A0A061HTX9_CRIGR Loading...

Pleckstrin homology domain-containing family F member 1

May induce apoptosis through the lysosomal-mitochondrial pathway. Translocates to the lysosome initiating the permeabilization of lysosomal membrane (LMP) and resulting in the release of CTSD and CTSL to the cytoplasm. Triggers the caspase-independent apoptosis by altering mitochondrial membrane permeabilization (MMP) resulting in the release of PDCD8.

AlphaFold DB , UniProt , Accession A0A061HTX9, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene LOC103160584, Length 280 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	53.1	Low	77.2	Confident	141 Å²	141	80.2 Å²	80.2	70%	0.695	41%	0.413	S	S	*	.				0	-8.6	0	-147.2	-169.1	-64.2	0	0	112.8	H4 W275	M1-H4 PolarHBondContact O-CE1 3.41Å; M1-H4 PolarHBondContact O-ND1 2.96Å; M1-W275 HydrophobicContact SD-CH2 3.82Å; M1-W275 HydrophobicContact SD-CZ3 4.03Å
2	V	57.4	Low	78.5	Confident	28 Å²	28	78.3 Å²	78.3	17%	0.17	41%	0.413	C	S	.	.			trans	-90.2	-23.6	175.3	177	0	0	0	0	111.4	H4 L5 V35 L37	V2-H4 PolarHBondContact O-N 3Å; V2-H4 VanDerWaalsContact O-N 3.16Å; V2-L5 PolarHBondContact O-N 2.92Å; V2-L5 VanDerWaalsContact O-N 3.14Å; V2-V35 HydrophobicContact CG1-CB 3.98Å; V2-V35 HydrophobicContact CG1-CG1 3.97Å; V2-V35 HydrophobicContact CG1-CG2 4.14Å; V2-L37 HydrophobicContact CB-CD2 4.28Å; V2-L37 HydrophobicContact CG1-CD2 3.49Å; V2-L37 VanDerWaalsContact CG1-CD2 3.49Å; V2-L37 HydrophobicContact CG2-CD2 3.77Å
3	D	63.4	Low	79.7	Confident	121 Å²	121	81.1 Å²	81.1	65%	0.647	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-64.4	-25.8	-170.6	-42.2	-63.5	0	0	0	113.3	L5 V6	D3-L5 VanDerWaalsContact C-N 3.3Å; D3-L5 PolarHBondContact O-N 2.88Å; D3-V6 WeakPolarHBondContact O-CB 3.44Å; D3-V6 PolarHBondContact O-N 2.91Å
4	H	73.7	Confident	80.7	Confident	110 Å²	110	81.5 Å²	81.5	51%	0.509	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-73.6	-18.8	179.6	74.5	-77.6	0	0	0	114	M1 V2 T8	M1-H4 PolarHBondContact O-CE1 3.41Å; M1-H4 PolarHBondContact O-ND1 2.96Å; V2-H4 PolarHBondContact O-N 3Å; V2-H4 VanDerWaalsContact O-N 3.16Å; H4-T8 WeakPolarHBondContact O-CG2 3.33Å
5	L	76.1	Confident	81.7	Confident	43 Å²	43	76.4 Å²	76.4	23%	0.225	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-93.5	-13	177.1	-65.7	177	0	0	0	112.5	V2 D3 N7 T8 N11 V35	V2-L5 PolarHBondContact O-N 2.92Å; V2-L5 VanDerWaalsContact O-N 3.14Å; D3-L5 VanDerWaalsContact C-N 3.3Å; D3-L5 PolarHBondContact O-N 2.88Å; L5-N7 PolarHBondContact O-N 3.21Å; L5-T8 WeakPolarHBondContact O-CB 3.49Å; L5-T8 WeakPolarHBondContact O-CG2 3.48Å; L5-T8 PolarHBondContact O-N 3.4Å; L5-T8 VanDerWaalsContact O-N 3.16Å; L5-T8 PolarHBondContact O-OG1 3.44Å; L5-N11 WeakPolarHBondContact O-CB 3.34Å; L5-V35 HydrophobicContact CB-CG1 3.87Å; L5-V35 HydrophobicContact CD1-CG1 4.37Å
6	V	81.9	Confident	82.5	Confident	44 Å²	44	74.5 Å²	74.5	27%	0.267	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	128.8	179.6	175.7	0	0	0	0	109.5	D3 T8 V35	D3-V6 WeakPolarHBondContact O-CB 3.44Å; D3-V6 PolarHBondContact O-N 2.91Å; V6-T8 PolarHBondContact O-N 3.42Å; V6-V35 HydrophobicContact CB-CG2 4.28Å; V6-V35 HydrophobicContact CG2-CG2 3.56Å
7	N	81.6	Confident	83.2	Confident	114 Å²	114	73.3 Å²	73.3	61%	0.61	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	18.8	179.1	-52.2	-30.5	0	0	0	114.9	L5 G33	L5-N7 PolarHBondContact O-N 3.21Å; N7-G33 PolarHBondContact OD1-N 3.15Å
8	T	88.6	Confident	83.8	Confident	39 Å²	39	69.4 Å²	69.4	24%	0.239	37%	0.372	C	S	.	.			trans	-77.4	151	171.9	62.9	0	0	0	0	111	H4 L5 V6 I10 N11 S12	H4-T8 WeakPolarHBondContact O-CG2 3.33Å; L5-T8 WeakPolarHBondContact O-CB 3.49Å; L5-T8 WeakPolarHBondContact O-CG2 3.48Å; L5-T8 PolarHBondContact O-N 3.4Å; L5-T8 VanDerWaalsContact O-N 3.16Å; L5-T8 PolarHBondContact O-OG1 3.44Å; V6-T8 PolarHBondContact O-N 3.42Å; T8-I10 VanDerWaalsContact C-N 3.25Å; T8-I10 PolarHBondContact O-N 2.74Å; T8-N11 PolarHBondContact O-N 3.2Å; T8-N11 VanDerWaalsContact OG1-CB 3.27Å; T8-N11 WeakPolarHBondContact OG1-CB 3.49Å; T8-N11 PolarHBondContact OG1-N 2.98Å; T8-N11 VanDerWaalsContact OG1-N 3.14Å; T8-S12 PolarHBondContact O-N 3.26Å; T8-S12 PolarHBondContact O-OG 3.27Å
9	E	89.4	Confident	84.4	Confident	127 Å²	127	68.5 Å²	68.5	59%	0.593	37%	0.365	S	S	*	.	H	α-helix	trans	-59.2	-40.3	173.5	-177.7	56	-149.7	0	0	111.1	N11 S12 Q13	E9-N11 PolarHBondContact O-N 2.66Å; E9-S12 PolarHBondContact O-N 3.31Å; E9-Q13 WeakPolarHBondContact O-CG 3.44Å; E9-Q13 PolarHBondContact O-N 2.89Å; E9-Q13 WeakPolarHBondContact OE1-CG 3.33Å; E9-Q13 PolarHBondContact OE1-NE2 3.05Å
10	I	90.7	Very high	84.9	Confident	111 Å²	111	69.7 Å²	69.7	57%	0.569	38%	0.378	S	S	*	.	H	α-helix	trans	-59.7	-47.1	177.5	-63.2	171.2	0	0	0	111	T8 Q13 R14	T8-I10 VanDerWaalsContact C-N 3.25Å; T8-I10 PolarHBondContact O-N 2.74Å; I10-Q13 PolarHBondContact O-N 3.39Å; I10-R14 VanDerWaalsContact O-CG 3.28Å; I10-R14 WeakPolarHBondContact O-CG 3.45Å; I10-R14 PolarHBondContact O-N 3.16Å; I10-R14 VanDerWaalsContact O-N 3.09Å
11	N	92.7	Very high	85.3	Confident	4 Å²	4	67.9 Å²	67.9	2%	0.021	37%	0.371	C	S	.	.	H	α-helix	trans	-62.5	-45.5	176.6	-179.6	60.8	0	0	0	110.9	L5 T8 E9 Q13 R14 I15 R34 V35 L36	L5-N11 WeakPolarHBondContact O-CB 3.34Å; T8-N11 PolarHBondContact O-N 3.2Å; T8-N11 VanDerWaalsContact OG1-CB 3.27Å; T8-N11 WeakPolarHBondContact OG1-CB 3.49Å; T8-N11 PolarHBondContact OG1-N 2.98Å; T8-N11 VanDerWaalsContact OG1-N 3.14Å; E9-N11 PolarHBondContact O-N 2.66Å; N11-Q13 VanDerWaalsContact C-N 3.32Å; N11-Q13 PolarHBondContact O-N 3.02Å; N11-R14 WeakPolarHBondContact O-CB 3.21Å; N11-R14 PolarHBondContact O-N 3.32Å; N11-R14 VanDerWaalsContact O-N 3.11Å; N11-I15 WeakPolarHBondContact O-CG1 3.48Å; N11-I15 PolarHBondContact O-N 2.94Å; N11-R34 PolarHBondContact ND2-O 2.77Å; N11-V35 WeakPolarHBondContact OD1-CA 3.35Å; N11-L36 PolarHBondContact OD1-N 2.78Å; N11-L36 VanDerWaalsContact OD1-N 3.08Å
12	S	93	Very high	87.2	Confident	58 Å²	58	61.4 Å²	61.4	41%	0.406	34%	0.339	S	S	.	.	H	α-helix	trans	-57.6	-43.9	179.2	-56.2	0	0	0	0	112.2	T8 E9 R14 I15 A16	T8-S12 PolarHBondContact O-N 3.26Å; T8-S12 PolarHBondContact O-OG 3.27Å; E9-S12 PolarHBondContact O-N 3.31Å; S12-R14 PolarHBondContact O-N 3.27Å; S12-I15 PolarHBondContact O-N 3Å; S12-A16 WeakPolarHBondContact O-CB 3.27Å; S12-A16 PolarHBondContact O-N 2.98Å
13	Q	94	Very high	88.8	Confident	114 Å²	114	62 Å²	62	53%	0.533	35%	0.35	S	S	.	.	H	α-helix	trans	-63.6	-40.7	175.8	-71.2	175.4	6.1	0	0	112.6	E9 I10 N11 A16 A17	E9-Q13 WeakPolarHBondContact O-CG 3.44Å; E9-Q13 PolarHBondContact O-N 2.89Å; E9-Q13 WeakPolarHBondContact OE1-CG 3.33Å; E9-Q13 PolarHBondContact OE1-NE2 3.05Å; I10-Q13 PolarHBondContact O-N 3.39Å; N11-Q13 VanDerWaalsContact C-N 3.32Å; N11-Q13 PolarHBondContact O-N 3.02Å; Q13-A16 PolarHBondContact O-N 3.09Å; Q13-A17 WeakPolarHBondContact O-CB 3.35Å; Q13-A17 PolarHBondContact O-N 2.97Å
14	R	94.6	Very high	89.9	Confident	87 Å²	87	61.8 Å²	61.8	33%	0.328	37%	0.366	S	S	.	.	H	α-helix	trans	-63.5	-43.9	176.5	-70.8	170.3	69.2	-141.9	1.2	111.7	I10 N11 S12 A17 V18 L36	I10-R14 VanDerWaalsContact O-CG 3.28Å; I10-R14 WeakPolarHBondContact O-CG 3.45Å; I10-R14 PolarHBondContact O-N 3.16Å; I10-R14 VanDerWaalsContact O-N 3.09Å; N11-R14 WeakPolarHBondContact O-CB 3.21Å; N11-R14 PolarHBondContact O-N 3.32Å; N11-R14 VanDerWaalsContact O-N 3.11Å; S12-R14 PolarHBondContact O-N 3.27Å; R14-A17 WeakPolarHBondContact O-CB 3.41Å; R14-A17 PolarHBondContact O-N 3.5Å; R14-V18 PolarHBondContact O-N 3.09Å; R14-L36 HydrophobicContact CB-CD2 4.04Å; R14-L36 PolarHBondContact NH1-O 3.42Å; R14-L36 PolarHBondContact NH2-O 3.14Å; R14-L36 VanDerWaalsContact NH2-O 3.14Å
15	I	95.5	Very high	90.5	Very high	5 Å²	5	60.4 Å²	60.4	3%	0.026	37%	0.368	C	S	.	.	H	α-helix	trans	-62.7	-46	176.3	-59.2	-176.2	0	0	0	110.6	N11 S12 A17 V18 E19 L29 A30 R34 L36 F58	N11-I15 WeakPolarHBondContact O-CG1 3.48Å; N11-I15 PolarHBondContact O-N 2.94Å; S12-I15 PolarHBondContact O-N 3Å; I15-A17 VanDerWaalsContact C-N 3.27Å; I15-A17 PolarHBondContact O-N 3.04Å; I15-V18 WeakPolarHBondContact O-CB 3.48Å; I15-V18 PolarHBondContact O-N 3.4Å; I15-V18 VanDerWaalsContact O-N 3.09Å; I15-E19 PolarHBondContact O-N 3.35Å; I15-L29 HydrophobicContact CG2-CB 3.87Å; I15-A30 HydrophobicContact CG2-CB 4.19Å; I15-R34 HydrophobicContact CD1-CG 4.49Å; I15-R34 WeakPolarHBondContact CD1-O 3.44Å; I15-L36 HydrophobicContact CG1-CB 4.35Å; I15-F58 HydrophobicContact CD1-CE1 4.19Å; I15-F58 HydrophobicContact CG1-CE1 3.94Å; I15-F58 HydrophobicContact CG2-CE1 4.29Å
16	A	95.1	Very high	91.1	Very high	46 Å²	46	59.3 Å²	59.3	38%	0.38	37%	0.368	S	S	.	.	H	α-helix	trans	-61	-35.4	177.3	0	0	0	0	0	112.5	S12 Q13 E19 S20	S12-A16 WeakPolarHBondContact O-CB 3.27Å; S12-A16 PolarHBondContact O-N 2.98Å; Q13-A16 PolarHBondContact O-N 3.09Å; A16-E19 PolarHBondContact O-N 3.33Å; A16-S20 WeakPolarHBondContact O-CB 3.28Å; A16-S20 PolarHBondContact O-N 3.38Å
17	A	93.8	Very high	91.8	Very high	54 Å²	54	63.4 Å²	63.4	45%	0.446	38%	0.384	S	S	.	.	H	α-helix	trans	-63.3	-41.1	174.1	0	0	0	0	0	111.9	Q13 R14 I15 S20 C21	Q13-A17 WeakPolarHBondContact O-CB 3.35Å; Q13-A17 PolarHBondContact O-N 2.97Å; R14-A17 WeakPolarHBondContact O-CB 3.41Å; R14-A17 PolarHBondContact O-N 3.5Å; I15-A17 VanDerWaalsContact C-N 3.27Å; I15-A17 PolarHBondContact O-N 3.04Å; A17-S20 PolarHBondContact O-N 2.83Å; A17-C21 PolarHBondContact O-N 3.46Å; A17-C21 VanDerWaalsContact O-N 3.16Å; A17-C21 PolarHBondContact O-SG 3.11Å
18	V	94.6	Very high	92.4	Very high	4 Å²	4	62.8 Å²	62.8	2%	0.024	39%	0.386	C	S	.	.	H	α-helix	trans	-62.9	-48.1	175	178.2	0	0	0	0	110.8	R14 I15 S20 C21 F22 L29 L36 F56	R14-V18 PolarHBondContact O-N 3.09Å; I15-V18 WeakPolarHBondContact O-CB 3.48Å; I15-V18 PolarHBondContact O-N 3.4Å; I15-V18 VanDerWaalsContact O-N 3.09Å; V18-S20 VanDerWaalsContact C-N 3.34Å; V18-S20 PolarHBondContact O-N 3.15Å; V18-C21 WeakPolarHBondContact O-CB 3.49Å; V18-C21 PolarHBondContact O-N 3.2Å; V18-C21 VanDerWaalsContact O-N 3.15Å; V18-F22 HydrophobicContact CG1-CD2 4.29Å; V18-F22 HydrophobicContact CG1-CE2 4.02Å; V18-F22 WeakPolarHBondContact O-CD2 3.36Å; V18-F22 PolarHBondContact O-N 3.3Å; V18-L29 HydrophobicContact CB-CD1 4.36Å; V18-L29 HydrophobicContact CG1-CD1 3.66Å; V18-L36 HydrophobicContact CG2-CD2 3.88Å; V18-F56 HydrophobicContact CB-CD1 4.49Å; V18-F56 HydrophobicContact CB-CE1 4.41Å; V18-F56 HydrophobicContact CG1-CD1 3.95Å; V18-F56 HydrophobicContact CG1-CD2 3.83Å; V18-F56 HydrophobicContact CG1-CE1 3.97Å; V18-F56 HydrophobicContact CG1-CE2 3.84Å; V18-F56 HydrophobicContact CG1-CG 3.89Å; V18-F56 HydrophobicContact CG1-CZ 3.92Å; V18-F56 HydrophobicContact CG2-CD1 3.64Å; V18-F56 HydrophobicContact CG2-CE1 3.66Å; V18-F56 HydrophobicContact CG2-CG 4.33Å; V18-F56 HydrophobicContact CG2-CZ 4.34Å
19	E	95.3	Very high	92.8	Very high	51 Å²	51	61 Å²	61	24%	0.238	38%	0.375	C	S	.	.	H	α-helix	trans	-57.3	-46.1	177.3	-68.4	175	160.9	0	0	111.8	I15 A16 C21 F22 G23 P28 L29 A30	I15-E19 PolarHBondContact O-N 3.35Å; A16-E19 PolarHBondContact O-N 3.33Å; E19-C21 PolarHBondContact O-N 3.46Å; E19-F22 PolarHBondContact O-N 3.14Å; E19-G23 PolarHBondContact O-N 2.88Å; E19-P28 WeakPolarHBondContact OE1-CA 3.38Å; E19-L29 HydrophobicContact CG-CB 4.02Å; E19-L29 HydrophobicContact CG-CD1 4.34Å; E19-L29 HydrophobicContact CG-CG 4.13Å; E19-L29 WeakPolarHBondContact OE1-CA 3.47Å; E19-L29 PolarHBondContact OE1-N 3.41Å; E19-A30 PolarHBondContact OE1-N 3.41Å
20	S	93.3	Very high	93.1	Very high	92 Å²	92	57.8 Å²	57.8	64%	0.643	37%	0.37	S	S	*	.	H	α-helix	trans	-57.8	-36.5	177.5	-176	0	0	0	0	112.5	A16 A17 V18 F22 G23	A16-S20 WeakPolarHBondContact O-CB 3.28Å; A16-S20 PolarHBondContact O-N 3.38Å; A17-S20 PolarHBondContact O-N 2.83Å; V18-S20 VanDerWaalsContact C-N 3.34Å; V18-S20 PolarHBondContact O-N 3.15Å; S20-F22 VanDerWaalsContact C-N 3.31Å; S20-F22 PolarHBondContact O-N 3.16Å; S20-G23 PolarHBondContact O-N 3.42Å; S20-G23 VanDerWaalsContact O-N 3.15Å
21	C	93.4	Very high	93.2	Very high	33 Å²	33	57 Å²	57	22%	0.223	37%	0.367	C	S	.	.	H	α-helix	trans	-65.4	-31.8	176.2	-64	0	0	0	0	112.9	A17 V18 E19 K73 Y74	A17-C21 PolarHBondContact O-N 3.46Å; A17-C21 VanDerWaalsContact O-N 3.16Å; A17-C21 PolarHBondContact O-SG 3.11Å; V18-C21 WeakPolarHBondContact O-CB 3.49Å; V18-C21 PolarHBondContact O-N 3.2Å; V18-C21 VanDerWaalsContact O-N 3.15Å; E19-C21 PolarHBondContact O-N 3.46Å; C21-K73 CarbonylContact O-C 3.58Å; C21-K73 WeakPolarHBondContact O-CA 3.36Å; C21-Y74 HydrophobicContact CB-CD2 3.29Å; C21-Y74 HydrophobicContact CB-CE2 3.34Å; C21-Y74 HydrophobicContact CB-CG 4.28Å; C21-Y74 PolarHBondContact O-N 3.16Å
22	F	93.6	Very high	93.2	Very high	5 Å²	5	62.7 Å²	62.7	2%	0.022	40%	0.404	C	S	.	.	H	α-helix	trans	-82.2	-22.9	172.7	-72.5	-79.7	0	0	0	113	V18 E19 S20 S25 F56 V63 Y74 Q77	V18-F22 HydrophobicContact CG1-CD2 4.29Å; V18-F22 HydrophobicContact CG1-CE2 4.02Å; V18-F22 WeakPolarHBondContact O-CD2 3.36Å; V18-F22 PolarHBondContact O-N 3.3Å; E19-F22 PolarHBondContact O-N 3.14Å; S20-F22 VanDerWaalsContact C-N 3.31Å; S20-F22 PolarHBondContact O-N 3.16Å; F22-S25 PolarHBondContact O-OG 2.77Å; F22-F56 HydrophobicContact CE2-CD2 4.24Å; F22-F56 AromaticContact CE2-CE2 3.78Å; F22-F56 HydrophobicContact CE2-CE2 3.78Å; F22-F56 HydrophobicContact CZ-CE2 4.08Å; F22-V63 HydrophobicContact CE2-CG1 4.23Å; F22-V63 HydrophobicContact CZ-CG1 4.22Å; F22-Y74 HydrophobicContact CD2-CD2 4.45Å; F22-Y74 VanDerWaalsContact CE1-CB 3.42Å; F22-Y74 HydrophobicContact CE1-CG 4.44Å; F22-Y74 HydrophobicContact CE2-CD2 4.16Å; F22-Y74 HydrophobicContact CZ-CD2 4.27Å; F22-Y74 HydrophobicContact CZ-CG 4.42Å; F22-Q77 HydrophobicContact CD1-CB 3.6Å; F22-Q77 HydrophobicContact CD1-CG 3.88Å; F22-Q77 HydrophobicContact CD2-CG 4.28Å; F22-Q77 HydrophobicContact CE1-CB 3.61Å; F22-Q77 HydrophobicContact CE1-CG 3.72Å; F22-Q77 HydrophobicContact CE2-CG 4.15Å; F22-Q77 HydrophobicContact CG-CB 4.24Å; F22-Q77 HydrophobicContact CG-CG 4.16Å; F22-Q77 HydrophobicContact CZ-CB 4.29Å; F22-Q77 HydrophobicContact CZ-CG 3.87Å
23	G	89.4	Confident	93.1	Very high	39 Å²	39	61.3 Å²	61.3	40%	0.402	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	57.9	-152	179.9	0	0	0	0	0	112.5	E19 S20 S25 G26	E19-G23 PolarHBondContact O-N 2.88Å; S20-G23 PolarHBondContact O-N 3.42Å; S20-G23 VanDerWaalsContact O-N 3.15Å; G23-S25 PolarHBondContact O-N 2.94Å; G23-G26 PolarHBondContact O-N 3.02Å
24	A	87.4	Confident	93.2	Very high	118 Å²	118	57 Å²	57	98%	0.975	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-62.5	-10.3	-177.6	0	0	0	0	0	115.1
25	S	85.6	Confident	93.2	Very high	81 Å²	81	52.9 Å²	52.9	57%	0.566	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-89.6	-9.5	176.2	71.3	0	0	0	0	113.7	F22 G23	F22-S25 PolarHBondContact O-OG 2.77Å; G23-S25 PolarHBondContact O-N 2.94Å
26	G	90.4	Very high	93.2	Very high	20 Å²	20	52.8 Å²	52.8	21%	0.206	36%	0.361	C	S	.	.	S	Bend	trans	-90.5	160	176.9	0	0	0	0	0	112.8	G23	G23-G26 PolarHBondContact O-N 3.02Å
27	Q	94.8	Very high	93.1	Very high	129 Å²	129	52.6 Å²	52.6	60%	0.603	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-90.2	147.5	166.3	-62.6	-72.4	-37.1	0	0	109.4	Q77 I79	Q27-Q77 PolarHBondContact O-NE2 3.02Å; Q27-I79 HydrophobicContact CB-CD1 3.9Å; Q27-I79 HydrophobicContact CG-CD1 4.5Å
28	P	95.8	Very high	93	Very high	102 Å²	102	50.2 Å²	50.2	66%	0.662	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-57	137.5	170.2	-23.2	33.9	0	0	0	111.8	E19	E19-P28 WeakPolarHBondContact OE1-CA 3.38Å
29	L	96.6	Very high	93	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	36%	0.361	C	S	.	.			trans	-109.3	-23	177.5	-59.7	179.2	0	0	0	111.6	I15 V18 E19 L31 R34 F58 I61 V63 I79	I15-L29 HydrophobicContact CG2-CB 3.87Å; V18-L29 HydrophobicContact CB-CD1 4.36Å; V18-L29 HydrophobicContact CG1-CD1 3.66Å; E19-L29 HydrophobicContact CG-CB 4.02Å; E19-L29 HydrophobicContact CG-CD1 4.34Å; E19-L29 HydrophobicContact CG-CG 4.13Å; E19-L29 WeakPolarHBondContact OE1-CA 3.47Å; E19-L29 PolarHBondContact OE1-N 3.41Å; L29-L31 PolarHBondContact O-N 2.69Å; L29-R34 WeakPolarHBondContact O-CD 3.5Å; L29-R34 PolarHBondContact O-NH1 2.88Å; L29-F58 HydrophobicContact CB-CZ 4.35Å; L29-F58 HydrophobicContact CD1-CE2 4.12Å; L29-F58 HydrophobicContact CD1-CZ 3.79Å; L29-I61 HydrophobicContact CD2-CD1 4.02Å; L29-V63 HydrophobicContact CD1-CG2 4.44Å; L29-V63 HydrophobicContact CD2-CG2 3.96Å; L29-I79 HydrophobicContact CD2-CD1 3.6Å; L29-I79 HydrophobicContact CD2-CG1 4.1Å
30	A	94.9	Very high	92.9	Very high	60 Å²	60	54.2 Å²	54.2	50%	0.496	36%	0.358	S	S	.	.			trans	-63.8	117.2	179.7	0	0	0	0	0	112	I15 E19	I15-A30 HydrophobicContact CG2-CB 4.19Å; E19-A30 PolarHBondContact OE1-N 3.41Å
31	L	94.2	Very high	93.1	Very high	96 Å²	96	53.3 Å²	53.3	50%	0.503	35%	0.349	S	S	.	.			trans	-138.1	148.4	170.7	-69.8	-176.5	0	0	0	109.9	L29 G33 R34	L29-L31 PolarHBondContact O-N 2.69Å; L31-G33 PolarHBondContact O-N 3.28Å; L31-R34 HydrophobicContact CB-CB 4.18Å; L31-R34 VanDerWaalsContact CD1-NH2 3.33Å; L31-R34 WeakPolarHBondContact O-CB 3.39Å; L31-R34 PolarHBondContact O-N 2.93Å; L31-R34 VanDerWaalsContact O-N 3.1Å
32	P	91.6	Very high	93.2	Very high	123 Å²	123	51.8 Å²	51.8	80%	0.799	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	134	171.8	-24.8	34.5	0	0	0	111.4	R34	P32-R34 PolarHBondContact O-N 3.39Å
33	G	91.6	Very high	93.3	Very high	29 Å²	29	54.1 Å²	54.1	30%	0.299	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.7	-10.6	-179.2	0	0	0	0	0	115.8	N7 L31 N59	N7-G33 PolarHBondContact OD1-N 3.15Å; L31-G33 PolarHBondContact O-N 3.28Å; G33-N59 PolarHBondContact O-ND2 3.1Å
34	R	94.9	Very high	93.6	Very high	23 Å²	23	52.9 Å²	52.9	9%	0.087	34%	0.337	C	S	.	.			trans	-79.8	132.7	177.3	-177.8	173.8	-73.3	159.5	-2.2	111.2	N11 I15 L29 L31 P32 F58 N59 D60 I61	N11-R34 PolarHBondContact ND2-O 2.77Å; I15-R34 HydrophobicContact CD1-CG 4.49Å; I15-R34 WeakPolarHBondContact CD1-O 3.44Å; L29-R34 WeakPolarHBondContact O-CD 3.5Å; L29-R34 PolarHBondContact O-NH1 2.88Å; L31-R34 HydrophobicContact CB-CB 4.18Å; L31-R34 VanDerWaalsContact CD1-NH2 3.33Å; L31-R34 WeakPolarHBondContact O-CB 3.39Å; L31-R34 PolarHBondContact O-N 2.93Å; L31-R34 VanDerWaalsContact O-N 3.1Å; P32-R34 PolarHBondContact O-N 3.39Å; R34-F58 HydrophobicContact CG-CB 4.1Å; R34-F58 HydrophobicContact CG-CD1 3.58Å; R34-F58 HydrophobicContact CG-CE1 4.37Å; R34-F58 HydrophobicContact CG-CG 4.18Å; R34-N59 WeakPolarHBondContact CA-OD1 3.16Å; R34-D60 WeakPolarHBondContact CG-OD1 3.42Å; R34-D60 IonicContact CZ-OD1 3.72Å; R34-D60 IonicContact CZ-OD2 3.42Å; R34-D60 VanDerWaalsContact CZ-OD2 3.25Å; R34-D60 VanDerWaalsContact NE-CG 3.31Å; R34-D60 IonicContact NE-OD1 2.84Å; R34-D60 PolarHBondContact NE-OD1 2.84Å; R34-D60 IonicContact NE-OD2 3.03Å; R34-D60 PolarHBondContact NE-OD2 3.13Å; R34-D60 IonicContact NH2-OD1 3.78Å; R34-D60 IonicContact NH2-OD2 2.69Å; R34-D60 PolarHBondContact NH2-OD2 2.86Å; R34-I61 VanDerWaalsContact CZ-CD1 3.42Å
35	V	94.9	Very high	93.9	Very high	0 Å²	0	50 Å²	50	0%	0	30%	0.303	C	S	.	.			trans	-127.8	132.6	-178	-177.1	0	0	0	0	110.2	V2 L5 V6 N11 L37 F58 N59	V2-V35 HydrophobicContact CG1-CB 3.98Å; V2-V35 HydrophobicContact CG1-CG1 3.97Å; V2-V35 HydrophobicContact CG1-CG2 4.14Å; L5-V35 HydrophobicContact CB-CG1 3.87Å; L5-V35 HydrophobicContact CD1-CG1 4.37Å; V6-V35 HydrophobicContact CB-CG2 4.28Å; V6-V35 HydrophobicContact CG2-CG2 3.56Å; N11-V35 WeakPolarHBondContact OD1-CA 3.35Å; V35-L37 HydrophobicContact CB-CD2 4.28Å; V35-L37 HydrophobicContact CG1-CD2 3.87Å; V35-F58 WeakPolarHBondContact O-CA 3.45Å; V35-N59 PolarHBondContact N-OD1 3.39Å; V35-N59 PolarHBondContact O-N 2.87Å; V35-N59 VanDerWaalsContact O-N 3.13Å
36	L	95.6	Very high	94.1	Very high	3 Å²	3	47.9 Å²	47.9	2%	0.016	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	117.7	170.5	-179.4	66.8	0	0	0	109.8	N11 R14 I15 V18 F56 F58	N11-L36 PolarHBondContact OD1-N 2.78Å; N11-L36 VanDerWaalsContact OD1-N 3.08Å; R14-L36 HydrophobicContact CB-CD2 4.04Å; R14-L36 PolarHBondContact NH1-O 3.42Å; R14-L36 PolarHBondContact NH2-O 3.14Å; R14-L36 VanDerWaalsContact NH2-O 3.14Å; I15-L36 HydrophobicContact CG1-CB 4.35Å; V18-L36 HydrophobicContact CG2-CD2 3.88Å; L36-F56 HydrophobicContact CD1-CB 3.99Å; L36-F56 HydrophobicContact CD1-CD1 4.36Å; L36-F58 HydrophobicContact CB-CD1 4.16Å; L36-F58 HydrophobicContact CB-CE1 3.97Å; L36-F58 HydrophobicContact CD1-CD1 4.24Å; L36-F58 HydrophobicContact CD1-CD2 4.3Å; L36-F58 HydrophobicContact CD1-CE1 3.93Å; L36-F58 HydrophobicContact CD1-CE2 3.95Å; L36-F58 HydrophobicContact CD1-CG 4.45Å; L36-F58 HydrophobicContact CD1-CZ 3.76Å
37	L	93.8	Very high	93.9	Very high	42 Å²	42	51.1 Å²	51.1	22%	0.22	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	-38.1	-173.2	-58	179.3	0	0	0	113	V2 V35 L57 N59 C129	V2-L37 HydrophobicContact CB-CD2 4.28Å; V2-L37 HydrophobicContact CG1-CD2 3.49Å; V2-L37 VanDerWaalsContact CG1-CD2 3.49Å; V2-L37 HydrophobicContact CG2-CD2 3.77Å; V35-L37 HydrophobicContact CB-CD2 4.28Å; V35-L37 HydrophobicContact CG1-CD2 3.87Å; L37-L57 WeakPolarHBondContact CA-O 3.24Å; L37-L57 HydrophobicContact CB-CD2 4.49Å; L37-L57 HydrophobicContact CB-CG 4.3Å; L37-L57 WeakPolarHBondContact CB-O 3.19Å; L37-L57 HydrophobicContact CD1-CG 4.42Å; L37-L57 PolarHBondContact N-O 3.25Å; L37-N59 HydrophobicContact CD1-CB 4.01Å; L37-C129 WeakPolarHBondContact CD1-SG 3.17Å
38	G	90.9	Very high	93.4	Very high	5 Å²	5	51.5 Å²	51.5	5%	0.052	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	156.3	-177.5	0	0	0	0	0	112.1	F56 L57	G38-F56 CarbonylContact O-C 3.59Å; G38-F56 WeakPolarHBondContact O-CA 3.45Å; G38-L57 PolarHBondContact N-O 2.86Å; G38-L57 PolarHBondContact O-N 3.25Å
39	E	94.9	Very high	93.1	Very high	120 Å²	120	53 Å²	53	56%	0.561	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.3	151.4	173.5	67	-179.4	173.6	0	0	110	F55 F56	E39-F55 VanDerWaalsContact CA-O 3.28Å; E39-F55 WeakPolarHBondContact CA-O 3.28Å; E39-F56 HydrophobicContact CB-CD1 3.62Å; E39-F56 HydrophobicContact CB-CE1 3.91Å; E39-F56 WeakPolarHBondContact OE2-CE1 3.32Å
40	G	94.3	Very high	92.9	Very high	18 Å²	18	55.8 Å²	55.8	19%	0.186	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.2	172.1	179.5	0	0	0	0	0	113	F55	G40-F55 PolarHBondContact N-O 2.97Å; G40-F55 PolarHBondContact O-N 3.21Å
41	V	95.8	Very high	92.8	Very high	73 Å²	73	55 Å²	55	44%	0.442	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	118.7	178.4	177.7	0	0	0	0	109.2	P52 R53 I67	V41-P52 HydrophobicContact CG1-CB 3.81Å; V41-R53 WeakPolarHBondContact CA-O 3.3Å; V41-I67 HydrophobicContact CG1-CD1 3.95Å; V41-I67 HydrophobicContact CG2-CD1 3.94Å
42	L	96.9	Very high	92.9	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.005	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	148.3	172.4	-56.9	176	0	0	0	110.2	K44 R53 F55 W100 V111 A113 W122	L42-K44 PolarHBondContact O-N 2.8Å; L42-R53 PolarHBondContact N-O 3.35Å; L42-R53 PolarHBondContact O-N 3.08Å; L42-F55 HydrophobicContact CB-CD2 3.68Å; L42-F55 HydrophobicContact CB-CE2 3.65Å; L42-F55 HydrophobicContact CD1-CB 4.49Å; L42-F55 HydrophobicContact CD1-CD1 4.39Å; L42-F55 HydrophobicContact CD1-CD2 3.85Å; L42-F55 HydrophobicContact CD1-CE2 4.12Å; L42-F55 HydrophobicContact CD1-CG 4Å; L42-F55 HydrophobicContact CG-CD2 3.87Å; L42-F55 HydrophobicContact CG-CE2 4.26Å; L42-F55 HydrophobicContact CG-CG 4.38Å; L42-W100 HydrophobicContact CD1-CH2 3.64Å; L42-W100 HydrophobicContact CD1-CZ2 3.6Å; L42-W100 HydrophobicContact CD2-CH2 3.71Å; L42-W100 HydrophobicContact CG-CH2 4.29Å; L42-V111 HydrophobicContact CB-CB 4.27Å; L42-V111 HydrophobicContact CD1-CB 4.37Å; L42-V111 HydrophobicContact CD1-CG2 4.16Å; L42-A113 HydrophobicContact CD2-CB 4.05Å; L42-W122 HydrophobicContact CD1-CD2 4.26Å; L42-W122 HydrophobicContact CD1-CG 4.45Å; L42-W122 HydrophobicContact CD2-CG 4.49Å
43	T	96.3	Very high	93.1	Very high	54 Å²	54	49.1 Å²	49.1	33%	0.331	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	111.1	173.8	-68	0	0	0	0	108.9	A50 V111 S112	T43-A50 HydrophobicContact CG2-CB 3.63Å; T43-V111 CarbonylContact O-C 3.51Å; T43-V111 VanDerWaalsContact O-CA 3.25Å; T43-V111 WeakPolarHBondContact O-CA 3.23Å; T43-S112 WeakPolarHBondContact CB-OG 3.42Å; T43-S112 PolarHBondContact N-O 3.08Å; T43-S112 PolarHBondContact O-N 2.78Å
44	K	95.5	Very high	93.3	Very high	14 Å²	14	48 Å²	48	6%	0.061	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	123.9	179.4	-173.8	-173.6	174.7	-56.7	0	110.4	L42 C46 A50 K51 R53 Y64 F109 V111	L42-K44 PolarHBondContact O-N 2.8Å; K44-C46 PolarHBondContact O-N 2.98Å; K44-C46 PolarHBondContact O-SG 3.2Å; K44-A50 WeakPolarHBondContact O-CA 3.41Å; K44-K51 PolarHBondContact N-O 3.19Å; K44-K51 PolarHBondContact O-N 2.99Å; K44-R53 HydrophobicContact CB-CG 3.79Å; K44-R53 HydrophobicContact CD-CG 4.28Å; K44-Y64 HydrophobicContact CD-CE2 4.27Å; K44-F109 HydrophobicContact CD-CD2 4.02Å; K44-F109 HydrophobicContact CD-CE2 4.47Å; K44-F109 HydrophobicContact CD-CG 4.41Å; K44-F109 HydrophobicContact CG-CD2 3.97Å; K44-V111 HydrophobicContact CB-CG1 4.26Å; K44-V111 HydrophobicContact CG-CG1 4.26Å
45	E	92.9	Very high	93.4	Very high	56 Å²	56	46.9 Å²	46.9	26%	0.262	24%	0.244	S	C	.	.			trans	-66.4	121.9	169.3	-63.4	-172.4	-162.2	0	0	109.3	V110	E45-V110 HydrophobicContact CB-CB 4.05Å; E45-V110 VanDerWaalsContact CD-CG1 3.47Å; E45-V110 HydrophobicContact CG-CB 4.05Å; E45-V110 HydrophobicContact CG-CG1 3.99Å; E45-V110 PolarHBondContact N-O 2.93Å; E45-V110 VanDerWaalsContact OE1-CG1 3.29Å; E45-V110 WeakPolarHBondContact OE1-CG1 3.49Å
46	C	89.6	Confident	93.6	Very high	37 Å²	37	47 Å²	47	25%	0.25	25%	0.245	C	C	.	.			trans	-119.4	162.8	173.9	-53.1	0	0	0	0	109	K44 K48 K49	K44-C46 PolarHBondContact O-N 2.98Å; K44-C46 PolarHBondContact O-SG 3.2Å; C46-K48 VanDerWaalsContact C-N 3.26Å; C46-K48 PolarHBondContact O-N 3.05Å; C46-K48 VanDerWaalsContact O-N 3.09Å; C46-K49 VanDerWaalsContact CB-O 3.26Å; C46-K49 WeakPolarHBondContact CB-O 3.35Å
47	R	85.6	Confident	93.7	Very high	89 Å²	89	46.9 Å²	46.9	34%	0.336	24%	0.244	S	C	.	.	S	Bend	trans	-45.5	-46.7	-176	-71.5	-170.4	-78.6	-169.5	2.8	114.5	W149 D152 H174	R47-W149 HydrophobicContact CG-CE3 3.72Å; R47-W149 HydrophobicContact CG-CZ3 4.32Å; R47-D152 PolarHBondContact O-N 3.32Å; R47-H174 WeakPolarHBondContact CD-CE1 3.21Å
48	K	85.6	Confident	93.9	Very high	137 Å²	137	44.9 Å²	44.9	60%	0.596	23%	0.233	S	C	*	.	S	Bend	trans	-92.9	-51.1	-174.7	-63	-178.2	-179.8	174.4	0	113.1	C46	C46-K48 VanDerWaalsContact C-N 3.26Å; C46-K48 PolarHBondContact O-N 3.05Å; C46-K48 VanDerWaalsContact O-N 3.09Å
49	K	88.8	Confident	94	Very high	132 Å²	132	46.2 Å²	46.2	57%	0.574	24%	0.239	S	C	*	.	S	Bend	trans	-148.4	145.9	-176.6	66.1	-179.3	-178.2	-178.8	0	110.9	C46 K51	C46-K49 VanDerWaalsContact CB-O 3.26Å; C46-K49 WeakPolarHBondContact CB-O 3.35Å; K49-K51 HydrophobicContact CG-CD 4.5Å; K49-K51 HydrophobicContact CG-CG 3.95Å
50	A	91.9	Very high	94.1	Very high	60 Å²	60	42.2 Å²	42.2	50%	0.496	22%	0.222	S	C	.	.			trans	-62.3	139.3	167.4	0	0	0	0	0	109.3	T43 K44	T43-A50 HydrophobicContact CG2-CB 3.63Å; K44-A50 WeakPolarHBondContact O-CA 3.41Å
51	K	93.7	Very high	94.2	Very high	44 Å²	44	41.8 Å²	41.8	19%	0.191	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	138.2	179.9	-63.2	-176.3	177.3	179.8	0	109.3	K44 K49 D253	K44-K51 PolarHBondContact N-O 3.19Å; K44-K51 PolarHBondContact O-N 2.99Å; K49-K51 HydrophobicContact CG-CD 4.5Å; K49-K51 HydrophobicContact CG-CG 3.95Å; K51-D253 IonicContact NZ-OD1 3.46Å; K51-D253 PolarHBondContact NZ-OD1 2.71Å; K51-D253 IonicContact NZ-OD2 2.9Å
52	P	94.8	Very high	94.3	Very high	60 Å²	60	38.3 Å²	38.3	39%	0.39	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	143.2	174.2	28.1	-34.6	0	0	0	110.6	V41 I67	V41-P52 HydrophobicContact CG1-CB 3.81Å; P52-I67 HydrophobicContact CB-CD1 4.31Å
53	R	95.8	Very high	94.4	Very high	35 Å²	35	38.2 Å²	38.2	13%	0.132	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	139.4	178.4	-67.2	-66.1	178.7	-96	8.6	108.1	V41 L42 K44 F55 G65 S66	V41-R53 WeakPolarHBondContact CA-O 3.3Å; L42-R53 PolarHBondContact N-O 3.35Å; L42-R53 PolarHBondContact O-N 3.08Å; K44-R53 HydrophobicContact CB-CG 3.79Å; K44-R53 HydrophobicContact CD-CG 4.28Å; R53-F55 HydrophobicContact CB-CD2 4.16Å; R53-F55 HydrophobicContact CB-CE2 3.58Å; R53-F55 HydrophobicContact CB-CZ 4.37Å; R53-F55 WeakPolarHBondContact O-CD2 3.37Å; R53-G65 WeakPolarHBondContact CA-O 3.28Å; R53-G65 WeakPolarHBondContact CD-O 3.39Å; R53-S66 PolarHBondContact NE-OG 2.95Å
54	V	96	Very high	94.4	Very high	5 Å²	5	36 Å²	36	3%	0.03	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	137.8	170.3	66.7	0	0	0	0	108.4	F56 Y64 G65 I67 Y74	V54-F56 HydrophobicContact CB-CE2 4.26Å; V54-F56 HydrophobicContact CB-CZ 4.43Å; V54-F56 HydrophobicContact CG1-CE2 3.72Å; V54-F56 HydrophobicContact CG1-CZ 4.2Å; V54-F56 HydrophobicContact CG2-CD2 4.39Å; V54-F56 HydrophobicContact CG2-CE1 4.09Å; V54-F56 HydrophobicContact CG2-CE2 3.58Å; V54-F56 HydrophobicContact CG2-CZ 3.39Å; V54-Y64 CarbonylContact O-C 3.59Å; V54-Y64 WeakPolarHBondContact O-CA 3.15Å; V54-Y64 VanDerWaalsContact O-CB 3.3Å; V54-Y64 WeakPolarHBondContact O-CB 3.34Å; V54-G65 PolarHBondContact N-O 3.04Å; V54-G65 VanDerWaalsContact N-O 3.14Å; V54-G65 PolarHBondContact O-N 3.48Å; V54-I67 HydrophobicContact CB-CD1 4.43Å; V54-I67 HydrophobicContact CB-CG1 4.17Å; V54-I67 HydrophobicContact CG1-CG1 4.49Å; V54-Y74 HydrophobicContact CB-CD1 4.3Å; V54-Y74 HydrophobicContact CB-CE1 4.01Å; V54-Y74 HydrophobicContact CG1-CD1 3.55Å; V54-Y74 HydrophobicContact CG1-CD2 3.8Å; V54-Y74 HydrophobicContact CG1-CE1 3.74Å; V54-Y74 HydrophobicContact CG1-CE2 4.01Å; V54-Y74 HydrophobicContact CG1-CG 3.59Å; V54-Y74 HydrophobicContact CG2-CE1 4.31Å; V54-Y74 HydrophobicContact CG2-CE2 4.22Å
55	F	97.9	Very high	94.4	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	142.6	175.6	-75.7	-100.5	0	0	0	109.5	E39 G40 L42 R53 L62 V63 Y64 I102 F109 V111 W122	E39-F55 VanDerWaalsContact CA-O 3.28Å; E39-F55 WeakPolarHBondContact CA-O 3.28Å; G40-F55 PolarHBondContact N-O 2.97Å; G40-F55 PolarHBondContact O-N 3.21Å; L42-F55 HydrophobicContact CB-CD2 3.68Å; L42-F55 HydrophobicContact CB-CE2 3.65Å; L42-F55 HydrophobicContact CD1-CB 4.49Å; L42-F55 HydrophobicContact CD1-CD1 4.39Å; L42-F55 HydrophobicContact CD1-CD2 3.85Å; L42-F55 HydrophobicContact CD1-CE2 4.12Å; L42-F55 HydrophobicContact CD1-CG 4Å; L42-F55 HydrophobicContact CG-CD2 3.87Å; L42-F55 HydrophobicContact CG-CE2 4.26Å; L42-F55 HydrophobicContact CG-CG 4.38Å; R53-F55 HydrophobicContact CB-CD2 4.16Å; R53-F55 HydrophobicContact CB-CE2 3.58Å; R53-F55 HydrophobicContact CB-CZ 4.37Å; R53-F55 WeakPolarHBondContact O-CD2 3.37Å; F55-L62 HydrophobicContact CD1-CD1 4.22Å; F55-L62 HydrophobicContact CD1-CD2 4.35Å; F55-L62 HydrophobicContact CD1-CG 4.37Å; F55-V63 CarbonylContact C-O 3.55Å; F55-V63 WeakPolarHBondContact CA-O 3.3Å; F55-Y64 VanDerWaalsContact CD1-CB 3.43Å; F55-Y64 HydrophobicContact CD1-CG 4.23Å; F55-Y64 VanDerWaalsContact CE1-CB 3.43Å; F55-Y64 HydrophobicContact CE1-CD1 4.04Å; F55-Y64 HydrophobicContact CE1-CD2 4.38Å; F55-Y64 AromaticContact CE1-CG 3.72Å; F55-Y64 HydrophobicContact CE1-CG 3.72Å; F55-Y64 HydrophobicContact CZ-CD2 4.18Å; F55-Y64 AromaticContact CZ-CG 3.97Å; F55-Y64 HydrophobicContact CZ-CG 3.97Å; F55-I102 HydrophobicContact CE1-CD1 4.36Å; F55-F109 HydrophobicContact CE1-CE2 4.04Å; F55-F109 HydrophobicContact CE1-CZ 4.29Å; F55-F109 AromaticContact CZ-CE2 3.96Å; F55-F109 HydrophobicContact CZ-CE2 3.96Å; F55-V111 HydrophobicContact CE2-CG1 4.28Å; F55-V111 HydrophobicContact CZ-CG1 3.79Å; F55-W122 HydrophobicContact CB-CH2 3.64Å; F55-W122 HydrophobicContact CB-CZ2 4.16Å; F55-W122 HydrophobicContact CB-CZ3 4.15Å
56	F	97.9	Very high	94.5	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.009	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	121.8	174.5	-54.5	-85.3	0	0	0	108.1	V18 F22 L36 G38 E39 V54 F58 V63 Y74	V18-F56 HydrophobicContact CB-CD1 4.49Å; V18-F56 HydrophobicContact CB-CE1 4.41Å; V18-F56 HydrophobicContact CG1-CD1 3.95Å; V18-F56 HydrophobicContact CG1-CD2 3.83Å; V18-F56 HydrophobicContact CG1-CE1 3.97Å; V18-F56 HydrophobicContact CG1-CE2 3.84Å; V18-F56 HydrophobicContact CG1-CG 3.89Å; V18-F56 HydrophobicContact CG1-CZ 3.92Å; V18-F56 HydrophobicContact CG2-CD1 3.64Å; V18-F56 HydrophobicContact CG2-CE1 3.66Å; V18-F56 HydrophobicContact CG2-CG 4.33Å; V18-F56 HydrophobicContact CG2-CZ 4.34Å; F22-F56 HydrophobicContact CE2-CD2 4.24Å; F22-F56 AromaticContact CE2-CE2 3.78Å; F22-F56 HydrophobicContact CE2-CE2 3.78Å; F22-F56 HydrophobicContact CZ-CE2 4.08Å; L36-F56 HydrophobicContact CD1-CB 3.99Å; L36-F56 HydrophobicContact CD1-CD1 4.36Å; G38-F56 CarbonylContact O-C 3.59Å; G38-F56 WeakPolarHBondContact O-CA 3.45Å; E39-F56 HydrophobicContact CB-CD1 3.62Å; E39-F56 HydrophobicContact CB-CE1 3.91Å; E39-F56 WeakPolarHBondContact OE2-CE1 3.32Å; V54-F56 HydrophobicContact CB-CE2 4.26Å; V54-F56 HydrophobicContact CB-CZ 4.43Å; V54-F56 HydrophobicContact CG1-CE2 3.72Å; V54-F56 HydrophobicContact CG1-CZ 4.2Å; V54-F56 HydrophobicContact CG2-CD2 4.39Å; V54-F56 HydrophobicContact CG2-CE1 4.09Å; V54-F56 HydrophobicContact CG2-CE2 3.58Å; V54-F56 HydrophobicContact CG2-CZ 3.39Å; F56-F58 HydrophobicContact CB-CD2 4.39Å; F56-F58 HydrophobicContact CB-CE2 3.77Å; F56-V63 HydrophobicContact CB-CB 4.27Å; F56-V63 HydrophobicContact CD2-CB 4.47Å; F56-V63 HydrophobicContact CD2-CG1 4.45Å; F56-V63 PolarHBondContact N-O 2.85Å; F56-V63 PolarHBondContact O-N 3.28Å; F56-Y74 HydrophobicContact CE2-CD2 4.16Å; F56-Y74 HydrophobicContact CE2-CE2 4.15Å; F56-Y74 HydrophobicContact CZ-CD2 4.05Å; F56-Y74 AromaticContact CZ-CE2 3.59Å; F56-Y74 HydrophobicContact CZ-CE2 3.59Å
57	L	98.2	Very high	94.6	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	120.1	173.9	-179.2	59.9	0	0	0	109.2	L37 G38 L62 L82 W122 H125 I126	L37-L57 WeakPolarHBondContact CA-O 3.24Å; L37-L57 HydrophobicContact CB-CD2 4.49Å; L37-L57 HydrophobicContact CB-CG 4.3Å; L37-L57 WeakPolarHBondContact CB-O 3.19Å; L37-L57 HydrophobicContact CD1-CG 4.42Å; L37-L57 PolarHBondContact N-O 3.25Å; G38-L57 PolarHBondContact N-O 2.86Å; G38-L57 PolarHBondContact O-N 3.25Å; L57-L62 HydrophobicContact CD1-CD1 4.29Å; L57-L82 HydrophobicContact CD1-CD1 4.04Å; L57-L82 HydrophobicContact CD1-CD2 4.2Å; L57-W122 HydrophobicContact CB-CZ3 3.9Å; L57-H125 HydrophobicContact CD2-CB 3.64Å; L57-I126 HydrophobicContact CD1-CG1 3.9Å; L57-I126 HydrophobicContact CD2-CG1 4.11Å
58	F	97.6	Very high	94.7	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	169.3	164.7	-61.1	-100.9	0	0	0	109.5	I15 L29 R34 V35 L36 F56 D60 I61 V63 L82	I15-F58 HydrophobicContact CD1-CE1 4.19Å; I15-F58 HydrophobicContact CG1-CE1 3.94Å; I15-F58 HydrophobicContact CG2-CE1 4.29Å; L29-F58 HydrophobicContact CB-CZ 4.35Å; L29-F58 HydrophobicContact CD1-CE2 4.12Å; L29-F58 HydrophobicContact CD1-CZ 3.79Å; R34-F58 HydrophobicContact CG-CB 4.1Å; R34-F58 HydrophobicContact CG-CD1 3.58Å; R34-F58 HydrophobicContact CG-CE1 4.37Å; R34-F58 HydrophobicContact CG-CG 4.18Å; V35-F58 WeakPolarHBondContact O-CA 3.45Å; L36-F58 HydrophobicContact CB-CD1 4.16Å; L36-F58 HydrophobicContact CB-CE1 3.97Å; L36-F58 HydrophobicContact CD1-CD1 4.24Å; L36-F58 HydrophobicContact CD1-CD2 4.3Å; L36-F58 HydrophobicContact CD1-CE1 3.93Å; L36-F58 HydrophobicContact CD1-CE2 3.95Å; L36-F58 HydrophobicContact CD1-CG 4.45Å; L36-F58 HydrophobicContact CD1-CZ 3.76Å; F56-F58 HydrophobicContact CB-CD2 4.39Å; F56-F58 HydrophobicContact CB-CE2 3.77Å; F58-D60 PolarHBondContact O-N 3.28Å; F58-I61 WeakPolarHBondContact CA-O 3.13Å; F58-I61 HydrophobicContact CB-CG1 3.67Å; F58-I61 WeakPolarHBondContact CB-O 3.39Å; F58-I61 HydrophobicContact CD2-CD1 4.08Å; F58-I61 HydrophobicContact CD2-CG1 3.74Å; F58-I61 HydrophobicContact CG-CD1 4.34Å; F58-I61 HydrophobicContact CG-CG1 3.84Å; F58-I61 PolarHBondContact N-O 3.16Å; F58-V63 HydrophobicContact CD2-CG2 3.92Å; F58-V63 HydrophobicContact CE2-CB 4.23Å; F58-V63 HydrophobicContact CE2-CG2 3.7Å; F58-L82 WeakPolarHBondContact O-CD1 3.35Å
59	N	94.9	Very high	93.8	Very high	33 Å²	33	31.9 Å²	31.9	18%	0.176	17%	0.172	C	C	.	.	S	Bend	trans	-66.8	-17.7	177.5	61.9	-35.3	0	0	0	114.4	G33 R34 V35 L37 Q133	G33-N59 PolarHBondContact O-ND2 3.1Å; R34-N59 WeakPolarHBondContact CA-OD1 3.16Å; V35-N59 PolarHBondContact N-OD1 3.39Å; V35-N59 PolarHBondContact O-N 2.87Å; V35-N59 VanDerWaalsContact O-N 3.13Å; L37-N59 HydrophobicContact CD1-CB 4.01Å; N59-Q133 WeakPolarHBondContact O-CG 3.19Å; N59-Q133 PolarHBondContact O-NE2 3.39Å
60	D	95.6	Very high	92.3	Very high	37 Å²	37	29.7 Å²	29.7	20%	0.198	17%	0.174	C	C	.	.	S	Bend	trans	-127.1	-20.4	-176.7	67.2	-31.1	0	0	0	114.1	R34 F58 L82	R34-D60 WeakPolarHBondContact CG-OD1 3.42Å; R34-D60 IonicContact CZ-OD1 3.72Å; R34-D60 IonicContact CZ-OD2 3.42Å; R34-D60 VanDerWaalsContact CZ-OD2 3.25Å; R34-D60 VanDerWaalsContact NE-CG 3.31Å; R34-D60 IonicContact NE-OD1 2.84Å; R34-D60 PolarHBondContact NE-OD1 2.84Å; R34-D60 IonicContact NE-OD2 3.03Å; R34-D60 PolarHBondContact NE-OD2 3.13Å; R34-D60 IonicContact NH2-OD1 3.78Å; R34-D60 IonicContact NH2-OD2 2.69Å; R34-D60 PolarHBondContact NH2-OD2 2.86Å; F58-D60 PolarHBondContact O-N 3.28Å; D60-L82 WeakPolarHBondContact O-CB 3.34Å; D60-L82 PolarHBondContact O-N 3.38Å
61	I	97.5	Very high	90.7	Very high	8 Å²	8	35.4 Å²	35.4	4%	0.041	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	150.1	-179.2	61.1	172.7	0	0	0	112.5	L29 R34 F58 V63 I79 I80	L29-I61 HydrophobicContact CD2-CD1 4.02Å; R34-I61 VanDerWaalsContact CZ-CD1 3.42Å; F58-I61 WeakPolarHBondContact CA-O 3.13Å; F58-I61 HydrophobicContact CB-CG1 3.67Å; F58-I61 WeakPolarHBondContact CB-O 3.39Å; F58-I61 HydrophobicContact CD2-CD1 4.08Å; F58-I61 HydrophobicContact CD2-CG1 3.74Å; F58-I61 HydrophobicContact CG-CD1 4.34Å; F58-I61 HydrophobicContact CG-CG1 3.84Å; F58-I61 PolarHBondContact N-O 3.16Å; I61-V63 HydrophobicContact CD1-CG2 3.64Å; I61-V63 HydrophobicContact CG1-CG2 4.08Å; I61-I79 HydrophobicContact CB-CG2 4.13Å; I61-I79 HydrophobicContact CD1-CG2 3.83Å; I61-I79 HydrophobicContact CG2-CG2 4.08Å; I61-I80 CarbonylContact C-O 3.52Å; I61-I80 VanDerWaalsContact CA-O 3.28Å; I61-I80 WeakPolarHBondContact CA-O 3.49Å
62	L	98.1	Very high	89.6	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	125.6	162.7	-177.5	68.1	0	0	0	108.9	F55 L57 I80 L82 I102 W122	F55-L62 HydrophobicContact CD1-CD1 4.22Å; F55-L62 HydrophobicContact CD1-CD2 4.35Å; F55-L62 HydrophobicContact CD1-CG 4.37Å; L57-L62 HydrophobicContact CD1-CD1 4.29Å; L62-I80 HydrophobicContact CB-CB 4.45Å; L62-I80 PolarHBondContact N-O 2.9Å; L62-I80 PolarHBondContact O-N 2.76Å; L62-L82 HydrophobicContact CB-CD2 3.84Å; L62-I102 HydrophobicContact CD2-CD1 4.01Å; L62-I102 HydrophobicContact CD2-CG2 4.43Å; L62-W122 HydrophobicContact CD1-CZ3 4.24Å
63	V	98	Very high	89.3	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	137	177.9	-175.3	0	0	0	0	109.8	F22 L29 F55 F56 F58 I61 Q77 H78 I79	F22-V63 HydrophobicContact CE2-CG1 4.23Å; F22-V63 HydrophobicContact CZ-CG1 4.22Å; L29-V63 HydrophobicContact CD1-CG2 4.44Å; L29-V63 HydrophobicContact CD2-CG2 3.96Å; F55-V63 CarbonylContact C-O 3.55Å; F55-V63 WeakPolarHBondContact CA-O 3.3Å; F56-V63 HydrophobicContact CB-CB 4.27Å; F56-V63 HydrophobicContact CD2-CB 4.47Å; F56-V63 HydrophobicContact CD2-CG1 4.45Å; F56-V63 PolarHBondContact N-O 2.85Å; F56-V63 PolarHBondContact O-N 3.28Å; F58-V63 HydrophobicContact CD2-CG2 3.92Å; F58-V63 HydrophobicContact CE2-CB 4.23Å; F58-V63 HydrophobicContact CE2-CG2 3.7Å; I61-V63 HydrophobicContact CD1-CG2 3.64Å; I61-V63 HydrophobicContact CG1-CG2 4.08Å; V63-Q77 HydrophobicContact CG1-CG 3.81Å; V63-H78 CarbonylContact C-O 3.52Å; V63-H78 VanDerWaalsContact CA-O 3.24Å; V63-H78 WeakPolarHBondContact CA-O 3.39Å; V63-I79 HydrophobicContact CG1-CG1 4.37Å; V63-I79 HydrophobicContact CG2-CG1 4.15Å; V63-I79 HydrophobicContact CG2-CG2 4.47Å
64	Y	97.4	Very high	89.2	Confident	7 Å²	7	42.9 Å²	42.9	3%	0.027	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	157.6	171	77.6	-84.9	0	0	0	113.2	K44 V54 F55 H78 I80 F109	K44-Y64 HydrophobicContact CD-CE2 4.27Å; V54-Y64 CarbonylContact O-C 3.59Å; V54-Y64 WeakPolarHBondContact O-CA 3.15Å; V54-Y64 VanDerWaalsContact O-CB 3.3Å; V54-Y64 WeakPolarHBondContact O-CB 3.34Å; F55-Y64 VanDerWaalsContact CD1-CB 3.43Å; F55-Y64 HydrophobicContact CD1-CG 4.23Å; F55-Y64 VanDerWaalsContact CE1-CB 3.43Å; F55-Y64 HydrophobicContact CE1-CD1 4.04Å; F55-Y64 HydrophobicContact CE1-CD2 4.38Å; F55-Y64 AromaticContact CE1-CG 3.72Å; F55-Y64 HydrophobicContact CE1-CG 3.72Å; F55-Y64 HydrophobicContact CZ-CD2 4.18Å; F55-Y64 AromaticContact CZ-CG 3.97Å; F55-Y64 HydrophobicContact CZ-CG 3.97Å; Y64-H78 HydrophobicContact CD1-CB 3.59Å; Y64-H78 HydrophobicContact CD2-CB 4.44Å; Y64-H78 AromaticContact CD2-CD2 3.96Å; Y64-H78 HydrophobicContact CE1-CB 3.24Å; Y64-H78 AromaticContact CE1-CG 3.74Å; Y64-H78 HydrophobicContact CE2-CB 4.17Å; Y64-H78 AromaticContact CE2-CD2 3.32Å; Y64-H78 WeakPolarHBondContact CE2-CD2 3.44Å; Y64-H78 AromaticContact CE2-CG 3.93Å; Y64-H78 HydrophobicContact CG-CB 4.18Å; Y64-H78 AromaticContact CZ-CD2 3.35Å; Y64-H78 AromaticContact CZ-CG 3.49Å; Y64-H78 VanDerWaalsContact CZ-CG 3.49Å; Y64-H78 PolarHBondContact N-O 2.85Å; Y64-H78 PolarHBondContact O-N 3.14Å; Y64-I80 HydrophobicContact CD1-CD1 4.05Å; Y64-I80 HydrophobicContact CE1-CD1 3.71Å; Y64-F109 HydrophobicContact CD1-CZ 4.26Å; Y64-F109 HydrophobicContact CE1-CE1 4.01Å; Y64-F109 AromaticContact CE1-CZ 3.81Å; Y64-F109 HydrophobicContact CE1-CZ 3.81Å
65	G	95.4	Very high	89	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	160.4	-174.4	0	0	0	0	0	114	R53 V54	R53-G65 WeakPolarHBondContact CA-O 3.28Å; R53-G65 WeakPolarHBondContact CD-O 3.39Å; V54-G65 PolarHBondContact N-O 3.04Å; V54-G65 VanDerWaalsContact N-O 3.14Å; V54-G65 PolarHBondContact O-N 3.48Å
66	S	93.8	Very high	88.8	Confident	18 Å²	18	56.1 Å²	56.1	13%	0.126	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	130.7	170.9	-57.7	0	0	0	0	110.2	R53 Y74 R75	R53-S66 PolarHBondContact NE-OG 2.95Å; S66-Y74 VanDerWaalsContact O-CA 3.3Å; S66-Y74 WeakPolarHBondContact O-CA 3.24Å; S66-R75 PolarHBondContact N-O 2.82Å; S66-R75 PolarHBondContact O-N 2.79Å
67	I	91.4	Very high	88.7	Confident	49 Å²	49	57.4 Å²	57.4	25%	0.251	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	130.3	177.4	-56.3	172.3	0	0	0	109.2	V41 P52 V54 Y74	V41-I67 HydrophobicContact CG1-CD1 3.95Å; V41-I67 HydrophobicContact CG2-CD1 3.94Å; P52-I67 HydrophobicContact CB-CD1 4.31Å; V54-I67 HydrophobicContact CB-CD1 4.43Å; V54-I67 HydrophobicContact CB-CG1 4.17Å; V54-I67 HydrophobicContact CG1-CG1 4.49Å; I67-Y74 HydrophobicContact CG1-CD1 4.33Å; I67-Y74 HydrophobicContact CG1-CE1 4.26Å
68	V	88.3	Confident	88.6	Confident	40 Å²	40	60.8 Å²	60.8	24%	0.242	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	120.2	171.8	-176.5	0	0	0	0	108.2	S70 K73 R75	V68-S70 PolarHBondContact O-N 2.87Å; V68-K73 WeakPolarHBondContact CB-O 3.38Å; V68-K73 PolarHBondContact N-O 3.23Å; V68-R75 HydrophobicContact CG2-CG 3.86Å
69	L	67.5	Low	88.6	Confident	139 Å²	139	64 Å²	64	73%	0.728	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-29.9	-173	-89	88.6	0	0	0	113.7	K71 W262	L69-K71 PolarHBondContact O-N 3.36Å; L69-W262 HydrophobicContact CD2-CE3 4.44Å; L69-W262 HydrophobicContact CD2-CZ3 3.8Å; L69-W262 HydrophobicContact CG-CH2 4.27Å; L69-W262 HydrophobicContact CG-CZ3 3.78Å
70	S	57.2	Low	88.7	Confident	87 Å²	87	63.2 Å²	63.2	61%	0.608	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	68.2	-170.4	67.9	0	0	0	0	114.1	V68	V68-S70 PolarHBondContact O-N 2.87Å
71	K	56.9	Low	88.7	Confident	180 Å²	180	63.5 Å²	63.5	78%	0.783	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.7	83.8	170	-49.5	162.1	-179.2	-175	0	116.3	L69 K73	L69-K71 PolarHBondContact O-N 3.36Å; K71-K73 WeakPolarHBondContact O-CG 3.29Å; K71-K73 PolarHBondContact O-N 2.87Å
72	R	72.3	Confident	88.5	Confident	121 Å²	121	63.1 Å²	63.1	46%	0.457	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	42.5	31.1	158.8	-50.5	-167.8	-147.6	163.3	-1.6	116.7	F268 Y269	R72-F268 HydrophobicContact CG-CE2 4.35Å; R72-Y269 VanDerWaalsContact NH1-CZ 3.29Å; R72-Y269 PolarHBondContact NH1-OH 2.83Å; R72-Y269 PolarHBondContact NH2-OH 3.42Å
73	K	88	Confident	88.2	Confident	133 Å²	133	66.8 Å²	66.8	58%	0.578	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.2	138.8	-178.6	-81.7	-175.2	-179.7	-171.8	0	109	C21 V68 K71	C21-K73 CarbonylContact O-C 3.58Å; C21-K73 WeakPolarHBondContact O-CA 3.36Å; V68-K73 WeakPolarHBondContact CB-O 3.38Å; V68-K73 PolarHBondContact N-O 3.23Å; K71-K73 WeakPolarHBondContact O-CG 3.29Å; K71-K73 PolarHBondContact O-N 2.87Å
74	Y	92.6	Very high	87.8	Confident	42 Å²	42	69.5 Å²	69.5	17%	0.165	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	149.8	179.6	-50.1	-45.4	0	0	0	109.9	C21 F22 V54 F56 S66 I67	C21-Y74 HydrophobicContact CB-CD2 3.29Å; C21-Y74 HydrophobicContact CB-CE2 3.34Å; C21-Y74 HydrophobicContact CB-CG 4.28Å; C21-Y74 PolarHBondContact O-N 3.16Å; F22-Y74 HydrophobicContact CD2-CD2 4.45Å; F22-Y74 VanDerWaalsContact CE1-CB 3.42Å; F22-Y74 HydrophobicContact CE1-CG 4.44Å; F22-Y74 HydrophobicContact CE2-CD2 4.16Å; F22-Y74 HydrophobicContact CZ-CD2 4.27Å; F22-Y74 HydrophobicContact CZ-CG 4.42Å; V54-Y74 HydrophobicContact CB-CD1 4.3Å; V54-Y74 HydrophobicContact CB-CE1 4.01Å; V54-Y74 HydrophobicContact CG1-CD1 3.55Å; V54-Y74 HydrophobicContact CG1-CD2 3.8Å; V54-Y74 HydrophobicContact CG1-CE1 3.74Å; V54-Y74 HydrophobicContact CG1-CE2 4.01Å; V54-Y74 HydrophobicContact CG1-CG 3.59Å; V54-Y74 HydrophobicContact CG2-CE1 4.31Å; V54-Y74 HydrophobicContact CG2-CE2 4.22Å; F56-Y74 HydrophobicContact CE2-CD2 4.16Å; F56-Y74 HydrophobicContact CE2-CE2 4.15Å; F56-Y74 HydrophobicContact CZ-CD2 4.05Å; F56-Y74 AromaticContact CZ-CE2 3.59Å; F56-Y74 HydrophobicContact CZ-CE2 3.59Å; S66-Y74 VanDerWaalsContact O-CA 3.3Å; S66-Y74 WeakPolarHBondContact O-CA 3.24Å; I67-Y74 HydrophobicContact CG1-CD1 4.33Å; I67-Y74 HydrophobicContact CG1-CE1 4.26Å
75	R	92.9	Very high	87.6	Confident	159 Å²	159	69.4 Å²	69.4	60%	0.6	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.9	166.5	177.2	-65.6	-175.4	-177.6	-166.3	1.9	110.1	S66 V68	S66-R75 PolarHBondContact N-O 2.82Å; S66-R75 PolarHBondContact O-N 2.79Å; V68-R75 HydrophobicContact CG2-CG 3.86Å
76	R	93.4	Very high	87.7	Confident	124 Å²	124	71.8 Å²	71.8	47%	0.468	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	55.4	58.2	-178.6	-53.3	-177	-175.6	-163.2	1.5	110	H78 D251	R76-H78 PolarHBondContact O-CD2 2.68Å; R76-H78 PolarHBondContact O-N 2.86Å; R76-H78 PolarHBondContact O-NE2 2.7Å; R76-D251 IonicContact CZ-OD1 2.83Å; R76-D251 IonicContact NH1-OD1 2.85Å; R76-D251 PolarHBondContact NH1-OD1 3.26Å; R76-D251 IonicContact NH2-OD1 3.87Å
77	Q	96.6	Very high	87.8	Confident	29 Å²	29	72 Å²	72	14%	0.136	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	127.7	177.1	-167.6	-168.3	40.9	0	0	108.9	F22 Q27 V63 I79	F22-Q77 HydrophobicContact CD1-CB 3.6Å; F22-Q77 HydrophobicContact CD1-CG 3.88Å; F22-Q77 HydrophobicContact CD2-CG 4.28Å; F22-Q77 HydrophobicContact CE1-CB 3.61Å; F22-Q77 HydrophobicContact CE1-CG 3.72Å; F22-Q77 HydrophobicContact CE2-CG 4.15Å; F22-Q77 HydrophobicContact CG-CB 4.24Å; F22-Q77 HydrophobicContact CG-CG 4.16Å; F22-Q77 HydrophobicContact CZ-CB 4.29Å; F22-Q77 HydrophobicContact CZ-CG 3.87Å; Q27-Q77 PolarHBondContact O-NE2 3.02Å; V63-Q77 HydrophobicContact CG1-CG 3.81Å; Q77-I79 HydrophobicContact CG-CG1 4.24Å
78	H	96.3	Very high	88	Confident	71 Å²	71	73 Å²	73	33%	0.329	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	123.3	173.4	-66.3	-73.2	0	0	0	107.9	V63 Y64 R76	V63-H78 CarbonylContact C-O 3.52Å; V63-H78 VanDerWaalsContact CA-O 3.24Å; V63-H78 WeakPolarHBondContact CA-O 3.39Å; Y64-H78 HydrophobicContact CD1-CB 3.59Å; Y64-H78 HydrophobicContact CD2-CB 4.44Å; Y64-H78 AromaticContact CD2-CD2 3.96Å; Y64-H78 HydrophobicContact CE1-CB 3.24Å; Y64-H78 AromaticContact CE1-CG 3.74Å; Y64-H78 HydrophobicContact CE2-CB 4.17Å; Y64-H78 AromaticContact CE2-CD2 3.32Å; Y64-H78 WeakPolarHBondContact CE2-CD2 3.44Å; Y64-H78 AromaticContact CE2-CG 3.93Å; Y64-H78 HydrophobicContact CG-CB 4.18Å; Y64-H78 AromaticContact CZ-CD2 3.35Å; Y64-H78 AromaticContact CZ-CG 3.49Å; Y64-H78 VanDerWaalsContact CZ-CG 3.49Å; Y64-H78 PolarHBondContact N-O 2.85Å; Y64-H78 PolarHBondContact O-N 3.14Å; R76-H78 PolarHBondContact O-CD2 2.68Å; R76-H78 PolarHBondContact O-N 2.86Å; R76-H78 PolarHBondContact O-NE2 2.7Å
79	I	97.1	Very high	88.4	Confident	67 Å²	67	75.3 Å²	75.3	34%	0.344	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	124.7	177.4	-58.8	172.8	0	0	0	107.3	Q27 L29 I61 V63 Q77	Q27-I79 HydrophobicContact CB-CD1 3.9Å; Q27-I79 HydrophobicContact CG-CD1 4.5Å; L29-I79 HydrophobicContact CD2-CD1 3.6Å; L29-I79 HydrophobicContact CD2-CG1 4.1Å; I61-I79 HydrophobicContact CB-CG2 4.13Å; I61-I79 HydrophobicContact CD1-CG2 3.83Å; I61-I79 HydrophobicContact CG2-CG2 4.08Å; V63-I79 HydrophobicContact CG1-CG1 4.37Å; V63-I79 HydrophobicContact CG2-CG1 4.15Å; V63-I79 HydrophobicContact CG2-CG2 4.47Å; Q77-I79 HydrophobicContact CG-CG1 4.24Å
80	I	96.4	Very high	89.6	Confident	16 Å²	16	70.3 Å²	70.3	8%	0.082	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	117.6	-177.4	-59.3	163.3	0	0	0	108.1	I61 L62 Y64 L82 V85 T104 F109	I61-I80 CarbonylContact C-O 3.52Å; I61-I80 VanDerWaalsContact CA-O 3.28Å; I61-I80 WeakPolarHBondContact CA-O 3.49Å; L62-I80 HydrophobicContact CB-CB 4.45Å; L62-I80 PolarHBondContact N-O 2.9Å; L62-I80 PolarHBondContact O-N 2.76Å; Y64-I80 HydrophobicContact CD1-CD1 4.05Å; Y64-I80 HydrophobicContact CE1-CD1 3.71Å; I80-L82 PolarHBondContact O-N 3.14Å; I80-V85 HydrophobicContact CG2-CG2 3.55Å; I80-T104 HydrophobicContact CD1-CG2 4.07Å; I80-T104 HydrophobicContact CG2-CG2 3.75Å; I80-F109 HydrophobicContact CD1-CE1 4.18Å; I80-F109 HydrophobicContact CD1-CZ 4.29Å
81	P	95.3	Very high	91.2	Very high	44 Å²	44	70.9 Å²	70.9	29%	0.286	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	131.6	169.3	-21.9	34	0	0	0	111.1	E83 E84	P81-E83 VanDerWaalsContact C-N 3.27Å; P81-E83 HydrophobicContact CB-CG 4.04Å; P81-E83 PolarHBondContact O-N 2.97Å; P81-E84 HydrophobicContact CB-CG 4.34Å; P81-E84 PolarHBondContact O-N 2.79Å; P81-E84 VanDerWaalsContact O-N 3.12Å
82	L	94.8	Very high	92.6	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-66.6	-29.2	-176.8	-73.7	-176.7	0	0	0	112.8	L57 F58 D60 L62 I80 E84 V85 I126 C129 V130	L57-L82 HydrophobicContact CD1-CD1 4.04Å; L57-L82 HydrophobicContact CD1-CD2 4.2Å; F58-L82 WeakPolarHBondContact O-CD1 3.35Å; D60-L82 WeakPolarHBondContact O-CB 3.34Å; D60-L82 PolarHBondContact O-N 3.38Å; L62-L82 HydrophobicContact CB-CD2 3.84Å; I80-L82 PolarHBondContact O-N 3.14Å; L82-E84 PolarHBondContact O-N 3Å; L82-E84 VanDerWaalsContact O-N 3.08Å; L82-V85 HydrophobicContact CD2-CG2 4.19Å; L82-V85 WeakPolarHBondContact O-CB 3.37Å; L82-V85 PolarHBondContact O-N 2.81Å; L82-I126 HydrophobicContact CD2-CG2 4.34Å; L82-C129 HydrophobicContact CD1-CB 3.34Å; L82-V130 HydrophobicContact CB-CG2 4.07Å; L82-V130 HydrophobicContact CD2-CG2 4.48Å; L82-V130 WeakPolarHBondContact O-CG2 3.47Å
83	E	90.3	Very high	93.3	Very high	77 Å²	77	64.2 Å²	64.2	36%	0.36	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-58	-22.4	173.6	61.6	-179.8	-164	0	0	113.7	P81 L134	P81-E83 VanDerWaalsContact C-N 3.27Å; P81-E83 HydrophobicContact CB-CG 4.04Å; P81-E83 PolarHBondContact O-N 2.97Å; E83-L134 HydrophobicContact CB-CD2 4.34Å
84	E	89.5	Confident	93	Very high	57 Å²	57	66.3 Å²	66.3	27%	0.266	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-90.8	-3.3	176.5	-60.8	-177.2	-159.8	0	0	113.7	P81 L82 A105 T142	P81-E84 HydrophobicContact CB-CG 4.34Å; P81-E84 PolarHBondContact O-N 2.79Å; P81-E84 VanDerWaalsContact O-N 3.12Å; L82-E84 PolarHBondContact O-N 3Å; L82-E84 VanDerWaalsContact O-N 3.08Å; E84-A105 WeakPolarHBondContact OE2-CB 3.4Å; E84-T142 WeakPolarHBondContact O-CG2 3.32Å
85	V	94.8	Very high	92.4	Very high	5 Å²	5	73.5 Å²	73.5	3%	0.03	37%	0.368	C	S	.	.			trans	-93.8	130	-172.1	177.1	0	0	0	0	110.9	I80 L82 L87 I102 K103 T104 I126 V130	I80-V85 HydrophobicContact CG2-CG2 3.55Å; L82-V85 HydrophobicContact CD2-CG2 4.19Å; L82-V85 WeakPolarHBondContact O-CB 3.37Å; L82-V85 PolarHBondContact O-N 2.81Å; V85-L87 HydrophobicContact CG1-CD2 3.76Å; V85-L87 HydrophobicContact CG1-CG 4.41Å; V85-I102 HydrophobicContact CG1-CG2 4.05Å; V85-K103 WeakPolarHBondContact CA-O 2.99Å; V85-T104 HydrophobicContact CG2-CG2 4.46Å; V85-I126 HydrophobicContact CG1-CG2 4.01Å; V85-V130 HydrophobicContact CB-CG2 4.28Å
86	T	95.8	Very high	92	Very high	50 Å²	50	67.1 Å²	67.1	31%	0.307	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	137.3	165.1	-58.8	0	0	0	0	109.1	K103 H145	T86-K103 PolarHBondContact N-O 2.85Å; T86-K103 VanDerWaalsContact N-O 3.08Å; T86-K103 WeakPolarHBondContact O-CB 3.48Å; T86-K103 PolarHBondContact O-N 3.36Å; T86-H145 PolarHBondContact OG1-CE1 3Å; T86-H145 PolarHBondContact OG1-NE2 3.27Å
87	L	96.8	Very high	91.9	Very high	21 Å²	21	67.3 Å²	67.3	11%	0.11	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	139.7	179.2	-56.8	-171	0	0	0	110.5	V85 M101 I102 I123 I126 E127	V85-L87 HydrophobicContact CG1-CD2 3.76Å; V85-L87 HydrophobicContact CG1-CG 4.41Å; L87-M101 WeakPolarHBondContact CA-O 3.42Å; L87-I102 HydrophobicContact CD2-CB 4.35Å; L87-I102 HydrophobicContact CD2-CG1 3.89Å; L87-I102 HydrophobicContact CD2-CG2 4.35Å; L87-I123 HydrophobicContact CD1-CB 4.18Å; L87-I123 HydrophobicContact CD1-CG1 4.2Å; L87-I123 HydrophobicContact CD1-CG2 4.01Å; L87-I126 HydrophobicContact CD1-CB 3.87Å; L87-I126 HydrophobicContact CD1-CD1 4.36Å; L87-I126 HydrophobicContact CD1-CG2 3.77Å; L87-I126 HydrophobicContact CD2-CG2 4.18Å; L87-I126 HydrophobicContact CG-CG2 4.12Å; L87-E127 HydrophobicContact CD1-CG 4.06Å
88	E	95.9	Very high	91.9	Very high	72 Å²	72	66.7 Å²	66.7	34%	0.336	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	108.3	174	172.4	178.5	-116.7	0	0	108.7	L90 W100 M101 K103	E88-L90 HydrophobicContact CG-CD2 4.29Å; E88-L90 PolarHBondContact O-N 2.85Å; E88-W100 CarbonylContact O-C 3.4Å; E88-W100 WeakPolarHBondContact O-CA 3.19Å; E88-M101 HydrophobicContact CB-CB 4.23Å; E88-M101 PolarHBondContact N-O 3.35Å; E88-M101 PolarHBondContact O-N 3.15Å; E88-K103 VanDerWaalsContact CD-CE 3.47Å; E88-K103 IonicContact OE1-NZ 2.95Å; E88-K103 PolarHBondContact OE1-NZ 3.44Å; E88-K103 WeakPolarHBondContact OE2-CE 3.42Å; E88-K103 IonicContact OE2-NZ 3.56Å; E88-K103 PolarHBondContact OE2-NZ 2.88Å
89	P	95.4	Very high	91.9	Very high	88 Å²	88	65.3 Å²	65.3	57%	0.571	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.1	138	169.8	-23.3	34.1	0	0	0	110.4
90	L	93.9	Very high	91.9	Very high	33 Å²	33	62.1 Å²	62.1	17%	0.173	33%	0.326	C	S	.	.			trans	-109.5	145.3	178.5	-65.1	178.3	0	0	0	110.7	E88 R99 M101 V110	E88-L90 HydrophobicContact CG-CD2 4.29Å; E88-L90 PolarHBondContact O-N 2.85Å; L90-R99 HydrophobicContact CB-CG 4.12Å; L90-R99 PolarHBondContact N-O 3.06Å; L90-M101 HydrophobicContact CD1-CB 4.34Å; L90-M101 HydrophobicContact CD2-CE 4.46Å; L90-M101 HydrophobicContact CG-CB 4.48Å; L90-V110 HydrophobicContact CD1-CB 4.29Å; L90-V110 HydrophobicContact CD1-CG1 3.64Å; L90-V110 HydrophobicContact CD1-CG2 3.65Å
91	P	89.8	Confident	91.9	Very high	99 Å²	99	62.2 Å²	62.2	64%	0.643	33%	0.326	S	S	*	.			trans	-56.2	143.5	176.6	-24	33	0	0	0	111.9	R99	P91-R99 PolarHBondContact O-NE 3.18Å; P91-R99 PolarHBondContact O-NH2 2.97Å
92	E	88	Confident	92.1	Very high	97 Å²	97	60.2 Å²	60.2	45%	0.453	31%	0.313	S	S	.	.			trans	-77	141.4	172.7	-64.6	-176.7	-167.4	0	0	110.3	R119	E92-R119 IonicContact OE1-CZ 3.05Å; E92-R119 IonicContact OE1-NH1 2.98Å; E92-R119 PolarHBondContact OE1-NH1 2.87Å; E92-R119 IonicContact OE1-NH2 2.62Å; E92-R119 PolarHBondContact OE1-NH2 3.38Å
93	T	85.5	Confident	92.1	Very high	65 Å²	65	62.3 Å²	62.3	40%	0.399	32%	0.322	S	S	.	.			trans	-122.8	168.1	168.8	59.4	0	0	0	0	109.4	E95 A96 R99	T93-E95 PolarHBondContact O-N 2.87Å; T93-A96 PolarHBondContact N-O 2.82Å; T93-A96 CarbonylContact O-C 3.56Å; T93-A96 PolarHBondContact O-N 2.96Å; T93-A96 WeakPolarHBondContact OG1-CB 3.45Å; T93-A96 PolarHBondContact OG1-N 3.06Å; T93-A96 VanDerWaalsContact OG1-N 3.1Å; T93-R99 PolarHBondContact OG1-NH2 3.41Å
94	L	82.4	Confident	92.3	Very high	176 Å²	176	58.9 Å²	58.9	92%	0.921	31%	0.307	S	S	*	.	S	Bend	trans	-55.1	-34.1	174.1	-66	174.4	0	0	0	112.1
95	E	79.9	Confident	92.3	Very high	194 Å²	194	57 Å²	57	91%	0.907	30%	0.301	S	S	*	.	S	Bend	trans	-93.9	-18	-175.6	-62.6	169.8	-179.7	0	0	113.6	T93	T93-E95 PolarHBondContact O-N 2.87Å
96	A	83.6	Confident	92.1	Very high	24 Å²	24	64 Å²	64	20%	0.198	33%	0.331	C	S	.	.			trans	-144.7	110.9	-174.4	0	0	0	0	0	111.9	T93 R99	T93-A96 PolarHBondContact N-O 2.82Å; T93-A96 CarbonylContact O-C 3.56Å; T93-A96 PolarHBondContact O-N 2.96Å; T93-A96 WeakPolarHBondContact OG1-CB 3.45Å; T93-A96 PolarHBondContact OG1-N 3.06Å; T93-A96 VanDerWaalsContact OG1-N 3.1Å; A96-R99 PolarHBondContact O-NE 3.43Å
97	K	92.9	Very high	91.9	Very high	128 Å²	128	66.6 Å²	66.6	56%	0.557	34%	0.338	S	S	*	.			trans	-113.8	166.8	179.9	-61.5	-175.3	-179.6	-177.6	0	110.9	R99	K97-R99 PolarHBondContact O-N 3.12Å; K97-R99 VanDerWaalsContact O-N 3.11Å
98	N	95.6	Very high	91.8	Very high	17 Å²	17	66 Å²	66	9%	0.091	34%	0.336	C	S	.	.	S	Bend	trans	54.4	34.3	169.8	-53.4	-34	0	0	0	114.7	W100 S112 A113 A114 S115 T116 R119	N98-W100 WeakPolarHBondContact O-CZ3 3.44Å; N98-S112 VanDerWaalsContact O-CA 3.27Å; N98-S112 WeakPolarHBondContact O-CA 3.33Å; N98-A113 HydrophobicContact CB-CB 4.4Å; N98-A113 WeakPolarHBondContact CB-O 3.45Å; N98-A113 PolarHBondContact O-N 3.39Å; N98-A114 PolarHBondContact ND2-O 2.89Å; N98-S115 VanDerWaalsContact CG-C 3.45Å; N98-S115 WeakPolarHBondContact ND2-CA 3.48Å; N98-T116 VanDerWaalsContact OD1-CA 3.31Å; N98-T116 WeakPolarHBondContact OD1-CA 3.44Å; N98-T116 PolarHBondContact OD1-N 3.04Å; N98-T116 PolarHBondContact OD1-OG1 3.28Å; N98-R119 HydrophobicContact CB-CB 4.35Å
99	R	95.7	Very high	91.9	Very high	42 Å²	42	63 Å²	63	16%	0.158	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	150.3	-172.7	53.3	169.7	172.3	161.1	2.2	114	L90 P91 T93 A96 K97 V110 V111	L90-R99 HydrophobicContact CB-CG 4.12Å; L90-R99 PolarHBondContact N-O 3.06Å; P91-R99 PolarHBondContact O-NE 3.18Å; P91-R99 PolarHBondContact O-NH2 2.97Å; T93-R99 PolarHBondContact OG1-NH2 3.41Å; A96-R99 PolarHBondContact O-NE 3.43Å; K97-R99 PolarHBondContact O-N 3.12Å; K97-R99 VanDerWaalsContact O-N 3.11Å; R99-V110 HydrophobicContact CB-CG1 4.2Å; R99-V111 CarbonylContact C-O 3.55Å; R99-V111 WeakPolarHBondContact CA-O 3.49Å; R99-V111 WeakPolarHBondContact CB-O 3.34Å
100	W	97.8	Very high	91.9	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	160.2	173.5	70.1	104.9	0	0	0	110.1	L42 E88 N98 V110 V111 A113 R119 W122 I123	L42-W100 HydrophobicContact CD1-CH2 3.64Å; L42-W100 HydrophobicContact CD1-CZ2 3.6Å; L42-W100 HydrophobicContact CD2-CH2 3.71Å; L42-W100 HydrophobicContact CG-CH2 4.29Å; E88-W100 CarbonylContact O-C 3.4Å; E88-W100 WeakPolarHBondContact O-CA 3.19Å; N98-W100 WeakPolarHBondContact O-CZ3 3.44Å; W100-V110 WeakPolarHBondContact O-CA 3.38Å; W100-V111 HydrophobicContact CD2-CG2 3.59Å; W100-V111 HydrophobicContact CE3-CG2 3.96Å; W100-V111 HydrophobicContact CG-CG2 4.23Å; W100-V111 HydrophobicContact CH2-CG2 3.81Å; W100-V111 HydrophobicContact CZ2-CG2 3.38Å; W100-V111 HydrophobicContact CZ3-CG2 4.06Å; W100-V111 PolarHBondContact N-O 2.91Å; W100-V111 PolarHBondContact O-N 3.44Å; W100-A113 HydrophobicContact CH2-CB 4.16Å; W100-A113 HydrophobicContact CZ3-CB 3.83Å; W100-R119 HydrophobicContact CD2-CG 4.47Å; W100-R119 HydrophobicContact CE3-CB 4.36Å; W100-R119 HydrophobicContact CE3-CG 3.66Å; W100-R119 HydrophobicContact CZ3-CB 4.06Å; W100-R119 HydrophobicContact CZ3-CG 3.87Å; W100-W122 HydrophobicContact CH2-CB 4.01Å; W100-W122 HydrophobicContact CH2-CG 4.31Å; W100-W122 HydrophobicContact CZ2-CB 3.83Å; W100-W122 HydrophobicContact CZ2-CG 4.32Å; W100-I123 HydrophobicContact CB-CD1 3.95Å; W100-I123 HydrophobicContact CD2-CD1 4.22Å; W100-I123 HydrophobicContact CD2-CG1 4.13Å; W100-I123 HydrophobicContact CG-CD1 3.95Å; W100-I123 HydrophobicContact CG-CG1 4.01Å
101	M	97.4	Very high	92.1	Very high	18 Å²	18	58 Å²	58	9%	0.089	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	131.3	174.3	-170	176.9	-55.5	0	0	110.3	L87 E88 L90 K103 F109 V110 P148	L87-M101 WeakPolarHBondContact CA-O 3.42Å; E88-M101 HydrophobicContact CB-CB 4.23Å; E88-M101 PolarHBondContact N-O 3.35Å; E88-M101 PolarHBondContact O-N 3.15Å; L90-M101 HydrophobicContact CD1-CB 4.34Å; L90-M101 HydrophobicContact CD2-CE 4.46Å; L90-M101 HydrophobicContact CG-CB 4.48Å; M101-K103 HydrophobicContact CG-CG 4.04Å; M101-K103 HydrophobicContact SD-CG 3.98Å; M101-F109 WeakPolarHBondContact CA-O 3.42Å; M101-V110 HydrophobicContact CB-CG2 4.34Å; M101-V110 HydrophobicContact CE-CG2 3.93Å; M101-V110 HydrophobicContact CG-CG2 4.36Å; M101-P148 HydrophobicContact CE-CB 3.97Å; M101-P148 HydrophobicContact CE-CG 3.72Å; M101-P148 HydrophobicContact SD-CB 3.91Å; M101-P148 HydrophobicContact SD-CG 3.72Å
102	I	97.7	Very high	92.4	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.005	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	111.8	166.1	-57.8	179.1	0	0	0	106.5	F55 L62 V85 L87 T104 S108 F109 V111	F55-I102 HydrophobicContact CE1-CD1 4.36Å; L62-I102 HydrophobicContact CD2-CD1 4.01Å; L62-I102 HydrophobicContact CD2-CG2 4.43Å; V85-I102 HydrophobicContact CG1-CG2 4.05Å; L87-I102 HydrophobicContact CD2-CB 4.35Å; L87-I102 HydrophobicContact CD2-CG1 3.89Å; L87-I102 HydrophobicContact CD2-CG2 4.35Å; I102-T104 HydrophobicContact CG2-CG2 4.12Å; I102-S108 CarbonylContact O-C 3.39Å; I102-S108 VanDerWaalsContact O-CA 3.26Å; I102-S108 WeakPolarHBondContact O-CA 3.4Å; I102-F109 HydrophobicContact CB-CE1 4.5Å; I102-F109 HydrophobicContact CB-CE2 4.13Å; I102-F109 HydrophobicContact CB-CZ 4.1Å; I102-F109 HydrophobicContact CD1-CE2 3.87Å; I102-F109 HydrophobicContact CD1-CZ 4.16Å; I102-F109 HydrophobicContact CG1-CE2 4.39Å; I102-F109 HydrophobicContact CG2-CE1 4.45Å; I102-F109 HydrophobicContact CG2-CZ 4.15Å; I102-F109 PolarHBondContact N-O 2.93Å; I102-F109 PolarHBondContact O-N 3.47Å; I102-V111 HydrophobicContact CD1-CG1 4.43Å; I102-V111 HydrophobicContact CD1-CG2 3.97Å; I102-V111 HydrophobicContact CG1-CG2 4.21Å
103	K	96.3	Very high	92.8	Very high	44 Å²	44	50.3 Å²	50.3	19%	0.191	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	132.7	177.7	-61	179.4	178.2	172.3	0	109.7	V85 T86 E88 M101 S108 H145	V85-K103 WeakPolarHBondContact CA-O 2.99Å; T86-K103 PolarHBondContact N-O 2.85Å; T86-K103 VanDerWaalsContact N-O 3.08Å; T86-K103 WeakPolarHBondContact O-CB 3.48Å; T86-K103 PolarHBondContact O-N 3.36Å; E88-K103 VanDerWaalsContact CD-CE 3.47Å; E88-K103 IonicContact OE1-NZ 2.95Å; E88-K103 PolarHBondContact OE1-NZ 3.44Å; E88-K103 WeakPolarHBondContact OE2-CE 3.42Å; E88-K103 IonicContact OE2-NZ 3.56Å; E88-K103 PolarHBondContact OE2-NZ 2.88Å; M101-K103 HydrophobicContact CG-CG 4.04Å; M101-K103 HydrophobicContact SD-CG 3.98Å; K103-S108 WeakPolarHBondContact CA-OG 3.38Å; K103-H145 HydrophobicContact CB-CB 3.99Å
104	T	94.3	Very high	93.2	Very high	5 Å²	5	51.7 Å²	51.7	3%	0.031	27%	0.269	C	S	.	.			trans	-141.8	165	178.5	76.8	0	0	0	0	110.6	I80 V85 I102 K106 K107 S108 H145 A146	I80-T104 HydrophobicContact CD1-CG2 4.07Å; I80-T104 HydrophobicContact CG2-CG2 3.75Å; V85-T104 HydrophobicContact CG2-CG2 4.46Å; I102-T104 HydrophobicContact CG2-CG2 4.12Å; T104-K106 VanDerWaalsContact C-N 3.3Å; T104-K106 PolarHBondContact O-N 3.1Å; T104-K107 PolarHBondContact OG1-N 3.42Å; T104-K107 PolarHBondContact OG1-O 2.73Å; T104-S108 PolarHBondContact N-OG 2.81Å; T104-H145 WeakPolarHBondContact O-CA 3.26Å; T104-A146 PolarHBondContact O-N 2.75Å
105	A	89.4	Confident	93.8	Very high	18 Å²	18	45.7 Å²	45.7	15%	0.149	24%	0.241	C	C	.	.	S	Bend	trans	-61.3	-37.9	179	0	0	0	0	0	112.8	E84 L196	E84-A105 WeakPolarHBondContact OE2-CB 3.4Å; A105-L196 WeakPolarHBondContact O-CD1 3.29Å
106	K	89.9	Confident	94.5	Very high	151 Å²	151	40 Å²	40	66%	0.657	22%	0.22	S	C	*	.	S	Bend	trans	-95.5	-36.7	-174.4	-66.8	-178.7	-177.7	172.5	0	113.6	T104 A146	T104-K106 VanDerWaalsContact C-N 3.3Å; T104-K106 PolarHBondContact O-N 3.1Å; K106-A146 WeakPolarHBondContact O-CB 3.5Å
107	K	91.9	Very high	95.1	Very high	106 Å²	106	43 Å²	43	46%	0.461	24%	0.236	S	C	.	.			trans	-158.3	110.2	-173.7	-171.1	174.3	-172.9	170.3	0	112.1	T104 F109	T104-K107 PolarHBondContact OG1-N 3.42Å; T104-K107 PolarHBondContact OG1-O 2.73Å; K107-F109 HydrophobicContact CG-CD1 4.34Å; K107-F109 WeakPolarHBondContact O-CD1 3.43Å
108	S	95.4	Very high	95.2	Very high	9 Å²	9	38.8 Å²	38.8	6%	0.063	22%	0.218	C	C	.	.			trans	-88.1	141.9	168.6	-54.3	0	0	0	0	110.7	I102 K103 T104 A146	I102-S108 CarbonylContact O-C 3.39Å; I102-S108 VanDerWaalsContact O-CA 3.26Å; I102-S108 WeakPolarHBondContact O-CA 3.4Å; K103-S108 WeakPolarHBondContact CA-OG 3.38Å; T104-S108 PolarHBondContact N-OG 2.81Å; S108-A146 WeakPolarHBondContact CB-O 2.84Å; S108-A146 PolarHBondContact OG-O 3.02Å
109	F	96.1	Very high	95.3	Very high	8 Å²	8	39.7 Å²	39.7	4%	0.035	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	154	-178	55.4	-88.5	0	0	0	112.2	K44 F55 Y64 I80 M101 I102 K107 V111	K44-F109 HydrophobicContact CD-CD2 4.02Å; K44-F109 HydrophobicContact CD-CE2 4.47Å; K44-F109 HydrophobicContact CD-CG 4.41Å; K44-F109 HydrophobicContact CG-CD2 3.97Å; F55-F109 HydrophobicContact CE1-CE2 4.04Å; F55-F109 HydrophobicContact CE1-CZ 4.29Å; F55-F109 AromaticContact CZ-CE2 3.96Å; F55-F109 HydrophobicContact CZ-CE2 3.96Å; Y64-F109 HydrophobicContact CD1-CZ 4.26Å; Y64-F109 HydrophobicContact CE1-CE1 4.01Å; Y64-F109 AromaticContact CE1-CZ 3.81Å; Y64-F109 HydrophobicContact CE1-CZ 3.81Å; I80-F109 HydrophobicContact CD1-CE1 4.18Å; I80-F109 HydrophobicContact CD1-CZ 4.29Å; M101-F109 WeakPolarHBondContact CA-O 3.42Å; I102-F109 HydrophobicContact CB-CE1 4.5Å; I102-F109 HydrophobicContact CB-CE2 4.13Å; I102-F109 HydrophobicContact CB-CZ 4.1Å; I102-F109 HydrophobicContact CD1-CE2 3.87Å; I102-F109 HydrophobicContact CD1-CZ 4.16Å; I102-F109 HydrophobicContact CG1-CE2 4.39Å; I102-F109 HydrophobicContact CG2-CE1 4.45Å; I102-F109 HydrophobicContact CG2-CZ 4.15Å; I102-F109 PolarHBondContact N-O 2.93Å; I102-F109 PolarHBondContact O-N 3.47Å; K107-F109 HydrophobicContact CG-CD1 4.34Å; K107-F109 WeakPolarHBondContact O-CD1 3.43Å; F109-V111 HydrophobicContact CD2-CG1 3.72Å; F109-V111 HydrophobicContact CE2-CG1 3.71Å
110	V	96.4	Very high	95.3	Very high	17 Å²	17	42.8 Å²	42.8	10%	0.103	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	139.5	175.8	-178.2	0	0	0	0	109.8	E45 L90 R99 W100 M101	E45-V110 HydrophobicContact CB-CB 4.05Å; E45-V110 VanDerWaalsContact CD-CG1 3.47Å; E45-V110 HydrophobicContact CG-CB 4.05Å; E45-V110 HydrophobicContact CG-CG1 3.99Å; E45-V110 PolarHBondContact N-O 2.93Å; E45-V110 VanDerWaalsContact OE1-CG1 3.29Å; E45-V110 WeakPolarHBondContact OE1-CG1 3.49Å; L90-V110 HydrophobicContact CD1-CB 4.29Å; L90-V110 HydrophobicContact CD1-CG1 3.64Å; L90-V110 HydrophobicContact CD1-CG2 3.65Å; R99-V110 HydrophobicContact CB-CG1 4.2Å; W100-V110 WeakPolarHBondContact O-CA 3.38Å; M101-V110 HydrophobicContact CB-CG2 4.34Å; M101-V110 HydrophobicContact CE-CG2 3.93Å; M101-V110 HydrophobicContact CG-CG2 4.36Å
111	V	97.4	Very high	95.2	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	156.8	170.6	-64.8	0	0	0	0	109.8	L42 T43 K44 F55 R99 W100 I102 F109	L42-V111 HydrophobicContact CB-CB 4.27Å; L42-V111 HydrophobicContact CD1-CB 4.37Å; L42-V111 HydrophobicContact CD1-CG2 4.16Å; T43-V111 CarbonylContact O-C 3.51Å; T43-V111 VanDerWaalsContact O-CA 3.25Å; T43-V111 WeakPolarHBondContact O-CA 3.23Å; K44-V111 HydrophobicContact CB-CG1 4.26Å; K44-V111 HydrophobicContact CG-CG1 4.26Å; F55-V111 HydrophobicContact CE2-CG1 4.28Å; F55-V111 HydrophobicContact CZ-CG1 3.79Å; R99-V111 CarbonylContact C-O 3.55Å; R99-V111 WeakPolarHBondContact CA-O 3.49Å; R99-V111 WeakPolarHBondContact CB-O 3.34Å; W100-V111 HydrophobicContact CD2-CG2 3.59Å; W100-V111 HydrophobicContact CE3-CG2 3.96Å; W100-V111 HydrophobicContact CG-CG2 4.23Å; W100-V111 HydrophobicContact CH2-CG2 3.81Å; W100-V111 HydrophobicContact CZ2-CG2 3.38Å; W100-V111 HydrophobicContact CZ3-CG2 4.06Å; W100-V111 PolarHBondContact N-O 2.91Å; W100-V111 PolarHBondContact O-N 3.44Å; I102-V111 HydrophobicContact CD1-CG1 4.43Å; I102-V111 HydrophobicContact CD1-CG2 3.97Å; I102-V111 HydrophobicContact CG1-CG2 4.21Å; F109-V111 HydrophobicContact CD2-CG1 3.72Å; F109-V111 HydrophobicContact CE2-CG1 3.71Å
112	S	97	Very high	95.2	Very high	26 Å²	26	44 Å²	44	18%	0.182	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	142.4	169.7	66.3	0	0	0	0	111.5	T43 N98	T43-S112 WeakPolarHBondContact CB-OG 3.42Å; T43-S112 PolarHBondContact N-O 3.08Å; T43-S112 PolarHBondContact O-N 2.78Å; N98-S112 VanDerWaalsContact O-CA 3.27Å; N98-S112 WeakPolarHBondContact O-CA 3.33Å
113	A	96.8	Very high	95.2	Very high	8 Å²	8	44.3 Å²	44.3	7%	0.066	24%	0.244	C	C	.	.			trans	-91.1	162.6	173.2	0	0	0	0	0	111.2	L42 N98 W100 S115 E118 R119	L42-A113 HydrophobicContact CD2-CB 4.05Å; N98-A113 HydrophobicContact CB-CB 4.4Å; N98-A113 WeakPolarHBondContact CB-O 3.45Å; N98-A113 PolarHBondContact O-N 3.39Å; W100-A113 HydrophobicContact CH2-CB 4.16Å; W100-A113 HydrophobicContact CZ3-CB 3.83Å; A113-S115 VanDerWaalsContact C-N 3.31Å; A113-E118 HydrophobicContact CB-CB 3.97Å; A113-E118 HydrophobicContact CB-CG 3.79Å; A113-E118 WeakPolarHBondContact CB-OE2 3.13Å; A113-R119 HydrophobicContact CB-CB 4.04Å
114	A	93.4	Very high	95.2	Very high	94 Å²	94	44.9 Å²	44.9	78%	0.777	25%	0.253	S	S	*	.	S	Bend	trans	-69.7	-31.6	176.5	0	0	0	0	0	111.8	N98 E118	N98-A114 PolarHBondContact ND2-O 2.89Å; A114-E118 WeakPolarHBondContact CB-OE2 3.42Å; A114-E118 PolarHBondContact N-OE2 2.94Å
115	S	94.8	Very high	95.3	Very high	50 Å²	50	46.3 Å²	46.3	35%	0.35	26%	0.259	S	S	.	.	S	Bend	trans	-132.4	163.4	179.7	74.6	0	0	0	0	113	N98 A113 T117 E118 R119	N98-S115 VanDerWaalsContact CG-C 3.45Å; N98-S115 WeakPolarHBondContact ND2-CA 3.48Å; A113-S115 VanDerWaalsContact C-N 3.31Å; S115-T117 VanDerWaalsContact C-N 3.32Å; S115-E118 WeakPolarHBondContact OG-CB 3.45Å; S115-E118 PolarHBondContact OG-N 3.34Å; S115-R119 PolarHBondContact O-N 3.44Å
116	T	95.2	Very high	95.6	Very high	73 Å²	73	45.5 Å²	45.5	45%	0.448	25%	0.252	S	S	.	.	H	α-helix	trans	-65.7	-37.7	174.5	-53.5	0	0	0	0	111.5	N98 R119 Q120	N98-T116 VanDerWaalsContact OD1-CA 3.31Å; N98-T116 WeakPolarHBondContact OD1-CA 3.44Å; N98-T116 PolarHBondContact OD1-N 3.04Å; N98-T116 PolarHBondContact OD1-OG1 3.28Å; T116-R119 WeakPolarHBondContact O-CB 3.36Å; T116-R119 PolarHBondContact O-N 3.41Å; T116-Q120 WeakPolarHBondContact O-CB 3.27Å; T116-Q120 PolarHBondContact O-N 2.84Å
117	T	95.7	Very high	96	Very high	88 Å²	88	42.8 Å²	42.8	54%	0.54	24%	0.242	S	C	.	.	H	α-helix	trans	-60.5	-52.8	175.1	-52.9	0	0	0	0	110.3	S115 R119 Q120 E121	S115-T117 VanDerWaalsContact C-N 3.32Å; T117-R119 VanDerWaalsContact C-N 3.3Å; T117-R119 PolarHBondContact O-N 3.07Å; T117-Q120 PolarHBondContact O-N 2.73Å; T117-E121 HydrophobicContact CG2-CG 4.34Å; T117-E121 VanDerWaalsContact O-CB 3.31Å; T117-E121 WeakPolarHBondContact O-CB 3.28Å; T117-E121 VanDerWaalsContact O-CG 3.28Å; T117-E121 WeakPolarHBondContact O-CG 3.36Å; T117-E121 PolarHBondContact O-N 3.08Å
118	E	95.8	Very high	96.1	Very high	39 Å²	39	40.4 Å²	40.4	18%	0.182	23%	0.233	C	C	.	.	H	α-helix	trans	-58.7	-41.3	178.4	-179.8	-178.2	-144.4	0	0	111.3	A113 A114 S115 Q120 E121 W122	A113-E118 HydrophobicContact CB-CB 3.97Å; A113-E118 HydrophobicContact CB-CG 3.79Å; A113-E118 WeakPolarHBondContact CB-OE2 3.13Å; A114-E118 WeakPolarHBondContact CB-OE2 3.42Å; A114-E118 PolarHBondContact N-OE2 2.94Å; S115-E118 WeakPolarHBondContact OG-CB 3.45Å; S115-E118 PolarHBondContact OG-N 3.34Å; E118-Q120 PolarHBondContact O-N 2.92Å; E118-E121 PolarHBondContact O-N 3.26Å; E118-W122 PolarHBondContact O-N 3.12Å
119	R	96.3	Very high	96.1	Very high	37 Å²	37	40.5 Å²	40.5	14%	0.14	23%	0.233	C	C	.	.	H	α-helix	trans	-55.9	-52.7	172.4	174.6	-175.7	75.7	-158.7	-4.4	111.3	E92 N98 W100 A113 S115 T116 T117 E121 W122 I123	E92-R119 IonicContact OE1-CZ 3.05Å; E92-R119 IonicContact OE1-NH1 2.98Å; E92-R119 PolarHBondContact OE1-NH1 2.87Å; E92-R119 IonicContact OE1-NH2 2.62Å; E92-R119 PolarHBondContact OE1-NH2 3.38Å; N98-R119 HydrophobicContact CB-CB 4.35Å; W100-R119 HydrophobicContact CD2-CG 4.47Å; W100-R119 HydrophobicContact CE3-CB 4.36Å; W100-R119 HydrophobicContact CE3-CG 3.66Å; W100-R119 HydrophobicContact CZ3-CB 4.06Å; W100-R119 HydrophobicContact CZ3-CG 3.87Å; A113-R119 HydrophobicContact CB-CB 4.04Å; S115-R119 PolarHBondContact O-N 3.44Å; T116-R119 WeakPolarHBondContact O-CB 3.36Å; T116-R119 PolarHBondContact O-N 3.41Å; T117-R119 VanDerWaalsContact C-N 3.3Å; T117-R119 PolarHBondContact O-N 3.07Å; R119-E121 VanDerWaalsContact C-N 3.28Å; R119-E121 PolarHBondContact O-N 2.84Å; R119-W122 PolarHBondContact O-N 2.96Å; R119-I123 HydrophobicContact CG-CD1 3.68Å; R119-I123 HydrophobicContact CG-CG1 4.42Å; R119-I123 WeakPolarHBondContact O-CG1 3.42Å; R119-I123 PolarHBondContact O-N 3.18Å
120	Q	96.3	Very high	96.1	Very high	106 Å²	106	41 Å²	41	50%	0.495	24%	0.237	S	C	.	.	H	α-helix	trans	-63.2	-40.2	-173.2	-174.4	57.5	53.6	0	0	111.4	T116 T117 E118 S124	T116-Q120 WeakPolarHBondContact O-CB 3.27Å; T116-Q120 PolarHBondContact O-N 2.84Å; T117-Q120 PolarHBondContact O-N 2.73Å; E118-Q120 PolarHBondContact O-N 2.92Å; Q120-S124 WeakPolarHBondContact O-CB 3.21Å; Q120-S124 PolarHBondContact O-N 3.26Å
121	E	95.8	Very high	96	Very high	43 Å²	43	45.9 Å²	45.9	20%	0.201	25%	0.253	C	S	.	.	H	α-helix	trans	-62.5	-50.1	176.6	-80.7	177.4	160.4	0	0	112.7	T117 E118 R119 I123 S124 H125 F278	T117-E121 HydrophobicContact CG2-CG 4.34Å; T117-E121 VanDerWaalsContact O-CB 3.31Å; T117-E121 WeakPolarHBondContact O-CB 3.28Å; T117-E121 VanDerWaalsContact O-CG 3.28Å; T117-E121 WeakPolarHBondContact O-CG 3.36Å; T117-E121 PolarHBondContact O-N 3.08Å; E118-E121 PolarHBondContact O-N 3.26Å; R119-E121 VanDerWaalsContact C-N 3.28Å; R119-E121 PolarHBondContact O-N 2.84Å; E121-I123 PolarHBondContact O-N 3.37Å; E121-S124 PolarHBondContact O-N 3.02Å; E121-H125 WeakPolarHBondContact O-CB 3.39Å; E121-H125 PolarHBondContact O-N 3.31Å; E121-F278 HydrophobicContact CB-CB 3.33Å; E121-F278 HydrophobicContact CB-CD1 3.81Å; E121-F278 HydrophobicContact CB-CD2 4.13Å; E121-F278 HydrophobicContact CB-CG 3.54Å; E121-F278 HydrophobicContact CG-CB 3.36Å; E121-F278 HydrophobicContact CG-CG 4.16Å; E121-F278 WeakPolarHBondContact OE2-CB 3.47Å
122	W	97.4	Very high	95.8	Very high	1 Å²	1	50.6 Å²	50.6	0%	0.004	27%	0.271	C	S	.	.	H	α-helix	trans	-59.2	-46.9	175.1	-88.3	102.8	0	0	0	112.3	L42 F55 L57 L62 W100 E118 R119 I126 F278	L42-W122 HydrophobicContact CD1-CD2 4.26Å; L42-W122 HydrophobicContact CD1-CG 4.45Å; L42-W122 HydrophobicContact CD2-CG 4.49Å; F55-W122 HydrophobicContact CB-CH2 3.64Å; F55-W122 HydrophobicContact CB-CZ2 4.16Å; F55-W122 HydrophobicContact CB-CZ3 4.15Å; L57-W122 HydrophobicContact CB-CZ3 3.9Å; L62-W122 HydrophobicContact CD1-CZ3 4.24Å; W100-W122 HydrophobicContact CH2-CB 4.01Å; W100-W122 HydrophobicContact CH2-CG 4.31Å; W100-W122 HydrophobicContact CZ2-CB 3.83Å; W100-W122 HydrophobicContact CZ2-CG 4.32Å; E118-W122 PolarHBondContact O-N 3.12Å; R119-W122 PolarHBondContact O-N 2.96Å; W122-I126 HydrophobicContact CE3-CD1 4.04Å; W122-I126 HydrophobicContact CE3-CG1 4.44Å; W122-I126 WeakPolarHBondContact O-CB 3.36Å; W122-I126 WeakPolarHBondContact O-CD1 3.36Å; W122-I126 WeakPolarHBondContact O-CG1 3.43Å; W122-I126 PolarHBondContact O-N 2.93Å; W122-F278 HydrophobicContact CD2-CE1 4.18Å; W122-F278 HydrophobicContact CD2-CE2 4.34Å; W122-F278 AromaticContact CD2-CZ 3.64Å; W122-F278 HydrophobicContact CD2-CZ 3.64Å; W122-F278 AromaticContact CE2-CE2 3.84Å; W122-F278 AromaticContact CE2-CZ 3.47Å; W122-F278 VanDerWaalsContact CE2-CZ 3.47Å; W122-F278 HydrophobicContact CE3-CE1 4.39Å; W122-F278 HydrophobicContact CE3-CZ 4.05Å; W122-F278 HydrophobicContact CG-CE1 4.41Å; W122-F278 HydrophobicContact CG-CZ 4.08Å; W122-F278 HydrophobicContact CH2-CZ 4.16Å; W122-F278 HydrophobicContact CZ2-CE2 4.18Å; W122-F278 AromaticContact CZ2-CZ 3.75Å; W122-F278 HydrophobicContact CZ2-CZ 3.75Å; W122-F278 HydrophobicContact CZ3-CZ 4.31Å; W122-F278 AromaticContact NE1-CE2 3.72Å; W122-F278 AromaticContact NE1-CZ 3.8Å
123	I	97.3	Very high	95.5	Very high	8 Å²	8	51.3 Å²	51.3	4%	0.041	27%	0.272	C	S	.	.	H	α-helix	trans	-60.9	-52.6	179.5	-69.9	173.7	0	0	0	110	L87 W100 R119 E121 H125 I126 E127	L87-I123 HydrophobicContact CD1-CB 4.18Å; L87-I123 HydrophobicContact CD1-CG1 4.2Å; L87-I123 HydrophobicContact CD1-CG2 4.01Å; W100-I123 HydrophobicContact CB-CD1 3.95Å; W100-I123 HydrophobicContact CD2-CD1 4.22Å; W100-I123 HydrophobicContact CD2-CG1 4.13Å; W100-I123 HydrophobicContact CG-CD1 3.95Å; W100-I123 HydrophobicContact CG-CG1 4.01Å; R119-I123 HydrophobicContact CG-CD1 3.68Å; R119-I123 HydrophobicContact CG-CG1 4.42Å; R119-I123 WeakPolarHBondContact O-CG1 3.42Å; R119-I123 PolarHBondContact O-N 3.18Å; E121-I123 PolarHBondContact O-N 3.37Å; I123-H125 PolarHBondContact O-N 2.94Å; I123-I126 PolarHBondContact O-N 3.38Å; I123-E127 HydrophobicContact CG2-CG 4.38Å; I123-E127 WeakPolarHBondContact O-CB 3.26Å; I123-E127 WeakPolarHBondContact O-CG 3.34Å; I123-E127 PolarHBondContact O-N 3.31Å
124	S	96.6	Very high	95.3	Very high	56 Å²	56	52.2 Å²	52.2	39%	0.392	28%	0.275	S	S	.	.	H	α-helix	trans	-57	-47.4	-178.6	179.6	0	0	0	0	112.1	Q120 E121 E127 E128	Q120-S124 WeakPolarHBondContact O-CB 3.21Å; Q120-S124 PolarHBondContact O-N 3.26Å; E121-S124 PolarHBondContact O-N 3.02Å; S124-E127 PolarHBondContact O-N 3.08Å; S124-E128 WeakPolarHBondContact O-CB 3.38Å; S124-E128 PolarHBondContact O-N 2.92Å
125	H	96	Very high	95.3	Very high	35 Å²	35	53.7 Å²	53.7	16%	0.162	27%	0.27	C	S	.	.	H	α-helix	trans	-70.4	-38.9	-177.9	-76.8	-164.3	0	0	0	112.7	L57 E121 I123 C129 F278 H279	L57-H125 HydrophobicContact CD2-CB 3.64Å; E121-H125 WeakPolarHBondContact O-CB 3.39Å; E121-H125 PolarHBondContact O-N 3.31Å; I123-H125 PolarHBondContact O-N 2.94Å; H125-C129 PolarHBondContact O-N 3.39Å; H125-C129 PolarHBondContact O-SG 3.1Å; H125-F278 HydrophobicContact CB-CD1 4.13Å; H125-F278 HydrophobicContact CB-CE1 4.05Å; H125-F278 AromaticContact CE1-CD1 3.42Å; H125-F278 VanDerWaalsContact CE1-CD1 3.42Å; H125-F278 WeakPolarHBondContact CE1-CD1 3.26Å; H125-F278 AromaticContact CG-CD1 3.58Å; H125-F278 AromaticContact CG-CE1 3.97Å; H125-F278 AromaticContact ND1-CD1 2.99Å; H125-F278 WeakPolarHBondContact ND1-CD1 3.41Å; H125-F278 AromaticContact ND1-CE1 3.48Å; H125-F278 WeakPolarHBondContact ND1-CE1 3.21Å; H125-F278 AromaticContact ND1-CG 3.99Å; H125-H279 AromaticContact CE1-CD2 3.68Å; H125-H279 AromaticContact NE2-CD2 3.42Å; H125-H279 PolarHBondContact NE2-CD2 2.97Å
126	I	97.3	Very high	95	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-62.9	-49.8	174.3	-69.3	166.3	0	0	0	109.5	L57 L82 V85 L87 W122 I123 E128 C129 V130	L57-I126 HydrophobicContact CD1-CG1 3.9Å; L57-I126 HydrophobicContact CD2-CG1 4.11Å; L82-I126 HydrophobicContact CD2-CG2 4.34Å; V85-I126 HydrophobicContact CG1-CG2 4.01Å; L87-I126 HydrophobicContact CD1-CB 3.87Å; L87-I126 HydrophobicContact CD1-CD1 4.36Å; L87-I126 HydrophobicContact CD1-CG2 3.77Å; L87-I126 HydrophobicContact CD2-CG2 4.18Å; L87-I126 HydrophobicContact CG-CG2 4.12Å; W122-I126 HydrophobicContact CE3-CD1 4.04Å; W122-I126 HydrophobicContact CE3-CG1 4.44Å; W122-I126 WeakPolarHBondContact O-CB 3.36Å; W122-I126 WeakPolarHBondContact O-CD1 3.36Å; W122-I126 WeakPolarHBondContact O-CG1 3.43Å; W122-I126 PolarHBondContact O-N 2.93Å; I123-I126 PolarHBondContact O-N 3.38Å; I126-E128 VanDerWaalsContact C-N 3.31Å; I126-E128 PolarHBondContact O-N 2.95Å; I126-C129 PolarHBondContact O-N 2.68Å; I126-C129 VanDerWaalsContact O-N 3.1Å; I126-V130 HydrophobicContact CG2-CG2 4.11Å; I126-V130 VanDerWaalsContact O-CG2 3.27Å; I126-V130 WeakPolarHBondContact O-CG2 3.39Å; I126-V130 PolarHBondContact O-N 3.44Å
127	E	96.4	Very high	94.7	Very high	93 Å²	93	55.3 Å²	55.3	44%	0.435	29%	0.286	S	S	.	.	H	α-helix	trans	-57.7	-42.8	179.7	-75.8	175.6	164.6	0	0	112.3	L87 I123 S124 C129 V130 R131	L87-E127 HydrophobicContact CD1-CG 4.06Å; I123-E127 HydrophobicContact CG2-CG 4.38Å; I123-E127 WeakPolarHBondContact O-CB 3.26Å; I123-E127 WeakPolarHBondContact O-CG 3.34Å; I123-E127 PolarHBondContact O-N 3.31Å; S124-E127 PolarHBondContact O-N 3.08Å; E127-C129 VanDerWaalsContact C-N 3.34Å; E127-C129 PolarHBondContact O-N 3.35Å; E127-V130 PolarHBondContact O-N 2.86Å; E127-R131 VanDerWaalsContact O-CB 3.28Å; E127-R131 WeakPolarHBondContact O-CB 3.42Å; E127-R131 PolarHBondContact O-N 2.71Å
128	E	95.3	Very high	94.4	Very high	57 Å²	57	53.9 Å²	53.9	27%	0.266	29%	0.289	S	S	.	.	H	α-helix	trans	-63.3	-40.2	176.7	175.9	58.6	-172.1	0	0	112.1	S124 I126 R131 R132	S124-E128 WeakPolarHBondContact O-CB 3.38Å; S124-E128 PolarHBondContact O-N 2.92Å; I126-E128 VanDerWaalsContact C-N 3.31Å; I126-E128 PolarHBondContact O-N 2.95Å; E128-R131 IonicContact OE1-CZ 3.58Å; E128-R131 IonicContact OE1-NH2 3.13Å; E128-R131 PolarHBondContact OE1-NH2 3.13Å; E128-R131 IonicContact OE2-CZ 2.9Å; E128-R131 VanDerWaalsContact OE2-CZ 3.22Å; E128-R131 IonicContact OE2-NE 3.3Å; E128-R131 PolarHBondContact OE2-NE 2.87Å; E128-R131 IonicContact OE2-NH2 3.06Å; E128-R131 PolarHBondContact OE2-NH2 2.86Å; E128-R132 WeakPolarHBondContact O-CG 3.49Å; E128-R132 PolarHBondContact O-N 2.97Å; E128-R132 IonicContact OE1-CZ 3.25Å; E128-R132 IonicContact OE1-NE 3.76Å; E128-R132 PolarHBondContact OE1-NE 3.45Å; E128-R132 IonicContact OE1-NH2 2.97Å; E128-R132 PolarHBondContact OE1-NH2 3.34Å
129	C	95.6	Very high	94	Very high	10 Å²	10	54.8 Å²	54.8	7%	0.068	30%	0.299	C	S	.	.	H	α-helix	trans	-67.5	-45.3	176.3	-64.9	0	0	0	0	111.8	L37 L82 H125 I126 E127 R131 R132 Q133	L37-C129 WeakPolarHBondContact CD1-SG 3.17Å; L82-C129 HydrophobicContact CD1-CB 3.34Å; H125-C129 PolarHBondContact O-N 3.39Å; H125-C129 PolarHBondContact O-SG 3.1Å; I126-C129 PolarHBondContact O-N 2.68Å; I126-C129 VanDerWaalsContact O-N 3.1Å; E127-C129 VanDerWaalsContact C-N 3.34Å; E127-C129 PolarHBondContact O-N 3.35Å; C129-R131 VanDerWaalsContact C-N 3.33Å; C129-R131 PolarHBondContact O-N 2.78Å; C129-R132 PolarHBondContact O-N 2.91Å; C129-Q133 WeakPolarHBondContact O-CG 3.25Å; C129-Q133 PolarHBondContact O-N 3.04Å
130	V	95.1	Very high	93.5	Very high	20 Å²	20	60.8 Å²	60.8	12%	0.121	33%	0.328	C	S	.	.	H	α-helix	trans	-56.2	-49.7	174.6	175.7	0	0	0	0	110.1	L82 V85 I126 E127 R132 Q133 L134	L82-V130 HydrophobicContact CB-CG2 4.07Å; L82-V130 HydrophobicContact CD2-CG2 4.48Å; L82-V130 WeakPolarHBondContact O-CG2 3.47Å; V85-V130 HydrophobicContact CB-CG2 4.28Å; I126-V130 HydrophobicContact CG2-CG2 4.11Å; I126-V130 VanDerWaalsContact O-CG2 3.27Å; I126-V130 WeakPolarHBondContact O-CG2 3.39Å; I126-V130 PolarHBondContact O-N 3.44Å; E127-V130 PolarHBondContact O-N 2.86Å; V130-R132 VanDerWaalsContact C-N 3.34Å; V130-R132 PolarHBondContact O-N 3.46Å; V130-Q133 PolarHBondContact O-N 3.06Å; V130-L134 HydrophobicContact CG1-CD1 3.91Å; V130-L134 HydrophobicContact CG1-CG 4.33Å; V130-L134 WeakPolarHBondContact O-CG 3.27Å; V130-L134 PolarHBondContact O-N 2.86Å
131	R	94.6	Very high	92.8	Very high	119 Å²	119	59.1 Å²	59.1	45%	0.449	33%	0.327	S	S	.	.	H	α-helix	trans	-57.1	-45.6	179	-172.8	-169.2	67.5	75.3	-0.1	111.8	E127 E128 C129 L135	E127-R131 VanDerWaalsContact O-CB 3.28Å; E127-R131 WeakPolarHBondContact O-CB 3.42Å; E127-R131 PolarHBondContact O-N 2.71Å; E128-R131 IonicContact OE1-CZ 3.58Å; E128-R131 IonicContact OE1-NH2 3.13Å; E128-R131 PolarHBondContact OE1-NH2 3.13Å; E128-R131 IonicContact OE2-CZ 2.9Å; E128-R131 VanDerWaalsContact OE2-CZ 3.22Å; E128-R131 IonicContact OE2-NE 3.3Å; E128-R131 PolarHBondContact OE2-NE 2.87Å; E128-R131 IonicContact OE2-NH2 3.06Å; E128-R131 PolarHBondContact OE2-NH2 2.86Å; C129-R131 VanDerWaalsContact C-N 3.33Å; C129-R131 PolarHBondContact O-N 2.78Å; R131-L135 HydrophobicContact CG-CD1 4.37Å; R131-L135 WeakPolarHBondContact O-CG 3.48Å; R131-L135 PolarHBondContact O-N 2.95Å; R131-L135 VanDerWaalsContact O-N 3.07Å
132	R	93.1	Very high	92.2	Very high	98 Å²	98	59 Å²	59	37%	0.37	33%	0.329	S	S	.	.	H	α-helix	trans	-65	-40.7	177.6	-74.1	-173.8	-169.8	167.9	13.7	112.5	E128 C129 V130 L135 A136	E128-R132 WeakPolarHBondContact O-CG 3.49Å; E128-R132 PolarHBondContact O-N 2.97Å; E128-R132 IonicContact OE1-CZ 3.25Å; E128-R132 IonicContact OE1-NE 3.76Å; E128-R132 PolarHBondContact OE1-NE 3.45Å; E128-R132 IonicContact OE1-NH2 2.97Å; E128-R132 PolarHBondContact OE1-NH2 3.34Å; C129-R132 PolarHBondContact O-N 2.91Å; V130-R132 VanDerWaalsContact C-N 3.34Å; V130-R132 PolarHBondContact O-N 3.46Å; R132-L135 PolarHBondContact O-N 2.96Å; R132-A136 WeakPolarHBondContact O-CB 3.46Å; R132-A136 PolarHBondContact O-N 2.9Å
133	Q	92	Very high	91.5	Very high	42 Å²	42	65 Å²	65	20%	0.196	37%	0.366	C	S	.	.	H	α-helix	trans	-62.6	-46.3	177.2	-73.2	-61.9	-33.7	0	0	111.8	N59 C129 V130 L135 A136 T137	N59-Q133 WeakPolarHBondContact O-CG 3.19Å; N59-Q133 PolarHBondContact O-NE2 3.39Å; C129-Q133 WeakPolarHBondContact O-CG 3.25Å; C129-Q133 PolarHBondContact O-N 3.04Å; V130-Q133 PolarHBondContact O-N 3.06Å; Q133-L135 VanDerWaalsContact C-N 3.34Å; Q133-L135 PolarHBondContact O-N 2.97Å; Q133-A136 PolarHBondContact O-N 3.04Å; Q133-T137 WeakPolarHBondContact O-CB 3.28Å; Q133-T137 WeakPolarHBondContact O-CG2 3.31Å; Q133-T137 PolarHBondContact O-N 3.47Å; Q133-T137 PolarHBondContact O-OG1 3.01Å
134	L	92	Very high	90.9	Very high	27 Å²	27	69.4 Å²	69.4	14%	0.141	39%	0.387	C	S	.	.	H	α-helix	trans	-63.3	-39.7	178.1	-65	174.8	0	0	0	112	E83 V130 G138 C139 P141	E83-L134 HydrophobicContact CB-CD2 4.34Å; V130-L134 HydrophobicContact CG1-CD1 3.91Å; V130-L134 HydrophobicContact CG1-CG 4.33Å; V130-L134 WeakPolarHBondContact O-CG 3.27Å; V130-L134 PolarHBondContact O-N 2.86Å; L134-G138 WeakPolarHBondContact O-CA 3.49Å; L134-G138 PolarHBondContact O-N 3.44Å; L134-C139 HydrophobicContact CD2-CB 4.13Å; L134-P141 HydrophobicContact CD1-CB 4.2Å; L134-P141 HydrophobicContact CD1-CG 3.81Å
135	L	92.5	Very high	90.7	Very high	125 Å²	125	69.2 Å²	69.2	65%	0.654	38%	0.38	S	S	*	.	H	α-helix	trans	-65.8	-40.4	174.7	-73.5	173.3	0	0	0	112.8	R131 R132 Q133	R131-L135 HydrophobicContact CG-CD1 4.37Å; R131-L135 WeakPolarHBondContact O-CG 3.48Å; R131-L135 PolarHBondContact O-N 2.95Å; R131-L135 VanDerWaalsContact O-N 3.07Å; R132-L135 PolarHBondContact O-N 2.96Å; Q133-L135 VanDerWaalsContact C-N 3.34Å; Q133-L135 PolarHBondContact O-N 2.97Å
136	A	89.8	Confident	90.6	Very high	86 Å²	86	68 Å²	68	71%	0.711	38%	0.375	S	S	*	.	H	α-helix	trans	-72.1	-34.9	-178.3	0	0	0	0	0	112.8	R132 Q133	R132-A136 WeakPolarHBondContact O-CB 3.46Å; R132-A136 PolarHBondContact O-N 2.9Å; Q133-A136 PolarHBondContact O-N 3.04Å
137	T	88.6	Confident	90.4	Very high	70 Å²	70	69.2 Å²	69.2	43%	0.429	39%	0.386	S	S	.	.	H	α-helix	trans	-92.2	-21.4	-177.3	56.3	0	0	0	0	113.4	Q133 C139	Q133-T137 WeakPolarHBondContact O-CB 3.28Å; Q133-T137 WeakPolarHBondContact O-CG2 3.31Å; Q133-T137 PolarHBondContact O-N 3.47Å; Q133-T137 PolarHBondContact O-OG1 3.01Å; T137-C139 PolarHBondContact O-N 3.42Å; T137-C139 WeakPolarHBondContact OG1-CB 3.34Å; T137-C139 PolarHBondContact OG1-N 2.92Å
138	G	89.4	Confident	90.2	Very high	59 Å²	59	66.9 Å²	66.9	61%	0.608	38%	0.379	S	S	*	.			trans	70.9	7.9	-169.5	0	0	0	0	0	113.6	L134	L134-G138 WeakPolarHBondContact O-CA 3.49Å; L134-G138 PolarHBondContact O-N 3.44Å
139	C	86.9	Confident	90.1	Very high	58 Å²	58	68.5 Å²	68.5	39%	0.392	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-68.1	152	177.5	-71.2	0	0	0	0	111.4	L134 T137	L134-C139 HydrophobicContact CD2-CB 4.13Å; T137-C139 PolarHBondContact O-N 3.42Å; T137-C139 WeakPolarHBondContact OG1-CB 3.34Å; T137-C139 PolarHBondContact OG1-N 2.92Å
140	Q	85.1	Confident	89.9	Confident	162 Å²	162	70.4 Å²	70.4	76%	0.757	39%	0.391	S	S	*	.	P	Polyproline II helix	trans	-87.6	146.9	171.6	-66.6	-60.7	-40.2	0	0	110.6	T142	Q140-T142 PolarHBondContact O-N 3.31Å
141	P	83	Confident	89.8	Confident	71 Å²	71	71.7 Å²	71.7	46%	0.461	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-55.4	136.4	171.5	-15.8	23.6	0	0	0	110.9	L134	L134-P141 HydrophobicContact CD1-CB 4.2Å; L134-P141 HydrophobicContact CD1-CG 3.81Å
142	T	83.3	Confident	89.6	Confident	41 Å²	41	67.5 Å²	67.5	25%	0.252	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-65.5	138.6	171.2	178.8	0	0	0	0	110.6	E84 Q140 E144	E84-T142 WeakPolarHBondContact O-CG2 3.32Å; Q140-T142 PolarHBondContact O-N 3.31Å; T142-E144 PolarHBondContact OG1-N 3.31Å; T142-E144 PolarHBondContact OG1-O 3.09Å
143	T	82.4	Confident	89.4	Confident	128 Å²	128	71.3 Å²	71.3	79%	0.785	41%	0.406	S	S	*	.			trans	-110	-5.7	174.9	56.1	0	0	0	0	112.3
144	E	85	Confident	89.4	Confident	99 Å²	99	72.6 Å²	72.6	46%	0.463	42%	0.424	S	S	.	.			trans	-112.1	112.3	-176.8	-66.9	-165.5	140.1	0	0	110.9	T142 R195	T142-E144 PolarHBondContact OG1-N 3.31Å; T142-E144 PolarHBondContact OG1-O 3.09Å; E144-R195 IonicContact OE1-NH2 3.22Å; E144-R195 PolarHBondContact OE1-NH2 3.16Å; E144-R195 VanDerWaalsContact OE1-NH2 3.16Å; E144-R195 IonicContact OE2-CZ 2.75Å; E144-R195 IonicContact OE2-NE 2.86Å; E144-R195 PolarHBondContact OE2-NE 3.4Å; E144-R195 IonicContact OE2-NH1 3.76Å; E144-R195 PolarHBondContact OE2-NH1 3.03Å; E144-R195 IonicContact OE2-NH2 2.73Å; E144-R195 PolarHBondContact OE2-NH2 2.97Å
145	H	91.9	Very high	89.5	Confident	53 Å²	53	72.6 Å²	72.6	25%	0.245	43%	0.425	C	S	.	.			trans	-121.1	154	-180	-51	-75.5	0	0	0	111.6	T86 K103 T104 A147	T86-H145 PolarHBondContact OG1-CE1 3Å; T86-H145 PolarHBondContact OG1-NE2 3.27Å; K103-H145 HydrophobicContact CB-CB 3.99Å; T104-H145 WeakPolarHBondContact O-CA 3.26Å; H145-A147 PolarHBondContact O-N 2.85Å
146	A	92.8	Very high	89.7	Confident	9 Å²	9	70.9 Å²	70.9	7%	0.074	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-62.4	135.7	168.8	0	0	0	0	0	109.8	T104 K106 S108 L196	T104-A146 PolarHBondContact O-N 2.75Å; K106-A146 WeakPolarHBondContact O-CB 3.5Å; S108-A146 WeakPolarHBondContact CB-O 2.84Å; S108-A146 PolarHBondContact OG-O 3.02Å; A146-L196 HydrophobicContact CB-CD1 4.17Å; A146-L196 HydrophobicContact CB-CD2 4.37Å; A146-L196 HydrophobicContact CB-CG 4.31Å
147	A	93.1	Very high	90.1	Very high	27 Å²	27	70.2 Å²	70.2	22%	0.223	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-64.1	132.5	176.5	0	0	0	0	0	110.7	H145 K177	H145-A147 PolarHBondContact O-N 2.85Å; A147-K177 VanDerWaalsContact CB-O 3.31Å; A147-K177 WeakPolarHBondContact CB-O 3.45Å
148	P	92.4	Very high	90.6	Very high	44 Å²	44	66.9 Å²	66.9	29%	0.286	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-63.8	139.9	173.8	30.1	-36.6	0	0	0	109.5	M101	M101-P148 HydrophobicContact CE-CB 3.97Å; M101-P148 HydrophobicContact CE-CG 3.72Å; M101-P148 HydrophobicContact SD-CB 3.91Å; M101-P148 HydrophobicContact SD-CG 3.72Å
149	W	93.4	Very high	91	Very high	90 Å²	90	67 Å²	67	34%	0.341	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-76.5	132.1	176.1	-76	7.9	0	0	0	110.8	R47 H174 R176	R47-W149 HydrophobicContact CG-CE3 3.72Å; R47-W149 HydrophobicContact CG-CZ3 4.32Å; W149-H174 HydrophobicContact CD2-CB 3.79Å; W149-H174 AromaticContact CD2-CG 3.86Å; W149-H174 HydrophobicContact CE3-CB 4.25Å; W149-H174 HydrophobicContact CG-CB 4.16Å; W149-H174 AromaticContact CG-CD2 3.95Å; W149-H174 HydrophobicContact CH2-CB 4.46Å; W149-H174 HydrophobicContact CZ2-CB 4.05Å; W149-R176 HydrophobicContact CZ2-CG 4.15Å
150	I	92	Very high	91.5	Very high	51 Å²	51	67.2 Å²	67.2	26%	0.262	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-67.3	127	173	-58.8	-58	0	0	0	108.6	A154 M159 H174 G179 F180 V181	I150-A154 HydrophobicContact CG2-CB 3.62Å; I150-M159 HydrophobicContact CB-SD 4.33Å; I150-M159 HydrophobicContact CG1-CE 4.3Å; I150-M159 HydrophobicContact CG1-SD 4.24Å; I150-M159 HydrophobicContact CG2-SD 4.1Å; I150-H174 PolarHBondContact O-CD2 3.04Å; I150-H174 PolarHBondContact O-NE2 3.38Å; I150-G179 PolarHBondContact N-O 2.62Å; I150-F180 HydrophobicContact CG1-CD1 4.23Å; I150-V181 HydrophobicContact CB-CG2 3.96Å; I150-V181 HydrophobicContact CG2-CG2 3.98Å
151	P	91.4	Very high	92.1	Very high	46 Å²	46	60.7 Å²	60.7	30%	0.299	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-56.8	146.8	177.9	-25.8	34.8	0	0	0	112.4	K153 A154	P151-K153 PolarHBondContact O-N 2.98Å; P151-K153 VanDerWaalsContact O-N 3.16Å; P151-A154 HydrophobicContact CB-CB 4.5Å; P151-A154 VanDerWaalsContact O-CB 3.27Å; P151-A154 WeakPolarHBondContact O-CB 3.34Å; P151-A154 PolarHBondContact O-N 2.99Å
152	D	91.6	Very high	92.8	Very high	32 Å²	32	61.9 Å²	61.9	17%	0.171	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-61.5	-31.7	-175.2	-70	5.1	0	0	0	112.2	R47 A154 R172 H174	R47-D152 PolarHBondContact O-N 3.32Å; D152-A154 VanDerWaalsContact C-N 3.3Å; D152-R172 PolarHBondContact O-NE 3.18Å; D152-H174 IonicContact OD1-CE1 3.08Å; D152-H174 PolarHBondContact OD1-CE1 2.95Å; D152-H174 IonicContact OD1-NE2 3.07Å; D152-H174 PolarHBondContact OD1-NE2 3.47Å
153	K	89.6	Confident	93.4	Very high	178 Å²	178	67.9 Å²	67.9	77%	0.774	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-77.6	-12.3	179	-62.2	-173.5	179.8	-173.5	0	113.7	P151 T155	P151-K153 PolarHBondContact O-N 2.98Å; P151-K153 VanDerWaalsContact O-N 3.16Å; K153-T155 PolarHBondContact O-N 3.43Å
154	A	90.6	Very high	94.2	Very high	69 Å²	69	63.9 Å²	63.9	57%	0.57	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-73.2	-14.2	179.7	0	0	0	0	0	112.5	I150 P151 D152	I150-A154 HydrophobicContact CG2-CB 3.62Å; P151-A154 HydrophobicContact CB-CB 4.5Å; P151-A154 VanDerWaalsContact O-CB 3.27Å; P151-A154 WeakPolarHBondContact O-CB 3.34Å; P151-A154 PolarHBondContact O-N 2.99Å; D152-A154 VanDerWaalsContact C-N 3.3Å
155	T	94.8	Very high	94.8	Very high	27 Å²	27	67.7 Å²	67.7	17%	0.166	35%	0.347	C	S	.	.			trans	-156.9	144.6	176.2	-169.9	0	0	0	0	113	K153 I157 M159 F166 R172 V181	K153-T155 PolarHBondContact O-N 3.43Å; T155-I157 WeakPolarHBondContact CG2-O 3.36Å; T155-I157 PolarHBondContact OG1-N 3.39Å; T155-I157 PolarHBondContact OG1-O 3.29Å; T155-I157 VanDerWaalsContact OG1-O 3.06Å; T155-M159 HydrophobicContact CG2-CG 3.91Å; T155-M159 HydrophobicContact CG2-SD 4.16Å; T155-F166 HydrophobicContact CG2-CE2 4.49Å; T155-R172 PolarHBondContact O-NE 2.72Å; T155-R172 PolarHBondContact O-NH2 3.05Å; T155-V181 HydrophobicContact CG2-CB 3.8Å; T155-V181 HydrophobicContact CG2-CG1 4.33Å; T155-V181 HydrophobicContact CG2-CG2 3.94Å
156	D	96.8	Very high	95.1	Very high	88 Å²	88	65.7 Å²	65.7	47%	0.471	34%	0.337	S	S	.	.	S	Bend	trans	-100.8	-0.7	172.4	-72.9	-34.9	0	0	0	113.4	R165 F166 R172	D156-R165 CarbonylContact O-C 3.54Å; D156-R165 WeakPolarHBondContact O-CA 3.31Å; D156-R165 WeakPolarHBondContact O-CG 3.45Å; D156-F166 PolarHBondContact O-N 3.16Å; D156-R172 IonicContact OD1-NH2 2.92Å; D156-R172 PolarHBondContact OD1-NH2 3.29Å
157	I	98	Very high	95.2	Very high	72 Å²	72	68.2 Å²	68.2	37%	0.369	35%	0.354	S	S	.	.	B	Isolated β-bridge	trans	-128.4	154.7	-178.9	61.9	171	0	0	0	111.2	T155 M159 T164 R165 F166	T155-I157 WeakPolarHBondContact CG2-O 3.36Å; T155-I157 PolarHBondContact OG1-N 3.39Å; T155-I157 PolarHBondContact OG1-O 3.29Å; T155-I157 VanDerWaalsContact OG1-O 3.06Å; I157-M159 PolarHBondContact O-N 3.5Å; I157-T164 CarbonylContact C-O 3.54Å; I157-T164 VanDerWaalsContact CA-O 3.3Å; I157-T164 WeakPolarHBondContact CA-O 3.43Å; I157-R165 HydrophobicContact CG2-CB 4.39Å; I157-R165 HydrophobicContact CG2-CG 4.36Å; I157-F166 VanDerWaalsContact O-CE2 3.23Å; I157-F166 WeakPolarHBondContact O-CE2 3.13Å
158	C	98.3	Very high	95.2	Very high	0 Å²	0	70.6 Å²	70.6	0%	0	37%	0.374	C	S	.	.			trans	-63.4	124.7	176.7	174.4	0	0	0	0	111.2	R160 C161 T162 T164 F166 C183	C158-R160 PolarHBondContact O-N 2.92Å; C158-R160 PolarHBondContact SG-N 3.47Å; C158-R160 VanDerWaalsContact SG-N 3.41Å; C158-C161 VanDerWaalsContact CB-SG 3.59Å; C158-T162 WeakPolarHBondContact O-CA 3.41Å; C158-T162 PolarHBondContact O-N 3.31Å; C158-T164 PolarHBondContact N-O 3.37Å; C158-F166 HydrophobicContact CB-CZ 3.97Å; C158-C183 HydrophobicContact CB-CB 4.17Å; C158-C183 PolarHBondContact SG-N 3.47Å; C158-C183 VanDerWaalsContact SG-N 3.36Å
159	M	98	Very high	95.2	Very high	61 Å²	61	76.2 Å²	76.2	30%	0.3	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	13.5	179.1	-56.1	177.5	74.3	0	0	114.1	I150 T155 I157 F180 V181	I150-M159 HydrophobicContact CB-SD 4.33Å; I150-M159 HydrophobicContact CG1-CE 4.3Å; I150-M159 HydrophobicContact CG1-SD 4.24Å; I150-M159 HydrophobicContact CG2-SD 4.1Å; T155-M159 HydrophobicContact CG2-CG 3.91Å; T155-M159 HydrophobicContact CG2-SD 4.16Å; I157-M159 PolarHBondContact O-N 3.5Å; M159-F180 HydrophobicContact CB-CB 4.13Å; M159-F180 HydrophobicContact CB-CD2 4.01Å; M159-F180 HydrophobicContact CB-CG 4.21Å; M159-F180 HydrophobicContact CE-CD1 3.85Å; M159-F180 HydrophobicContact CE-CD2 4.41Å; M159-F180 HydrophobicContact CE-CE1 4.04Å; M159-F180 HydrophobicContact CE-CG 4.05Å; M159-F180 HydrophobicContact CE-CZ 4.41Å; M159-F180 HydrophobicContact SD-CB 4.01Å; M159-F180 HydrophobicContact SD-CD1 4.26Å; M159-F180 HydrophobicContact SD-CG 4.11Å; M159-V181 WeakPolarHBondContact CB-O 3.33Å; M159-V181 HydrophobicContact CG-CB 4.44Å; M159-V181 WeakPolarHBondContact CG-O 3.44Å; M159-V181 PolarHBondContact N-O 3.43Å; M159-V181 HydrophobicContact SD-CB 4.15Å; M159-V181 HydrophobicContact SD-CG2 4.19Å; M159-V181 PolarHBondContact SD-N 3.1Å; M159-V181 VanDerWaalsContact SD-N 3.39Å
160	R	97.3	Very high	95.3	Very high	63 Å²	63	74.3 Å²	74.3	24%	0.238	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.7	-59.8	177.2	-70	-66	-175	-160.2	7.8	111.6	C158 C178 V182 C186 C204 L206 C207	C158-R160 PolarHBondContact O-N 2.92Å; C158-R160 PolarHBondContact SG-N 3.47Å; C158-R160 VanDerWaalsContact SG-N 3.41Å; R160-C178 PolarHBondContact NH2-SG 3.01Å; R160-V182 HydrophobicContact CB-CG1 4.31Å; R160-V182 HydrophobicContact CG-CB 4.49Å; R160-V182 HydrophobicContact CG-CG1 3.44Å; R160-V182 VanDerWaalsContact CG-CG1 3.44Å; R160-C186 HydrophobicContact CB-CB 3.72Å; R160-C186 HydrophobicContact CG-CB 4.27Å; R160-C204 HydrophobicContact CG-CB 4.04Å; R160-C204 PolarHBondContact NE-SG 2.99Å; R160-C204 PolarHBondContact NH2-SG 3.18Å; R160-L206 VanDerWaalsContact NH1-CD1 3.32Å; R160-C207 PolarHBondContact NH2-SG 2.94Å
161	C	97.6	Very high	95.5	Very high	26 Å²	26	79.9 Å²	79.9	18%	0.176	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-17.5	177.9	65	0	0	0	0	113.6	C158 Q163 T164	C158-C161 VanDerWaalsContact CB-SG 3.59Å; C161-Q163 HydrophobicContact CB-CB 4.47Å; C161-Q163 VanDerWaalsContact O-CG 3.26Å; C161-Q163 WeakPolarHBondContact O-CG 3.4Å; C161-Q163 PolarHBondContact O-N 3.04Å; C161-Q163 PolarHBondContact O-NE2 3.3Å; C161-T164 PolarHBondContact SG-N 3.34Å; C161-T164 VanDerWaalsContact SG-N 3.42Å; C161-T164 PolarHBondContact SG-OG1 3.31Å
162	T	97.4	Very high	95.8	Very high	96 Å²	96	81.1 Å²	81.1	59%	0.589	42%	0.416	S	S	*	.	S	Bend	trans	53.5	5.7	-173.7	67.1	0	0	0	0	115.6	C158	C158-T162 WeakPolarHBondContact O-CA 3.41Å; C158-T162 PolarHBondContact O-N 3.31Å
163	Q	97.7	Very high	96	Very high	166 Å²	166	82 Å²	82	78%	0.776	42%	0.418	S	S	*	.			trans	-103.1	-39.2	-176.4	-70.9	157.9	61.3	0	0	111.6	C161 R165	C161-Q163 HydrophobicContact CB-CB 4.47Å; C161-Q163 VanDerWaalsContact O-CG 3.26Å; C161-Q163 WeakPolarHBondContact O-CG 3.4Å; C161-Q163 PolarHBondContact O-N 3.04Å; C161-Q163 PolarHBondContact O-NE2 3.3Å; Q163-R165 PolarHBondContact O-N 2.65Å
164	T	98	Very high	96.4	Very high	45 Å²	45	73.6 Å²	73.6	28%	0.276	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-77.3	116.7	-177	-54	0	0	0	0	110.6	I157 C158 C161 T170 C183	I157-T164 CarbonylContact C-O 3.54Å; I157-T164 VanDerWaalsContact CA-O 3.3Å; I157-T164 WeakPolarHBondContact CA-O 3.43Å; C158-T164 PolarHBondContact N-O 3.37Å; C161-T164 PolarHBondContact SG-N 3.34Å; C161-T164 VanDerWaalsContact SG-N 3.42Å; C161-T164 PolarHBondContact SG-OG1 3.31Å; T164-T170 HydrophobicContact CG2-CG2 3.54Å; T164-C183 HydrophobicContact CG2-CB 3.75Å
165	R	98.1	Very high	96.7	Very high	178 Å²	178	70.3 Å²	70.3	67%	0.672	36%	0.355	S	S	*	.	B	Isolated β-bridge	trans	-84.4	135.1	169.1	-165.9	175	-175	141.5	3.2	110.8	D156 I157 Q163 T170	D156-R165 CarbonylContact O-C 3.54Å; D156-R165 WeakPolarHBondContact O-CA 3.31Å; D156-R165 WeakPolarHBondContact O-CG 3.45Å; I157-R165 HydrophobicContact CG2-CB 4.39Å; I157-R165 HydrophobicContact CG2-CG 4.36Å; Q163-R165 PolarHBondContact O-N 2.65Å; R165-T170 WeakPolarHBondContact O-CG2 3.46Å
166	F	97.8	Very high	96.8	Very high	12 Å²	12	72.4 Å²	72.4	5%	0.053	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-78.3	145.9	176.2	-62	-60.1	0	0	0	111.3	T155 D156 I157 C158 T170 R172 V181 C183	T155-F166 HydrophobicContact CG2-CE2 4.49Å; D156-F166 PolarHBondContact O-N 3.16Å; I157-F166 VanDerWaalsContact O-CE2 3.23Å; I157-F166 WeakPolarHBondContact O-CE2 3.13Å; C158-F166 HydrophobicContact CB-CZ 3.97Å; F166-T170 WeakPolarHBondContact CA-O 3.38Å; F166-T170 HydrophobicContact CD1-CG2 4.25Å; F166-R172 HydrophobicContact CB-CG 3.93Å; F166-R172 HydrophobicContact CD1-CB 4.43Å; F166-R172 HydrophobicContact CD1-CG 3.68Å; F166-R172 HydrophobicContact CD2-CG 3.64Å; F166-R172 HydrophobicContact CE1-CB 4.47Å; F166-R172 HydrophobicContact CE1-CG 4.04Å; F166-R172 HydrophobicContact CE2-CG 3.99Å; F166-R172 HydrophobicContact CG-CG 3.47Å; F166-R172 VanDerWaalsContact CG-CG 3.47Å; F166-R172 HydrophobicContact CZ-CG 4.18Å; F166-V181 HydrophobicContact CD2-CG1 4.37Å; F166-V181 HydrophobicContact CE2-CB 4.3Å; F166-V181 HydrophobicContact CE2-CG1 3.55Å; F166-V181 HydrophobicContact CZ-CG1 3.74Å; F166-C183 HydrophobicContact CE1-CB 4.12Å
167	S	95.3	Very high	96.8	Very high	61 Å²	61	72.4 Å²	72.4	43%	0.427	36%	0.356	S	S	.	.			trans	-154.3	-175.2	-179.2	72.4	0	0	0	0	110.3	L169 T170	S167-L169 PolarHBondContact O-N 3.44Å; S167-L169 PolarHBondContact OG-N 3.07Å; S167-T170 PolarHBondContact N-O 2.95Å; S167-T170 CarbonylContact O-C 3.46Å; S167-T170 PolarHBondContact O-N 3.35Å; S167-T170 PolarHBondContact OG-N 3.38Å
168	A	92.1	Very high	96.7	Very high	77 Å²	77	70.4 Å²	70.4	64%	0.636	35%	0.347	S	S	*	.	S	Bend	trans	-59.3	-33.9	173.1	0	0	0	0	0	112.5	R171	A168-R171 VanDerWaalsContact O-CZ 3.28Å; A168-R171 PolarHBondContact O-NE 3.05Å; A168-R171 PolarHBondContact O-NH1 3.3Å
169	L	94.1	Very high	96.6	Very high	163 Å²	163	70.4 Å²	70.4	85%	0.853	35%	0.347	S	S	*	.	S	Bend	trans	-86.6	-38.7	177.3	-61.1	175.7	0	0	0	111.8	S167 R171	S167-L169 PolarHBondContact O-N 3.44Å; S167-L169 PolarHBondContact OG-N 3.07Å; L169-R171 PolarHBondContact O-N 3.42Å
170	T	95.5	Very high	96.5	Very high	50 Å²	50	70.7 Å²	70.7	31%	0.307	35%	0.347	S	S	.	.	S	Bend	trans	-93.1	88	179	-51	0	0	0	0	110.2	T164 R165 F166 S167	T164-T170 HydrophobicContact CG2-CG2 3.54Å; R165-T170 WeakPolarHBondContact O-CG2 3.46Å; F166-T170 WeakPolarHBondContact CA-O 3.38Å; F166-T170 HydrophobicContact CD1-CG2 4.25Å; S167-T170 PolarHBondContact N-O 2.95Å; S167-T170 CarbonylContact O-C 3.46Å; S167-T170 PolarHBondContact O-N 3.35Å; S167-T170 PolarHBondContact OG-N 3.38Å
171	R	95.6	Very high	96.6	Very high	168 Å²	168	67.7 Å²	67.7	63%	0.634	34%	0.336	S	S	*	.			trans	-67.3	150.4	-176.9	-57.9	-58.8	-161.4	177.8	4.3	112.7	A168 L169	A168-R171 VanDerWaalsContact O-CZ 3.28Å; A168-R171 PolarHBondContact O-NE 3.05Å; A168-R171 PolarHBondContact O-NH1 3.3Å; L169-R171 PolarHBondContact O-N 3.42Å
172	R	96.9	Very high	96.6	Very high	72 Å²	72	66.5 Å²	66.5	27%	0.272	33%	0.328	S	S	.	.			trans	-82.8	142.5	172.7	-70.6	174.9	173.1	81.1	-3.6	110.5	D152 T155 D156 F166 V181	D152-R172 PolarHBondContact O-NE 3.18Å; T155-R172 PolarHBondContact O-NE 2.72Å; T155-R172 PolarHBondContact O-NH2 3.05Å; D156-R172 IonicContact OD1-NH2 2.92Å; D156-R172 PolarHBondContact OD1-NH2 3.29Å; F166-R172 HydrophobicContact CB-CG 3.93Å; F166-R172 HydrophobicContact CD1-CB 4.43Å; F166-R172 HydrophobicContact CD1-CG 3.68Å; F166-R172 HydrophobicContact CD2-CG 3.64Å; F166-R172 HydrophobicContact CE1-CB 4.47Å; F166-R172 HydrophobicContact CE1-CG 4.04Å; F166-R172 HydrophobicContact CE2-CG 3.99Å; F166-R172 HydrophobicContact CG-CG 3.47Å; F166-R172 VanDerWaalsContact CG-CG 3.47Å; F166-R172 HydrophobicContact CZ-CG 4.18Å; R172-V181 HydrophobicContact CB-CG1 3.78Å; R172-V181 HydrophobicContact CG-CG1 3.74Å
173	H	97	Very high	96.7	Very high	49 Å²	49	62.1 Å²	62.1	23%	0.227	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	158.4	169.6	-51.8	-71.6	0	0	0	110.6	V181 V182 A184	H173-V181 CarbonylContact O-C 3.53Å; H173-V181 WeakPolarHBondContact O-CA 3.38Å; H173-V182 HydrophobicContact CB-CG2 4.2Å; H173-V182 WeakPolarHBondContact CB-O 3.43Å; H173-V182 PolarHBondContact N-O 3.35Å; H173-V182 WeakPolarHBondContact O-CG2 3.33Å; H173-V182 PolarHBondContact O-N 3.14Å; H173-A184 PolarHBondContact CD2-N 3.1Å
174	H	96.9	Very high	96.7	Very high	3 Å²	3	56.8 Å²	56.8	1%	0.014	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	135.1	174.9	-62.8	75.1	0	0	0	111.1	R47 W149 I150 D152 R176 F180	R47-H174 WeakPolarHBondContact CD-CE1 3.21Å; W149-H174 HydrophobicContact CD2-CB 3.79Å; W149-H174 AromaticContact CD2-CG 3.86Å; W149-H174 HydrophobicContact CE3-CB 4.25Å; W149-H174 HydrophobicContact CG-CB 4.16Å; W149-H174 AromaticContact CG-CD2 3.95Å; W149-H174 HydrophobicContact CH2-CB 4.46Å; W149-H174 HydrophobicContact CZ2-CB 4.05Å; I150-H174 PolarHBondContact O-CD2 3.04Å; I150-H174 PolarHBondContact O-NE2 3.38Å; D152-H174 IonicContact OD1-CE1 3.08Å; D152-H174 PolarHBondContact OD1-CE1 2.95Å; D152-H174 IonicContact OD1-NE2 3.07Å; D152-H174 PolarHBondContact OD1-NE2 3.47Å; H174-R176 PolarHBondContact O-NH1 3.35Å; H174-F180 WeakPolarHBondContact CA-O 3.4Å
175	C	97.8	Very high	96.7	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.296	C	S	.	.			trans	-71.8	124.7	165.9	177.4	0	0	0	0	109.5	K177 C178 G179 F180 C204	C175-K177 VanDerWaalsContact C-N 3.28Å; C175-K177 PolarHBondContact O-N 3.2Å; C175-C178 VanDerWaalsContact CB-SG 3.54Å; C175-G179 VanDerWaalsContact O-CA 3.29Å; C175-G179 WeakPolarHBondContact O-CA 3.29Å; C175-G179 PolarHBondContact O-N 2.61Å; C175-F180 PolarHBondContact N-O 2.79Å; C175-F180 VanDerWaalsContact N-O 3.1Å; C175-C204 HydrophobicContact CB-CB 4.13Å; C175-C204 PolarHBondContact SG-N 3.45Å
176	R	96.6	Very high	96.7	Very high	71 Å²	71	52 Å²	52	27%	0.268	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-20.8	-179.4	-79.1	75.5	165.6	160.6	-9.4	113.7	W149 H174 L193 L196 L201 R202	W149-R176 HydrophobicContact CZ2-CG 4.15Å; H174-R176 PolarHBondContact O-NH1 3.35Å; R176-L193 HydrophobicContact CB-CD1 4.01Å; R176-L196 HydrophobicContact CB-CD2 4.47Å; R176-L196 WeakPolarHBondContact O-CD2 3.49Å; R176-L201 HydrophobicContact CB-CB 3.85Å; R176-L201 HydrophobicContact CB-CD1 4.01Å; R176-L201 HydrophobicContact CG-CB 3.85Å; R176-L201 HydrophobicContact CG-CD1 3.99Å; R176-L201 HydrophobicContact CG-CD2 4.49Å; R176-L201 HydrophobicContact CG-CG 4.33Å; R176-R202 WeakPolarHBondContact CD-O 3.36Å; R176-R202 PolarHBondContact N-O 3.38Å
177	K	95.9	Very high	96.7	Very high	88 Å²	88	51.5 Å²	51.5	38%	0.383	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-42.9	177.1	178.5	64.1	175.5	-172.7	0	113.1	A147 C175 L193 V203 C207 L211	A147-K177 VanDerWaalsContact CB-O 3.31Å; A147-K177 WeakPolarHBondContact CB-O 3.45Å; C175-K177 VanDerWaalsContact C-N 3.28Å; C175-K177 PolarHBondContact O-N 3.2Å; K177-L193 HydrophobicContact CB-CD1 4.34Å; K177-L193 HydrophobicContact CD-CD2 4.47Å; K177-V203 HydrophobicContact CB-CG1 4.12Å; K177-C207 HydrophobicContact CB-CB 4.02Å; K177-C207 HydrophobicContact CG-CB 4.08Å; K177-L211 HydrophobicContact CB-CD1 4.31Å; K177-L211 HydrophobicContact CD-CD1 4.48Å; K177-L211 HydrophobicContact CD-CD2 4.23Å; K177-L211 HydrophobicContact CG-CD1 4.2Å
178	C	96.4	Very high	96.9	Very high	29 Å²	29	56.5 Å²	56.5	20%	0.196	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.4	-3.8	-171.8	76.2	0	0	0	0	115.1	R160 C175 F180	R160-C178 PolarHBondContact NH2-SG 3.01Å; C175-C178 VanDerWaalsContact CB-SG 3.54Å; C178-F180 PolarHBondContact O-N 2.98Å; C178-F180 VanDerWaalsContact O-N 3.13Å
179	G	96.1	Very high	97.1	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	26%	0.264	C	S	.	.			trans	74.6	-5	176.1	0	0	0	0	0	116.8	I150 C175	I150-G179 PolarHBondContact N-O 2.62Å; C175-G179 VanDerWaalsContact O-CA 3.29Å; C175-G179 WeakPolarHBondContact O-CA 3.29Å; C175-G179 PolarHBondContact O-N 2.61Å
180	F	97.6	Very high	97.3	Very high	68 Å²	68	56.7 Å²	56.7	30%	0.298	25%	0.253	S	S	.	.			trans	-65.9	148.2	-178	-75.2	5.2	0	0	0	113.7	I150 M159 H174 C175 C178 V182	I150-F180 HydrophobicContact CG1-CD1 4.23Å; M159-F180 HydrophobicContact CB-CB 4.13Å; M159-F180 HydrophobicContact CB-CD2 4.01Å; M159-F180 HydrophobicContact CB-CG 4.21Å; M159-F180 HydrophobicContact CE-CD1 3.85Å; M159-F180 HydrophobicContact CE-CD2 4.41Å; M159-F180 HydrophobicContact CE-CE1 4.04Å; M159-F180 HydrophobicContact CE-CG 4.05Å; M159-F180 HydrophobicContact CE-CZ 4.41Å; M159-F180 HydrophobicContact SD-CB 4.01Å; M159-F180 HydrophobicContact SD-CD1 4.26Å; M159-F180 HydrophobicContact SD-CG 4.11Å; H174-F180 WeakPolarHBondContact CA-O 3.4Å; C175-F180 PolarHBondContact N-O 2.79Å; C175-F180 VanDerWaalsContact N-O 3.1Å; C178-F180 PolarHBondContact O-N 2.98Å; C178-F180 VanDerWaalsContact O-N 3.13Å; F180-V182 HydrophobicContact CB-CG1 4.23Å
181	V	97.8	Very high	97.5	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	120.1	172.6	-164.6	0	0	0	0	109.9	I150 T155 M159 F166 R172 H173	I150-V181 HydrophobicContact CB-CG2 3.96Å; I150-V181 HydrophobicContact CG2-CG2 3.98Å; T155-V181 HydrophobicContact CG2-CB 3.8Å; T155-V181 HydrophobicContact CG2-CG1 4.33Å; T155-V181 HydrophobicContact CG2-CG2 3.94Å; M159-V181 WeakPolarHBondContact CB-O 3.33Å; M159-V181 HydrophobicContact CG-CB 4.44Å; M159-V181 WeakPolarHBondContact CG-O 3.44Å; M159-V181 PolarHBondContact N-O 3.43Å; M159-V181 HydrophobicContact SD-CB 4.15Å; M159-V181 HydrophobicContact SD-CG2 4.19Å; M159-V181 PolarHBondContact SD-N 3.1Å; M159-V181 VanDerWaalsContact SD-N 3.39Å; F166-V181 HydrophobicContact CD2-CG1 4.37Å; F166-V181 HydrophobicContact CE2-CB 4.3Å; F166-V181 HydrophobicContact CE2-CG1 3.55Å; F166-V181 HydrophobicContact CZ-CG1 3.74Å; R172-V181 HydrophobicContact CB-CG1 3.78Å; R172-V181 HydrophobicContact CG-CG1 3.74Å; H173-V181 CarbonylContact O-C 3.53Å; H173-V181 WeakPolarHBondContact O-CA 3.38Å
182	V	98.4	Very high	97.5	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	149.4	-169.6	-63.2	0	0	0	0	111.7	R160 H173 F180 C186 C204	R160-V182 HydrophobicContact CB-CG1 4.31Å; R160-V182 HydrophobicContact CG-CB 4.49Å; R160-V182 HydrophobicContact CG-CG1 3.44Å; R160-V182 VanDerWaalsContact CG-CG1 3.44Å; H173-V182 HydrophobicContact CB-CG2 4.2Å; H173-V182 WeakPolarHBondContact CB-O 3.43Å; H173-V182 PolarHBondContact N-O 3.35Å; H173-V182 WeakPolarHBondContact O-CG2 3.33Å; H173-V182 PolarHBondContact O-N 3.14Å; F180-V182 HydrophobicContact CB-CG1 4.23Å; V182-C186 HydrophobicContact CB-CB 4.44Å; V182-C204 HydrophobicContact CG1-CB 4.2Å
183	C	98.4	Very high	97.5	Very high	5 Å²	5	49 Å²	49	3%	0.034	23%	0.226	C	C	.	.			trans	-77.1	168.9	171.4	68.5	0	0	0	0	111.2	C158 T164 F166 E185 C186 S187	C158-C183 HydrophobicContact CB-CB 4.17Å; C158-C183 PolarHBondContact SG-N 3.47Å; C158-C183 VanDerWaalsContact SG-N 3.36Å; T164-C183 HydrophobicContact CG2-CB 3.75Å; F166-C183 HydrophobicContact CE1-CB 4.12Å; C183-E185 VanDerWaalsContact C-N 3.25Å; C183-E185 PolarHBondContact O-N 2.85Å; C183-C186 PolarHBondContact O-N 3.37Å; C183-C186 VanDerWaalsContact SG-SG 3.65Å; C183-S187 PolarHBondContact O-N 2.81Å; C183-S187 PolarHBondContact O-OG 2.93Å
184	A	98.1	Very high	97.2	Very high	53 Å²	53	51.5 Å²	51.5	44%	0.438	25%	0.246	S	C	.	.	S	Bend	trans	-57.4	-42	179.3	0	0	0	0	0	111.4	H173 C186 S187 R188	H173-A184 PolarHBondContact CD2-N 3.1Å; A184-C186 PolarHBondContact O-N 2.98Å; A184-S187 CarbonylContact O-C 3.58Å; A184-S187 PolarHBondContact O-N 2.87Å; A184-S187 VanDerWaalsContact O-N 3.1Å; A184-R188 WeakPolarHBondContact O-CG 3.48Å; A184-R188 PolarHBondContact O-N 2.76Å
185	E	98.3	Very high	96.8	Very high	108 Å²	108	58.1 Å²	58.1	51%	0.505	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-60.3	-46.7	-179.3	-165.9	56.8	-144.7	0	0	112.9	C183 S187 R188	C183-E185 VanDerWaalsContact C-N 3.25Å; C183-E185 PolarHBondContact O-N 2.85Å; E185-S187 PolarHBondContact O-N 2.96Å; E185-S187 VanDerWaalsContact O-N 3.14Å; E185-R188 VanDerWaalsContact CD-NE 3.26Å; E185-R188 IonicContact OE1-CZ 2.78Å; E185-R188 IonicContact OE1-NE 2.65Å; E185-R188 PolarHBondContact OE1-NE 3.42Å; E185-R188 IonicContact OE1-NH1 3.82Å; E185-R188 IonicContact OE1-NH2 3.44Å; E185-R188 PolarHBondContact OE1-NH2 3.03Å; E185-R188 IonicContact OE2-CZ 2.71Å; E185-R188 IonicContact OE2-NE 2.79Å; E185-R188 PolarHBondContact OE2-NE 2.9Å; E185-R188 IonicContact OE2-NH2 3.16Å; E185-R188 PolarHBondContact OE2-NH2 3.49Å
186	C	98.6	Very high	96.5	Very high	16 Å²	16	60.8 Å²	60.8	11%	0.108	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-75	1.2	179.4	-66.4	0	0	0	0	113.8	R160 V182 C183 A184 C204 S205	R160-C186 HydrophobicContact CB-CB 3.72Å; R160-C186 HydrophobicContact CG-CB 4.27Å; V182-C186 HydrophobicContact CB-CB 4.44Å; C183-C186 PolarHBondContact O-N 3.37Å; C183-C186 VanDerWaalsContact SG-SG 3.65Å; A184-C186 PolarHBondContact O-N 2.98Å; C186-C204 CarbonylContact O-C 3.59Å; C186-C204 WeakPolarHBondContact O-CA 3.49Å; C186-C204 WeakPolarHBondContact O-CB 3.5Å; C186-S205 PolarHBondContact O-N 3.01Å
187	S	98.2	Very high	96.3	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-145.3	32.9	-173.5	66.9	0	0	0	0	114.5	C183 A184 E185 E189 R202 V203	C183-S187 PolarHBondContact O-N 2.81Å; C183-S187 PolarHBondContact O-OG 2.93Å; A184-S187 CarbonylContact O-C 3.58Å; A184-S187 PolarHBondContact O-N 2.87Å; A184-S187 VanDerWaalsContact O-N 3.1Å; E185-S187 PolarHBondContact O-N 2.96Å; E185-S187 VanDerWaalsContact O-N 3.14Å; S187-E189 PolarHBondContact O-N 2.79Å; S187-R202 WeakPolarHBondContact O-CG 3.31Å; S187-R202 PolarHBondContact O-NH1 3.42Å; S187-R202 PolarHBondContact OG-NH1 3.28Å; S187-R202 VanDerWaalsContact OG-NH1 3.13Å; S187-V203 WeakPolarHBondContact CA-O 3.32Å
188	R	97.9	Very high	96.2	Very high	166 Å²	166	60 Å²	60	63%	0.626	30%	0.299	S	S	*	.			trans	-60.6	-30.7	178.8	-67.6	177.7	171.6	-165.6	-2.2	113.2	A184 E185	A184-R188 WeakPolarHBondContact O-CG 3.48Å; A184-R188 PolarHBondContact O-N 2.76Å; E185-R188 VanDerWaalsContact CD-NE 3.26Å; E185-R188 IonicContact OE1-CZ 2.78Å; E185-R188 IonicContact OE1-NE 2.65Å; E185-R188 PolarHBondContact OE1-NE 3.42Å; E185-R188 IonicContact OE1-NH1 3.82Å; E185-R188 IonicContact OE1-NH2 3.44Å; E185-R188 PolarHBondContact OE1-NH2 3.03Å; E185-R188 IonicContact OE2-CZ 2.71Å; E185-R188 IonicContact OE2-NE 2.79Å; E185-R188 PolarHBondContact OE2-NE 2.9Å; E185-R188 IonicContact OE2-NH2 3.16Å; E185-R188 PolarHBondContact OE2-NH2 3.49Å
189	E	98.1	Very high	96.2	Very high	82 Å²	82	65 Å²	65	38%	0.383	32%	0.317	S	S	.	.			trans	-81.9	153.6	-172.7	-55.5	-52.9	139.5	0	0	114.2	S187 V203 Y208	S187-E189 PolarHBondContact O-N 2.79Å; E189-V203 HydrophobicContact CB-CG2 4.47Å; E189-V203 PolarHBondContact O-N 2.92Å; E189-Y208 HydrophobicContact CB-CD1 4.22Å; E189-Y208 HydrophobicContact CB-CD2 3.42Å; E189-Y208 VanDerWaalsContact CB-CD2 3.42Å; E189-Y208 HydrophobicContact CB-CE2 3.87Å; E189-Y208 HydrophobicContact CB-CG 3.61Å; E189-Y208 HydrophobicContact CG-CD1 3.88Å; E189-Y208 HydrophobicContact CG-CD2 4.01Å; E189-Y208 HydrophobicContact CG-CE1 4.17Å; E189-Y208 HydrophobicContact CG-CE2 4.3Å; E189-Y208 HydrophobicContact CG-CG 3.77Å
190	R	98.3	Very high	96.2	Very high	163 Å²	163	68.6 Å²	68.6	62%	0.615	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.7	143.2	169.8	-67.7	-178.3	163.3	122	-9.8	109.9	P200 L201	R190-P200 HydrophobicContact CB-CB 3.91Å; R190-L201 CarbonylContact C-O 3.48Å; R190-L201 VanDerWaalsContact CA-O 3.23Å; R190-L201 WeakPolarHBondContact CA-O 3.44Å
191	F	98.2	Very high	96.2	Very high	32 Å²	32	66.9 Å²	66.9	14%	0.14	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	142.7	179.1	-160.5	-86.1	0	0	0	110.4	L193 P200 L201 V203 Y208 L211 K215	F191-L193 HydrophobicContact CD1-CD2 4.2Å; F191-L193 PolarHBondContact O-N 3.01Å; F191-P200 WeakPolarHBondContact O-CA 3.49Å; F191-L201 PolarHBondContact N-O 3.49Å; F191-L201 PolarHBondContact O-N 3.45Å; F191-V203 HydrophobicContact CB-CG1 4.26Å; F191-V203 HydrophobicContact CB-CG2 3.76Å; F191-Y208 HydrophobicContact CB-CD2 4.22Å; F191-Y208 AromaticContact CD2-CD2 3.87Å; F191-Y208 HydrophobicContact CD2-CD2 3.87Å; F191-Y208 AromaticContact CD2-CE2 3.83Å; F191-Y208 HydrophobicContact CD2-CE2 3.83Å; F191-L211 HydrophobicContact CB-CD1 4.14Å; F191-L211 HydrophobicContact CD1-CB 3.85Å; F191-L211 HydrophobicContact CD1-CD1 3.79Å; F191-L211 HydrophobicContact CD1-CD2 4.43Å; F191-L211 HydrophobicContact CD1-CG 4.24Å; F191-L211 HydrophobicContact CD2-CB 3.96Å; F191-L211 HydrophobicContact CE1-CB 3.71Å; F191-L211 HydrophobicContact CE1-CD1 4.4Å; F191-L211 HydrophobicContact CE1-CD2 4.33Å; F191-L211 HydrophobicContact CE1-CG 4.37Å; F191-L211 HydrophobicContact CE2-CB 3.79Å; F191-L211 HydrophobicContact CG-CB 3.99Å; F191-L211 HydrophobicContact CG-CD1 3.93Å; F191-L211 HydrophobicContact CZ-CB 3.67Å; F191-K215 HydrophobicContact CZ-CB 4.18Å; F191-K215 HydrophobicContact CZ-CD 4.17Å
192	L	97.3	Very high	96.2	Very high	80 Å²	80	69.4 Å²	69.4	42%	0.419	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	120.9	177	-177.2	63.7	0	0	0	109.8	P194 P198	L192-P194 HydrophobicContact CD2-CG 4.3Å; L192-P194 HydrophobicContact CG-CG 4.07Å; L192-P194 WeakPolarHBondContact O-CD 3.27Å; L192-P198 VanDerWaalsContact CD1-O 3.24Å; L192-P198 WeakPolarHBondContact CD1-O 3.49Å
193	L	95.2	Very high	96.2	Very high	17 Å²	17	69.4 Å²	69.4	9%	0.089	34%	0.344	C	S	.	.			trans	-118.1	82.9	176.1	-62.3	177.4	0	0	0	107.9	R176 K177 F191 R195 L196 S197 L201 V203 L211	R176-L193 HydrophobicContact CB-CD1 4.01Å; K177-L193 HydrophobicContact CB-CD1 4.34Å; K177-L193 HydrophobicContact CD-CD2 4.47Å; F191-L193 HydrophobicContact CD1-CD2 4.2Å; F191-L193 PolarHBondContact O-N 3.01Å; L193-R195 PolarHBondContact O-N 3.43Å; L193-L196 HydrophobicContact CB-CB 4.21Å; L193-L196 HydrophobicContact CD1-CD2 4.21Å; L193-L196 PolarHBondContact O-N 3.11Å; L193-S197 CarbonylContact C-O 3.56Å; L193-S197 PolarHBondContact O-N 2.99Å; L193-S197 VanDerWaalsContact O-O 3.06Å; L193-L201 HydrophobicContact CB-CD1 4.28Å; L193-L201 HydrophobicContact CD1-CB 4.43Å; L193-L201 HydrophobicContact CD1-CD1 4.25Å; L193-V203 HydrophobicContact CD1-CG1 4.29Å; L193-L211 HydrophobicContact CD2-CD1 3.9Å; L193-L211 HydrophobicContact CD2-CD2 4.14Å
194	P	91.8	Very high	96.2	Very high	101 Å²	101	69.2 Å²	69.2	66%	0.656	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-33.5	-167	-28	35	0	0	0	114.3	L192 L196	L192-P194 HydrophobicContact CD2-CG 4.3Å; L192-P194 HydrophobicContact CG-CG 4.07Å; L192-P194 WeakPolarHBondContact O-CD 3.27Å; P194-L196 VanDerWaalsContact C-N 3.31Å; P194-L196 PolarHBondContact O-N 3.04Å
195	R	87.8	Confident	96.2	Very high	141 Å²	141	69.6 Å²	69.6	53%	0.532	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-28.1	177	-68.4	-167	-78.8	-84.5	10.5	113.8	E144 L193	E144-R195 IonicContact OE1-NH2 3.22Å; E144-R195 PolarHBondContact OE1-NH2 3.16Å; E144-R195 VanDerWaalsContact OE1-NH2 3.16Å; E144-R195 IonicContact OE2-CZ 2.75Å; E144-R195 IonicContact OE2-NE 2.86Å; E144-R195 PolarHBondContact OE2-NE 3.4Å; E144-R195 IonicContact OE2-NH1 3.76Å; E144-R195 PolarHBondContact OE2-NH1 3.03Å; E144-R195 IonicContact OE2-NH2 2.73Å; E144-R195 PolarHBondContact OE2-NH2 2.97Å; L193-R195 PolarHBondContact O-N 3.43Å
196	L	91.3	Very high	96.2	Very high	56 Å²	56	67.1 Å²	67.1	29%	0.293	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-40.6	-178.8	-85.4	64.5	0	0	0	111.9	A105 A146 R176 L193 P194 L201	A105-L196 WeakPolarHBondContact O-CD1 3.29Å; A146-L196 HydrophobicContact CB-CD1 4.17Å; A146-L196 HydrophobicContact CB-CD2 4.37Å; A146-L196 HydrophobicContact CB-CG 4.31Å; R176-L196 HydrophobicContact CB-CD2 4.47Å; R176-L196 WeakPolarHBondContact O-CD2 3.49Å; L193-L196 HydrophobicContact CB-CB 4.21Å; L193-L196 HydrophobicContact CD1-CD2 4.21Å; L193-L196 PolarHBondContact O-N 3.11Å; P194-L196 VanDerWaalsContact C-N 3.31Å; P194-L196 PolarHBondContact O-N 3.04Å; L196-L201 HydrophobicContact CB-CD1 3.79Å; L196-L201 HydrophobicContact CD2-CD1 4.35Å
197	S	92.7	Very high	96.2	Very high	25 Å²	25	66.5 Å²	66.5	18%	0.175	33%	0.328	C	S	.	.			trans	-157.7	145.5	-177.3	-175.3	0	0	0	0	111.5	L193 K199	L193-S197 CarbonylContact C-O 3.56Å; L193-S197 PolarHBondContact O-N 2.99Å; L193-S197 VanDerWaalsContact O-O 3.06Å; S197-K199 PolarHBondContact O-N 2.83Å; S197-K199 PolarHBondContact OG-N 2.84Å; S197-K199 VanDerWaalsContact OG-N 3.15Å
198	P	93.8	Very high	96.2	Very high	118 Å²	118	70.3 Å²	70.3	77%	0.766	34%	0.342	S	S	*	.	S	Bend	trans	-71.2	-11.4	169.2	31.6	-36.9	0	0	0	112.9	L192	L192-P198 VanDerWaalsContact CD1-O 3.24Å; L192-P198 WeakPolarHBondContact CD1-O 3.49Å
199	K	95.9	Very high	96.2	Very high	133 Å²	133	70 Å²	70	58%	0.578	34%	0.341	S	S	*	.	S	Bend	trans	-104.2	152	179	-64.4	-176.4	179.8	-178.2	0	110.9	S197 L201	S197-K199 PolarHBondContact O-N 2.83Å; S197-K199 PolarHBondContact OG-N 2.84Å; S197-K199 VanDerWaalsContact OG-N 3.15Å; K199-L201 PolarHBondContact O-N 3.29Å
200	P	97.4	Very high	96.2	Very high	76 Å²	76	71.4 Å²	71.4	49%	0.494	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	130.8	172.7	-25.4	35.4	0	0	0	113.1	R190 F191	R190-P200 HydrophobicContact CB-CB 3.91Å; F191-P200 WeakPolarHBondContact O-CA 3.49Å
201	L	97.1	Very high	96.1	Very high	33 Å²	33	64.3 Å²	64.3	17%	0.173	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	148.5	-177.6	-64.3	176.4	0	0	0	111.2	R176 R190 F191 L193 L196 K199 V203	R176-L201 HydrophobicContact CB-CB 3.85Å; R176-L201 HydrophobicContact CB-CD1 4.01Å; R176-L201 HydrophobicContact CG-CB 3.85Å; R176-L201 HydrophobicContact CG-CD1 3.99Å; R176-L201 HydrophobicContact CG-CD2 4.49Å; R176-L201 HydrophobicContact CG-CG 4.33Å; R190-L201 CarbonylContact C-O 3.48Å; R190-L201 VanDerWaalsContact CA-O 3.23Å; R190-L201 WeakPolarHBondContact CA-O 3.44Å; F191-L201 PolarHBondContact N-O 3.49Å; F191-L201 PolarHBondContact O-N 3.45Å; L193-L201 HydrophobicContact CB-CD1 4.28Å; L193-L201 HydrophobicContact CD1-CB 4.43Å; L193-L201 HydrophobicContact CD1-CD1 4.25Å; L196-L201 HydrophobicContact CB-CD1 3.79Å; L196-L201 HydrophobicContact CD2-CD1 4.35Å; K199-L201 PolarHBondContact O-N 3.29Å; L201-V203 PolarHBondContact O-N 3.08Å
202	R	98.1	Very high	96.1	Very high	53 Å²	53	63.5 Å²	63.5	20%	0.2	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	127.4	176.1	179.8	-179	-69.5	-94.4	1.6	111.2	R176 S187	R176-R202 WeakPolarHBondContact CD-O 3.36Å; R176-R202 PolarHBondContact N-O 3.38Å; S187-R202 WeakPolarHBondContact O-CG 3.31Å; S187-R202 PolarHBondContact O-NH1 3.42Å; S187-R202 PolarHBondContact OG-NH1 3.28Å; S187-R202 VanDerWaalsContact OG-NH1 3.13Å
203	V	98.6	Very high	96.1	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.312	C	S	.	.			trans	-128.5	150.7	174.2	-69.1	0	0	0	0	109.4	K177 S187 E189 F191 L193 L201 C207 Y208 L211	K177-V203 HydrophobicContact CB-CG1 4.12Å; S187-V203 WeakPolarHBondContact CA-O 3.32Å; E189-V203 HydrophobicContact CB-CG2 4.47Å; E189-V203 PolarHBondContact O-N 2.92Å; F191-V203 HydrophobicContact CB-CG1 4.26Å; F191-V203 HydrophobicContact CB-CG2 3.76Å; L193-V203 HydrophobicContact CD1-CG1 4.29Å; L201-V203 PolarHBondContact O-N 3.08Å; V203-C207 HydrophobicContact CB-CB 4.28Å; V203-Y208 HydrophobicContact CG2-CD2 3.94Å; V203-Y208 HydrophobicContact CG2-CG 4.4Å; V203-L211 HydrophobicContact CG1-CD1 4.19Å
204	C	98.6	Very high	96.1	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	33%	0.329	C	S	.	.			trans	-69.9	158.2	171.4	62.6	0	0	0	0	110.9	R160 C175 V182 C186 L206 C207 Y208	R160-C204 HydrophobicContact CG-CB 4.04Å; R160-C204 PolarHBondContact NE-SG 2.99Å; R160-C204 PolarHBondContact NH2-SG 3.18Å; C175-C204 HydrophobicContact CB-CB 4.13Å; C175-C204 PolarHBondContact SG-N 3.45Å; V182-C204 HydrophobicContact CG1-CB 4.2Å; C186-C204 CarbonylContact O-C 3.59Å; C186-C204 WeakPolarHBondContact O-CA 3.49Å; C186-C204 WeakPolarHBondContact O-CB 3.5Å; C204-L206 VanDerWaalsContact C-N 3.26Å; C204-L206 PolarHBondContact O-N 3.39Å; C204-L206 VanDerWaalsContact O-N 3.17Å; C204-C207 PolarHBondContact O-N 3.48Å; C204-C207 VanDerWaalsContact O-N 3.12Å; C204-C207 PolarHBondContact SG-SG 3.04Å; C204-Y208 PolarHBondContact O-N 3.26Å
205	S	98	Very high	96.3	Very high	61 Å²	61	65 Å²	65	43%	0.427	32%	0.32	S	S	.	.	H	α-helix	trans	-51.6	-40.7	-179.4	56.1	0	0	0	0	113.8	C186 Y208 R209	C186-S205 PolarHBondContact O-N 3.01Å; S205-Y208 PolarHBondContact O-N 2.98Å; S205-R209 PolarHBondContact O-N 3.12Å
206	L	97.9	Very high	96.7	Very high	57 Å²	57	65.5 Å²	65.5	30%	0.298	32%	0.322	S	S	.	.	H	α-helix	trans	-62.4	-53.6	177.1	-68.4	-179.5	0	0	0	112.1	R160 C204 Y208 R209 E210	R160-L206 VanDerWaalsContact NH1-CD1 3.32Å; C204-L206 VanDerWaalsContact C-N 3.26Å; C204-L206 PolarHBondContact O-N 3.39Å; C204-L206 VanDerWaalsContact O-N 3.17Å; L206-Y208 VanDerWaalsContact C-N 3.29Å; L206-Y208 PolarHBondContact O-N 3.37Å; L206-R209 VanDerWaalsContact CD2-NH2 3.25Å; L206-R209 PolarHBondContact O-N 3.31Å; L206-E210 WeakPolarHBondContact O-CG 3.43Å; L206-E210 PolarHBondContact O-N 2.99Å; L206-E210 VanDerWaalsContact O-N 3.09Å
207	C	98.2	Very high	96.8	Very high	2 Å²	2	72.2 Å²	72.2	1%	0.014	34%	0.343	C	S	.	.	H	α-helix	trans	-61.7	-36.7	176.2	-67.3	0	0	0	0	112.5	R160 K177 V203 C204 R209 E210 L211	R160-C207 PolarHBondContact NH2-SG 2.94Å; K177-C207 HydrophobicContact CB-CB 4.02Å; K177-C207 HydrophobicContact CG-CB 4.08Å; V203-C207 HydrophobicContact CB-CB 4.28Å; C204-C207 PolarHBondContact O-N 3.48Å; C204-C207 VanDerWaalsContact O-N 3.12Å; C204-C207 PolarHBondContact SG-SG 3.04Å; C207-R209 VanDerWaalsContact C-N 3.34Å; C207-R209 PolarHBondContact O-N 3.39Å; C207-E210 PolarHBondContact O-N 3.16Å; C207-L211 HydrophobicContact CB-CD1 4.46Å; C207-L211 VanDerWaalsContact O-CB 3.27Å; C207-L211 WeakPolarHBondContact O-CB 3.49Å; C207-L211 WeakPolarHBondContact O-CD1 3.27Å; C207-L211 WeakPolarHBondContact O-CG 3.34Å; C207-L211 PolarHBondContact O-N 2.9Å
208	Y	98.4	Very high	96.8	Very high	80 Å²	80	75.9 Å²	75.9	31%	0.314	36%	0.357	S	S	.	.	H	α-helix	trans	-60.3	-45.6	176.2	-176.2	-98.8	0	0	0	111.5	E189 F191 V203 C204 S205 L206 L211 S212	E189-Y208 HydrophobicContact CB-CD1 4.22Å; E189-Y208 HydrophobicContact CB-CD2 3.42Å; E189-Y208 VanDerWaalsContact CB-CD2 3.42Å; E189-Y208 HydrophobicContact CB-CE2 3.87Å; E189-Y208 HydrophobicContact CB-CG 3.61Å; E189-Y208 HydrophobicContact CG-CD1 3.88Å; E189-Y208 HydrophobicContact CG-CD2 4.01Å; E189-Y208 HydrophobicContact CG-CE1 4.17Å; E189-Y208 HydrophobicContact CG-CE2 4.3Å; E189-Y208 HydrophobicContact CG-CG 3.77Å; F191-Y208 HydrophobicContact CB-CD2 4.22Å; F191-Y208 AromaticContact CD2-CD2 3.87Å; F191-Y208 HydrophobicContact CD2-CD2 3.87Å; F191-Y208 AromaticContact CD2-CE2 3.83Å; F191-Y208 HydrophobicContact CD2-CE2 3.83Å; V203-Y208 HydrophobicContact CG2-CD2 3.94Å; V203-Y208 HydrophobicContact CG2-CG 4.4Å; C204-Y208 PolarHBondContact O-N 3.26Å; S205-Y208 PolarHBondContact O-N 2.98Å; L206-Y208 VanDerWaalsContact C-N 3.29Å; L206-Y208 PolarHBondContact O-N 3.37Å; Y208-L211 PolarHBondContact O-N 2.84Å; Y208-S212 WeakPolarHBondContact O-CB 3.21Å; Y208-S212 PolarHBondContact O-N 2.98Å; Y208-S212 PolarHBondContact O-OG 2.73Å
209	R	98	Very high	96.8	Very high	160 Å²	160	75.2 Å²	75.2	60%	0.604	34%	0.344	S	S	*	.	H	α-helix	trans	-61.7	-44.9	178.1	-176.8	175	64.6	-160.3	2.5	111.8	S205 L206 C207 A213	S205-R209 PolarHBondContact O-N 3.12Å; L206-R209 VanDerWaalsContact CD2-NH2 3.25Å; L206-R209 PolarHBondContact O-N 3.31Å; C207-R209 VanDerWaalsContact C-N 3.34Å; C207-R209 PolarHBondContact O-N 3.39Å; R209-A213 WeakPolarHBondContact O-CB 3.41Å; R209-A213 PolarHBondContact O-N 2.88Å
210	E	97.7	Very high	96.6	Very high	112 Å²	112	71.9 Å²	71.9	52%	0.523	34%	0.341	S	S	.	.	H	α-helix	trans	-61.7	-52.2	177.3	-71.4	163.4	-170.1	0	0	111.6	L206 C207 S212 A213 Q214	L206-E210 WeakPolarHBondContact O-CG 3.43Å; L206-E210 PolarHBondContact O-N 2.99Å; L206-E210 VanDerWaalsContact O-N 3.09Å; C207-E210 PolarHBondContact O-N 3.16Å; E210-S212 VanDerWaalsContact C-N 3.34Å; E210-S212 PolarHBondContact O-N 3.21Å; E210-A213 PolarHBondContact O-N 3.42Å; E210-Q214 PolarHBondContact O-N 3.36Å
211	L	97.1	Very high	96.1	Very high	13 Å²	13	74.7 Å²	74.7	7%	0.068	35%	0.35	C	S	.	.	H	α-helix	trans	-62.3	-40.4	-179.9	-71	165.7	0	0	0	112.1	K177 F191 L193 V203 C207 Y208 Q214 K215	K177-L211 HydrophobicContact CB-CD1 4.31Å; K177-L211 HydrophobicContact CD-CD1 4.48Å; K177-L211 HydrophobicContact CD-CD2 4.23Å; K177-L211 HydrophobicContact CG-CD1 4.2Å; F191-L211 HydrophobicContact CB-CD1 4.14Å; F191-L211 HydrophobicContact CD1-CB 3.85Å; F191-L211 HydrophobicContact CD1-CD1 3.79Å; F191-L211 HydrophobicContact CD1-CD2 4.43Å; F191-L211 HydrophobicContact CD1-CG 4.24Å; F191-L211 HydrophobicContact CD2-CB 3.96Å; F191-L211 HydrophobicContact CE1-CB 3.71Å; F191-L211 HydrophobicContact CE1-CD1 4.4Å; F191-L211 HydrophobicContact CE1-CD2 4.33Å; F191-L211 HydrophobicContact CE1-CG 4.37Å; F191-L211 HydrophobicContact CE2-CB 3.79Å; F191-L211 HydrophobicContact CG-CB 3.99Å; F191-L211 HydrophobicContact CG-CD1 3.93Å; F191-L211 HydrophobicContact CZ-CB 3.67Å; L193-L211 HydrophobicContact CD2-CD1 3.9Å; L193-L211 HydrophobicContact CD2-CD2 4.14Å; V203-L211 HydrophobicContact CG1-CD1 4.19Å; C207-L211 HydrophobicContact CB-CD1 4.46Å; C207-L211 VanDerWaalsContact O-CB 3.27Å; C207-L211 WeakPolarHBondContact O-CB 3.49Å; C207-L211 WeakPolarHBondContact O-CD1 3.27Å; C207-L211 WeakPolarHBondContact O-CG 3.34Å; C207-L211 PolarHBondContact O-N 2.9Å; Y208-L211 PolarHBondContact O-N 2.84Å; L211-Q214 PolarHBondContact O-N 2.9Å; L211-K215 WeakPolarHBondContact O-CB 3.15Å; L211-K215 PolarHBondContact O-N 2.9Å
212	S	97.4	Very high	95.4	Very high	15 Å²	15	80.3 Å²	80.3	11%	0.105	38%	0.375	C	S	.	.	H	α-helix	trans	-67.6	-37.8	177.1	-58.8	0	0	0	0	112	Y208 E210 R216	Y208-S212 WeakPolarHBondContact O-CB 3.21Å; Y208-S212 PolarHBondContact O-N 2.98Å; Y208-S212 PolarHBondContact O-OG 2.73Å; E210-S212 VanDerWaalsContact C-N 3.34Å; E210-S212 PolarHBondContact O-N 3.21Å; S212-R216 WeakPolarHBondContact O-CG 3.12Å; S212-R216 PolarHBondContact O-N 3.49Å; S212-R216 VanDerWaalsContact O-N 3.12Å; S212-R216 PolarHBondContact O-NH1 3.21Å
213	A	97.2	Very high	94.1	Very high	30 Å²	30	80.3 Å²	80.3	25%	0.248	39%	0.392	C	S	.	.	H	α-helix	trans	-66.9	-40.3	174.8	0	0	0	0	0	111.5	R209 E210 R217	R209-A213 WeakPolarHBondContact O-CB 3.41Å; R209-A213 PolarHBondContact O-N 2.88Å; E210-A213 PolarHBondContact O-N 3.42Å; A213-R217 WeakPolarHBondContact O-CG 3.33Å; A213-R217 PolarHBondContact O-N 3.05Å; A213-R217 VanDerWaalsContact O-N 3.16Å
214	Q	95.6	Very high	92.4	Very high	96 Å²	96	85.8 Å²	85.8	45%	0.449	43%	0.429	S	S	.	.	H	α-helix	trans	-61	-51.5	174.1	178.3	175.5	-3	0	0	111.2	E210 L211 R216 R217 E218	E210-Q214 PolarHBondContact O-N 3.36Å; L211-Q214 PolarHBondContact O-N 2.9Å; Q214-R216 VanDerWaalsContact C-N 3.32Å; Q214-R216 PolarHBondContact O-N 3.09Å; Q214-R217 WeakPolarHBondContact O-CA 2.83Å; Q214-R217 WeakPolarHBondContact O-CB 3.27Å; Q214-R217 PolarHBondContact O-N 3.49Å; Q214-E218 HydrophobicContact CG-CG 4.47Å; Q214-E218 VanDerWaalsContact CG-OE1 3.27Å; Q214-E218 WeakPolarHBondContact CG-OE1 3.41Å; Q214-E218 PolarHBondContact NE2-OE1 3.12Å; Q214-E218 WeakPolarHBondContact O-CG 3.48Å; Q214-E218 PolarHBondContact O-N 3.4Å
215	K	95.4	Very high	90.5	Very high	105 Å²	105	96.1 Å²	96.1	46%	0.457	47%	0.468	S	S	.	.	H	α-helix	trans	-55.4	-45	178.9	178.8	173.9	172	176.9	0	112.4	F191 L211 R217 E218 E219	F191-K215 HydrophobicContact CZ-CB 4.18Å; F191-K215 HydrophobicContact CZ-CD 4.17Å; L211-K215 WeakPolarHBondContact O-CB 3.15Å; L211-K215 PolarHBondContact O-N 2.9Å; K215-R217 VanDerWaalsContact C-N 3.31Å; K215-R217 PolarHBondContact O-N 3.36Å; K215-E218 PolarHBondContact O-N 2.89Å; K215-E219 WeakPolarHBondContact CE-OE1 3.3Å; K215-E219 HydrophobicContact CG-CG 4.48Å; K215-E219 IonicContact NZ-OE1 2.73Å; K215-E219 WeakPolarHBondContact O-CG 3.43Å; K215-E219 PolarHBondContact O-N 3.17Å
216	R	95.3	Very high	88.4	Confident	151 Å²	151	95.6 Å²	95.6	57%	0.57	47%	0.472	S	S	*	.	H	α-helix	trans	-62.8	-35.3	176.1	-73.4	-169.7	-59	-87.9	2.2	113.2	S212 Q214 A220	S212-R216 WeakPolarHBondContact O-CG 3.12Å; S212-R216 PolarHBondContact O-N 3.49Å; S212-R216 VanDerWaalsContact O-N 3.12Å; S212-R216 PolarHBondContact O-NH1 3.21Å; Q214-R216 VanDerWaalsContact C-N 3.32Å; Q214-R216 PolarHBondContact O-N 3.09Å; R216-A220 VanDerWaalsContact O-CB 3.32Å; R216-A220 WeakPolarHBondContact O-CB 3.39Å; R216-A220 PolarHBondContact O-N 3.4Å
217	R	94.8	Very high	86.1	Confident	197 Å²	197	98.3 Å²	98.3	74%	0.743	50%	0.496	S	S	*	.	H	α-helix	trans	-68.8	-40.2	176.5	-72.4	175.7	-176.5	-159.8	1.2	111.4	A213 Q214 K215 A220 M221	A213-R217 WeakPolarHBondContact O-CG 3.33Å; A213-R217 PolarHBondContact O-N 3.05Å; A213-R217 VanDerWaalsContact O-N 3.16Å; Q214-R217 WeakPolarHBondContact O-CA 2.83Å; Q214-R217 WeakPolarHBondContact O-CB 3.27Å; Q214-R217 PolarHBondContact O-N 3.49Å; K215-R217 VanDerWaalsContact C-N 3.31Å; K215-R217 PolarHBondContact O-N 3.36Å; R217-A220 PolarHBondContact O-N 2.88Å; R217-M221 WeakPolarHBondContact O-CB 3.43Å; R217-M221 PolarHBondContact O-N 3.43Å
218	E	93.1	Very high	83.8	Confident	101 Å²	101	104 Å²	104	47%	0.472	53%	0.532	S	S	.	.	H	α-helix	trans	-63.1	-48.8	175.7	-69.2	166.5	177.8	0	0	110.5	Q214 K215 A220 M221 E222	Q214-E218 HydrophobicContact CG-CG 4.47Å; Q214-E218 VanDerWaalsContact CG-OE1 3.27Å; Q214-E218 WeakPolarHBondContact CG-OE1 3.41Å; Q214-E218 PolarHBondContact NE2-OE1 3.12Å; Q214-E218 WeakPolarHBondContact O-CG 3.48Å; Q214-E218 PolarHBondContact O-N 3.4Å; K215-E218 PolarHBondContact O-N 2.89Å; E218-A220 VanDerWaalsContact C-N 3.35Å; E218-A220 PolarHBondContact O-N 3.11Å; E218-M221 PolarHBondContact O-N 3.06Å; E218-E222 PolarHBondContact O-N 3.5Å
219	E	93.3	Very high	81.5	Confident	105 Å²	105	103.6 Å²	103.6	49%	0.491	55%	0.553	S	S	.	*	H	α-helix	trans	-60.2	-40.3	176.4	-71.1	169	167.6	0	0	112.6	K215 E222 G223	K215-E219 WeakPolarHBondContact CE-OE1 3.3Å; K215-E219 HydrophobicContact CG-CG 4.48Å; K215-E219 IonicContact NZ-OE1 2.73Å; K215-E219 WeakPolarHBondContact O-CG 3.43Å; K215-E219 PolarHBondContact O-N 3.17Å; E219-E222 PolarHBondContact O-N 3.17Å; E219-G223 PolarHBondContact O-N 3.13Å
220	A	91.9	Very high	79	Confident	63 Å²	63	105 Å²	105	52%	0.521	57%	0.567	S	S	.	*	H	α-helix	trans	-67.7	-36.3	176.8	0	0	0	0	0	112.7	R216 R217 E218 C224	R216-A220 VanDerWaalsContact O-CB 3.32Å; R216-A220 WeakPolarHBondContact O-CB 3.39Å; R216-A220 PolarHBondContact O-N 3.4Å; R217-A220 PolarHBondContact O-N 2.88Å; E218-A220 VanDerWaalsContact C-N 3.35Å; E218-A220 PolarHBondContact O-N 3.11Å; A220-C224 PolarHBondContact O-N 2.85Å
221	M	86.6	Confident	76.5	Confident	135 Å²	135	105.7 Å²	105.7	67%	0.665	58%	0.581	S	S	*	*	H	α-helix	trans	-69.9	-36.9	176.5	-176	178	-80.9	0	0	111.7	R217 E218	R217-M221 WeakPolarHBondContact O-CB 3.43Å; R217-M221 PolarHBondContact O-N 3.43Å; E218-M221 PolarHBondContact O-N 3.06Å
222	E	82.4	Confident	74.1	Confident	150 Å²	150	109.5 Å²	109.5	70%	0.701	61%	0.614	S	S	*	*	H	α-helix	trans	-72.9	-37.4	177.5	-166.1	150.6	-156	0	0	112	E218 E219 C224 R225 G226	E218-E222 PolarHBondContact O-N 3.5Å; E219-E222 PolarHBondContact O-N 3.17Å; E222-C224 VanDerWaalsContact C-N 3.26Å; E222-C224 PolarHBondContact O-N 2.9Å; E222-R225 PolarHBondContact O-N 3.36Å; E222-R225 VanDerWaalsContact O-N 3.08Å; E222-G226 PolarHBondContact O-N 3.29Å
223	G	71.4	Confident	71.3	Confident	54 Å²	54	118 Å²	118	56%	0.557	65%	0.651	S	S	*	*	H	α-helix	trans	-60.3	-28.3	172.7	0	0	0	0	0	114.6	E219	E219-G223 PolarHBondContact O-N 3.13Å
224	C	61.4	Low	68.8	Low	115 Å²	115	124.3 Å²	124.3	78%	0.777	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-16.9	174.9	-77.6	0	0	0	0	114.2	A220 E222	A220-C224 PolarHBondContact O-N 2.85Å; E222-C224 VanDerWaalsContact C-N 3.26Å; E222-C224 PolarHBondContact O-N 2.9Å
225	R	59.6	Low	65.9	Low	217 Å²	217	123.7 Å²	123.7	82%	0.819	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.9	-16.8	177	-73.2	-175.7	175.1	-145.8	-0.5	113	E222 S227	E222-R225 PolarHBondContact O-N 3.36Å; E222-R225 VanDerWaalsContact O-N 3.08Å; R225-S227 PolarHBondContact O-N 2.91Å
226	G	52.6	Low	63	Low	50 Å²	50	122.7 Å²	122.7	52%	0.515	72%	0.719	S	S	.	*			trans	-91.1	74.7	176.5	0	0	0	0	0	113.3	E222	E222-G226 PolarHBondContact O-N 3.29Å
227	S	51.3	Low	60.1	Low	114 Å²	114	119 Å²	119	80%	0.797	73%	0.727	S	S	*	*			trans	-134.5	79.3	156	-83.5	0	0	0	0	111.6	R225	R225-S227 PolarHBondContact O-N 2.91Å
228	P	50.1	Low	57.3	Low	120 Å²	120	115 Å²	115	78%	0.779	73%	0.726	S	S	*	*			trans	-84.1	112.7	139	25.3	-10.8	0	0	0	107.3	Q230	P228-Q230 PolarHBondContact O-N 3.28Å
229	G	49.4	Very low	54.8	Low	73 Å²	73	115.2 Å²	115.2	75%	0.753	73%	0.733	S	S	*	*			trans	-58.6	133.1	176.4	0	0	0	0	0	111.2
230	Q	44.7	Very low	52.2	Low	190 Å²	190	119.2 Å²	119.2	89%	0.888	75%	0.745	S	S	*	*			trans	-160	147.9	149.9	-107.5	172.5	26.2	0	0	110.4	P228	P228-Q230 PolarHBondContact O-N 3.28Å
231	P	46.7	Very low	49.5	Very low	126 Å²	126	120 Å²	120	82%	0.818	76%	0.759	S	S	*	*			trans	-84.1	163.4	-166.8	34.7	-33.3	0	0	0	113.4
232	A	45.5	Very low	47.5	Very low	93 Å²	93	118.7 Å²	118.7	77%	0.769	77%	0.77	S	S	*	*			trans	-48	144.6	-173.2	0	0	0	0	0	116.5
233	H	39.8	Very low	45.5	Very low	193 Å²	193	117.1 Å²	117.1	89%	0.894	78%	0.776	S	S	*	*			trans	-139.9	138.6	142.6	-143.4	-82	0	0	0	111.8
234	L	43.5	Very low	44.4	Very low	163 Å²	163	119.8 Å²	119.8	85%	0.853	79%	0.785	S	S	*	*			trans	-83	157	-168.9	-74	150.6	0	0	0	113.9
235	G	34.9	Very low	43	Very low	83 Å²	83	117.1 Å²	117.1	86%	0.856	78%	0.778	S	S	*	*			trans	112.3	127.7	156.2	0	0	0	0	0	112.9
236	G	34.8	Very low	42.1	Very low	83 Å²	83	114.4 Å²	114.4	86%	0.856	78%	0.779	S	S	*	*			cis	149.8	136.1	10.2	0	0	0	0	0	107.1
237	G	34.4	Very low	41.2	Very low	73 Å²	73	118.4 Å²	118.4	75%	0.753	79%	0.789	S	S	*	*			trans	103.7	98.2	159.2	0	0	0	0	0	118.6
238	T	35.8	Very low	40.4	Very low	115 Å²	115	119.6 Å²	119.6	71%	0.706	79%	0.787	S	S	*	*			trans	-3.2	141.4	132.8	34	0	0	0	0	117.1	Y240	T238-Y240 HydrophobicContact CG2-CE1 4.06Å
239	V	40.6	Very low	39.9	Very low	105 Å²	105	121.8 Å²	121.8	64%	0.636	79%	0.792	S	S	*	*				-173.3	131.3	70.2	161.6	0	0	0	0	108.7
240	Y	38.4	Very low	39.4	Very low	189 Å²	189	121.6 Å²	121.6	74%	0.741	78%	0.779	S	S	*	*			trans	-24.7	119	153.6	18.4	-84.1	0	0	0	116.9	T238	T238-Y240 HydrophobicContact CG2-CE1 4.06Å
241	G	36	Very low	39.3	Very low	79 Å²	79	116.8 Å²	116.8	81%	0.814	76%	0.759	S	S	*	*			trans	-120.2	93.7	161.8	0	0	0	0	0	110.1	S243	G241-S243 PolarHBondContact O-N 3.41Å
242	A	44.3	Very low	38.7	Very low	107 Å²	107	116.7 Å²	116.7	88%	0.884	75%	0.752	S	S	*	*			trans	-71.4	113.7	169.2	0	0	0	0	0	108.8
243	S	40	Very low	38.4	Very low	118 Å²	118	115.5 Å²	115.5	83%	0.825	73%	0.733	S	S	*	*			trans	-101.1	102.3	165.6	-171.7	0	0	0	0	108	G241 G245	G241-S243 PolarHBondContact O-N 3.41Å; S243-G245 PolarHBondContact O-N 3.39Å
244	S	48	Very low	38.2	Very low	109 Å²	109	117.2 Å²	117.2	76%	0.762	73%	0.731	S	S	*	*			trans	-67.7	104.3	167.1	54.3	0	0	0	0	108.9
245	G	32.3	Very low	37.9	Very low	60 Å²	60	118.2 Å²	118.2	62%	0.619	73%	0.731	S	S	*	*			trans	-109.8	99	163.3	0	0	0	0	0	108	S243 D247	S243-G245 PolarHBondContact O-N 3.39Å; G245-D247 PolarHBondContact O-N 3.35Å
246	D	40.3	Very low	37.8	Very low	159 Å²	159	117.9 Å²	117.9	85%	0.85	73%	0.728	S	S	*	*			trans	-71.3	102.5	166.3	-69.2	-48.3	0	0	0	108.1
247	D	35.2	Very low	38.1	Very low	135 Å²	135	119.8 Å²	119.8	72%	0.722	73%	0.729	S	S	*	*			trans	-117.3	100.2	166.1	-71.4	-38.1	0	0	0	109.1	G245 D249	G245-D247 PolarHBondContact O-N 3.35Å; D247-D249 PolarHBondContact O-N 2.82Å
248	D	33.3	Very low	38.1	Very low	139 Å²	139	119.4 Å²	119.4	74%	0.743	72%	0.724	S	S	*	*			trans	-66.9	100.3	169.8	-152.9	-35.4	0	0	0	108.5	S250	D248-S250 PolarHBondContact O-N 3.34Å; D248-S250 PolarHBondContact OD1-OG 3.06Å
249	D	39.3	Very low	38.4	Very low	165 Å²	165	122.7 Å²	122.7	88%	0.882	74%	0.738	S	S	*	*			trans	-78.4	61.8	170.4	-150.6	2.4	0	0	0	108.5	D247 D251	D247-D249 PolarHBondContact O-N 2.82Å; D249-D251 PolarHBondContact O-N 2.85Å
250	S	38.9	Very low	38.2	Very low	70 Å²	70	120.3 Å²	120.3	49%	0.49	74%	0.735	S	S	.	*			trans	-72	104.3	168.4	-83.2	0	0	0	0	107.4	D248 D252	D248-S250 PolarHBondContact O-N 3.34Å; D248-S250 PolarHBondContact OD1-OG 3.06Å; S250-D252 PolarHBondContact O-N 3.02Å
251	D	42.7	Very low	38	Very low	88 Å²	88	119.3 Å²	119.3	47%	0.471	74%	0.742	S	S	.	*			trans	-58.3	80.5	148.4	-92.9	-52.1	0	0	0	106.7	R76 D249 D253	R76-D251 IonicContact CZ-OD1 2.83Å; R76-D251 IonicContact NH1-OD1 2.85Å; R76-D251 PolarHBondContact NH1-OD1 3.26Å; R76-D251 IonicContact NH2-OD1 3.87Å; D249-D251 PolarHBondContact O-N 2.85Å; D251-D253 PolarHBondContact O-N 3.34Å
252	D	34.3	Very low	38.3	Very low	124 Å²	124	122.2 Å²	122.2	66%	0.663	73%	0.728	S	S	*	*			trans	-72.3	82.3	176.4	-145.6	-5.5	0	0	0	107.2	S250 R254	S250-D252 PolarHBondContact O-N 3.02Å; D252-R254 PolarHBondContact O-N 3.32Å
253	D	40.3	Very low	37.7	Very low	68 Å²	68	121.2 Å²	121.2	36%	0.364	71%	0.713	S	S	.	*			trans	-68.9	80.8	165.4	-81.3	-49.2	0	0	0	106.8	K51 D251 E255	K51-D253 IonicContact NZ-OD1 3.46Å; K51-D253 PolarHBondContact NZ-OD1 2.71Å; K51-D253 IonicContact NZ-OD2 2.9Å; D251-D253 PolarHBondContact O-N 3.34Å; D253-E255 PolarHBondContact O-N 3.04Å
254	R	35.6	Very low	37.7	Very low	230 Å²	230	121.7 Å²	121.7	87%	0.868	72%	0.716	S	S	*	*			trans	-62.4	111.2	162.8	-91.9	-171.9	178.2	-163.5	-0.9	108.2	D252 G256	D252-R254 PolarHBondContact O-N 3.32Å; R254-G256 PolarHBondContact O-N 3.34Å
255	E	36.9	Very low	37.2	Very low	183 Å²	183	123.3 Å²	123.3	86%	0.855	71%	0.712	S	S	*	*			trans	-67.2	114.9	177.8	-61.1	-168.7	151.9	0	0	110.1	D253	D253-E255 PolarHBondContact O-N 3.04Å
256	G	33.1	Very low	37.4	Very low	77 Å²	77	124.6 Å²	124.6	79%	0.794	71%	0.708	S	S	*	*			trans	-89.2	99.6	147.5	0	0	0	0	0	106.6	R254 G258	R254-G256 PolarHBondContact O-N 3.34Å; G256-G258 PolarHBondContact O-N 3.3Å; G256-G258 VanDerWaalsContact O-N 3.08Å
257	S	40.8	Very low	37.2	Very low	123 Å²	123	123.9 Å²	123.9	86%	0.86	70%	0.699	S	S	*	*			trans	-60.2	105.5	168.5	49	0	0	0	0	108.8
258	G	34.8	Very low	37.3	Very low	64 Å²	64	122.5 Å²	122.5	66%	0.66	69%	0.687	S	S	*	*			trans	-151.2	91.6	170.6	0	0	0	0	0	106.8	G256 G260	G256-G258 PolarHBondContact O-N 3.3Å; G256-G258 VanDerWaalsContact O-N 3.08Å; G258-G260 PolarHBondContact O-N 2.73Å
259	D	40.8	Very low	37.3	Very low	184 Å²	184	124.3 Å²	124.3	98%	0.984	68%	0.684	S	S	*	*			trans	-61.6	92.2	162.3	-73.7	-37.9	0	0	0	107
260	G	35.9	Very low	37.3	Very low	56 Å²	56	122.3 Å²	122.3	58%	0.577	68%	0.679	S	S	*	*			trans	-114.2	103.4	174.1	0	0	0	0	0	108	G258 W262	G258-G260 PolarHBondContact O-N 2.73Å; G260-W262 PolarHBondContact O-N 2.91Å; G260-W262 VanDerWaalsContact O-N 3.12Å
261	D	35.1	Very low	37.2	Very low	167 Å²	167	124.7 Å²	124.7	89%	0.893	70%	0.695	S	S	*	*			trans	-46.9	113.6	160.3	-167.1	25.8	0	0	0	108	P263	D261-P263 VanDerWaalsContact O-CD 3.29Å; D261-P263 WeakPolarHBondContact O-CD 3.23Å
262	W	41.8	Very low	37	Very low	140 Å²	140	124.2 Å²	124.2	53%	0.53	71%	0.711	S	S	.	*			trans	-86.9	113	-171.7	-168.3	-101.6	0	0	0	108.2	L69 G260 S264 V266	L69-W262 HydrophobicContact CD2-CE3 4.44Å; L69-W262 HydrophobicContact CD2-CZ3 3.8Å; L69-W262 HydrophobicContact CG-CH2 4.27Å; L69-W262 HydrophobicContact CG-CZ3 3.78Å; G260-W262 PolarHBondContact O-N 2.91Å; G260-W262 VanDerWaalsContact O-N 3.12Å; W262-S264 PolarHBondContact O-N 3.1Å; W262-V266 HydrophobicContact CZ2-CG2 4.36Å
263	P	31.9	Very low	36.9	Very low	86 Å²	86	124.6 Å²	124.6	56%	0.558	72%	0.718	S	S	*	*			trans	-63.4	125	179.3	24	-30.2	0	0	0	108.9	D261 Q265	D261-P263 VanDerWaalsContact O-CD 3.29Å; D261-P263 WeakPolarHBondContact O-CD 3.23Å; P263-Q265 PolarHBondContact O-N 3.28Å
264	S	41.2	Very low	37.1	Very low	128 Å²	128	126.6 Å²	126.6	90%	0.895	74%	0.737	S	S	*	*	S	Bend	trans	-65.2	19.6	-179.7	47	0	0	0	0	114.5	W262	W262-S264 PolarHBondContact O-N 3.1Å
265	Q	37.6	Very low	37.2	Very low	143 Å²	143	123.8 Å²	123.8	67%	0.668	73%	0.726	S	S	*	*			trans	-150.7	80.2	-172.2	-151	170.7	-5.7	0	0	109.7	P263 E267	P263-Q265 PolarHBondContact O-N 3.28Å; Q265-E267 HydrophobicContact CG-CG 4.44Å
266	V	35.2	Very low	37.4	Very low	88 Å²	88	117 Å²	117	53%	0.533	70%	0.7	S	S	.	*			trans	-95.5	89.9	163.6	179.5	0	0	0	0	106.2	W262 F268	W262-V266 HydrophobicContact CZ2-CG2 4.36Å; V266-F268 HydrophobicContact CG1-CD2 3.74Å; V266-F268 HydrophobicContact CG1-CE2 4.5Å; V266-F268 PolarHBondContact O-N 3.19Å
267	E	37	Very low	38	Very low	143 Å²	143	117.4 Å²	117.4	67%	0.668	70%	0.695	S	S	*	*			trans	-66.1	112.8	168.8	-75.4	-169.5	167.7	0	0	108.6	Q265	Q265-E267 HydrophobicContact CG-CG 4.44Å
268	F	36.6	Very low	38.1	Very low	106 Å²	106	112.2 Å²	112.2	47%	0.465	66%	0.657	S	S	.	*			trans	-121.9	108.4	176.1	-125.9	-66.5	0	0	0	110.5	R72 V266	R72-F268 HydrophobicContact CG-CE2 4.35Å; V266-F268 HydrophobicContact CG1-CD2 3.74Å; V266-F268 HydrophobicContact CG1-CE2 4.5Å; V266-F268 PolarHBondContact O-N 3.19Å
269	Y	34.2	Very low	38	Very low	177 Å²	177	114 Å²	114	69%	0.694	65%	0.648	S	S	*	*			trans	62.3	83	178	-66.2	-65.1	0	0	0	117.7	R72	R72-Y269 VanDerWaalsContact NH1-CZ 3.29Å; R72-Y269 PolarHBondContact NH1-OH 2.83Å; R72-Y269 PolarHBondContact NH2-OH 3.42Å
270	T	38.8	Very low	37.6	Very low	124 Å²	124	113.7 Å²	113.7	76%	0.761	66%	0.66	S	S	*	*			trans	-93.2	115.1	151.4	52.8	0	0	0	0	109.5
271	S	37.4	Very low	37.6	Very low	119 Å²	119	116.6 Å²	116.6	83%	0.832	66%	0.664	S	S	*	*			trans	-154.2	78.9	145.6	66.2	0	0	0	0	110.2
272	G	37.8	Very low	37.8	Very low	79 Å²	79	113.9 Å²	113.9	81%	0.814	65%	0.652	S	S	*	*	S	Bend		100.2	14.6	129.7	0	0	0	0	0	120
273	V	32.6	Very low	37.5	Very low	132 Å²	132	112.4 Å²	112.4	80%	0.8	66%	0.659	S	S	*	*			trans	-138.4	118.7	160.3	-165.8	0	0	0	0	109.8	W275	V273-W275 PolarHBondContact O-N 3Å
274	S	43.6	Very low	37.9	Very low	110 Å²	110	114 Å²	114	77%	0.769	67%	0.665	S	S	*	*			trans	-66.2	107.1	172.3	175.3	0	0	0	0	109.7
275	W	38.7	Very low	37.7	Very low	170 Å²	170	113.1 Å²	113.1	64%	0.644	65%	0.651	S	S	*	*			trans	-138.6	82.7	153	-95.3	75	0	0	0	108.1	M1 V273	M1-W275 HydrophobicContact SD-CH2 3.82Å; M1-W275 HydrophobicContact SD-CZ3 4.03Å; V273-W275 PolarHBondContact O-N 3Å
276	S	40.6	Very low	37.7	Very low	42 Å²	42	111.1 Å²	111.1	29%	0.294	65%	0.65	S	S	.	*				38.9	98.9	129.8	46.1	0	0	0	0	117.3	F278	S276-F278 PolarHBondContact O-N 2.93Å
277	A	46.5	Very low	37.9	Very low	84 Å²	84	112.8 Å²	112.8	69%	0.694	66%	0.658	S	S	*	*	S	Bend	trans	-51.8	-34.1	177.5	0	0	0	0	0	112.7
278	F	42.7	Very low	37.9	Very low	15 Å²	15	110.5 Å²	110.5	7%	0.066	66%	0.657	C	S	.	*	S	Bend	trans	-155	36	172.5	-77.1	-94.7	0	0	0	113.6	E121 W122 H125 S276	E121-F278 HydrophobicContact CB-CB 3.33Å; E121-F278 HydrophobicContact CB-CD1 3.81Å; E121-F278 HydrophobicContact CB-CD2 4.13Å; E121-F278 HydrophobicContact CB-CG 3.54Å; E121-F278 HydrophobicContact CG-CB 3.36Å; E121-F278 HydrophobicContact CG-CG 4.16Å; E121-F278 WeakPolarHBondContact OE2-CB 3.47Å; W122-F278 HydrophobicContact CD2-CE1 4.18Å; W122-F278 HydrophobicContact CD2-CE2 4.34Å; W122-F278 AromaticContact CD2-CZ 3.64Å; W122-F278 HydrophobicContact CD2-CZ 3.64Å; W122-F278 AromaticContact CE2-CE2 3.84Å; W122-F278 AromaticContact CE2-CZ 3.47Å; W122-F278 VanDerWaalsContact CE2-CZ 3.47Å; W122-F278 HydrophobicContact CE3-CE1 4.39Å; W122-F278 HydrophobicContact CE3-CZ 4.05Å; W122-F278 HydrophobicContact CG-CE1 4.41Å; W122-F278 HydrophobicContact CG-CZ 4.08Å; W122-F278 HydrophobicContact CH2-CZ 4.16Å; W122-F278 HydrophobicContact CZ2-CE2 4.18Å; W122-F278 AromaticContact CZ2-CZ 3.75Å; W122-F278 HydrophobicContact CZ2-CZ 3.75Å; W122-F278 HydrophobicContact CZ3-CZ 4.31Å; W122-F278 AromaticContact NE1-CE2 3.72Å; W122-F278 AromaticContact NE1-CZ 3.8Å; H125-F278 HydrophobicContact CB-CD1 4.13Å; H125-F278 HydrophobicContact CB-CE1 4.05Å; H125-F278 AromaticContact CE1-CD1 3.42Å; H125-F278 VanDerWaalsContact CE1-CD1 3.42Å; H125-F278 WeakPolarHBondContact CE1-CD1 3.26Å; H125-F278 AromaticContact CG-CD1 3.58Å; H125-F278 AromaticContact CG-CE1 3.97Å; H125-F278 AromaticContact ND1-CD1 2.99Å; H125-F278 WeakPolarHBondContact ND1-CD1 3.41Å; H125-F278 AromaticContact ND1-CE1 3.48Å; H125-F278 WeakPolarHBondContact ND1-CE1 3.21Å; H125-F278 AromaticContact ND1-CG 3.99Å; S276-F278 PolarHBondContact O-N 2.93Å
279	H	32	Very low	38	Very low	100 Å²	100	110.8 Å²	110.8	46%	0.463	67%	0.673	S	S	.	*			trans	86.7	105.4	-177.3	-60.8	-69.8	0	0	0	117.3	H125	H125-H279 AromaticContact CE1-CD2 3.68Å; H125-H279 AromaticContact NE2-CD2 3.42Å; H125-H279 PolarHBondContact NE2-CD2 2.97Å
280	S	31.7	Very low	38.4	Very low	178 Å²	178	104.8 Å²	104.8	100%	1.245	67%	0.671	S	S	*	*			trans	69.2	0	171.1	-50.7	0	0	0	0	117

Retrieved 280 of 280 residues in 46.3 ms (Link to these results)

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