G4VJT2_SCHMA Loading...

Large ribosomal subunit protein uL1

AlphaFold DB , UniProt , Accession G4VJT2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 217 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	46.9	Very low	77.6	Confident	227 Å²	227	98.5 Å²	98.5	100%	1.118	48%	0.484	S	S	*	.				0	123.4	0	-64.7	-172.4	-148.3	0	0	109.1
2	S	61.5	Low	78.5	Confident	53 Å²	53	90.8 Å²	90.8	37%	0.371	45%	0.446	S	S	.	.			trans	-72	126.3	177.3	-51.6	0	0	0	0	109.1	V4 N188	S2-V4 PolarHBondContact O-N 2.97Å; S2-N188 PolarHBondContact OG-OD1 3.08Å
3	K	71.7	Confident	79.1	Confident	112 Å²	112	83.9 Å²	83.9	49%	0.487	41%	0.413	S	S	.	.	S	Bend	trans	-74.9	-8.1	179.3	-72.4	-164.5	174	-165.9	0	113.9	W198 Y217	K3-W198 HydrophobicContact CB-CD2 4.06Å; K3-W198 HydrophobicContact CB-CE3 3.92Å; K3-W198 HydrophobicContact CB-CH2 4.06Å; K3-W198 HydrophobicContact CB-CZ2 4.19Å; K3-W198 HydrophobicContact CB-CZ3 3.91Å; K3-W198 HydrophobicContact CD-CB 4.15Å; K3-W198 HydrophobicContact CD-CD2 4Å; K3-W198 HydrophobicContact CD-CE3 4.03Å; K3-W198 HydrophobicContact CD-CG 4.06Å; K3-W198 HydrophobicContact CG-CD2 3.85Å; K3-W198 HydrophobicContact CG-CE3 4.11Å; K3-W198 HydrophobicContact CG-CG 4.12Å; K3-Y217 HydrophobicContact CB-CD2 4.33Å; K3-Y217 HydrophobicContact CB-CE2 4.07Å; K3-Y217 HydrophobicContact CD-CE2 3.74Å; K3-Y217 PolarHBondContact NZ-OH 2.76Å
4	V	75.8	Confident	79.7	Confident	15 Å²	15	80.9 Å²	80.9	9%	0.091	41%	0.408	C	S	.	.	S	Bend	trans	-90	120.1	-177.5	178.6	0	0	0	0	108.7	S2 K6 L9 I187 W198 L204 L216	S2-V4 PolarHBondContact O-N 2.97Å; V4-K6 PolarHBondContact O-N 3.4Å; V4-L9 HydrophobicContact CG1-CB 4.37Å; V4-L9 HydrophobicContact CG1-CD1 4.5Å; V4-I187 HydrophobicContact CG2-CD1 4.34Å; V4-W198 HydrophobicContact CG2-CH2 3.9Å; V4-W198 HydrophobicContact CG2-CZ3 4.35Å; V4-L204 HydrophobicContact CG2-CD1 4.03Å; V4-L216 HydrophobicContact CG1-CB 4.2Å; V4-L216 HydrophobicContact CG1-CD1 4.29Å; V4-L216 HydrophobicContact CG1-CD2 4.21Å; V4-L216 HydrophobicContact CG1-CG 4.5Å; V4-L216 HydrophobicContact CG2-CB 4.47Å
5	P	82.4	Confident	80.2	Confident	69 Å²	69	80.1 Å²	80.1	45%	0.448	41%	0.405	S	S	.	.			trans	-61.2	131.9	175.3	-18.7	30.5	0	0	0	110.5	D7 L8 L9	P5-D7 VanDerWaalsContact C-N 3.27Å; P5-D7 PolarHBondContact O-N 3.49Å; P5-L8 HydrophobicContact CB-CB 3.96Å; P5-L8 HydrophobicContact CG-CB 4.27Å; P5-L8 PolarHBondContact O-N 3.37Å; P5-L9 PolarHBondContact O-N 2.86Å; P5-L9 VanDerWaalsContact O-N 3.09Å
6	K	82.5	Confident	80.5	Confident	152 Å²	152	75.4 Å²	75.4	66%	0.661	38%	0.381	S	S	*	.	H	α-helix	trans	-62	-38.1	179.7	-68.6	-177.8	-179.3	177.4	0	111.5	V4 L9 L10	V4-K6 PolarHBondContact O-N 3.4Å; K6-L9 WeakPolarHBondContact O-CB 3.48Å; K6-L9 PolarHBondContact O-N 3.26Å; K6-L10 PolarHBondContact O-N 2.97Å
7	D	84.3	Confident	80.7	Confident	129 Å²	129	71.8 Å²	71.8	69%	0.69	36%	0.363	S	S	*	.	H	α-helix	trans	-66	-42.3	179.8	-51.3	-71.2	0	0	0	111.8	P5 L9 L10 R11	P5-D7 VanDerWaalsContact C-N 3.27Å; P5-D7 PolarHBondContact O-N 3.49Å; D7-L9 VanDerWaalsContact C-N 3.3Å; D7-L9 PolarHBondContact O-N 3.46Å; D7-L10 PolarHBondContact O-N 3.44Å; D7-R11 VanDerWaalsContact O-CB 3.29Å; D7-R11 WeakPolarHBondContact O-CB 3.29Å; D7-R11 PolarHBondContact O-N 3.44Å
8	L	86.7	Confident	80.9	Confident	69 Å²	69	71.5 Å²	71.5	36%	0.361	36%	0.363	S	S	.	.	H	α-helix	trans	-63.2	-39.6	175.2	-177	65.6	0	0	0	111.1	P5 S12	P5-L8 HydrophobicContact CB-CB 3.96Å; P5-L8 HydrophobicContact CG-CB 4.27Å; P5-L8 PolarHBondContact O-N 3.37Å; L8-S12 VanDerWaalsContact O-CB 3.25Å; L8-S12 WeakPolarHBondContact O-CB 3.34Å; L8-S12 PolarHBondContact O-N 3.4Å; L8-S12 PolarHBondContact O-OG 2.85Å
9	L	86	Confident	81	Confident	10 Å²	10	70.4 Å²	70.4	5%	0.052	35%	0.354	C	S	.	.	H	α-helix	trans	-63.7	-50	178	-175.8	74.7	0	0	0	111.4	V4 P5 K6 D7 S12 C13 A180 I183 N184 I206 L216	V4-L9 HydrophobicContact CG1-CB 4.37Å; V4-L9 HydrophobicContact CG1-CD1 4.5Å; P5-L9 PolarHBondContact O-N 2.86Å; P5-L9 VanDerWaalsContact O-N 3.09Å; K6-L9 WeakPolarHBondContact O-CB 3.48Å; K6-L9 PolarHBondContact O-N 3.26Å; D7-L9 VanDerWaalsContact C-N 3.3Å; D7-L9 PolarHBondContact O-N 3.46Å; L9-S12 PolarHBondContact O-N 2.9Å; L9-C13 WeakPolarHBondContact O-CB 3.34Å; L9-C13 PolarHBondContact O-N 3.09Å; L9-C13 PolarHBondContact O-SG 3.39Å; L9-A180 HydrophobicContact CD2-CB 3.71Å; L9-A180 WeakPolarHBondContact CD2-O 3.15Å; L9-A180 HydrophobicContact CG-CB 4.04Å; L9-I183 HydrophobicContact CD1-CB 4.08Å; L9-I183 HydrophobicContact CD1-CD1 4.29Å; L9-I183 HydrophobicContact CD1-CG2 3.55Å; L9-N184 HydrophobicContact CD2-CB 4.38Å; L9-I206 HydrophobicContact CD1-CD1 3.91Å; L9-L216 HydrophobicContact CD1-CD1 3.83Å; L9-L216 HydrophobicContact CD1-CD2 3.96Å
10	L	87.6	Confident	80.9	Confident	71 Å²	71	67.1 Å²	67.1	37%	0.372	34%	0.338	S	S	.	.	H	α-helix	trans	-61.9	-46.3	179.2	-77.1	167.1	0	0	0	111.4	K6 D7 S12 C13 A14 E177 A180	K6-L10 PolarHBondContact O-N 2.97Å; D7-L10 PolarHBondContact O-N 3.44Å; L10-S12 PolarHBondContact O-N 2.89Å; L10-C13 PolarHBondContact O-N 3.11Å; L10-A14 WeakPolarHBondContact O-CB 3.43Å; L10-A14 PolarHBondContact O-N 2.92Å; L10-E177 HydrophobicContact CD2-CG 4.35Å; L10-A180 HydrophobicContact CD2-CB 3.78Å; L10-A180 HydrophobicContact CG-CB 4.38Å
11	R	88.7	Confident	80.8	Confident	177 Å²	177	67.5 Å²	67.5	67%	0.668	34%	0.341	S	S	*	.	H	α-helix	trans	-60.1	-46.8	176.3	-175.3	177	177.9	171.9	2.2	111.9	D7 C13 A14 D15	D7-R11 VanDerWaalsContact O-CB 3.29Å; D7-R11 WeakPolarHBondContact O-CB 3.29Å; D7-R11 PolarHBondContact O-N 3.44Å; R11-C13 VanDerWaalsContact C-N 3.31Å; R11-C13 PolarHBondContact O-N 3.12Å; R11-A14 PolarHBondContact O-N 3.13Å; R11-D15 VanDerWaalsContact O-CG 3.24Å; R11-D15 PolarHBondContact O-N 3Å
12	S	87.5	Confident	82.3	Confident	5 Å²	5	64.4 Å²	64.4	4%	0.035	32%	0.322	C	S	.	.	H	α-helix	trans	-63	-38	178.3	-58.2	0	0	0	0	111.9	L8 L9 L10 I16	L8-S12 VanDerWaalsContact O-CB 3.25Å; L8-S12 WeakPolarHBondContact O-CB 3.34Å; L8-S12 PolarHBondContact O-N 3.4Å; L8-S12 PolarHBondContact O-OG 2.85Å; L9-S12 PolarHBondContact O-N 2.9Å; L10-S12 PolarHBondContact O-N 2.89Å; S12-I16 WeakPolarHBondContact O-CD1 3.38Å; S12-I16 WeakPolarHBondContact O-CG1 3.41Å; S12-I16 PolarHBondContact O-N 3.15Å; S12-I16 VanDerWaalsContact O-N 3.09Å
13	C	86.2	Confident	83.1	Confident	2 Å²	2	66.1 Å²	66.1	1%	0.014	33%	0.33	C	S	.	.	H	α-helix	trans	-67	-42.9	175.3	-66	0	0	0	0	111.4	L9 L10 R11 I16 L17 P176 L179 I183	L9-C13 WeakPolarHBondContact O-CB 3.34Å; L9-C13 PolarHBondContact O-N 3.09Å; L9-C13 PolarHBondContact O-SG 3.39Å; L10-C13 PolarHBondContact O-N 3.11Å; R11-C13 VanDerWaalsContact C-N 3.31Å; R11-C13 PolarHBondContact O-N 3.12Å; C13-I16 PolarHBondContact O-N 3.14Å; C13-L17 WeakPolarHBondContact O-CB 3.44Å; C13-L17 VanDerWaalsContact O-CG 3.28Å; C13-L17 WeakPolarHBondContact O-CG 3.14Å; C13-L17 PolarHBondContact O-N 2.95Å; C13-P176 HydrophobicContact CB-CB 4.26Å; C13-L179 HydrophobicContact CB-CB 4.36Å; C13-I183 VanDerWaalsContact SG-CD1 3.53Å
14	A	87.4	Confident	83.4	Confident	41 Å²	41	67.6 Å²	67.6	34%	0.339	33%	0.332	S	S	.	.	H	α-helix	trans	-61.5	-45.6	176.2	0	0	0	0	0	111.6	L10 R11 I16 L17 D18	L10-A14 WeakPolarHBondContact O-CB 3.43Å; L10-A14 PolarHBondContact O-N 2.92Å; R11-A14 PolarHBondContact O-N 3.13Å; A14-I16 PolarHBondContact O-N 3.44Å; A14-L17 PolarHBondContact O-N 2.99Å; A14-D18 VanDerWaalsContact O-CB 3.29Å; A14-D18 WeakPolarHBondContact O-CB 3.47Å; A14-D18 PolarHBondContact O-N 2.91Å
15	D	87.2	Confident	83.6	Confident	69 Å²	69	74.9 Å²	74.9	37%	0.369	36%	0.362	S	S	.	.	H	α-helix	trans	-61.1	-42.5	177.9	-68.4	-16.1	0	0	0	111.8	R11 D18 Y19 H214	R11-D15 VanDerWaalsContact O-CG 3.24Å; R11-D15 PolarHBondContact O-N 3Å; D15-D18 PolarHBondContact O-N 3.03Å; D15-Y19 WeakPolarHBondContact O-CB 3.4Å; D15-Y19 PolarHBondContact O-N 2.96Å; D15-H214 IonicContact OD2-CE1 3.86Å
16	I	85.6	Confident	83.6	Confident	5 Å²	5	75.6 Å²	75.6	3%	0.026	36%	0.356	C	S	.	.	H	α-helix	trans	-64.1	-44.4	177	-70.3	168.2	0	0	0	110.9	S12 C13 A14 S20 V32 I206 H214	S12-I16 WeakPolarHBondContact O-CD1 3.38Å; S12-I16 WeakPolarHBondContact O-CG1 3.41Å; S12-I16 PolarHBondContact O-N 3.15Å; S12-I16 VanDerWaalsContact O-N 3.09Å; C13-I16 PolarHBondContact O-N 3.14Å; A14-I16 PolarHBondContact O-N 3.44Å; I16-S20 VanDerWaalsContact O-CB 3.26Å; I16-S20 WeakPolarHBondContact O-CB 3.48Å; I16-S20 PolarHBondContact O-N 2.63Å; I16-S20 PolarHBondContact O-OG 3.3Å; I16-V32 HydrophobicContact CG2-CG2 4.33Å; I16-I206 HydrophobicContact CD1-CB 3.86Å; I16-I206 HydrophobicContact CD1-CG2 3.43Å; I16-I206 VanDerWaalsContact CD1-CG2 3.43Å; I16-H214 WeakPolarHBondContact CG1-CD2 3.29Å
17	L	84.3	Confident	83.5	Confident	15 Å²	15	79 Å²	79	8%	0.079	37%	0.371	C	S	.	.	H	α-helix	trans	-65.9	-42	178.5	-74.1	179.2	0	0	0	111.5	C13 A14 S20 N21 V172 M174 P176 L179	C13-L17 WeakPolarHBondContact O-CB 3.44Å; C13-L17 VanDerWaalsContact O-CG 3.28Å; C13-L17 WeakPolarHBondContact O-CG 3.14Å; C13-L17 PolarHBondContact O-N 2.95Å; A14-L17 PolarHBondContact O-N 2.99Å; L17-S20 PolarHBondContact O-N 3.12Å; L17-N21 VanDerWaalsContact O-CB 3.22Å; L17-N21 WeakPolarHBondContact O-CB 3.38Å; L17-N21 PolarHBondContact O-N 3.3Å; L17-N21 PolarHBondContact O-ND2 3.38Å; L17-N21 VanDerWaalsContact O-ND2 3.17Å; L17-V172 HydrophobicContact CD2-CB 4.33Å; L17-V172 HydrophobicContact CD2-CG1 4.18Å; L17-V172 VanDerWaalsContact CD2-O 3.25Å; L17-V172 WeakPolarHBondContact CD2-O 3.39Å; L17-M174 WeakPolarHBondContact CD1-O 3.28Å; L17-P176 HydrophobicContact CD1-CB 3.95Å; L17-P176 HydrophobicContact CD1-CG 4.35Å; L17-L179 HydrophobicContact CD1-CD1 3.91Å; L17-L179 HydrophobicContact CD2-CD1 3.78Å; L17-L179 HydrophobicContact CG-CD1 3.86Å
18	D	84.8	Confident	83.5	Confident	66 Å²	66	77.4 Å²	77.4	35%	0.353	36%	0.358	S	S	.	.	H	α-helix	trans	-65	-46.7	179.4	-164.4	61.7	0	0	0	111.2	A14 D15 S20 N21 K22 V23	A14-D18 VanDerWaalsContact O-CB 3.29Å; A14-D18 WeakPolarHBondContact O-CB 3.47Å; A14-D18 PolarHBondContact O-N 2.91Å; D15-D18 PolarHBondContact O-N 3.03Å; D18-S20 VanDerWaalsContact C-N 3.34Å; D18-S20 PolarHBondContact O-N 3.29Å; D18-N21 PolarHBondContact O-N 3.43Å; D18-K22 WeakPolarHBondContact O-CA 3.32Å; D18-K22 WeakPolarHBondContact O-CB 3.16Å; D18-K22 PolarHBondContact O-N 3.35Å; D18-K22 WeakPolarHBondContact OD1-CD 3.27Å; D18-K22 WeakPolarHBondContact OD1-CE 3.47Å; D18-K22 IonicContact OD1-NZ 2.68Å; D18-K22 PolarHBondContact OD1-NZ 3.17Å; D18-V23 PolarHBondContact O-N 3.49Å
19	Y	82.5	Confident	83.3	Confident	50 Å²	50	76.6 Å²	76.6	20%	0.196	36%	0.356	C	S	.	.	I	π-helix	trans	-61.3	-43	176.2	-174.6	-97	0	0	0	112.3	D15 V23 R24	D15-Y19 WeakPolarHBondContact O-CB 3.4Å; D15-Y19 PolarHBondContact O-N 2.96Å; Y19-V23 HydrophobicContact CD2-CB 3.88Å; Y19-V23 HydrophobicContact CD2-CG1 4.04Å; Y19-V23 HydrophobicContact CD2-CG2 4.14Å; Y19-V23 HydrophobicContact CE2-CB 4.23Å; Y19-V23 HydrophobicContact CE2-CG1 3.93Å; Y19-V23 HydrophobicContact CG-CB 4.46Å; Y19-V23 PolarHBondContact O-N 2.9Å; Y19-R24 PolarHBondContact O-N 3.48Å
20	S	79.2	Confident	83.2	Confident	5 Å²	5	76.3 Å²	76.3	4%	0.035	36%	0.355	C	S	.	.	I	π-helix	trans	-75.2	-31.6	-176.4	-54.9	0	0	0	0	113.1	I16 L17 D18 K25 S208	I16-S20 VanDerWaalsContact O-CB 3.26Å; I16-S20 WeakPolarHBondContact O-CB 3.48Å; I16-S20 PolarHBondContact O-N 2.63Å; I16-S20 PolarHBondContact O-OG 3.3Å; L17-S20 PolarHBondContact O-N 3.12Å; D18-S20 VanDerWaalsContact C-N 3.34Å; D18-S20 PolarHBondContact O-N 3.29Å; S20-K25 WeakPolarHBondContact O-CA 3.46Å; S20-S208 PolarHBondContact OG-OG 3.36Å
21	N	78.5	Confident	83.2	Confident	76 Å²	76	74.3 Å²	74.3	41%	0.406	35%	0.345	S	S	.	.	I	π-helix	trans	-93.5	-38	-178	-75	-45.7	0	0	0	113.6	L17 D18 V172	L17-N21 VanDerWaalsContact O-CB 3.22Å; L17-N21 WeakPolarHBondContact O-CB 3.38Å; L17-N21 PolarHBondContact O-N 3.3Å; L17-N21 PolarHBondContact O-ND2 3.38Å; L17-N21 VanDerWaalsContact O-ND2 3.17Å; D18-N21 PolarHBondContact O-N 3.43Å; N21-V172 WeakPolarHBondContact ND2-CG1 3.41Å; N21-V172 PolarHBondContact ND2-O 3.44Å; N21-V172 WeakPolarHBondContact OD1-CG1 3.15Å
22	K	78.1	Confident	83.2	Confident	162 Å²	162	66 Å²	66	70%	0.704	31%	0.314	S	S	*	.	I	π-helix	trans	-103.8	-47.2	-172.8	-57.4	-168.2	-166.6	147.2	0	113.4	D18	D18-K22 WeakPolarHBondContact O-CA 3.32Å; D18-K22 WeakPolarHBondContact O-CB 3.16Å; D18-K22 PolarHBondContact O-N 3.35Å; D18-K22 WeakPolarHBondContact OD1-CD 3.27Å; D18-K22 WeakPolarHBondContact OD1-CE 3.47Å; D18-K22 IonicContact OD1-NZ 2.68Å; D18-K22 PolarHBondContact OD1-NZ 3.17Å
23	V	78.7	Confident	83.3	Confident	89 Å²	89	67.9 Å²	67.9	54%	0.539	32%	0.322	S	S	.	.	I	π-helix	trans	-79.5	-48.8	-170.9	-173.6	0	0	0	0	111.8	D18 Y19	D18-V23 PolarHBondContact O-N 3.49Å; Y19-V23 HydrophobicContact CD2-CB 3.88Å; Y19-V23 HydrophobicContact CD2-CG1 4.04Å; Y19-V23 HydrophobicContact CD2-CG2 4.14Å; Y19-V23 HydrophobicContact CE2-CB 4.23Å; Y19-V23 HydrophobicContact CE2-CG1 3.93Å; Y19-V23 HydrophobicContact CG-CB 4.46Å; Y19-V23 PolarHBondContact O-N 2.9Å
24	R	77.6	Confident	83.5	Confident	143 Å²	143	67.8 Å²	67.8	54%	0.54	32%	0.322	S	S	.	.	S	Bend	trans	-137.2	68.7	179.9	-73.2	-170	175	-174.3	-3.5	111.9	Y19 R26	Y19-R24 PolarHBondContact O-N 3.48Å; R24-R26 WeakPolarHBondContact O-CD 3.46Å; R24-R26 PolarHBondContact O-N 3.41Å
25	K	79.8	Confident	83.6	Confident	167 Å²	167	67.9 Å²	67.9	73%	0.726	32%	0.315	S	S	*	.			trans	-58.6	120.2	175.6	-169	172.8	-178.4	177.1	0	111	S20	S20-K25 WeakPolarHBondContact O-CA 3.46Å
26	R	82	Confident	83.7	Confident	84 Å²	84	64.8 Å²	64.8	32%	0.317	30%	0.299	S	S	.	.			trans	-89.7	155.6	176	-53.8	-53.1	-176.2	164.3	5.2	110.7	R24 F28 E30	R24-R26 WeakPolarHBondContact O-CD 3.46Å; R24-R26 PolarHBondContact O-N 3.41Å; R26-F28 HydrophobicContact CB-CD1 3.95Å; R26-F28 HydrophobicContact CB-CE1 3.87Å; R26-F28 HydrophobicContact CB-CZ 4.42Å; R26-F28 HydrophobicContact CG-CE1 4.25Å; R26-F28 PolarHBondContact O-N 3.43Å; R26-F28 VanDerWaalsContact O-N 3.17Å; R26-E30 HydrophobicContact CG-CG 4.21Å; R26-E30 WeakPolarHBondContact CG-OE1 3.4Å; R26-E30 IonicContact NE-OE1 3.75Å
27	K	81.9	Confident	83.9	Confident	224 Å²	224	65.3 Å²	65.3	97%	0.974	30%	0.304	S	S	*	.	S	Bend	trans	-72.2	1.5	174.5	-62.8	-173.8	179.8	-177	0	113.3
28	F	83.1	Confident	84	Confident	96 Å²	96	65 Å²	65	42%	0.421	30%	0.302	S	S	.	.	S	Bend	trans	-132.7	155.7	176.4	69.4	-87.4	0	0	0	110.5	R26 E30 T209 M210	R26-F28 HydrophobicContact CB-CD1 3.95Å; R26-F28 HydrophobicContact CB-CE1 3.87Å; R26-F28 HydrophobicContact CB-CZ 4.42Å; R26-F28 HydrophobicContact CG-CE1 4.25Å; R26-F28 PolarHBondContact O-N 3.43Å; R26-F28 VanDerWaalsContact O-N 3.17Å; F28-E30 HydrophobicContact CD2-CG 4.49Å; F28-E30 HydrophobicContact CE2-CB 4.42Å; F28-E30 HydrophobicContact CE2-CG 3.86Å; F28-E30 HydrophobicContact CZ-CG 4.18Å; F28-E30 PolarHBondContact O-N 3.19Å; F28-T209 HydrophobicContact CE2-CG2 4.34Å; F28-T209 HydrophobicContact CZ-CG2 4.5Å; F28-M210 HydrophobicContact CE1-CE 4.09Å; F28-M210 HydrophobicContact CE1-SD 4.21Å; F28-M210 HydrophobicContact CZ-CE 3.94Å; F28-M210 HydrophobicContact CZ-CG 4.39Å; F28-M210 HydrophobicContact CZ-SD 4.04Å
29	T	82.9	Confident	84.2	Confident	51 Å²	51	66 Å²	66	31%	0.313	30%	0.303	S	S	.	.			trans	-74.4	111.4	175.6	-45.5	0	0	0	0	109.8	H171 K173	T29-H171 HydrophobicContact CG2-CB 4.11Å; T29-K173 HydrophobicContact CG2-CD 4.26Å; T29-K173 HydrophobicContact CG2-CG 3.96Å
30	E	83.2	Confident	84.2	Confident	5 Å²	5	69.9 Å²	69.9	2%	0.023	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-68.8	144.7	176.9	-56.8	-169.2	-168.8	0	0	111.4	R26 F28 H171 V172 S208 T209 M210	R26-E30 HydrophobicContact CG-CG 4.21Å; R26-E30 WeakPolarHBondContact CG-OE1 3.4Å; R26-E30 IonicContact NE-OE1 3.75Å; F28-E30 HydrophobicContact CD2-CG 4.49Å; F28-E30 HydrophobicContact CE2-CB 4.42Å; F28-E30 HydrophobicContact CE2-CG 3.86Å; F28-E30 HydrophobicContact CZ-CG 4.18Å; F28-E30 PolarHBondContact O-N 3.19Å; E30-H171 WeakPolarHBondContact O-CA 3.2Å; E30-V172 HydrophobicContact CB-CG2 3.74Å; E30-V172 PolarHBondContact O-N 3.04Å; E30-V172 VanDerWaalsContact O-N 3.08Å; E30-S208 WeakPolarHBondContact OE2-CB 3.47Å; E30-S208 PolarHBondContact OE2-OG 3.24Å; E30-T209 PolarHBondContact OE2-N 3.4Å; E30-M210 PolarHBondContact OE2-N 2.93Å; E30-M210 VanDerWaalsContact OE2-N 3.14Å
31	T	87.8	Confident	84.1	Confident	29 Å²	29	70.4 Å²	70.4	18%	0.178	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	137.1	171	-57.1	0	0	0	0	108.9	E33 A168 G170 S208 T209	T31-E33 HydrophobicContact CG2-CG 4.33Å; T31-A168 HydrophobicContact CG2-CB 3.62Å; T31-G170 WeakPolarHBondContact CG2-O 3.48Å; T31-S208 CarbonylContact O-C 3.55Å; T31-S208 WeakPolarHBondContact O-CA 3.26Å; T31-T209 PolarHBondContact N-OG1 3.03Å; T31-T209 PolarHBondContact O-N 3.22Å; T31-T209 PolarHBondContact O-OG1 3.27Å
32	V	88.6	Confident	84.1	Confident	2 Å²	2	69.6 Å²	69.6	1%	0.012	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	124.2	171	-177.1	0	0	0	0	108.2	I16 V169 G170 V172 L179 I206	I16-V32 HydrophobicContact CG2-CG2 4.33Å; V32-V169 HydrophobicContact CB-CG2 4.46Å; V32-V169 HydrophobicContact CG1-CG2 4.06Å; V32-V169 WeakPolarHBondContact O-CG2 3.41Å; V32-V169 PolarHBondContact O-N 3.26Å; V32-G170 PolarHBondContact N-O 2.73Å; V32-G170 PolarHBondContact O-N 3.4Å; V32-V172 HydrophobicContact CG2-CG2 4.36Å; V32-L179 HydrophobicContact CB-CD2 4.42Å; V32-L179 HydrophobicContact CG2-CD1 4.26Å; V32-L179 HydrophobicContact CG2-CD2 4.35Å; V32-I206 HydrophobicContact CG1-CG2 3.51Å
33	E	90.3	Very high	84	Confident	44 Å²	44	63.2 Å²	63.2	21%	0.206	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	134.9	-177.3	-60.8	-173	156.1	0	0	110.9	T31 V167 I206 K207	T31-E33 HydrophobicContact CG2-CG 4.33Å; E33-V167 CarbonylContact C-O 3.57Å; E33-V167 VanDerWaalsContact CA-O 3.27Å; E33-V167 WeakPolarHBondContact CA-O 3.46Å; E33-I206 WeakPolarHBondContact O-CA 3.43Å; E33-K207 HydrophobicContact CB-CG 4.44Å; E33-K207 PolarHBondContact N-O 3.29Å; E33-K207 PolarHBondContact O-N 3.17Å; E33-K207 WeakPolarHBondContact OE2-CE 3.48Å
34	L	90	Very high	84	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	117.2	166.5	-178.7	69	0	0	0	108.2	I36 N166 V167 V169 I183 I187 I206 L216	L34-I36 HydrophobicContact CD2-CD1 4Å; L34-I36 HydrophobicContact CD2-CG1 4.15Å; L34-I36 HydrophobicContact CG-CD1 4.18Å; L34-I36 HydrophobicContact CG-CG1 3.96Å; L34-N166 WeakPolarHBondContact O-CA 3.29Å; L34-V167 PolarHBondContact N-O 3.18Å; L34-V167 PolarHBondContact O-N 3.13Å; L34-V169 HydrophobicContact CB-CG1 3.65Å; L34-V169 HydrophobicContact CB-CG2 4.17Å; L34-V169 HydrophobicContact CD2-CG1 4.34Å; L34-I183 HydrophobicContact CD1-CG2 4.24Å; L34-I187 HydrophobicContact CD1-CD1 4.39Å; L34-I187 HydrophobicContact CD1-CG1 4.4Å; L34-I187 HydrophobicContact CD2-CG1 3.74Å; L34-I206 HydrophobicContact CD1-CG1 4.07Å; L34-L216 HydrophobicContact CD1-CD1 4.44Å
35	Q	90	Very high	84	Confident	44 Å²	44	69 Å²	69	21%	0.206	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	131.8	172.6	-45.4	-165.8	-68	0	0	109.6	L165 N166 Y205 K207	Q35-L165 CarbonylContact C-O 3.56Å; Q35-L165 WeakPolarHBondContact CA-O 3.25Å; Q35-N166 WeakPolarHBondContact CB-OD1 3.36Å; Q35-N166 VanDerWaalsContact CG-OD1 3.25Å; Q35-N166 WeakPolarHBondContact CG-OD1 3.36Å; Q35-N166 PolarHBondContact NE2-OD1 3.23Å; Q35-Y205 PolarHBondContact N-O 3.16Å; Q35-Y205 PolarHBondContact O-N 2.81Å; Q35-K207 HydrophobicContact CG-CD 4.29Å; Q35-K207 HydrophobicContact CG-CG 4.29Å; Q35-K207 VanDerWaalsContact NE2-CE 3.32Å
36	I	89.4	Confident	83.8	Confident	3 Å²	3	62.7 Å²	62.7	2%	0.015	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	125.2	-173.3	-53.3	144.1	0	0	0	107.8	L34 L38 F157 C164 L165 L190 L204	L34-I36 HydrophobicContact CD2-CD1 4Å; L34-I36 HydrophobicContact CD2-CG1 4.15Å; L34-I36 HydrophobicContact CG-CD1 4.18Å; L34-I36 HydrophobicContact CG-CG1 3.96Å; I36-L38 HydrophobicContact CG2-CD2 4.2Å; I36-F157 HydrophobicContact CD1-CE1 4.06Å; I36-C164 CarbonylContact O-C 3.57Å; I36-C164 VanDerWaalsContact O-CA 3.28Å; I36-C164 WeakPolarHBondContact O-CA 3.27Å; I36-L165 HydrophobicContact CB-CB 4.33Å; I36-L165 HydrophobicContact CD1-CB 4.3Å; I36-L165 PolarHBondContact N-O 2.7Å; I36-L165 PolarHBondContact O-N 3.38Å; I36-L190 HydrophobicContact CB-CD2 4.21Å; I36-L190 HydrophobicContact CD1-CD1 4.44Å; I36-L190 HydrophobicContact CD1-CD2 3.5Å; I36-L190 VanDerWaalsContact CD1-CD2 3.5Å; I36-L190 HydrophobicContact CD1-CG 4.48Å; I36-L190 HydrophobicContact CG1-CD2 3.99Å; I36-L190 HydrophobicContact CG2-CD2 3.51Å; I36-L204 HydrophobicContact CB-CD2 3.92Å; I36-L204 HydrophobicContact CG1-CD2 3.61Å; I36-L204 HydrophobicContact CG2-CD2 3.55Å
37	A	89.8	Confident	83.4	Confident	16 Å²	16	67.1 Å²	67.1	13%	0.132	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	123.4	172.5	0	0	0	0	0	109.8	R202 C203	A37-R202 HydrophobicContact CB-CB 4.21Å; A37-R202 WeakPolarHBondContact O-CB 3.47Å; A37-R202 PolarHBondContact O-N 3.03Å; A37-C203 VanDerWaalsContact CB-SG 3.55Å; A37-C203 PolarHBondContact N-O 3.48Å; A37-C203 PolarHBondContact O-N 2.78Å
38	L	86.6	Confident	83.2	Confident	8 Å²	8	63.6 Å²	63.6	4%	0.042	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	144.7	174.4	-58.2	176.9	0	0	0	110.8	I36 F49 M159 L163 L165 L194 N200	I36-L38 HydrophobicContact CG2-CD2 4.2Å; L38-F49 HydrophobicContact CD1-CE1 4.37Å; L38-F49 HydrophobicContact CD1-CZ 4.37Å; L38-M159 HydrophobicContact CD1-CE 4.06Å; L38-M159 HydrophobicContact CD1-SD 3.86Å; L38-L163 HydrophobicContact CB-CB 4.49Å; L38-L163 WeakPolarHBondContact CB-O 3.19Å; L38-L163 PolarHBondContact N-O 2.94Å; L38-L165 HydrophobicContact CD1-CD1 4Å; L38-L165 HydrophobicContact CG-CD1 4.48Å; L38-L194 HydrophobicContact CD1-CD2 4.13Å; L38-L194 HydrophobicContact CD2-CD1 3.77Å; L38-L194 HydrophobicContact CD2-CD2 3.9Å; L38-N200 CarbonylContact C-O 3.45Å; L38-N200 WeakPolarHBondContact CA-O 3.21Å
39	K	87.5	Confident	83.1	Confident	87 Å²	87	59.9 Å²	59.9	38%	0.378	28%	0.284	S	S	.	.			trans	-116.6	154.4	169.1	62.2	-179.9	-174.3	-178.2	0	110.3	Y41 Q199 N200 R202	K39-Y41 PolarHBondContact O-N 3.44Å; K39-Y41 VanDerWaalsContact O-N 3.12Å; K39-Q199 WeakPolarHBondContact CE-O 3.48Å; K39-Q199 WeakPolarHBondContact CG-O 3.39Å; K39-N200 PolarHBondContact N-O 3.49Å; K39-R202 HydrophobicContact CB-CB 4.03Å; K39-R202 HydrophobicContact CD-CB 4.38Å; K39-R202 HydrophobicContact CG-CB 4.29Å
40	N	82.6	Confident	83.1	Confident	132 Å²	132	61.3 Å²	61.3	71%	0.706	29%	0.293	S	S	*	.	S	Bend	trans	54.1	32.4	173.1	-56.4	-17.1	0	0	0	113.9
41	Y	78.9	Confident	83.1	Confident	16 Å²	16	61.5 Å²	61.5	6%	0.063	30%	0.296	C	S	.	.			trans	-111.4	117.6	176.8	-160.5	-79.4	0	0	0	108.7	K39 D46 K47 F49 M159 L163 L194	K39-Y41 PolarHBondContact O-N 3.44Å; K39-Y41 VanDerWaalsContact O-N 3.12Å; Y41-D46 HydrophobicContact CD1-CB 3.94Å; Y41-D46 HydrophobicContact CD2-CB 4.38Å; Y41-D46 HydrophobicContact CE1-CB 3.41Å; Y41-D46 VanDerWaalsContact CE1-CB 3.41Å; Y41-D46 HydrophobicContact CE2-CB 3.9Å; Y41-D46 HydrophobicContact CG-CB 4.42Å; Y41-K47 PolarHBondContact OH-O 2.98Å; Y41-F49 HydrophobicContact CE2-CE1 4.48Å; Y41-M159 HydrophobicContact CD1-CE 3.17Å; Y41-M159 HydrophobicContact CD1-SD 3.7Å; Y41-M159 HydrophobicContact CE1-CE 3.46Å; Y41-M159 VanDerWaalsContact CE1-CE 3.46Å; Y41-M159 HydrophobicContact CE1-SD 3.37Å; Y41-M159 WeakPolarHBondContact CE1-SD 3.42Å; Y41-M159 HydrophobicContact CG-CE 3.93Å; Y41-M159 HydrophobicContact CG-SD 4.36Å; Y41-L163 VanDerWaalsContact O-CD2 3.31Å; Y41-L163 WeakPolarHBondContact O-CD2 3.46Å; Y41-L194 HydrophobicContact CD2-CD2 4.38Å; Y41-L194 HydrophobicContact CE2-CD2 4.23Å
42	D	77.2	Confident	83	Confident	59 Å²	59	64.2 Å²	64.2	32%	0.316	31%	0.313	S	S	.	.			trans	-98.3	114.6	179.7	-176.2	-17.1	0	0	0	108.9	Q44 K45 D46	D42-Q44 PolarHBondContact O-N 3.03Å; D42-Q44 WeakPolarHBondContact OD1-CB 3.28Å; D42-Q44 PolarHBondContact OD1-N 2.75Å; D42-K45 HydrophobicContact CB-CB 4.12Å; D42-K45 HydrophobicContact CB-CG 4.42Å; D42-K45 PolarHBondContact O-N 3.23Å; D42-K45 VanDerWaalsContact OD2-CD 3.29Å; D42-K45 WeakPolarHBondContact OD2-CD 3.45Å; D42-K45 WeakPolarHBondContact OD2-CE 3.47Å; D42-K45 WeakPolarHBondContact OD2-CG 3.46Å; D42-D46 PolarHBondContact N-OD2 3.19Å; D42-D46 VanDerWaalsContact N-OD2 3.13Å; D42-D46 WeakPolarHBondContact O-CA 3.22Å; D42-D46 VanDerWaalsContact O-CB 3.26Å; D42-D46 WeakPolarHBondContact O-CB 3.49Å; D42-D46 PolarHBondContact O-N 3.33Å
43	V	76.7	Confident	83	Confident	29 Å²	29	65 Å²	65	18%	0.176	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-18.7	-176.8	-174	0	0	0	0	112.7	M159	V43-M159 HydrophobicContact CG2-CE 4.11Å
44	Q	77.2	Confident	82.8	Confident	182 Å²	182	70.2 Å²	70.2	85%	0.85	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-40	178.6	-61	-173.1	-4.7	0	0	112.5	D42	D42-Q44 PolarHBondContact O-N 3.03Å; D42-Q44 WeakPolarHBondContact OD1-CB 3.28Å; D42-Q44 PolarHBondContact OD1-N 2.75Å
45	K	79	Confident	82.6	Confident	172 Å²	172	70.4 Å²	70.4	75%	0.748	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-31.9	-177.6	-61.9	179.1	-174.5	176.4	0	112.8	D42	D42-K45 HydrophobicContact CB-CB 4.12Å; D42-K45 HydrophobicContact CB-CG 4.42Å; D42-K45 PolarHBondContact O-N 3.23Å; D42-K45 VanDerWaalsContact OD2-CD 3.29Å; D42-K45 WeakPolarHBondContact OD2-CD 3.45Å; D42-K45 WeakPolarHBondContact OD2-CE 3.47Å; D42-K45 WeakPolarHBondContact OD2-CG 3.46Å
46	D	75	Confident	82.2	Confident	34 Å²	34	75.1 Å²	75.1	18%	0.182	36%	0.356	C	S	.	.	S	Bend	trans	-93.8	139.3	-178.5	-68.3	-56	0	0	0	112.4	Y41 D42 R48 K195	Y41-D46 HydrophobicContact CD1-CB 3.94Å; Y41-D46 HydrophobicContact CD2-CB 4.38Å; Y41-D46 HydrophobicContact CE1-CB 3.41Å; Y41-D46 VanDerWaalsContact CE1-CB 3.41Å; Y41-D46 HydrophobicContact CE2-CB 3.9Å; Y41-D46 HydrophobicContact CG-CB 4.42Å; D42-D46 PolarHBondContact N-OD2 3.19Å; D42-D46 VanDerWaalsContact N-OD2 3.13Å; D42-D46 WeakPolarHBondContact O-CA 3.22Å; D42-D46 VanDerWaalsContact O-CB 3.26Å; D42-D46 WeakPolarHBondContact O-CB 3.49Å; D42-D46 PolarHBondContact O-N 3.33Å; D46-R48 PolarHBondContact O-N 3.16Å; D46-R48 VanDerWaalsContact O-N 3.17Å; D46-K195 IonicContact OD1-NZ 2.76Å; D46-K195 PolarHBondContact OD1-NZ 2.88Å
47	K	73.8	Confident	82.1	Confident	177 Å²	177	77.5 Å²	77.5	77%	0.77	37%	0.367	S	S	*	.			trans	-65.4	115.3	-179.7	-70.6	-175.1	177.7	-178.5	0	109.8	Y41 F49	Y41-K47 PolarHBondContact OH-O 2.98Å; K47-F49 PolarHBondContact O-N 3.35Å; K47-F49 VanDerWaalsContact O-N 3.15Å
48	R	78.6	Confident	81.7	Confident	150 Å²	150	79.3 Å²	79.3	57%	0.566	37%	0.374	S	S	*	.			trans	-53.8	122.5	171.6	-62.3	-176.3	-171.7	169.7	6.7	109.8	D46	D46-R48 PolarHBondContact O-N 3.16Å; D46-R48 VanDerWaalsContact O-N 3.17Å
49	F	80.9	Confident	81.2	Confident	17 Å²	17	79.1 Å²	79.1	8%	0.075	37%	0.373	C	S	.	.			trans	-95.3	142.8	176.3	63.4	-90.8	0	0	0	110.8	L38 Y41 K47 M159 L165 L190 L193 L194	L38-F49 HydrophobicContact CD1-CE1 4.37Å; L38-F49 HydrophobicContact CD1-CZ 4.37Å; Y41-F49 HydrophobicContact CE2-CE1 4.48Å; K47-F49 PolarHBondContact O-N 3.35Å; K47-F49 VanDerWaalsContact O-N 3.15Å; F49-M159 HydrophobicContact CD1-CB 4.18Å; F49-M159 HydrophobicContact CD1-SD 4.12Å; F49-M159 HydrophobicContact CE1-CB 3.93Å; F49-M159 HydrophobicContact CE1-CG 4.34Å; F49-M159 HydrophobicContact CE1-SD 3.52Å; F49-M159 VanDerWaalsContact CE1-SD 3.52Å; F49-M159 HydrophobicContact CE2-CB 4.37Å; F49-M159 HydrophobicContact CZ-CB 4.05Å; F49-M159 HydrophobicContact CZ-SD 4.21Å; F49-M159 PolarHBondContact O-N 3.39Å; F49-M159 VanDerWaalsContact O-N 3.15Å; F49-L165 HydrophobicContact CE2-CD1 4.32Å; F49-L165 HydrophobicContact CZ-CD1 3.85Å; F49-L190 HydrophobicContact CE2-CD1 3.87Å; F49-L190 HydrophobicContact CZ-CD1 4.04Å; F49-L193 HydrophobicContact CD2-CB 3.96Å; F49-L193 HydrophobicContact CD2-CD1 3.84Å; F49-L193 HydrophobicContact CD2-CG 4.46Å; F49-L193 HydrophobicContact CE2-CB 4.34Å; F49-L193 HydrophobicContact CE2-CD1 4.2Å; F49-L193 HydrophobicContact CG-CB 4.22Å; F49-L194 HydrophobicContact CE1-CD2 3.66Å; F49-L194 HydrophobicContact CZ-CD2 3.99Å
50	T	82.4	Confident	80.5	Confident	82 Å²	82	79.3 Å²	79.3	50%	0.503	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	120.7	164.2	-60.4	0	0	0	0	106.1	K156 F157 Q158	T50-K156 HydrophobicContact CG2-CD 4.38Å; T50-K156 HydrophobicContact CG2-CG 4.25Å; T50-F157 CarbonylContact C-O 3.53Å; T50-F157 WeakPolarHBondContact CA-O 3.42Å; T50-Q158 HydrophobicContact CG2-CB 4.42Å; T50-Q158 HydrophobicContact CG2-CG 4.45Å
51	G	82.8	Confident	79.9	Confident	9 Å²	9	76.5 Å²	76.5	9%	0.093	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	146	178.9	0	0	0	0	0	110.4	K156 F157	G51-K156 CarbonylContact O-C 3.53Å; G51-F157 PolarHBondContact N-O 2.77Å; G51-F157 PolarHBondContact O-N 2.97Å
52	T	86.7	Confident	79.7	Confident	86 Å²	86	84.4 Å²	84.4	53%	0.528	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	131.1	174.7	47.2	0	0	0	0	108.7	T154 V155 K156 F189	T52-T154 HydrophobicContact CG2-CG2 4.25Å; T52-V155 WeakPolarHBondContact CA-O 3.48Å; T52-K156 HydrophobicContact CG2-CB 4.09Å; T52-K156 HydrophobicContact CG2-CG 3.98Å; T52-F189 VanDerWaalsContact O-CZ 3.25Å; T52-F189 WeakPolarHBondContact O-CZ 3.25Å
53	V	87.4	Confident	79.6	Confident	18 Å²	18	83.6 Å²	83.6	11%	0.109	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	136.1	172.7	75.2	0	0	0	0	108.9	L55 T154 V155 F157 F189	V53-L55 HydrophobicContact CG1-CD2 3.79Å; V53-L55 HydrophobicContact CG1-CG 4.38Å; V53-T154 CarbonylContact O-C 3.5Å; V53-T154 WeakPolarHBondContact O-CA 3.5Å; V53-V155 HydrophobicContact CG1-CB 4.41Å; V53-V155 PolarHBondContact N-O 2.79Å; V53-V155 PolarHBondContact O-N 2.78Å; V53-F157 HydrophobicContact CB-CE2 4.32Å; V53-F157 HydrophobicContact CG1-CD2 4.4Å; V53-F157 HydrophobicContact CG1-CE2 3.61Å; V53-F189 HydrophobicContact CB-CB 4.29Å; V53-F189 HydrophobicContact CB-CD1 3.7Å; V53-F189 HydrophobicContact CB-CD2 4.35Å; V53-F189 HydrophobicContact CB-CE1 4.04Å; V53-F189 HydrophobicContact CB-CG 3.85Å; V53-F189 HydrophobicContact CG1-CD1 4.48Å; V53-F189 HydrophobicContact CG2-CB 3.96Å; V53-F189 HydrophobicContact CG2-CD1 4.25Å; V53-F189 HydrophobicContact CG2-CD2 4.16Å; V53-F189 HydrophobicContact CG2-CG 3.86Å
54	R	86.7	Confident	79.6	Confident	154 Å²	154	84 Å²	84	58%	0.581	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83	117.5	166.2	-177.3	178.1	172.7	168.5	4.8	108.2	E150 A153	R54-E150 IonicContact CZ-OE1 3.47Å; R54-E150 IonicContact NH1-OE1 2.72Å; R54-E150 PolarHBondContact NH1-OE1 2.92Å; R54-E150 IonicContact NH2-OE1 3.65Å; R54-A153 HydrophobicContact CG-CB 4.29Å
55	L	85.5	Confident	79.8	Confident	3 Å²	3	75.3 Å²	75.3	2%	0.016	35%	0.353	C	S	.	.			trans	-78.2	156.3	171.2	-60.3	-175.6	0	0	0	110	V53 P59 A153 V155 N182 S186	V53-L55 HydrophobicContact CG1-CD2 3.79Å; V53-L55 HydrophobicContact CG1-CG 4.38Å; L55-P59 HydrophobicContact CD1-CB 4.3Å; L55-P59 HydrophobicContact CD1-CG 4.05Å; L55-A153 WeakPolarHBondContact CB-O 3.45Å; L55-A153 PolarHBondContact N-O 3.35Å; L55-V155 HydrophobicContact CD1-CB 4.43Å; L55-V155 HydrophobicContact CD1-CG2 3.48Å; L55-V155 VanDerWaalsContact CD1-CG2 3.48Å; L55-V155 HydrophobicContact CG-CG2 3.89Å; L55-N182 HydrophobicContact CD1-CB 4.3Å; L55-N182 HydrophobicContact CD2-CB 4.5Å; L55-S186 WeakPolarHBondContact CD2-OG 3.28Å
56	K	82.7	Confident	79.9	Confident	143 Å²	143	67.1 Å²	67.1	62%	0.622	32%	0.318	S	S	*	.	S	Bend	trans	-71.7	-39.3	176.9	-72.5	-177.9	176.9	-170.9	0	111.2	N182 L185	K56-N182 PolarHBondContact N-OD1 2.85Å; K56-L185 HydrophobicContact CD-CD1 3.98Å; K56-L185 HydrophobicContact CG-CD1 3.74Å
57	H	86	Confident	80.2	Confident	53 Å²	53	65.6 Å²	65.6	25%	0.245	31%	0.31	C	S	.	.	S	Bend	trans	-113.2	136.5	-177.8	-55.4	-69.6	0	0	0	110.8	P59 M174 Q181 N182	H57-P59 WeakPolarHBondContact O-CD 3.47Å; H57-M174 HydrophobicContact CB-CE 3.64Å; H57-M174 HydrophobicContact CB-SD 4.43Å; H57-Q181 PolarHBondContact NE2-OE1 3.48Å; H57-N182 PolarHBondContact N-OD1 2.91Å; H57-N182 PolarHBondContact O-ND2 2.92Å
58	I	82.6	Confident	80.5	Confident	55 Å²	55	57.4 Å²	57.4	28%	0.282	27%	0.274	S	S	.	.			trans	-67.2	109.3	-173.8	-65.2	169.3	0	0	0	110.8	R60 D149 K152 A153 M174	I58-R60 VanDerWaalsContact C-N 3.32Å; I58-R60 PolarHBondContact O-N 3.27Å; I58-D149 HydrophobicContact CD1-CB 4.33Å; I58-K152 HydrophobicContact CG2-CB 3.72Å; I58-A153 HydrophobicContact CG1-CB 4.23Å; I58-M174 VanDerWaalsContact C-CE 3.48Å; I58-M174 WeakPolarHBondContact O-CE 3.29Å
59	P	75	Confident	80.5	Confident	4 Å²	4	50.3 Å²	50.3	3%	0.026	25%	0.248	C	C	.	.	S	Bend	trans	-70.5	-26.4	-175.5	30.1	-38.7	0	0	0	113.7	L55 H57 K152 V155	L55-P59 HydrophobicContact CD1-CB 4.3Å; L55-P59 HydrophobicContact CD1-CG 4.05Å; H57-P59 WeakPolarHBondContact O-CD 3.47Å; P59-K152 VanDerWaalsContact CD-O 3.32Å; P59-K152 WeakPolarHBondContact CD-O 3.31Å; P59-V155 HydrophobicContact CG-CG2 3.8Å
60	R	73.2	Confident	80.2	Confident	90 Å²	90	52.1 Å²	52.1	34%	0.34	26%	0.258	S	S	.	.			trans	-134.3	83.5	-173.5	-67.4	-173.5	175.3	-152.5	-2.1	111.3	I58 K62 M63 A168	I58-R60 VanDerWaalsContact C-N 3.32Å; I58-R60 PolarHBondContact O-N 3.27Å; R60-K62 PolarHBondContact O-N 3.48Å; R60-M63 HydrophobicContact CB-CB 4.27Å; R60-M63 WeakPolarHBondContact O-CB 3.39Å; R60-M63 PolarHBondContact O-N 3.16Å; R60-A168 VanDerWaalsContact NE-CB 3.27Å
61	P	70.2	Confident	79.9	Confident	73 Å²	73	55.8 Å²	55.8	47%	0.474	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-27.3	-178.7	23.9	-33.7	0	0	0	113.3	M63	P61-M63 VanDerWaalsContact C-N 3.31Å; P61-M63 PolarHBondContact O-N 3.26Å
62	K	73.5	Confident	79.5	Confident	182 Å²	182	61.5 Å²	61.5	79%	0.791	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	12.2	179.2	-63.2	-171.2	176.7	-171.6	0	114.3	R60 S64	R60-K62 PolarHBondContact O-N 3.48Å; K62-S64 PolarHBondContact O-N 3.02Å
63	M	76.3	Confident	78.8	Confident	43 Å²	43	57.6 Å²	57.6	21%	0.212	27%	0.27	C	S	.	.			trans	-66	117.8	179	-173.9	177.3	-98.3	0	0	109.8	R60 P61 V65 H108 K152	R60-M63 HydrophobicContact CB-CB 4.27Å; R60-M63 WeakPolarHBondContact O-CB 3.39Å; R60-M63 PolarHBondContact O-N 3.16Å; P61-M63 VanDerWaalsContact C-N 3.31Å; P61-M63 PolarHBondContact O-N 3.26Å; M63-V65 PolarHBondContact O-N 3.09Å; M63-H108 HydrophobicContact CE-CB 4.23Å; M63-H108 HydrophobicContact CG-CB 3.5Å; M63-H108 HydrophobicContact SD-CB 4.26Å; M63-K152 HydrophobicContact CB-CG 4.4Å
64	S	77	Confident	78.1	Confident	37 Å²	37	56.8 Å²	56.8	26%	0.259	27%	0.265	S	S	.	.			trans	-75.4	114.1	176.5	58.4	0	0	0	0	110.2	K62 S106 H108 A109	K62-S64 PolarHBondContact O-N 3.02Å; S64-S106 PolarHBondContact OG-O 2.92Å; S64-H108 PolarHBondContact O-N 2.87Å; S64-H108 PolarHBondContact OG-ND1 3.39Å; S64-A109 PolarHBondContact O-N 3.41Å
65	V	81.1	Confident	77.7	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	127	175.4	-174.1	0	0	0	0	107.6	M63 P83 A109 V111 I148 I151 K152	M63-V65 PolarHBondContact O-N 3.09Å; V65-P83 WeakPolarHBondContact O-CD 3.22Å; V65-P83 WeakPolarHBondContact O-CG 3.08Å; V65-A109 WeakPolarHBondContact CA-O 3.4Å; V65-A109 HydrophobicContact CG1-CB 4.43Å; V65-A109 HydrophobicContact CG2-CB 4.29Å; V65-V111 HydrophobicContact CG1-CG2 3.71Å; V65-I148 HydrophobicContact CB-CG2 4.22Å; V65-I148 HydrophobicContact CG1-CG1 4.21Å; V65-I148 HydrophobicContact CG2-CG2 4.1Å; V65-I151 HydrophobicContact CG2-CG2 4.48Å; V65-K152 HydrophobicContact CG2-CG 4.48Å
66	C	80.8	Confident	77.3	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	132.9	176.1	-176.9	0	0	0	0	109.5	P83 Y107 A109 F110 V111	C66-P83 WeakPolarHBondContact CA-O 3.05Å; C66-Y107 HydrophobicContact CB-CD1 3.83Å; C66-Y107 HydrophobicContact CB-CD2 3.63Å; C66-Y107 HydrophobicContact CB-CE1 4.23Å; C66-Y107 HydrophobicContact CB-CE2 3.99Å; C66-Y107 HydrophobicContact CB-CG 3.52Å; C66-A109 PolarHBondContact N-O 3.43Å; C66-F110 HydrophobicContact CB-CD1 3.64Å; C66-F110 HydrophobicContact CB-CE1 3.66Å; C66-F110 CarbonylContact O-C 3.55Å; C66-F110 WeakPolarHBondContact O-CA 3.47Å; C66-V111 PolarHBondContact O-N 3.21Å
67	V	80.9	Confident	77	Confident	2 Å²	2	51 Å²	51	1%	0.012	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	129.8	176.8	179.6	0	0	0	0	108.6	A77 F82 P83 C84 M85 V111 L144 I148	V67-A77 HydrophobicContact CB-CB 3.95Å; V67-A77 HydrophobicContact CG1-CB 4.1Å; V67-A77 HydrophobicContact CG2-CB 3.95Å; V67-F82 HydrophobicContact CG2-CB 4.37Å; V67-P83 PolarHBondContact N-O 2.83Å; V67-C84 CarbonylContact O-C 3.56Å; V67-C84 WeakPolarHBondContact O-CA 3.43Å; V67-M85 PolarHBondContact O-N 3.5Å; V67-V111 CarbonylContact C-O 3.46Å; V67-V111 WeakPolarHBondContact CA-O 3.29Å; V67-L144 HydrophobicContact CB-CD2 4.38Å; V67-L144 HydrophobicContact CG1-CD2 3.55Å; V67-L144 HydrophobicContact CG2-CD2 3.97Å; V67-I148 HydrophobicContact CG2-CD1 4.08Å
68	L	79.4	Confident	76.5	Confident	5 Å²	5	54.3 Å²	54.3	3%	0.026	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	102.2	175.9	-55.9	175.3	0	0	0	106.9	M85 L90 F110 V111 A112 S113 V116	L68-M85 HydrophobicContact CD2-CB 3.88Å; L68-L90 HydrophobicContact CB-CD2 4.46Å; L68-L90 HydrophobicContact CD1-CD2 4.25Å; L68-L90 HydrophobicContact CD2-CD1 4.25Å; L68-L90 HydrophobicContact CD2-CD2 4.33Å; L68-F110 HydrophobicContact CD1-CB 4.48Å; L68-F110 HydrophobicContact CD1-CD1 4.13Å; L68-F110 HydrophobicContact CG-CD1 4.4Å; L68-V111 PolarHBondContact N-O 2.64Å; L68-A112 HydrophobicContact CB-CB 3.92Å; L68-A112 HydrophobicContact CD1-CB 4.34Å; L68-A112 CarbonylContact O-C 3.54Å; L68-A112 WeakPolarHBondContact O-CA 2.96Å; L68-S113 PolarHBondContact O-N 3.47Å; L68-V116 HydrophobicContact CB-CG1 4.29Å
69	G	79.3	Confident	76.2	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.01	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	167.1	-167	0	0	0	0	0	113.5	M85	G69-M85 PolarHBondContact N-O 2.84Å
70	D	75	Confident	76.1	Confident	55 Å²	55	57.7 Å²	57.7	29%	0.294	30%	0.299	S	S	.	.			trans	-75.8	173.1	162.1	-61.2	-38.1	0	0	0	109.3	Q72 H73 C74 T115	D70-Q72 PolarHBondContact O-N 3.03Å; D70-Q72 VanDerWaalsContact O-N 3.09Å; D70-H73 PolarHBondContact O-N 3.07Å; D70-C74 PolarHBondContact O-N 2.87Å; D70-T115 WeakPolarHBondContact OD2-CB 3.45Å; D70-T115 PolarHBondContact OD2-OG1 3.21Å
71	E	74.8	Confident	76	Confident	159 Å²	159	56.5 Å²	56.5	74%	0.743	32%	0.316	S	S	*	.	H	α-helix	trans	-48.8	-42.9	-172.7	-67	179.2	168.1	0	0	113.4	H73 C74 D75	E71-H73 PolarHBondContact O-N 3.04Å; E71-C74 WeakPolarHBondContact O-CB 3.3Å; E71-C74 PolarHBondContact O-N 3.41Å; E71-C74 VanDerWaalsContact O-N 3.12Å; E71-D75 PolarHBondContact O-N 3.22Å
72	Q	74.3	Confident	76.1	Confident	129 Å²	129	54.9 Å²	54.9	60%	0.603	30%	0.301	S	S	*	.	H	α-helix	trans	-58.7	-44.7	178.3	-65.1	-175.4	-11.2	0	0	113.1	D70 C74 D75 E76 H140	D70-Q72 PolarHBondContact O-N 3.03Å; D70-Q72 VanDerWaalsContact O-N 3.09Å; Q72-C74 VanDerWaalsContact C-N 3.32Å; Q72-D75 PolarHBondContact O-N 3.15Å; Q72-E76 PolarHBondContact O-N 3.48Å; Q72-E76 VanDerWaalsContact O-N 3.11Å; Q72-H140 PolarHBondContact OE1-CD2 3.21Å
73	H	73	Confident	76.2	Confident	4 Å²	4	48.3 Å²	48.3	2%	0.019	28%	0.277	C	S	.	.	H	α-helix	trans	-74.3	-27.5	178.4	-71.6	-53.8	0	0	0	112.2	D70 E71 A77 S113 H140 L144	D70-H73 PolarHBondContact O-N 3.07Å; E71-H73 PolarHBondContact O-N 3.04Å; H73-A77 WeakPolarHBondContact O-CB 3.35Å; H73-A77 PolarHBondContact O-N 3.3Å; H73-S113 VanDerWaalsContact CD2-CB 3.4Å; H73-S113 WeakPolarHBondContact CD2-CB 3.44Å; H73-S113 PolarHBondContact CD2-OG 3.31Å; H73-S113 VanDerWaalsContact CD2-OG 3.29Å; H73-S113 PolarHBondContact NE2-OG 2.72Å; H73-H140 AromaticContact CD2-CD2 3.94Å; H73-H140 AromaticContact CD2-NE2 3.63Å; H73-H140 AromaticContact CE1-CD2 3.74Å; H73-H140 AromaticContact NE2-CD2 3.35Å; H73-H140 PolarHBondContact NE2-CD2 3.27Å; H73-H140 VanDerWaalsContact NE2-CD2 3.35Å; H73-H140 AromaticContact NE2-CE1 3.7Å; H73-H140 AromaticContact NE2-CG 3.78Å; H73-H140 AromaticContact NE2-ND1 3.99Å; H73-H140 AromaticContact NE2-NE2 3.3Å; H73-H140 PolarHBondContact NE2-NE2 3.49Å; H73-L144 HydrophobicContact CB-CD2 4.33Å; H73-L144 WeakPolarHBondContact ND1-CD1 3.29Å
74	C	71.9	Confident	76	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.007	28%	0.277	C	S	.	.	H	α-helix	trans	-70.6	-35.5	173.5	-69.8	0	0	0	0	111.4	D70 E71 Q72 A77 K78 C84 D86	D70-C74 PolarHBondContact O-N 2.87Å; E71-C74 WeakPolarHBondContact O-CB 3.3Å; E71-C74 PolarHBondContact O-N 3.41Å; E71-C74 VanDerWaalsContact O-N 3.12Å; Q72-C74 VanDerWaalsContact C-N 3.32Å; C74-A77 PolarHBondContact O-N 3.44Å; C74-K78 VanDerWaalsContact O-CB 3.29Å; C74-K78 WeakPolarHBondContact O-CB 3.5Å; C74-K78 WeakPolarHBondContact O-CD 3.37Å; C74-K78 WeakPolarHBondContact O-CG 3.26Å; C74-K78 PolarHBondContact O-N 3.35Å; C74-C84 HydrophobicContact CB-CB 4.17Å; C74-D86 PolarHBondContact SG-OD1 3.08Å
75	D	78.5	Confident	75.8	Confident	97 Å²	97	47.5 Å²	47.5	52%	0.519	27%	0.272	S	S	.	.	H	α-helix	trans	-68.5	-44.6	174.1	-68.4	-21.4	0	0	0	111.7	E71 Q72 A77 K78 A79	E71-D75 PolarHBondContact O-N 3.22Å; Q72-D75 PolarHBondContact O-N 3.15Å; D75-A77 VanDerWaalsContact C-N 3.34Å; D75-A77 PolarHBondContact O-N 3.49Å; D75-K78 PolarHBondContact O-N 3.39Å; D75-A79 WeakPolarHBondContact O-CB 3.3Å; D75-A79 PolarHBondContact O-N 3Å
76	E	77.1	Confident	75.5	Confident	82 Å²	82	50.2 Å²	50.2	38%	0.383	29%	0.287	S	S	.	.	H	α-helix	trans	-60.7	-42	172.5	-74.3	-175.4	-163.1	0	0	112.3	Q72 A79 A80 L144	Q72-E76 PolarHBondContact O-N 3.48Å; Q72-E76 VanDerWaalsContact O-N 3.11Å; E76-A79 PolarHBondContact O-N 3.17Å; E76-A80 WeakPolarHBondContact O-CB 3.18Å; E76-A80 PolarHBondContact O-N 3.06Å; E76-L144 HydrophobicContact CB-CD2 4.27Å; E76-L144 WeakPolarHBondContact OE2-CD1 3.38Å
77	A	76.3	Confident	75.1	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-67.5	-41.4	178.7	0	0	0	0	0	112.1	V67 H73 C74 D75 A80 G81 F82 C84 L144	V67-A77 HydrophobicContact CB-CB 3.95Å; V67-A77 HydrophobicContact CG1-CB 4.1Å; V67-A77 HydrophobicContact CG2-CB 3.95Å; H73-A77 WeakPolarHBondContact O-CB 3.35Å; H73-A77 PolarHBondContact O-N 3.3Å; C74-A77 PolarHBondContact O-N 3.44Å; D75-A77 VanDerWaalsContact C-N 3.34Å; D75-A77 PolarHBondContact O-N 3.49Å; A77-A80 CarbonylContact O-C 3.53Å; A77-A80 PolarHBondContact O-N 3.18Å; A77-G81 PolarHBondContact O-N 3.11Å; A77-F82 PolarHBondContact O-N 3.03Å; A77-C84 HydrophobicContact CB-CB 3.91Å; A77-L144 HydrophobicContact CB-CD2 4.15Å
78	K	76.7	Confident	74.8	Confident	122 Å²	122	57.7 Å²	57.7	53%	0.53	33%	0.325	S	S	.	.	H	α-helix	trans	-63.3	-43.1	174.6	-76	168.4	-169.9	167	0	110.9	C74 D75 A80 G81 C84	C74-K78 VanDerWaalsContact O-CB 3.29Å; C74-K78 WeakPolarHBondContact O-CB 3.5Å; C74-K78 WeakPolarHBondContact O-CD 3.37Å; C74-K78 WeakPolarHBondContact O-CG 3.26Å; C74-K78 PolarHBondContact O-N 3.35Å; D75-K78 PolarHBondContact O-N 3.39Å; K78-A80 VanDerWaalsContact C-N 3.28Å; K78-A80 PolarHBondContact O-N 2.9Å; K78-G81 PolarHBondContact O-N 3.39Å; K78-G81 VanDerWaalsContact O-N 3.08Å; K78-C84 VanDerWaalsContact CE-SG 3.59Å
79	A	76.4	Confident	74.6	Confident	94 Å²	94	61.8 Å²	61.8	78%	0.777	34%	0.344	S	S	*	.	H	α-helix	trans	-60.7	-38.4	175	0	0	0	0	0	112	D75 E76 G81	D75-A79 WeakPolarHBondContact O-CB 3.3Å; D75-A79 PolarHBondContact O-N 3Å; E76-A79 PolarHBondContact O-N 3.17Å; A79-G81 VanDerWaalsContact C-N 3.31Å; A79-G81 PolarHBondContact O-N 3.42Å
80	A	71.4	Confident	74.4	Confident	35 Å²	35	61.8 Å²	61.8	29%	0.289	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-0.3	176.9	0	0	0	0	0	114.3	E76 A77 K78 F82 V145	E76-A80 WeakPolarHBondContact O-CB 3.18Å; E76-A80 PolarHBondContact O-N 3.06Å; A77-A80 CarbonylContact O-C 3.53Å; A77-A80 PolarHBondContact O-N 3.18Å; K78-A80 VanDerWaalsContact C-N 3.28Å; K78-A80 PolarHBondContact O-N 2.9Å; A80-F82 VanDerWaalsContact C-N 3.32Å; A80-F82 HydrophobicContact CB-CD2 3.54Å; A80-F82 HydrophobicContact CB-CE2 3.75Å; A80-F82 PolarHBondContact O-N 2.94Å; A80-V145 HydrophobicContact CB-CG2 3.98Å
81	G	71.8	Confident	74.4	Confident	66 Å²	66	64.1 Å²	64.1	68%	0.68	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.2	21.8	179.2	0	0	0	0	0	114.8	A77 K78 A79	A77-G81 PolarHBondContact O-N 3.11Å; K78-G81 PolarHBondContact O-N 3.39Å; K78-G81 VanDerWaalsContact O-N 3.08Å; A79-G81 VanDerWaalsContact C-N 3.31Å; A79-G81 PolarHBondContact O-N 3.42Å
82	F	72	Confident	74.6	Confident	38 Å²	38	63.6 Å²	63.6	17%	0.167	35%	0.346	C	S	.	.			trans	-93.4	145.1	176.5	-66.6	-71.1	0	0	0	111.8	V67 A77 A80 C84 I148	V67-F82 HydrophobicContact CG2-CB 4.37Å; A77-F82 PolarHBondContact O-N 3.03Å; A80-F82 VanDerWaalsContact C-N 3.32Å; A80-F82 HydrophobicContact CB-CD2 3.54Å; A80-F82 HydrophobicContact CB-CE2 3.75Å; A80-F82 PolarHBondContact O-N 2.94Å; F82-C84 PolarHBondContact O-N 3.33Å; F82-C84 VanDerWaalsContact O-N 3.13Å; F82-I148 HydrophobicContact CB-CD1 4.48Å; F82-I148 HydrophobicContact CD1-CD1 4.32Å; F82-I148 HydrophobicContact CD1-CG2 4.44Å; F82-I148 HydrophobicContact CD2-CD1 3.39Å; F82-I148 HydrophobicContact CE1-CD1 4.49Å; F82-I148 HydrophobicContact CE1-CG2 3.78Å; F82-I148 HydrophobicContact CE2-CD1 3.59Å; F82-I148 HydrophobicContact CE2-CG2 4.09Å; F82-I148 HydrophobicContact CG-CD1 3.8Å; F82-I148 HydrophobicContact CZ-CB 4.49Å; F82-I148 HydrophobicContact CZ-CD1 4.17Å; F82-I148 HydrophobicContact CZ-CG2 3.6Å
83	P	75.8	Confident	74.8	Confident	45 Å²	45	58.9 Å²	58.9	29%	0.292	33%	0.325	S	S	.	.			trans	-64.4	115.7	174.8	24.4	-29.7	0	0	0	109.9	V65 C66 V67 Y107	V65-P83 WeakPolarHBondContact O-CD 3.22Å; V65-P83 WeakPolarHBondContact O-CG 3.08Å; C66-P83 WeakPolarHBondContact CA-O 3.05Å; V67-P83 PolarHBondContact N-O 2.83Å; P83-Y107 HydrophobicContact CB-CE1 3.86Å; P83-Y107 WeakPolarHBondContact CB-OH 3.31Å; P83-Y107 HydrophobicContact CG-CD1 4.14Å; P83-Y107 HydrophobicContact CG-CE1 3.42Å; P83-Y107 VanDerWaalsContact CG-CE1 3.42Å
84	C	71.8	Confident	74.8	Confident	32 Å²	32	60 Å²	60	22%	0.216	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	150.5	173.9	62.7	0	0	0	0	110.5	V67 C74 A77 K78 F82	V67-C84 CarbonylContact O-C 3.56Å; V67-C84 WeakPolarHBondContact O-CA 3.43Å; C74-C84 HydrophobicContact CB-CB 4.17Å; A77-C84 HydrophobicContact CB-CB 3.91Å; K78-C84 VanDerWaalsContact CE-SG 3.59Å; F82-C84 PolarHBondContact O-N 3.33Å; F82-C84 VanDerWaalsContact O-N 3.13Å
85	M	73.5	Confident	75	Confident	31 Å²	31	68.6 Å²	68.6	15%	0.153	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	130.7	164.3	-80.1	-168.6	153.5	0	0	109.6	V67 L68 G69 I93 L103	V67-M85 PolarHBondContact O-N 3.5Å; L68-M85 HydrophobicContact CD2-CB 3.88Å; G69-M85 PolarHBondContact N-O 2.84Å; M85-I93 HydrophobicContact CE-CD1 3.38Å; M85-I93 HydrophobicContact SD-CD1 3.71Å; M85-L103 HydrophobicContact CE-CD1 3.37Å; M85-L103 HydrophobicContact SD-CD1 3.16Å; M85-L103 WeakPolarHBondContact SD-CD1 3.16Å
86	D	74.8	Confident	75	Confident	57 Å²	57	69.9 Å²	69.9	31%	0.305	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	156.2	177.6	-62.1	-36.2	0	0	0	111	C74 E88 E89 L90	C74-D86 PolarHBondContact SG-OD1 3.08Å; D86-E88 PolarHBondContact O-N 3.46Å; D86-E88 VanDerWaalsContact O-N 3.14Å; D86-E89 PolarHBondContact O-N 2.89Å; D86-E89 VanDerWaalsContact O-N 3.15Å; D86-L90 PolarHBondContact O-N 3.41Å
87	A	72.3	Confident	75	Confident	18 Å²	18	74 Å²	74	15%	0.149	39%	0.39	C	S	.	.	H	α-helix	trans	-56.2	-31.4	179.2	0	0	0	0	0	113.2	K91	A87-K91 WeakPolarHBondContact O-CG 3.41Å; A87-K91 PolarHBondContact O-N 3.37Å
88	E	75	Confident	75.3	Confident	140 Å²	140	82.2 Å²	82.2	65%	0.654	43%	0.426	S	S	*	.	H	α-helix	trans	-73	-41.6	177.9	-61.4	-159	156.5	0	0	113.2	D86 L90 K91 K92	D86-E88 PolarHBondContact O-N 3.46Å; D86-E88 VanDerWaalsContact O-N 3.14Å; E88-L90 VanDerWaalsContact C-N 3.29Å; E88-L90 PolarHBondContact O-N 2.86Å; E88-K91 WeakPolarHBondContact O-CB 3.25Å; E88-K91 PolarHBondContact O-N 2.88Å; E88-K92 PolarHBondContact O-N 2.81Å
89	E	75.5	Confident	75.6	Confident	91 Å²	91	78.2 Å²	78.2	43%	0.425	41%	0.412	S	S	.	.	H	α-helix	trans	-63.9	-41	174.6	-63.8	-163.9	150.3	0	0	110.3	D86 K91 K92 I93	D86-E89 PolarHBondContact O-N 2.89Å; D86-E89 VanDerWaalsContact O-N 3.15Å; E89-K91 VanDerWaalsContact C-N 3.3Å; E89-K91 PolarHBondContact O-N 3.28Å; E89-K92 PolarHBondContact O-N 3.17Å; E89-I93 WeakPolarHBondContact O-CB 3.41Å; E89-I93 VanDerWaalsContact O-CG1 3.27Å; E89-I93 WeakPolarHBondContact O-CG1 3.28Å; E89-I93 PolarHBondContact O-N 3.11Å
90	L	74.9	Confident	75.8	Confident	2 Å²	2	73.9 Å²	73.9	1%	0.01	38%	0.376	C	S	.	.	H	α-helix	trans	-63.5	-36.9	176.2	-165.9	60.9	0	0	0	111.5	L68 D86 E88 I93 S94 V116 F120 V124	L68-L90 HydrophobicContact CB-CD2 4.46Å; L68-L90 HydrophobicContact CD1-CD2 4.25Å; L68-L90 HydrophobicContact CD2-CD1 4.25Å; L68-L90 HydrophobicContact CD2-CD2 4.33Å; D86-L90 PolarHBondContact O-N 3.41Å; E88-L90 VanDerWaalsContact C-N 3.29Å; E88-L90 PolarHBondContact O-N 2.86Å; L90-I93 PolarHBondContact O-N 3.36Å; L90-S94 WeakPolarHBondContact O-CB 3.08Å; L90-S94 PolarHBondContact O-N 3.16Å; L90-S94 PolarHBondContact O-OG 3.26Å; L90-V116 HydrophobicContact CD2-CG1 3.91Å; L90-F120 HydrophobicContact CB-CE1 4.21Å; L90-F120 HydrophobicContact CB-CE2 4.34Å; L90-F120 HydrophobicContact CB-CZ 3.95Å; L90-F120 HydrophobicContact CD2-CB 4.5Å; L90-F120 HydrophobicContact CD2-CD1 4.14Å; L90-F120 HydrophobicContact CD2-CD2 3.45Å; L90-F120 VanDerWaalsContact CD2-CD2 3.45Å; L90-F120 HydrophobicContact CD2-CE1 4.21Å; L90-F120 HydrophobicContact CD2-CE2 3.61Å; L90-F120 HydrophobicContact CD2-CG 3.77Å; L90-F120 HydrophobicContact CD2-CZ 3.96Å; L90-F120 HydrophobicContact CG-CD1 4.09Å; L90-F120 HydrophobicContact CG-CD2 4.23Å; L90-F120 HydrophobicContact CG-CE1 3.94Å; L90-F120 HydrophobicContact CG-CE2 4.17Å; L90-F120 HydrophobicContact CG-CG 4.23Å; L90-F120 HydrophobicContact CG-CZ 3.99Å; L90-V124 HydrophobicContact CD1-CG2 4.21Å; L90-V124 HydrophobicContact CG-CG2 4.35Å
91	K	74.4	Confident	76.2	Confident	104 Å²	104	77.1 Å²	77.1	45%	0.452	38%	0.383	S	S	.	.	H	α-helix	trans	-61.8	-47	171.7	-78.4	174.3	-171.7	170.9	0	112	A87 E88 E89 I93 S94 K95 F120	A87-K91 WeakPolarHBondContact O-CG 3.41Å; A87-K91 PolarHBondContact O-N 3.37Å; E88-K91 WeakPolarHBondContact O-CB 3.25Å; E88-K91 PolarHBondContact O-N 2.88Å; E89-K91 VanDerWaalsContact C-N 3.3Å; E89-K91 PolarHBondContact O-N 3.28Å; K91-I93 PolarHBondContact O-N 2.95Å; K91-S94 PolarHBondContact O-N 2.66Å; K91-S94 PolarHBondContact O-OG 2.68Å; K91-K95 PolarHBondContact O-N 3.45Å; K91-F120 HydrophobicContact CB-CE1 4.5Å; K91-F120 HydrophobicContact CG-CE1 3.72Å; K91-F120 HydrophobicContact CG-CZ 3.72Å
92	K	78.8	Confident	76.8	Confident	148 Å²	148	81.7 Å²	81.7	64%	0.643	38%	0.384	S	S	*	.	H	α-helix	trans	-59.7	-46.9	177.6	-69	173.5	-174.7	169.9	0	111.1	E88 E89 S94 K95	E88-K92 PolarHBondContact O-N 2.81Å; E89-K92 PolarHBondContact O-N 3.17Å; K92-S94 VanDerWaalsContact C-N 3.32Å; K92-S94 PolarHBondContact O-N 3.34Å; K92-K95 PolarHBondContact O-N 3.05Å
93	I	78.3	Confident	77.3	Confident	29 Å²	29	80.5 Å²	80.5	15%	0.149	38%	0.38	C	S	.	.	H	α-helix	trans	-67.7	-32.6	179.4	-65.4	166.3	0	0	0	111.6	M85 E89 L90 K91 K95 E96 P99 L100 L103	M85-I93 HydrophobicContact CE-CD1 3.38Å; M85-I93 HydrophobicContact SD-CD1 3.71Å; E89-I93 WeakPolarHBondContact O-CB 3.41Å; E89-I93 VanDerWaalsContact O-CG1 3.27Å; E89-I93 WeakPolarHBondContact O-CG1 3.28Å; E89-I93 PolarHBondContact O-N 3.11Å; L90-I93 PolarHBondContact O-N 3.36Å; K91-I93 PolarHBondContact O-N 2.95Å; I93-K95 VanDerWaalsContact C-N 3.3Å; I93-K95 PolarHBondContact O-N 3.09Å; I93-E96 PolarHBondContact O-N 3.41Å; I93-P99 HydrophobicContact CG2-CB 4.21Å; I93-P99 HydrophobicContact CG2-CG 4.41Å; I93-L100 HydrophobicContact CG2-CB 4.03Å; I93-L100 HydrophobicContact CG2-CD1 4.12Å; I93-L103 HydrophobicContact CD1-CD1 4.36Å
94	S	73.1	Confident	77.5	Confident	27 Å²	27	78.4 Å²	78.4	19%	0.189	37%	0.366	C	S	.	.	H	α-helix	trans	-68.3	-26.3	-179	75.4	0	0	0	0	113.7	L90 K91 K92 E96	L90-S94 WeakPolarHBondContact O-CB 3.08Å; L90-S94 PolarHBondContact O-N 3.16Å; L90-S94 PolarHBondContact O-OG 3.26Å; K91-S94 PolarHBondContact O-N 2.66Å; K91-S94 PolarHBondContact O-OG 2.68Å; K92-S94 VanDerWaalsContact C-N 3.32Å; K92-S94 PolarHBondContact O-N 3.34Å; S94-E96 VanDerWaalsContact C-N 3.29Å; S94-E96 PolarHBondContact O-N 3.19Å
95	K	76	Confident	77.9	Confident	183 Å²	183	84 Å²	84	80%	0.796	39%	0.387	S	S	*	.	H	α-helix	trans	-67.7	-31.8	176.9	-69.9	-177.8	180	-177.9	0	111.7	K91 K92 I93	K91-K95 PolarHBondContact O-N 3.45Å; K92-K95 PolarHBondContact O-N 3.05Å; I93-K95 VanDerWaalsContact C-N 3.3Å; I93-K95 PolarHBondContact O-N 3.09Å
96	E	79.7	Confident	78.4	Confident	124 Å²	124	85.6 Å²	85.6	58%	0.579	40%	0.401	S	S	*	.			trans	-108.6	119.2	-177.4	-64.6	-173.5	-174.4	0	0	112.7	I93 S94 K98 P99 L100	I93-E96 PolarHBondContact O-N 3.41Å; S94-E96 VanDerWaalsContact C-N 3.29Å; S94-E96 PolarHBondContact O-N 3.19Å; E96-K98 PolarHBondContact O-N 3.24Å; E96-K98 VanDerWaalsContact O-N 3.15Å; E96-P99 HydrophobicContact CB-CG 3.42Å; E96-P99 VanDerWaalsContact CB-CG 3.42Å; E96-P99 HydrophobicContact CG-CG 4.44Å; E96-P99 VanDerWaalsContact O-CD 3.25Å; E96-P99 WeakPolarHBondContact O-CD 3.48Å; E96-P99 WeakPolarHBondContact O-CG 3.28Å; E96-P99 WeakPolarHBondContact OE2-CD 3.33Å; E96-L100 PolarHBondContact O-N 3.26Å
97	K	76.4	Confident	78.7	Confident	168 Å²	168	85.3 Å²	85.3	73%	0.73	40%	0.396	S	S	*	.	H	α-helix	trans	-64.1	-22	179.8	-66.9	179	-179.9	173	0	114.1	K101	K97-K101 WeakPolarHBondContact O-CD 3.46Å; K97-K101 WeakPolarHBondContact O-CG 3.49Å; K97-K101 PolarHBondContact O-N 3.12Å
98	K	82.6	Confident	78.9	Confident	173 Å²	173	89 Å²	89	75%	0.752	41%	0.41	S	S	*	.	H	α-helix	trans	-76.8	-55.2	-177.6	-74.2	-178.6	-179.6	176	0	113	E96 L100 K101 K102	E96-K98 PolarHBondContact O-N 3.24Å; E96-K98 VanDerWaalsContact O-N 3.15Å; K98-L100 VanDerWaalsContact C-N 3.31Å; K98-L100 PolarHBondContact O-N 3.06Å; K98-K101 PolarHBondContact O-N 3.3Å; K98-K102 PolarHBondContact O-N 2.85Å
99	P	82.6	Confident	79.3	Confident	37 Å²	37	83 Å²	83	24%	0.24	39%	0.385	C	S	.	.	H	α-helix	trans	-62.5	-37.7	176.9	24.8	-34.7	0	0	0	111.8	I93 E96 K101 K102 L103	I93-P99 HydrophobicContact CG2-CB 4.21Å; I93-P99 HydrophobicContact CG2-CG 4.41Å; E96-P99 HydrophobicContact CB-CG 3.42Å; E96-P99 VanDerWaalsContact CB-CG 3.42Å; E96-P99 HydrophobicContact CG-CG 4.44Å; E96-P99 VanDerWaalsContact O-CD 3.25Å; E96-P99 WeakPolarHBondContact O-CD 3.48Å; E96-P99 WeakPolarHBondContact O-CG 3.28Å; E96-P99 WeakPolarHBondContact OE2-CD 3.33Å; P99-K101 VanDerWaalsContact C-N 3.29Å; P99-K101 PolarHBondContact O-N 2.93Å; P99-K102 WeakPolarHBondContact O-CB 3.41Å; P99-K102 PolarHBondContact O-N 3.45Å; P99-L103 WeakPolarHBondContact O-CB 3.41Å; P99-L103 PolarHBondContact O-N 3.29Å
100	L	80.4	Confident	79.7	Confident	4 Å²	4	78.8 Å²	78.8	2%	0.021	37%	0.365	C	S	.	.	H	α-helix	trans	-60.8	-37.8	175.9	-172.9	60.9	0	0	0	112.6	I93 E96 K98 A104 V124 V127	I93-L100 HydrophobicContact CG2-CB 4.03Å; I93-L100 HydrophobicContact CG2-CD1 4.12Å; E96-L100 PolarHBondContact O-N 3.26Å; K98-L100 VanDerWaalsContact C-N 3.31Å; K98-L100 PolarHBondContact O-N 3.06Å; L100-A104 VanDerWaalsContact O-CB 3.3Å; L100-A104 WeakPolarHBondContact O-CB 3.45Å; L100-A104 PolarHBondContact O-N 3.15Å; L100-V124 HydrophobicContact CD1-CG1 4.28Å; L100-V124 HydrophobicContact CD1-CG2 4.23Å; L100-V127 HydrophobicContact CD2-CB 3.85Å; L100-V127 HydrophobicContact CD2-CG1 4.07Å; L100-V127 HydrophobicContact CD2-CG2 3.69Å; L100-V127 HydrophobicContact CG-CB 4.23Å; L100-V127 HydrophobicContact CG-CG1 3.96Å; L100-V127 HydrophobicContact CG-CG2 4.49Å
101	K	80.9	Confident	80.1	Confident	102 Å²	102	78.8 Å²	78.8	44%	0.443	37%	0.365	S	S	.	.	H	α-helix	trans	-70.1	-33.3	173.1	-76.1	174.3	-175.5	178.8	0	113.1	K97 K98 P99 K105 V127 F131	K97-K101 WeakPolarHBondContact O-CD 3.46Å; K97-K101 WeakPolarHBondContact O-CG 3.49Å; K97-K101 PolarHBondContact O-N 3.12Å; K98-K101 PolarHBondContact O-N 3.3Å; P99-K101 VanDerWaalsContact C-N 3.29Å; P99-K101 PolarHBondContact O-N 2.93Å; K101-K105 WeakPolarHBondContact O-CG 3.48Å; K101-K105 PolarHBondContact O-N 2.91Å; K101-V127 HydrophobicContact CG-CG1 4.32Å; K101-F131 HydrophobicContact CB-CE2 4.41Å; K101-F131 HydrophobicContact CB-CZ 4.34Å; K101-F131 HydrophobicContact CG-CE2 4.08Å; K101-F131 HydrophobicContact CG-CZ 4.19Å
102	K	84	Confident	80.6	Confident	162 Å²	162	74 Å²	74	70%	0.704	35%	0.345	S	S	*	.	H	α-helix	trans	-67	-46.1	175.1	-73.2	-177	176.7	-177.6	0	110.2	K98 P99 K105 S106	K98-K102 PolarHBondContact O-N 2.85Å; P99-K102 WeakPolarHBondContact O-CB 3.41Å; P99-K102 PolarHBondContact O-N 3.45Å; K102-K105 WeakPolarHBondContact O-CB 2.92Å; K102-K105 PolarHBondContact O-N 2.87Å; K102-S106 PolarHBondContact O-N 2.86Å
103	L	81.6	Confident	80.7	Confident	14 Å²	14	67.1 Å²	67.1	7%	0.073	32%	0.315	C	S	.	.	H	α-helix	trans	-61.8	-45.7	176.6	-176.1	130.3	0	0	0	112.4	M85 I93 P99 K105 S106 Y107 F110	M85-L103 HydrophobicContact CE-CD1 3.37Å; M85-L103 HydrophobicContact SD-CD1 3.16Å; M85-L103 WeakPolarHBondContact SD-CD1 3.16Å; I93-L103 HydrophobicContact CD1-CD1 4.36Å; P99-L103 WeakPolarHBondContact O-CB 3.41Å; P99-L103 PolarHBondContact O-N 3.29Å; L103-K105 PolarHBondContact O-N 3.36Å; L103-K105 VanDerWaalsContact O-N 3.11Å; L103-S106 WeakPolarHBondContact CA-OG 3.25Å; L103-S106 PolarHBondContact O-N 2.94Å; L103-S106 PolarHBondContact O-OG 3.33Å; L103-Y107 HydrophobicContact CD1-CE2 4.3Å; L103-Y107 HydrophobicContact CG-CD2 4.12Å; L103-Y107 HydrophobicContact CG-CE2 4.25Å; L103-Y107 PolarHBondContact O-N 3.49Å; L103-F110 HydrophobicContact CD2-CE1 3.47Å; L103-F110 VanDerWaalsContact CD2-CE1 3.47Å; L103-F110 HydrophobicContact CD2-CZ 3.61Å; L103-F110 HydrophobicContact CG-CE1 4.3Å; L103-F110 HydrophobicContact CG-CZ 4.39Å
104	A	79.9	Confident	80.8	Confident	0 Å²	0	70 Å²	70	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-62.1	-20.4	175.5	0	0	0	0	0	113	L100 L128 F131 K133	L100-A104 VanDerWaalsContact O-CB 3.3Å; L100-A104 WeakPolarHBondContact O-CB 3.45Å; L100-A104 PolarHBondContact O-N 3.15Å; A104-L128 HydrophobicContact CB-CD2 3.85Å; A104-F131 HydrophobicContact CB-CD2 3.42Å; A104-F131 VanDerWaalsContact CB-CD2 3.42Å; A104-F131 HydrophobicContact CB-CE2 3.74Å; A104-F131 HydrophobicContact CB-CG 4.08Å; A104-K133 WeakPolarHBondContact O-CD 3.32Å; A104-K133 WeakPolarHBondContact O-CE 3.29Å; A104-K133 PolarHBondContact O-NZ 3.23Å
105	K	81.3	Confident	81.1	Confident	149 Å²	149	71.7 Å²	71.7	65%	0.648	34%	0.337	S	S	*	.	H	α-helix	trans	-88.1	-35.4	174.4	-74.7	178.1	179.4	-172.3	0	112.8	K101 K102 L103 F131	K101-K105 WeakPolarHBondContact O-CG 3.48Å; K101-K105 PolarHBondContact O-N 2.91Å; K102-K105 WeakPolarHBondContact O-CB 2.92Å; K102-K105 PolarHBondContact O-N 2.87Å; L103-K105 PolarHBondContact O-N 3.36Å; L103-K105 VanDerWaalsContact O-N 3.11Å; K105-F131 HydrophobicContact CG-CE1 3.98Å; K105-F131 HydrophobicContact CG-CZ 4.36Å
106	S	82.8	Confident	81.2	Confident	65 Å²	65	63.1 Å²	63.1	46%	0.455	30%	0.3	S	S	.	.	H	α-helix	trans	-69.7	-37.2	-175	56.9	0	0	0	0	113.6	S64 K102 L103	S64-S106 PolarHBondContact OG-O 2.92Å; K102-S106 PolarHBondContact O-N 2.86Å; L103-S106 WeakPolarHBondContact CA-OG 3.25Å; L103-S106 PolarHBondContact O-N 2.94Å; L103-S106 PolarHBondContact O-OG 3.33Å
107	Y	81.7	Confident	81.2	Confident	52 Å²	52	58.7 Å²	58.7	20%	0.204	28%	0.28	C	S	.	.			trans	-102.8	143	-177.6	-60.3	-67.4	0	0	0	112.4	C66 P83 L103 F110 K133	C66-Y107 HydrophobicContact CB-CD1 3.83Å; C66-Y107 HydrophobicContact CB-CD2 3.63Å; C66-Y107 HydrophobicContact CB-CE1 4.23Å; C66-Y107 HydrophobicContact CB-CE2 3.99Å; C66-Y107 HydrophobicContact CB-CG 3.52Å; P83-Y107 HydrophobicContact CB-CE1 3.86Å; P83-Y107 WeakPolarHBondContact CB-OH 3.31Å; P83-Y107 HydrophobicContact CG-CD1 4.14Å; P83-Y107 HydrophobicContact CG-CE1 3.42Å; P83-Y107 VanDerWaalsContact CG-CE1 3.42Å; L103-Y107 HydrophobicContact CD1-CE2 4.3Å; L103-Y107 HydrophobicContact CG-CD2 4.12Å; L103-Y107 HydrophobicContact CG-CE2 4.25Å; L103-Y107 PolarHBondContact O-N 3.49Å; Y107-F110 AromaticContact CD2-CE1 3.87Å; Y107-F110 HydrophobicContact CD2-CE1 3.87Å; Y107-F110 HydrophobicContact CD2-CZ 4.09Å; Y107-F110 HydrophobicContact CG-CE1 4.24Å; Y107-F110 HydrophobicContact CG-CZ 4.35Å; Y107-K133 VanDerWaalsContact O-CD 3.31Å; Y107-K133 WeakPolarHBondContact O-CD 3.47Å; Y107-K133 VanDerWaalsContact O-CE 3.3Å; Y107-K133 WeakPolarHBondContact O-CE 3.44Å; Y107-K133 PolarHBondContact O-NZ 3.26Å
108	H	76.6	Confident	81.3	Confident	95 Å²	95	60.2 Å²	60.2	44%	0.44	28%	0.281	S	S	.	.	S	Bend	trans	-82.5	-36.6	-177.9	-66.5	85.1	0	0	0	112.4	M63 S64	M63-H108 HydrophobicContact CE-CB 4.23Å; M63-H108 HydrophobicContact CG-CB 3.5Å; M63-H108 HydrophobicContact SD-CB 4.26Å; S64-H108 PolarHBondContact O-N 2.87Å; S64-H108 PolarHBondContact OG-ND1 3.39Å
109	A	82.9	Confident	81	Confident	15 Å²	15	57.3 Å²	57.3	12%	0.124	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	158.3	176.7	0	0	0	0	0	110.9	S64 V65 C66 I151	S64-A109 PolarHBondContact O-N 3.41Å; V65-A109 WeakPolarHBondContact CA-O 3.4Å; V65-A109 HydrophobicContact CG1-CB 4.43Å; V65-A109 HydrophobicContact CG2-CB 4.29Å; C66-A109 PolarHBondContact N-O 3.43Å; A109-I151 HydrophobicContact CB-CG2 3.56Å
110	F	83.6	Confident	80.6	Confident	2 Å²	2	56 Å²	56	1%	0.009	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	138.5	177.6	-67	-82.3	0	0	0	109.3	C66 L68 L103 Y107 L128 K133 P135 S136	C66-F110 HydrophobicContact CB-CD1 3.64Å; C66-F110 HydrophobicContact CB-CE1 3.66Å; C66-F110 CarbonylContact O-C 3.55Å; C66-F110 WeakPolarHBondContact O-CA 3.47Å; L68-F110 HydrophobicContact CD1-CB 4.48Å; L68-F110 HydrophobicContact CD1-CD1 4.13Å; L68-F110 HydrophobicContact CG-CD1 4.4Å; L103-F110 HydrophobicContact CD2-CE1 3.47Å; L103-F110 VanDerWaalsContact CD2-CE1 3.47Å; L103-F110 HydrophobicContact CD2-CZ 3.61Å; L103-F110 HydrophobicContact CG-CE1 4.3Å; L103-F110 HydrophobicContact CG-CZ 4.39Å; Y107-F110 AromaticContact CD2-CE1 3.87Å; Y107-F110 HydrophobicContact CD2-CE1 3.87Å; Y107-F110 HydrophobicContact CD2-CZ 4.09Å; Y107-F110 HydrophobicContact CG-CE1 4.24Å; Y107-F110 HydrophobicContact CG-CZ 4.35Å; F110-L128 HydrophobicContact CD2-CD1 4.15Å; F110-L128 HydrophobicContact CD2-CD2 3.79Å; F110-L128 HydrophobicContact CE2-CD2 3.5Å; F110-L128 HydrophobicContact CG-CD1 4.35Å; F110-L128 HydrophobicContact CZ-CD2 4.08Å; F110-K133 HydrophobicContact CD2-CB 4.04Å; F110-K133 HydrophobicContact CE2-CB 4.2Å; F110-K133 HydrophobicContact CE2-CD 4.14Å; F110-P135 HydrophobicContact CB-CB 3.89Å; F110-P135 CarbonylContact O-C 3.6Å; F110-P135 VanDerWaalsContact O-CA 3.28Å; F110-P135 WeakPolarHBondContact O-CA 3.39Å; F110-S136 PolarHBondContact O-N 3.22Å
111	V	84.7	Confident	80.6	Confident	2 Å²	2	59.1 Å²	59.1	1%	0.012	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	133.2	169	173.3	0	0	0	0	106.3	V65 C66 V67 L68 S136 V138 I148 I151	V65-V111 HydrophobicContact CG1-CG2 3.71Å; C66-V111 PolarHBondContact O-N 3.21Å; V67-V111 CarbonylContact C-O 3.46Å; V67-V111 WeakPolarHBondContact CA-O 3.29Å; L68-V111 PolarHBondContact N-O 2.64Å; V111-S136 WeakPolarHBondContact CA-O 3.43Å; V111-V138 HydrophobicContact CG1-CB 4.02Å; V111-V138 HydrophobicContact CG1-CG2 3.32Å; V111-I148 HydrophobicContact CG2-CG1 4.29Å; V111-I151 HydrophobicContact CG2-CD1 3.26Å
112	A	83.7	Confident	80.5	Confident	3 Å²	3	65.4 Å²	65.4	3%	0.025	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	140.4	179.3	0	0	0	0	0	111.9	L68 I117 P135 S136 A137 V138	L68-A112 HydrophobicContact CB-CB 3.92Å; L68-A112 HydrophobicContact CD1-CB 4.34Å; L68-A112 CarbonylContact O-C 3.54Å; L68-A112 WeakPolarHBondContact O-CA 2.96Å; A112-I117 HydrophobicContact CB-CD1 3.8Å; A112-I117 HydrophobicContact CB-CG1 3.41Å; A112-I117 VanDerWaalsContact CB-CG1 3.41Å; A112-I117 WeakPolarHBondContact O-CD1 3.43Å; A112-P135 HydrophobicContact CB-CB 3.93Å; A112-S136 PolarHBondContact N-O 2.98Å; A112-A137 CarbonylContact O-C 3.57Å; A112-A137 VanDerWaalsContact O-CA 3.29Å; A112-A137 WeakPolarHBondContact O-CA 3.46Å; A112-V138 PolarHBondContact O-N 3.35Å
113	S	81.8	Confident	80.4	Confident	3 Å²	3	60.6 Å²	60.6	2%	0.021	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	148.9	172.2	-165.8	0	0	0	0	110.7	L68 H73 T115 V116 I117 H140	L68-S113 PolarHBondContact O-N 3.47Å; H73-S113 VanDerWaalsContact CD2-CB 3.4Å; H73-S113 WeakPolarHBondContact CD2-CB 3.44Å; H73-S113 PolarHBondContact CD2-OG 3.31Å; H73-S113 VanDerWaalsContact CD2-OG 3.29Å; H73-S113 PolarHBondContact NE2-OG 2.72Å; S113-T115 PolarHBondContact O-N 3.27Å; S113-V116 PolarHBondContact O-N 3.14Å; S113-V116 VanDerWaalsContact O-N 3.16Å; S113-I117 WeakPolarHBondContact O-CG1 3.23Å; S113-I117 PolarHBondContact O-N 2.8Å; S113-H140 PolarHBondContact OG-CE1 3.38Å
114	E	80	Confident	80.2	Confident	90 Å²	90	60.2 Å²	60.2	42%	0.421	28%	0.284	S	S	.	.	H	α-helix	trans	-58.5	-35.8	-177.3	-66.6	-169.4	168.2	0	0	113.2	I117 R118 A137 V138 T139	E114-I117 PolarHBondContact O-N 2.71Å; E114-R118 WeakPolarHBondContact O-CG 3.25Å; E114-R118 PolarHBondContact O-N 3.42Å; E114-A137 HydrophobicContact CG-CB 4.36Å; E114-V138 PolarHBondContact N-O 2.65Å; E114-T139 HydrophobicContact CG-CG2 4.44Å; E114-T139 VanDerWaalsContact OE1-CG2 3.25Å; E114-T139 WeakPolarHBondContact OE1-CG2 3.12Å
115	T	79.1	Confident	80.2	Confident	62 Å²	62	61.2 Å²	61.2	38%	0.38	29%	0.29	S	S	.	.	H	α-helix	trans	-59.7	-48.3	176.6	49.6	0	0	0	0	111	D70 S113	D70-T115 WeakPolarHBondContact OD2-CB 3.45Å; D70-T115 PolarHBondContact OD2-OG1 3.21Å; S113-T115 PolarHBondContact O-N 3.27Å
116	V	78.5	Confident	80.3	Confident	3 Å²	3	57.7 Å²	57.7	2%	0.018	28%	0.282	C	S	.	.	H	α-helix	trans	-67.2	-46.9	179.3	176.9	0	0	0	0	110.3	L68 L90 S113 R118 Q119 F120	L68-V116 HydrophobicContact CB-CG1 4.29Å; L90-V116 HydrophobicContact CD2-CG1 3.91Å; S113-V116 PolarHBondContact O-N 3.14Å; S113-V116 VanDerWaalsContact O-N 3.16Å; V116-R118 VanDerWaalsContact C-N 3.27Å; V116-R118 PolarHBondContact O-N 3.27Å; V116-Q119 PolarHBondContact O-N 2.9Å; V116-Q119 VanDerWaalsContact O-N 3.09Å; V116-F120 HydrophobicContact CB-CD2 4.48Å; V116-F120 HydrophobicContact CG1-CD2 3.52Å; V116-F120 HydrophobicContact CG1-CE2 3.67Å; V116-F120 WeakPolarHBondContact O-CD2 3.43Å; V116-F120 PolarHBondContact O-N 3.48Å; V116-F120 VanDerWaalsContact O-N 3.16Å
117	I	79	Confident	80.3	Confident	32 Å²	32	56.1 Å²	56.1	16%	0.164	27%	0.27	C	S	.	.	H	α-helix	trans	-54.3	-44.1	-178.2	-70.7	171.3	0	0	0	111.6	A112 S113 E114 Q119 F120 T121 A137	A112-I117 HydrophobicContact CB-CD1 3.8Å; A112-I117 HydrophobicContact CB-CG1 3.41Å; A112-I117 VanDerWaalsContact CB-CG1 3.41Å; A112-I117 WeakPolarHBondContact O-CD1 3.43Å; S113-I117 WeakPolarHBondContact O-CG1 3.23Å; S113-I117 PolarHBondContact O-N 2.8Å; E114-I117 PolarHBondContact O-N 2.71Å; I117-Q119 VanDerWaalsContact C-N 3.34Å; I117-Q119 PolarHBondContact O-N 2.67Å; I117-F120 PolarHBondContact O-N 3.43Å; I117-T121 PolarHBondContact O-N 2.7Å; I117-T121 PolarHBondContact O-OG1 3.03Å; I117-A137 HydrophobicContact CD1-CB 3.53Å
118	R	78.9	Confident	80.2	Confident	200 Å²	200	53.7 Å²	53.7	76%	0.755	26%	0.26	S	S	*	.	H	α-helix	trans	-60.9	-41.1	-179.2	-71.3	-179.5	-176.3	-147.9	3.2	112.3	E114 V116	E114-R118 WeakPolarHBondContact O-CG 3.25Å; E114-R118 PolarHBondContact O-N 3.42Å; V116-R118 VanDerWaalsContact C-N 3.27Å; V116-R118 PolarHBondContact O-N 3.27Å
119	Q	77.4	Confident	80.5	Confident	112 Å²	112	52.8 Å²	52.8	52%	0.523	26%	0.262	S	S	.	.	H	α-helix	trans	-68.2	-37.2	178.9	-63.1	-175.4	10	0	0	112.2	V116 I117	V116-Q119 PolarHBondContact O-N 2.9Å; V116-Q119 VanDerWaalsContact O-N 3.09Å; I117-Q119 VanDerWaalsContact C-N 3.34Å; I117-Q119 PolarHBondContact O-N 2.67Å
120	F	74.8	Confident	80.3	Confident	10 Å²	10	60.6 Å²	60.6	4%	0.044	29%	0.293	C	S	.	.	H	α-helix	trans	-102.9	8.8	-171.8	-59.5	-74.3	0	0	0	114.8	L90 K91 V116 I117 R122 T123 V124 V125	L90-F120 HydrophobicContact CB-CE1 4.21Å; L90-F120 HydrophobicContact CB-CE2 4.34Å; L90-F120 HydrophobicContact CB-CZ 3.95Å; L90-F120 HydrophobicContact CD2-CB 4.5Å; L90-F120 HydrophobicContact CD2-CD1 4.14Å; L90-F120 HydrophobicContact CD2-CD2 3.45Å; L90-F120 VanDerWaalsContact CD2-CD2 3.45Å; L90-F120 HydrophobicContact CD2-CE1 4.21Å; L90-F120 HydrophobicContact CD2-CE2 3.61Å; L90-F120 HydrophobicContact CD2-CG 3.77Å; L90-F120 HydrophobicContact CD2-CZ 3.96Å; L90-F120 HydrophobicContact CG-CD1 4.09Å; L90-F120 HydrophobicContact CG-CD2 4.23Å; L90-F120 HydrophobicContact CG-CE1 3.94Å; L90-F120 HydrophobicContact CG-CE2 4.17Å; L90-F120 HydrophobicContact CG-CG 4.23Å; L90-F120 HydrophobicContact CG-CZ 3.99Å; K91-F120 HydrophobicContact CB-CE1 4.5Å; K91-F120 HydrophobicContact CG-CE1 3.72Å; K91-F120 HydrophobicContact CG-CZ 3.72Å; V116-F120 HydrophobicContact CB-CD2 4.48Å; V116-F120 HydrophobicContact CG1-CD2 3.52Å; V116-F120 HydrophobicContact CG1-CE2 3.67Å; V116-F120 WeakPolarHBondContact O-CD2 3.43Å; V116-F120 PolarHBondContact O-N 3.48Å; V116-F120 VanDerWaalsContact O-N 3.16Å; I117-F120 PolarHBondContact O-N 3.43Å; F120-R122 PolarHBondContact O-N 3.04Å; F120-T123 PolarHBondContact O-N 3.03Å; F120-V124 HydrophobicContact CB-CB 3.9Å; F120-V124 HydrophobicContact CB-CG2 3.75Å; F120-V124 HydrophobicContact CD1-CG2 3.99Å; F120-V124 HydrophobicContact CG-CG2 4.14Å; F120-V124 PolarHBondContact O-N 3.02Å; F120-V125 PolarHBondContact O-N 3.38Å
121	T	80	Confident	80	Confident	69 Å²	69	63.9 Å²	63.9	42%	0.423	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-32.8	179.5	-62.7	0	0	0	0	112.2	I117 V125 P126	I117-T121 PolarHBondContact O-N 2.7Å; I117-T121 PolarHBondContact O-OG1 3.03Å; T121-V125 WeakPolarHBondContact O-CB 3.2Å; T121-P126 WeakPolarHBondContact O-CD 3.46Å
122	R	78.9	Confident	79.5	Confident	233 Å²	233	65.6 Å²	65.6	88%	0.879	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-30.1	-178.5	-66.9	-176.3	179.5	179.5	0.4	114	F120 P126	F120-R122 PolarHBondContact O-N 3.04Å; R122-P126 WeakPolarHBondContact O-CG 3.33Å
123	T	80.3	Confident	79.2	Confident	62 Å²	62	67.5 Å²	67.5	38%	0.38	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	-50.7	-170.2	50.8	0	0	0	0	112.2	F120	F120-T123 PolarHBondContact O-N 3.03Å
124	V	79.1	Confident	79.1	Confident	6 Å²	6	73.4 Å²	73.4	4%	0.036	36%	0.358	C	S	.	.	H	α-helix	trans	-86.5	-44.7	-171.8	174.8	0	0	0	0	111.3	L90 L100 F120 V127 L128	L90-V124 HydrophobicContact CD1-CG2 4.21Å; L90-V124 HydrophobicContact CG-CG2 4.35Å; L100-V124 HydrophobicContact CD1-CG1 4.28Å; L100-V124 HydrophobicContact CD1-CG2 4.23Å; F120-V124 HydrophobicContact CB-CB 3.9Å; F120-V124 HydrophobicContact CB-CG2 3.75Å; F120-V124 HydrophobicContact CD1-CG2 3.99Å; F120-V124 HydrophobicContact CG-CG2 4.14Å; F120-V124 PolarHBondContact O-N 3.02Å; V124-V127 PolarHBondContact O-N 2.91Å; V124-V127 VanDerWaalsContact O-N 3.08Å; V124-L128 HydrophobicContact CG1-CD1 3.5Å; V124-L128 VanDerWaalsContact CG1-CD1 3.5Å; V124-L128 HydrophobicContact CG1-CG 3.76Å; V124-L128 PolarHBondContact O-N 2.96Å
125	V	78.1	Confident	79	Confident	21 Å²	21	69.4 Å²	69.4	13%	0.127	34%	0.34	C	S	.	.	H	α-helix	trans	-59.1	-41.6	-175.4	172.4	0	0	0	0	113.4	F120 T121 V127 L128 T129 F134	F120-V125 PolarHBondContact O-N 3.38Å; T121-V125 WeakPolarHBondContact O-CB 3.2Å; V125-V127 VanDerWaalsContact C-N 3.28Å; V125-V127 PolarHBondContact O-N 3.08Å; V125-L128 PolarHBondContact O-N 3.32Å; V125-T129 WeakPolarHBondContact O-CB 3.2Å; V125-T129 PolarHBondContact O-N 2.94Å; V125-T129 PolarHBondContact O-OG1 3.38Å; V125-F134 HydrophobicContact CG1-CD2 3.97Å; V125-F134 HydrophobicContact CG1-CE2 3.49Å; V125-F134 VanDerWaalsContact CG1-CE2 3.49Å; V125-F134 HydrophobicContact CG1-CZ 4.49Å
126	P	83.4	Confident	79.1	Confident	74 Å²	74	68.6 Å²	68.6	48%	0.481	34%	0.337	S	S	.	.	H	α-helix	trans	-62.4	-36.6	176.6	-24.9	36	0	0	0	112.7	T121 R122 K130	T121-P126 WeakPolarHBondContact O-CD 3.46Å; R122-P126 WeakPolarHBondContact O-CG 3.33Å; P126-K130 PolarHBondContact O-N 2.98Å; P126-K130 VanDerWaalsContact O-N 3.16Å
127	V	82.9	Confident	79.4	Confident	32 Å²	32	70.8 Å²	70.8	19%	0.194	36%	0.355	C	S	.	.	H	α-helix	trans	-71.5	-46.7	178.6	-178.5	0	0	0	0	110.4	L100 K101 V124 V125 T129 K130 F131	L100-V127 HydrophobicContact CD2-CB 3.85Å; L100-V127 HydrophobicContact CD2-CG1 4.07Å; L100-V127 HydrophobicContact CD2-CG2 3.69Å; L100-V127 HydrophobicContact CG-CB 4.23Å; L100-V127 HydrophobicContact CG-CG1 3.96Å; L100-V127 HydrophobicContact CG-CG2 4.49Å; K101-V127 HydrophobicContact CG-CG1 4.32Å; V124-V127 PolarHBondContact O-N 2.91Å; V124-V127 VanDerWaalsContact O-N 3.08Å; V125-V127 VanDerWaalsContact C-N 3.28Å; V125-V127 PolarHBondContact O-N 3.08Å; V127-T129 VanDerWaalsContact C-N 3.33Å; V127-T129 PolarHBondContact O-N 3.25Å; V127-K130 WeakPolarHBondContact O-CB 3.34Å; V127-K130 PolarHBondContact O-N 3.43Å; V127-F131 HydrophobicContact CG1-CD2 4.34Å; V127-F131 HydrophobicContact CG1-CE2 4.06Å; V127-F131 WeakPolarHBondContact O-CD2 3.11Å; V127-F131 PolarHBondContact O-N 3.4Å
128	L	80.7	Confident	79.5	Confident	1 Å²	1	69.3 Å²	69.3	1%	0.005	35%	0.347	C	S	.	.	H	α-helix	trans	-63.2	-38.2	177.2	-71.2	-173.3	0	0	0	112.7	A104 F110 V124 V125 K130 F131 G132 K133 P135	A104-L128 HydrophobicContact CB-CD2 3.85Å; F110-L128 HydrophobicContact CD2-CD1 4.15Å; F110-L128 HydrophobicContact CD2-CD2 3.79Å; F110-L128 HydrophobicContact CE2-CD2 3.5Å; F110-L128 HydrophobicContact CG-CD1 4.35Å; F110-L128 HydrophobicContact CZ-CD2 4.08Å; V124-L128 HydrophobicContact CG1-CD1 3.5Å; V124-L128 VanDerWaalsContact CG1-CD1 3.5Å; V124-L128 HydrophobicContact CG1-CG 3.76Å; V124-L128 PolarHBondContact O-N 2.96Å; V125-L128 PolarHBondContact O-N 3.32Å; L128-K130 VanDerWaalsContact C-N 3.32Å; L128-K130 PolarHBondContact O-N 3.09Å; L128-F131 CarbonylContact O-C 3.57Å; L128-F131 PolarHBondContact O-N 3.33Å; L128-F131 VanDerWaalsContact O-N 3.08Å; L128-G132 PolarHBondContact O-N 2.81Å; L128-K133 WeakPolarHBondContact CB-O 3.36Å; L128-K133 PolarHBondContact O-N 3.24Å; L128-P135 HydrophobicContact CD1-CG 4.19Å
129	T	82	Confident	79.5	Confident	77 Å²	77	61.9 Å²	61.9	47%	0.472	32%	0.324	S	S	.	.	H	α-helix	trans	-64.7	-37.4	176.6	-59.3	0	0	0	0	111.4	V125 V127 F131 G132	V125-T129 WeakPolarHBondContact O-CB 3.2Å; V125-T129 PolarHBondContact O-N 2.94Å; V125-T129 PolarHBondContact O-OG1 3.38Å; V127-T129 VanDerWaalsContact C-N 3.33Å; V127-T129 PolarHBondContact O-N 3.25Å; T129-F131 PolarHBondContact O-N 2.93Å; T129-G132 WeakPolarHBondContact O-CA 3.16Å; T129-G132 PolarHBondContact O-N 3.43Å
130	K	78.6	Confident	79.2	Confident	179 Å²	179	60.6 Å²	60.6	78%	0.778	32%	0.318	S	S	*	.	H	α-helix	trans	-60.9	-30.2	173.6	-170.5	170.3	-177.3	166.7	0	112.6	P126 V127 L128	P126-K130 PolarHBondContact O-N 2.98Å; P126-K130 VanDerWaalsContact O-N 3.16Å; V127-K130 WeakPolarHBondContact O-CB 3.34Å; V127-K130 PolarHBondContact O-N 3.43Å; L128-K130 VanDerWaalsContact C-N 3.32Å; L128-K130 PolarHBondContact O-N 3.09Å
131	F	78.1	Confident	79.1	Confident	71 Å²	71	67.4 Å²	67.4	31%	0.311	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-2.9	172.8	-68.6	-74.8	0	0	0	113.8	K101 A104 K105 V127 L128 T129 K133	K101-F131 HydrophobicContact CB-CE2 4.41Å; K101-F131 HydrophobicContact CB-CZ 4.34Å; K101-F131 HydrophobicContact CG-CE2 4.08Å; K101-F131 HydrophobicContact CG-CZ 4.19Å; A104-F131 HydrophobicContact CB-CD2 3.42Å; A104-F131 VanDerWaalsContact CB-CD2 3.42Å; A104-F131 HydrophobicContact CB-CE2 3.74Å; A104-F131 HydrophobicContact CB-CG 4.08Å; K105-F131 HydrophobicContact CG-CE1 3.98Å; K105-F131 HydrophobicContact CG-CZ 4.36Å; V127-F131 HydrophobicContact CG1-CD2 4.34Å; V127-F131 HydrophobicContact CG1-CE2 4.06Å; V127-F131 WeakPolarHBondContact O-CD2 3.11Å; V127-F131 PolarHBondContact O-N 3.4Å; L128-F131 CarbonylContact O-C 3.57Å; L128-F131 PolarHBondContact O-N 3.33Å; L128-F131 VanDerWaalsContact O-N 3.08Å; T129-F131 PolarHBondContact O-N 2.93Å; F131-K133 VanDerWaalsContact C-N 3.31Å; F131-K133 HydrophobicContact CB-CD 4.46Å; F131-K133 HydrophobicContact CB-CG 4.43Å
132	G	74.4	Confident	78.8	Confident	37 Å²	37	68.1 Å²	68.1	38%	0.381	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.4	16.1	-179.2	0	0	0	0	0	114.9	L128 T129	L128-G132 PolarHBondContact O-N 2.81Å; T129-G132 WeakPolarHBondContact O-CA 3.16Å; T129-G132 PolarHBondContact O-N 3.43Å
133	K	78.2	Confident	78.7	Confident	43 Å²	43	60.2 Å²	60.2	19%	0.187	33%	0.333	C	S	.	.			trans	-111.5	59.1	-173.3	-60.2	179.1	-177.6	175.1	0	111.3	A104 Y107 F110 L128 F131	A104-K133 WeakPolarHBondContact O-CD 3.32Å; A104-K133 WeakPolarHBondContact O-CE 3.29Å; A104-K133 PolarHBondContact O-NZ 3.23Å; Y107-K133 VanDerWaalsContact O-CD 3.31Å; Y107-K133 WeakPolarHBondContact O-CD 3.47Å; Y107-K133 VanDerWaalsContact O-CE 3.3Å; Y107-K133 WeakPolarHBondContact O-CE 3.44Å; Y107-K133 PolarHBondContact O-NZ 3.26Å; F110-K133 HydrophobicContact CD2-CB 4.04Å; F110-K133 HydrophobicContact CE2-CB 4.2Å; F110-K133 HydrophobicContact CE2-CD 4.14Å; L128-K133 WeakPolarHBondContact CB-O 3.36Å; L128-K133 PolarHBondContact O-N 3.24Å; F131-K133 VanDerWaalsContact C-N 3.31Å; F131-K133 HydrophobicContact CB-CD 4.46Å; F131-K133 HydrophobicContact CB-CG 4.43Å
134	F	77.9	Confident	78.5	Confident	128 Å²	128	57.4 Å²	57.4	56%	0.561	32%	0.315	S	S	*	.	P	Polyproline II helix	trans	-62.9	132.5	178.2	-168.5	-90.6	0	0	0	109.9	V125	V125-F134 HydrophobicContact CG1-CD2 3.97Å; V125-F134 HydrophobicContact CG1-CE2 3.49Å; V125-F134 VanDerWaalsContact CG1-CE2 3.49Å; V125-F134 HydrophobicContact CG1-CZ 4.49Å
135	P	78.3	Confident	78.6	Confident	5 Å²	5	60.3 Å²	60.3	3%	0.032	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-70.8	135	-178.2	28.1	-32.4	0	0	0	110.9	F110 A112 L128	F110-P135 HydrophobicContact CB-CB 3.89Å; F110-P135 CarbonylContact O-C 3.6Å; F110-P135 VanDerWaalsContact O-CA 3.28Å; F110-P135 WeakPolarHBondContact O-CA 3.39Å; A112-P135 HydrophobicContact CB-CB 3.93Å; L128-P135 HydrophobicContact CD1-CG 4.19Å
136	S	82.4	Confident	78.8	Confident	46 Å²	46	63.9 Å²	63.9	32%	0.322	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	128.8	170.8	-66.9	0	0	0	0	109.5	F110 V111 A112	F110-S136 PolarHBondContact O-N 3.22Å; V111-S136 WeakPolarHBondContact CA-O 3.43Å; A112-S136 PolarHBondContact N-O 2.98Å
137	A	83.4	Confident	78.7	Confident	48 Å²	48	62.3 Å²	62.3	40%	0.397	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	137.9	174.2	0	0	0	0	0	110.8	A112 E114 I117	A112-A137 CarbonylContact O-C 3.57Å; A112-A137 VanDerWaalsContact O-CA 3.29Å; A112-A137 WeakPolarHBondContact O-CA 3.46Å; E114-A137 HydrophobicContact CG-CB 4.36Å; I117-A137 HydrophobicContact CD1-CB 3.53Å
138	V	81.1	Confident	78.6	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.006	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	136	171.5	169.6	0	0	0	0	109.3	V111 A112 E114 L144 K147	V111-V138 HydrophobicContact CG1-CB 4.02Å; V111-V138 HydrophobicContact CG1-CG2 3.32Å; A112-V138 PolarHBondContact O-N 3.35Å; E114-V138 PolarHBondContact N-O 2.65Å; V138-L144 HydrophobicContact CG1-CD1 3.74Å; V138-K147 HydrophobicContact CG2-CB 3.9Å; V138-K147 HydrophobicContact CG2-CD 4.27Å; V138-K147 HydrophobicContact CG2-CG 3.55Å
139	T	78.7	Confident	78.7	Confident	44 Å²	44	63.5 Å²	63.5	27%	0.27	34%	0.342	S	S	.	.			trans	-92.6	155.1	169.9	60	0	0	0	0	109	E114 N141 E142	E114-T139 HydrophobicContact CG-CG2 4.44Å; E114-T139 VanDerWaalsContact OE1-CG2 3.25Å; E114-T139 WeakPolarHBondContact OE1-CG2 3.12Å; T139-N141 PolarHBondContact O-N 2.87Å; T139-E142 PolarHBondContact O-N 2.89Å
140	H	72.1	Confident	78.8	Confident	85 Å²	85	62.7 Å²	62.7	39%	0.394	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-8.7	176	-59.9	83.9	0	0	0	113.5	Q72 H73 S113	Q72-H140 PolarHBondContact OE1-CD2 3.21Å; H73-H140 AromaticContact CD2-CD2 3.94Å; H73-H140 AromaticContact CD2-NE2 3.63Å; H73-H140 AromaticContact CE1-CD2 3.74Å; H73-H140 AromaticContact NE2-CD2 3.35Å; H73-H140 PolarHBondContact NE2-CD2 3.27Å; H73-H140 VanDerWaalsContact NE2-CD2 3.35Å; H73-H140 AromaticContact NE2-CE1 3.7Å; H73-H140 AromaticContact NE2-CG 3.78Å; H73-H140 AromaticContact NE2-ND1 3.99Å; H73-H140 AromaticContact NE2-NE2 3.3Å; H73-H140 PolarHBondContact NE2-NE2 3.49Å; S113-H140 PolarHBondContact OG-CE1 3.38Å
141	N	73.4	Confident	79	Confident	153 Å²	153	55.2 Å²	55.2	82%	0.818	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-15.6	179.8	-66.1	-16.4	0	0	0	113	T139	T139-N141 PolarHBondContact O-N 2.87Å
142	E	73.1	Confident	79.2	Confident	84 Å²	84	53.1 Å²	53.1	39%	0.393	29%	0.292	S	S	.	.	S	Bend	trans	-105.3	127.1	-179.5	-70	-176.6	176.5	0	0	110.4	T139 L144 K147	T139-E142 PolarHBondContact O-N 2.89Å; E142-L144 PolarHBondContact O-N 2.97Å; E142-K147 IonicContact OE2-NZ 2.8Å; E142-K147 PolarHBondContact OE2-NZ 3.23Å
143	P	75.5	Confident	79.7	Confident	68 Å²	68	51.6 Å²	51.6	44%	0.442	28%	0.276	S	S	.	.			trans	-63	129.6	177.4	25.9	-34	0	0	0	110.3	V145 N146 K147	P143-V145 PolarHBondContact O-N 2.81Å; P143-V145 VanDerWaalsContact O-N 3.12Å; P143-N146 HydrophobicContact CG-CB 4.07Å; P143-N146 VanDerWaalsContact CG-ND2 3.32Å; P143-N146 WeakPolarHBondContact CG-ND2 3.47Å; P143-N146 PolarHBondContact O-N 2.84Å; P143-N146 VanDerWaalsContact O-N 3.09Å; P143-K147 PolarHBondContact O-N 2.93Å
144	L	77.8	Confident	80	Confident	3 Å²	3	51.9 Å²	51.9	2%	0.016	28%	0.282	C	S	.	.	H	α-helix	trans	-53.1	-38	-176.9	-106.9	67.3	0	0	0	113.3	V67 H73 E76 A77 V138 E142 N146 K147 I148	V67-L144 HydrophobicContact CB-CD2 4.38Å; V67-L144 HydrophobicContact CG1-CD2 3.55Å; V67-L144 HydrophobicContact CG2-CD2 3.97Å; H73-L144 HydrophobicContact CB-CD2 4.33Å; H73-L144 WeakPolarHBondContact ND1-CD1 3.29Å; E76-L144 HydrophobicContact CB-CD2 4.27Å; E76-L144 WeakPolarHBondContact OE2-CD1 3.38Å; A77-L144 HydrophobicContact CB-CD2 4.15Å; V138-L144 HydrophobicContact CG1-CD1 3.74Å; E142-L144 PolarHBondContact O-N 2.97Å; L144-N146 VanDerWaalsContact C-N 3.33Å; L144-N146 PolarHBondContact O-N 3.28Å; L144-K147 PolarHBondContact O-N 3.47Å; L144-I148 WeakPolarHBondContact O-CB 3.45Å; L144-I148 VanDerWaalsContact O-CG1 3.22Å; L144-I148 WeakPolarHBondContact O-CG1 3.49Å; L144-I148 PolarHBondContact O-N 3.04Å
145	V	80.4	Confident	80.3	Confident	66 Å²	66	46.5 Å²	46.5	40%	0.4	26%	0.259	S	S	.	.	H	α-helix	trans	-58.7	-45.1	-178.7	-177.4	0	0	0	0	111.2	A80 P143 K147 I148 D149	A80-V145 HydrophobicContact CB-CG2 3.98Å; P143-V145 PolarHBondContact O-N 2.81Å; P143-V145 VanDerWaalsContact O-N 3.12Å; V145-K147 VanDerWaalsContact C-N 3.34Å; V145-K147 PolarHBondContact O-N 2.86Å; V145-I148 PolarHBondContact O-N 3.39Å; V145-D149 WeakPolarHBondContact O-CB 3.29Å; V145-D149 PolarHBondContact O-N 2.88Å
146	N	82.6	Confident	80.6	Confident	97 Å²	97	50.8 Å²	50.8	52%	0.519	28%	0.277	S	S	.	.	H	α-helix	trans	-63.9	-42.2	179.6	-71.1	-4.7	0	0	0	110.8	P143 L144 I148 D149 E150	P143-N146 HydrophobicContact CG-CB 4.07Å; P143-N146 VanDerWaalsContact CG-ND2 3.32Å; P143-N146 WeakPolarHBondContact CG-ND2 3.47Å; P143-N146 PolarHBondContact O-N 2.84Å; P143-N146 VanDerWaalsContact O-N 3.09Å; L144-N146 VanDerWaalsContact C-N 3.33Å; L144-N146 PolarHBondContact O-N 3.28Å; N146-I148 VanDerWaalsContact C-N 3.35Å; N146-I148 PolarHBondContact O-N 3.38Å; N146-D149 PolarHBondContact O-N 3.4Å; N146-E150 WeakPolarHBondContact O-CB 3.39Å; N146-E150 VanDerWaalsContact O-CG 3.28Å; N146-E150 WeakPolarHBondContact O-CG 3.42Å; N146-E150 PolarHBondContact O-N 2.97Å
147	K	81.4	Confident	80.6	Confident	41 Å²	41	48.6 Å²	48.6	18%	0.178	26%	0.262	C	S	.	.	H	α-helix	trans	-65.5	-40.4	177.7	-156	72.2	155.3	-162.3	0	112.4	V138 E142 P143 L144 V145 D149 E150 I151	V138-K147 HydrophobicContact CG2-CB 3.9Å; V138-K147 HydrophobicContact CG2-CD 4.27Å; V138-K147 HydrophobicContact CG2-CG 3.55Å; E142-K147 IonicContact OE2-NZ 2.8Å; E142-K147 PolarHBondContact OE2-NZ 3.23Å; P143-K147 PolarHBondContact O-N 2.93Å; L144-K147 PolarHBondContact O-N 3.47Å; V145-K147 VanDerWaalsContact C-N 3.34Å; V145-K147 PolarHBondContact O-N 2.86Å; K147-D149 VanDerWaalsContact C-N 3.33Å; K147-E150 WeakPolarHBondContact O-CB 3.35Å; K147-E150 PolarHBondContact O-N 3.43Å; K147-I151 HydrophobicContact CG-CD1 4.28Å; K147-I151 WeakPolarHBondContact O-CD1 3.32Å; K147-I151 VanDerWaalsContact O-CG1 3.25Å; K147-I151 WeakPolarHBondContact O-CG1 3.27Å; K147-I151 PolarHBondContact O-N 3.02Å
148	I	81.5	Confident	80.4	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-64	-43.3	178.2	-69.7	167.9	0	0	0	110	V65 V67 F82 V111 L144 V145 N146 I151 K152	V65-I148 HydrophobicContact CB-CG2 4.22Å; V65-I148 HydrophobicContact CG1-CG1 4.21Å; V65-I148 HydrophobicContact CG2-CG2 4.1Å; V67-I148 HydrophobicContact CG2-CD1 4.08Å; F82-I148 HydrophobicContact CB-CD1 4.48Å; F82-I148 HydrophobicContact CD1-CD1 4.32Å; F82-I148 HydrophobicContact CD1-CG2 4.44Å; F82-I148 HydrophobicContact CD2-CD1 3.39Å; F82-I148 HydrophobicContact CE1-CD1 4.49Å; F82-I148 HydrophobicContact CE1-CG2 3.78Å; F82-I148 HydrophobicContact CE2-CD1 3.59Å; F82-I148 HydrophobicContact CE2-CG2 4.09Å; F82-I148 HydrophobicContact CG-CD1 3.8Å; F82-I148 HydrophobicContact CZ-CB 4.49Å; F82-I148 HydrophobicContact CZ-CD1 4.17Å; F82-I148 HydrophobicContact CZ-CG2 3.6Å; V111-I148 HydrophobicContact CG2-CG1 4.29Å; L144-I148 WeakPolarHBondContact O-CB 3.45Å; L144-I148 VanDerWaalsContact O-CG1 3.22Å; L144-I148 WeakPolarHBondContact O-CG1 3.49Å; L144-I148 PolarHBondContact O-N 3.04Å; V145-I148 PolarHBondContact O-N 3.39Å; N146-I148 VanDerWaalsContact C-N 3.35Å; N146-I148 PolarHBondContact O-N 3.38Å; I148-I151 PolarHBondContact O-N 3.27Å; I148-K152 HydrophobicContact CG2-CD 4.24Å; I148-K152 HydrophobicContact CG2-CG 4.48Å; I148-K152 VanDerWaalsContact O-CG 3.29Å; I148-K152 WeakPolarHBondContact O-CG 3.31Å; I148-K152 PolarHBondContact O-N 3.39Å
149	D	82.3	Confident	80.2	Confident	57 Å²	57	50.3 Å²	50.3	31%	0.305	26%	0.262	S	S	.	.	H	α-helix	trans	-69.1	-34.2	177.7	-73.3	-15.3	0	0	0	112.2	I58 V145 N146 K147 K152 A153	I58-D149 HydrophobicContact CD1-CB 4.33Å; V145-D149 WeakPolarHBondContact O-CB 3.29Å; V145-D149 PolarHBondContact O-N 2.88Å; N146-D149 PolarHBondContact O-N 3.4Å; K147-D149 VanDerWaalsContact C-N 3.33Å; D149-K152 PolarHBondContact O-N 3.45Å; D149-K152 IonicContact OD1-NZ 3.16Å; D149-K152 PolarHBondContact OD1-NZ 3.24Å; D149-K152 VanDerWaalsContact OD1-NZ 3.16Å; D149-A153 VanDerWaalsContact O-CB 3.23Å; D149-A153 WeakPolarHBondContact O-CB 3.4Å; D149-A153 PolarHBondContact O-N 3.16Å
150	E	83.2	Confident	80.2	Confident	60 Å²	60	55.1 Å²	55.1	28%	0.28	28%	0.279	S	S	.	.	H	α-helix	trans	-59.7	-45.4	168.5	-77.7	-173.9	169.9	0	0	112.2	R54 N146 K147 A153 T154	R54-E150 IonicContact CZ-OE1 3.47Å; R54-E150 IonicContact NH1-OE1 2.72Å; R54-E150 PolarHBondContact NH1-OE1 2.92Å; R54-E150 IonicContact NH2-OE1 3.65Å; N146-E150 WeakPolarHBondContact O-CB 3.39Å; N146-E150 VanDerWaalsContact O-CG 3.28Å; N146-E150 WeakPolarHBondContact O-CG 3.42Å; N146-E150 PolarHBondContact O-N 2.97Å; K147-E150 WeakPolarHBondContact O-CB 3.35Å; K147-E150 PolarHBondContact O-N 3.43Å; E150-A153 CarbonylContact O-C 3.46Å; E150-A153 PolarHBondContact O-N 3.45Å; E150-T154 VanDerWaalsContact O-CB 3.27Å; E150-T154 WeakPolarHBondContact O-CB 3.22Å; E150-T154 PolarHBondContact O-N 2.71Å; E150-T154 PolarHBondContact O-OG1 2.98Å
151	I	83.8	Confident	80.6	Confident	23 Å²	23	59.2 Å²	59.2	12%	0.118	30%	0.295	C	S	.	.	H	α-helix	trans	-65.4	-42	178.2	-70.6	164.2	0	0	0	110.5	V65 A109 V111 K147 I148 A153 T154	V65-I151 HydrophobicContact CG2-CG2 4.48Å; A109-I151 HydrophobicContact CB-CG2 3.56Å; V111-I151 HydrophobicContact CG2-CD1 3.26Å; K147-I151 HydrophobicContact CG-CD1 4.28Å; K147-I151 WeakPolarHBondContact O-CD1 3.32Å; K147-I151 VanDerWaalsContact O-CG1 3.25Å; K147-I151 WeakPolarHBondContact O-CG1 3.27Å; K147-I151 PolarHBondContact O-N 3.02Å; I148-I151 PolarHBondContact O-N 3.27Å; I151-A153 VanDerWaalsContact C-N 3.3Å; I151-A153 PolarHBondContact O-N 2.83Å; I151-T154 PolarHBondContact O-N 3.08Å; I151-T154 VanDerWaalsContact O-N 3.15Å
152	K	82.3	Confident	81.1	Confident	26 Å²	26	56.2 Å²	56.2	11%	0.113	28%	0.282	C	S	.	.	H	α-helix	trans	-64	-36.1	176.1	-71.9	173.9	-173.2	159.9	0	112.1	I58 P59 M63 V65 I148 D149 T154	I58-K152 HydrophobicContact CG2-CB 3.72Å; P59-K152 VanDerWaalsContact CD-O 3.32Å; P59-K152 WeakPolarHBondContact CD-O 3.31Å; M63-K152 HydrophobicContact CB-CG 4.4Å; V65-K152 HydrophobicContact CG2-CG 4.48Å; I148-K152 HydrophobicContact CG2-CD 4.24Å; I148-K152 HydrophobicContact CG2-CG 4.48Å; I148-K152 VanDerWaalsContact O-CG 3.29Å; I148-K152 WeakPolarHBondContact O-CG 3.31Å; I148-K152 PolarHBondContact O-N 3.39Å; D149-K152 PolarHBondContact O-N 3.45Å; D149-K152 IonicContact OD1-NZ 3.16Å; D149-K152 PolarHBondContact OD1-NZ 3.24Å; D149-K152 VanDerWaalsContact OD1-NZ 3.16Å; K152-T154 VanDerWaalsContact C-N 3.33Å
153	A	84.2	Confident	81.6	Confident	6 Å²	6	55.4 Å²	55.4	5%	0.05	28%	0.281	C	S	.	.	H	α-helix	trans	-76.8	-20.3	175.4	0	0	0	0	0	112.8	R54 L55 I58 D149 E150 I151	R54-A153 HydrophobicContact CG-CB 4.29Å; L55-A153 WeakPolarHBondContact CB-O 3.45Å; L55-A153 PolarHBondContact N-O 3.35Å; I58-A153 HydrophobicContact CG1-CB 4.23Å; D149-A153 VanDerWaalsContact O-CB 3.23Å; D149-A153 WeakPolarHBondContact O-CB 3.4Å; D149-A153 PolarHBondContact O-N 3.16Å; E150-A153 CarbonylContact O-C 3.46Å; E150-A153 PolarHBondContact O-N 3.45Å; I151-A153 VanDerWaalsContact C-N 3.3Å; I151-A153 PolarHBondContact O-N 2.83Å
154	T	85.6	Confident	82.2	Confident	49 Å²	49	55.8 Å²	55.8	30%	0.301	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	131.9	-177	-62.8	0	0	0	0	111.5	T52 V53 E150 I151 K152	T52-T154 HydrophobicContact CG2-CG2 4.25Å; V53-T154 CarbonylContact O-C 3.5Å; V53-T154 WeakPolarHBondContact O-CA 3.5Å; E150-T154 VanDerWaalsContact O-CB 3.27Å; E150-T154 WeakPolarHBondContact O-CB 3.22Å; E150-T154 PolarHBondContact O-N 2.71Å; E150-T154 PolarHBondContact O-OG1 2.98Å; I151-T154 PolarHBondContact O-N 3.08Å; I151-T154 VanDerWaalsContact O-N 3.15Å; K152-T154 VanDerWaalsContact C-N 3.33Å
155	V	84.1	Confident	82.6	Confident	15 Å²	15	56.1 Å²	56.1	9%	0.091	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	130	178.7	-172.1	0	0	0	0	110.3	T52 V53 L55 P59 V167	T52-V155 WeakPolarHBondContact CA-O 3.48Å; V53-V155 HydrophobicContact CG1-CB 4.41Å; V53-V155 PolarHBondContact N-O 2.79Å; V53-V155 PolarHBondContact O-N 2.78Å; L55-V155 HydrophobicContact CD1-CB 4.43Å; L55-V155 HydrophobicContact CD1-CG2 3.48Å; L55-V155 VanDerWaalsContact CD1-CG2 3.48Å; L55-V155 HydrophobicContact CG-CG2 3.89Å; P59-V155 HydrophobicContact CG-CG2 3.8Å; V155-V167 HydrophobicContact CB-CG1 4.35Å; V155-V167 HydrophobicContact CG1-CG1 3.15Å
156	K	83.4	Confident	83.1	Confident	94 Å²	94	57.4 Å²	57.4	41%	0.409	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	117.8	-177.1	-171	-177.8	-174.5	-172.7	0	110.9	T50 G51 T52 Q158	T50-K156 HydrophobicContact CG2-CD 4.38Å; T50-K156 HydrophobicContact CG2-CG 4.25Å; G51-K156 CarbonylContact O-C 3.53Å; T52-K156 HydrophobicContact CG2-CB 4.09Å; T52-K156 HydrophobicContact CG2-CG 3.98Å; K156-Q158 VanDerWaalsContact NZ-OE1 3.16Å
157	F	83.5	Confident	83.3	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	112.7	163.6	-64.8	-91.1	0	0	0	108.5	I36 T50 G51 V53 V167 F189 L190 L193	I36-F157 HydrophobicContact CD1-CE1 4.06Å; T50-F157 CarbonylContact C-O 3.53Å; T50-F157 WeakPolarHBondContact CA-O 3.42Å; G51-F157 PolarHBondContact N-O 2.77Å; G51-F157 PolarHBondContact O-N 2.97Å; V53-F157 HydrophobicContact CB-CE2 4.32Å; V53-F157 HydrophobicContact CG1-CD2 4.4Å; V53-F157 HydrophobicContact CG1-CE2 3.61Å; F157-V167 HydrophobicContact CD1-CG2 3.55Å; F157-V167 HydrophobicContact CE1-CB 3.98Å; F157-V167 HydrophobicContact CE1-CG1 3.89Å; F157-V167 HydrophobicContact CE1-CG2 3.48Å; F157-V167 VanDerWaalsContact CE1-CG2 3.48Å; F157-V167 HydrophobicContact CE2-CG1 4.47Å; F157-V167 HydrophobicContact CG-CG2 4.4Å; F157-V167 HydrophobicContact CZ-CB 4.41Å; F157-V167 HydrophobicContact CZ-CG1 3.85Å; F157-V167 HydrophobicContact CZ-CG2 4.28Å; F157-F189 AromaticContact CD2-CD1 3.87Å; F157-F189 HydrophobicContact CD2-CD1 3.87Å; F157-F189 HydrophobicContact CD2-CE1 4.1Å; F157-F189 HydrophobicContact CE2-CD1 4Å; F157-L190 HydrophobicContact CD1-CD1 3.7Å; F157-L190 HydrophobicContact CE1-CB 4.42Å; F157-L190 HydrophobicContact CE1-CD1 4.21Å; F157-L190 HydrophobicContact CG-CD1 4.32Å; F157-L193 HydrophobicContact CB-CD1 4.49Å
158	Q	79.3	Confident	83.6	Confident	81 Å²	81	51.6 Å²	51.6	38%	0.379	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	115.6	175.1	-176.7	174.4	-9.1	0	0	109.9	T50 K156 K160 L165	T50-Q158 HydrophobicContact CG2-CB 4.42Å; T50-Q158 HydrophobicContact CG2-CG 4.45Å; K156-Q158 VanDerWaalsContact NZ-OE1 3.16Å; Q158-K160 PolarHBondContact O-N 2.9Å; Q158-L165 VanDerWaalsContact O-CD2 3.28Å; Q158-L165 WeakPolarHBondContact O-CD2 3.35Å
159	M	76.9	Confident	83.8	Confident	5 Å²	5	51.6 Å²	51.6	3%	0.025	26%	0.263	C	S	.	.			trans	-78.1	119.1	172.2	-169.2	168.5	176.9	0	0	110.3	L38 Y41 V43 F49 L163 L165	L38-M159 HydrophobicContact CD1-CE 4.06Å; L38-M159 HydrophobicContact CD1-SD 3.86Å; Y41-M159 HydrophobicContact CD1-CE 3.17Å; Y41-M159 HydrophobicContact CD1-SD 3.7Å; Y41-M159 HydrophobicContact CE1-CE 3.46Å; Y41-M159 VanDerWaalsContact CE1-CE 3.46Å; Y41-M159 HydrophobicContact CE1-SD 3.37Å; Y41-M159 WeakPolarHBondContact CE1-SD 3.42Å; Y41-M159 HydrophobicContact CG-CE 3.93Å; Y41-M159 HydrophobicContact CG-SD 4.36Å; V43-M159 HydrophobicContact CG2-CE 4.11Å; F49-M159 HydrophobicContact CD1-CB 4.18Å; F49-M159 HydrophobicContact CD1-SD 4.12Å; F49-M159 HydrophobicContact CE1-CB 3.93Å; F49-M159 HydrophobicContact CE1-CG 4.34Å; F49-M159 HydrophobicContact CE1-SD 3.52Å; F49-M159 VanDerWaalsContact CE1-SD 3.52Å; F49-M159 HydrophobicContact CE2-CB 4.37Å; F49-M159 HydrophobicContact CZ-CB 4.05Å; F49-M159 HydrophobicContact CZ-SD 4.21Å; F49-M159 PolarHBondContact O-N 3.39Å; F49-M159 VanDerWaalsContact O-N 3.15Å; M159-L163 HydrophobicContact CE-CD2 3.96Å; M159-L165 HydrophobicContact CB-CD2 4.38Å
160	K	77.8	Confident	84.1	Confident	145 Å²	145	48.9 Å²	48.9	63%	0.63	25%	0.248	S	C	*	.			trans	-93.4	-142.7	173.1	-66.8	-175.1	177.7	178	0	109.2	Q158 V162	Q158-K160 PolarHBondContact O-N 2.9Å; K160-V162 VanDerWaalsContact C-N 3.33Å
161	K	80.5	Confident	84.3	Confident	170 Å²	170	47.5 Å²	47.5	74%	0.739	24%	0.242	S	C	*	.	S	Bend	trans	-83.3	-9.4	175.3	-63.5	-176.7	177.5	-175.8	0	113.7
162	V	83.4	Confident	84.2	Confident	90 Å²	90	46.8 Å²	46.8	55%	0.545	24%	0.238	S	C	.	.	S	Bend	trans	-103.1	142.1	-173.8	-167.7	0	0	0	0	109.2	K160 C164	K160-V162 VanDerWaalsContact C-N 3.33Å; V162-C164 HydrophobicContact CG1-CB 4.18Å; V162-C164 PolarHBondContact O-N 2.9Å
163	L	84.9	Confident	84.3	Confident	68 Å²	68	53.1 Å²	53.1	36%	0.356	27%	0.266	S	S	.	.	S	Bend	trans	-76.2	-6.4	178.6	-61.5	173.8	0	0	0	113.7	L38 Y41 M159	L38-L163 HydrophobicContact CB-CB 4.49Å; L38-L163 WeakPolarHBondContact CB-O 3.19Å; L38-L163 PolarHBondContact N-O 2.94Å; Y41-L163 VanDerWaalsContact O-CD2 3.31Å; Y41-L163 WeakPolarHBondContact O-CD2 3.46Å; M159-L163 HydrophobicContact CE-CD2 3.96Å
164	C	87.2	Confident	84.3	Confident	75 Å²	75	53.4 Å²	53.4	51%	0.507	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	128.1	177.8	-57.8	0	0	0	0	109.8	I36 V162	I36-C164 CarbonylContact O-C 3.57Å; I36-C164 VanDerWaalsContact O-CA 3.28Å; I36-C164 WeakPolarHBondContact O-CA 3.27Å; V162-C164 HydrophobicContact CG1-CB 4.18Å; V162-C164 PolarHBondContact O-N 2.9Å
165	L	87.4	Confident	84.4	Confident	10 Å²	10	54.1 Å²	54.1	5%	0.052	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	135.1	175.3	-66.4	157.9	0	0	0	108.4	Q35 I36 L38 F49 Q158 M159 L190	Q35-L165 CarbonylContact C-O 3.56Å; Q35-L165 WeakPolarHBondContact CA-O 3.25Å; I36-L165 HydrophobicContact CB-CB 4.33Å; I36-L165 HydrophobicContact CD1-CB 4.3Å; I36-L165 PolarHBondContact N-O 2.7Å; I36-L165 PolarHBondContact O-N 3.38Å; L38-L165 HydrophobicContact CD1-CD1 4Å; L38-L165 HydrophobicContact CG-CD1 4.48Å; F49-L165 HydrophobicContact CE2-CD1 4.32Å; F49-L165 HydrophobicContact CZ-CD1 3.85Å; Q158-L165 VanDerWaalsContact O-CD2 3.28Å; Q158-L165 WeakPolarHBondContact O-CD2 3.35Å; M159-L165 HydrophobicContact CB-CD2 4.38Å; L165-L190 HydrophobicContact CD1-CD1 4.01Å
166	N	88.9	Confident	84.6	Confident	94 Å²	94	55.8 Å²	55.8	50%	0.503	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	129.9	173.7	-63.3	-38.4	0	0	0	108.5	L34 Q35	L34-N166 WeakPolarHBondContact O-CA 3.29Å; Q35-N166 WeakPolarHBondContact CB-OD1 3.36Å; Q35-N166 VanDerWaalsContact CG-OD1 3.25Å; Q35-N166 WeakPolarHBondContact CG-OD1 3.36Å; Q35-N166 PolarHBondContact NE2-OD1 3.23Å
167	V	87.7	Confident	84.8	Confident	7 Å²	7	57.5 Å²	57.5	4%	0.042	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	130.5	-173.1	179.8	0	0	0	0	110.1	E33 L34 V155 F157 V169	E33-V167 CarbonylContact C-O 3.57Å; E33-V167 VanDerWaalsContact CA-O 3.27Å; E33-V167 WeakPolarHBondContact CA-O 3.46Å; L34-V167 PolarHBondContact N-O 3.18Å; L34-V167 PolarHBondContact O-N 3.13Å; V155-V167 HydrophobicContact CB-CG1 4.35Å; V155-V167 HydrophobicContact CG1-CG1 3.15Å; F157-V167 HydrophobicContact CD1-CG2 3.55Å; F157-V167 HydrophobicContact CE1-CB 3.98Å; F157-V167 HydrophobicContact CE1-CG1 3.89Å; F157-V167 HydrophobicContact CE1-CG2 3.48Å; F157-V167 VanDerWaalsContact CE1-CG2 3.48Å; F157-V167 HydrophobicContact CE2-CG1 4.47Å; F157-V167 HydrophobicContact CG-CG2 4.4Å; F157-V167 HydrophobicContact CZ-CB 4.41Å; F157-V167 HydrophobicContact CZ-CG1 3.85Å; F157-V167 HydrophobicContact CZ-CG2 4.28Å; V167-V169 HydrophobicContact CG1-CG1 4.41Å; V167-V169 PolarHBondContact O-N 2.77Å
168	A	88.6	Confident	85.1	Confident	9 Å²	9	60.3 Å²	60.3	7%	0.074	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	117.9	176	0	0	0	0	0	110.1	T31 R60	T31-A168 HydrophobicContact CG2-CB 3.62Å; R60-A168 VanDerWaalsContact NE-CB 3.27Å
169	V	85.5	Confident	85.5	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	-11.2	-174.8	-69.1	0	0	0	0	112.6	V32 L34 V167 N182 I183 S186	V32-V169 HydrophobicContact CB-CG2 4.46Å; V32-V169 HydrophobicContact CG1-CG2 4.06Å; V32-V169 WeakPolarHBondContact O-CG2 3.41Å; V32-V169 PolarHBondContact O-N 3.26Å; L34-V169 HydrophobicContact CB-CG1 3.65Å; L34-V169 HydrophobicContact CB-CG2 4.17Å; L34-V169 HydrophobicContact CD2-CG1 4.34Å; V167-V169 HydrophobicContact CG1-CG1 4.41Å; V167-V169 PolarHBondContact O-N 2.77Å; V169-N182 VanDerWaalsContact O-CB 3.29Å; V169-N182 WeakPolarHBondContact O-CB 3.26Å; V169-N182 PolarHBondContact O-ND2 2.93Å; V169-I183 HydrophobicContact CB-CG1 4.03Å; V169-I183 HydrophobicContact CG2-CD1 4.36Å; V169-I183 HydrophobicContact CG2-CG1 3.67Å; V169-S186 WeakPolarHBondContact CG1-OG 3.36Å
170	G	87.1	Confident	86.1	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.6	-166.2	179.2	0	0	0	0	0	113.9	T31 V32	T31-G170 WeakPolarHBondContact CG2-O 3.48Å; V32-G170 PolarHBondContact N-O 2.73Å; V32-G170 PolarHBondContact O-N 3.4Å
171	H	88.1	Confident	86.7	Confident	30 Å²	30	53.6 Å²	53.6	14%	0.139	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	161.1	177.6	70.1	-31.7	0	0	0	110.6	T29 E30 K173 M174	T29-H171 HydrophobicContact CG2-CB 4.11Å; E30-H171 WeakPolarHBondContact O-CA 3.2Å; H171-K173 PolarHBondContact O-N 2.97Å; H171-M174 VanDerWaalsContact CE1-CG 3.48Å; H171-M174 WeakPolarHBondContact CE1-CG 3.34Å; H171-M174 WeakPolarHBondContact ND1-CE 3.47Å; H171-M174 VanDerWaalsContact ND1-CG 3.33Å; H171-M174 WeakPolarHBondContact ND1-CG 3.39Å; H171-M174 PolarHBondContact ND1-SD 3.44Å; H171-M174 PolarHBondContact O-N 2.95Å; H171-M174 VanDerWaalsContact O-N 3.11Å
172	V	82.2	Confident	87.1	Confident	8 Å²	8	45.5 Å²	45.5	5%	0.048	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-9.9	-172.2	171.5	0	0	0	0	114.6	L17 N21 E30 V32	L17-V172 HydrophobicContact CD2-CB 4.33Å; L17-V172 HydrophobicContact CD2-CG1 4.18Å; L17-V172 VanDerWaalsContact CD2-O 3.25Å; L17-V172 WeakPolarHBondContact CD2-O 3.39Å; N21-V172 WeakPolarHBondContact ND2-CG1 3.41Å; N21-V172 PolarHBondContact ND2-O 3.44Å; N21-V172 WeakPolarHBondContact OD1-CG1 3.15Å; E30-V172 HydrophobicContact CB-CG2 3.74Å; E30-V172 PolarHBondContact O-N 3.04Å; E30-V172 VanDerWaalsContact O-N 3.08Å; V32-V172 HydrophobicContact CG2-CG2 4.36Å
173	K	83.7	Confident	87.4	Confident	159 Å²	159	41.2 Å²	41.2	69%	0.691	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86	-9.2	175.2	-67.5	-174	176	-167.2	0	114.2	T29 H171	T29-K173 HydrophobicContact CG2-CD 4.26Å; T29-K173 HydrophobicContact CG2-CG 3.96Å; H171-K173 PolarHBondContact O-N 2.97Å
174	M	84.2	Confident	87.5	Confident	13 Å²	13	40.3 Å²	40.3	6%	0.064	21%	0.211	C	C	.	.	S	Bend	trans	-74.4	156.3	175.3	-83.5	156.5	-177.7	0	0	111.5	L17 H57 I58 H171 E178 L179	L17-M174 WeakPolarHBondContact CD1-O 3.28Å; H57-M174 HydrophobicContact CB-CE 3.64Å; H57-M174 HydrophobicContact CB-SD 4.43Å; I58-M174 VanDerWaalsContact C-CE 3.48Å; I58-M174 WeakPolarHBondContact O-CE 3.29Å; H171-M174 VanDerWaalsContact CE1-CG 3.48Å; H171-M174 WeakPolarHBondContact CE1-CG 3.34Å; H171-M174 WeakPolarHBondContact ND1-CE 3.47Å; H171-M174 VanDerWaalsContact ND1-CG 3.33Å; H171-M174 WeakPolarHBondContact ND1-CG 3.39Å; H171-M174 PolarHBondContact ND1-SD 3.44Å; H171-M174 PolarHBondContact O-N 2.95Å; H171-M174 VanDerWaalsContact O-N 3.11Å; M174-E178 WeakPolarHBondContact CA-OE2 3.41Å; M174-E178 HydrophobicContact CB-CB 4.23Å; M174-E178 WeakPolarHBondContact CB-OE2 3.45Å; M174-E178 HydrophobicContact CG-CB 4.35Å; M174-E178 WeakPolarHBondContact CG-OE2 3.28Å; M174-L179 HydrophobicContact CB-CD1 4.49Å; M174-L179 HydrophobicContact CB-CD2 3.93Å; M174-L179 HydrophobicContact CB-CG 3.79Å; M174-L179 HydrophobicContact CG-CD2 4.44Å; M174-L179 HydrophobicContact SD-CD2 3.68Å; M174-L179 HydrophobicContact SD-CG 4.49Å
175	T	88.5	Confident	87.6	Confident	63 Å²	63	39.6 Å²	39.6	39%	0.387	20%	0.202	S	C	.	.			trans	-70.3	154.7	168.5	71.2	0	0	0	0	110.3	E177 E178 L179	T175-E177 PolarHBondContact O-N 3.09Å; T175-E178 PolarHBondContact N-OE2 3.26Å; T175-E178 PolarHBondContact O-N 3.39Å; T175-E178 VanDerWaalsContact OG1-CD 3.28Å; T175-E178 WeakPolarHBondContact OG1-CG 3.33Å; T175-E178 PolarHBondContact OG1-N 3.48Å; T175-L179 PolarHBondContact O-N 2.91Å; T175-L179 VanDerWaalsContact O-N 3.12Å
176	P	87.6	Confident	87.7	Confident	50 Å²	50	39.1 Å²	39.1	33%	0.325	20%	0.199	S	C	.	.	H	α-helix	trans	-59.7	-31	177.7	22.1	-32.5	0	0	0	112.4	C13 L17 A180	C13-P176 HydrophobicContact CB-CB 4.26Å; L17-P176 HydrophobicContact CD1-CB 3.95Å; L17-P176 HydrophobicContact CD1-CG 4.35Å; P176-A180 VanDerWaalsContact O-CB 3.31Å; P176-A180 WeakPolarHBondContact O-CB 3.43Å; P176-A180 PolarHBondContact O-N 3.45Å
177	E	88.5	Confident	87.7	Confident	131 Å²	131	34.8 Å²	34.8	61%	0.612	18%	0.176	S	C	*	.	H	α-helix	trans	-69	-44.8	177.5	-63.1	-176.5	-178.1	0	0	112.1	L10 T175 L179 A180 Q181	L10-E177 HydrophobicContact CD2-CG 4.35Å; T175-E177 PolarHBondContact O-N 3.09Å; E177-L179 VanDerWaalsContact C-N 3.34Å; E177-L179 PolarHBondContact O-N 2.88Å; E177-A180 PolarHBondContact O-N 3.01Å; E177-Q181 VanDerWaalsContact O-CG 3.31Å; E177-Q181 WeakPolarHBondContact O-CG 3.25Å; E177-Q181 PolarHBondContact O-N 3.23Å
178	E	89	Confident	87.7	Confident	58 Å²	58	37.2 Å²	37.2	27%	0.271	19%	0.189	S	C	.	.	H	α-helix	trans	-61	-43.3	176	-70.6	169	176.2	0	0	111.6	M174 T175 Q181 N182	M174-E178 WeakPolarHBondContact CA-OE2 3.41Å; M174-E178 HydrophobicContact CB-CB 4.23Å; M174-E178 WeakPolarHBondContact CB-OE2 3.45Å; M174-E178 HydrophobicContact CG-CB 4.35Å; M174-E178 WeakPolarHBondContact CG-OE2 3.28Å; T175-E178 PolarHBondContact N-OE2 3.26Å; T175-E178 PolarHBondContact O-N 3.39Å; T175-E178 VanDerWaalsContact OG1-CD 3.28Å; T175-E178 WeakPolarHBondContact OG1-CG 3.33Å; T175-E178 PolarHBondContact OG1-N 3.48Å; E178-Q181 PolarHBondContact O-N 2.98Å; E178-N182 PolarHBondContact O-N 3.45Å
179	L	88.5	Confident	87.6	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62	-47.1	175.1	-73	179.4	0	0	0	111.4	C13 L17 V32 M174 T175 E177 Q181 N182 I183	C13-L179 HydrophobicContact CB-CB 4.36Å; L17-L179 HydrophobicContact CD1-CD1 3.91Å; L17-L179 HydrophobicContact CD2-CD1 3.78Å; L17-L179 HydrophobicContact CG-CD1 3.86Å; V32-L179 HydrophobicContact CB-CD2 4.42Å; V32-L179 HydrophobicContact CG2-CD1 4.26Å; V32-L179 HydrophobicContact CG2-CD2 4.35Å; M174-L179 HydrophobicContact CB-CD1 4.49Å; M174-L179 HydrophobicContact CB-CD2 3.93Å; M174-L179 HydrophobicContact CB-CG 3.79Å; M174-L179 HydrophobicContact CG-CD2 4.44Å; M174-L179 HydrophobicContact SD-CD2 3.68Å; M174-L179 HydrophobicContact SD-CG 4.49Å; T175-L179 PolarHBondContact O-N 2.91Å; T175-L179 VanDerWaalsContact O-N 3.12Å; E177-L179 VanDerWaalsContact C-N 3.34Å; E177-L179 PolarHBondContact O-N 2.88Å; L179-Q181 VanDerWaalsContact C-N 3.3Å; L179-Q181 PolarHBondContact O-N 3.46Å; L179-N182 PolarHBondContact O-N 3.02Å; L179-I183 HydrophobicContact CB-CD1 4.48Å; L179-I183 WeakPolarHBondContact O-CB 3.27Å; L179-I183 WeakPolarHBondContact O-CD1 3.33Å; L179-I183 VanDerWaalsContact O-CG1 3.26Å; L179-I183 WeakPolarHBondContact O-CG1 3.28Å; L179-I183 PolarHBondContact O-N 3.48Å
180	A	89.4	Confident	87.6	Confident	9 Å²	9	39.6 Å²	39.6	7%	0.074	20%	0.198	C	C	.	.	H	α-helix	trans	-59.8	-41.3	178.4	0	0	0	0	0	111.7	L9 L10 P176 E177 I183 N184	L9-A180 HydrophobicContact CD2-CB 3.71Å; L9-A180 WeakPolarHBondContact CD2-O 3.15Å; L9-A180 HydrophobicContact CG-CB 4.04Å; L10-A180 HydrophobicContact CD2-CB 3.78Å; L10-A180 HydrophobicContact CG-CB 4.38Å; P176-A180 VanDerWaalsContact O-CB 3.31Å; P176-A180 WeakPolarHBondContact O-CB 3.43Å; P176-A180 PolarHBondContact O-N 3.45Å; E177-A180 PolarHBondContact O-N 3.01Å; A180-I183 PolarHBondContact O-N 2.77Å; A180-N184 VanDerWaalsContact O-CB 3.28Å; A180-N184 WeakPolarHBondContact O-CB 3.25Å; A180-N184 PolarHBondContact O-N 2.74Å
181	Q	89	Confident	87.6	Confident	82 Å²	82	40.2 Å²	40.2	38%	0.383	20%	0.201	S	C	.	.	H	α-helix	trans	-61	-48.5	175	-71.6	176.8	18.8	0	0	111.7	H57 E177 E178 L179 I183 N184 L185	H57-Q181 PolarHBondContact NE2-OE1 3.48Å; E177-Q181 VanDerWaalsContact O-CG 3.31Å; E177-Q181 WeakPolarHBondContact O-CG 3.25Å; E177-Q181 PolarHBondContact O-N 3.23Å; E178-Q181 PolarHBondContact O-N 2.98Å; L179-Q181 VanDerWaalsContact C-N 3.3Å; L179-Q181 PolarHBondContact O-N 3.46Å; Q181-I183 PolarHBondContact O-N 2.83Å; Q181-N184 PolarHBondContact O-N 3.35Å; Q181-L185 WeakPolarHBondContact O-CG 3.4Å; Q181-L185 PolarHBondContact O-N 2.97Å
182	N	89.9	Confident	87.5	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-62.3	-41.7	178.6	-84.1	2.6	0	0	0	112.6	L55 K56 H57 V169 E178 L179 S186	L55-N182 HydrophobicContact CD1-CB 4.3Å; L55-N182 HydrophobicContact CD2-CB 4.5Å; K56-N182 PolarHBondContact N-OD1 2.85Å; H57-N182 PolarHBondContact N-OD1 2.91Å; H57-N182 PolarHBondContact O-ND2 2.92Å; V169-N182 VanDerWaalsContact O-CB 3.29Å; V169-N182 WeakPolarHBondContact O-CB 3.26Å; V169-N182 PolarHBondContact O-ND2 2.93Å; E178-N182 PolarHBondContact O-N 3.45Å; L179-N182 PolarHBondContact O-N 3.02Å; N182-S186 VanDerWaalsContact O-CB 3.29Å; N182-S186 WeakPolarHBondContact O-CB 3.39Å; N182-S186 PolarHBondContact O-N 3.23Å; N182-S186 PolarHBondContact O-OG 3.07Å
183	I	88.8	Confident	87.6	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-66.4	-44.7	178.1	-68.3	156.5	0	0	0	110.7	L9 C13 L34 V169 L179 A180 Q181 L185 S186 I187 I206 L216	L9-I183 HydrophobicContact CD1-CB 4.08Å; L9-I183 HydrophobicContact CD1-CD1 4.29Å; L9-I183 HydrophobicContact CD1-CG2 3.55Å; C13-I183 VanDerWaalsContact SG-CD1 3.53Å; L34-I183 HydrophobicContact CD1-CG2 4.24Å; V169-I183 HydrophobicContact CB-CG1 4.03Å; V169-I183 HydrophobicContact CG2-CD1 4.36Å; V169-I183 HydrophobicContact CG2-CG1 3.67Å; L179-I183 HydrophobicContact CB-CD1 4.48Å; L179-I183 WeakPolarHBondContact O-CB 3.27Å; L179-I183 WeakPolarHBondContact O-CD1 3.33Å; L179-I183 VanDerWaalsContact O-CG1 3.26Å; L179-I183 WeakPolarHBondContact O-CG1 3.28Å; L179-I183 PolarHBondContact O-N 3.48Å; A180-I183 PolarHBondContact O-N 2.77Å; Q181-I183 PolarHBondContact O-N 2.83Å; I183-L185 PolarHBondContact O-N 2.82Å; I183-S186 WeakPolarHBondContact O-CB 3.49Å; I183-S186 PolarHBondContact O-N 3.42Å; I183-I187 HydrophobicContact CG2-CD1 3.51Å; I183-I187 HydrophobicContact CG2-CG1 4.19Å; I183-I187 VanDerWaalsContact O-CG1 3.28Å; I183-I187 WeakPolarHBondContact O-CG1 3.37Å; I183-I187 PolarHBondContact O-N 2.86Å; I183-I206 HydrophobicContact CD1-CD1 3.63Å; I183-I206 HydrophobicContact CD1-CG1 4.26Å; I183-I206 HydrophobicContact CD1-CG2 4.35Å; I183-I206 HydrophobicContact CG2-CD1 4.3Å; I183-L216 HydrophobicContact CG2-CD1 4.25Å
184	N	88.7	Confident	87.5	Confident	48 Å²	48	38.3 Å²	38.3	26%	0.257	20%	0.203	S	C	.	.	H	α-helix	trans	-63.1	-44.2	179.8	-168	8.6	0	0	0	111.3	L9 A180 Q181 S186 I187 N188	L9-N184 HydrophobicContact CD2-CB 4.38Å; A180-N184 VanDerWaalsContact O-CB 3.28Å; A180-N184 WeakPolarHBondContact O-CB 3.25Å; A180-N184 PolarHBondContact O-N 2.74Å; Q181-N184 PolarHBondContact O-N 3.35Å; N184-S186 VanDerWaalsContact C-N 3.34Å; N184-S186 PolarHBondContact O-N 3.38Å; N184-I187 PolarHBondContact O-N 3.46Å; N184-N188 WeakPolarHBondContact O-CB 3.27Å; N184-N188 PolarHBondContact O-N 3.43Å; N184-N188 PolarHBondContact O-ND2 3.39Å; N184-N188 PolarHBondContact OD1-ND2 3.43Å
185	L	89.1	Confident	87.4	Confident	60 Å²	60	43.9 Å²	43.9	31%	0.314	23%	0.227	S	C	.	.	H	α-helix	trans	-59.5	-44.8	173.8	-72.6	171.6	0	0	0	112	K56 Q181 I183 N188 F189	K56-L185 HydrophobicContact CD-CD1 3.98Å; K56-L185 HydrophobicContact CG-CD1 3.74Å; Q181-L185 WeakPolarHBondContact O-CG 3.4Å; Q181-L185 PolarHBondContact O-N 2.97Å; I183-L185 PolarHBondContact O-N 2.82Å; L185-N188 PolarHBondContact O-N 2.94Å; L185-F189 WeakPolarHBondContact O-CB 3.44Å; L185-F189 PolarHBondContact O-N 2.97Å
186	S	88.8	Confident	87.2	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59.9	-46.4	177.8	-66.9	0	0	0	0	112.5	L55 V169 N182 I183 N184 L190	L55-S186 WeakPolarHBondContact CD2-OG 3.28Å; V169-S186 WeakPolarHBondContact CG1-OG 3.36Å; N182-S186 VanDerWaalsContact O-CB 3.29Å; N182-S186 WeakPolarHBondContact O-CB 3.39Å; N182-S186 PolarHBondContact O-N 3.23Å; N182-S186 PolarHBondContact O-OG 3.07Å; I183-S186 WeakPolarHBondContact O-CB 3.49Å; I183-S186 PolarHBondContact O-N 3.42Å; N184-S186 VanDerWaalsContact C-N 3.34Å; N184-S186 PolarHBondContact O-N 3.38Å; S186-L190 WeakPolarHBondContact O-CB 3.45Å; S186-L190 PolarHBondContact O-N 3.01Å
187	I	88.2	Confident	87.1	Confident	4 Å²	4	48.3 Å²	48.3	2%	0.021	24%	0.24	C	C	.	.	H	α-helix	trans	-66.4	-47.3	179.5	-68.8	168	0	0	0	110.3	V4 L34 I183 N184 F189 L190 V191 W198 L204 L216	V4-I187 HydrophobicContact CG2-CD1 4.34Å; L34-I187 HydrophobicContact CD1-CD1 4.39Å; L34-I187 HydrophobicContact CD1-CG1 4.4Å; L34-I187 HydrophobicContact CD2-CG1 3.74Å; I183-I187 HydrophobicContact CG2-CD1 3.51Å; I183-I187 HydrophobicContact CG2-CG1 4.19Å; I183-I187 VanDerWaalsContact O-CG1 3.28Å; I183-I187 WeakPolarHBondContact O-CG1 3.37Å; I183-I187 PolarHBondContact O-N 2.86Å; N184-I187 PolarHBondContact O-N 3.46Å; I187-F189 VanDerWaalsContact C-N 3.34Å; I187-F189 PolarHBondContact O-N 2.88Å; I187-L190 PolarHBondContact O-N 2.84Å; I187-V191 HydrophobicContact CG2-CG2 4.4Å; I187-V191 VanDerWaalsContact O-CG2 3.27Å; I187-V191 WeakPolarHBondContact O-CG2 3.46Å; I187-V191 PolarHBondContact O-N 3.48Å; I187-W198 HydrophobicContact CG2-CH2 3.5Å; I187-W198 HydrophobicContact CG2-CZ2 3.91Å; I187-W198 HydrophobicContact CG2-CZ3 4.42Å; I187-L204 HydrophobicContact CD1-CD1 4.01Å; I187-L204 HydrophobicContact CG1-CD1 4.21Å; I187-L204 HydrophobicContact CG2-CD1 4.1Å; I187-L216 HydrophobicContact CD1-CD1 4.06Å
188	N	88.1	Confident	86.9	Confident	57 Å²	57	43.4 Å²	43.4	31%	0.305	22%	0.216	S	C	.	.	H	α-helix	trans	-63.1	-42	-178.4	-67.2	-28.4	0	0	0	111.4	S2 N184 L185 V191 T192	S2-N188 PolarHBondContact OG-OD1 3.08Å; N184-N188 WeakPolarHBondContact O-CB 3.27Å; N184-N188 PolarHBondContact O-N 3.43Å; N184-N188 PolarHBondContact O-ND2 3.39Å; N184-N188 PolarHBondContact OD1-ND2 3.43Å; L185-N188 PolarHBondContact O-N 2.94Å; N188-V191 PolarHBondContact O-N 3.49Å; N188-T192 PolarHBondContact O-N 2.86Å
189	F	87.6	Confident	86.7	Confident	57 Å²	57	47 Å²	47	25%	0.25	23%	0.233	C	C	.	.	H	α-helix	trans	-66.2	-37.6	175.6	-176.3	-101.8	0	0	0	112.7	T52 V53 F157 L185 I187 V191 T192 L193	T52-F189 VanDerWaalsContact O-CZ 3.25Å; T52-F189 WeakPolarHBondContact O-CZ 3.25Å; V53-F189 HydrophobicContact CB-CB 4.29Å; V53-F189 HydrophobicContact CB-CD1 3.7Å; V53-F189 HydrophobicContact CB-CD2 4.35Å; V53-F189 HydrophobicContact CB-CE1 4.04Å; V53-F189 HydrophobicContact CB-CG 3.85Å; V53-F189 HydrophobicContact CG1-CD1 4.48Å; V53-F189 HydrophobicContact CG2-CB 3.96Å; V53-F189 HydrophobicContact CG2-CD1 4.25Å; V53-F189 HydrophobicContact CG2-CD2 4.16Å; V53-F189 HydrophobicContact CG2-CG 3.86Å; F157-F189 AromaticContact CD2-CD1 3.87Å; F157-F189 HydrophobicContact CD2-CD1 3.87Å; F157-F189 HydrophobicContact CD2-CE1 4.1Å; F157-F189 HydrophobicContact CE2-CD1 4Å; L185-F189 WeakPolarHBondContact O-CB 3.44Å; L185-F189 PolarHBondContact O-N 2.97Å; I187-F189 VanDerWaalsContact C-N 3.34Å; I187-F189 PolarHBondContact O-N 2.88Å; F189-V191 VanDerWaalsContact C-N 3.34Å; F189-T192 PolarHBondContact O-N 3.29Å; F189-T192 PolarHBondContact O-OG1 3.38Å; F189-L193 HydrophobicContact CD1-CD1 3.96Å; F189-L193 HydrophobicContact CE1-CD1 3.59Å; F189-L193 HydrophobicContact CE1-CG 4.32Å; F189-L193 HydrophobicContact CZ-CD1 4.21Å; F189-L193 WeakPolarHBondContact O-CG 3.03Å; F189-L193 PolarHBondContact O-N 3.16Å
190	L	85.5	Confident	86.5	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-63.9	-43.1	174.8	-176.7	79.8	0	0	0	111.6	I36 F49 F157 L165 S186 I187 T192 L193 L194	I36-L190 HydrophobicContact CB-CD2 4.21Å; I36-L190 HydrophobicContact CD1-CD1 4.44Å; I36-L190 HydrophobicContact CD1-CD2 3.5Å; I36-L190 VanDerWaalsContact CD1-CD2 3.5Å; I36-L190 HydrophobicContact CD1-CG 4.48Å; I36-L190 HydrophobicContact CG1-CD2 3.99Å; I36-L190 HydrophobicContact CG2-CD2 3.51Å; F49-L190 HydrophobicContact CE2-CD1 3.87Å; F49-L190 HydrophobicContact CZ-CD1 4.04Å; F157-L190 HydrophobicContact CD1-CD1 3.7Å; F157-L190 HydrophobicContact CE1-CB 4.42Å; F157-L190 HydrophobicContact CE1-CD1 4.21Å; F157-L190 HydrophobicContact CG-CD1 4.32Å; L165-L190 HydrophobicContact CD1-CD1 4.01Å; S186-L190 WeakPolarHBondContact O-CB 3.45Å; S186-L190 PolarHBondContact O-N 3.01Å; I187-L190 PolarHBondContact O-N 2.84Å; L190-T192 VanDerWaalsContact C-N 3.25Å; L190-T192 PolarHBondContact O-N 3.04Å; L190-L193 WeakPolarHBondContact O-CB 3.47Å; L190-L193 PolarHBondContact O-N 2.98Å; L190-L193 VanDerWaalsContact O-N 3.07Å; L190-L194 HydrophobicContact CG-CD1 4.43Å; L190-L194 PolarHBondContact O-N 3.15Å
191	V	85.7	Confident	86.3	Confident	13 Å²	13	46.9 Å²	46.9	8%	0.079	23%	0.231	C	C	.	.	H	α-helix	trans	-60.1	-38.3	-177.7	170.7	0	0	0	0	110.9	I187 N188 F189 L193 L194 N197 W198	I187-V191 HydrophobicContact CG2-CG2 4.4Å; I187-V191 VanDerWaalsContact O-CG2 3.27Å; I187-V191 WeakPolarHBondContact O-CG2 3.46Å; I187-V191 PolarHBondContact O-N 3.48Å; N188-V191 PolarHBondContact O-N 3.49Å; F189-V191 VanDerWaalsContact C-N 3.34Å; V191-L193 VanDerWaalsContact C-N 3.28Å; V191-L193 PolarHBondContact O-N 2.88Å; V191-L194 PolarHBondContact O-N 2.91Å; V191-N197 HydrophobicContact CG1-CB 3.71Å; V191-N197 PolarHBondContact O-OD1 2.82Å; V191-N197 VanDerWaalsContact O-OD1 3.1Å; V191-W198 HydrophobicContact CG1-CG 4.34Å; V191-W198 HydrophobicContact CG2-CD2 4.03Å; V191-W198 HydrophobicContact CG2-CG 4.45Å; V191-W198 HydrophobicContact CG2-CH2 4.39Å; V191-W198 HydrophobicContact CG2-CZ2 3.89Å
192	T	86.6	Confident	86.3	Confident	102 Å²	102	51.2 Å²	51.2	63%	0.626	24%	0.244	S	C	*	.	H	α-helix	trans	-69.5	-23.2	177.7	58.9	0	0	0	0	113.6	N188 F189 L190 L194	N188-T192 PolarHBondContact O-N 2.86Å; F189-T192 PolarHBondContact O-N 3.29Å; F189-T192 PolarHBondContact O-OG1 3.38Å; L190-T192 VanDerWaalsContact C-N 3.25Å; L190-T192 PolarHBondContact O-N 3.04Å; T192-L194 VanDerWaalsContact C-N 3.34Å
193	L	84.3	Confident	86.2	Confident	52 Å²	52	51.7 Å²	51.7	27%	0.272	25%	0.247	S	C	.	.	H	α-helix	trans	-78.4	-17.5	175.3	-65.7	171.7	0	0	0	113.1	F49 F157 F189 L190 V191	F49-L193 HydrophobicContact CD2-CB 3.96Å; F49-L193 HydrophobicContact CD2-CD1 3.84Å; F49-L193 HydrophobicContact CD2-CG 4.46Å; F49-L193 HydrophobicContact CE2-CB 4.34Å; F49-L193 HydrophobicContact CE2-CD1 4.2Å; F49-L193 HydrophobicContact CG-CB 4.22Å; F157-L193 HydrophobicContact CB-CD1 4.49Å; F189-L193 HydrophobicContact CD1-CD1 3.96Å; F189-L193 HydrophobicContact CE1-CD1 3.59Å; F189-L193 HydrophobicContact CE1-CG 4.32Å; F189-L193 HydrophobicContact CZ-CD1 4.21Å; F189-L193 WeakPolarHBondContact O-CG 3.03Å; F189-L193 PolarHBondContact O-N 3.16Å; L190-L193 WeakPolarHBondContact O-CB 3.47Å; L190-L193 PolarHBondContact O-N 2.98Å; L190-L193 VanDerWaalsContact O-N 3.07Å; V191-L193 VanDerWaalsContact C-N 3.28Å; V191-L193 PolarHBondContact O-N 2.88Å
194	L	82.2	Confident	86.4	Confident	3 Å²	3	51.8 Å²	51.8	2%	0.016	25%	0.247	C	C	.	.	S	Bend	trans	-91.7	126.3	-176.9	-65.1	170.7	0	0	0	110.8	L38 Y41 F49 L190 V191 T192 K196 N197 N200 V201	L38-L194 HydrophobicContact CD1-CD2 4.13Å; L38-L194 HydrophobicContact CD2-CD1 3.77Å; L38-L194 HydrophobicContact CD2-CD2 3.9Å; Y41-L194 HydrophobicContact CD2-CD2 4.38Å; Y41-L194 HydrophobicContact CE2-CD2 4.23Å; F49-L194 HydrophobicContact CE1-CD2 3.66Å; F49-L194 HydrophobicContact CZ-CD2 3.99Å; L190-L194 HydrophobicContact CG-CD1 4.43Å; L190-L194 PolarHBondContact O-N 3.15Å; V191-L194 PolarHBondContact O-N 2.91Å; T192-L194 VanDerWaalsContact C-N 3.34Å; L194-K196 PolarHBondContact O-N 3.35Å; L194-N197 PolarHBondContact O-N 3.35Å; L194-N197 PolarHBondContact O-OD1 3.15Å; L194-N200 HydrophobicContact CB-CB 4.41Å; L194-N200 HydrophobicContact CD1-CB 4.17Å; L194-N200 HydrophobicContact CD2-CB 4.4Å; L194-V201 HydrophobicContact CD1-CG2 3.76Å
195	K	81.2	Confident	86.5	Confident	131 Å²	131	53.2 Å²	53.2	57%	0.57	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.4	-38	179.6	-68	-177.7	-178	171	0	114.5	D46	D46-K195 IonicContact OD1-NZ 2.76Å; D46-K195 PolarHBondContact OD1-NZ 2.88Å
196	K	84.8	Confident	86.6	Confident	122 Å²	122	50.3 Å²	50.3	53%	0.53	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.9	19.6	179.7	-54.1	-174.6	176.6	-178.7	0	113	L194 W198 Q199	L194-K196 PolarHBondContact O-N 3.35Å; K196-W198 PolarHBondContact O-N 3.24Å; K196-Q199 HydrophobicContact CB-CB 4.04Å; K196-Q199 WeakPolarHBondContact O-CB 3.01Å; K196-Q199 PolarHBondContact O-N 3.4Å
197	N	85	Confident	86.7	Confident	83 Å²	83	52.8 Å²	52.8	44%	0.444	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	49.6	-126.6	178.9	-61.7	-41.1	0	0	0	111.7	V191 L194 Q199 N200	V191-N197 HydrophobicContact CG1-CB 3.71Å; V191-N197 PolarHBondContact O-OD1 2.82Å; V191-N197 VanDerWaalsContact O-OD1 3.1Å; L194-N197 PolarHBondContact O-N 3.35Å; L194-N197 PolarHBondContact O-OD1 3.15Å; N197-Q199 VanDerWaalsContact C-N 3.25Å; N197-Q199 PolarHBondContact O-N 3.07Å; N197-N200 PolarHBondContact O-N 3.1Å
198	W	85.5	Confident	86.6	Confident	29 Å²	29	52.7 Å²	52.7	11%	0.11	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-62.3	-21.2	180	-73.9	99.1	0	0	0	115.3	K3 V4 I187 V191 K196 N200 V201 L204 Y217	K3-W198 HydrophobicContact CB-CD2 4.06Å; K3-W198 HydrophobicContact CB-CE3 3.92Å; K3-W198 HydrophobicContact CB-CH2 4.06Å; K3-W198 HydrophobicContact CB-CZ2 4.19Å; K3-W198 HydrophobicContact CB-CZ3 3.91Å; K3-W198 HydrophobicContact CD-CB 4.15Å; K3-W198 HydrophobicContact CD-CD2 4Å; K3-W198 HydrophobicContact CD-CE3 4.03Å; K3-W198 HydrophobicContact CD-CG 4.06Å; K3-W198 HydrophobicContact CG-CD2 3.85Å; K3-W198 HydrophobicContact CG-CE3 4.11Å; K3-W198 HydrophobicContact CG-CG 4.12Å; V4-W198 HydrophobicContact CG2-CH2 3.9Å; V4-W198 HydrophobicContact CG2-CZ3 4.35Å; I187-W198 HydrophobicContact CG2-CH2 3.5Å; I187-W198 HydrophobicContact CG2-CZ2 3.91Å; I187-W198 HydrophobicContact CG2-CZ3 4.42Å; V191-W198 HydrophobicContact CG1-CG 4.34Å; V191-W198 HydrophobicContact CG2-CD2 4.03Å; V191-W198 HydrophobicContact CG2-CG 4.45Å; V191-W198 HydrophobicContact CG2-CH2 4.39Å; V191-W198 HydrophobicContact CG2-CZ2 3.89Å; K196-W198 PolarHBondContact O-N 3.24Å; W198-N200 PolarHBondContact O-N 3.44Å; W198-V201 HydrophobicContact CE3-CB 4.48Å; W198-V201 PolarHBondContact O-N 3.33Å; W198-V201 VanDerWaalsContact O-N 3.16Å; W198-L204 HydrophobicContact CH2-CD1 4.21Å; W198-L204 HydrophobicContact CZ3-CD1 3.91Å; W198-Y217 HydrophobicContact CE3-CE1 4.45Å
199	Q	84.3	Confident	86.5	Confident	134 Å²	134	53 Å²	53	63%	0.626	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-69.2	-23.4	178.6	-64.6	-176.4	-6.7	0	0	112.1	K39 K196 N197 V201	K39-Q199 WeakPolarHBondContact CE-O 3.48Å; K39-Q199 WeakPolarHBondContact CG-O 3.39Å; K196-Q199 HydrophobicContact CB-CB 4.04Å; K196-Q199 WeakPolarHBondContact O-CB 3.01Å; K196-Q199 PolarHBondContact O-N 3.4Å; N197-Q199 VanDerWaalsContact C-N 3.25Å; N197-Q199 PolarHBondContact O-N 3.07Å; Q199-V201 VanDerWaalsContact C-N 3.33Å
200	N	84.5	Confident	86.4	Confident	5 Å²	5	55 Å²	55	3%	0.027	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-85.6	-6.6	175.4	-76.6	2.1	0	0	0	112.7	L38 K39 L194 N197 W198	L38-N200 CarbonylContact C-O 3.45Å; L38-N200 WeakPolarHBondContact CA-O 3.21Å; K39-N200 PolarHBondContact N-O 3.49Å; L194-N200 HydrophobicContact CB-CB 4.41Å; L194-N200 HydrophobicContact CD1-CB 4.17Å; L194-N200 HydrophobicContact CD2-CB 4.4Å; N197-N200 PolarHBondContact O-N 3.1Å; W198-N200 PolarHBondContact O-N 3.44Å
201	V	85.7	Confident	86.2	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.006	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	119.2	178.2	-175.6	0	0	0	0	108.7	L194 W198 Q199 L204 Y217	L194-V201 HydrophobicContact CD1-CG2 3.76Å; W198-V201 HydrophobicContact CE3-CB 4.48Å; W198-V201 PolarHBondContact O-N 3.33Å; W198-V201 VanDerWaalsContact O-N 3.16Å; Q199-V201 VanDerWaalsContact C-N 3.33Å; V201-L204 HydrophobicContact CG1-CD1 4.36Å; V201-L204 HydrophobicContact CG1-CD2 3.83Å; V201-L204 HydrophobicContact CG1-CG 3.82Å; V201-Y217 HydrophobicContact CG1-CD1 4.12Å; V201-Y217 HydrophobicContact CG1-CE1 4.47Å
202	R	87.2	Confident	86.1	Confident	173 Å²	173	63.6 Å²	63.6	65%	0.653	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.4	-56	174.2	-174.9	179.6	176.1	174.1	-0.9	110.5	A37 K39	A37-R202 HydrophobicContact CB-CB 4.21Å; A37-R202 WeakPolarHBondContact O-CB 3.47Å; A37-R202 PolarHBondContact O-N 3.03Å; K39-R202 HydrophobicContact CB-CB 4.03Å; K39-R202 HydrophobicContact CD-CB 4.38Å; K39-R202 HydrophobicContact CG-CB 4.29Å
203	C	89.2	Confident	86.2	Confident	10 Å²	10	62.7 Å²	62.7	7%	0.068	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	155.8	-178.8	48.8	0	0	0	0	111.3	A37 Y205 Y217	A37-C203 VanDerWaalsContact CB-SG 3.55Å; A37-C203 PolarHBondContact N-O 3.48Å; A37-C203 PolarHBondContact O-N 2.78Å; C203-Y205 HydrophobicContact CB-CE2 4.04Å; C203-Y205 WeakPolarHBondContact SG-CE2 3.37Å; C203-Y217 CarbonylContact C-O 3.48Å; C203-Y217 WeakPolarHBondContact CA-O 3.18Å; C203-Y217 WeakPolarHBondContact CB-O 3.31Å
204	L	91.3	Very high	86.4	Confident	1 Å²	1	62.3 Å²	62.3	1%	0.005	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	126.8	177.5	-63.8	174	0	0	0	108.3	V4 I36 I187 W198 V201 L216 Y217	V4-L204 HydrophobicContact CG2-CD1 4.03Å; I36-L204 HydrophobicContact CB-CD2 3.92Å; I36-L204 HydrophobicContact CG1-CD2 3.61Å; I36-L204 HydrophobicContact CG2-CD2 3.55Å; I187-L204 HydrophobicContact CD1-CD1 4.01Å; I187-L204 HydrophobicContact CG1-CD1 4.21Å; I187-L204 HydrophobicContact CG2-CD1 4.1Å; W198-L204 HydrophobicContact CH2-CD1 4.21Å; W198-L204 HydrophobicContact CZ3-CD1 3.91Å; V201-L204 HydrophobicContact CG1-CD1 4.36Å; V201-L204 HydrophobicContact CG1-CD2 3.83Å; V201-L204 HydrophobicContact CG1-CG 3.82Å; L204-L216 HydrophobicContact CB-CB 4.07Å; L204-L216 PolarHBondContact O-N 2.91Å; L204-Y217 PolarHBondContact N-O 3.13Å; L204-Y217 PolarHBondContact O-N 2.78Å
205	Y	91.4	Very high	86.7	Confident	78 Å²	78	69.1 Å²	69.1	31%	0.306	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	140.9	174.2	-60.8	-83.5	0	0	0	110.2	Q35 C203 P213 H214 R215	Q35-Y205 PolarHBondContact N-O 3.16Å; Q35-Y205 PolarHBondContact O-N 2.81Å; C203-Y205 HydrophobicContact CB-CE2 4.04Å; C203-Y205 WeakPolarHBondContact SG-CE2 3.37Å; Y205-P213 HydrophobicContact CD1-CB 4.48Å; Y205-H214 CarbonylContact C-O 3.6Å; Y205-H214 VanDerWaalsContact CA-O 3.27Å; Y205-H214 WeakPolarHBondContact CA-O 3.46Å; Y205-R215 HydrophobicContact CD1-CB 3.81Å; Y205-R215 HydrophobicContact CD1-CG 4.08Å; Y205-R215 HydrophobicContact CE1-CB 3.65Å; Y205-R215 HydrophobicContact CE1-CG 3.71Å
206	I	91.5	Very high	86.8	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	135.5	164.1	-53.1	163	0	0	0	107.5	L9 I16 V32 E33 L34 I183 P213 H214 L216	L9-I206 HydrophobicContact CD1-CD1 3.91Å; I16-I206 HydrophobicContact CD1-CB 3.86Å; I16-I206 HydrophobicContact CD1-CG2 3.43Å; I16-I206 VanDerWaalsContact CD1-CG2 3.43Å; V32-I206 HydrophobicContact CG1-CG2 3.51Å; E33-I206 WeakPolarHBondContact O-CA 3.43Å; L34-I206 HydrophobicContact CD1-CG1 4.07Å; I183-I206 HydrophobicContact CD1-CD1 3.63Å; I183-I206 HydrophobicContact CD1-CG1 4.26Å; I183-I206 HydrophobicContact CD1-CG2 4.35Å; I183-I206 HydrophobicContact CG2-CD1 4.3Å; I206-P213 CarbonylContact O-C 3.56Å; I206-P213 WeakPolarHBondContact O-CA 3.43Å; I206-H214 PolarHBondContact N-O 2.93Å; I206-H214 PolarHBondContact O-N 2.71Å; I206-L216 HydrophobicContact CD1-CD1 3.41Å; I206-L216 VanDerWaalsContact CD1-CD1 3.41Å; I206-L216 HydrophobicContact CD1-CD2 3.77Å; I206-L216 HydrophobicContact CD1-CG 3.7Å; I206-L216 HydrophobicContact CG1-CD1 3.56Å; I206-L216 HydrophobicContact CG1-CG 3.92Å
207	K	89.9	Confident	86.6	Confident	52 Å²	52	60.9 Å²	60.9	23%	0.226	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	155.1	170.3	65.4	173.2	-166.5	175.7	0	110.2	E33 Q35 P213	E33-K207 HydrophobicContact CB-CG 4.44Å; E33-K207 PolarHBondContact N-O 3.29Å; E33-K207 PolarHBondContact O-N 3.17Å; E33-K207 WeakPolarHBondContact OE2-CE 3.48Å; Q35-K207 HydrophobicContact CG-CD 4.29Å; Q35-K207 HydrophobicContact CG-CG 4.29Å; Q35-K207 VanDerWaalsContact NE2-CE 3.32Å; K207-P213 HydrophobicContact CB-CB 4.24Å
208	S	88	Confident	86.7	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.007	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	174.7	158.7	73.4	0	0	0	0	110.4	S20 E30 T31 M210 G211	S20-S208 PolarHBondContact OG-OG 3.36Å; E30-S208 WeakPolarHBondContact OE2-CB 3.47Å; E30-S208 PolarHBondContact OE2-OG 3.24Å; T31-S208 CarbonylContact O-C 3.55Å; T31-S208 WeakPolarHBondContact O-CA 3.26Å; S208-M210 VanDerWaalsContact C-N 3.25Å; S208-M210 PolarHBondContact O-N 3.07Å; S208-G211 WeakPolarHBondContact OG-CA 2.79Å; S208-G211 PolarHBondContact OG-N 3.44Å
209	T	86	Confident	86.7	Confident	64 Å²	64	61.4 Å²	61.4	39%	0.393	28%	0.277	S	S	.	.	S	Bend	trans	-57	-38.6	-177.3	-53.4	0	0	0	0	112.4	F28 E30 T31	F28-T209 HydrophobicContact CE2-CG2 4.34Å; F28-T209 HydrophobicContact CZ-CG2 4.5Å; E30-T209 PolarHBondContact OE2-N 3.4Å; T31-T209 PolarHBondContact N-OG1 3.03Å; T31-T209 PolarHBondContact O-N 3.22Å; T31-T209 PolarHBondContact O-OG1 3.27Å
210	M	83.7	Confident	86.9	Confident	100 Å²	100	57.3 Å²	57.3	49%	0.493	26%	0.258	S	S	.	.	S	Bend	trans	-127	11.4	178.9	-63.8	-171.5	172.7	0	0	113.4	F28 E30 S208	F28-M210 HydrophobicContact CE1-CE 4.09Å; F28-M210 HydrophobicContact CE1-SD 4.21Å; F28-M210 HydrophobicContact CZ-CE 3.94Å; F28-M210 HydrophobicContact CZ-CG 4.39Å; F28-M210 HydrophobicContact CZ-SD 4.04Å; E30-M210 PolarHBondContact OE2-N 2.93Å; E30-M210 VanDerWaalsContact OE2-N 3.14Å; S208-M210 VanDerWaalsContact C-N 3.25Å; S208-M210 PolarHBondContact O-N 3.07Å
211	G	81.2	Confident	87	Confident	16 Å²	16	60.4 Å²	60.4	17%	0.165	27%	0.271	C	S	.	.	S	Bend	trans	-89.1	171.3	178.6	0	0	0	0	0	112.9	S208	S208-G211 WeakPolarHBondContact OG-CA 2.79Å; S208-G211 PolarHBondContact OG-N 3.44Å
212	R	85	Confident	87.1	Confident	179 Å²	179	64.1 Å²	64.1	68%	0.675	29%	0.288	S	S	*	.	P	Polyproline II helix	trans	-73	144.6	175.7	-65.1	-178.4	178.7	-176.8	-0.8	110.1	H214	R212-H214 PolarHBondContact O-CD2 3.12Å
213	P	87.8	Confident	87.1	Confident	82 Å²	82	56.9 Å²	56.9	53%	0.532	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-75.7	133.4	173.5	30.5	-32.7	0	0	0	110.8	Y205 I206 K207	Y205-P213 HydrophobicContact CD1-CB 4.48Å; I206-P213 CarbonylContact O-C 3.56Å; I206-P213 WeakPolarHBondContact O-CA 3.43Å; K207-P213 HydrophobicContact CB-CB 4.24Å
214	H	88.4	Confident	86.9	Confident	45 Å²	45	60.2 Å²	60.2	21%	0.208	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	128.5	170.6	-69.1	-99	0	0	0	109.2	D15 I16 Y205 I206 R212	D15-H214 IonicContact OD2-CE1 3.86Å; I16-H214 WeakPolarHBondContact CG1-CD2 3.29Å; Y205-H214 CarbonylContact C-O 3.6Å; Y205-H214 VanDerWaalsContact CA-O 3.27Å; Y205-H214 WeakPolarHBondContact CA-O 3.46Å; I206-H214 PolarHBondContact N-O 2.93Å; I206-H214 PolarHBondContact O-N 2.71Å; R212-H214 PolarHBondContact O-CD2 3.12Å
215	R	88.4	Confident	86.6	Confident	145 Å²	145	64.8 Å²	64.8	55%	0.547	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	125.1	177.7	-171.4	174.5	172.3	-166.3	-9.8	110.1	Y205 Y217	Y205-R215 HydrophobicContact CD1-CB 3.81Å; Y205-R215 HydrophobicContact CD1-CG 4.08Å; Y205-R215 HydrophobicContact CE1-CB 3.65Å; Y205-R215 HydrophobicContact CE1-CG 3.71Å; R215-Y217 WeakPolarHBondContact CG-O 3.39Å; R215-Y217 VanDerWaalsContact NE-C 3.34Å; R215-Y217 PolarHBondContact NE-O 3.07Å; R215-Y217 PolarHBondContact NE-OXT 2.8Å; R215-Y217 VanDerWaalsContact NE-OXT 3.16Å; R215-Y217 PolarHBondContact NH2-OXT 3.26Å
216	L	84.6	Confident	86.2	Confident	8 Å²	8	63.7 Å²	63.7	4%	0.042	30%	0.298	C	S	.	.			trans	-95.3	-33.3	175	-69	-179.6	0	0	0	113.4	V4 L9 L34 I183 I187 L204 I206	V4-L216 HydrophobicContact CG1-CB 4.2Å; V4-L216 HydrophobicContact CG1-CD1 4.29Å; V4-L216 HydrophobicContact CG1-CD2 4.21Å; V4-L216 HydrophobicContact CG1-CG 4.5Å; V4-L216 HydrophobicContact CG2-CB 4.47Å; L9-L216 HydrophobicContact CD1-CD1 3.83Å; L9-L216 HydrophobicContact CD1-CD2 3.96Å; L34-L216 HydrophobicContact CD1-CD1 4.44Å; I183-L216 HydrophobicContact CG2-CD1 4.25Å; I187-L216 HydrophobicContact CD1-CD1 4.06Å; L204-L216 HydrophobicContact CB-CB 4.07Å; L204-L216 PolarHBondContact O-N 2.91Å; I206-L216 HydrophobicContact CD1-CD1 3.41Å; I206-L216 VanDerWaalsContact CD1-CD1 3.41Å; I206-L216 HydrophobicContact CD1-CD2 3.77Å; I206-L216 HydrophobicContact CD1-CG 3.7Å; I206-L216 HydrophobicContact CG1-CD1 3.56Å; I206-L216 HydrophobicContact CG1-CG 3.92Å
217	Y	80.2	Confident	85.7	Confident	72 Å²	72	69.5 Å²	69.5	28%	0.282	33%	0.325	S	S	.	.			trans	-150.5	0	-177.5	-171.9	-105.8	0	0	0	109.4	K3 W198 V201 C203 L204 R215	K3-Y217 HydrophobicContact CB-CD2 4.33Å; K3-Y217 HydrophobicContact CB-CE2 4.07Å; K3-Y217 HydrophobicContact CD-CE2 3.74Å; K3-Y217 PolarHBondContact NZ-OH 2.76Å; W198-Y217 HydrophobicContact CE3-CE1 4.45Å; V201-Y217 HydrophobicContact CG1-CD1 4.12Å; V201-Y217 HydrophobicContact CG1-CE1 4.47Å; C203-Y217 CarbonylContact C-O 3.48Å; C203-Y217 WeakPolarHBondContact CA-O 3.18Å; C203-Y217 WeakPolarHBondContact CB-O 3.31Å; L204-Y217 PolarHBondContact N-O 3.13Å; L204-Y217 PolarHBondContact O-N 2.78Å; R215-Y217 WeakPolarHBondContact CG-O 3.39Å; R215-Y217 VanDerWaalsContact NE-C 3.34Å; R215-Y217 PolarHBondContact NE-O 3.07Å; R215-Y217 PolarHBondContact NE-OXT 2.8Å; R215-Y217 VanDerWaalsContact NE-OXT 3.16Å; R215-Y217 PolarHBondContact NH2-OXT 3.26Å

Retrieved 217 of 217 residues in 295.1 ms (Link to these results)

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