N108-L111 PolarHBondContact O-N 2.87Å; N108-L111 VanDerWaalsContact O-N 3.16Å; M109-L111 PolarHBondContact O-N 3.3Å; L111-H113 VanDerWaalsContact C-N 3.29Å; L111-H113 PolarHBondContact O-N 3.36Å; L111-F114 PolarHBondContact O-N 3.2Å; L111-H115 PolarHBondContact O-CD2 3.05Å; L111-H115 PolarHBondContact O-N 3.41Å; L111-H115 VanDerWaalsContact O-N 3.16Å; L111-S172 WeakPolarHBondContact CD1-OG 3.29Å; L111-W176 HydrophobicContact CD1-CB 4.34Å
112	Q	84.4	Confident	83	Confident	49 Å²	49	64.5 Å²	64.5	23%	0.229	31%	0.308	C	S	.	.	H	α-helix	trans	-61.8	-36.4	173.6	-65.9	-174.4	2	0	0	112.6	L106 N108 M109 E110 H115 R116	L106-Q112 WeakPolarHBondContact O-CG 3.39Å; L106-Q112 PolarHBondContact O-NE2 3.41Å; N108-Q112 PolarHBondContact O-N 2.89Å; M109-Q112 PolarHBondContact O-N 2.91Å; E110-Q112 VanDerWaalsContact C-N 3.33Å; E110-Q112 PolarHBondContact O-N 3.48Å; Q112-H115 PolarHBondContact O-N 2.86Å; Q112-R116 WeakPolarHBondContact O-CB 3.32Å; Q112-R116 VanDerWaalsContact O-CG 3.25Å; Q112-R116 WeakPolarHBondContact O-CG 3.36Å; Q112-R116 PolarHBondContact O-N 3.36Å
113	H	88.8	Confident	84.2	Confident	99 Å²	99	58.9 Å²	58.9	46%	0.458	29%	0.29	S	S	.	.	H	α-helix	trans	-65.7	-39.7	176	-73.5	-61.4	0	0	0	112.3	M109 E110 L111 R116 A117	M109-H113 PolarHBondContact O-CD2 3.38Å; M109-H113 PolarHBondContact O-N 3.21Å; M109-H113 VanDerWaalsContact O-N 3.1Å; E110-H113 WeakPolarHBondContact O-CB 3.49Å; E110-H113 PolarHBondContact O-N 3.22Å; E110-H113 VanDerWaalsContact O-N 3.11Å; L111-H113 VanDerWaalsContact C-N 3.29Å; L111-H113 PolarHBondContact O-N 3.36Å; H113-R116 PolarHBondContact O-N 3.03Å; H113-A117 WeakPolarHBondContact O-CB 3.5Å; H113-A117 PolarHBondContact O-N 2.81Å
114	F	89.5	Confident	85.4	Confident	52 Å²	52	60.4 Å²	60.4	23%	0.228	30%	0.297	C	S	.	.	H	α-helix	trans	-61.8	-46.3	174.6	-70.1	-67.4	0	0	0	111.9	E110 L111 R116 A117 M118 T168 H171 N175	E110-F114 WeakPolarHBondContact O-CD2 3.31Å; E110-F114 PolarHBondContact O-N 3.42Å; E110-F114 VanDerWaalsContact O-N 3.16Å; L111-F114 PolarHBondContact O-N 3.2Å; F114-R116 PolarHBondContact O-N 2.98Å; F114-A117 PolarHBondContact O-N 2.92Å; F114-M118 WeakPolarHBondContact O-CG 3.4Å; F114-M118 PolarHBondContact O-N 3.33Å; F114-T168 HydrophobicContact CB-CG2 4.21Å; F114-T168 HydrophobicContact CD1-CG2 3.8Å; F114-H171 HydrophobicContact CD1-CB 4.49Å; F114-H171 HydrophobicContact CE1-CB 3.93Å; F114-H171 HydrophobicContact CZ-CB 4.42Å; F114-N175 HydrophobicContact CE2-CB 4.33Å
115	H	88.1	Confident	86.8	Confident	15 Å²	15	54.9 Å²	54.9	7%	0.069	27%	0.272	C	S	.	.	H	α-helix	trans	-63.5	-40.7	178	-64.2	-56.3	0	0	0	113	Y95 L111 Q112 M118 A119	Y95-H115 HydrophobicContact CD2-CB 3.92Å; Y95-H115 AromaticContact CD2-CG 3.77Å; Y95-H115 AromaticContact CD2-ND1 3.73Å; Y95-H115 HydrophobicContact CE2-CB 4.34Å; Y95-H115 AromaticContact CE2-CE1 3.62Å; Y95-H115 AromaticContact CE2-CG 3.77Å; Y95-H115 AromaticContact CE2-ND1 3.24Å; Y95-H115 WeakPolarHBondContact CE2-ND1 3.36Å; Y95-H115 HydrophobicContact CG-CB 4.36Å; Y95-H115 AromaticContact CZ-CE1 3.47Å; Y95-H115 VanDerWaalsContact CZ-CE1 3.47Å; Y95-H115 AromaticContact CZ-ND1 3.63Å; Y95-H115 AromaticContact CZ-NE2 3.94Å; Y95-H115 PolarHBondContact OH-CE1 2.93Å; L111-H115 PolarHBondContact O-CD2 3.05Å; L111-H115 PolarHBondContact O-N 3.41Å; L111-H115 VanDerWaalsContact O-N 3.16Å; Q112-H115 PolarHBondContact O-N 2.86Å; H115-M118 HydrophobicContact CB-CE 4.45Å; H115-M118 VanDerWaalsContact ND1-CE 3.27Å; H115-M118 WeakPolarHBondContact ND1-CE 3.45Å; H115-M118 PolarHBondContact O-N 3.31Å; H115-A119 PolarHBondContact O-N 3.21Å
116	R	91	Very high	88	Confident	118 Å²	118	55.8 Å²	55.8	45%	0.445	28%	0.279	S	S	.	.	H	α-helix	trans	-62.1	-46.6	174.1	-74.7	171.3	-178	-173.7	5	111.8	F96 Q112 H113 F114 A119 V120	F96-R116 HydrophobicContact CE1-CG 3.79Å; F96-R116 HydrophobicContact CZ-CG 4.3Å; Q112-R116 WeakPolarHBondContact O-CB 3.32Å; Q112-R116 VanDerWaalsContact O-CG 3.25Å; Q112-R116 WeakPolarHBondContact O-CG 3.36Å; Q112-R116 PolarHBondContact O-N 3.36Å; H113-R116 PolarHBondContact O-N 3.03Å; F114-R116 PolarHBondContact O-N 2.98Å; R116-A119 PolarHBondContact O-N 2.79Å; R116-V120 VanDerWaalsContact O-CG2 3.32Å; R116-V120 WeakPolarHBondContact O-CG2 3.3Å; R116-V120 PolarHBondContact O-N 2.93Å
117	A	92.8	Very high	89.2	Confident	32 Å²	32	58.9 Å²	58.9	26%	0.264	30%	0.301	S	S	.	.	H	α-helix	trans	-60.2	-47.3	177.5	0	0	0	0	0	111	H113 F114 A119 V120 F121 T168	H113-A117 WeakPolarHBondContact O-CB 3.5Å; H113-A117 PolarHBondContact O-N 2.81Å; F114-A117 PolarHBondContact O-N 2.92Å; A117-A119 PolarHBondContact O-N 3.33Å; A117-V120 PolarHBondContact O-N 3.23Å; A117-F121 HydrophobicContact CB-CD2 4.4Å; A117-F121 HydrophobicContact CB-CE2 4.46Å; A117-F121 WeakPolarHBondContact O-CD2 3.16Å; A117-F121 PolarHBondContact O-N 2.74Å; A117-T168 HydrophobicContact CB-CG2 4.16Å
118	M	92.8	Very high	90.4	Very high	3 Å²	3	53.1 Å²	53.1	2%	0.015	28%	0.277	C	S	.	.	H	α-helix	trans	-55.7	-50.8	176.4	-73	-171.5	-71.2	0	0	111.8	F114 H115 V120 F121 T122 T168 L169	F114-M118 WeakPolarHBondContact O-CG 3.4Å; F114-M118 PolarHBondContact O-N 3.33Å; H115-M118 HydrophobicContact CB-CE 4.45Å; H115-M118 VanDerWaalsContact ND1-CE 3.27Å; H115-M118 WeakPolarHBondContact ND1-CE 3.45Å; H115-M118 PolarHBondContact O-N 3.31Å; M118-V120 VanDerWaalsContact C-N 3.34Å; M118-V120 PolarHBondContact O-N 3.46Å; M118-F121 PolarHBondContact O-N 3.48Å; M118-T122 WeakPolarHBondContact O-CB 3.2Å; M118-T122 PolarHBondContact O-N 2.9Å; M118-T122 PolarHBondContact O-OG1 3.14Å; M118-T168 HydrophobicContact CG-CG2 3.51Å; M118-T168 HydrophobicContact SD-CG2 4.44Å; M118-L169 HydrophobicContact SD-CB 3.79Å; M118-L169 HydrophobicContact SD-CD1 4.09Å
119	A	92.8	Very high	91.3	Very high	8 Å²	8	50.8 Å²	50.8	7%	0.066	27%	0.265	C	S	.	.	H	α-helix	trans	-59.7	-42.8	-180	0	0	0	0	0	112.7	I75 W76 F96 H115 R116 A117 A123	I75-A119 HydrophobicContact CG2-CB 4.1Å; W76-A119 HydrophobicContact CE3-CB 4.47Å; W76-A119 HydrophobicContact CH2-CB 4.38Å; W76-A119 HydrophobicContact CZ3-CB 4.04Å; F96-A119 HydrophobicContact CE2-CB 3.89Å; F96-A119 HydrophobicContact CZ-CB 3.61Å; H115-A119 PolarHBondContact O-N 3.21Å; R116-A119 PolarHBondContact O-N 2.79Å; A117-A119 PolarHBondContact O-N 3.33Å; A119-A123 WeakPolarHBondContact O-CB 3.43Å; A119-A123 PolarHBondContact O-N 2.76Å
120	V	94.3	Very high	92	Very high	82 Å²	82	49 Å²	49	50%	0.497	26%	0.261	S	S	.	.	H	α-helix	trans	-66.3	-47.4	178.7	172.4	0	0	0	0	111.3	R116 A117 M118 T122 A123 I124	R116-V120 VanDerWaalsContact O-CG2 3.32Å; R116-V120 WeakPolarHBondContact O-CG2 3.3Å; R116-V120 PolarHBondContact O-N 2.93Å; A117-V120 PolarHBondContact O-N 3.23Å; M118-V120 VanDerWaalsContact C-N 3.34Å; M118-V120 PolarHBondContact O-N 3.46Å; V120-T122 VanDerWaalsContact C-N 3.33Å; V120-T122 PolarHBondContact O-N 3.31Å; V120-A123 PolarHBondContact O-N 3.49Å; V120-I124 HydrophobicContact CG1-CD1 3.72Å; V120-I124 HydrophobicContact CG1-CG1 4.39Å; V120-I124 VanDerWaalsContact O-CG1 3.31Å; V120-I124 WeakPolarHBondContact O-CG1 3.46Å; V120-I124 PolarHBondContact O-N 3.02Å
121	F	95.8	Very high	92.6	Very high	72 Å²	72	45.3 Å²	45.3	32%	0.316	25%	0.251	S	S	.	.	H	α-helix	trans	-65.5	-35.8	179.2	-79.2	-67.3	0	0	0	112.4	A117 M118 A125 V164 V165	A117-F121 HydrophobicContact CB-CD2 4.4Å; A117-F121 HydrophobicContact CB-CE2 4.46Å; A117-F121 WeakPolarHBondContact O-CD2 3.16Å; A117-F121 PolarHBondContact O-N 2.74Å; M118-F121 PolarHBondContact O-N 3.48Å; F121-A125 VanDerWaalsContact O-CB 3.26Å; F121-A125 WeakPolarHBondContact O-CB 3.4Å; F121-A125 PolarHBondContact O-N 3.24Å; F121-V164 HydrophobicContact CD1-CG1 4.13Å; F121-V164 HydrophobicContact CD2-CG1 3.63Å; F121-V164 HydrophobicContact CE1-CG1 4.11Å; F121-V164 HydrophobicContact CE2-CG1 3.63Å; F121-V164 HydrophobicContact CG-CG1 3.92Å; F121-V164 HydrophobicContact CZ-CG1 3.87Å; F121-V165 HydrophobicContact CB-CG2 3.56Å
122	T	94.1	Very high	93.2	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.012	25%	0.248	C	C	.	.	H	α-helix	trans	-65.6	-43	172.9	-56.8	0	0	0	0	111.8	A51 I75 M118 V120 A125 L126	A51-T122 HydrophobicContact CB-CG2 3.64Å; I75-T122 HydrophobicContact CD1-CG2 4.03Å; I75-T122 WeakPolarHBondContact CD1-OG1 3.38Å; M118-T122 WeakPolarHBondContact O-CB 3.2Å; M118-T122 PolarHBondContact O-N 2.9Å; M118-T122 PolarHBondContact O-OG1 3.14Å; V120-T122 VanDerWaalsContact C-N 3.33Å; V120-T122 PolarHBondContact O-N 3.31Å; T122-A125 PolarHBondContact O-N 3.18Å; T122-L126 HydrophobicContact CG2-CD1 4.3Å; T122-L126 WeakPolarHBondContact O-CG 3.38Å; T122-L126 PolarHBondContact O-N 2.93Å
123	A	94.9	Very high	93.6	Very high	49 Å²	49	43.1 Å²	43.1	41%	0.405	24%	0.24	S	C	.	.	H	α-helix	trans	-63.2	-44.5	177.2	0	0	0	0	0	111.9	A119 V120 L126 S127	A119-A123 WeakPolarHBondContact O-CB 3.43Å; A119-A123 PolarHBondContact O-N 2.76Å; V120-A123 PolarHBondContact O-N 3.49Å; A123-L126 PolarHBondContact O-N 3.42Å; A123-S127 PolarHBondContact O-N 3.32Å
124	I	96.2	Very high	93.7	Very high	70 Å²	70	40.3 Å²	40.3	36%	0.359	24%	0.238	S	C	.	.	H	α-helix	trans	-60.7	-47.1	174.4	-67.8	169.2	0	0	0	110	V120 L126 S127 L128	V120-I124 HydrophobicContact CG1-CD1 3.72Å; V120-I124 HydrophobicContact CG1-CG1 4.39Å; V120-I124 VanDerWaalsContact O-CG1 3.31Å; V120-I124 WeakPolarHBondContact O-CG1 3.46Å; V120-I124 PolarHBondContact O-N 3.02Å; I124-L126 PolarHBondContact O-N 3.49Å; I124-S127 PolarHBondContact O-N 3.09Å; I124-S127 PolarHBondContact O-OG 3.02Å; I124-L128 HydrophobicContact CG2-CD1 3.82Å; I124-L128 HydrophobicContact CG2-CG 4.19Å; I124-L128 WeakPolarHBondContact O-CB 3.43Å; I124-L128 WeakPolarHBondContact O-CG 3.33Å; I124-L128 PolarHBondContact O-N 3.35Å
125	A	95.7	Very high	93.8	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-57.1	-48.9	178.3	0	0	0	0	0	111.7	L47 F121 T122 S127 L128 M129 C161 V162	L47-A125 HydrophobicContact CD2-CB 4.07Å; F121-A125 VanDerWaalsContact O-CB 3.26Å; F121-A125 WeakPolarHBondContact O-CB 3.4Å; F121-A125 PolarHBondContact O-N 3.24Å; T122-A125 PolarHBondContact O-N 3.18Å; A125-S127 VanDerWaalsContact C-N 3.32Å; A125-S127 PolarHBondContact O-N 3.46Å; A125-L128 PolarHBondContact O-N 3.26Å; A125-M129 WeakPolarHBondContact O-CG 3.48Å; A125-M129 PolarHBondContact O-N 3.5Å; A125-C161 HydrophobicContact CB-CB 3.9Å; A125-V162 HydrophobicContact CB-CG2 4.2Å
126	L	95.4	Very high	93.9	Very high	47 Å²	47	40.5 Å²	40.5	25%	0.246	24%	0.239	C	C	.	.	H	α-helix	trans	-60	-41.5	178	-72.2	171.8	0	0	0	112.1	L47 A51 T122 A123 I124 M129 V130	L47-L126 HydrophobicContact CB-CD2 4.33Å; L47-L126 HydrophobicContact CD2-CD2 4.07Å; L47-L126 HydrophobicContact CD2-CG 4.4Å; L47-L126 HydrophobicContact CG-CD2 4.24Å; A51-L126 HydrophobicContact CB-CD1 4.46Å; T122-L126 HydrophobicContact CG2-CD1 4.3Å; T122-L126 WeakPolarHBondContact O-CG 3.38Å; T122-L126 PolarHBondContact O-N 2.93Å; A123-L126 PolarHBondContact O-N 3.42Å; I124-L126 PolarHBondContact O-N 3.49Å; L126-M129 HydrophobicContact CD2-SD 4.16Å; L126-M129 PolarHBondContact O-N 3.36Å; L126-V130 WeakPolarHBondContact O-CG2 3.48Å; L126-V130 PolarHBondContact O-N 2.87Å; L126-V130 VanDerWaalsContact O-N 3.14Å
127	S	95.7	Very high	93.8	Very high	71 Å²	71	38.6 Å²	38.6	50%	0.497	24%	0.237	S	C	.	.	H	α-helix	trans	-63.9	-42.9	176.5	75.6	0	0	0	0	112.4	A123 I124 A125 M129 V130 A131	A123-S127 PolarHBondContact O-N 3.32Å; I124-S127 PolarHBondContact O-N 3.09Å; I124-S127 PolarHBondContact O-OG 3.02Å; A125-S127 VanDerWaalsContact C-N 3.32Å; A125-S127 PolarHBondContact O-N 3.46Å; S127-M129 VanDerWaalsContact C-N 3.33Å; S127-M129 PolarHBondContact O-N 3.3Å; S127-V130 PolarHBondContact O-N 3.43Å; S127-A131 PolarHBondContact O-N 3.3Å
128	L	96.2	Very high	93.6	Very high	35 Å²	35	41.4 Å²	41.4	18%	0.183	24%	0.242	C	C	.	.	H	α-helix	trans	-66.6	-35.7	177.6	-72	177.1	0	0	0	111.7	I124 A125 A131 S132 L154 L157 V158	I124-L128 HydrophobicContact CG2-CD1 3.82Å; I124-L128 HydrophobicContact CG2-CG 4.19Å; I124-L128 WeakPolarHBondContact O-CB 3.43Å; I124-L128 WeakPolarHBondContact O-CG 3.33Å; I124-L128 PolarHBondContact O-N 3.35Å; A125-L128 PolarHBondContact O-N 3.26Å; L128-A131 PolarHBondContact O-N 3.25Å; L128-S132 VanDerWaalsContact O-CB 3.3Å; L128-S132 WeakPolarHBondContact O-CB 3.4Å; L128-S132 PolarHBondContact O-N 2.99Å; L128-S132 PolarHBondContact O-OG 3.49Å; L128-L154 HydrophobicContact CD2-CD2 4.1Å; L128-L157 HydrophobicContact CD1-CB 4.25Å; L128-V158 HydrophobicContact CB-CG2 3.49Å; L128-V158 VanDerWaalsContact CB-CG2 3.49Å
129	M	95.5	Very high	93.2	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-64.6	-43.8	175.8	-68.8	168.2	104.2	0	0	111.8	G43 V44 L47 A125 L126 S127 S132 N133 V158 T207 Y211	G43-M129 VanDerWaalsContact C-CE 3.45Å; G43-M129 VanDerWaalsContact O-CE 3.26Å; G43-M129 WeakPolarHBondContact O-CE 3.42Å; V44-M129 HydrophobicContact CG2-CB 3.93Å; V44-M129 HydrophobicContact CG2-CE 4.33Å; L47-M129 HydrophobicContact CB-CE 3.82Å; L47-M129 HydrophobicContact CB-SD 4.07Å; L47-M129 HydrophobicContact CD2-CE 3.98Å; L47-M129 HydrophobicContact CD2-SD 3.36Å; L47-M129 WeakPolarHBondContact CD2-SD 3.16Å; L47-M129 HydrophobicContact CG-SD 4.33Å; A125-M129 WeakPolarHBondContact O-CG 3.48Å; A125-M129 PolarHBondContact O-N 3.5Å; L126-M129 HydrophobicContact CD2-SD 4.16Å; L126-M129 PolarHBondContact O-N 3.36Å; S127-M129 VanDerWaalsContact C-N 3.33Å; S127-M129 PolarHBondContact O-N 3.3Å; M129-S132 WeakPolarHBondContact CA-OG 3.42Å; M129-S132 PolarHBondContact O-N 2.91Å; M129-S132 PolarHBondContact O-OG 3.38Å; M129-N133 PolarHBondContact O-N 3Å; M129-N133 PolarHBondContact O-ND2 3.17Å; M129-V158 HydrophobicContact CE-CG1 4.45Å; M129-V158 HydrophobicContact CG-CB 4.31Å; M129-V158 HydrophobicContact CG-CG1 3.45Å; M129-V158 VanDerWaalsContact CG-CG1 3.45Å; M129-V158 HydrophobicContact CG-CG2 3.82Å; M129-V158 HydrophobicContact SD-CG1 4.22Å; M129-T207 HydrophobicContact CE-CG2 3.9Å; M129-Y211 HydrophobicContact CE-CD2 4.2Å; M129-Y211 HydrophobicContact CE-CE2 3.24Å; M129-Y211 VanDerWaalsContact CE-CZ 3.44Å; M129-Y211 VanDerWaalsContact CE-OH 3.3Å; M129-Y211 WeakPolarHBondContact CE-OH 3.29Å; M129-Y211 HydrophobicContact CG-CE1 4.02Å; M129-Y211 HydrophobicContact CG-CE2 4.39Å; M129-Y211 WeakPolarHBondContact CG-OH 3.4Å
130	V	94.1	Very high	92.8	Very high	99 Å²	99	42.5 Å²	42.5	60%	0.6	25%	0.245	S	C	*	.	H	α-helix	trans	-62.3	-47	176.1	174.5	0	0	0	0	109.9	L126 S127 S132 N133 G134	L126-V130 WeakPolarHBondContact O-CG2 3.48Å; L126-V130 PolarHBondContact O-N 2.87Å; L126-V130 VanDerWaalsContact O-N 3.14Å; S127-V130 PolarHBondContact O-N 3.43Å; V130-S132 PolarHBondContact O-N 3.4Å; V130-N133 PolarHBondContact O-N 3.5Å; V130-G134 PolarHBondContact O-N 3.48Å
131	A	94.1	Very high	92	Very high	38 Å²	38	45.8 Å²	45.8	31%	0.314	25%	0.253	S	S	.	.	H	α-helix	trans	-60.2	-45.5	176.7	0	0	0	0	0	112.3	S127 L128 N133 G134 F135	S127-A131 PolarHBondContact O-N 3.3Å; L128-A131 PolarHBondContact O-N 3.25Å; A131-N133 PolarHBondContact O-N 2.9Å; A131-G134 PolarHBondContact O-N 3.11Å; A131-F135 WeakPolarHBondContact O-CD2 3.3Å; A131-F135 PolarHBondContact O-N 3Å
132	S	94.3	Very high	91.2	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-64.9	-38.9	-179.1	67.4	0	0	0	0	112.4	L128 M129 V130 F135 A136	L128-S132 VanDerWaalsContact O-CB 3.3Å; L128-S132 WeakPolarHBondContact O-CB 3.4Å; L128-S132 PolarHBondContact O-N 2.99Å; L128-S132 PolarHBondContact O-OG 3.49Å; M129-S132 WeakPolarHBondContact CA-OG 3.42Å; M129-S132 PolarHBondContact O-N 2.91Å; M129-S132 PolarHBondContact O-OG 3.38Å; V130-S132 PolarHBondContact O-N 3.4Å; S132-F135 PolarHBondContact O-N 3.44Å; S132-A136 VanDerWaalsContact O-CB 3.3Å; S132-A136 WeakPolarHBondContact O-CB 3.32Å; S132-A136 PolarHBondContact O-N 3.49Å
133	N	92.6	Very high	90.1	Very high	13 Å²	13	46.8 Å²	46.8	7%	0.07	26%	0.259	C	S	.	.	H	α-helix	trans	-70.1	-36	175.8	-75.2	-75.3	0	0	0	111.3	T40 C41 V44 M129 V130 A131 A136 L137 Y211	T40-N133 PolarHBondContact OG1-OD1 2.69Å; C41-N133 PolarHBondContact N-OD1 3.44Å; C41-N133 PolarHBondContact SG-OD1 2.97Å; V44-N133 WeakPolarHBondContact CG2-ND2 3.26Å; M129-N133 PolarHBondContact O-N 3Å; M129-N133 PolarHBondContact O-ND2 3.17Å; V130-N133 PolarHBondContact O-N 3.5Å; A131-N133 PolarHBondContact O-N 2.9Å; N133-A136 WeakPolarHBondContact O-CB 3.36Å; N133-A136 PolarHBondContact O-N 3.36Å; N133-L137 WeakPolarHBondContact O-CG 3.41Å; N133-L137 PolarHBondContact O-N 3.33Å; N133-Y211 PolarHBondContact ND2-OH 3.26Å
134	G	92	Very high	89.4	Confident	40 Å²	40	50.4 Å²	50.4	41%	0.412	26%	0.262	S	S	.	.	H	α-helix	trans	-58.8	-49.2	171.2	0	0	0	0	0	112.4	V130 A131 A136 L137 Y138	V130-G134 PolarHBondContact O-N 3.48Å; A131-G134 PolarHBondContact O-N 3.11Å; G134-A136 PolarHBondContact O-N 3.38Å; G134-L137 PolarHBondContact O-N 2.91Å; G134-Y138 WeakPolarHBondContact O-CB 3.42Å; G134-Y138 PolarHBondContact O-N 3.25Å
135	F	91.5	Very high	88.7	Confident	72 Å²	72	49.5 Å²	49.5	32%	0.316	25%	0.254	S	S	.	.	H	α-helix	trans	-67.1	-33.1	175.7	-73.5	-63.1	0	0	0	113.2	A131 S132 Y138 S139 L150 T151 L154	A131-F135 WeakPolarHBondContact O-CD2 3.3Å; A131-F135 PolarHBondContact O-N 3Å; S132-F135 PolarHBondContact O-N 3.44Å; F135-Y138 PolarHBondContact O-N 2.93Å; F135-S139 WeakPolarHBondContact O-CB 3.42Å; F135-S139 PolarHBondContact O-N 3.11Å; F135-S139 PolarHBondContact O-OG 3.36Å; F135-L150 HydrophobicContact CD1-CD2 4.14Å; F135-L150 HydrophobicContact CD2-CD2 4.35Å; F135-L150 HydrophobicContact CE1-CD2 3.95Å; F135-L150 HydrophobicContact CE2-CD2 4.17Å; F135-L150 HydrophobicContact CG-CD2 4.35Å; F135-L150 HydrophobicContact CZ-CD2 3.96Å; F135-T151 VanDerWaalsContact CB-OG1 3.31Å; F135-T151 WeakPolarHBondContact CB-OG1 3.26Å; F135-L154 HydrophobicContact CD2-CD1 3.42Å; F135-L154 VanDerWaalsContact CD2-CD1 3.42Å; F135-L154 HydrophobicContact CE2-CD1 3.82Å; F135-L154 HydrophobicContact CG-CD1 4.44Å
136	A	90.3	Very high	88.2	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-61.9	-48.2	174.1	0	0	0	0	0	111.3	T37 S132 N133 G134 S139 F140 T151 M155 F218	T37-A136 HydrophobicContact CG2-CB 3.82Å; S132-A136 VanDerWaalsContact O-CB 3.3Å; S132-A136 WeakPolarHBondContact O-CB 3.32Å; S132-A136 PolarHBondContact O-N 3.49Å; N133-A136 WeakPolarHBondContact O-CB 3.36Å; N133-A136 PolarHBondContact O-N 3.36Å; G134-A136 PolarHBondContact O-N 3.38Å; A136-S139 WeakPolarHBondContact O-CB 3.47Å; A136-S139 PolarHBondContact O-N 3.37Å; A136-F140 WeakPolarHBondContact O-CD2 3.41Å; A136-F140 WeakPolarHBondContact O-CE2 3.4Å; A136-T151 HydrophobicContact CB-CG2 3.82Å; A136-M155 HydrophobicContact CB-CE 4.23Å; A136-F218 HydrophobicContact CB-CE1 4.44Å; A136-F218 HydrophobicContact CB-CZ 3.84Å
137	L	88.5	Confident	87.9	Confident	78 Å²	78	52.8 Å²	52.8	41%	0.408	27%	0.27	S	S	.	.	H	α-helix	trans	-63.4	-44.2	175.8	-69.2	174.6	0	0	0	111.7	T37 N133 G134 S139 F140 F141	T37-L137 HydrophobicContact CG2-CD2 4.24Å; N133-L137 WeakPolarHBondContact O-CG 3.41Å; N133-L137 PolarHBondContact O-N 3.33Å; G134-L137 PolarHBondContact O-N 2.91Å; L137-S139 PolarHBondContact O-N 2.83Å; L137-F140 PolarHBondContact O-N 3.24Å; L137-F140 VanDerWaalsContact O-N 3.09Å; L137-F141 WeakPolarHBondContact O-CD2 3.42Å
138	Y	88.1	Confident	87.6	Confident	91 Å²	91	49.8 Å²	49.8	36%	0.357	25%	0.248	S	C	.	.	H	α-helix	trans	-60.1	-34.1	177	-171.9	-100.7	0	0	0	112.6	G134 F135 F140 F141 H142 Y147	G134-Y138 WeakPolarHBondContact O-CB 3.42Å; G134-Y138 PolarHBondContact O-N 3.25Å; F135-Y138 PolarHBondContact O-N 2.93Å; Y138-F140 PolarHBondContact O-N 3.04Å; Y138-F141 PolarHBondContact O-N 2.95Å; Y138-F141 VanDerWaalsContact O-N 3.12Å; Y138-H142 HydrophobicContact CE1-CB 4.15Å; Y138-H142 AromaticContact CE1-CD2 3.77Å; Y138-H142 AromaticContact CE2-CD2 3.42Å; Y138-H142 VanDerWaalsContact CE2-CD2 3.42Å; Y138-H142 WeakPolarHBondContact CE2-CD2 3.38Å; Y138-H142 AromaticContact CE2-NE2 3.94Å; Y138-H142 AromaticContact CZ-CD2 3.17Å; Y138-H142 AromaticContact CZ-CG 3.97Å; Y138-H142 AromaticContact CZ-NE2 3.84Å; Y138-H142 PolarHBondContact O-N 2.95Å; Y138-H142 PolarHBondContact OH-CD2 3.32Å; Y138-H142 PolarHBondContact OH-NE2 2.87Å; Y138-Y147 HydrophobicContact CD1-CD1 4.12Å; Y138-Y147 HydrophobicContact CD1-CD2 4.16Å; Y138-Y147 HydrophobicContact CD1-CE1 4.29Å; Y138-Y147 HydrophobicContact CD1-CE2 4.35Å; Y138-Y147 HydrophobicContact CD1-CG 4.06Å; Y138-Y147 HydrophobicContact CE1-CD1 4.1Å; Y138-Y147 AromaticContact CE1-CD2 3.92Å; Y138-Y147 HydrophobicContact CE1-CD2 3.92Å; Y138-Y147 AromaticContact CE1-CE1 3.82Å; Y138-Y147 HydrophobicContact CE1-CE1 3.82Å; Y138-Y147 AromaticContact CE1-CE2 3.65Å; Y138-Y147 HydrophobicContact CE1-CE2 3.65Å; Y138-Y147 HydrophobicContact CE1-CG 4.15Å; Y138-Y147 AromaticContact CE1-CZ 3.6Å
139	S	86.3	Confident	87.3	Confident	6 Å²	6	54.2 Å²	54.2	4%	0.042	26%	0.262	C	S	.	.	H	α-helix	trans	-66.6	-15.4	177.6	-59.9	0	0	0	0	114.1	F135 A136 L137 Y147	F135-S139 WeakPolarHBondContact O-CB 3.42Å; F135-S139 PolarHBondContact O-N 3.11Å; F135-S139 PolarHBondContact O-OG 3.36Å; A136-S139 WeakPolarHBondContact O-CB 3.47Å; A136-S139 PolarHBondContact O-N 3.37Å; L137-S139 PolarHBondContact O-N 2.83Å; S139-Y147 WeakPolarHBondContact OG-CB 3.47Å
140	F	83.2	Confident	87.1	Confident	27 Å²	27	58 Å²	58	12%	0.118	28%	0.282	C	S	.	.	H	α-helix	trans	-82.1	-30.9	172.3	-69.2	-74	0	0	0	112.4	F9 M33 A34 A136 L137 Y138	F9-F140 HydrophobicContact CB-CD1 4.24Å; F9-F140 HydrophobicContact CD1-CB 3.91Å; F9-F140 HydrophobicContact CD1-CD2 4.46Å; F9-F140 HydrophobicContact CD1-CG 4.09Å; M33-F140 HydrophobicContact CB-CE1 4.43Å; M33-F140 HydrophobicContact CB-CZ 4.14Å; A34-F140 HydrophobicContact CB-CE1 4.17Å; A34-F140 HydrophobicContact CB-CZ 3.98Å; A136-F140 WeakPolarHBondContact O-CD2 3.41Å; A136-F140 WeakPolarHBondContact O-CE2 3.4Å; L137-F140 PolarHBondContact O-N 3.24Å; L137-F140 VanDerWaalsContact O-N 3.09Å; Y138-F140 PolarHBondContact O-N 3.04Å
141	F	78.7	Confident	87.1	Confident	151 Å²	151	53.3 Å²	53.3	66%	0.662	25%	0.254	S	S	*	.	H	α-helix	trans	-82.2	-41.8	177.8	-67.3	-72.6	0	0	0	112.6	F9 L137 Y138	F9-F141 HydrophobicContact CE1-CZ 4.47Å; L137-F141 WeakPolarHBondContact O-CD2 3.42Å; Y138-F141 PolarHBondContact O-N 2.95Å; Y138-F141 VanDerWaalsContact O-N 3.12Å
142	H	78.8	Confident	87.1	Confident	90 Å²	90	51.8 Å²	51.8	42%	0.417	24%	0.241	S	C	.	.	S	Bend	trans	-110.9	111.8	175.5	-68.7	-75	0	0	0	109.5	Y138 R144 Y147	Y138-H142 HydrophobicContact CE1-CB 4.15Å; Y138-H142 AromaticContact CE1-CD2 3.77Å; Y138-H142 AromaticContact CE2-CD2 3.42Å; Y138-H142 VanDerWaalsContact CE2-CD2 3.42Å; Y138-H142 WeakPolarHBondContact CE2-CD2 3.38Å; Y138-H142 AromaticContact CE2-NE2 3.94Å; Y138-H142 AromaticContact CZ-CD2 3.17Å; Y138-H142 AromaticContact CZ-CG 3.97Å; Y138-H142 AromaticContact CZ-NE2 3.84Å; Y138-H142 PolarHBondContact O-N 2.95Å; Y138-H142 PolarHBondContact OH-CD2 3.32Å; Y138-H142 PolarHBondContact OH-NE2 2.87Å; H142-R144 PolarHBondContact O-N 2.97Å; H142-Y147 HydrophobicContact CB-CD2 4.37Å; H142-Y147 HydrophobicContact CB-CE2 4.27Å
143	H	70.7	Confident	87.1	Confident	6 Å²	6	53.5 Å²	53.5	3%	0.028	26%	0.259	C	S	.	.			trans	-73.1	-16.2	-168.1	174.7	-89.4	0	0	0	113.8	M26 Y145 K148 F235 E238	M26-H143 WeakPolarHBondContact CE-NE2 3.44Å; H143-Y145 PolarHBondContact O-N 3.3Å; H143-K148 PolarHBondContact CD2-NZ 2.91Å; H143-K148 PolarHBondContact NE2-NZ 3.23Å; H143-K148 VanDerWaalsContact O-CE 3.31Å; H143-K148 WeakPolarHBondContact O-CE 3.4Å; H143-K148 PolarHBondContact O-NZ 3.19Å; H143-F235 HydrophobicContact CB-CD1 3.77Å; H143-F235 HydrophobicContact CB-CE1 3.66Å; H143-F235 AromaticContact CD2-CD1 3.42Å; H143-F235 VanDerWaalsContact CD2-CD1 3.42Å; H143-F235 WeakPolarHBondContact CD2-CD1 3.47Å; H143-F235 AromaticContact CD2-CE1 3.08Å; H143-F235 WeakPolarHBondContact CD2-CE1 3.47Å; H143-F235 AromaticContact CD2-CZ 3.56Å; H143-F235 AromaticContact CE1-CD1 3.28Å; H143-F235 WeakPolarHBondContact CE1-CD1 3.48Å; H143-F235 AromaticContact CE1-CD2 3.94Å; H143-F235 AromaticContact CE1-CE1 3.77Å; H143-F235 AromaticContact CE1-CG 3.37Å; H143-F235 WeakPolarHBondContact CE1-CG 3.47Å; H143-F235 AromaticContact CG-CD1 3.06Å; H143-F235 AromaticContact CG-CE1 3.09Å; H143-F235 AromaticContact CG-CG 3.98Å; H143-F235 AromaticContact ND1-CD1 2.98Å; H143-F235 WeakPolarHBondContact ND1-CD1 3.4Å; H143-F235 AromaticContact ND1-CE1 3.56Å; H143-F235 AromaticContact ND1-CG 3.51Å; H143-F235 AromaticContact NE2-CD1 3.59Å; H143-F235 AromaticContact NE2-CE1 3.57Å; H143-F235 AromaticContact NE2-CE2 4Å; H143-F235 AromaticContact NE2-CG 3.83Å; H143-F235 AromaticContact NE2-CZ 3.78Å; H143-E238 WeakPolarHBondContact CA-OE2 3.12Å; H143-E238 WeakPolarHBondContact CB-OE2 3.46Å; H143-E238 PolarHBondContact N-OE2 2.88Å
144	R	80.2	Confident	87.2	Confident	124 Å²	124	54.1 Å²	54.1	47%	0.468	26%	0.262	S	S	.	.			trans	-36.8	122.2	178.5	-171.3	177.8	-178.5	172	6.3	113.7	H142 T146 Y147 E238	H142-R144 PolarHBondContact O-N 2.97Å; R144-T146 PolarHBondContact NE-OG1 2.97Å; R144-T146 PolarHBondContact O-N 3.22Å; R144-Y147 HydrophobicContact CB-CD2 3.94Å; R144-Y147 HydrophobicContact CB-CE2 4.03Å; R144-Y147 HydrophobicContact CG-CE2 4.45Å; R144-Y147 PolarHBondContact O-N 3.49Å; R144-E238 PolarHBondContact N-OE2 2.96Å
145	Y	81.9	Confident	87.4	Confident	52 Å²	52	52.2 Å²	52.2	20%	0.204	24%	0.242	C	C	.	.	H	α-helix	trans	-57.4	-24.4	-177	74.3	-87.3	0	0	0	114.7	H143 Y147 K148 R149 K224 D239	H143-Y145 PolarHBondContact O-N 3.3Å; Y145-Y147 PolarHBondContact O-N 3.43Å; Y145-K148 PolarHBondContact O-N 3.49Å; Y145-R149 PolarHBondContact O-N 3.12Å; Y145-K224 HydrophobicContact CD1-CD 4.49Å; Y145-K224 HydrophobicContact CD1-CG 4.32Å; Y145-K224 HydrophobicContact CE1-CD 4Å; Y145-K224 HydrophobicContact CE1-CG 4.31Å; Y145-K224 PolarHBondContact OH-NZ 3.34Å; Y145-D239 HydrophobicContact CD1-CB 4.4Å; Y145-D239 WeakPolarHBondContact CD1-OD1 3.49Å
146	T	85	Confident	87.6	Confident	56 Å²	56	50.8 Å²	50.8	34%	0.344	24%	0.244	S	C	.	.	H	α-helix	trans	-61.4	-42.8	-177.9	-47.9	0	0	0	0	112.2	R144 K148 R149 L150	R144-T146 PolarHBondContact NE-OG1 2.97Å; R144-T146 PolarHBondContact O-N 3.22Å; T146-K148 PolarHBondContact O-N 3.13Å; T146-R149 PolarHBondContact O-N 3.14Å; T146-L150 PolarHBondContact O-N 2.84Å
147	Y	87.5	Confident	87.9	Confident	60 Å²	60	55.2 Å²	55.2	24%	0.235	27%	0.267	C	S	.	.	H	α-helix	trans	-66.8	-38.8	-179.7	-60.5	-62.3	0	0	0	111.8	Y138 S139 H142 R144 Y145 R149 L150 T151	Y138-Y147 HydrophobicContact CD1-CD1 4.12Å; Y138-Y147 HydrophobicContact CD1-CD2 4.16Å; Y138-Y147 HydrophobicContact CD1-CE1 4.29Å; Y138-Y147 HydrophobicContact CD1-CE2 4.35Å; Y138-Y147 HydrophobicContact CD1-CG 4.06Å; Y138-Y147 HydrophobicContact CE1-CD1 4.1Å; Y138-Y147 AromaticContact CE1-CD2 3.92Å; Y138-Y147 HydrophobicContact CE1-CD2 3.92Å; Y138-Y147 AromaticContact CE1-CE1 3.82Å; Y138-Y147 HydrophobicContact CE1-CE1 3.82Å; Y138-Y147 AromaticContact CE1-CE2 3.65Å; Y138-Y147 HydrophobicContact CE1-CE2 3.65Å; Y138-Y147 HydrophobicContact CE1-CG 4.15Å; Y138-Y147 AromaticContact CE1-CZ 3.6Å; S139-Y147 WeakPolarHBondContact OG-CB 3.47Å; H142-Y147 HydrophobicContact CB-CD2 4.37Å; H142-Y147 HydrophobicContact CB-CE2 4.27Å; R144-Y147 HydrophobicContact CB-CD2 3.94Å; R144-Y147 HydrophobicContact CB-CE2 4.03Å; R144-Y147 HydrophobicContact CG-CE2 4.45Å; R144-Y147 PolarHBondContact O-N 3.49Å; Y145-Y147 PolarHBondContact O-N 3.43Å; Y147-R149 VanDerWaalsContact C-N 3.32Å; Y147-R149 PolarHBondContact O-N 3.37Å; Y147-L150 PolarHBondContact O-N 3.4Å; Y147-T151 WeakPolarHBondContact O-CB 3.26Å; Y147-T151 PolarHBondContact O-N 3.33Å; Y147-T151 PolarHBondContact O-OG1 3.46Å
148	K	90.1	Very high	88.3	Confident	7 Å²	7	51.5 Å²	51.5	3%	0.03	25%	0.248	C	C	.	.	H	α-helix	trans	-61.3	-39.6	176.6	-58.7	177.5	-167.9	166	0	112.3	M33 H143 Y145 T146 A152 F218	M33-K148 HydrophobicContact CE-CD 4.4Å; M33-K148 HydrophobicContact SD-CD 4.07Å; H143-K148 PolarHBondContact CD2-NZ 2.91Å; H143-K148 PolarHBondContact NE2-NZ 3.23Å; H143-K148 VanDerWaalsContact O-CE 3.31Å; H143-K148 WeakPolarHBondContact O-CE 3.4Å; H143-K148 PolarHBondContact O-NZ 3.19Å; Y145-K148 PolarHBondContact O-N 3.49Å; T146-K148 PolarHBondContact O-N 3.13Å; K148-A152 PolarHBondContact O-N 3.32Å; K148-F218 HydrophobicContact CB-CD1 4.44Å
149	R	90.4	Very high	88.7	Confident	128 Å²	128	47.5 Å²	47.5	48%	0.483	23%	0.233	S	C	.	.	H	α-helix	trans	-69.4	-40.9	176	-68.2	-174.4	-179.7	-166.6	-2.5	112.3	Y145 T146 Y147 T151 A152 G153 S222	Y145-R149 PolarHBondContact O-N 3.12Å; T146-R149 PolarHBondContact O-N 3.14Å; Y147-R149 VanDerWaalsContact C-N 3.32Å; Y147-R149 PolarHBondContact O-N 3.37Å; R149-T151 VanDerWaalsContact C-N 3.35Å; R149-A152 WeakPolarHBondContact O-CB 3.48Å; R149-A152 PolarHBondContact O-N 2.64Å; R149-G153 PolarHBondContact O-N 2.72Å; R149-S222 WeakPolarHBondContact CG-OG 3.38Å
150	L	91.9	Very high	89.1	Confident	81 Å²	81	52.4 Å²	52.4	42%	0.424	26%	0.257	S	S	.	.	H	α-helix	trans	-60.8	-47	175.5	-176.4	66.8	0	0	0	110.5	F135 T146 Y147 A152 G153 L154	F135-L150 HydrophobicContact CD1-CD2 4.14Å; F135-L150 HydrophobicContact CD2-CD2 4.35Å; F135-L150 HydrophobicContact CE1-CD2 3.95Å; F135-L150 HydrophobicContact CE2-CD2 4.17Å; F135-L150 HydrophobicContact CG-CD2 4.35Å; F135-L150 HydrophobicContact CZ-CD2 3.96Å; T146-L150 PolarHBondContact O-N 2.84Å; Y147-L150 PolarHBondContact O-N 3.4Å; L150-A152 VanDerWaalsContact C-N 3.34Å; L150-A152 PolarHBondContact O-N 2.89Å; L150-G153 PolarHBondContact O-N 2.97Å; L150-G153 VanDerWaalsContact O-N 3.17Å; L150-L154 HydrophobicContact CG-CD1 4.27Å; L150-L154 WeakPolarHBondContact O-CG 3.43Å; L150-L154 PolarHBondContact O-N 2.92Å
151	T	93.4	Very high	89.7	Confident	0 Å²	0	52 Å²	52	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-56.7	-45.9	174.9	-58.7	0	0	0	0	111.8	F135 A136 Y147 R149 G153 L154 M155 F218	F135-T151 VanDerWaalsContact CB-OG1 3.31Å; F135-T151 WeakPolarHBondContact CB-OG1 3.26Å; A136-T151 HydrophobicContact CB-CG2 3.82Å; Y147-T151 WeakPolarHBondContact O-CB 3.26Å; Y147-T151 PolarHBondContact O-N 3.33Å; Y147-T151 PolarHBondContact O-OG1 3.46Å; R149-T151 VanDerWaalsContact C-N 3.35Å; T151-G153 VanDerWaalsContact C-N 3.34Å; T151-G153 PolarHBondContact O-N 3.46Å; T151-L154 PolarHBondContact O-N 3.45Å; T151-M155 HydrophobicContact CG2-CE 3.57Å; T151-M155 HydrophobicContact CG2-CG 4.44Å; T151-M155 HydrophobicContact CG2-SD 4.02Å; T151-M155 WeakPolarHBondContact O-CB 3.33Å; T151-M155 VanDerWaalsContact O-CG 3.31Å; T151-M155 WeakPolarHBondContact O-CG 3.44Å; T151-M155 PolarHBondContact O-N 3.47Å; T151-F218 HydrophobicContact CG2-CD1 3.94Å; T151-F218 HydrophobicContact CG2-CD2 4.34Å; T151-F218 HydrophobicContact CG2-CE1 3.84Å; T151-F218 HydrophobicContact CG2-CE2 4.25Å; T151-F218 HydrophobicContact CG2-CG 4.2Å; T151-F218 HydrophobicContact CG2-CZ 4.01Å
152	A	93.6	Very high	90.5	Very high	6 Å²	6	44.9 Å²	44.9	5%	0.05	23%	0.226	C	C	.	.	H	α-helix	trans	-58.6	-44.6	176.1	0	0	0	0	0	112.4	K148 R149 L150 M155 A156 F218	K148-A152 PolarHBondContact O-N 3.32Å; R149-A152 WeakPolarHBondContact O-CB 3.48Å; R149-A152 PolarHBondContact O-N 2.64Å; L150-A152 VanDerWaalsContact C-N 3.34Å; L150-A152 PolarHBondContact O-N 2.89Å; A152-M155 PolarHBondContact O-N 3.22Å; A152-A156 WeakPolarHBondContact O-CB 3.34Å; A152-A156 PolarHBondContact O-N 3.4Å; A152-F218 HydrophobicContact CB-CB 3.77Å
153	G	94.4	Very high	91.3	Very high	36 Å²	36	43.1 Å²	43.1	37%	0.371	22%	0.219	S	C	.	.	H	α-helix	trans	-63.7	-42.8	177.6	0	0	0	0	0	112.8	R149 L150 T151 A156 L157	R149-G153 PolarHBondContact O-N 2.72Å; L150-G153 PolarHBondContact O-N 2.97Å; L150-G153 VanDerWaalsContact O-N 3.17Å; T151-G153 VanDerWaalsContact C-N 3.34Å; T151-G153 PolarHBondContact O-N 3.46Å; G153-A156 PolarHBondContact O-N 3.01Å; G153-L157 WeakPolarHBondContact O-CG 3.36Å; G153-L157 PolarHBondContact O-N 3.43Å
154	L	95.9	Very high	92.5	Very high	25 Å²	25	45.2 Å²	45.2	13%	0.131	23%	0.232	C	C	.	.	H	α-helix	trans	-65.2	-41.8	176.2	-67.9	174.2	0	0	0	111.7	L128 F135 L150 T151 A156 L157 V158	L128-L154 HydrophobicContact CD2-CD2 4.1Å; F135-L154 HydrophobicContact CD2-CD1 3.42Å; F135-L154 VanDerWaalsContact CD2-CD1 3.42Å; F135-L154 HydrophobicContact CE2-CD1 3.82Å; F135-L154 HydrophobicContact CG-CD1 4.44Å; L150-L154 HydrophobicContact CG-CD1 4.27Å; L150-L154 WeakPolarHBondContact O-CG 3.43Å; L150-L154 PolarHBondContact O-N 2.92Å; T151-L154 PolarHBondContact O-N 3.45Å; L154-A156 VanDerWaalsContact C-N 3.33Å; L154-A156 PolarHBondContact O-N 3.3Å; L154-L157 PolarHBondContact O-N 3.43Å; L154-V158 WeakPolarHBondContact O-CG2 3.25Å; L154-V158 PolarHBondContact O-N 2.91Å
155	M	95.6	Very high	93.2	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-63.7	-38.5	176.3	-72	177.5	175.2	0	0	112.1	T40 A136 T151 A152 V158 A159 Y211 A214 A215 F218	T40-M155 HydrophobicContact CG2-CE 3.84Å; T40-M155 HydrophobicContact CG2-SD 4.19Å; A136-M155 HydrophobicContact CB-CE 4.23Å; T151-M155 HydrophobicContact CG2-CE 3.57Å; T151-M155 HydrophobicContact CG2-CG 4.44Å; T151-M155 HydrophobicContact CG2-SD 4.02Å; T151-M155 WeakPolarHBondContact O-CB 3.33Å; T151-M155 VanDerWaalsContact O-CG 3.31Å; T151-M155 WeakPolarHBondContact O-CG 3.44Å; T151-M155 PolarHBondContact O-N 3.47Å; A152-M155 PolarHBondContact O-N 3.22Å; M155-V158 PolarHBondContact O-N 3.28Å; M155-A159 PolarHBondContact O-N 3.08Å; M155-A159 VanDerWaalsContact O-N 3.11Å; M155-Y211 HydrophobicContact CB-CD1 4.03Å; M155-Y211 HydrophobicContact CG-CD1 4.09Å; M155-Y211 HydrophobicContact CG-CE1 4.28Å; M155-A214 HydrophobicContact SD-CB 3.7Å; M155-A215 HydrophobicContact CB-CB 3.98Å; M155-F218 HydrophobicContact CE-CD2 4.01Å; M155-F218 HydrophobicContact CE-CE2 3.64Å; M155-F218 HydrophobicContact CE-CZ 4.31Å; M155-F218 HydrophobicContact SD-CD2 3.66Å; M155-F218 HydrophobicContact SD-CE2 3.94Å; M155-F218 HydrophobicContact SD-CG 4.47Å
156	A	95.6	Very high	93.7	Very high	42 Å²	42	37.1 Å²	37.1	35%	0.347	20%	0.202	S	C	.	.	H	α-helix	trans	-65.3	-41.8	173.6	0	0	0	0	0	112	A152 G153 L154 V158 A159 M160 A215	A152-A156 WeakPolarHBondContact O-CB 3.34Å; A152-A156 PolarHBondContact O-N 3.4Å; G153-A156 PolarHBondContact O-N 3.01Å; L154-A156 VanDerWaalsContact C-N 3.33Å; L154-A156 PolarHBondContact O-N 3.3Å; A156-V158 PolarHBondContact O-N 2.9Å; A156-A159 PolarHBondContact O-N 3.46Å; A156-M160 WeakPolarHBondContact O-CG 3.43Å; A156-M160 PolarHBondContact O-N 3.43Å; A156-A215 HydrophobicContact CB-CB 4.24Å
157	L	96.1	Very high	94.1	Very high	94 Å²	94	39.2 Å²	39.2	49%	0.492	21%	0.208	S	C	.	.	H	α-helix	trans	-62.1	-40.9	174.7	-77.9	172.8	0	0	0	112.2	L128 G153 L154 A159 M160 C161	L128-L157 HydrophobicContact CD1-CB 4.25Å; G153-L157 WeakPolarHBondContact O-CG 3.36Å; G153-L157 PolarHBondContact O-N 3.43Å; L154-L157 PolarHBondContact O-N 3.43Å; L157-A159 PolarHBondContact O-N 3.05Å; L157-M160 PolarHBondContact O-N 2.99Å; L157-C161 PolarHBondContact O-N 3.27Å; L157-C161 PolarHBondContact O-SG 3.3Å
158	V	96.5	Very high	94.4	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-57.4	-49.4	173.3	170.2	0	0	0	0	110.7	L128 M129 L154 M155 A156 M160 C161 V162 Y211	L128-V158 HydrophobicContact CB-CG2 3.49Å; L128-V158 VanDerWaalsContact CB-CG2 3.49Å; M129-V158 HydrophobicContact CE-CG1 4.45Å; M129-V158 HydrophobicContact CG-CB 4.31Å; M129-V158 HydrophobicContact CG-CG1 3.45Å; M129-V158 VanDerWaalsContact CG-CG1 3.45Å; M129-V158 HydrophobicContact CG-CG2 3.82Å; M129-V158 HydrophobicContact SD-CG1 4.22Å; L154-V158 WeakPolarHBondContact O-CG2 3.25Å; L154-V158 PolarHBondContact O-N 2.91Å; M155-V158 PolarHBondContact O-N 3.28Å; A156-V158 PolarHBondContact O-N 2.9Å; V158-M160 VanDerWaalsContact C-N 3.27Å; V158-M160 PolarHBondContact O-N 3Å; V158-C161 PolarHBondContact O-N 2.95Å; V158-V162 HydrophobicContact CG1-CG2 4.44Å; V158-V162 WeakPolarHBondContact O-CG2 3.43Å; V158-V162 PolarHBondContact O-N 3.17Å; V158-Y211 HydrophobicContact CB-CD1 3.71Å; V158-Y211 HydrophobicContact CB-CE1 4.01Å; V158-Y211 HydrophobicContact CB-CG 4.36Å; V158-Y211 HydrophobicContact CG1-CD1 3.54Å; V158-Y211 HydrophobicContact CG1-CD2 4.24Å; V158-Y211 HydrophobicContact CG1-CE1 3.69Å; V158-Y211 HydrophobicContact CG1-CE2 4.39Å; V158-Y211 HydrophobicContact CG1-CG 3.84Å; V158-Y211 HydrophobicContact CG2-CD1 4.31Å; V158-Y211 HydrophobicContact CG2-CE1 4.16Å
159	A	96.1	Very high	94.4	Very high	6 Å²	6	37.1 Å²	37.1	5%	0.05	20%	0.202	C	C	.	.	H	α-helix	trans	-57.8	-42.5	179.1	0	0	0	0	0	111.5	M155 A156 L157 V162 L163	M155-A159 PolarHBondContact O-N 3.08Å; M155-A159 VanDerWaalsContact O-N 3.11Å; A156-A159 PolarHBondContact O-N 3.46Å; L157-A159 PolarHBondContact O-N 3.05Å; A159-V162 PolarHBondContact O-N 2.94Å; A159-L163 WeakPolarHBondContact O-CG 3.38Å; A159-L163 PolarHBondContact O-N 3.04Å
160	M	96.2	Very high	94.3	Very high	110 Å²	110	32 Å²	32	54%	0.542	19%	0.186	S	C	.	.	H	α-helix	trans	-64.2	-43.9	175.5	-69.4	-57	-59.8	0	0	112.6	A156 L157 V158 V162 L163 V164	A156-M160 WeakPolarHBondContact O-CG 3.43Å; A156-M160 PolarHBondContact O-N 3.43Å; L157-M160 PolarHBondContact O-N 2.99Å; V158-M160 VanDerWaalsContact C-N 3.27Å; V158-M160 PolarHBondContact O-N 3Å; M160-V162 VanDerWaalsContact C-N 3.34Å; M160-V162 PolarHBondContact O-N 3.44Å; M160-L163 PolarHBondContact O-N 3.29Å; M160-L163 HydrophobicContact SD-CD1 4.28Å; M160-V164 WeakPolarHBondContact O-CG2 3.46Å; M160-V164 PolarHBondContact O-N 3.49Å
161	C	95.8	Very high	94.2	Very high	17 Å²	17	32.5 Å²	32.5	12%	0.115	19%	0.186	C	C	.	.	H	α-helix	trans	-60.7	-42.6	176.9	-69.3	0	0	0	0	111.8	A125 L157 V158 V164 V165	A125-C161 HydrophobicContact CB-CB 3.9Å; L157-C161 PolarHBondContact O-N 3.27Å; L157-C161 PolarHBondContact O-SG 3.3Å; V158-C161 PolarHBondContact O-N 2.95Å; C161-V164 PolarHBondContact O-N 3.15Å; C161-V165 WeakPolarHBondContact O-CG2 3.28Å; C161-V165 PolarHBondContact O-N 3.47Å; C161-V165 VanDerWaalsContact O-N 3.08Å
162	V	94.9	Very high	93.9	Very high	2 Å²	2	32.7 Å²	32.7	1%	0.012	19%	0.187	C	C	.	.	H	α-helix	trans	-67.5	-39.6	178	179.6	0	0	0	0	111.2	L47 A125 V158 A159 M160 V164 V165 I166 A204 V208	L47-V162 HydrophobicContact CD1-CG1 4.3Å; L47-V162 HydrophobicContact CD1-CG2 4.15Å; L47-V162 HydrophobicContact CD2-CG2 3.84Å; A125-V162 HydrophobicContact CB-CG2 4.2Å; V158-V162 HydrophobicContact CG1-CG2 4.44Å; V158-V162 WeakPolarHBondContact O-CG2 3.43Å; V158-V162 PolarHBondContact O-N 3.17Å; A159-V162 PolarHBondContact O-N 2.94Å; M160-V162 VanDerWaalsContact C-N 3.34Å; M160-V162 PolarHBondContact O-N 3.44Å; V162-V164 VanDerWaalsContact C-N 3.33Å; V162-V164 PolarHBondContact O-N 2.97Å; V162-V165 WeakPolarHBondContact O-CB 3.34Å; V162-V165 PolarHBondContact O-N 3.47Å; V162-V165 VanDerWaalsContact O-N 3.17Å; V162-I166 HydrophobicContact CG1-CD1 4.31Å; V162-I166 WeakPolarHBondContact O-CG1 3.47Å; V162-I166 PolarHBondContact O-N 3.37Å; V162-A204 HydrophobicContact CG1-CB 4.17Å; V162-V208 HydrophobicContact CB-CG2 3.83Å; V162-V208 HydrophobicContact CG1-CG2 3.56Å
163	L	95.8	Very high	93.4	Very high	53 Å²	53	32.6 Å²	32.6	28%	0.277	19%	0.185	S	C	.	.	H	α-helix	trans	-59.8	-42.7	172.8	-78.3	173.1	0	0	0	112.1	A159 M160 V165 I166 E167 W205 V208	A159-L163 WeakPolarHBondContact O-CG 3.38Å; A159-L163 PolarHBondContact O-N 3.04Å; M160-L163 PolarHBondContact O-N 3.29Å; M160-L163 HydrophobicContact SD-CD1 4.28Å; L163-V165 VanDerWaalsContact C-N 3.29Å; L163-V165 PolarHBondContact O-N 2.98Å; L163-I166 PolarHBondContact O-N 2.89Å; L163-E167 WeakPolarHBondContact O-CB 3.27Å; L163-E167 PolarHBondContact O-N 3.06Å; L163-W205 HydrophobicContact CD2-CE3 4.39Å; L163-W205 HydrophobicContact CD2-CH2 3.78Å; L163-W205 HydrophobicContact CD2-CZ3 3.67Å; L163-V208 HydrophobicContact CD1-CG1 4.09Å; L163-V208 HydrophobicContact CD2-CG1 3.91Å; L163-V208 HydrophobicContact CD2-CG2 4.08Å; L163-V208 HydrophobicContact CG-CG1 3.82Å; L163-V208 HydrophobicContact CG-CG2 3.97Å
164	V	95.6	Very high	92.9	Very high	50 Å²	50	33.9 Å²	33.9	30%	0.303	19%	0.189	S	C	.	.	H	α-helix	trans	-60.5	-39.6	175	171.1	0	0	0	0	111.1	F121 M160 C161 V162 E167 T168	F121-V164 HydrophobicContact CD1-CG1 4.13Å; F121-V164 HydrophobicContact CD2-CG1 3.63Å; F121-V164 HydrophobicContact CE1-CG1 4.11Å; F121-V164 HydrophobicContact CE2-CG1 3.63Å; F121-V164 HydrophobicContact CG-CG1 3.92Å; F121-V164 HydrophobicContact CZ-CG1 3.87Å; M160-V164 WeakPolarHBondContact O-CG2 3.46Å; M160-V164 PolarHBondContact O-N 3.49Å; C161-V164 PolarHBondContact O-N 3.15Å; V162-V164 VanDerWaalsContact C-N 3.33Å; V162-V164 PolarHBondContact O-N 2.97Å; V164-E167 PolarHBondContact O-N 3.4Å; V164-T168 VanDerWaalsContact O-CB 3.26Å; V164-T168 WeakPolarHBondContact O-CB 3.48Å; V164-T168 PolarHBondContact O-N 2.77Å; V164-T168 PolarHBondContact O-OG1 2.91Å
165	V	94.2	Very high	92.4	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.012	19%	0.19	C	C	.	.	H	α-helix	trans	-62	-45.9	175.3	174.3	0	0	0	0	111.3	W56 I75 F121 C161 V162 L163 E167 T168 L169	W56-V165 HydrophobicContact CH2-CG1 4.02Å; W56-V165 HydrophobicContact CZ3-CG1 3.94Å; I75-V165 HydrophobicContact CD1-CG1 4.44Å; F121-V165 HydrophobicContact CB-CG2 3.56Å; C161-V165 WeakPolarHBondContact O-CG2 3.28Å; C161-V165 PolarHBondContact O-N 3.47Å; C161-V165 VanDerWaalsContact O-N 3.08Å; V162-V165 WeakPolarHBondContact O-CB 3.34Å; V162-V165 PolarHBondContact O-N 3.47Å; V162-V165 VanDerWaalsContact O-N 3.17Å; L163-V165 VanDerWaalsContact C-N 3.29Å; L163-V165 PolarHBondContact O-N 2.98Å; V165-E167 VanDerWaalsContact C-N 3.35Å; V165-E167 PolarHBondContact O-N 2.92Å; V165-T168 PolarHBondContact O-N 3.34Å; V165-L169 PolarHBondContact O-N 3Å
166	I	93	Very high	91.5	Very high	4 Å²	4	35 Å²	35	2%	0.021	19%	0.193	C	C	.	.	H	α-helix	trans	-61.5	-44.6	177.8	-64.3	167.9	0	0	0	110.6	V162 L163 L169 S170 T201 A204 W205 V208	V162-I166 HydrophobicContact CG1-CD1 4.31Å; V162-I166 WeakPolarHBondContact O-CG1 3.47Å; V162-I166 PolarHBondContact O-N 3.37Å; L163-I166 PolarHBondContact O-N 2.89Å; I166-L169 WeakPolarHBondContact O-CB 3.4Å; I166-L169 PolarHBondContact O-N 3.41Å; I166-S170 PolarHBondContact O-N 3.3Å; I166-S170 PolarHBondContact O-OG 2.95Å; I166-S170 VanDerWaalsContact O-OG 3.14Å; I166-T201 HydrophobicContact CG2-CG2 4.38Å; I166-A204 HydrophobicContact CD1-CB 3.87Å; I166-A204 HydrophobicContact CG1-CB 4.04Å; I166-W205 HydrophobicContact CD1-CD2 4.12Å; I166-W205 HydrophobicContact CD1-CG 4.18Å; I166-W205 HydrophobicContact CG2-CZ2 4.17Å; I166-V208 HydrophobicContact CD1-CG2 4.27Å
167	E	93.6	Very high	90.7	Very high	101 Å²	101	39 Å²	39	47%	0.472	20%	0.2	S	C	.	.	H	α-helix	trans	-67.4	-40.8	179.8	-166.2	58.4	-150.5	0	0	111.8	L163 V164 V165 L169 S170 H171	L163-E167 WeakPolarHBondContact O-CB 3.27Å; L163-E167 PolarHBondContact O-N 3.06Å; V164-E167 PolarHBondContact O-N 3.4Å; V165-E167 VanDerWaalsContact C-N 3.35Å; V165-E167 PolarHBondContact O-N 2.92Å; E167-L169 VanDerWaalsContact C-N 3.29Å; E167-L169 PolarHBondContact O-N 3.08Å; E167-S170 PolarHBondContact O-N 2.93Å; E167-H171 WeakPolarHBondContact O-CB 3.44Å; E167-H171 PolarHBondContact O-CD2 2.87Å; E167-H171 VanDerWaalsContact O-CD2 3.3Å; E167-H171 PolarHBondContact O-N 3.38Å; E167-H171 IonicContact OE1-CD2 3.22Å; E167-H171 IonicContact OE1-CE1 3.86Å; E167-H171 IonicContact OE1-NE2 3.28Å; E167-H171 PolarHBondContact OE1-NE2 3.22Å
168	T	92.9	Very high	89.9	Confident	18 Å²	18	37.2 Å²	37.2	11%	0.11	20%	0.198	C	C	.	.	H	α-helix	trans	-62.2	-38.1	176.2	-55	0	0	0	0	110.9	F114 A117 M118 V164 V165 S172	F114-T168 HydrophobicContact CB-CG2 4.21Å; F114-T168 HydrophobicContact CD1-CG2 3.8Å; A117-T168 HydrophobicContact CB-CG2 4.16Å; M118-T168 HydrophobicContact CG-CG2 3.51Å; M118-T168 HydrophobicContact SD-CG2 4.44Å; V164-T168 VanDerWaalsContact O-CB 3.26Å; V164-T168 WeakPolarHBondContact O-CB 3.48Å; V164-T168 PolarHBondContact O-N 2.77Å; V164-T168 PolarHBondContact O-OG1 2.91Å; V165-T168 PolarHBondContact O-N 3.34Å; T168-S172 VanDerWaalsContact O-CB 3.29Å; T168-S172 WeakPolarHBondContact O-CB 3.23Å; T168-S172 PolarHBondContact O-N 3.39Å
169	L	90.6	Very high	88.9	Confident	4 Å²	4	38.9 Å²	38.9	2%	0.021	21%	0.207	C	C	.	.	H	α-helix	trans	-64	-48.9	173.3	177.8	71.5	0	0	0	111.5	W56 A57 M118 V165 I166 E167 H171 S172 V173	W56-L169 HydrophobicContact CB-CD1 4.41Å; W56-L169 HydrophobicContact CB-CD2 3.75Å; W56-L169 HydrophobicContact CE3-CD2 3.97Å; A57-L169 HydrophobicContact CB-CD1 4.33Å; M118-L169 HydrophobicContact SD-CB 3.79Å; M118-L169 HydrophobicContact SD-CD1 4.09Å; V165-L169 PolarHBondContact O-N 3Å; I166-L169 WeakPolarHBondContact O-CB 3.4Å; I166-L169 PolarHBondContact O-N 3.41Å; E167-L169 VanDerWaalsContact C-N 3.29Å; E167-L169 PolarHBondContact O-N 3.08Å; L169-H171 VanDerWaalsContact C-N 3.3Å; L169-H171 PolarHBondContact O-N 3.28Å; L169-S172 WeakPolarHBondContact O-CB 3.26Å; L169-S172 PolarHBondContact O-N 3.49Å; L169-V173 WeakPolarHBondContact O-CG2 3.48Å; L169-V173 PolarHBondContact O-N 3.31Å
170	S	88.7	Confident	87.7	Confident	21 Å²	21	39.7 Å²	39.7	15%	0.147	21%	0.212	C	C	.	.	H	α-helix	trans	-57.5	-45	177.8	-62.4	0	0	0	0	111.3	I166 E167 V173 S174 Y197	I166-S170 PolarHBondContact O-N 3.3Å; I166-S170 PolarHBondContact O-OG 2.95Å; I166-S170 VanDerWaalsContact O-OG 3.14Å; E167-S170 PolarHBondContact O-N 2.93Å; S170-V173 PolarHBondContact O-N 3.04Å; S170-S174 WeakPolarHBondContact O-CB 3.09Å; S170-S174 PolarHBondContact O-N 3.1Å; S170-S174 PolarHBondContact O-OG 3.48Å; S170-Y197 PolarHBondContact OG-OH 3.35Å
171	H	89.5	Confident	86.6	Confident	92 Å²	92	39.3 Å²	39.3	43%	0.426	21%	0.209	S	C	.	.	H	α-helix	trans	-63.6	-44.6	174.7	-79.9	-54.6	0	0	0	112.6	F114 E167 L169 V173 S174 N175	F114-H171 HydrophobicContact CD1-CB 4.49Å; F114-H171 HydrophobicContact CE1-CB 3.93Å; F114-H171 HydrophobicContact CZ-CB 4.42Å; E167-H171 WeakPolarHBondContact O-CB 3.44Å; E167-H171 PolarHBondContact O-CD2 2.87Å; E167-H171 VanDerWaalsContact O-CD2 3.3Å; E167-H171 PolarHBondContact O-N 3.38Å; E167-H171 IonicContact OE1-CD2 3.22Å; E167-H171 IonicContact OE1-CE1 3.86Å; E167-H171 IonicContact OE1-NE2 3.28Å; E167-H171 PolarHBondContact OE1-NE2 3.22Å; L169-H171 VanDerWaalsContact C-N 3.3Å; L169-H171 PolarHBondContact O-N 3.28Å; H171-V173 VanDerWaalsContact C-N 3.3Å; H171-V173 PolarHBondContact O-N 3.3Å; H171-S174 WeakPolarHBondContact CA-OG 3.48Å; H171-S174 PolarHBondContact O-N 3.35Å; H171-S174 PolarHBondContact O-OG 3.4Å; H171-N175 WeakPolarHBondContact O-CB 3.45Å; H171-N175 PolarHBondContact O-N 3.2Å
172	S	87.2	Confident	85.5	Confident	3 Å²	3	42.1 Å²	42.1	2%	0.021	23%	0.234	C	C	.	.	H	α-helix	trans	-56.3	-44.7	177.6	-172.8	0	0	0	0	111.8	L111 T168 L169 W176	L111-S172 WeakPolarHBondContact CD1-OG 3.29Å; T168-S172 VanDerWaalsContact O-CB 3.29Å; T168-S172 WeakPolarHBondContact O-CB 3.23Å; T168-S172 PolarHBondContact O-N 3.39Å; L169-S172 WeakPolarHBondContact O-CB 3.26Å; L169-S172 PolarHBondContact O-N 3.49Å; S172-W176 WeakPolarHBondContact O-CB 3.49Å; S172-W176 PolarHBondContact O-N 3.44Å
173	V	83.2	Confident	84.1	Confident	4 Å²	4	46 Å²	46	2%	0.024	25%	0.252	C	S	.	.	H	α-helix	trans	-72.2	-41.3	179.1	179.2	0	0	0	0	111.4	A57 M73 L169 S170 H171 N175 W176 R177 L195	A57-V173 HydrophobicContact CB-CG2 4.21Å; M73-V173 HydrophobicContact SD-CG2 4.1Å; L169-V173 WeakPolarHBondContact O-CG2 3.48Å; L169-V173 PolarHBondContact O-N 3.31Å; S170-V173 PolarHBondContact O-N 3.04Å; H171-V173 VanDerWaalsContact C-N 3.3Å; H171-V173 PolarHBondContact O-N 3.3Å; V173-N175 VanDerWaalsContact C-N 3.32Å; V173-N175 PolarHBondContact O-N 3.2Å; V173-W176 PolarHBondContact O-N 3.03Å; V173-R177 WeakPolarHBondContact O-CB 3.47Å; V173-R177 PolarHBondContact O-N 3.16Å; V173-L195 HydrophobicContact CB-CD1 4.24Å; V173-L195 HydrophobicContact CB-CD2 3.97Å; V173-L195 HydrophobicContact CG1-CB 3.94Å; V173-L195 HydrophobicContact CG1-CD1 3.71Å; V173-L195 HydrophobicContact CG1-CD2 3.7Å; V173-L195 HydrophobicContact CG1-CG 3.94Å; V173-L195 HydrophobicContact CG2-CD1 3.99Å; V173-L195 HydrophobicContact CG2-CD2 4.44Å
174	S	84.7	Confident	82.3	Confident	63 Å²	63	49 Å²	49	44%	0.441	27%	0.267	S	S	.	.	H	α-helix	trans	-62.2	-40	177.9	72.1	0	0	0	0	112.3	S170 H171 R177 A178	S170-S174 WeakPolarHBondContact O-CB 3.09Å; S170-S174 PolarHBondContact O-N 3.1Å; S170-S174 PolarHBondContact O-OG 3.48Å; H171-S174 WeakPolarHBondContact CA-OG 3.48Å; H171-S174 PolarHBondContact O-N 3.35Å; H171-S174 PolarHBondContact O-OG 3.4Å; S174-R177 PolarHBondContact O-N 2.98Å; S174-A178 PolarHBondContact O-N 3.02Å
175	N	83.7	Confident	80.2	Confident	31 Å²	31	53 Å²	53	17%	0.166	29%	0.292	C	S	.	.	H	α-helix	trans	-65.7	-46	175.3	-177.1	-43.2	0	0	0	109.9	E110 F114 H171 V173 R177 A178 I179	E110-N175 PolarHBondContact OE2-ND2 3.11Å; F114-N175 HydrophobicContact CE2-CB 4.33Å; H171-N175 WeakPolarHBondContact O-CB 3.45Å; H171-N175 PolarHBondContact O-N 3.2Å; V173-N175 VanDerWaalsContact C-N 3.32Å; V173-N175 PolarHBondContact O-N 3.2Å; N175-R177 VanDerWaalsContact C-N 3.31Å; N175-R177 PolarHBondContact O-N 3.16Å; N175-A178 PolarHBondContact O-N 3.39Å; N175-A178 VanDerWaalsContact O-N 3.12Å; N175-I179 WeakPolarHBondContact O-CG1 3.43Å; N175-I179 PolarHBondContact O-N 3.45Å; N175-I179 WeakPolarHBondContact OD1-CD1 3.27Å
176	W	77.2	Confident	78.2	Confident	17 Å²	17	57.7 Å²	57.7	6%	0.064	32%	0.321	C	S	.	.	H	α-helix	trans	-59.2	-42.2	176.7	-179.3	49.5	0	0	0	112.7	V59 L61 L71 M73 L111 S172 V173 I179 S180 Y191	V59-W176 HydrophobicContact CB-CH2 4.19Å; V59-W176 HydrophobicContact CB-CZ3 3.61Å; V59-W176 HydrophobicContact CG1-CE3 4.33Å; V59-W176 HydrophobicContact CG1-CH2 3.64Å; V59-W176 HydrophobicContact CG1-CZ3 3.24Å; V59-W176 HydrophobicContact CG2-CE3 4.43Å; V59-W176 HydrophobicContact CG2-CZ3 3.77Å; L61-W176 HydrophobicContact CD1-CH2 4.21Å; L61-W176 HydrophobicContact CD1-CZ2 4.33Å; L61-W176 HydrophobicContact CD2-CH2 3.86Å; L61-W176 HydrophobicContact CD2-CZ2 4.04Å; L61-W176 HydrophobicContact CG-CH2 4.19Å; L71-W176 HydrophobicContact CD1-CH2 3.77Å; L71-W176 HydrophobicContact CD1-CZ2 4.3Å; M73-W176 HydrophobicContact CE-CD2 4.41Å; M73-W176 HydrophobicContact CE-CE3 3.64Å; M73-W176 HydrophobicContact CE-CH2 4.39Å; M73-W176 HydrophobicContact CE-CZ3 3.56Å; L111-W176 HydrophobicContact CD1-CB 4.34Å; S172-W176 WeakPolarHBondContact O-CB 3.49Å; S172-W176 PolarHBondContact O-N 3.44Å; V173-W176 PolarHBondContact O-N 3.03Å; W176-I179 PolarHBondContact O-N 2.87Å; W176-S180 PolarHBondContact O-N 3.16Å; W176-S180 PolarHBondContact O-OG 3.24Å; W176-Y191 AromaticContact CE3-CE2 3.93Å; W176-Y191 HydrophobicContact CE3-CE2 3.93Å; W176-Y191 HydrophobicContact CH2-CD2 4.09Å; W176-Y191 AromaticContact CH2-CE2 3.96Å; W176-Y191 HydrophobicContact CH2-CE2 3.96Å; W176-Y191 HydrophobicContact CZ2-CD2 4.37Å; W176-Y191 HydrophobicContact CZ3-CD2 4.28Å; W176-Y191 AromaticContact CZ3-CE2 3.69Å; W176-Y191 HydrophobicContact CZ3-CE2 3.69Å
177	R	78.5	Confident	76.3	Confident	127 Å²	127	61 Å²	61	48%	0.479	33%	0.333	S	S	.	.	H	α-helix	trans	-59.2	-46.2	174	-179.9	179.1	172.9	175.7	1.7	112	V173 S174 N175 I179 S180 E181 Y191	V173-R177 WeakPolarHBondContact O-CB 3.47Å; V173-R177 PolarHBondContact O-N 3.16Å; S174-R177 PolarHBondContact O-N 2.98Å; N175-R177 VanDerWaalsContact C-N 3.31Å; N175-R177 PolarHBondContact O-N 3.16Å; R177-I179 VanDerWaalsContact C-N 3.34Å; R177-I179 PolarHBondContact O-N 3.46Å; R177-S180 WeakPolarHBondContact CA-OG 3.29Å; R177-S180 PolarHBondContact O-N 3.46Å; R177-S180 PolarHBondContact O-OG 3.33Å; R177-E181 WeakPolarHBondContact CG-OE1 3.47Å; R177-E181 IonicContact CZ-OE1 3.63Å; R177-E181 IonicContact NE-OE1 2.88Å; R177-E181 PolarHBondContact NE-OE1 2.85Å; R177-E181 IonicContact NH2-OE1 3.47Å; R177-E181 PolarHBondContact NH2-OE1 3.5Å; R177-E181 WeakPolarHBondContact O-CG 3.28Å; R177-E181 PolarHBondContact O-N 3.24Å; R177-Y191 HydrophobicContact CG-CE1 4Å
178	A	80.5	Confident	74.2	Confident	56 Å²	56	61.5 Å²	61.5	46%	0.463	34%	0.343	S	S	.	.	H	α-helix	trans	-62.5	-39.9	177.9	0	0	0	0	0	112.2	S174 N175 E181 A182	S174-A178 PolarHBondContact O-N 3.02Å; N175-A178 PolarHBondContact O-N 3.39Å; N175-A178 VanDerWaalsContact O-N 3.12Å; A178-E181 PolarHBondContact O-N 3.03Å; A178-A182 WeakPolarHBondContact O-CB 3.47Å; A178-A182 PolarHBondContact O-N 3.31Å
179	I	75.1	Confident	72.4	Confident	36 Å²	36	63.8 Å²	63.8	19%	0.185	35%	0.353	C	S	.	.	H	α-helix	trans	-65.3	-42.5	176	-67.6	174.9	0	0	0	111.2	N175 W176 R177 A182 H183	N175-I179 WeakPolarHBondContact O-CG1 3.43Å; N175-I179 PolarHBondContact O-N 3.45Å; N175-I179 WeakPolarHBondContact OD1-CD1 3.27Å; W176-I179 PolarHBondContact O-N 2.87Å; R177-I179 VanDerWaalsContact C-N 3.34Å; R177-I179 PolarHBondContact O-N 3.46Å; I179-A182 PolarHBondContact O-N 3.33Å; I179-H183 PolarHBondContact O-N 3.04Å; I179-H183 PolarHBondContact O-ND1 3.3Å
180	S	70.7	Confident	70.4	Confident	23 Å²	23	67.6 Å²	67.6	16%	0.161	37%	0.373	C	S	.	.	H	α-helix	trans	-65.1	-38.5	178.2	55.3	0	0	0	0	112.4	W176 R177 H183 L184	W176-S180 PolarHBondContact O-N 3.16Å; W176-S180 PolarHBondContact O-OG 3.24Å; R177-S180 WeakPolarHBondContact CA-OG 3.29Å; R177-S180 PolarHBondContact O-N 3.46Å; R177-S180 PolarHBondContact O-OG 3.33Å; S180-H183 PolarHBondContact O-N 2.81Å; S180-L184 PolarHBondContact O-N 2.81Å
181	E	73.5	Confident	68.7	Low	101 Å²	101	68.7 Å²	68.7	47%	0.472	37%	0.374	S	S	.	.	H	α-helix	trans	-68	-36.8	176.2	-71.7	174.2	-170.4	0	0	111.2	R177 A178 L184	R177-E181 WeakPolarHBondContact CG-OE1 3.47Å; R177-E181 IonicContact CZ-OE1 3.63Å; R177-E181 IonicContact NE-OE1 2.88Å; R177-E181 PolarHBondContact NE-OE1 2.85Å; R177-E181 IonicContact NH2-OE1 3.47Å; R177-E181 PolarHBondContact NH2-OE1 3.5Å; R177-E181 WeakPolarHBondContact O-CG 3.28Å; R177-E181 PolarHBondContact O-N 3.24Å; A178-E181 PolarHBondContact O-N 3.03Å; E181-L184 VanDerWaalsContact O-CD1 3.26Å; E181-L184 WeakPolarHBondContact O-CD1 3.24Å
182	A	71.7	Confident	66.9	Low	76 Å²	76	66.6 Å²	66.6	63%	0.628	37%	0.37	S	S	*	.	H	α-helix	trans	-73.3	-29.1	178	0	0	0	0	0	114.1	A178 I179	A178-A182 WeakPolarHBondContact O-CB 3.47Å; A178-A182 PolarHBondContact O-N 3.31Å; I179-A182 PolarHBondContact O-N 3.33Å
183	H	66.1	Low	65.3	Low	85 Å²	85	74.8 Å²	74.8	39%	0.394	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	28.2	-175.1	-64.1	81.8	0	0	0	114	I179 S180 T185 T186 Y187	I179-H183 PolarHBondContact O-N 3.04Å; I179-H183 PolarHBondContact O-ND1 3.3Å; S180-H183 PolarHBondContact O-N 2.81Å; H183-T185 PolarHBondContact O-N 3.48Å; H183-T186 PolarHBondContact O-N 3.07Å; H183-Y187 HydrophobicContact CB-CD2 3.58Å; H183-Y187 HydrophobicContact CB-CE2 3.82Å; H183-Y187 PolarHBondContact O-N 2.98Å
184	L	58.6	Low	64.1	Low	114 Å²	114	76.1 Å²	76.1	60%	0.597	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.1	-27.9	176.2	-92.6	154.6	0	0	0	114.1	S180 E181	S180-L184 PolarHBondContact O-N 2.81Å; E181-L184 VanDerWaalsContact O-CD1 3.26Å; E181-L184 WeakPolarHBondContact O-CD1 3.24Å
185	T	51.3	Low	63.2	Low	136 Å²	136	75.9 Å²	75.9	83%	0.834	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-15.8	-179.1	53.9	0	0	0	0	115	H183	H183-T185 PolarHBondContact O-N 3.48Å
186	T	52.8	Low	63.1	Low	99 Å²	99	82.3 Å²	82.3	61%	0.607	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.3	-25.7	-174.7	-52.9	0	0	0	0	112.4	H183	H183-T186 PolarHBondContact O-N 3.07Å
187	Y	51.9	Low	63.4	Low	74 Å²	74	86.9 Å²	86.9	29%	0.29	45%	0.449	S	S	.	.			trans	-109.8	107.2	176.8	-63.5	-84.1	0	0	0	108.7	H104 H183 E189	H104-Y187 HydrophobicContact CB-CE1 3.89Å; H183-Y187 HydrophobicContact CB-CD2 3.58Å; H183-Y187 HydrophobicContact CB-CE2 3.82Å; H183-Y187 PolarHBondContact O-N 2.98Å; Y187-E189 PolarHBondContact O-N 3.08Å; Y187-E189 VanDerWaalsContact O-N 3.11Å
188	V	50.3	Low	63.7	Low	111 Å²	111	80.9 Å²	80.9	67%	0.673	43%	0.426	S	S	*	.			trans	-67.6	-4	177.2	-177.7	0	0	0	0	112.1	P64 D190	P64-V188 HydrophobicContact CG-CG1 4.19Å; V188-D190 PolarHBondContact O-N 3.38Å
189	E	53.9	Low	64	Low	67 Å²	67	81.8 Å²	81.8	31%	0.313	43%	0.428	S	S	.	.	S	Bend	trans	-82	93.7	176.8	-53.9	-170.8	154.5	0	0	109.1	L63 Y187 Y191	L63-E189 HydrophobicContact CD1-CB 4.16Å; L63-E189 HydrophobicContact CD1-CG 3.9Å; Y187-E189 PolarHBondContact O-N 3.08Å; Y187-E189 VanDerWaalsContact O-N 3.11Å; E189-Y191 PolarHBondContact O-N 2.89Å
190	D	50	Low	64.7	Low	84 Å²	84	80.2 Å²	80.2	45%	0.449	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	109.3	171.6	-78.3	-26.6	0	0	0	109	S62 V188 S192	S62-D190 PolarHBondContact N-O 2.96Å; V188-D190 PolarHBondContact O-N 3.38Å; D190-S192 VanDerWaalsContact C-N 3.27Å; D190-S192 PolarHBondContact O-N 2.85Å
191	Y	53.1	Low	65.7	Low	44 Å²	44	79.2 Å²	79.2	17%	0.173	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	91.5	168	-174.3	-84.9	0	0	0	107.8	V59 L61 W176 R177 E189	V59-Y191 HydrophobicContact CG1-CD2 4.37Å; V59-Y191 HydrophobicContact CG1-CE2 3.59Å; L61-Y191 HydrophobicContact CD2-CD2 3.93Å; W176-Y191 AromaticContact CE3-CE2 3.93Å; W176-Y191 HydrophobicContact CE3-CE2 3.93Å; W176-Y191 HydrophobicContact CH2-CD2 4.09Å; W176-Y191 AromaticContact CH2-CE2 3.96Å; W176-Y191 HydrophobicContact CH2-CE2 3.96Å; W176-Y191 HydrophobicContact CZ2-CD2 4.37Å; W176-Y191 HydrophobicContact CZ3-CD2 4.28Å; W176-Y191 AromaticContact CZ3-CE2 3.69Å; W176-Y191 HydrophobicContact CZ3-CE2 3.69Å; R177-Y191 HydrophobicContact CG-CE1 4Å; E189-Y191 PolarHBondContact O-N 2.89Å
192	S	51.5	Low	66.5	Low	48 Å²	48	82.6 Å²	82.6	34%	0.336	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	-21.9	-164.4	67.5	0	0	0	0	114.6	S62 D190	S62-S192 WeakPolarHBondContact CB-OG 3.48Å; S62-S192 PolarHBondContact N-OG 3.45Å; S62-S192 VanDerWaalsContact N-OG 3.15Å; S62-S192 WeakPolarHBondContact OG-CB 3.44Å; S62-S192 PolarHBondContact OG-OG 3.23Å; D190-S192 VanDerWaalsContact C-N 3.27Å; D190-S192 PolarHBondContact O-N 2.85Å
193	R	52.5	Low	67.5	Low	174 Å²	174	82.1 Å²	82.1	66%	0.657	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-149	68.3	-168.5	-71.4	-170.5	175.7	166	0.5	115.3	E60	E60-R193 HydrophobicContact CB-CB 4.02Å; E60-R193 PolarHBondContact O-N 2.96Å
194	G	59.2	Low	68.7	Low	33 Å²	33	78 Å²	78	34%	0.34	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	64.5	153.3	147.5	0	0	0	0	0	118.5
195	L	66.2	Low	70.4	Confident	58 Å²	58	78.6 Å²	78.6	30%	0.304	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	121.8	166.9	171.4	56.1	0	0	0	109.4	A57 V59 V173 Y197	A57-L195 HydrophobicContact CB-CD1 3.66Å; V59-L195 HydrophobicContact CG2-CD1 4.38Å; V173-L195 HydrophobicContact CB-CD1 4.24Å; V173-L195 HydrophobicContact CB-CD2 3.97Å; V173-L195 HydrophobicContact CG1-CB 3.94Å; V173-L195 HydrophobicContact CG1-CD1 3.71Å; V173-L195 HydrophobicContact CG1-CD2 3.7Å; V173-L195 HydrophobicContact CG1-CG 3.94Å; V173-L195 HydrophobicContact CG2-CD1 3.99Å; V173-L195 HydrophobicContact CG2-CD2 4.44Å; L195-Y197 HydrophobicContact CD2-CE1 4.24Å
196	R	81.1	Confident	72.5	Confident	166 Å²	166	75.2 Å²	75.2	63%	0.626	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.2	120.9	165.7	-62.5	-177.3	72.7	-169	2.3	109.2	L58 G198	L58-R196 HydrophobicContact CB-CB 4.41Å; L58-R196 PolarHBondContact N-O 2.87Å; L58-R196 PolarHBondContact O-N 3.19Å; R196-G198 PolarHBondContact O-N 2.81Å
197	Y	83.2	Confident	74.4	Confident	112 Å²	112	70.5 Å²	70.5	44%	0.439	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	123.6	170.3	-68.2	-65.4	0	0	0	109.5	S170 L195 T201	S170-Y197 PolarHBondContact OG-OH 3.35Å; L195-Y197 HydrophobicContact CD2-CE1 4.24Å; Y197-T201 HydrophobicContact CD1-CG2 3.75Å; Y197-T201 HydrophobicContact CE1-CG2 4.38Å; Y197-T201 HydrophobicContact CG-CG2 4.29Å
198	G	84.4	Confident	76.5	Confident	1 Å²	1	67.4 Å²	67.4	1%	0.01	32%	0.322	C	S	.	.			trans	-76.4	168.2	176.4	0	0	0	0	0	112.4	N55 W56 L58 R196 A200 T201	N55-G198 CarbonylContact O-C 3.12Å; N55-G198 VanDerWaalsContact O-C 3.31Å; N55-G198 VanDerWaalsContact O-CA 3.26Å; N55-G198 WeakPolarHBondContact O-CA 3.36Å; W56-G198 WeakPolarHBondContact O-CA 3.39Å; W56-G198 PolarHBondContact O-N 3.05Å; L58-G198 VanDerWaalsContact CD1-CA 3.45Å; R196-G198 PolarHBondContact O-N 2.81Å; G198-A200 PolarHBondContact O-N 3.35Å; G198-T201 PolarHBondContact O-N 3.41Å; G198-T201 VanDerWaalsContact O-N 3.12Å
199	P	87.5	Confident	78.7	Confident	76 Å²	76	64.3 Å²	64.3	49%	0.494	31%	0.309	S	S	.	.	H	α-helix	trans	-58.4	-30.5	-179.4	23.9	-34.8	0	0	0	113.1	N55 T201 W202 L203	N55-P199 HydrophobicContact CB-CG 4Å; N55-P199 WeakPolarHBondContact O-CD 3.5Å; P199-T201 VanDerWaalsContact C-N 3.3Å; P199-T201 PolarHBondContact O-N 3.45Å; P199-W202 PolarHBondContact O-N 3.14Å; P199-L203 WeakPolarHBondContact O-CG 3.12Å; P199-L203 PolarHBondContact O-N 3Å
200	A	90.1	Very high	80.7	Confident	2 Å²	2	62.7 Å²	62.7	2%	0.017	30%	0.302	C	S	.	.	H	α-helix	trans	-65.6	-33.5	179	0	0	0	0	0	112.2	C50 N55 W56 G198 L203 A204	C50-A200 HydrophobicContact CB-CB 4.38Å; N55-A200 VanDerWaalsContact O-CB 3.27Å; N55-A200 WeakPolarHBondContact O-CB 3.17Å; N55-A200 PolarHBondContact O-N 3.5Å; N55-A200 VanDerWaalsContact O-N 3.09Å; W56-A200 HydrophobicContact CD2-CB 4.1Å; W56-A200 HydrophobicContact CG-CB 3.93Å; G198-A200 PolarHBondContact O-N 3.35Å; A200-L203 PolarHBondContact O-N 3.07Å; A200-A204 WeakPolarHBondContact O-CB 3.3Å; A200-A204 PolarHBondContact O-N 3.12Å
201	T	90.5	Very high	82.8	Confident	2 Å²	2	58.7 Å²	58.7	1%	0.012	28%	0.28	C	S	.	.	H	α-helix	trans	-67.8	-39.8	175.9	-61	0	0	0	0	111.3	W56 I166 Y197 G198 P199 L203 A204 W205	W56-T201 PolarHBondContact O-OG1 3.32Å; I166-T201 HydrophobicContact CG2-CG2 4.38Å; Y197-T201 HydrophobicContact CD1-CG2 3.75Å; Y197-T201 HydrophobicContact CE1-CG2 4.38Å; Y197-T201 HydrophobicContact CG-CG2 4.29Å; G198-T201 PolarHBondContact O-N 3.41Å; G198-T201 VanDerWaalsContact O-N 3.12Å; P199-T201 VanDerWaalsContact C-N 3.3Å; P199-T201 PolarHBondContact O-N 3.45Å; T201-L203 VanDerWaalsContact C-N 3.35Å; T201-L203 PolarHBondContact O-N 3.3Å; T201-A204 WeakPolarHBondContact O-CB 3.04Å; T201-A204 PolarHBondContact O-N 3.15Å; T201-W205 VanDerWaalsContact O-CD1 3.26Å; T201-W205 PolarHBondContact O-N 3.39Å
202	W	91.2	Very high	84.8	Confident	172 Å²	172	59.6 Å²	59.6	65%	0.652	29%	0.29	S	S	*	.	H	α-helix	trans	-63.5	-40.1	173.8	-72.7	106.6	0	0	0	112.3	P199 A204 W205 T206	P199-W202 PolarHBondContact O-N 3.14Å; W202-A204 VanDerWaalsContact C-N 3.34Å; W202-W205 WeakPolarHBondContact O-CB 3.33Å; W202-W205 PolarHBondContact O-N 2.79Å; W202-T206 WeakPolarHBondContact O-CG2 3.39Å; W202-T206 PolarHBondContact O-N 3.4Å
203	L	91.7	Very high	86.9	Confident	66 Å²	66	62.3 Å²	62.3	35%	0.346	30%	0.3	S	S	.	.	H	α-helix	trans	-69.1	-30.2	174.6	-68.7	172.7	0	0	0	112.9	L46 C50 P199 A200 T201 T206 T207	L46-L203 HydrophobicContact CD2-CD2 4.44Å; C50-L203 WeakPolarHBondContact SG-CB 3.24Å; P199-L203 WeakPolarHBondContact O-CG 3.12Å; P199-L203 PolarHBondContact O-N 3Å; A200-L203 PolarHBondContact O-N 3.07Å; T201-L203 VanDerWaalsContact C-N 3.35Å; T201-L203 PolarHBondContact O-N 3.3Å; L203-T206 WeakPolarHBondContact CA-OG1 3.35Å; L203-T206 PolarHBondContact O-N 3.12Å; L203-T206 PolarHBondContact O-OG1 3.21Å; L203-T207 PolarHBondContact O-N 3.08Å; L203-T207 PolarHBondContact O-OG1 3.24Å
204	A	92.5	Very high	88.9	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-66.3	-42.4	171.4	0	0	0	0	0	110.9	W56 V162 I166 A200 T201 W202 T206 T207 V208	W56-A204 HydrophobicContact CH2-CB 3.84Å; W56-A204 HydrophobicContact CZ3-CB 3.75Å; V162-A204 HydrophobicContact CG1-CB 4.17Å; I166-A204 HydrophobicContact CD1-CB 3.87Å; I166-A204 HydrophobicContact CG1-CB 4.04Å; A200-A204 WeakPolarHBondContact O-CB 3.3Å; A200-A204 PolarHBondContact O-N 3.12Å; T201-A204 WeakPolarHBondContact O-CB 3.04Å; T201-A204 PolarHBondContact O-N 3.15Å; W202-A204 VanDerWaalsContact C-N 3.34Å; A204-T206 PolarHBondContact O-N 2.69Å; A204-T207 WeakPolarHBondContact O-CB 3.44Å; A204-T207 PolarHBondContact O-N 3.41Å; A204-T207 VanDerWaalsContact O-N 3.15Å; A204-V208 WeakPolarHBondContact O-CG2 3.41Å; A204-V208 PolarHBondContact O-N 2.59Å
205	W	94.1	Very high	90.6	Very high	125 Å²	125	53 Å²	53	47%	0.473	26%	0.257	S	S	.	.	H	α-helix	trans	-60.5	-41.1	173.5	-84.5	109.9	0	0	0	113.1	L163 I166 T201 W202 T207 V208 A209	L163-W205 HydrophobicContact CD2-CE3 4.39Å; L163-W205 HydrophobicContact CD2-CH2 3.78Å; L163-W205 HydrophobicContact CD2-CZ3 3.67Å; I166-W205 HydrophobicContact CD1-CD2 4.12Å; I166-W205 HydrophobicContact CD1-CG 4.18Å; I166-W205 HydrophobicContact CG2-CZ2 4.17Å; T201-W205 VanDerWaalsContact O-CD1 3.26Å; T201-W205 PolarHBondContact O-N 3.39Å; W202-W205 WeakPolarHBondContact O-CB 3.33Å; W202-W205 PolarHBondContact O-N 2.79Å; W205-T207 VanDerWaalsContact C-N 3.29Å; W205-T207 PolarHBondContact O-N 3.27Å; W205-V208 PolarHBondContact O-N 2.9Å; W205-A209 PolarHBondContact O-N 2.97Å
206	T	93.9	Very high	91.9	Very high	65 Å²	65	55 Å²	55	40%	0.399	27%	0.268	S	S	.	.	H	α-helix	trans	-64.7	-36.9	175	61.3	0	0	0	0	111.4	W202 L203 A204 A209 I210	W202-T206 WeakPolarHBondContact O-CG2 3.39Å; W202-T206 PolarHBondContact O-N 3.4Å; L203-T206 WeakPolarHBondContact CA-OG1 3.35Å; L203-T206 PolarHBondContact O-N 3.12Å; L203-T206 PolarHBondContact O-OG1 3.21Å; A204-T206 PolarHBondContact O-N 2.69Å; T206-A209 PolarHBondContact O-N 2.84Å; T206-I210 VanDerWaalsContact O-CG1 3.28Å; T206-I210 WeakPolarHBondContact O-CG1 3.38Å; T206-I210 PolarHBondContact O-N 2.94Å
207	T	94.4	Very high	92.4	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-62.1	-44.5	173.7	-55.5	0	0	0	0	111.4	L47 M129 L203 A204 W205 A209 I210 Y211	L47-T207 HydrophobicContact CB-CG2 4.23Å; M129-T207 HydrophobicContact CE-CG2 3.9Å; L203-T207 PolarHBondContact O-N 3.08Å; L203-T207 PolarHBondContact O-OG1 3.24Å; A204-T207 WeakPolarHBondContact O-CB 3.44Å; A204-T207 PolarHBondContact O-N 3.41Å; A204-T207 VanDerWaalsContact O-N 3.15Å; W205-T207 VanDerWaalsContact C-N 3.29Å; W205-T207 PolarHBondContact O-N 3.27Å; T207-A209 VanDerWaalsContact C-N 3.33Å; T207-A209 PolarHBondContact O-N 3.49Å; T207-I210 PolarHBondContact O-N 3.4Å; T207-Y211 HydrophobicContact CG2-CD2 3.91Å; T207-Y211 HydrophobicContact CG2-CE2 4.12Å; T207-Y211 WeakPolarHBondContact O-CD2 3.48Å; T207-Y211 PolarHBondContact O-N 3.09Å
208	V	95.6	Very high	92.8	Very high	9 Å²	9	43.1 Å²	43.1	6%	0.055	23%	0.226	C	C	.	.	H	α-helix	trans	-57.6	-46.7	174.3	173	0	0	0	0	110.9	V162 L163 I166 A204 W205 I210 Y211 T212	V162-V208 HydrophobicContact CB-CG2 3.83Å; V162-V208 HydrophobicContact CG1-CG2 3.56Å; L163-V208 HydrophobicContact CD1-CG1 4.09Å; L163-V208 HydrophobicContact CD2-CG1 3.91Å; L163-V208 HydrophobicContact CD2-CG2 4.08Å; L163-V208 HydrophobicContact CG-CG1 3.82Å; L163-V208 HydrophobicContact CG-CG2 3.97Å; I166-V208 HydrophobicContact CD1-CG2 4.27Å; A204-V208 WeakPolarHBondContact O-CG2 3.41Å; A204-V208 PolarHBondContact O-N 2.59Å; W205-V208 PolarHBondContact O-N 2.9Å; V208-I210 PolarHBondContact O-N 2.85Å; V208-Y211 PolarHBondContact O-N 3.47Å; V208-T212 WeakPolarHBondContact O-CB 3.23Å; V208-T212 PolarHBondContact O-N 2.99Å; V208-T212 PolarHBondContact O-OG1 3.46Å
209	A	95.8	Very high	93.1	Very high	47 Å²	47	46.7 Å²	46.7	39%	0.388	25%	0.247	S	C	.	.	H	α-helix	trans	-61.7	-44.6	179	0	0	0	0	0	112	W205 T206 T207 Y211 T212 I213	W205-A209 PolarHBondContact O-N 2.97Å; T206-A209 PolarHBondContact O-N 2.84Å; T207-A209 VanDerWaalsContact C-N 3.33Å; T207-A209 PolarHBondContact O-N 3.49Å; A209-Y211 PolarHBondContact O-N 2.86Å; A209-T212 PolarHBondContact O-N 3.3Å; A209-I213 WeakPolarHBondContact O-CB 3.18Å; A209-I213 VanDerWaalsContact O-CG1 3.27Å; A209-I213 WeakPolarHBondContact O-CG1 3.45Å; A209-I213 PolarHBondContact O-N 2.94Å
210	I	95.4	Very high	93.1	Very high	32 Å²	32	47.6 Å²	47.6	16%	0.164	25%	0.247	C	C	.	.	H	α-helix	trans	-57.6	-51.1	176.5	-72.2	166.6	0	0	0	110.9	T39 T40 L46 T206 T207 V208 T212 I213 A214	T39-I210 HydrophobicContact CG2-CB 4.34Å; T39-I210 HydrophobicContact CG2-CD1 4.18Å; T39-I210 HydrophobicContact CG2-CG1 3.9Å; T39-I210 HydrophobicContact CG2-CG2 3.61Å; T40-I210 HydrophobicContact CG2-CG2 4.31Å; L46-I210 HydrophobicContact CD1-CD1 4.09Å; T206-I210 VanDerWaalsContact O-CG1 3.28Å; T206-I210 WeakPolarHBondContact O-CG1 3.38Å; T206-I210 PolarHBondContact O-N 2.94Å; T207-I210 PolarHBondContact O-N 3.4Å; V208-I210 PolarHBondContact O-N 2.85Å; I210-T212 PolarHBondContact O-N 2.91Å; I210-I213 PolarHBondContact O-N 3.26Å; I210-A214 VanDerWaalsContact O-CB 3.29Å; I210-A214 WeakPolarHBondContact O-CB 3.29Å; I210-A214 PolarHBondContact O-N 3.34Å
211	Y	95.4	Very high	92.8	Very high	1 Å²	1	47.8 Å²	47.8	0%	0.004	25%	0.249	C	C	.	.	H	α-helix	trans	-69.4	-33.5	-177	-88.3	-96.1	0	0	0	112.5	T40 M129 N133 M155 V158 T207 V208 A209 A215	T40-Y211 HydrophobicContact CG2-CD1 4.38Å; T40-Y211 HydrophobicContact CG2-CE1 4.15Å; T40-Y211 HydrophobicContact CG2-CE2 4.36Å; T40-Y211 PolarHBondContact O-OH 3.12Å; T40-Y211 VanDerWaalsContact O-OH 3.11Å; M129-Y211 HydrophobicContact CE-CD2 4.2Å; M129-Y211 HydrophobicContact CE-CE2 3.24Å; M129-Y211 VanDerWaalsContact CE-CZ 3.44Å; M129-Y211 VanDerWaalsContact CE-OH 3.3Å; M129-Y211 WeakPolarHBondContact CE-OH 3.29Å; M129-Y211 HydrophobicContact CG-CE1 4.02Å; M129-Y211 HydrophobicContact CG-CE2 4.39Å; M129-Y211 WeakPolarHBondContact CG-OH 3.4Å; N133-Y211 PolarHBondContact ND2-OH 3.26Å; M155-Y211 HydrophobicContact CB-CD1 4.03Å; M155-Y211 HydrophobicContact CG-CD1 4.09Å; M155-Y211 HydrophobicContact CG-CE1 4.28Å; V158-Y211 HydrophobicContact CB-CD1 3.71Å; V158-Y211 HydrophobicContact CB-CE1 4.01Å; V158-Y211 HydrophobicContact CB-CG 4.36Å; V158-Y211 HydrophobicContact CG1-CD1 3.54Å; V158-Y211 HydrophobicContact CG1-CD2 4.24Å; V158-Y211 HydrophobicContact CG1-CE1 3.69Å; V158-Y211 HydrophobicContact CG1-CE2 4.39Å; V158-Y211 HydrophobicContact CG1-CG 3.84Å; V158-Y211 HydrophobicContact CG2-CD1 4.31Å; V158-Y211 HydrophobicContact CG2-CE1 4.16Å; T207-Y211 HydrophobicContact CG2-CD2 3.91Å; T207-Y211 HydrophobicContact CG2-CE2 4.12Å; T207-Y211 WeakPolarHBondContact O-CD2 3.48Å; T207-Y211 PolarHBondContact O-N 3.09Å; V208-Y211 PolarHBondContact O-N 3.47Å; A209-Y211 PolarHBondContact O-N 2.86Å; Y211-A215 VanDerWaalsContact O-CB 3.29Å; Y211-A215 WeakPolarHBondContact O-CB 3.49Å; Y211-A215 PolarHBondContact O-N 3.42Å
212	T	95.7	Very high	92.5	Very high	62 Å²	62	48.1 Å²	48.1	38%	0.38	25%	0.251	S	S	.	.	H	α-helix	trans	-66.5	-47.2	175.2	-55.6	0	0	0	0	111.2	V208 A209 I210 A214 A215 L216	V208-T212 WeakPolarHBondContact O-CB 3.23Å; V208-T212 PolarHBondContact O-N 2.99Å; V208-T212 PolarHBondContact O-OG1 3.46Å; A209-T212 PolarHBondContact O-N 3.3Å; I210-T212 PolarHBondContact O-N 2.91Å; T212-A214 VanDerWaalsContact C-N 3.35Å; T212-A214 PolarHBondContact O-N 3.45Å; T212-A215 PolarHBondContact O-N 3.04Å; T212-L216 WeakPolarHBondContact O-CG 3.19Å; T212-L216 PolarHBondContact O-N 2.89Å
213	I	95.2	Very high	91.9	Very high	106 Å²	106	44.8 Å²	44.8	54%	0.544	24%	0.243	S	C	.	.	H	α-helix	trans	-63.5	-43.1	176.8	-66.8	166.8	0	0	0	110.3	A209 I210 L216 C217	A209-I213 WeakPolarHBondContact O-CB 3.18Å; A209-I213 VanDerWaalsContact O-CG1 3.27Å; A209-I213 WeakPolarHBondContact O-CG1 3.45Å; A209-I213 PolarHBondContact O-N 2.94Å; I210-I213 PolarHBondContact O-N 3.26Å; I213-L216 PolarHBondContact O-N 3.27Å; I213-C217 PolarHBondContact O-N 2.71Å; I213-C217 PolarHBondContact O-SG 3.12Å; I213-C217 VanDerWaalsContact O-SG 3.33Å
214	A	93.6	Very high	91	Very high	2 Å²	2	45 Å²	45	2%	0.017	24%	0.241	C	C	.	.	H	α-helix	trans	-61.5	-45	176.9	0	0	0	0	0	111.9	T40 M155 I210 T212 L216 C217 F218	T40-A214 HydrophobicContact CG2-CB 3.44Å; T40-A214 VanDerWaalsContact CG2-CB 3.44Å; M155-A214 HydrophobicContact SD-CB 3.7Å; I210-A214 VanDerWaalsContact O-CB 3.29Å; I210-A214 WeakPolarHBondContact O-CB 3.29Å; I210-A214 PolarHBondContact O-N 3.34Å; T212-A214 VanDerWaalsContact C-N 3.35Å; T212-A214 PolarHBondContact O-N 3.45Å; A214-L216 VanDerWaalsContact C-N 3.29Å; A214-L216 PolarHBondContact O-N 3.04Å; A214-C217 WeakPolarHBondContact O-CB 3.4Å; A214-C217 PolarHBondContact O-N 2.88Å; A214-C217 VanDerWaalsContact O-N 3.16Å; A214-F218 WeakPolarHBondContact O-CD2 3.48Å; A214-F218 PolarHBondContact O-N 3.02Å
215	A	94.3	Very high	89.7	Confident	9 Å²	9	46 Å²	46	7%	0.074	25%	0.246	C	C	.	.	H	α-helix	trans	-58.9	-40.3	175.8	0	0	0	0	0	112	M155 A156 Y211 T212 T219	M155-A215 HydrophobicContact CB-CB 3.98Å; A156-A215 HydrophobicContact CB-CB 4.24Å; Y211-A215 VanDerWaalsContact O-CB 3.29Å; Y211-A215 WeakPolarHBondContact O-CB 3.49Å; Y211-A215 PolarHBondContact O-N 3.42Å; T212-A215 PolarHBondContact O-N 3.04Å; A215-T219 VanDerWaalsContact O-CB 3.3Å; A215-T219 WeakPolarHBondContact O-CB 3.5Å; A215-T219 PolarHBondContact O-N 2.83Å; A215-T219 PolarHBondContact O-OG1 2.86Å
216	L	94	Very high	88.2	Confident	101 Å²	101	46.7 Å²	46.7	53%	0.529	25%	0.252	S	S	.	.	H	α-helix	trans	-65.6	-45.3	174	-69.5	173.4	0	0	0	112	T212 I213 A214 F218 T219 I220	T212-L216 WeakPolarHBondContact O-CG 3.19Å; T212-L216 PolarHBondContact O-N 2.89Å; I213-L216 PolarHBondContact O-N 3.27Å; A214-L216 VanDerWaalsContact C-N 3.29Å; A214-L216 PolarHBondContact O-N 3.04Å; L216-F218 PolarHBondContact O-N 3.4Å; L216-T219 PolarHBondContact O-N 3.23Å; L216-I220 VanDerWaalsContact O-CG1 3.32Å; L216-I220 WeakPolarHBondContact O-CG1 3.43Å; L216-I220 PolarHBondContact O-N 2.85Å
217	C	92.2	Very high	86.6	Confident	27 Å²	27	45.3 Å²	45.3	18%	0.182	25%	0.251	C	S	.	.	H	α-helix	trans	-58	-45.8	176.3	-72	0	0	0	0	111.9	I213 A214 G221	I213-C217 PolarHBondContact O-N 2.71Å; I213-C217 PolarHBondContact O-SG 3.12Å; I213-C217 VanDerWaalsContact O-SG 3.33Å; A214-C217 WeakPolarHBondContact O-CB 3.4Å; A214-C217 PolarHBondContact O-N 2.88Å; A214-C217 VanDerWaalsContact O-N 3.16Å; C217-G221 PolarHBondContact O-N 3.07Å
218	F	90.9	Very high	84.8	Confident	1 Å²	1	53.2 Å²	53.2	0%	0.004	29%	0.288	C	S	.	.	H	α-helix	trans	-68.3	-37.9	176.5	-87.3	-87.3	0	0	0	112.2	M33 S36 A136 K148 T151 A152 M155 A214 L216 G221 S222	M33-F218 HydrophobicContact CB-CE1 4.39Å; M33-F218 HydrophobicContact CB-CZ 4.28Å; M33-F218 HydrophobicContact CG-CD1 4.36Å; M33-F218 HydrophobicContact CG-CE1 4.34Å; M33-F218 HydrophobicContact SD-CD1 4.17Å; M33-F218 HydrophobicContact SD-CE1 4.26Å; S36-F218 WeakPolarHBondContact OG-CE2 3.27Å; A136-F218 HydrophobicContact CB-CE1 4.44Å; A136-F218 HydrophobicContact CB-CZ 3.84Å; K148-F218 HydrophobicContact CB-CD1 4.44Å; T151-F218 HydrophobicContact CG2-CD1 3.94Å; T151-F218 HydrophobicContact CG2-CD2 4.34Å; T151-F218 HydrophobicContact CG2-CE1 3.84Å; T151-F218 HydrophobicContact CG2-CE2 4.25Å; T151-F218 HydrophobicContact CG2-CG 4.2Å; T151-F218 HydrophobicContact CG2-CZ 4.01Å; A152-F218 HydrophobicContact CB-CB 3.77Å; M155-F218 HydrophobicContact CE-CD2 4.01Å; M155-F218 HydrophobicContact CE-CE2 3.64Å; M155-F218 HydrophobicContact CE-CZ 4.31Å; M155-F218 HydrophobicContact SD-CD2 3.66Å; M155-F218 HydrophobicContact SD-CE2 3.94Å; M155-F218 HydrophobicContact SD-CG 4.47Å; A214-F218 WeakPolarHBondContact O-CD2 3.48Å; A214-F218 PolarHBondContact O-N 3.02Å; L216-F218 PolarHBondContact O-N 3.4Å; F218-G221 PolarHBondContact O-N 2.83Å; F218-S222 WeakPolarHBondContact O-CB 3.41Å; F218-S222 PolarHBondContact O-N 2.83Å; F218-S222 PolarHBondContact O-OG 3.23Å
219	T	90.3	Very high	83.2	Confident	75 Å²	75	58.7 Å²	58.7	46%	0.46	31%	0.313	S	S	.	.	H	α-helix	trans	-60.9	-49.1	176	-62.2	0	0	0	0	111.1	A215 L216 S222	A215-T219 VanDerWaalsContact O-CB 3.3Å; A215-T219 WeakPolarHBondContact O-CB 3.5Å; A215-T219 PolarHBondContact O-N 2.83Å; A215-T219 PolarHBondContact O-OG1 2.86Å; L216-T219 PolarHBondContact O-N 3.23Å; T219-S222 PolarHBondContact O-N 3.44Å; T219-S222 PolarHBondContact O-OG 2.93Å
220	I	88	Confident	81.6	Confident	96 Å²	96	56.5 Å²	56.5	49%	0.492	29%	0.294	S	S	.	.	H	α-helix	trans	-66.7	-38.5	177.7	-63.1	167.7	0	0	0	111	L216 S222 Q223	L216-I220 VanDerWaalsContact O-CG1 3.32Å; L216-I220 WeakPolarHBondContact O-CG1 3.43Å; L216-I220 PolarHBondContact O-N 2.85Å; I220-S222 VanDerWaalsContact C-N 3.27Å; I220-S222 PolarHBondContact O-N 2.93Å; I220-Q223 WeakPolarHBondContact O-CG 3.48Å
221	G	83.6	Confident	80.2	Confident	5 Å²	5	55 Å²	55	5%	0.052	29%	0.287	C	S	.	.	H	α-helix	trans	-69.2	-19.9	176.9	0	0	0	0	0	114.5	C217 F218 Q223	C217-G221 PolarHBondContact O-N 3.07Å; F218-G221 PolarHBondContact O-N 2.83Å; G221-Q223 VanDerWaalsContact C-N 3.3Å; G221-Q223 PolarHBondContact O-N 3.49Å
222	S	84	Confident	78.9	Confident	9 Å²	9	55 Å²	55	6%	0.063	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	11.3	-175.1	77.1	0	0	0	0	115.5	R149 F218 T219 I220 K224	R149-S222 WeakPolarHBondContact CG-OG 3.38Å; F218-S222 WeakPolarHBondContact O-CB 3.41Å; F218-S222 PolarHBondContact O-N 2.83Å; F218-S222 PolarHBondContact O-OG 3.23Å; T219-S222 PolarHBondContact O-N 3.44Å; T219-S222 PolarHBondContact O-OG 2.93Å; I220-S222 VanDerWaalsContact C-N 3.27Å; I220-S222 PolarHBondContact O-N 2.93Å; S222-K224 PolarHBondContact O-N 3.05Å
223	Q	78.6	Confident	77.5	Confident	102 Å²	102	57.1 Å²	57.1	48%	0.477	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-61.6	127.9	179.1	-72.1	-178.9	-10.4	0	0	110.8	I220 G221 Q225	I220-Q223 WeakPolarHBondContact O-CG 3.48Å; G221-Q223 VanDerWaalsContact C-N 3.3Å; G221-Q223 PolarHBondContact O-N 3.49Å; Q223-Q225 PolarHBondContact O-N 2.99Å; Q223-Q225 PolarHBondContact O-NE2 3.29Å
224	K	73.3	Confident	76.3	Confident	70 Å²	70	56.9 Å²	56.9	30%	0.304	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-64.7	131.1	-179.4	-173.4	168	-175.4	162.7	0	109.7	Y145 S222 K226	Y145-K224 HydrophobicContact CD1-CD 4.49Å; Y145-K224 HydrophobicContact CD1-CG 4.32Å; Y145-K224 HydrophobicContact CE1-CD 4Å; Y145-K224 HydrophobicContact CE1-CG 4.31Å; Y145-K224 PolarHBondContact OH-NZ 3.34Å; S222-K224 PolarHBondContact O-N 3.05Å; K224-K226 HydrophobicContact CD-CG 4.37Å; K224-K226 HydrophobicContact CG-CG 4.16Å
225	Q	65.1	Low	75.2	Confident	23 Å²	23	57 Å²	57	11%	0.107	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-96.4	120.5	178.6	-59.4	-60.9	-27.5	0	0	108.5	Q223 H229 A230 D239	Q223-Q225 PolarHBondContact O-N 2.99Å; Q223-Q225 PolarHBondContact O-NE2 3.29Å; Q225-H229 PolarHBondContact OE1-O 2.88Å; Q225-A230 HydrophobicContact CB-CB 4.43Å; Q225-D239 PolarHBondContact N-OD2 2.97Å; Q225-D239 VanDerWaalsContact N-OD2 3.07Å
226	K	62.4	Low	74	Confident	138 Å²	138	58.6 Å²	58.6	60%	0.6	30%	0.295	S	S	*	.			trans	-134.4	136.6	176.9	-68.1	-168.7	179.9	-177.4	0	111.1	K224 Q228 H229	K224-K226 HydrophobicContact CD-CG 4.37Å; K224-K226 HydrophobicContact CG-CG 4.16Å; K226-Q228 PolarHBondContact O-N 3.47Å; K226-H229 PolarHBondContact O-N 2.76Å
227	G	61.5	Low	73	Confident	36 Å²	36	57.6 Å²	57.6	37%	0.371	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	56.8	-131.9	171.8	0	0	0	0	0	113	H229 A230	G227-H229 PolarHBondContact O-N 3.06Å; G227-A230 WeakPolarHBondContact O-CB 3.39Å; G227-A230 PolarHBondContact O-N 2.86Å
228	Q	56.2	Low	72	Confident	166 Å²	166	59.9 Å²	59.9	78%	0.776	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-59.3	-11.6	-177.9	-66.1	-177.4	-14.1	0	0	115.2	K226	K226-Q228 PolarHBondContact O-N 3.47Å
229	H	61.7	Low	71	Confident	125 Å²	125	60.2 Å²	60.2	58%	0.579	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-88.7	-14.8	177.3	-65	66.8	0	0	0	112.6	Q225 K226 G227 A231	Q225-H229 PolarHBondContact OE1-O 2.88Å; K226-H229 PolarHBondContact O-N 2.76Å; G227-H229 PolarHBondContact O-N 3.06Å; H229-A231 PolarHBondContact O-N 2.79Å
230	A	62.4	Low	70	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	31%	0.308	C	S	.	.			trans	-65.7	126.3	178.2	0	0	0	0	0	110.9	Q225 G227 T232 E236	Q225-A230 HydrophobicContact CB-CB 4.43Å; G227-A230 WeakPolarHBondContact O-CB 3.39Å; G227-A230 PolarHBondContact O-N 2.86Å; A230-T232 VanDerWaalsContact C-N 3.3Å; A230-E236 HydrophobicContact CB-CB 3.84Å; A230-E236 HydrophobicContact CB-CG 4.24Å
231	A	64.9	Low	69.2	Low	2 Å²	2	63.8 Å²	63.8	2%	0.017	32%	0.315	C	S	.	.	S	Bend	trans	-66.5	-35.6	176.9	0	0	0	0	0	111.8	L18 M26 H229 F235	L18-A231 PolarHBondContact N-O 2.79Å; L18-A231 VanDerWaalsContact N-O 3.12Å; M26-A231 HydrophobicContact CB-CB 3.93Å; M26-A231 HydrophobicContact CG-CB 4.21Å; H229-A231 PolarHBondContact O-N 2.79Å; A231-F235 HydrophobicContact CB-CD2 4.33Å
232	T	69.1	Low	68.4	Low	0 Å²	0	72 Å²	72	0%	0	35%	0.349	C	S	.	.	B	Isolated β-bridge	trans	-143	153.5	-177.2	61.7	0	0	0	0	110.5	M12 L15 S16 Y23 A230 E234 F235 E236	M12-T232 HydrophobicContact CE-CG2 3.45Å; M12-T232 VanDerWaalsContact CE-CG2 3.45Å; L15-T232 HydrophobicContact CB-CG2 3.53Å; L15-T232 HydrophobicContact CD1-CG2 3.85Å; L15-T232 HydrophobicContact CG-CG2 4.26Å; S16-T232 VanDerWaalsContact O-CA 3.32Å; S16-T232 WeakPolarHBondContact O-CA 3.38Å; Y23-T232 HydrophobicContact CD2-CG2 4.24Å; A230-T232 VanDerWaalsContact C-N 3.3Å; T232-E234 VanDerWaalsContact C-N 3.26Å; T232-E234 PolarHBondContact O-N 3.11Å; T232-F235 PolarHBondContact O-N 2.97Å; T232-F235 WeakPolarHBondContact OG1-CD2 3.35Å; T232-F235 VanDerWaalsContact OG1-CG 3.26Å; T232-F235 WeakPolarHBondContact OG1-CG 3.26Å; T232-E236 PolarHBondContact O-N 2.84Å
233	Q	66.3	Low	67.6	Low	107 Å²	107	77.7 Å²	77.7	50%	0.5	38%	0.379	S	S	.	.	H	α-helix	trans	-60.9	-36.2	179.4	-171.3	177	-5	0	0	112	S16 L18 F235 E236 V237	S16-Q233 PolarHBondContact O-N 2.8Å; S16-Q233 VanDerWaalsContact OG-CB 3.24Å; S16-Q233 WeakPolarHBondContact OG-CB 3.42Å; S16-Q233 PolarHBondContact OG-OE1 2.87Å; L18-Q233 HydrophobicContact CD1-CB 4.39Å; Q233-F235 PolarHBondContact O-N 3.18Å; Q233-E236 WeakPolarHBondContact O-CB 3.35Å; Q233-E236 PolarHBondContact O-N 3.36Å; Q233-V237 HydrophobicContact CG-CG2 4.46Å; Q233-V237 VanDerWaalsContact O-CG2 3.32Å; Q233-V237 WeakPolarHBondContact O-CG2 2.97Å; Q233-V237 PolarHBondContact O-N 3.15Å
234	E	70.2	Confident	66.8	Low	101 Å²	101	80.3 Å²	80.3	47%	0.472	40%	0.395	S	S	.	.	H	α-helix	trans	-64	-40.9	179.7	-65.1	-171.7	-165.8	0	0	112.7	L15 T232 E236 V237 E238	L15-E234 HydrophobicContact CD2-CB 3.91Å; L15-E234 HydrophobicContact CD2-CG 3.63Å; L15-E234 VanDerWaalsContact CD2-OE1 3.24Å; L15-E234 WeakPolarHBondContact CD2-OE1 3.26Å; L15-E234 WeakPolarHBondContact CD2-OE2 3.4Å; T232-E234 VanDerWaalsContact C-N 3.26Å; T232-E234 PolarHBondContact O-N 3.11Å; E234-E236 VanDerWaalsContact C-N 3.29Å; E234-E236 PolarHBondContact O-N 3.37Å; E234-V237 PolarHBondContact O-N 2.61Å; E234-E238 PolarHBondContact O-N 2.83Å
235	F	69.1	Low	66.3	Low	5 Å²	5	80.5 Å²	80.5	2%	0.022	42%	0.417	C	S	.	.	H	α-helix	trans	-66.1	-34.2	175.3	-65	-25.1	0	0	0	112.4	M12 L15 M26 R30 H143 A231 T232 Q233 D239	M12-F235 HydrophobicContact CE-CD2 4.24Å; M12-F235 HydrophobicContact CE-CE2 3.24Å; M12-F235 HydrophobicContact CE-CZ 3.65Å; M12-F235 HydrophobicContact SD-CE2 4.09Å; M12-F235 HydrophobicContact SD-CZ 4.17Å; L15-F235 HydrophobicContact CD1-CZ 4.29Å; M26-F235 HydrophobicContact CE-CD2 4.17Å; M26-F235 HydrophobicContact CE-CE2 3.85Å; M26-F235 HydrophobicContact CE-CZ 4.29Å; M26-F235 HydrophobicContact CG-CE2 4Å; R30-F235 VanDerWaalsContact NH2-CZ 3.35Å; H143-F235 HydrophobicContact CB-CD1 3.77Å; H143-F235 HydrophobicContact CB-CE1 3.66Å; H143-F235 AromaticContact CD2-CD1 3.42Å; H143-F235 VanDerWaalsContact CD2-CD1 3.42Å; H143-F235 WeakPolarHBondContact CD2-CD1 3.47Å; H143-F235 AromaticContact CD2-CE1 3.08Å; H143-F235 WeakPolarHBondContact CD2-CE1 3.47Å; H143-F235 AromaticContact CD2-CZ 3.56Å; H143-F235 AromaticContact CE1-CD1 3.28Å; H143-F235 WeakPolarHBondContact CE1-CD1 3.48Å; H143-F235 AromaticContact CE1-CD2 3.94Å; H143-F235 AromaticContact CE1-CE1 3.77Å; H143-F235 AromaticContact CE1-CG 3.37Å; H143-F235 WeakPolarHBondContact CE1-CG 3.47Å; H143-F235 AromaticContact CG-CD1 3.06Å; H143-F235 AromaticContact CG-CE1 3.09Å; H143-F235 AromaticContact CG-CG 3.98Å; H143-F235 AromaticContact ND1-CD1 2.98Å; H143-F235 WeakPolarHBondContact ND1-CD1 3.4Å; H143-F235 AromaticContact ND1-CE1 3.56Å; H143-F235 AromaticContact ND1-CG 3.51Å; H143-F235 AromaticContact NE2-CD1 3.59Å; H143-F235 AromaticContact NE2-CE1 3.57Å; H143-F235 AromaticContact NE2-CE2 4Å; H143-F235 AromaticContact NE2-CG 3.83Å; H143-F235 AromaticContact NE2-CZ 3.78Å; A231-F235 HydrophobicContact CB-CD2 4.33Å; T232-F235 PolarHBondContact O-N 2.97Å; T232-F235 WeakPolarHBondContact OG1-CD2 3.35Å; T232-F235 VanDerWaalsContact OG1-CG 3.26Å; T232-F235 WeakPolarHBondContact OG1-CG 3.26Å; Q233-F235 PolarHBondContact O-N 3.18Å; F235-D239 WeakPolarHBondContact O-CB 3.46Å; F235-D239 PolarHBondContact O-N 3.23Å
236	E	69.9	Low	65.2	Low	41 Å²	41	94.2 Å²	94.2	19%	0.192	47%	0.468	C	S	.	.	H	α-helix	trans	-66.1	-43.7	173.5	-162.9	-164.3	144.8	0	0	111.1	A230 T232 Q233 E234 D239 R240	A230-E236 HydrophobicContact CB-CB 3.84Å; A230-E236 HydrophobicContact CB-CG 4.24Å; T232-E236 PolarHBondContact O-N 2.84Å; Q233-E236 WeakPolarHBondContact O-CB 3.35Å; Q233-E236 PolarHBondContact O-N 3.36Å; E234-E236 VanDerWaalsContact C-N 3.29Å; E234-E236 PolarHBondContact O-N 3.37Å; E236-D239 PolarHBondContact O-N 2.98Å; E236-R240 WeakPolarHBondContact O-CG 3.45Å; E236-R240 PolarHBondContact O-N 3.06Å; E236-R240 IonicContact OE1-CZ 3.6Å; E236-R240 IonicContact OE1-NE 3.63Å; E236-R240 IonicContact OE1-NH2 2.73Å; E236-R240 PolarHBondContact OE1-NH2 3.13Å
237	V	72.5	Confident	65.3	Low	80 Å²	80	92.1 Å²	92.1	49%	0.485	46%	0.462	S	S	.	.	H	α-helix	trans	-64.5	-43.4	179.9	172.6	0	0	0	0	111.2	Q233 E234 D239 R240	Q233-V237 HydrophobicContact CG-CG2 4.46Å; Q233-V237 VanDerWaalsContact O-CG2 3.32Å; Q233-V237 WeakPolarHBondContact O-CG2 2.97Å; Q233-V237 PolarHBondContact O-N 3.15Å; E234-V237 PolarHBondContact O-N 2.61Å; V237-D239 PolarHBondContact O-N 2.93Å; V237-R240 WeakPolarHBondContact O-CB 3.44Å; V237-R240 PolarHBondContact O-N 3.37Å
238	E	71.6	Confident	65.5	Low	76 Å²	76	95 Å²	95	36%	0.355	47%	0.466	S	S	.	.	H	α-helix	trans	-68.1	-30.3	179	-76.9	-170.1	-153.8	0	0	114.2	H143 R144 E234 R240	H143-E238 WeakPolarHBondContact CA-OE2 3.12Å; H143-E238 WeakPolarHBondContact CB-OE2 3.46Å; H143-E238 PolarHBondContact N-OE2 2.88Å; R144-E238 PolarHBondContact N-OE2 2.96Å; E234-E238 PolarHBondContact O-N 2.83Å; E238-R240 VanDerWaalsContact C-N 3.32Å
239	D	70.2	Confident	66.1	Low	8 Å²	8	91.1 Å²	91.1	4%	0.043	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-6	-179.8	-84.3	5.6	0	0	0	113.1	Y145 Q225 F235 E236 V237	Y145-D239 HydrophobicContact CD1-CB 4.4Å; Y145-D239 WeakPolarHBondContact CD1-OD1 3.49Å; Q225-D239 PolarHBondContact N-OD2 2.97Å; Q225-D239 VanDerWaalsContact N-OD2 3.07Å; F235-D239 WeakPolarHBondContact O-CB 3.46Å; F235-D239 PolarHBondContact O-N 3.23Å; E236-D239 PolarHBondContact O-N 2.98Å; V237-D239 PolarHBondContact O-N 2.93Å
240	R	70	Confident	66.3	Low	147 Å²	147	89.1 Å²	89.1	56%	0.555	44%	0.442	S	S	*	.	S	Bend	trans	-68.9	142.6	175.1	-77.4	171	-171.9	-165.1	1.8	110.5	E236 V237 E238 F242	E236-R240 WeakPolarHBondContact O-CG 3.45Å; E236-R240 PolarHBondContact O-N 3.06Å; E236-R240 IonicContact OE1-CZ 3.6Å; E236-R240 IonicContact OE1-NE 3.63Å; E236-R240 IonicContact OE1-NH2 2.73Å; E236-R240 PolarHBondContact OE1-NH2 3.13Å; V237-R240 WeakPolarHBondContact O-CB 3.44Å; V237-R240 PolarHBondContact O-N 3.37Å; E238-R240 VanDerWaalsContact C-N 3.32Å; R240-F242 PolarHBondContact O-N 3.08Å
241	P	70.5	Confident	66.6	Low	99 Å²	99	94.6 Å²	94.6	64%	0.643	47%	0.469	S	S	*	.			trans	-61	135	172.6	27.6	-32.9	0	0	0	109.3	N243	P241-N243 PolarHBondContact O-N 3.08Å; P241-N243 VanDerWaalsContact O-N 3.07Å
242	F	66	Low	66.7	Low	176 Å²	176	100.8 Å²	100.8	77%	0.772	50%	0.499	S	S	*	.			trans	-71.3	103.6	172.5	-163.7	-89.4	0	0	0	107.8	R240 L244	R240-F242 PolarHBondContact O-N 3.08Å; F242-L244 VanDerWaalsContact C-N 3.31Å; F242-L244 HydrophobicContact CD1-CB 4.43Å; F242-L244 HydrophobicContact CD1-CD1 3.56Å; F242-L244 HydrophobicContact CD1-CD2 4.38Å; F242-L244 HydrophobicContact CD1-CG 3.48Å; F242-L244 VanDerWaalsContact CD1-CG 3.48Å; F242-L244 HydrophobicContact CE1-CD1 4.01Å; F242-L244 HydrophobicContact CE1-CD2 3.98Å; F242-L244 HydrophobicContact CE1-CG 3.53Å; F242-L244 PolarHBondContact O-N 3.07Å
243	N	68.4	Low	66.5	Low	129 Å²	129	108 Å²	108	69%	0.69	54%	0.535	S	S	*	.			trans	-76.8	85.7	174.1	-68.9	-22.2	0	0	0	108.4	P241 G245	P241-N243 PolarHBondContact O-N 3.08Å; P241-N243 VanDerWaalsContact O-N 3.07Å; N243-G245 VanDerWaalsContact C-N 3.29Å; N243-G245 PolarHBondContact O-N 3.02Å
244	L	60.9	Low	66.5	Low	157 Å²	157	108.1 Å²	108.1	82%	0.822	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	91.9	160.9	-79.7	127.9	0	0	0	107.4	F242	F242-L244 VanDerWaalsContact C-N 3.31Å; F242-L244 HydrophobicContact CD1-CB 4.43Å; F242-L244 HydrophobicContact CD1-CD1 3.56Å; F242-L244 HydrophobicContact CD1-CD2 4.38Å; F242-L244 HydrophobicContact CD1-CG 3.48Å; F242-L244 VanDerWaalsContact CD1-CG 3.48Å; F242-L244 HydrophobicContact CE1-CD1 4.01Å; F242-L244 HydrophobicContact CE1-CD2 3.98Å; F242-L244 HydrophobicContact CE1-CG 3.53Å; F242-L244 PolarHBondContact O-N 3.07Å
245	G	64.4	Low	66.2	Low	74 Å²	74	108.7 Å²	108.7	76%	0.763	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	145.5	20.6	168.9	0	0	0	0	0	119.4	N243	N243-G245 VanDerWaalsContact C-N 3.29Å; N243-G245 PolarHBondContact O-N 3.02Å
246	R	40.9	Very low	65.9	Low	312 Å²	312	118.1 Å²	118.1	100%	1.177	59%	0.591	S	S	*	*			trans	-139.4	0	159.8	-83.7	-176.2	77.3	147.7	-0.1	111.2

Retrieved 246 of 246 residues in 111 ms (Link to these results)

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