A0A077Z0X6_TRITR Loading...

ParA domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z0X6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 242 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	48.5	Very low	54.1	Low	224 Å²	224	113.6 Å²	113.6	100%	1.103	62%	0.623	S	S	*	*				0	101.1	0	-80	178.9	-142.2	0	0	108.1
2	T	49.3	Very low	54.3	Low	116 Å²	116	109.1 Å²	109.1	71%	0.712	61%	0.612	S	S	*	*			trans	-73.9	137.9	-176.4	-15.8	0	0	0	0	109.1	G4 S5	T2-G4 PolarHBondContact O-N 3.03Å; T2-S5 WeakPolarHBondContact O-CB 3.5Å; T2-S5 PolarHBondContact O-N 3.39Å; T2-S5 PolarHBondContact O-OG 2.92Å
3	I	58.6	Low	54.2	Low	143 Å²	143	115.4 Å²	115.4	73%	0.733	63%	0.628	S	S	*	*	H	α-helix	trans	-46.7	-33.7	-178.9	-65.6	163.9	0	0	0	112	S5 T6 V7	I3-S5 PolarHBondContact O-N 3.27Å; I3-T6 PolarHBondContact O-N 3.37Å; I3-V7 HydrophobicContact CG2-CG2 4.45Å; I3-V7 WeakPolarHBondContact O-CG2 3.43Å; I3-V7 PolarHBondContact O-N 3.19Å
4	G	57.6	Low	54.6	Low	41 Å²	41	111.7 Å²	111.7	42%	0.423	63%	0.631	S	S	.	*	H	α-helix	trans	-59.1	-36.1	174.8	0	0	0	0	0	115.4	T2 T6 L8	T2-G4 PolarHBondContact O-N 3.03Å; G4-T6 VanDerWaalsContact C-N 3.34Å; G4-T6 PolarHBondContact O-N 3.1Å; G4-L8 WeakPolarHBondContact O-CB 3.46Å; G4-L8 WeakPolarHBondContact O-CD1 3.48Å; G4-L8 WeakPolarHBondContact O-CG 3.35Å; G4-L8 PolarHBondContact O-N 3.41Å
5	S	58.6	Low	55.3	Low	51 Å²	51	110.2 Å²	110.2	36%	0.357	62%	0.62	S	S	.	*	H	α-helix	trans	-69.5	-31.8	178.9	67.6	0	0	0	0	113	T2 I3 R9	T2-S5 WeakPolarHBondContact O-CB 3.5Å; T2-S5 PolarHBondContact O-N 3.39Å; T2-S5 PolarHBondContact O-OG 2.92Å; I3-S5 PolarHBondContact O-N 3.27Å; S5-R9 WeakPolarHBondContact O-CG 3.44Å; S5-R9 PolarHBondContact O-N 3.49Å
6	T	55.1	Low	56.1	Low	89 Å²	89	107.7 Å²	107.7	55%	0.546	61%	0.609	S	S	.	*	H	α-helix	trans	-75.6	-41.6	178.4	-51.8	0	0	0	0	110.7	I3 G4 R9 S10	I3-T6 PolarHBondContact O-N 3.37Å; G4-T6 VanDerWaalsContact C-N 3.34Å; G4-T6 PolarHBondContact O-N 3.1Å; T6-R9 PolarHBondContact O-N 3.36Å; T6-S10 PolarHBondContact O-N 2.97Å
7	V	57.9	Low	57.4	Low	76 Å²	76	108.6 Å²	108.6	46%	0.461	62%	0.618	S	S	.	*	H	α-helix	trans	-62.9	-46.1	175.4	174.9	0	0	0	0	111	I3 R9 S10 I11	I3-V7 HydrophobicContact CG2-CG2 4.45Å; I3-V7 WeakPolarHBondContact O-CG2 3.43Å; I3-V7 PolarHBondContact O-N 3.19Å; V7-R9 VanDerWaalsContact C-N 3.34Å; V7-R9 PolarHBondContact O-N 3.42Å; V7-S10 WeakPolarHBondContact O-CB 3.49Å; V7-S10 PolarHBondContact O-N 3.34Å; V7-S10 VanDerWaalsContact O-N 3.1Å; V7-I11 HydrophobicContact CG1-CD1 3.8Å; V7-I11 HydrophobicContact CG1-CG1 4.41Å; V7-I11 WeakPolarHBondContact O-CG1 3.43Å; V7-I11 PolarHBondContact O-N 3.13Å
8	L	52.4	Low	59.1	Low	123 Å²	123	106.6 Å²	106.6	64%	0.644	60%	0.601	S	S	*	*	H	α-helix	trans	-58.9	-42.8	176.3	-82	161.5	0	0	0	112.4	G4 S10 I11 A12	G4-L8 WeakPolarHBondContact O-CB 3.46Å; G4-L8 WeakPolarHBondContact O-CD1 3.48Å; G4-L8 WeakPolarHBondContact O-CG 3.35Å; G4-L8 PolarHBondContact O-N 3.41Å; L8-S10 VanDerWaalsContact C-N 3.34Å; L8-S10 PolarHBondContact O-N 3.48Å; L8-I11 PolarHBondContact O-N 2.78Å; L8-A12 WeakPolarHBondContact O-CB 3.46Å; L8-A12 PolarHBondContact O-N 2.96Å
9	R	51.1	Low	60.8	Low	196 Å²	196	106.4 Å²	106.4	74%	0.74	60%	0.597	S	S	*	*	H	α-helix	trans	-64.8	-36.6	174.6	-79.1	-177.3	-179.4	-172.6	0.7	112.7	S5 T6 V7 A12 K13	S5-R9 WeakPolarHBondContact O-CG 3.44Å; S5-R9 PolarHBondContact O-N 3.49Å; T6-R9 PolarHBondContact O-N 3.36Å; V7-R9 VanDerWaalsContact C-N 3.34Å; V7-R9 PolarHBondContact O-N 3.42Å; R9-A12 PolarHBondContact O-N 3.19Å; R9-K13 PolarHBondContact O-N 3.5Å; R9-K13 VanDerWaalsContact O-N 3.13Å
10	S	50.5	Low	62.5	Low	83 Å²	83	105.7 Å²	105.7	58%	0.58	60%	0.598	S	S	*	*	H	α-helix	trans	-68.6	-38.7	177.1	-166.3	0	0	0	0	112.3	T6 V7 L8 K13	T6-S10 PolarHBondContact O-N 2.97Å; V7-S10 WeakPolarHBondContact O-CB 3.49Å; V7-S10 PolarHBondContact O-N 3.34Å; V7-S10 VanDerWaalsContact O-N 3.1Å; L8-S10 VanDerWaalsContact C-N 3.34Å; L8-S10 PolarHBondContact O-N 3.48Å; S10-K13 PolarHBondContact O-N 2.99Å
11	I	55.8	Low	63.9	Low	108 Å²	108	100.9 Å²	100.9	55%	0.554	57%	0.57	S	S	*	*	H	α-helix	trans	-67	-42.2	175.4	-65.3	166.4	0	0	0	110.1	V7 L8 K13 G14	V7-I11 HydrophobicContact CG1-CD1 3.8Å; V7-I11 HydrophobicContact CG1-CG1 4.41Å; V7-I11 WeakPolarHBondContact O-CG1 3.43Å; V7-I11 PolarHBondContact O-N 3.13Å; L8-I11 PolarHBondContact O-N 2.78Å; I11-K13 VanDerWaalsContact C-N 3.28Å; I11-K13 PolarHBondContact O-N 3.02Å; I11-G14 PolarHBondContact O-N 2.83Å
12	A	56.5	Low	66	Low	59 Å²	59	94 Å²	94	49%	0.488	55%	0.549	S	S	.	.	H	α-helix	trans	-62	-34.3	177.6	0	0	0	0	0	112.9	L8 R9 G14 L15	L8-A12 WeakPolarHBondContact O-CB 3.46Å; L8-A12 PolarHBondContact O-N 2.96Å; R9-A12 PolarHBondContact O-N 3.19Å; A12-G14 PolarHBondContact O-N 3.33Å; A12-L15 PolarHBondContact O-N 3.33Å
13	K	53.2	Low	68.1	Low	191 Å²	191	90.6 Å²	90.6	83%	0.83	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-19.3	173.9	-79.5	-173.9	176.3	-172.7	0	113.9	R9 S10 I11	R9-K13 PolarHBondContact O-N 3.5Å; R9-K13 VanDerWaalsContact O-N 3.13Å; S10-K13 PolarHBondContact O-N 2.99Å; I11-K13 VanDerWaalsContact C-N 3.28Å; I11-K13 PolarHBondContact O-N 3.02Å
14	G	60.1	Low	69.8	Low	64 Å²	64	84.7 Å²	84.7	66%	0.66	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-3.5	178.1	0	0	0	0	0	114.4	I11 A12	I11-G14 PolarHBondContact O-N 2.83Å; A12-G14 PolarHBondContact O-N 3.33Å
15	L	64.9	Low	71.7	Confident	89 Å²	89	89.9 Å²	89.9	47%	0.466	52%	0.518	S	S	.	.	S	Bend	trans	-73.5	133.7	178.4	-71.4	168.2	0	0	0	109.9	A12	A12-L15 PolarHBondContact O-N 3.33Å
16	P	68.3	Low	73.5	Confident	70 Å²	70	93.7 Å²	93.7	46%	0.455	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-59.5	145.3	-179.7	23.5	-32.1	0	0	0	111.1	K18 Q152	P16-K18 PolarHBondContact O-N 3.19Å; P16-Q152 HydrophobicContact CG-CB 4.43Å
17	V	77.9	Confident	75.5	Confident	124 Å²	124	89.8 Å²	89.8	75%	0.752	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-63.1	119.7	172.9	178.4	0	0	0	0	108.3	L19	V17-L19 PolarHBondContact O-N 3.27Å
18	K	88.5	Confident	77.4	Confident	72 Å²	72	87 Å²	87	31%	0.313	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-64.6	120.1	175.5	-68.9	179.7	-178.1	-155.7	0	109.4	P16 V151 Q152 I154 P155	P16-K18 PolarHBondContact O-N 3.19Å; K18-V151 WeakPolarHBondContact CE-O 3.09Å; K18-V151 PolarHBondContact NZ-O 2.87Å; K18-Q152 WeakPolarHBondContact CG-O 3.44Å; K18-I154 WeakPolarHBondContact CD-O 3.37Å; K18-P155 HydrophobicContact CB-CG 4.22Å
19	L	91.2	Very high	79.5	Confident	102 Å²	102	81.2 Å²	81.2	53%	0.534	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-97	127.2	177.9	-66.7	173.6	0	0	0	109.8	V17 R125 N153 P155	V17-L19 PolarHBondContact O-N 3.27Å; L19-R125 PolarHBondContact O-NH1 3.27Å; L19-R125 PolarHBondContact O-NH2 3.01Å; L19-N153 PolarHBondContact N-O 3.39Å; L19-P155 VanDerWaalsContact O-CD 3.32Å; L19-P155 WeakPolarHBondContact O-CD 3.48Å
20	P	93.7	Very high	81.7	Confident	93 Å²	93	71.9 Å²	71.9	60%	0.604	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-55.6	152.7	172.8	-24	33	0	0	0	112.7	R125 P155	P20-R125 PolarHBondContact O-NH1 3.35Å; P20-P155 HydrophobicContact CB-CG 4.47Å; P20-P155 HydrophobicContact CG-CG 4.13Å
21	I	93.3	Very high	83.9	Confident	5 Å²	5	68 Å²	68	3%	0.026	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-80.5	127.4	170	-60.5	170	0	0	0	107.7	G23 V24 V27 L124 W129 L135 I154	I21-G23 PolarHBondContact O-N 3.15Å; I21-V24 HydrophobicContact CB-CB 4.03Å; I21-V24 HydrophobicContact CB-CG2 4.02Å; I21-V24 HydrophobicContact CG2-CB 4.14Å; I21-V24 HydrophobicContact CG2-CG2 3.55Å; I21-V24 PolarHBondContact O-N 2.76Å; I21-V24 VanDerWaalsContact O-N 3.14Å; I21-V27 HydrophobicContact CD1-CG2 4Å; I21-L124 HydrophobicContact CD1-CD2 3.64Å; I21-L124 HydrophobicContact CG1-CD2 4.35Å; I21-L124 WeakPolarHBondContact CG2-O 3.47Å; I21-W129 HydrophobicContact CG2-CG 4.29Å; I21-L135 HydrophobicContact CD1-CD2 3.62Å; I21-I154 HydrophobicContact CD1-CD1 4.03Å; I21-I154 HydrophobicContact CD1-CG2 4.22Å; I21-I154 HydrophobicContact CG1-CB 4.5Å; I21-I154 HydrophobicContact CG1-CG2 3.87Å
22	A	92.7	Very high	85.7	Confident	79 Å²	79	63 Å²	63	65%	0.653	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	123.8	-176.8	0	0	0	0	0	111.3	V24	A22-V24 VanDerWaalsContact C-N 3.34Å
23	G	92.2	Very high	87.1	Confident	45 Å²	45	61 Å²	61	46%	0.464	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.8	11.4	178.1	0	0	0	0	0	115.6	I21 G130 P131 L132	I21-G23 PolarHBondContact O-N 3.15Å; G23-G130 VanDerWaalsContact O-CA 3.23Å; G23-G130 WeakPolarHBondContact O-CA 3.44Å; G23-P131 CarbonylContact O-C 3.41Å; G23-P131 WeakPolarHBondContact O-CA 3.45Å; G23-L132 PolarHBondContact O-N 2.87Å
24	V	95.3	Very high	88.5	Confident	18 Å²	18	54.3 Å²	54.3	11%	0.109	32%	0.321	C	S	.	.	B	Isolated β-bridge	trans	-113	122.9	176	178.5	0	0	0	0	109.6	I21 A22 R26 V27 W129 L132 L135	I21-V24 HydrophobicContact CB-CB 4.03Å; I21-V24 HydrophobicContact CB-CG2 4.02Å; I21-V24 HydrophobicContact CG2-CB 4.14Å; I21-V24 HydrophobicContact CG2-CG2 3.55Å; I21-V24 PolarHBondContact O-N 2.76Å; I21-V24 VanDerWaalsContact O-N 3.14Å; A22-V24 VanDerWaalsContact C-N 3.34Å; V24-R26 VanDerWaalsContact CG1-O 3.24Å; V24-R26 WeakPolarHBondContact CG1-O 3.44Å; V24-V27 HydrophobicContact CG1-CG2 3.98Å; V24-W129 HydrophobicContact CG2-CB 3.66Å; V24-W129 HydrophobicContact CG2-CG 4.12Å; V24-L132 HydrophobicContact CG2-CB 4.27Å; V24-L132 HydrophobicContact CG2-CD1 4.21Å; V24-L135 HydrophobicContact CG1-CB 3.57Å; V24-L135 HydrophobicContact CG2-CB 4.39Å; V24-L135 HydrophobicContact CG2-CD2 4.36Å
25	K	96.3	Very high	89.7	Confident	150 Å²	150	53.7 Å²	53.7	65%	0.652	31%	0.314	S	S	*	.	S	Bend	trans	-78.2	-41.1	-180	-65.2	-177.3	-170.3	163.1	0	113.2	L132 D133	K25-L132 PolarHBondContact N-O 2.94Å; K25-D133 WeakPolarHBondContact CD-OD1 3.26Å; K25-D133 WeakPolarHBondContact CE-OD1 3.3Å; K25-D133 IonicContact NZ-OD1 2.67Å; K25-D133 PolarHBondContact NZ-OD1 3.12Å
26	R	96.8	Very high	90.6	Very high	132 Å²	132	52.9 Å²	52.9	50%	0.498	33%	0.328	S	S	.	.			trans	-138.7	147.8	-177.9	-65.4	-176.7	-68.2	-179.9	-2.1	112	V24 D133 L134 L135 D157	V24-R26 VanDerWaalsContact CG1-O 3.24Å; V24-R26 WeakPolarHBondContact CG1-O 3.44Å; R26-D133 PolarHBondContact N-O 2.95Å; R26-L134 HydrophobicContact CB-CD1 3.99Å; R26-L134 CarbonylContact O-C 3.55Å; R26-L134 WeakPolarHBondContact O-CA 3.2Å; R26-L135 PolarHBondContact O-N 3.24Å; R26-D157 WeakPolarHBondContact CA-OD2 3.41Å; R26-D157 HydrophobicContact CB-CB 4.32Å
27	V	97.3	Very high	91.6	Very high	7 Å²	7	49.8 Å²	49.8	4%	0.042	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	123.3	177.9	-178.7	0	0	0	0	110.2	I21 V24 L29 L135 V137 I154 D157 G158	I21-V27 HydrophobicContact CD1-CG2 4Å; V24-V27 HydrophobicContact CG1-CG2 3.98Å; V27-L29 HydrophobicContact CG1-CD2 3.76Å; V27-L135 WeakPolarHBondContact CA-O 2.92Å; V27-V137 HydrophobicContact CG1-CG2 3.89Å; V27-I154 HydrophobicContact CG1-CD1 3.88Å; V27-D157 PolarHBondContact N-OD2 3.31Å; V27-D157 WeakPolarHBondContact O-CB 3.22Å; V27-D157 PolarHBondContact O-N 2.96Å; V27-G158 PolarHBondContact O-N 3.08Å
28	V	97.6	Very high	92.2	Very high	18 Å²	18	44.7 Å²	44.7	11%	0.109	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	126.2	170	169	0	0	0	0	109.3	L134 L135 V136 V137 G158 V160 I188	V28-L134 HydrophobicContact CB-CD1 4.09Å; V28-L134 HydrophobicContact CG2-CD1 3.69Å; V28-L135 PolarHBondContact N-O 3.4Å; V28-V136 CarbonylContact O-C 3.28Å; V28-V136 WeakPolarHBondContact O-CA 3.36Å; V28-V137 PolarHBondContact O-N 3Å; V28-G158 CarbonylContact C-O 3.58Å; V28-G158 WeakPolarHBondContact CA-O 3.16Å; V28-V160 HydrophobicContact CG1-CG2 4.05Å; V28-I188 HydrophobicContact CG1-CD1 4.17Å; V28-I188 HydrophobicContact CG2-CD1 4.11Å
29	L	97.3	Very high	92.4	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	137.2	176.3	-51.8	-174.9	0	0	0	110	V27 V137 M139 I150 V151 V156 G158 V159 V160 F180	V27-L29 HydrophobicContact CG1-CD2 3.76Å; L29-V137 HydrophobicContact CD2-CB 3.69Å; L29-V137 HydrophobicContact CD2-CG1 4.24Å; L29-V137 HydrophobicContact CD2-CG2 3.94Å; L29-M139 HydrophobicContact CB-CG 3.96Å; L29-M139 HydrophobicContact CB-SD 4.18Å; L29-M139 HydrophobicContact CD1-CE 3.96Å; L29-M139 HydrophobicContact CD1-SD 3.93Å; L29-M139 HydrophobicContact CD2-SD 3.83Å; L29-M139 HydrophobicContact CG-SD 4.2Å; L29-I150 HydrophobicContact CD2-CG2 4.42Å; L29-V151 HydrophobicContact CD1-CG2 3.64Å; L29-V156 HydrophobicContact CD1-CB 4.48Å; L29-V156 HydrophobicContact CD1-CG1 3.9Å; L29-V156 HydrophobicContact CD1-CG2 3.7Å; L29-V156 HydrophobicContact CD2-CG2 4.45Å; L29-V156 HydrophobicContact CG-CG1 3.84Å; L29-V156 HydrophobicContact CG-CG2 4.1Å; L29-G158 PolarHBondContact N-O 3.04Å; L29-V159 HydrophobicContact CB-CG1 4.43Å; L29-V159 HydrophobicContact CB-CG2 4.29Å; L29-V159 HydrophobicContact CD1-CG2 4.31Å; L29-V159 CarbonylContact O-C 3.46Å; L29-V159 WeakPolarHBondContact O-CA 3.28Å; L29-V160 PolarHBondContact O-N 2.97Å; L29-F180 HydrophobicContact CD1-CE1 4.4Å
30	V	96.9	Very high	92.5	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	110.9	169.2	-176.1	0	0	0	0	107.3	K39 V42 A43 L46 V136 V137 M139 V162	V30-K39 HydrophobicContact CG1-CG 4.03Å; V30-V42 HydrophobicContact CG1-CG1 4.37Å; V30-A43 HydrophobicContact CB-CB 3.97Å; V30-A43 HydrophobicContact CG1-CB 4.04Å; V30-A43 HydrophobicContact CG2-CB 3.98Å; V30-L46 HydrophobicContact CG2-CD2 3.99Å; V30-V136 HydrophobicContact CG2-CG1 3.69Å; V30-V137 PolarHBondContact N-O 3.34Å; V30-M139 VanDerWaalsContact O-CB 3.31Å; V30-M139 WeakPolarHBondContact O-CB 3.18Å; V30-M139 WeakPolarHBondContact O-CG 3.41Å; V30-M139 PolarHBondContact O-N 2.75Å; V30-V162 HydrophobicContact CG1-CG2 3.62Å
31	A	95.7	Very high	92.4	Very high	2 Å²	2	35.1 Å²	35.1	2%	0.017	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	150.3	-170.7	0	0	0	0	0	111.8	M139 V159 V160 I161 V162 F180	A31-M139 HydrophobicContact CB-CB 4.42Å; A31-M139 HydrophobicContact CB-CG 4.33Å; A31-V159 HydrophobicContact CB-CG1 4.1Å; A31-V160 PolarHBondContact N-O 3.36Å; A31-I161 CarbonylContact O-C 3.58Å; A31-I161 WeakPolarHBondContact O-CA 3.27Å; A31-V162 PolarHBondContact O-N 3.3Å; A31-F180 HydrophobicContact CB-CE2 3.6Å; A31-F180 HydrophobicContact CB-CZ 3.45Å; A31-F180 VanDerWaalsContact CB-CZ 3.45Å
32	S	93.1	Very high	92.5	Very high	3 Å²	3	35.6 Å²	35.6	2%	0.021	23%	0.233	C	C	.	.			trans	-139.5	146.3	169.4	66.6	0	0	0	0	109.8	K34 K39 G142 Q147 V162	S32-K34 VanDerWaalsContact C-N 3.29Å; S32-K34 WeakPolarHBondContact CB-O 3.48Å; S32-K34 PolarHBondContact OG-O 3.04Å; S32-K39 WeakPolarHBondContact OG-CD 3.4Å; S32-G142 PolarHBondContact O-N 3.04Å; S32-Q147 PolarHBondContact O-NE2 2.91Å; S32-V162 WeakPolarHBondContact CB-O 3.48Å
33	A	86.5	Confident	92.5	Very high	17 Å²	17	31.9 Å²	31.9	14%	0.14	20%	0.202	C	C	.	.	S	Bend	trans	-83	-8	179.9	0	0	0	0	0	113.7	G142 T143 D172	A33-G142 VanDerWaalsContact O-CA 3.29Å; A33-G142 WeakPolarHBondContact O-CA 3.36Å; A33-T143 HydrophobicContact CB-CG2 4.34Å; A33-D172 HydrophobicContact CB-CB 3.56Å; A33-D172 WeakPolarHBondContact CB-O 3.3Å
34	K	83.8	Confident	92.6	Very high	50 Å²	50	30.2 Å²	30.2	22%	0.217	18%	0.183	C	C	.	.	S	Bend	trans	-143.7	161.7	171.7	70.8	179.6	-171.3	175.6	0	111.5	S32 V37 A169	S32-K34 VanDerWaalsContact C-N 3.29Å; S32-K34 WeakPolarHBondContact CB-O 3.48Å; S32-K34 PolarHBondContact OG-O 3.04Å; K34-V37 HydrophobicContact CD-CG1 4.19Å; K34-V37 VanDerWaalsContact CE-CG1 3.46Å; K34-V37 HydrophobicContact CG-CG1 3.64Å; K34-A169 HydrophobicContact CD-CB 4.34Å; K34-A169 VanDerWaalsContact CE-CB 3.43Å
35	G	84.2	Confident	92.4	Very high	51 Å²	51	32.8 Å²	32.8	53%	0.526	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	159.7	170.9	0	0	0	0	0	112	V37	G35-V37 VanDerWaalsContact C-N 3.34Å; G35-V37 PolarHBondContact O-N 3.24Å
36	G	84.5	Confident	92.3	Very high	73 Å²	73	27.8 Å²	27.8	75%	0.753	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.9	-5.1	171.5	0	0	0	0	0	116.8	G38	G36-G38 PolarHBondContact O-N 3.02Å
37	V	88.3	Confident	92.1	Very high	4 Å²	4	21.5 Å²	21.5	2%	0.024	15%	0.153	C	C	.	.	S	Bend	trans	-75.2	0.9	175.6	-58.2	0	0	0	0	113.8	K34 G35 K39 V162 T164 N193	K34-V37 HydrophobicContact CD-CG1 4.19Å; K34-V37 VanDerWaalsContact CE-CG1 3.46Å; K34-V37 HydrophobicContact CG-CG1 3.64Å; G35-V37 VanDerWaalsContact C-N 3.34Å; G35-V37 PolarHBondContact O-N 3.24Å; V37-K39 HydrophobicContact CG2-CB 4.38Å; V37-V162 HydrophobicContact CG2-CB 4.38Å; V37-V162 HydrophobicContact CG2-CG1 4.04Å; V37-T164 HydrophobicContact CB-CG2 4.28Å; V37-T164 HydrophobicContact CG1-CG2 4.28Å; V37-N193 WeakPolarHBondContact O-CB 3.3Å; V37-N193 PolarHBondContact O-ND2 2.74Å
38	G	90.4	Very high	91.7	Very high	17 Å²	17	21.7 Å²	21.7	18%	0.175	15%	0.154	C	C	.	.			trans	74.6	28.8	-177.6	0	0	0	0	0	115.1	G36 S40 T41 V42 N193	G36-G38 PolarHBondContact O-N 3.02Å; G38-S40 VanDerWaalsContact C-N 3.33Å; G38-S40 PolarHBondContact O-N 3.14Å; G38-T41 WeakPolarHBondContact O-CA 3.29Å; G38-T41 VanDerWaalsContact O-CB 3.28Å; G38-T41 WeakPolarHBondContact O-CB 3.43Å; G38-T41 PolarHBondContact O-N 2.98Å; G38-T41 VanDerWaalsContact O-N 3.08Å; G38-V42 PolarHBondContact O-N 3.46Å; G38-N193 WeakPolarHBondContact CA-ND2 3.49Å
39	K	94.1	Very high	91.5	Very high	8 Å²	8	23.1 Å²	23.1	4%	0.035	17%	0.168	C	C	.	.	H	α-helix	trans	-44.3	-53.1	172.1	179.5	-169.3	40.5	74.1	0	113	V30 S32 V37 T41 V42 A43 D65 D138 M139	V30-K39 HydrophobicContact CG1-CG 4.03Å; S32-K39 WeakPolarHBondContact OG-CD 3.4Å; V37-K39 HydrophobicContact CG2-CB 4.38Å; K39-T41 VanDerWaalsContact C-N 3.31Å; K39-T41 PolarHBondContact O-N 3.22Å; K39-V42 WeakPolarHBondContact O-CB 3.32Å; K39-V42 PolarHBondContact O-N 3.19Å; K39-V42 VanDerWaalsContact O-N 3.1Å; K39-A43 PolarHBondContact O-N 2.76Å; K39-D65 IonicContact NZ-OD2 2.79Å; K39-D65 PolarHBondContact NZ-OD2 3.42Å; K39-D138 WeakPolarHBondContact CD-OD1 3.39Å; K39-D138 VanDerWaalsContact CG-OD1 3.29Å; K39-D138 WeakPolarHBondContact CG-OD1 3.46Å; K39-D138 VanDerWaalsContact NZ-CG 3.33Å; K39-D138 IonicContact NZ-OD1 2.96Å; K39-D138 PolarHBondContact NZ-OD1 3.05Å; K39-D138 IonicContact NZ-OD2 3.32Å; K39-D138 PolarHBondContact NZ-OD2 2.7Å; K39-M139 WeakPolarHBondContact CD-O 3.37Å; K39-M139 WeakPolarHBondContact CE-O 3.12Å; K39-M139 PolarHBondContact NZ-O 3.43Å
40	S	92.7	Very high	91.2	Very high	12 Å²	12	25.2 Å²	25.2	8%	0.084	18%	0.179	C	C	.	.	H	α-helix	trans	-64.3	-35	-179.1	-50.2	0	0	0	0	112.5	G38 A43 V44 S70 D138	G38-S40 VanDerWaalsContact C-N 3.33Å; G38-S40 PolarHBondContact O-N 3.14Å; S40-A43 PolarHBondContact O-N 3.47Å; S40-V44 WeakPolarHBondContact O-CB 3.33Å; S40-V44 WeakPolarHBondContact O-CG2 3.46Å; S40-V44 PolarHBondContact O-N 3.12Å; S40-S70 WeakPolarHBondContact CB-OG 3.32Å; S40-S70 PolarHBondContact OG-OG 3.13Å; S40-D138 WeakPolarHBondContact CA-OD2 3.45Å; S40-D138 WeakPolarHBondContact CB-OD2 2.86Å; S40-D138 PolarHBondContact OG-OD2 3.19Å
41	T	92.2	Very high	90.9	Very high	47 Å²	47	26.5 Å²	26.5	29%	0.288	19%	0.185	S	C	.	.	H	α-helix	trans	-61.4	-45.1	172	-51.8	0	0	0	0	111.6	G38 K39 N45 M74	G38-T41 WeakPolarHBondContact O-CA 3.29Å; G38-T41 VanDerWaalsContact O-CB 3.28Å; G38-T41 WeakPolarHBondContact O-CB 3.43Å; G38-T41 PolarHBondContact O-N 2.98Å; G38-T41 VanDerWaalsContact O-N 3.08Å; K39-T41 VanDerWaalsContact C-N 3.31Å; K39-T41 PolarHBondContact O-N 3.22Å; T41-N45 WeakPolarHBondContact O-CB 3.38Å; T41-N45 PolarHBondContact O-N 3.26Å; T41-N45 PolarHBondContact O-ND2 3Å; T41-M74 VanDerWaalsContact CA-CE 3.43Å; T41-M74 HydrophobicContact CG2-CE 3.99Å
42	V	93.7	Very high	90.6	Very high	15 Å²	15	30.4 Å²	30.4	9%	0.091	20%	0.199	C	C	.	.	H	α-helix	trans	-64.4	-42.6	175.6	175.9	0	0	0	0	110.5	V30 G38 K39 V44 N45 L46 V162 V191 N193	V30-V42 HydrophobicContact CG1-CG1 4.37Å; G38-V42 PolarHBondContact O-N 3.46Å; K39-V42 WeakPolarHBondContact O-CB 3.32Å; K39-V42 PolarHBondContact O-N 3.19Å; K39-V42 VanDerWaalsContact O-N 3.1Å; V42-V44 PolarHBondContact O-N 3.19Å; V42-N45 PolarHBondContact O-N 3.2Å; V42-L46 WeakPolarHBondContact O-CB 3.34Å; V42-L46 PolarHBondContact O-N 3.32Å; V42-V162 HydrophobicContact CB-CG1 4.45Å; V42-V162 HydrophobicContact CB-CG2 3.88Å; V42-V162 HydrophobicContact CG1-CG2 3.84Å; V42-V162 HydrophobicContact CG2-CG1 3.82Å; V42-V162 HydrophobicContact CG2-CG2 4.11Å; V42-V191 HydrophobicContact CG1-CB 4.21Å; V42-V191 HydrophobicContact CG1-CG1 4.03Å; V42-V191 HydrophobicContact CG1-CG2 4.09Å; V42-V191 HydrophobicContact CG2-CG1 3.89Å; V42-N193 HydrophobicContact CG2-CB 4.45Å
43	A	94.5	Very high	90.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-60.7	-46.5	178.6	0	0	0	0	0	112.8	V30 K39 S40 L46 A47 L61 V136 D138	V30-A43 HydrophobicContact CB-CB 3.97Å; V30-A43 HydrophobicContact CG1-CB 4.04Å; V30-A43 HydrophobicContact CG2-CB 3.98Å; K39-A43 PolarHBondContact O-N 2.76Å; S40-A43 PolarHBondContact O-N 3.47Å; A43-L46 PolarHBondContact O-N 2.97Å; A43-A47 WeakPolarHBondContact O-CB 3.44Å; A43-A47 PolarHBondContact O-N 2.89Å; A43-L61 HydrophobicContact CB-CD1 4.22Å; A43-V136 HydrophobicContact CB-CG1 4.37Å; A43-D138 HydrophobicContact CB-CB 3.86Å
44	V	92.5	Very high	90.7	Very high	11 Å²	11	39 Å²	39	7%	0.067	24%	0.241	C	C	.	.	H	α-helix	trans	-61.2	-48.3	176.7	166.6	0	0	0	0	111.4	S40 V42 T48 L61 I71 M74 M75	S40-V44 WeakPolarHBondContact O-CB 3.33Å; S40-V44 WeakPolarHBondContact O-CG2 3.46Å; S40-V44 PolarHBondContact O-N 3.12Å; V42-V44 PolarHBondContact O-N 3.19Å; V44-T48 WeakPolarHBondContact O-CB 3.41Å; V44-T48 PolarHBondContact O-N 3.2Å; V44-T48 PolarHBondContact O-OG1 3.08Å; V44-L61 HydrophobicContact CB-CD2 4.48Å; V44-L61 HydrophobicContact CG2-CD2 3.85Å; V44-I71 HydrophobicContact CG2-CD1 4.34Å; V44-I71 HydrophobicContact CG2-CG1 3.96Å; V44-I71 HydrophobicContact CG2-CG2 4.27Å; V44-M74 HydrophobicContact CB-CE 4.29Å; V44-M74 HydrophobicContact CG2-CB 4.35Å; V44-M74 HydrophobicContact CG2-CE 4.26Å; V44-M74 HydrophobicContact CG2-SD 4.28Å; V44-M75 HydrophobicContact CG1-CG 4.27Å; V44-M75 HydrophobicContact CG1-SD 3.46Å; V44-M75 WeakPolarHBondContact CG1-SD 3.39Å; V44-M75 HydrophobicContact CG2-CG 4.26Å; V44-M75 HydrophobicContact CG2-SD 4.46Å
45	N	92.4	Very high	90.8	Very high	71 Å²	71	41.2 Å²	41.2	38%	0.38	26%	0.261	S	S	.	.	H	α-helix	trans	-66.7	-41	-179.7	-79.5	-70.3	0	0	0	111.7	T41 V42 T48 A49	T41-N45 WeakPolarHBondContact O-CB 3.38Å; T41-N45 PolarHBondContact O-N 3.26Å; T41-N45 PolarHBondContact O-ND2 3Å; V42-N45 PolarHBondContact O-N 3.2Å; N45-T48 PolarHBondContact O-N 2.96Å; N45-A49 WeakPolarHBondContact O-CB 3.28Å; N45-A49 PolarHBondContact O-N 3.22Å
46	L	92.8	Very high	91	Very high	45 Å²	45	46.8 Å²	46.8	24%	0.236	28%	0.278	C	S	.	.	H	α-helix	trans	-59.7	-52.4	176.2	179.9	63	0	0	0	110.9	V30 V42 A43 T48 A49 L50 V136 V160	V30-L46 HydrophobicContact CG2-CD2 3.99Å; V42-L46 WeakPolarHBondContact O-CB 3.34Å; V42-L46 PolarHBondContact O-N 3.32Å; A43-L46 PolarHBondContact O-N 2.97Å; L46-T48 PolarHBondContact O-N 2.83Å; L46-A49 PolarHBondContact O-N 3.43Å; L46-L50 HydrophobicContact CD1-CD1 3.79Å; L46-L50 HydrophobicContact CD1-CG 4.1Å; L46-L50 HydrophobicContact CG-CD1 3.87Å; L46-L50 WeakPolarHBondContact O-CB 3.35Å; L46-L50 WeakPolarHBondContact O-CG 3.46Å; L46-L50 PolarHBondContact O-N 3.4Å; L46-V136 HydrophobicContact CD2-CG1 4.38Å; L46-V160 HydrophobicContact CD2-CG2 4.32Å
47	A	92.6	Very high	91.2	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-60.6	-44.7	179.7	0	0	0	0	0	112	A43 Q51 V59 L61 V136	A43-A47 WeakPolarHBondContact O-CB 3.44Å; A43-A47 PolarHBondContact O-N 2.89Å; A47-Q51 WeakPolarHBondContact O-CB 3.44Å; A47-Q51 PolarHBondContact O-N 3.14Å; A47-Q51 VanDerWaalsContact O-N 3.07Å; A47-V59 HydrophobicContact CB-CG1 4.16Å; A47-L61 HydrophobicContact CB-CB 4.14Å; A47-L61 HydrophobicContact CB-CD1 4.12Å; A47-L61 HydrophobicContact CB-CD2 4.39Å; A47-L61 HydrophobicContact CB-CG 4.45Å; A47-V136 HydrophobicContact CB-CB 4.16Å; A47-V136 HydrophobicContact CB-CG2 4.02Å
48	T	90.8	Very high	91.3	Very high	12 Å²	12	45.5 Å²	45.5	7%	0.074	26%	0.258	C	S	.	.	H	α-helix	trans	-68.7	-41.8	-179.5	-54.4	0	0	0	0	112	V44 N45 L46 Q51 R52 F93	V44-T48 WeakPolarHBondContact O-CB 3.41Å; V44-T48 PolarHBondContact O-N 3.2Å; V44-T48 PolarHBondContact O-OG1 3.08Å; N45-T48 PolarHBondContact O-N 2.96Å; L46-T48 PolarHBondContact O-N 2.83Å; T48-Q51 PolarHBondContact O-N 3.5Å; T48-R52 WeakPolarHBondContact O-CG 3.41Å; T48-R52 PolarHBondContact O-N 3.38Å; T48-F93 HydrophobicContact CG2-CD2 4.01Å
49	A	91.6	Very high	91.4	Very high	48 Å²	48	44.8 Å²	44.8	40%	0.397	25%	0.25	S	S	.	.	H	α-helix	trans	-64.1	-46.4	176.9	0	0	0	0	0	111.1	N45 L46 Q51 R52 I53	N45-A49 WeakPolarHBondContact O-CB 3.28Å; N45-A49 PolarHBondContact O-N 3.22Å; L46-A49 PolarHBondContact O-N 3.43Å; A49-Q51 VanDerWaalsContact C-N 3.31Å; A49-Q51 PolarHBondContact O-N 3.29Å; A49-R52 PolarHBondContact O-N 2.94Å; A49-R52 VanDerWaalsContact O-N 3.11Å; A49-I53 WeakPolarHBondContact O-CG1 3.3Å; A49-I53 WeakPolarHBondContact O-CG2 3.45Å; A49-I53 PolarHBondContact O-N 3.44Å
50	L	91.9	Very high	91.3	Very high	44 Å²	44	44.4 Å²	44.4	23%	0.23	25%	0.249	C	C	.	.	H	α-helix	trans	-59.4	-41.7	177.6	-72.6	172.6	0	0	0	112.4	L46 R52 I53 N54 V59 L134	L46-L50 HydrophobicContact CD1-CD1 3.79Å; L46-L50 HydrophobicContact CD1-CG 4.1Å; L46-L50 HydrophobicContact CG-CD1 3.87Å; L46-L50 WeakPolarHBondContact O-CB 3.35Å; L46-L50 WeakPolarHBondContact O-CG 3.46Å; L46-L50 PolarHBondContact O-N 3.4Å; L50-R52 VanDerWaalsContact C-N 3.32Å; L50-R52 PolarHBondContact O-N 2.97Å; L50-I53 HydrophobicContact CD2-CD1 4.12Å; L50-N54 PolarHBondContact O-N 3.28Å; L50-N54 VanDerWaalsContact O-N 3.11Å; L50-V59 HydrophobicContact CB-CG2 4.26Å; L50-L134 HydrophobicContact CD1-CD2 3.47Å; L50-L134 VanDerWaalsContact CD1-CD2 3.47Å
51	Q	89.7	Confident	91.4	Very high	27 Å²	27	43.8 Å²	43.8	13%	0.126	25%	0.245	C	C	.	.	H	α-helix	trans	-65.6	-35.1	176.4	-176.1	58.9	75.7	0	0	112.7	A47 T48 A49 N54 S57 V59 F93 C94	A47-Q51 WeakPolarHBondContact O-CB 3.44Å; A47-Q51 PolarHBondContact O-N 3.14Å; A47-Q51 VanDerWaalsContact O-N 3.07Å; T48-Q51 PolarHBondContact O-N 3.5Å; A49-Q51 VanDerWaalsContact C-N 3.31Å; A49-Q51 PolarHBondContact O-N 3.29Å; Q51-N54 CarbonylContact O-C 3.58Å; Q51-S57 PolarHBondContact NE2-O 2.9Å; Q51-S57 PolarHBondContact OE1-O 2.93Å; Q51-V59 HydrophobicContact CB-CB 4.18Å; Q51-V59 HydrophobicContact CB-CG2 4.16Å; Q51-F93 HydrophobicContact CG-CB 4.33Å; Q51-F93 VanDerWaalsContact CG-O 3.23Å; Q51-F93 WeakPolarHBondContact CG-O 3.43Å; Q51-C94 HydrophobicContact CB-CB 4.45Å; Q51-C94 HydrophobicContact CG-CB 4.37Å
52	R	89.9	Confident	91.4	Very high	83 Å²	83	41.6 Å²	41.6	31%	0.313	23%	0.231	S	C	.	.	H	α-helix	trans	-74.7	-44.9	178.5	-79.6	179.1	170	153.5	-2.1	113.6	T48 A49 L50 N54 P55 V240	T48-R52 WeakPolarHBondContact O-CG 3.41Å; T48-R52 PolarHBondContact O-N 3.38Å; A49-R52 PolarHBondContact O-N 2.94Å; A49-R52 VanDerWaalsContact O-N 3.11Å; L50-R52 VanDerWaalsContact C-N 3.32Å; L50-R52 PolarHBondContact O-N 2.97Å; R52-N54 VanDerWaalsContact C-N 3.26Å; R52-N54 PolarHBondContact O-N 2.91Å; R52-P55 WeakPolarHBondContact O-CD 3.22Å; R52-P55 WeakPolarHBondContact O-CG 3.19Å; R52-V240 VanDerWaalsContact NH1-CB 3.3Å; R52-V240 VanDerWaalsContact NH2-C 3.3Å; R52-V240 PolarHBondContact NH2-O 3.13Å
53	I	91.6	Very high	91.3	Very high	116 Å²	116	40.9 Å²	40.9	60%	0.595	23%	0.227	S	C	*	.	H	α-helix	trans	-72.4	-24.6	-179.1	68.7	179.8	0	0	0	111.6	A49 L50	A49-I53 WeakPolarHBondContact O-CG1 3.3Å; A49-I53 WeakPolarHBondContact O-CG2 3.45Å; A49-I53 PolarHBondContact O-N 3.44Å; L50-I53 HydrophobicContact CD2-CD1 4.12Å
54	N	90.2	Very high	91.1	Very high	85 Å²	85	41 Å²	41	46%	0.455	23%	0.228	S	C	.	.			trans	-125.7	75.5	175.9	-62.6	-56	0	0	0	111.2	L50 Q51 R52 N56 S57	L50-N54 PolarHBondContact O-N 3.28Å; L50-N54 VanDerWaalsContact O-N 3.11Å; Q51-N54 CarbonylContact O-C 3.58Å; R52-N54 VanDerWaalsContact C-N 3.26Å; R52-N54 PolarHBondContact O-N 2.91Å; N54-N56 PolarHBondContact O-N 2.91Å; N54-N56 VanDerWaalsContact O-N 3.07Å; N54-S57 WeakPolarHBondContact O-CB 3.35Å; N54-S57 PolarHBondContact O-N 3.45Å
55	P	85.8	Confident	90.9	Very high	97 Å²	97	41.1 Å²	41.1	63%	0.63	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-25.6	-176.9	-25.8	35.4	0	0	0	114.6	R52 S57	R52-P55 WeakPolarHBondContact O-CD 3.22Å; R52-P55 WeakPolarHBondContact O-CG 3.19Å; P55-S57 VanDerWaalsContact C-N 3.32Å
56	N	88.1	Confident	90.3	Very high	167 Å²	167	37.8 Å²	37.8	89%	0.893	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-9.1	177.6	-62.5	-32.5	0	0	0	113.3	N54	N54-N56 PolarHBondContact O-N 2.91Å; N54-N56 VanDerWaalsContact O-N 3.07Å
57	S	88.8	Confident	89.6	Confident	24 Å²	24	41.2 Å²	41.2	17%	0.168	22%	0.223	C	C	.	.	S	Bend	trans	-89.8	137.5	174.7	-173.1	0	0	0	0	109.3	Q51 N54 P55 D133	Q51-S57 PolarHBondContact NE2-O 2.9Å; Q51-S57 PolarHBondContact OE1-O 2.93Å; N54-S57 WeakPolarHBondContact O-CB 3.35Å; N54-S57 PolarHBondContact O-N 3.45Å; P55-S57 VanDerWaalsContact C-N 3.32Å; S57-D133 WeakPolarHBondContact CA-OD2 3.48Å; S57-D133 WeakPolarHBondContact OG-CB 3.16Å
58	S	91	Very high	89	Confident	27 Å²	27	43 Å²	43	19%	0.189	24%	0.242	C	C	.	.			trans	-92.6	110.3	175.5	49.5	0	0	0	0	110.1	P131 L132 D133 L134	S58-P131 PolarHBondContact OG-O 3.22Å; S58-L132 VanDerWaalsContact OG-CA 3.22Å; S58-L132 WeakPolarHBondContact OG-CA 3.46Å; S58-D133 PolarHBondContact N-OD2 3.19Å; S58-D133 PolarHBondContact O-N 2.76Å; S58-D133 PolarHBondContact OG-N 2.82Å; S58-D133 PolarHBondContact OG-OD2 3.01Å; S58-L134 PolarHBondContact O-N 2.83Å
59	V	92.8	Very high	88.4	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.006	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	135.3	-179.5	-175.1	0	0	0	0	110.3	A47 L50 Q51 C94 H95 L134 V136	A47-V59 HydrophobicContact CB-CG1 4.16Å; L50-V59 HydrophobicContact CB-CG2 4.26Å; Q51-V59 HydrophobicContact CB-CB 4.18Å; Q51-V59 HydrophobicContact CB-CG2 4.16Å; V59-C94 HydrophobicContact CB-CB 4.35Å; V59-C94 VanDerWaalsContact O-CB 3.28Å; V59-C94 WeakPolarHBondContact O-CB 3.37Å; V59-H95 PolarHBondContact O-N 3.26Å; V59-L134 CarbonylContact C-O 3.57Å; V59-L134 WeakPolarHBondContact CA-O 3.32Å; V59-V136 HydrophobicContact CG1-CG2 4.38Å
60	G	92.6	Very high	88	Confident	0 Å²	0	43 Å²	43	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	154.6	169.5	0	0	0	0	0	112.4	H95 L134 V136	G60-H95 CarbonylContact C-O 3.58Å; G60-H95 WeakPolarHBondContact CA-O 3.45Å; G60-L134 PolarHBondContact N-O 3.36Å; G60-V136 PolarHBondContact O-N 3.47Å
61	L	93.1	Very high	87.8	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	120.6	172.4	-179.6	61.1	0	0	0	110.1	A43 V44 A47 I71 H95 H96 M97 V136	A43-L61 HydrophobicContact CB-CD1 4.22Å; V44-L61 HydrophobicContact CB-CD2 4.48Å; V44-L61 HydrophobicContact CG2-CD2 3.85Å; A47-L61 HydrophobicContact CB-CB 4.14Å; A47-L61 HydrophobicContact CB-CD1 4.12Å; A47-L61 HydrophobicContact CB-CD2 4.39Å; A47-L61 HydrophobicContact CB-CG 4.45Å; L61-I71 HydrophobicContact CD1-CD1 3.97Å; L61-I71 HydrophobicContact CD2-CD1 4.01Å; L61-I71 HydrophobicContact CD2-CG2 3.78Å; L61-I71 HydrophobicContact CG-CD1 3.97Å; L61-I71 HydrophobicContact CG-CG2 4.35Å; L61-H95 PolarHBondContact N-O 3.4Å; L61-H96 CarbonylContact O-C 3.4Å; L61-H96 VanDerWaalsContact O-CA 3.26Å; L61-H96 WeakPolarHBondContact O-CA 3.28Å; L61-M97 PolarHBondContact O-N 2.9Å; L61-V136 CarbonylContact C-O 3.59Å; L61-V136 WeakPolarHBondContact CA-O 2.96Å; L61-V136 HydrophobicContact CD1-CB 4.11Å; L61-V136 HydrophobicContact CD1-CG1 4Å
62	L	92.6	Very high	87.4	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	119.5	175.2	172.6	51.5	0	0	0	110.1	A64 M97 L123 L124 W129 L135 V136 V137 D138	L62-A64 HydrophobicContact CG-CB 4.47Å; L62-A64 PolarHBondContact O-N 3.11Å; L62-M97 WeakPolarHBondContact CA-O 3.29Å; L62-L123 HydrophobicContact CD1-CB 4.05Å; L62-L123 HydrophobicContact CD1-CD1 3.73Å; L62-L123 HydrophobicContact CD1-CG 4.42Å; L62-L124 HydrophobicContact CD2-CD2 3.56Å; L62-L124 HydrophobicContact CD2-CG 4.46Å; L62-W129 HydrophobicContact CB-CH2 3.54Å; L62-W129 HydrophobicContact CB-CZ2 3.79Å; L62-W129 HydrophobicContact CD1-CH2 4.05Å; L62-W129 HydrophobicContact CD1-CZ2 3.79Å; L62-W129 HydrophobicContact CD2-CZ2 3.98Å; L62-W129 HydrophobicContact CG-CH2 4.24Å; L62-W129 HydrophobicContact CG-CZ2 4.05Å; L62-L135 HydrophobicContact CB-CD1 4.07Å; L62-L135 HydrophobicContact CB-CG 4.47Å; L62-L135 HydrophobicContact CD2-CD2 4.48Å; L62-V136 PolarHBondContact N-O 3.07Å; L62-V137 HydrophobicContact CB-CG1 4.37Å; L62-V137 HydrophobicContact CB-CG2 4.24Å; L62-V137 HydrophobicContact CD2-CG1 4.07Å; L62-V137 HydrophobicContact CD2-CG2 4.21Å; L62-V137 HydrophobicContact CG-CG1 4.13Å; L62-V137 CarbonylContact O-C 3.58Å; L62-V137 WeakPolarHBondContact O-CA 3.34Å; L62-D138 PolarHBondContact O-N 3.4Å
63	D	91.2	Very high	87.1	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	102	165.5	-172.5	-3.5	0	0	0	110.2	D65 P69 I71 M97 S98 M99	D63-D65 WeakPolarHBondContact OD1-CB 3.48Å; D63-D65 PolarHBondContact OD1-N 3.13Å; D63-P69 VanDerWaalsContact OD2-CA 3.27Å; D63-P69 WeakPolarHBondContact OD2-CA 3.34Å; D63-P69 VanDerWaalsContact OD2-CB 3.26Å; D63-P69 WeakPolarHBondContact OD2-CB 3.45Å; D63-I71 HydrophobicContact CB-CB 3.89Å; D63-I71 HydrophobicContact CB-CD1 3.68Å; D63-I71 HydrophobicContact CB-CG1 4.02Å; D63-M97 PolarHBondContact N-O 3.18Å; D63-S98 VanDerWaalsContact CB-OG 3.3Å; D63-S98 WeakPolarHBondContact CB-OG 3.39Å; D63-S98 PolarHBondContact OD2-OG 3.25Å; D63-M99 PolarHBondContact O-N 3.28Å
64	A	90.9	Very high	86.7	Confident	2 Å²	2	43 Å²	43	2%	0.017	23%	0.231	C	C	.	.			trans	-97.1	5.1	174.5	0	0	0	0	0	112.3	L62 V66 V137 D138 P140 I150	L62-A64 HydrophobicContact CG-CB 4.47Å; L62-A64 PolarHBondContact O-N 3.11Å; A64-V66 VanDerWaalsContact C-N 3.32Å; A64-V66 WeakPolarHBondContact O-CG2 3.46Å; A64-V66 PolarHBondContact O-N 3.49Å; A64-V137 HydrophobicContact CB-CG1 3.96Å; A64-D138 CarbonylContact C-O 3.55Å; A64-D138 WeakPolarHBondContact CA-O 3.44Å; A64-D138 WeakPolarHBondContact CB-O 3.4Å; A64-D138 PolarHBondContact N-O 2.97Å; A64-P140 WeakPolarHBondContact O-CD 3.4Å; A64-P140 WeakPolarHBondContact O-CG 3.29Å; A64-I150 HydrophobicContact CB-CD1 4.1Å
65	D	88.5	Confident	86.3	Confident	14 Å²	14	40.3 Å²	40.3	8%	0.075	22%	0.216	C	C	.	.			trans	-79.9	80.3	177.8	-162.1	-16	0	0	0	110.6	K39 D63 F67 G68 P69 D138 P141	K39-D65 IonicContact NZ-OD2 2.79Å; K39-D65 PolarHBondContact NZ-OD2 3.42Å; D63-D65 WeakPolarHBondContact OD1-CB 3.48Å; D63-D65 PolarHBondContact OD1-N 3.13Å; D65-F67 PolarHBondContact O-N 2.9Å; D65-G68 CarbonylContact O-C 3.57Å; D65-G68 PolarHBondContact O-N 2.82Å; D65-P69 WeakPolarHBondContact O-CA 3.09Å; D65-P69 WeakPolarHBondContact O-CD 3.35Å; D65-D138 PolarHBondContact N-O 3.38Å; D65-P141 WeakPolarHBondContact OD1-CD 3.45Å; D65-P141 WeakPolarHBondContact OD2-CD 3.36Å
66	V	80.8	Confident	86.1	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-29.3	-173	-174.8	0	0	0	0	112.4	A64 M99 I109 W111 V116 I120	A64-V66 VanDerWaalsContact C-N 3.32Å; A64-V66 WeakPolarHBondContact O-CG2 3.46Å; A64-V66 PolarHBondContact O-N 3.49Å; V66-M99 HydrophobicContact CB-CG 4.45Å; V66-M99 HydrophobicContact CG1-CE 3.82Å; V66-M99 HydrophobicContact CG2-CE 4.22Å; V66-M99 HydrophobicContact CG2-CG 3.78Å; V66-M99 HydrophobicContact CG2-SD 4.34Å; V66-I109 HydrophobicContact CG1-CG2 4.22Å; V66-I109 WeakPolarHBondContact O-CD1 3.36Å; V66-W111 HydrophobicContact CG1-CE3 4.12Å; V66-W111 HydrophobicContact CG1-CZ3 4.41Å; V66-V116 HydrophobicContact CB-CG1 3.99Å; V66-V116 HydrophobicContact CG1-CG1 4.27Å; V66-V116 HydrophobicContact CG1-CG2 4.19Å; V66-V116 HydrophobicContact CG2-CG1 3.65Å; V66-I120 HydrophobicContact CG2-CD1 4.03Å; V66-I120 HydrophobicContact CG2-CG1 3.96Å
67	F	77.9	Confident	85.5	Confident	118 Å²	118	34.7 Å²	34.7	52%	0.518	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-16.6	-172.9	-61.8	-72.1	0	0	0	113.7	D65 V116	D65-F67 PolarHBondContact O-N 2.9Å; F67-V116 HydrophobicContact CE1-CG2 4.23Å; F67-V116 HydrophobicContact CE2-CG1 4.49Å; F67-V116 HydrophobicContact CZ-CG2 3.86Å
68	G	79.5	Confident	84.5	Confident	38 Å²	38	37.5 Å²	37.5	39%	0.392	20%	0.2	S	C	.	.	S	Bend	trans	-153.8	59.6	-179.5	0	0	0	0	0	111.9	D65 S70	D65-G68 CarbonylContact O-C 3.57Å; D65-G68 PolarHBondContact O-N 2.82Å; G68-S70 PolarHBondContact O-N 2.9Å
69	P	78.5	Confident	83.2	Confident	21 Å²	21	38.9 Å²	38.9	14%	0.136	22%	0.219	C	C	.	.			trans	-65.6	103.2	-175.1	27.7	-34.5	0	0	0	110	D63 D65 G100 I109	D63-P69 VanDerWaalsContact OD2-CA 3.27Å; D63-P69 WeakPolarHBondContact OD2-CA 3.34Å; D63-P69 VanDerWaalsContact OD2-CB 3.26Å; D63-P69 WeakPolarHBondContact OD2-CB 3.45Å; D65-P69 WeakPolarHBondContact O-CA 3.09Å; D65-P69 WeakPolarHBondContact O-CD 3.35Å; P69-G100 VanDerWaalsContact CG-CA 3.47Å; P69-I109 HydrophobicContact CG-CD1 4.49Å
70	S	83.3	Confident	81.5	Confident	39 Å²	39	46.7 Å²	46.7	27%	0.273	26%	0.255	S	S	.	.			trans	-98.5	-20	-176.9	70.9	0	0	0	0	112.8	S40 G68 R73 M74	S40-S70 WeakPolarHBondContact CB-OG 3.32Å; S40-S70 PolarHBondContact OG-OG 3.13Å; G68-S70 PolarHBondContact O-N 2.9Å; S70-R73 PolarHBondContact O-N 2.83Å; S70-R73 VanDerWaalsContact O-N 3.17Å; S70-M74 VanDerWaalsContact O-CG 3.31Å; S70-M74 WeakPolarHBondContact O-CG 3.44Å; S70-M74 PolarHBondContact O-N 2.88Å
71	I	86.3	Confident	80	Confident	1 Å²	1	47 Å²	47	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-58.3	-43.7	-173.5	-68.1	-173.9	0	0	0	112.5	V44 L61 D63 R73 M74 M75 D138	V44-I71 HydrophobicContact CG2-CD1 4.34Å; V44-I71 HydrophobicContact CG2-CG1 3.96Å; V44-I71 HydrophobicContact CG2-CG2 4.27Å; L61-I71 HydrophobicContact CD1-CD1 3.97Å; L61-I71 HydrophobicContact CD2-CD1 4.01Å; L61-I71 HydrophobicContact CD2-CG2 3.78Å; L61-I71 HydrophobicContact CG-CD1 3.97Å; L61-I71 HydrophobicContact CG-CG2 4.35Å; D63-I71 HydrophobicContact CB-CB 3.89Å; D63-I71 HydrophobicContact CB-CD1 3.68Å; D63-I71 HydrophobicContact CB-CG1 4.02Å; I71-R73 VanDerWaalsContact C-N 3.3Å; I71-R73 PolarHBondContact O-N 3.34Å; I71-M74 PolarHBondContact O-N 3.47Å; I71-M75 HydrophobicContact CG2-CG 4.12Å; I71-M75 WeakPolarHBondContact O-CB 3.47Å; I71-M75 WeakPolarHBondContact O-CG 3.17Å; I71-M75 PolarHBondContact O-N 2.9Å; I71-D138 HydrophobicContact CD1-CB 3.55Å
72	P	81.8	Confident	78	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-54.4	-46.8	176.7	-30.4	38.5	0	0	0	112.9	M75 N76 L77 S98 L101	P72-M75 PolarHBondContact O-N 3.08Å; P72-N76 PolarHBondContact O-N 3.36Å; P72-N76 VanDerWaalsContact O-N 3.09Å; P72-L77 HydrophobicContact CB-CB 4.3Å; P72-L77 PolarHBondContact O-N 3.12Å; P72-S98 VanDerWaalsContact CD-OG 3.26Å; P72-S98 WeakPolarHBondContact CD-OG 3.36Å; P72-S98 WeakPolarHBondContact CG-OG 3.31Å; P72-L101 HydrophobicContact CB-CD2 3.97Å; P72-L101 HydrophobicContact CG-CD2 4.01Å; P72-L101 HydrophobicContact CG-CG 4.16Å
73	R	82.9	Confident	76.2	Confident	199 Å²	199	55.4 Å²	55.4	75%	0.751	30%	0.3	S	S	*	.	H	α-helix	trans	-65.9	-43.1	178.1	-177.2	176.3	173.5	-177.2	-1.5	112	S70 I71 M75 N76	S70-R73 PolarHBondContact O-N 2.83Å; S70-R73 VanDerWaalsContact O-N 3.17Å; I71-R73 VanDerWaalsContact C-N 3.3Å; I71-R73 PolarHBondContact O-N 3.34Å; R73-M75 VanDerWaalsContact C-N 3.26Å; R73-M75 PolarHBondContact O-N 3.41Å; R73-N76 PolarHBondContact O-N 3.45Å
74	M	83.8	Confident	74.2	Confident	70 Å²	70	61.3 Å²	61.3	35%	0.345	33%	0.332	S	S	.	.	H	α-helix	trans	-63.7	-32.1	179.6	-69.1	-173.9	68.4	0	0	113.2	T41 V44 S70 I71	T41-M74 VanDerWaalsContact CA-CE 3.43Å; T41-M74 HydrophobicContact CG2-CE 3.99Å; V44-M74 HydrophobicContact CB-CE 4.29Å; V44-M74 HydrophobicContact CG2-CB 4.35Å; V44-M74 HydrophobicContact CG2-CE 4.26Å; V44-M74 HydrophobicContact CG2-SD 4.28Å; S70-M74 VanDerWaalsContact O-CG 3.31Å; S70-M74 WeakPolarHBondContact O-CG 3.44Å; S70-M74 PolarHBondContact O-N 2.88Å; I71-M74 PolarHBondContact O-N 3.47Å
75	M	82.7	Confident	72.5	Confident	28 Å²	28	65.4 Å²	65.4	14%	0.138	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	7.5	-178.7	-66.4	-66.5	-73.4	0	0	112.7	V44 I71 P72 R73 L77	V44-M75 HydrophobicContact CG1-CG 4.27Å; V44-M75 HydrophobicContact CG1-SD 3.46Å; V44-M75 WeakPolarHBondContact CG1-SD 3.39Å; V44-M75 HydrophobicContact CG2-CG 4.26Å; V44-M75 HydrophobicContact CG2-SD 4.46Å; I71-M75 HydrophobicContact CG2-CG 4.12Å; I71-M75 WeakPolarHBondContact O-CB 3.47Å; I71-M75 WeakPolarHBondContact O-CG 3.17Å; I71-M75 PolarHBondContact O-N 2.9Å; P72-M75 PolarHBondContact O-N 3.08Å; R73-M75 VanDerWaalsContact C-N 3.26Å; R73-M75 PolarHBondContact O-N 3.41Å; M75-L77 HydrophobicContact CB-CD1 3.59Å; M75-L77 HydrophobicContact CB-CD2 4.14Å; M75-L77 HydrophobicContact CB-CG 3.52Å; M75-L77 HydrophobicContact CG-CD1 4.4Å; M75-L77 PolarHBondContact O-N 3.25Å
76	N	80.4	Confident	71	Confident	134 Å²	134	70.8 Å²	70.8	72%	0.717	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	42	-175.4	-165.3	30.6	0	0	0	113.5	P72 R73	P72-N76 PolarHBondContact O-N 3.36Å; P72-N76 VanDerWaalsContact O-N 3.09Å; R73-N76 PolarHBondContact O-N 3.45Å
77	L	75.6	Confident	69.8	Low	12 Å²	12	70.9 Å²	70.9	6%	0.063	37%	0.371	C	S	.	.			trans	-90.4	138.4	-178.3	-55.2	172.2	0	0	0	110.3	P72 M75 K91 H96	P72-L77 HydrophobicContact CB-CB 4.3Å; P72-L77 PolarHBondContact O-N 3.12Å; M75-L77 HydrophobicContact CB-CD1 3.59Å; M75-L77 HydrophobicContact CB-CD2 4.14Å; M75-L77 HydrophobicContact CB-CG 3.52Å; M75-L77 HydrophobicContact CG-CD1 4.4Å; M75-L77 PolarHBondContact O-N 3.25Å; L77-K91 HydrophobicContact CD2-CB 4.39Å; L77-H96 HydrophobicContact CD1-CB 4.39Å; L77-H96 WeakPolarHBondContact CD1-CD2 3.38Å; L77-H96 WeakPolarHBondContact CD1-NE2 3.39Å; L77-H96 WeakPolarHBondContact CD2-CE1 3.24Å; L77-H96 WeakPolarHBondContact CD2-NE2 3.49Å
78	S	68	Low	68.9	Low	82 Å²	82	67.2 Å²	67.2	57%	0.573	36%	0.356	S	S	*	.			trans	-142.4	152.2	-178.5	38.3	0	0	0	0	109.7	K91	S78-K91 PolarHBondContact OG-NZ 2.97Å
79	G	64	Low	67.8	Low	56 Å²	56	68.6 Å²	68.6	58%	0.577	36%	0.358	S	S	*	.	S	Bend	trans	96.1	160.1	-178.5	0	0	0	0	0	113.4
80	Q	58.2	Low	66.4	Low	165 Å²	165	76 Å²	76	77%	0.771	39%	0.388	S	S	*	.			trans	-83.2	133.2	171.6	-70.2	-174	-9.5	0	0	109.3	E82	Q80-E82 PolarHBondContact O-N 3.07Å
81	P	59.6	Low	65	Low	8 Å²	8	80.5 Å²	80.5	5%	0.052	40%	0.402	C	S	.	.			trans	-65.5	132.4	171.2	26.8	-35.2	0	0	0	108.1	V83 M97 L101 L102	P81-V83 PolarHBondContact O-N 3.39Å; P81-M97 HydrophobicContact CB-CE 3.67Å; P81-M97 HydrophobicContact CB-SD 3.52Å; P81-M97 VanDerWaalsContact CB-SD 3.52Å; P81-M97 HydrophobicContact CG-CE 4.29Å; P81-M97 HydrophobicContact CG-SD 3.48Å; P81-M97 WeakPolarHBondContact CG-SD 3.23Å; P81-L101 HydrophobicContact CG-CB 3.8Å; P81-L101 HydrophobicContact CG-CD1 4.17Å; P81-L102 HydrophobicContact CG-CD2 4.18Å
82	E	52.5	Low	63.7	Low	120 Å²	120	81.3 Å²	81.3	56%	0.561	41%	0.408	S	S	*	.			trans	-68.7	108.2	163.8	-66.3	-165.7	-169.6	0	0	107.3	Q80 N84 E85	Q80-E82 PolarHBondContact O-N 3.07Å; E82-N84 PolarHBondContact O-N 3.03Å; E82-E85 HydrophobicContact CB-CB 3.92Å; E82-E85 HydrophobicContact CB-CG 3.77Å; E82-E85 PolarHBondContact O-N 2.9Å; E82-E85 WeakPolarHBondContact OE2-CG 3.5Å
83	V	53	Low	62.7	Low	56 Å²	56	85.6 Å²	85.6	34%	0.339	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-20.5	-177.6	-179.4	0	0	0	0	112	P81 L102	P81-V83 PolarHBondContact O-N 3.39Å; V83-L102 HydrophobicContact CG2-CD2 4.02Å
84	N	50.3	Low	61.9	Low	125 Å²	125	76.2 Å²	76.2	67%	0.668	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-12.3	-179.9	-62.7	-26	0	0	0	114.3	E82 R128	E82-N84 PolarHBondContact O-N 3.03Å; N84-R128 PolarHBondContact O-NH1 2.89Å
85	E	54.5	Low	61.3	Low	88 Å²	88	73.8 Å²	73.8	41%	0.411	38%	0.379	S	S	.	.	S	Bend	trans	-92	159.7	173.8	-64.8	-161.5	146.3	0	0	110.8	E82 A87	E82-E85 HydrophobicContact CB-CB 3.92Å; E82-E85 HydrophobicContact CB-CG 3.77Å; E82-E85 PolarHBondContact O-N 2.9Å; E82-E85 WeakPolarHBondContact OE2-CG 3.5Å; E85-A87 PolarHBondContact O-N 3.13Å
86	R	56.7	Low	60.7	Low	126 Å²	126	72.8 Å²	72.8	48%	0.475	37%	0.374	S	S	.	.	B	Isolated β-bridge	trans	-57.3	138.7	178	-170.3	173.8	-179.6	-171.5	-6.9	108.9	N88 H95	R86-N88 PolarHBondContact O-N 3.44Å; R86-N88 VanDerWaalsContact O-N 3.14Å; R86-H95 PolarHBondContact NE-CE1 3.48Å; R86-H95 VanDerWaalsContact NE-CE1 3.27Å; R86-H95 PolarHBondContact NH2-NE2 3.03Å
87	A	57.5	Low	60.4	Low	2 Å²	2	66.6 Å²	66.6	2%	0.017	34%	0.341	C	S	.	.			trans	-43.4	124.5	177.9	0	0	0	0	0	110.5	E85 T89 H95 M97 V127 R128 W129	E85-A87 PolarHBondContact O-N 3.13Å; A87-T89 PolarHBondContact O-N 3.06Å; A87-H95 HydrophobicContact CB-CB 4.36Å; A87-H95 PolarHBondContact O-ND1 2.9Å; A87-M97 HydrophobicContact CB-CE 4.33Å; A87-V127 HydrophobicContact CB-CG1 4.3Å; A87-R128 PolarHBondContact N-O 3.07Å; A87-W129 HydrophobicContact CB-CE3 4.11Å; A87-W129 HydrophobicContact CB-CZ3 4.36Å
88	N	57.2	Low	60.1	Low	41 Å²	41	66 Å²	66	22%	0.219	34%	0.338	C	S	.	.			trans	-56.4	126.4	-164.2	-80	-33.1	0	0	0	111.2	R86 H96	R86-N88 PolarHBondContact O-N 3.44Å; R86-N88 VanDerWaalsContact O-N 3.14Å; N88-H96 PolarHBondContact O-CE1 3.26Å; N88-H96 PolarHBondContact O-N 2.75Å; N88-H96 PolarHBondContact O-ND1 2.95Å
89	T	57.1	Low	60	Low	68 Å²	68	62.1 Å²	62.1	42%	0.417	31%	0.311	S	S	.	.			trans	-110.2	-10.4	170.3	50	0	0	0	0	113.2	A87 K91 S92 H95	A87-T89 PolarHBondContact O-N 3.06Å; T89-K91 PolarHBondContact O-N 3.36Å; T89-S92 PolarHBondContact O-N 2.79Å; T89-H95 HydrophobicContact CG2-CB 4.33Å; T89-H95 WeakPolarHBondContact CG2-CE1 3.47Å; T89-H95 WeakPolarHBondContact CG2-ND1 3.47Å
90	K	49.6	Very low	59.8	Low	177 Å²	177	59.6 Å²	59.6	77%	0.77	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-15.2	-163	-69.7	-179.6	-179.6	167	0	115
91	K	52.7	Low	60.1	Low	132 Å²	132	52.3 Å²	52.3	57%	0.574	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.6	0.9	-178.5	-66.8	-172.8	178.6	-179.4	0	115.3	L77 S78 T89	L77-K91 HydrophobicContact CD2-CB 4.39Å; S78-K91 PolarHBondContact OG-NZ 2.97Å; T89-K91 PolarHBondContact O-N 3.36Å
92	S	58.9	Low	60.5	Low	18 Å²	18	55 Å²	55	13%	0.126	26%	0.264	C	S	.	.	S	Bend	trans	-136	151.5	-170.3	55.8	0	0	0	0	112.5	T89 C94 H96	T89-S92 PolarHBondContact O-N 2.79Å; S92-C94 PolarHBondContact O-N 3.48Å; S92-C94 PolarHBondContact OG-O 2.87Å; S92-H96 PolarHBondContact OG-CE1 3.48Å; S92-H96 VanDerWaalsContact OG-CE1 3.32Å; S92-H96 PolarHBondContact OG-ND1 2.84Å
93	F	62.1	Low	61.1	Low	91 Å²	91	50 Å²	50	40%	0.399	24%	0.242	S	C	.	.	S	Bend	trans	-59.6	-31.3	176.4	-68	-73.8	0	0	0	113	T48 Q51 L241	T48-F93 HydrophobicContact CG2-CD2 4.01Å; Q51-F93 HydrophobicContact CG-CB 4.33Å; Q51-F93 VanDerWaalsContact CG-O 3.23Å; Q51-F93 WeakPolarHBondContact CG-O 3.43Å; F93-L241 HydrophobicContact CD2-CD2 4.03Å; F93-L241 HydrophobicContact CE2-CD2 3.23Å; F93-L241 HydrophobicContact CE2-CG 4.05Å; F93-L241 HydrophobicContact CZ-CD2 3.75Å
94	C	65.4	Low	61.5	Low	2 Å²	2	50.1 Å²	50.1	1%	0.014	26%	0.255	C	S	.	.	S	Bend	trans	-118.9	160.9	-179.6	57.2	0	0	0	0	111.9	Q51 V59 S92	Q51-C94 HydrophobicContact CB-CB 4.45Å; Q51-C94 HydrophobicContact CG-CB 4.37Å; V59-C94 HydrophobicContact CB-CB 4.35Å; V59-C94 VanDerWaalsContact O-CB 3.28Å; V59-C94 WeakPolarHBondContact O-CB 3.37Å; S92-C94 PolarHBondContact O-N 3.48Å; S92-C94 PolarHBondContact OG-O 2.87Å
95	H	70.5	Confident	62.1	Low	18 Å²	18	48.2 Å²	48.2	8%	0.083	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63	138.8	169	-74.1	-86.5	0	0	0	109.6	V59 G60 L61 R86 A87 T89 L132	V59-H95 PolarHBondContact O-N 3.26Å; G60-H95 CarbonylContact C-O 3.58Å; G60-H95 WeakPolarHBondContact CA-O 3.45Å; L61-H95 PolarHBondContact N-O 3.4Å; R86-H95 PolarHBondContact NE-CE1 3.48Å; R86-H95 VanDerWaalsContact NE-CE1 3.27Å; R86-H95 PolarHBondContact NH2-NE2 3.03Å; A87-H95 HydrophobicContact CB-CB 4.36Å; A87-H95 PolarHBondContact O-ND1 2.9Å; T89-H95 HydrophobicContact CG2-CB 4.33Å; T89-H95 WeakPolarHBondContact CG2-CE1 3.47Å; T89-H95 WeakPolarHBondContact CG2-ND1 3.47Å; H95-L132 HydrophobicContact CB-CD2 4.13Å; H95-L132 VanDerWaalsContact CD2-CD2 3.46Å; H95-L132 WeakPolarHBondContact CD2-CD2 3.43Å
96	H	71.2	Confident	62.5	Low	7 Å²	7	51.6 Å²	51.6	3%	0.032	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	151.4	176.7	63.9	-91	0	0	0	113.2	L61 L77 N88 S92	L61-H96 CarbonylContact O-C 3.4Å; L61-H96 VanDerWaalsContact O-CA 3.26Å; L61-H96 WeakPolarHBondContact O-CA 3.28Å; L77-H96 HydrophobicContact CD1-CB 4.39Å; L77-H96 WeakPolarHBondContact CD1-CD2 3.38Å; L77-H96 WeakPolarHBondContact CD1-NE2 3.39Å; L77-H96 WeakPolarHBondContact CD2-CE1 3.24Å; L77-H96 WeakPolarHBondContact CD2-NE2 3.49Å; N88-H96 PolarHBondContact O-CE1 3.26Å; N88-H96 PolarHBondContact O-N 2.75Å; N88-H96 PolarHBondContact O-ND1 2.95Å; S92-H96 PolarHBondContact OG-CE1 3.48Å; S92-H96 VanDerWaalsContact OG-CE1 3.32Å; S92-H96 PolarHBondContact OG-ND1 2.84Å
97	M	73.2	Confident	62.9	Low	5 Å²	5	53 Å²	53	3%	0.025	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	140	165.2	-168.7	58.3	65.2	0	0	108.6	L61 L62 D63 P81 A87 L123 V127 W129	L61-M97 PolarHBondContact O-N 2.9Å; L62-M97 WeakPolarHBondContact CA-O 3.29Å; D63-M97 PolarHBondContact N-O 3.18Å; P81-M97 HydrophobicContact CB-CE 3.67Å; P81-M97 HydrophobicContact CB-SD 3.52Å; P81-M97 VanDerWaalsContact CB-SD 3.52Å; P81-M97 HydrophobicContact CG-CE 4.29Å; P81-M97 HydrophobicContact CG-SD 3.48Å; P81-M97 WeakPolarHBondContact CG-SD 3.23Å; A87-M97 HydrophobicContact CB-CE 4.33Å; M97-L123 HydrophobicContact CG-CD2 3.54Å; M97-L123 HydrophobicContact SD-CD2 4.45Å; M97-V127 HydrophobicContact CB-CG1 4.49Å; M97-V127 HydrophobicContact CE-CG1 3.78Å; M97-V127 HydrophobicContact CE-CG2 4.31Å; M97-V127 HydrophobicContact CG-CG1 4.31Å; M97-V127 HydrophobicContact CG-CG2 4.09Å; M97-W129 HydrophobicContact CB-CH2 3.33Å; M97-W129 HydrophobicContact CB-CZ2 3.7Å; M97-W129 HydrophobicContact CB-CZ3 4.06Å; M97-W129 HydrophobicContact CG-CZ2 4.48Å
98	S	70	Confident	63.4	Low	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	143.7	177	166.4	0	0	0	0	112.1	D63 P72 G100 L101	D63-S98 VanDerWaalsContact CB-OG 3.3Å; D63-S98 WeakPolarHBondContact CB-OG 3.39Å; D63-S98 PolarHBondContact OD2-OG 3.25Å; P72-S98 VanDerWaalsContact CD-OG 3.26Å; P72-S98 WeakPolarHBondContact CD-OG 3.36Å; P72-S98 WeakPolarHBondContact CG-OG 3.31Å; S98-G100 PolarHBondContact O-N 2.98Å; S98-G100 PolarHBondContact OG-N 3.11Å; S98-L101 PolarHBondContact O-N 2.83Å; S98-L101 VanDerWaalsContact O-N 3.12Å
99	M	66.4	Low	64.1	Low	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-51.3	-42.4	167.2	-83.6	-58.6	-54.9	0	0	112	D63 V66 L101 L102 V103 W111 A119 L123	D63-M99 PolarHBondContact O-N 3.28Å; V66-M99 HydrophobicContact CB-CG 4.45Å; V66-M99 HydrophobicContact CG1-CE 3.82Å; V66-M99 HydrophobicContact CG2-CE 4.22Å; V66-M99 HydrophobicContact CG2-CG 3.78Å; V66-M99 HydrophobicContact CG2-SD 4.34Å; M99-L101 PolarHBondContact O-N 3.32Å; M99-L102 WeakPolarHBondContact O-CA 3.39Å; M99-L102 WeakPolarHBondContact O-CB 3.43Å; M99-L102 PolarHBondContact O-N 3.32Å; M99-L102 HydrophobicContact SD-CD1 4.36Å; M99-V103 HydrophobicContact CE-CG1 4.26Å; M99-V103 HydrophobicContact CE-CG2 4.38Å; M99-V103 VanDerWaalsContact O-CG2 3.29Å; M99-V103 WeakPolarHBondContact O-CG2 3.47Å; M99-V103 PolarHBondContact O-N 2.71Å; M99-W111 HydrophobicContact CE-CH2 4.12Å; M99-W111 HydrophobicContact CE-CZ3 3.68Å; M99-A119 HydrophobicContact CE-CB 3.52Å; M99-A119 HydrophobicContact SD-CB 3.76Å; M99-L123 HydrophobicContact CB-CD1 4.36Å; M99-L123 HydrophobicContact CG-CD1 3.42Å; M99-L123 VanDerWaalsContact CG-CD1 3.42Å; M99-L123 HydrophobicContact SD-CD1 3.28Å; M99-L123 WeakPolarHBondContact SD-CD1 3.47Å; M99-L123 HydrophobicContact SD-CG 3.96Å
100	G	59.1	Low	65	Low	2 Å²	2	61.1 Å²	61.1	2%	0.021	33%	0.326	C	S	.	.	H	α-helix	trans	-64.7	-5.5	-179.4	0	0	0	0	0	115.1	P69 S98 V103 Q105	P69-G100 VanDerWaalsContact CG-CA 3.47Å; S98-G100 PolarHBondContact O-N 2.98Å; S98-G100 PolarHBondContact OG-N 3.11Å; G100-V103 CarbonylContact C-O 3.56Å; G100-V103 VanDerWaalsContact C-O 3.28Å; G100-V103 WeakPolarHBondContact CA-O 3.46Å; G100-Q105 VanDerWaalsContact O-CG 3.31Å; G100-Q105 WeakPolarHBondContact O-CG 3.43Å
101	L	65.4	Low	66.5	Low	12 Å²	12	56.7 Å²	56.7	6%	0.063	30%	0.304	C	S	.	.	H	α-helix	trans	-93.9	-20.2	169	-49.4	170.6	0	0	0	113.1	P72 P81 S98 M99	P72-L101 HydrophobicContact CB-CD2 3.97Å; P72-L101 HydrophobicContact CG-CD2 4.01Å; P72-L101 HydrophobicContact CG-CG 4.16Å; P81-L101 HydrophobicContact CG-CB 3.8Å; P81-L101 HydrophobicContact CG-CD1 4.17Å; S98-L101 PolarHBondContact O-N 2.83Å; S98-L101 VanDerWaalsContact O-N 3.12Å; M99-L101 PolarHBondContact O-N 3.32Å
102	L	66.9	Low	68	Low	64 Å²	64	59.8 Å²	59.8	34%	0.335	31%	0.312	S	S	.	.	H	α-helix	trans	-87.8	-32	173.4	-62.9	-179.8	0	0	0	112	P81 V83 M99 L123	P81-L102 HydrophobicContact CG-CD2 4.18Å; V83-L102 HydrophobicContact CG2-CD2 4.02Å; M99-L102 WeakPolarHBondContact O-CA 3.39Å; M99-L102 WeakPolarHBondContact O-CB 3.43Å; M99-L102 PolarHBondContact O-N 3.32Å; M99-L102 HydrophobicContact SD-CD1 4.36Å; L102-L123 HydrophobicContact CD1-CD2 3.59Å; L102-L123 HydrophobicContact CD1-CG 4.15Å
103	V	64.8	Low	69.1	Low	17 Å²	17	61.3 Å²	61.3	10%	0.103	33%	0.331	C	S	.	.	S	Bend	trans	-118.1	116.9	177.4	-60.5	0	0	0	0	107	M99 G100 Q105 I109 W111	M99-V103 HydrophobicContact CE-CG1 4.26Å; M99-V103 HydrophobicContact CE-CG2 4.38Å; M99-V103 VanDerWaalsContact O-CG2 3.29Å; M99-V103 WeakPolarHBondContact O-CG2 3.47Å; M99-V103 PolarHBondContact O-N 2.71Å; G100-V103 CarbonylContact C-O 3.56Å; G100-V103 VanDerWaalsContact C-O 3.28Å; G100-V103 WeakPolarHBondContact CA-O 3.46Å; V103-Q105 PolarHBondContact O-N 2.98Å; V103-I109 HydrophobicContact CB-CD1 4.18Å; V103-I109 HydrophobicContact CB-CG1 4.3Å; V103-I109 HydrophobicContact CG2-CD1 3.32Å; V103-I109 HydrophobicContact CG2-CG1 3.96Å; V103-W111 HydrophobicContact CB-CZ2 4.43Å; V103-W111 HydrophobicContact CG1-CH2 3.13Å; V103-W111 HydrophobicContact CG1-CZ2 3.16Å; V103-W111 HydrophobicContact CG1-CZ3 4.01Å
104	G	62.6	Low	70.2	Confident	58 Å²	58	64.1 Å²	64.1	60%	0.598	35%	0.349	S	S	*	.			trans	-49.9	140.3	-172.2	0	0	0	0	0	113	D106	G104-D106 PolarHBondContact O-N 3.33Å; G104-D106 VanDerWaalsContact O-N 3.16Å
105	Q	62	Low	71.2	Confident	85 Å²	85	67.9 Å²	67.9	40%	0.397	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-20.9	-168.1	-64.7	-177	24	0	0	114.7	G100 V103	G100-Q105 VanDerWaalsContact O-CG 3.31Å; G100-Q105 WeakPolarHBondContact O-CG 3.43Å; V103-Q105 PolarHBondContact O-N 2.98Å
106	D	64.2	Low	71.9	Confident	159 Å²	159	67 Å²	67	85%	0.85	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	1.9	-168.1	-60.4	-45.1	0	0	0	114.4	G104	G104-D106 PolarHBondContact O-N 3.33Å; G104-D106 VanDerWaalsContact O-N 3.16Å
107	Q	64.5	Low	72.5	Confident	156 Å²	156	68.5 Å²	68.5	73%	0.729	37%	0.371	S	S	*	.	S	Bend	trans	-113.5	134	179.3	-63.6	-138	-7.6	0	0	112.2	I109	Q107-I109 PolarHBondContact O-N 2.95Å
108	P	67.7	Low	73.2	Confident	115 Å²	115	71.7 Å²	71.7	75%	0.747	39%	0.394	S	S	*	.			trans	-61	124.5	173.9	25.3	-32.3	0	0	0	109.6	V110	P108-V110 PolarHBondContact O-N 3.05Å; P108-V110 VanDerWaalsContact O-N 3.12Å
109	I	72.6	Confident	73.9	Confident	30 Å²	30	72.3 Å²	72.3	15%	0.154	40%	0.399	C	S	.	.			trans	-82.3	98.7	-175.9	-64.3	152.1	0	0	0	108.6	V66 P69 V103 Q107 W111	V66-I109 HydrophobicContact CG1-CG2 4.22Å; V66-I109 WeakPolarHBondContact O-CD1 3.36Å; P69-I109 HydrophobicContact CG-CD1 4.49Å; V103-I109 HydrophobicContact CB-CD1 4.18Å; V103-I109 HydrophobicContact CB-CG1 4.3Å; V103-I109 HydrophobicContact CG2-CD1 3.32Å; V103-I109 HydrophobicContact CG2-CG1 3.96Å; Q107-I109 PolarHBondContact O-N 2.95Å; I109-W111 HydrophobicContact CG2-CB 3.95Å; I109-W111 HydrophobicContact CG2-CD2 3.63Å; I109-W111 HydrophobicContact CG2-CE3 4.21Å; I109-W111 HydrophobicContact CG2-CG 3.46Å; I109-W111 VanDerWaalsContact CG2-CG 3.46Å; I109-W111 PolarHBondContact O-N 2.94Å
110	V	76.2	Confident	74.9	Confident	136 Å²	136	72.5 Å²	72.5	82%	0.824	40%	0.4	S	S	*	.			trans	-94.6	73.5	175.6	-170.2	0	0	0	0	109.4	P108	P108-V110 PolarHBondContact O-N 3.05Å; P108-V110 VanDerWaalsContact O-N 3.12Å
111	W	80.4	Confident	76.3	Confident	83 Å²	83	75.8 Å²	75.8	31%	0.314	42%	0.417	S	S	.	.			trans	-106.2	143.4	-177.6	-77.3	12.2	0	0	0	112.1	V66 M99 V103 I109 M115 V116 A119	V66-W111 HydrophobicContact CG1-CE3 4.12Å; V66-W111 HydrophobicContact CG1-CZ3 4.41Å; M99-W111 HydrophobicContact CE-CH2 4.12Å; M99-W111 HydrophobicContact CE-CZ3 3.68Å; V103-W111 HydrophobicContact CB-CZ2 4.43Å; V103-W111 HydrophobicContact CG1-CH2 3.13Å; V103-W111 HydrophobicContact CG1-CZ2 3.16Å; V103-W111 HydrophobicContact CG1-CZ3 4.01Å; I109-W111 HydrophobicContact CG2-CB 3.95Å; I109-W111 HydrophobicContact CG2-CD2 3.63Å; I109-W111 HydrophobicContact CG2-CE3 4.21Å; I109-W111 HydrophobicContact CG2-CG 3.46Å; I109-W111 VanDerWaalsContact CG2-CG 3.46Å; I109-W111 PolarHBondContact O-N 2.94Å; W111-M115 HydrophobicContact CB-CB 4.25Å; W111-M115 HydrophobicContact CD2-CB 4.34Å; W111-M115 HydrophobicContact CD2-CE 4.14Å; W111-M115 HydrophobicContact CE3-CB 4.18Å; W111-M115 HydrophobicContact CG-CB 4.43Å; W111-M115 HydrophobicContact CG-CE 4.11Å; W111-V116 HydrophobicContact CB-CG2 3.91Å; W111-V116 HydrophobicContact CE3-CG2 4.42Å; W111-A119 HydrophobicContact CH2-CB 4.37Å; W111-A119 HydrophobicContact CZ3-CB 3.63Å
112	R	83.4	Confident	77.3	Confident	197 Å²	197	76.7 Å²	76.7	74%	0.743	42%	0.423	S	S	*	.			trans	-69.5	148.2	169.5	-58.7	-170.4	-161.6	113.4	0.9	109.4	L114 M115 V116	R112-L114 PolarHBondContact O-N 2.88Å; R112-L114 VanDerWaalsContact O-N 3.08Å; R112-M115 HydrophobicContact CB-CG 4.48Å; R112-M115 HydrophobicContact CB-SD 4.49Å; R112-M115 WeakPolarHBondContact O-CA 3.39Å; R112-M115 WeakPolarHBondContact O-CB 3.41Å; R112-M115 PolarHBondContact O-N 2.72Å; R112-V116 PolarHBondContact O-N 2.84Å
113	G	82.2	Confident	78.2	Confident	50 Å²	50	73.8 Å²	73.8	52%	0.515	41%	0.408	S	S	.	.	H	α-helix	trans	-51.8	-36.8	-178	0	0	0	0	0	114.3	M115 V116 M117	G113-M115 VanDerWaalsContact C-N 3.32Å; G113-M115 PolarHBondContact O-N 3.29Å; G113-V116 WeakPolarHBondContact O-CB 3.39Å; G113-V116 PolarHBondContact O-N 2.99Å; G113-M117 WeakPolarHBondContact O-CG 3.42Å; G113-M117 PolarHBondContact O-N 2.82Å
114	L	84.8	Confident	79.3	Confident	151 Å²	151	73.1 Å²	73.1	79%	0.791	40%	0.404	S	S	*	.	H	α-helix	trans	-62.4	-35.7	175.1	-65.5	172.9	0	0	0	113.3	R112 S118	R112-L114 PolarHBondContact O-N 2.88Å; R112-L114 VanDerWaalsContact O-N 3.08Å; L114-S118 WeakPolarHBondContact O-CB 3.46Å; L114-S118 PolarHBondContact O-N 3.26Å
115	M	86.7	Confident	80.6	Confident	81 Å²	81	73.6 Å²	73.6	40%	0.399	39%	0.387	S	S	.	.	H	α-helix	trans	-70.5	-42.6	177.1	-63.1	176.4	62.2	0	0	110.9	W111 R112 G113 M117 S118 A119	W111-M115 HydrophobicContact CB-CB 4.25Å; W111-M115 HydrophobicContact CD2-CB 4.34Å; W111-M115 HydrophobicContact CD2-CE 4.14Å; W111-M115 HydrophobicContact CE3-CB 4.18Å; W111-M115 HydrophobicContact CG-CB 4.43Å; W111-M115 HydrophobicContact CG-CE 4.11Å; R112-M115 HydrophobicContact CB-CG 4.48Å; R112-M115 HydrophobicContact CB-SD 4.49Å; R112-M115 WeakPolarHBondContact O-CA 3.39Å; R112-M115 WeakPolarHBondContact O-CB 3.41Å; R112-M115 PolarHBondContact O-N 2.72Å; G113-M115 VanDerWaalsContact C-N 3.32Å; G113-M115 PolarHBondContact O-N 3.29Å; M115-M117 VanDerWaalsContact C-N 3.3Å; M115-M117 PolarHBondContact O-N 3.24Å; M115-S118 PolarHBondContact O-N 3.05Å; M115-A119 WeakPolarHBondContact O-CB 3.49Å; M115-A119 PolarHBondContact O-N 2.94Å
116	V	85	Confident	81.7	Confident	0 Å²	0	76.3 Å²	76.3	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-56.2	-48.5	173.6	175.9	0	0	0	0	109.9	V66 F67 W111 R112 G113 S118 A119 I120 T146	V66-V116 HydrophobicContact CB-CG1 3.99Å; V66-V116 HydrophobicContact CG1-CG1 4.27Å; V66-V116 HydrophobicContact CG1-CG2 4.19Å; V66-V116 HydrophobicContact CG2-CG1 3.65Å; F67-V116 HydrophobicContact CE1-CG2 4.23Å; F67-V116 HydrophobicContact CE2-CG1 4.49Å; F67-V116 HydrophobicContact CZ-CG2 3.86Å; W111-V116 HydrophobicContact CB-CG2 3.91Å; W111-V116 HydrophobicContact CE3-CG2 4.42Å; R112-V116 PolarHBondContact O-N 2.84Å; G113-V116 WeakPolarHBondContact O-CB 3.39Å; G113-V116 PolarHBondContact O-N 2.99Å; V116-S118 PolarHBondContact O-N 3.45Å; V116-A119 PolarHBondContact O-N 3.43Å; V116-I120 HydrophobicContact CG1-CD1 3.92Å; V116-I120 WeakPolarHBondContact O-CG1 3.44Å; V116-I120 PolarHBondContact O-N 3.49Å; V116-T146 HydrophobicContact CG1-CG2 3.91Å
117	M	85	Confident	82.7	Confident	38 Å²	38	69.2 Å²	69.2	19%	0.187	36%	0.36	C	S	.	.	H	α-helix	trans	-64.5	-41.4	178.2	-71.4	-49.7	-41.9	0	0	113.4	G113 M115 A119 I120 N121 T146 S149	G113-M117 WeakPolarHBondContact O-CG 3.42Å; G113-M117 PolarHBondContact O-N 2.82Å; M115-M117 VanDerWaalsContact C-N 3.3Å; M115-M117 PolarHBondContact O-N 3.24Å; M117-A119 VanDerWaalsContact C-N 3.31Å; M117-A119 PolarHBondContact O-N 2.91Å; M117-I120 PolarHBondContact O-N 2.81Å; M117-I120 HydrophobicContact SD-CD1 4.42Å; M117-N121 WeakPolarHBondContact O-CB 3.26Å; M117-N121 PolarHBondContact O-N 2.87Å; M117-T146 HydrophobicContact SD-CG2 3.95Å; M117-S149 WeakPolarHBondContact CE-OG 3.21Å
118	S	86.4	Confident	83.7	Confident	72 Å²	72	69.6 Å²	69.6	50%	0.503	36%	0.355	S	S	.	.	H	α-helix	trans	-62.2	-38.6	175.8	-179.7	0	0	0	0	112.2	L114 M115 V116 T122	L114-S118 WeakPolarHBondContact O-CB 3.46Å; L114-S118 PolarHBondContact O-N 3.26Å; M115-S118 PolarHBondContact O-N 3.05Å; V116-S118 PolarHBondContact O-N 3.45Å; S118-T122 WeakPolarHBondContact O-CB 3.37Å; S118-T122 PolarHBondContact O-N 2.92Å; S118-T122 PolarHBondContact O-OG1 3.2Å
119	A	85.2	Confident	84.6	Confident	12 Å²	12	64.1 Å²	64.1	10%	0.099	32%	0.32	C	S	.	.	H	α-helix	trans	-71.2	-44.1	178.7	0	0	0	0	0	112.1	M99 W111 M115 V116 M117 N121 T122 L123	M99-A119 HydrophobicContact CE-CB 3.52Å; M99-A119 HydrophobicContact SD-CB 3.76Å; W111-A119 HydrophobicContact CH2-CB 4.37Å; W111-A119 HydrophobicContact CZ3-CB 3.63Å; M115-A119 WeakPolarHBondContact O-CB 3.49Å; M115-A119 PolarHBondContact O-N 2.94Å; V116-A119 PolarHBondContact O-N 3.43Å; M117-A119 VanDerWaalsContact C-N 3.31Å; M117-A119 PolarHBondContact O-N 2.91Å; A119-N121 VanDerWaalsContact C-N 3.31Å; A119-N121 PolarHBondContact O-N 2.92Å; A119-T122 WeakPolarHBondContact O-CA 3.4Å; A119-T122 VanDerWaalsContact O-CB 3.3Å; A119-T122 WeakPolarHBondContact O-CB 3.46Å; A119-T122 PolarHBondContact O-N 2.81Å; A119-T122 VanDerWaalsContact O-N 3.08Å; A119-L123 PolarHBondContact O-N 2.87Å
120	I	87.6	Confident	85	Confident	5 Å²	5	63.9 Å²	63.9	3%	0.026	32%	0.324	C	S	.	.	H	α-helix	trans	-57.2	-47.1	171.6	-71.6	165.2	0	0	0	110.3	V66 V116 M117 T122 L123 L124 T146 I150	V66-I120 HydrophobicContact CG2-CD1 4.03Å; V66-I120 HydrophobicContact CG2-CG1 3.96Å; V116-I120 HydrophobicContact CG1-CD1 3.92Å; V116-I120 WeakPolarHBondContact O-CG1 3.44Å; V116-I120 PolarHBondContact O-N 3.49Å; M117-I120 PolarHBondContact O-N 2.81Å; M117-I120 HydrophobicContact SD-CD1 4.42Å; I120-T122 VanDerWaalsContact C-N 3.27Å; I120-T122 PolarHBondContact O-N 3.07Å; I120-L123 PolarHBondContact O-N 2.92Å; I120-L123 VanDerWaalsContact O-N 3.13Å; I120-L124 HydrophobicContact CG2-CD1 3.72Å; I120-L124 HydrophobicContact CG2-CG 4.27Å; I120-L124 VanDerWaalsContact O-CG 3.28Å; I120-L124 WeakPolarHBondContact O-CG 3.22Å; I120-L124 PolarHBondContact O-N 2.79Å; I120-T146 HydrophobicContact CD1-CG2 3.18Å; I120-I150 HydrophobicContact CD1-CD1 4.22Å; I120-I150 HydrophobicContact CG2-CD1 4.13Å; I120-I150 HydrophobicContact CG2-CG1 3.65Å
121	N	88.2	Confident	85.6	Confident	70 Å²	70	61.6 Å²	61.6	37%	0.374	31%	0.312	S	S	.	.	H	α-helix	trans	-61.6	-36.9	176.8	-172.8	55.5	0	0	0	111.8	M117 A119 L124 R125	M117-N121 WeakPolarHBondContact O-CB 3.26Å; M117-N121 PolarHBondContact O-N 2.87Å; A119-N121 VanDerWaalsContact C-N 3.31Å; A119-N121 PolarHBondContact O-N 2.92Å; N121-L124 PolarHBondContact O-N 2.85Å; N121-R125 WeakPolarHBondContact O-CB 3.26Å; N121-R125 WeakPolarHBondContact O-CG 3.39Å; N121-R125 PolarHBondContact O-N 2.84Å; N121-R125 VanDerWaalsContact OD1-CG 3.22Å; N121-R125 WeakPolarHBondContact OD1-CG 3.48Å
122	T	86.5	Confident	86.2	Confident	32 Å²	32	57.7 Å²	57.7	20%	0.196	30%	0.298	C	S	.	.	H	α-helix	trans	-61.2	-45.9	173	-67.1	0	0	0	0	111.5	S118 A119 I120 L124 R125 K126	S118-T122 WeakPolarHBondContact O-CB 3.37Å; S118-T122 PolarHBondContact O-N 2.92Å; S118-T122 PolarHBondContact O-OG1 3.2Å; A119-T122 WeakPolarHBondContact O-CA 3.4Å; A119-T122 VanDerWaalsContact O-CB 3.3Å; A119-T122 WeakPolarHBondContact O-CB 3.46Å; A119-T122 PolarHBondContact O-N 2.81Å; A119-T122 VanDerWaalsContact O-N 3.08Å; I120-T122 VanDerWaalsContact C-N 3.27Å; I120-T122 PolarHBondContact O-N 3.07Å; T122-L124 VanDerWaalsContact C-N 3.34Å; T122-L124 PolarHBondContact O-N 3.32Å; T122-R125 PolarHBondContact O-N 3.29Å; T122-K126 HydrophobicContact CG2-CB 4.22Å; T122-K126 HydrophobicContact CG2-CD 4.05Å; T122-K126 HydrophobicContact CG2-CG 4.39Å; T122-K126 WeakPolarHBondContact O-CA 3.35Å; T122-K126 WeakPolarHBondContact O-CB 2.96Å; T122-K126 PolarHBondContact O-N 3.47Å
123	L	86.1	Confident	86.8	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-64.4	-36.5	176.3	-70.5	-176	0	0	0	113.3	L62 M97 M99 L102 A119 I120 V127 W129	L62-L123 HydrophobicContact CD1-CB 4.05Å; L62-L123 HydrophobicContact CD1-CD1 3.73Å; L62-L123 HydrophobicContact CD1-CG 4.42Å; M97-L123 HydrophobicContact CG-CD2 3.54Å; M97-L123 HydrophobicContact SD-CD2 4.45Å; M99-L123 HydrophobicContact CB-CD1 4.36Å; M99-L123 HydrophobicContact CG-CD1 3.42Å; M99-L123 VanDerWaalsContact CG-CD1 3.42Å; M99-L123 HydrophobicContact SD-CD1 3.28Å; M99-L123 WeakPolarHBondContact SD-CD1 3.47Å; M99-L123 HydrophobicContact SD-CG 3.96Å; L102-L123 HydrophobicContact CD1-CD2 3.59Å; L102-L123 HydrophobicContact CD1-CG 4.15Å; A119-L123 PolarHBondContact O-N 2.87Å; I120-L123 PolarHBondContact O-N 2.92Å; I120-L123 VanDerWaalsContact O-N 3.13Å; L123-V127 HydrophobicContact CD2-CG2 3.91Å; L123-V127 WeakPolarHBondContact O-CB 3.29Å; L123-W129 PolarHBondContact O-NE1 2.89Å
124	L	89	Confident	87.4	Confident	3 Å²	3	48.3 Å²	48.3	2%	0.016	25%	0.25	C	S	.	.	H	α-helix	trans	-78	-27.7	179.4	-65.5	173.9	0	0	0	113.2	I21 L62 I120 N121 T122 I154	I21-L124 HydrophobicContact CD1-CD2 3.64Å; I21-L124 HydrophobicContact CG1-CD2 4.35Å; I21-L124 WeakPolarHBondContact CG2-O 3.47Å; L62-L124 HydrophobicContact CD2-CD2 3.56Å; L62-L124 HydrophobicContact CD2-CG 4.46Å; I120-L124 HydrophobicContact CG2-CD1 3.72Å; I120-L124 HydrophobicContact CG2-CG 4.27Å; I120-L124 VanDerWaalsContact O-CG 3.28Å; I120-L124 WeakPolarHBondContact O-CG 3.22Å; I120-L124 PolarHBondContact O-N 2.79Å; N121-L124 PolarHBondContact O-N 2.85Å; T122-L124 VanDerWaalsContact C-N 3.34Å; T122-L124 PolarHBondContact O-N 3.32Å; L124-I154 HydrophobicContact CD1-CG2 4.07Å; L124-I154 HydrophobicContact CD2-CD1 4.17Å
125	R	88.7	Confident	87.9	Confident	68 Å²	68	41.1 Å²	41.1	26%	0.257	21%	0.213	S	C	.	.	H	α-helix	trans	-114	-34.2	-170.1	-56.2	-56.6	178.2	-156.4	0.1	115.2	L19 P20 N121 T122 N153	L19-R125 PolarHBondContact O-NH1 3.27Å; L19-R125 PolarHBondContact O-NH2 3.01Å; P20-R125 PolarHBondContact O-NH1 3.35Å; N121-R125 WeakPolarHBondContact O-CB 3.26Å; N121-R125 WeakPolarHBondContact O-CG 3.39Å; N121-R125 PolarHBondContact O-N 2.84Å; N121-R125 VanDerWaalsContact OD1-CG 3.22Å; N121-R125 WeakPolarHBondContact OD1-CG 3.48Å; T122-R125 PolarHBondContact O-N 3.29Å; R125-N153 PolarHBondContact NH2-O 2.81Å
126	K	86	Confident	88.4	Confident	142 Å²	142	37.2 Å²	37.2	62%	0.617	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99	-19.4	-173	-58.6	-168.7	-180	176	0	113.1	T122	T122-K126 HydrophobicContact CG2-CB 4.22Å; T122-K126 HydrophobicContact CG2-CD 4.05Å; T122-K126 HydrophobicContact CG2-CG 4.39Å; T122-K126 WeakPolarHBondContact O-CA 3.35Å; T122-K126 WeakPolarHBondContact O-CB 2.96Å; T122-K126 PolarHBondContact O-N 3.47Å
127	V	83.9	Confident	88.9	Confident	10 Å²	10	37.3 Å²	37.3	6%	0.061	19%	0.194	C	C	.	.	S	Bend	trans	-76.6	132.3	177.4	174.5	0	0	0	0	110.5	A87 M97 L123 W129	A87-V127 HydrophobicContact CB-CG1 4.3Å; M97-V127 HydrophobicContact CB-CG1 4.49Å; M97-V127 HydrophobicContact CE-CG1 3.78Å; M97-V127 HydrophobicContact CE-CG2 4.31Å; M97-V127 HydrophobicContact CG-CG1 4.31Å; M97-V127 HydrophobicContact CG-CG2 4.09Å; L123-V127 HydrophobicContact CD2-CG2 3.91Å; L123-V127 WeakPolarHBondContact O-CB 3.29Å; V127-W129 HydrophobicContact CG1-CD2 4.07Å; V127-W129 HydrophobicContact CG1-CG 4.22Å; V127-W129 HydrophobicContact CG1-CZ2 4.27Å; V127-W129 PolarHBondContact O-N 2.83Å; V127-W129 VanDerWaalsContact O-N 3.07Å
128	R	85.7	Confident	89.4	Confident	165 Å²	165	35.5 Å²	35.5	62%	0.623	19%	0.185	S	C	*	.	B	Isolated β-bridge	trans	-79.7	83.9	172.4	-68.9	-180	175.2	170.5	-7.3	110.3	N84 A87	N84-R128 PolarHBondContact O-NH1 2.89Å; A87-R128 PolarHBondContact N-O 3.07Å
129	W	86.6	Confident	89.7	Confident	0 Å²	0	32 Å²	32	0%	0	16%	0.161	C	C	.	.			trans	-70.3	-48.2	176.6	-72.4	103.3	0	0	0	112.8	I21 V24 L62 A87 M97 L123 V127 L132 L135	I21-W129 HydrophobicContact CG2-CG 4.29Å; V24-W129 HydrophobicContact CG2-CB 3.66Å; V24-W129 HydrophobicContact CG2-CG 4.12Å; L62-W129 HydrophobicContact CB-CH2 3.54Å; L62-W129 HydrophobicContact CB-CZ2 3.79Å; L62-W129 HydrophobicContact CD1-CH2 4.05Å; L62-W129 HydrophobicContact CD1-CZ2 3.79Å; L62-W129 HydrophobicContact CD2-CZ2 3.98Å; L62-W129 HydrophobicContact CG-CH2 4.24Å; L62-W129 HydrophobicContact CG-CZ2 4.05Å; A87-W129 HydrophobicContact CB-CE3 4.11Å; A87-W129 HydrophobicContact CB-CZ3 4.36Å; M97-W129 HydrophobicContact CB-CH2 3.33Å; M97-W129 HydrophobicContact CB-CZ2 3.7Å; M97-W129 HydrophobicContact CB-CZ3 4.06Å; M97-W129 HydrophobicContact CG-CZ2 4.48Å; L123-W129 PolarHBondContact O-NE1 2.89Å; V127-W129 HydrophobicContact CG1-CD2 4.07Å; V127-W129 HydrophobicContact CG1-CG 4.22Å; V127-W129 HydrophobicContact CG1-CZ2 4.27Å; V127-W129 PolarHBondContact O-N 2.83Å; V127-W129 VanDerWaalsContact O-N 3.07Å; W129-L132 HydrophobicContact CB-CD1 3.98Å; W129-L132 HydrophobicContact CB-CG 4.49Å; W129-L132 HydrophobicContact CD2-CD1 4.41Å; W129-L132 HydrophobicContact CE3-CD1 3.78Å; W129-L132 WeakPolarHBondContact O-CG 3.37Å; W129-L135 HydrophobicContact CD2-CD1 4.11Å; W129-L135 HydrophobicContact CD2-CD2 4.32Å; W129-L135 HydrophobicContact CE3-CD1 3.64Å; W129-L135 HydrophobicContact CH2-CD1 3.74Å; W129-L135 HydrophobicContact CZ2-CD1 4.22Å; W129-L135 HydrophobicContact CZ2-CD2 4.43Å; W129-L135 HydrophobicContact CZ3-CD1 3.44Å; W129-L135 VanDerWaalsContact CZ3-CD1 3.44Å
130	G	80.4	Confident	90.1	Very high	25 Å²	25	31.6 Å²	31.6	26%	0.258	16%	0.157	S	C	.	.			trans	-75.4	167.8	-160.3	0	0	0	0	0	117.2	G23	G23-G130 VanDerWaalsContact O-CA 3.23Å; G23-G130 WeakPolarHBondContact O-CA 3.44Å
131	P	90.1	Very high	90.2	Very high	88 Å²	88	33.6 Å²	33.6	57%	0.571	17%	0.17	S	C	*	.	S	Bend	cis	-75.3	133.2	-6	29.5	-34.7	0	0	0	112.2	G23 S58	G23-P131 CarbonylContact O-C 3.41Å; G23-P131 WeakPolarHBondContact O-CA 3.45Å; S58-P131 PolarHBondContact OG-O 3.22Å
132	L	92.9	Very high	90.1	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.005	16%	0.162	C	C	.	.	B	Isolated β-bridge	trans	-128.1	134.5	172.5	-66.6	-174.2	0	0	0	111.2	G23 V24 K25 S58 H95 W129 L135	G23-L132 PolarHBondContact O-N 2.87Å; V24-L132 HydrophobicContact CG2-CB 4.27Å; V24-L132 HydrophobicContact CG2-CD1 4.21Å; K25-L132 PolarHBondContact N-O 2.94Å; S58-L132 VanDerWaalsContact OG-CA 3.22Å; S58-L132 WeakPolarHBondContact OG-CA 3.46Å; H95-L132 HydrophobicContact CB-CD2 4.13Å; H95-L132 VanDerWaalsContact CD2-CD2 3.46Å; H95-L132 WeakPolarHBondContact CD2-CD2 3.43Å; W129-L132 HydrophobicContact CB-CD1 3.98Å; W129-L132 HydrophobicContact CB-CG 4.49Å; W129-L132 HydrophobicContact CD2-CD1 4.41Å; W129-L132 HydrophobicContact CE3-CD1 3.78Å; W129-L132 WeakPolarHBondContact O-CG 3.37Å; L132-L135 HydrophobicContact CD1-CD1 4.19Å
133	D	95	Very high	89.9	Confident	33 Å²	33	32.8 Å²	32.8	18%	0.176	17%	0.172	C	C	.	.	S	Bend	trans	-79.8	-27.5	170.9	-63.4	-63.2	0	0	0	112.3	K25 R26 S57 S58	K25-D133 WeakPolarHBondContact CD-OD1 3.26Å; K25-D133 WeakPolarHBondContact CE-OD1 3.3Å; K25-D133 IonicContact NZ-OD1 2.67Å; K25-D133 PolarHBondContact NZ-OD1 3.12Å; R26-D133 PolarHBondContact N-O 2.95Å; S57-D133 WeakPolarHBondContact CA-OD2 3.48Å; S57-D133 WeakPolarHBondContact OG-CB 3.16Å; S58-D133 PolarHBondContact N-OD2 3.19Å; S58-D133 PolarHBondContact O-N 2.76Å; S58-D133 PolarHBondContact OG-N 2.82Å; S58-D133 PolarHBondContact OG-OD2 3.01Å
134	L	95.7	Very high	89.7	Confident	16 Å²	16	34.7 Å²	34.7	8%	0.084	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	135	178.1	-179.8	67.2	0	0	0	111.2	R26 V28 L50 S58 V59 G60 V136	R26-L134 HydrophobicContact CB-CD1 3.99Å; R26-L134 CarbonylContact O-C 3.55Å; R26-L134 WeakPolarHBondContact O-CA 3.2Å; V28-L134 HydrophobicContact CB-CD1 4.09Å; V28-L134 HydrophobicContact CG2-CD1 3.69Å; L50-L134 HydrophobicContact CD1-CD2 3.47Å; L50-L134 VanDerWaalsContact CD1-CD2 3.47Å; S58-L134 PolarHBondContact O-N 2.83Å; V59-L134 CarbonylContact C-O 3.57Å; V59-L134 WeakPolarHBondContact CA-O 3.32Å; G60-L134 PolarHBondContact N-O 3.36Å; L134-V136 HydrophobicContact CD2-CG2 4.12Å; L134-V136 HydrophobicContact CG-CG2 4.36Å
135	L	95.8	Very high	89.4	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	119.2	165.2	-179	63.4	0	0	0	109.7	I21 V24 R26 V27 V28 L62 W129 L132 V137	I21-L135 HydrophobicContact CD1-CD2 3.62Å; V24-L135 HydrophobicContact CG1-CB 3.57Å; V24-L135 HydrophobicContact CG2-CB 4.39Å; V24-L135 HydrophobicContact CG2-CD2 4.36Å; R26-L135 PolarHBondContact O-N 3.24Å; V27-L135 WeakPolarHBondContact CA-O 2.92Å; V28-L135 PolarHBondContact N-O 3.4Å; L62-L135 HydrophobicContact CB-CD1 4.07Å; L62-L135 HydrophobicContact CB-CG 4.47Å; L62-L135 HydrophobicContact CD2-CD2 4.48Å; W129-L135 HydrophobicContact CD2-CD1 4.11Å; W129-L135 HydrophobicContact CD2-CD2 4.32Å; W129-L135 HydrophobicContact CE3-CD1 3.64Å; W129-L135 HydrophobicContact CH2-CD1 3.74Å; W129-L135 HydrophobicContact CZ2-CD1 4.22Å; W129-L135 HydrophobicContact CZ2-CD2 4.43Å; W129-L135 HydrophobicContact CZ3-CD1 3.44Å; W129-L135 VanDerWaalsContact CZ3-CD1 3.44Å; L132-L135 HydrophobicContact CD1-CD1 4.19Å; L135-V137 HydrophobicContact CD2-CG2 4.13Å; L135-V137 HydrophobicContact CG-CG2 4.01Å
136	V	96.5	Very high	89.2	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	125.5	169.5	-179	0	0	0	0	108.3	V28 V30 A43 L46 A47 V59 G60 L61 L62 L134	V28-V136 CarbonylContact O-C 3.28Å; V28-V136 WeakPolarHBondContact O-CA 3.36Å; V30-V136 HydrophobicContact CG2-CG1 3.69Å; A43-V136 HydrophobicContact CB-CG1 4.37Å; L46-V136 HydrophobicContact CD2-CG1 4.38Å; A47-V136 HydrophobicContact CB-CB 4.16Å; A47-V136 HydrophobicContact CB-CG2 4.02Å; V59-V136 HydrophobicContact CG1-CG2 4.38Å; G60-V136 PolarHBondContact O-N 3.47Å; L61-V136 CarbonylContact C-O 3.59Å; L61-V136 WeakPolarHBondContact CA-O 2.96Å; L61-V136 HydrophobicContact CD1-CB 4.11Å; L61-V136 HydrophobicContact CD1-CG1 4Å; L62-V136 PolarHBondContact N-O 3.07Å; L134-V136 HydrophobicContact CD2-CG2 4.12Å; L134-V136 HydrophobicContact CG-CG2 4.36Å
137	V	95.7	Very high	89.3	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.006	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	114.8	-179.6	-175.1	0	0	0	0	109.6	V27 V28 L29 V30 L62 A64 L135 M139	V27-V137 HydrophobicContact CG1-CG2 3.89Å; V28-V137 PolarHBondContact O-N 3Å; L29-V137 HydrophobicContact CD2-CB 3.69Å; L29-V137 HydrophobicContact CD2-CG1 4.24Å; L29-V137 HydrophobicContact CD2-CG2 3.94Å; V30-V137 PolarHBondContact N-O 3.34Å; L62-V137 HydrophobicContact CB-CG1 4.37Å; L62-V137 HydrophobicContact CB-CG2 4.24Å; L62-V137 HydrophobicContact CD2-CG1 4.07Å; L62-V137 HydrophobicContact CD2-CG2 4.21Å; L62-V137 HydrophobicContact CG-CG1 4.13Å; L62-V137 CarbonylContact O-C 3.58Å; L62-V137 WeakPolarHBondContact O-CA 3.34Å; A64-V137 HydrophobicContact CB-CG1 3.96Å; L135-V137 HydrophobicContact CD2-CG2 4.13Å; L135-V137 HydrophobicContact CG-CG2 4.01Å; V137-M139 HydrophobicContact CG1-SD 4.02Å; V137-M139 PolarHBondContact O-N 3.12Å
138	D	95	Very high	89.4	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	104.1	169.2	-176.1	27.2	0	0	0	109.3	K39 S40 A43 L62 A64 D65 I71	K39-D138 WeakPolarHBondContact CD-OD1 3.39Å; K39-D138 VanDerWaalsContact CG-OD1 3.29Å; K39-D138 WeakPolarHBondContact CG-OD1 3.46Å; K39-D138 VanDerWaalsContact NZ-CG 3.33Å; K39-D138 IonicContact NZ-OD1 2.96Å; K39-D138 PolarHBondContact NZ-OD1 3.05Å; K39-D138 IonicContact NZ-OD2 3.32Å; K39-D138 PolarHBondContact NZ-OD2 2.7Å; S40-D138 WeakPolarHBondContact CA-OD2 3.45Å; S40-D138 WeakPolarHBondContact CB-OD2 2.86Å; S40-D138 PolarHBondContact OG-OD2 3.19Å; A43-D138 HydrophobicContact CB-CB 3.86Å; L62-D138 PolarHBondContact O-N 3.4Å; A64-D138 CarbonylContact C-O 3.55Å; A64-D138 WeakPolarHBondContact CA-O 3.44Å; A64-D138 WeakPolarHBondContact CB-O 3.4Å; A64-D138 PolarHBondContact N-O 2.97Å; D65-D138 PolarHBondContact N-O 3.38Å; I71-D138 HydrophobicContact CD1-CB 3.55Å
139	M	94	Very high	89.5	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-74.6	153.3	-173.4	-63.4	-73.8	-74.8	0	0	110.9	L29 V30 A31 K39 V137 Q147 I150 V151	L29-M139 HydrophobicContact CB-CG 3.96Å; L29-M139 HydrophobicContact CB-SD 4.18Å; L29-M139 HydrophobicContact CD1-CE 3.96Å; L29-M139 HydrophobicContact CD1-SD 3.93Å; L29-M139 HydrophobicContact CD2-SD 3.83Å; L29-M139 HydrophobicContact CG-SD 4.2Å; V30-M139 VanDerWaalsContact O-CB 3.31Å; V30-M139 WeakPolarHBondContact O-CB 3.18Å; V30-M139 WeakPolarHBondContact O-CG 3.41Å; V30-M139 PolarHBondContact O-N 2.75Å; A31-M139 HydrophobicContact CB-CB 4.42Å; A31-M139 HydrophobicContact CB-CG 4.33Å; K39-M139 WeakPolarHBondContact CD-O 3.37Å; K39-M139 WeakPolarHBondContact CE-O 3.12Å; K39-M139 PolarHBondContact NZ-O 3.43Å; V137-M139 HydrophobicContact CG1-SD 4.02Å; V137-M139 PolarHBondContact O-N 3.12Å; M139-Q147 HydrophobicContact CE-CB 3.93Å; M139-Q147 HydrophobicContact CE-CG 4.04Å; M139-I150 HydrophobicContact CE-CB 3.84Å; M139-I150 HydrophobicContact CE-CD1 3.85Å; M139-I150 HydrophobicContact CE-CG1 4.45Å; M139-I150 HydrophobicContact CE-CG2 3.9Å; M139-I150 HydrophobicContact SD-CB 4.21Å; M139-I150 HydrophobicContact SD-CD1 3.73Å; M139-I150 HydrophobicContact SD-CG2 3.73Å; M139-V151 HydrophobicContact CE-CG2 4.25Å
140	P	91.6	Very high	89.7	Confident	3 Å²	3	27.7 Å²	27.7	2%	0.019	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-55.3	151	162.9	-7.5	13.5	0	0	0	110.8	A64 T146 Q147 I150	A64-P140 WeakPolarHBondContact O-CD 3.4Å; A64-P140 WeakPolarHBondContact O-CG 3.29Å; P140-T146 HydrophobicContact CB-CG2 4.37Å; P140-T146 HydrophobicContact CG-CG2 3.48Å; P140-T146 VanDerWaalsContact CG-CG2 3.48Å; P140-Q147 WeakPolarHBondContact O-CG 3.47Å; P140-Q147 PolarHBondContact O-NE2 3.47Å; P140-I150 HydrophobicContact CG-CD1 4.3Å
141	P	89.8	Confident	90.2	Very high	47 Å²	47	26.5 Å²	26.5	31%	0.305	17%	0.169	S	C	.	.	S	Bend	trans	-72.4	164.1	178	31.9	-36.3	0	0	0	112	D65	D65-P141 WeakPolarHBondContact OD1-CD 3.45Å; D65-P141 WeakPolarHBondContact OD2-CD 3.36Å
142	G	86.9	Confident	90.1	Very high	19 Å²	19	24.6 Å²	24.6	20%	0.196	15%	0.152	C	C	.	.	S	Bend	trans	101.9	-159.9	172.2	0	0	0	0	0	113.1	S32 A33 Q147	S32-G142 PolarHBondContact O-N 3.04Å; A33-G142 VanDerWaalsContact O-CA 3.29Å; A33-G142 WeakPolarHBondContact O-CA 3.36Å; G142-Q147 PolarHBondContact O-NE2 2.93Å; G142-Q147 PolarHBondContact O-OE1 2.78Å
143	T	81.8	Confident	89.9	Confident	66 Å²	66	26.8 Å²	26.8	41%	0.405	16%	0.164	S	C	.	.	S	Bend	trans	-133.6	30.8	171.7	62.9	0	0	0	0	110.3	A33 R175	A33-T143 HydrophobicContact CB-CG2 4.34Å; T143-R175 HydrophobicContact CG2-CB 4.33Å
144	G	81.8	Confident	89.8	Confident	41 Å²	41	25.2 Å²	25.2	42%	0.423	16%	0.155	S	C	.	.	S	Bend	trans	-85.4	-179.6	-175.9	0	0	0	0	0	113.6	T146 Q147 L148	G144-T146 PolarHBondContact O-N 3.46Å; G144-T146 VanDerWaalsContact O-N 3.11Å; G144-Q147 PolarHBondContact O-N 2.96Å; G144-L148 PolarHBondContact O-N 2.76Å
145	D	82.6	Confident	89.8	Confident	134 Å²	134	26.8 Å²	26.8	72%	0.717	17%	0.167	S	C	*	.	H	α-helix	trans	-57.4	-31	-173.3	-65.4	-28.7	0	0	0	113.9	Q147 L148 S149	D145-Q147 PolarHBondContact O-N 2.66Å; D145-L148 PolarHBondContact O-N 2.7Å; D145-S149 WeakPolarHBondContact O-CB 3.26Å; D145-S149 PolarHBondContact O-N 2.92Å
146	T	84.5	Confident	89.8	Confident	27 Å²	27	27.7 Å²	27.7	17%	0.166	17%	0.172	C	C	.	.	H	α-helix	trans	-63.5	-43.6	-179.5	-44.6	0	0	0	0	112.3	V116 M117 I120 P140 G144 I150	V116-T146 HydrophobicContact CG1-CG2 3.91Å; M117-T146 HydrophobicContact SD-CG2 3.95Å; I120-T146 HydrophobicContact CD1-CG2 3.18Å; P140-T146 HydrophobicContact CB-CG2 4.37Å; P140-T146 HydrophobicContact CG-CG2 3.48Å; P140-T146 VanDerWaalsContact CG-CG2 3.48Å; G144-T146 PolarHBondContact O-N 3.46Å; G144-T146 VanDerWaalsContact O-N 3.11Å; T146-I150 WeakPolarHBondContact O-CG1 3.34Å; T146-I150 PolarHBondContact O-N 3.43Å; T146-I150 VanDerWaalsContact O-N 3.13Å
147	Q	88.2	Confident	89.8	Confident	2 Å²	2	31.3 Å²	31.3	1%	0.009	19%	0.191	C	C	.	.	H	α-helix	trans	-67.2	-45.9	176.8	-71.9	-168.7	-10	0	0	111	S32 M139 P140 G142 G144 D145 S149 I150 V151 M179	S32-Q147 PolarHBondContact O-NE2 2.91Å; M139-Q147 HydrophobicContact CE-CB 3.93Å; M139-Q147 HydrophobicContact CE-CG 4.04Å; P140-Q147 WeakPolarHBondContact O-CG 3.47Å; P140-Q147 PolarHBondContact O-NE2 3.47Å; G142-Q147 PolarHBondContact O-NE2 2.93Å; G142-Q147 PolarHBondContact O-OE1 2.78Å; G144-Q147 PolarHBondContact O-N 2.96Å; D145-Q147 PolarHBondContact O-N 2.66Å; Q147-S149 VanDerWaalsContact C-N 3.26Å; Q147-S149 PolarHBondContact O-N 3.14Å; Q147-I150 PolarHBondContact O-N 2.56Å; Q147-V151 WeakPolarHBondContact O-CG2 3.49Å; Q147-V151 PolarHBondContact O-N 3.33Å; Q147-V151 VanDerWaalsContact O-N 3.12Å; Q147-M179 HydrophobicContact CB-CE 4.01Å; Q147-M179 VanDerWaalsContact OE1-CE 3.22Å
148	L	87	Confident	89.8	Confident	48 Å²	48	31.2 Å²	31.2	25%	0.251	19%	0.191	S	C	.	.	H	α-helix	trans	-56.7	-44.9	178.5	-180	58.7	0	0	0	111	G144 D145 V151 Q152 V183	G144-L148 PolarHBondContact O-N 2.76Å; D145-L148 PolarHBondContact O-N 2.7Å; L148-V151 PolarHBondContact O-N 2.94Å; L148-Q152 HydrophobicContact CD1-CG 4.16Å; L148-Q152 HydrophobicContact CG-CG 4.47Å; L148-Q152 WeakPolarHBondContact O-CB 3.08Å; L148-Q152 VanDerWaalsContact O-CG 3.27Å; L148-Q152 WeakPolarHBondContact O-CG 3.38Å; L148-Q152 PolarHBondContact O-N 3.32Å; L148-V183 HydrophobicContact CD1-CG1 3.42Å; L148-V183 VanDerWaalsContact CD1-CG1 3.42Å
149	S	86.7	Confident	89.9	Confident	29 Å²	29	31.2 Å²	31.2	20%	0.203	19%	0.191	C	C	.	.	H	α-helix	trans	-68	-37.7	-178.7	-167.3	0	0	0	0	112.5	M117 D145 Q147 Q152 N153	M117-S149 WeakPolarHBondContact CE-OG 3.21Å; D145-S149 WeakPolarHBondContact O-CB 3.26Å; D145-S149 PolarHBondContact O-N 2.92Å; Q147-S149 VanDerWaalsContact C-N 3.26Å; Q147-S149 PolarHBondContact O-N 3.14Å; S149-Q152 PolarHBondContact O-N 3.34Å; S149-N153 VanDerWaalsContact O-CB 3.3Å; S149-N153 WeakPolarHBondContact O-CB 3.5Å; S149-N153 PolarHBondContact O-N 3.48Å; S149-N153 PolarHBondContact O-ND2 3.3Å; S149-N153 PolarHBondContact OG-ND2 2.77Å; S149-N153 VanDerWaalsContact OG-ND2 3.15Å
150	I	91.4	Very high	90	Very high	2 Å²	2	31.4 Å²	31.4	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-58.2	-52.2	171.7	-69.3	164.2	0	0	0	110	L29 A64 I120 M139 P140 T146 Q147 Q152 N153 I154	L29-I150 HydrophobicContact CD2-CG2 4.42Å; A64-I150 HydrophobicContact CB-CD1 4.1Å; I120-I150 HydrophobicContact CD1-CD1 4.22Å; I120-I150 HydrophobicContact CG2-CD1 4.13Å; I120-I150 HydrophobicContact CG2-CG1 3.65Å; M139-I150 HydrophobicContact CE-CB 3.84Å; M139-I150 HydrophobicContact CE-CD1 3.85Å; M139-I150 HydrophobicContact CE-CG1 4.45Å; M139-I150 HydrophobicContact CE-CG2 3.9Å; M139-I150 HydrophobicContact SD-CB 4.21Å; M139-I150 HydrophobicContact SD-CD1 3.73Å; M139-I150 HydrophobicContact SD-CG2 3.73Å; P140-I150 HydrophobicContact CG-CD1 4.3Å; T146-I150 WeakPolarHBondContact O-CG1 3.34Å; T146-I150 PolarHBondContact O-N 3.43Å; T146-I150 VanDerWaalsContact O-N 3.13Å; Q147-I150 PolarHBondContact O-N 2.56Å; I150-Q152 PolarHBondContact O-N 2.99Å; I150-N153 PolarHBondContact O-N 2.82Å; I150-I154 HydrophobicContact CG2-CD1 4.01Å; I150-I154 HydrophobicContact CG2-CG1 4.44Å; I150-I154 WeakPolarHBondContact O-CG1 3.04Å; I150-I154 PolarHBondContact O-N 3.48Å
151	V	91.7	Very high	90.2	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-64.1	-29.1	-176.4	-179	0	0	0	0	112.9	K18 L29 M139 Q147 L148 V156 F180 V183 A185	K18-V151 WeakPolarHBondContact CE-O 3.09Å; K18-V151 PolarHBondContact NZ-O 2.87Å; L29-V151 HydrophobicContact CD1-CG2 3.64Å; M139-V151 HydrophobicContact CE-CG2 4.25Å; Q147-V151 WeakPolarHBondContact O-CG2 3.49Å; Q147-V151 PolarHBondContact O-N 3.33Å; Q147-V151 VanDerWaalsContact O-N 3.12Å; L148-V151 PolarHBondContact O-N 2.94Å; V151-V156 HydrophobicContact CG1-CG2 4.43Å; V151-F180 HydrophobicContact CG2-CD1 4Å; V151-F180 HydrophobicContact CG2-CE1 3.6Å; V151-V183 HydrophobicContact CB-CG2 4.3Å; V151-V183 HydrophobicContact CG1-CB 4.2Å; V151-V183 HydrophobicContact CG1-CG2 3.4Å; V151-V183 VanDerWaalsContact CG1-CG2 3.4Å; V151-A185 HydrophobicContact CG1-CB 3.78Å
152	Q	88.2	Confident	90.4	Very high	48 Å²	48	29.3 Å²	29.3	22%	0.224	18%	0.178	C	C	.	.	H	α-helix	trans	-81.7	-21.2	175.9	-73.2	177.6	-15.3	0	0	113.4	P16 K18 L148 S149 I150	P16-Q152 HydrophobicContact CG-CB 4.43Å; K18-Q152 WeakPolarHBondContact CG-O 3.44Å; L148-Q152 HydrophobicContact CD1-CG 4.16Å; L148-Q152 HydrophobicContact CG-CG 4.47Å; L148-Q152 WeakPolarHBondContact O-CB 3.08Å; L148-Q152 VanDerWaalsContact O-CG 3.27Å; L148-Q152 WeakPolarHBondContact O-CG 3.38Å; L148-Q152 PolarHBondContact O-N 3.32Å; S149-Q152 PolarHBondContact O-N 3.34Å; I150-Q152 PolarHBondContact O-N 2.99Å
153	N	88.7	Confident	90.7	Very high	46 Å²	46	28.4 Å²	28.4	25%	0.246	17%	0.169	C	C	.	.	H	α-helix	trans	-88.7	-31.4	-178	-85.3	-58.6	0	0	0	113.5	L19 R125 S149 I150	L19-N153 PolarHBondContact N-O 3.39Å; R125-N153 PolarHBondContact NH2-O 2.81Å; S149-N153 VanDerWaalsContact O-CB 3.3Å; S149-N153 WeakPolarHBondContact O-CB 3.5Å; S149-N153 PolarHBondContact O-N 3.48Å; S149-N153 PolarHBondContact O-ND2 3.3Å; S149-N153 PolarHBondContact OG-ND2 2.77Å; S149-N153 VanDerWaalsContact OG-ND2 3.15Å; I150-N153 PolarHBondContact O-N 2.82Å
154	I	93.2	Very high	91	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.151	C	C	.	.	S	Bend	trans	-124	148.1	-174.6	65.8	-177	0	0	0	112	K18 I21 V27 L124 I150 V156	K18-I154 WeakPolarHBondContact CD-O 3.37Å; I21-I154 HydrophobicContact CD1-CD1 4.03Å; I21-I154 HydrophobicContact CD1-CG2 4.22Å; I21-I154 HydrophobicContact CG1-CB 4.5Å; I21-I154 HydrophobicContact CG1-CG2 3.87Å; V27-I154 HydrophobicContact CG1-CD1 3.88Å; L124-I154 HydrophobicContact CD1-CG2 4.07Å; L124-I154 HydrophobicContact CD2-CD1 4.17Å; I150-I154 HydrophobicContact CG2-CD1 4.01Å; I150-I154 HydrophobicContact CG2-CG1 4.44Å; I150-I154 WeakPolarHBondContact O-CG1 3.04Å; I150-I154 PolarHBondContact O-N 3.48Å; I154-V156 HydrophobicContact CG1-CG2 4.16Å
155	P	94.2	Very high	91.1	Very high	49 Å²	49	23.9 Å²	23.9	32%	0.318	13%	0.134	S	C	.	.			trans	-57.9	135.8	162.6	-20.1	32.5	0	0	0	109.9	K18 L19 P20	K18-P155 HydrophobicContact CB-CG 4.22Å; L19-P155 VanDerWaalsContact O-CD 3.32Å; L19-P155 WeakPolarHBondContact O-CD 3.48Å; P20-P155 HydrophobicContact CB-CG 4.47Å; P20-P155 HydrophobicContact CG-CG 4.13Å
156	V	95.9	Very high	91.2	Very high	19 Å²	19	20.9 Å²	20.9	12%	0.115	12%	0.116	C	C	.	.			trans	-123.8	121.3	-179.1	174	0	0	0	0	107.7	L29 V151 I154 G158 V159 A185	L29-V156 HydrophobicContact CD1-CB 4.48Å; L29-V156 HydrophobicContact CD1-CG1 3.9Å; L29-V156 HydrophobicContact CD1-CG2 3.7Å; L29-V156 HydrophobicContact CD2-CG2 4.45Å; L29-V156 HydrophobicContact CG-CG1 3.84Å; L29-V156 HydrophobicContact CG-CG2 4.1Å; V151-V156 HydrophobicContact CG1-CG2 4.43Å; I154-V156 HydrophobicContact CG1-CG2 4.16Å; V156-G158 WeakPolarHBondContact CG1-O 3.41Å; V156-V159 HydrophobicContact CG1-CG2 3.93Å; V156-A185 HydrophobicContact CG1-CB 4.34Å
157	D	96.8	Very high	91.2	Very high	76 Å²	76	25.1 Å²	25.1	41%	0.406	14%	0.137	S	C	.	.	S	Bend	trans	-87.4	-21.2	179.6	-60.9	-96	0	0	0	112.3	R26 V27 P186	R26-D157 WeakPolarHBondContact CA-OD2 3.41Å; R26-D157 HydrophobicContact CB-CB 4.32Å; V27-D157 PolarHBondContact N-OD2 3.31Å; V27-D157 WeakPolarHBondContact O-CB 3.22Å; V27-D157 PolarHBondContact O-N 2.96Å; D157-P186 WeakPolarHBondContact O-CG 3.28Å
158	G	96.4	Very high	91	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.1	152.8	177.8	0	0	0	0	0	113.8	V27 V28 L29 V156 P186	V27-G158 PolarHBondContact O-N 3.08Å; V28-G158 CarbonylContact C-O 3.58Å; V28-G158 WeakPolarHBondContact CA-O 3.16Å; L29-G158 PolarHBondContact N-O 3.04Å; V156-G158 WeakPolarHBondContact CG1-O 3.41Å; G158-P186 CarbonylContact C-O 3.42Å; G158-P186 WeakPolarHBondContact CA-O 3.47Å
159	V	96.7	Very high	91	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	126.7	171	-174.3	0	0	0	0	109.2	L29 A31 V156 I161 F180 A185 P186 I187 I188	L29-V159 HydrophobicContact CB-CG1 4.43Å; L29-V159 HydrophobicContact CB-CG2 4.29Å; L29-V159 HydrophobicContact CD1-CG2 4.31Å; L29-V159 CarbonylContact O-C 3.46Å; L29-V159 WeakPolarHBondContact O-CA 3.28Å; A31-V159 HydrophobicContact CB-CG1 4.1Å; V156-V159 HydrophobicContact CG1-CG2 3.93Å; V159-I161 HydrophobicContact CG1-CG1 4.36Å; V159-F180 HydrophobicContact CB-CG 4.5Å; V159-F180 HydrophobicContact CG1-CD1 4.19Å; V159-F180 HydrophobicContact CG1-CD2 3.83Å; V159-F180 HydrophobicContact CG1-CE1 4.01Å; V159-F180 HydrophobicContact CG1-CE2 3.68Å; V159-F180 HydrophobicContact CG1-CG 4.11Å; V159-F180 HydrophobicContact CG1-CZ 3.78Å; V159-F180 HydrophobicContact CG2-CD1 3.79Å; V159-F180 HydrophobicContact CG2-CE1 4.04Å; V159-F180 HydrophobicContact CG2-CG 4.15Å; V159-A185 HydrophobicContact CG2-CB 3.9Å; V159-P186 PolarHBondContact N-O 2.78Å; V159-I187 CarbonylContact O-C 3.59Å; V159-I187 WeakPolarHBondContact O-CA 3.49Å; V159-I187 WeakPolarHBondContact O-CG2 3.37Å; V159-I188 WeakPolarHBondContact O-CG1 3.3Å; V159-I188 PolarHBondContact O-N 2.8Å
160	V	96.8	Very high	91	Very high	3 Å²	3	26.6 Å²	26.6	2%	0.018	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	120.2	167.8	178.7	0	0	0	0	107.8	V28 L29 A31 L46 I188 G189 V191 L227	V28-V160 HydrophobicContact CG1-CG2 4.05Å; L29-V160 PolarHBondContact O-N 2.97Å; A31-V160 PolarHBondContact N-O 3.36Å; L46-V160 HydrophobicContact CD2-CG2 4.32Å; V160-I188 HydrophobicContact CG2-CD1 4.05Å; V160-I188 HydrophobicContact CG2-CG1 3.99Å; V160-G189 WeakPolarHBondContact CA-O 3.49Å; V160-V191 HydrophobicContact CG1-CB 4.47Å; V160-V191 HydrophobicContact CG1-CG2 3.67Å; V160-L227 HydrophobicContact CG1-CD1 4.12Å; V160-L227 HydrophobicContact CG2-CD1 4.07Å
161	I	95.1	Very high	90.8	Very high	4 Å²	4	29.2 Å²	29.2	2%	0.021	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	131.7	176	-62.3	-179.1	0	0	0	108.7	A31 V159 A173 A177 I187 G189 L190 V191 I224	A31-I161 CarbonylContact O-C 3.58Å; A31-I161 WeakPolarHBondContact O-CA 3.27Å; V159-I161 HydrophobicContact CG1-CG1 4.36Å; I161-A173 HydrophobicContact CG2-CB 4.15Å; I161-A177 HydrophobicContact CD1-CB 3.61Å; I161-I187 HydrophobicContact CD1-CD1 3.99Å; I161-I187 HydrophobicContact CD1-CG1 4.36Å; I161-I187 HydrophobicContact CD1-CG2 3.8Å; I161-I187 HydrophobicContact CG1-CG2 3.96Å; I161-G189 PolarHBondContact N-O 3.2Å; I161-L190 HydrophobicContact CB-CD1 4.06Å; I161-L190 HydrophobicContact CG2-CD1 3.88Å; I161-L190 CarbonylContact O-C 3.59Å; I161-L190 WeakPolarHBondContact O-CA 3.35Å; I161-L190 WeakPolarHBondContact O-CD1 3.46Å; I161-V191 PolarHBondContact O-N 2.83Å; I161-I224 HydrophobicContact CD1-CD1 4.48Å
162	V	94.7	Very high	90.7	Very high	2 Å²	2	31 Å²	31	1%	0.012	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	125.6	174.8	-173.8	0	0	0	0	109.1	V30 A31 S32 V37 V42 V191 N193	V30-V162 HydrophobicContact CG1-CG2 3.62Å; A31-V162 PolarHBondContact O-N 3.3Å; S32-V162 WeakPolarHBondContact CB-O 3.48Å; V37-V162 HydrophobicContact CG2-CB 4.38Å; V37-V162 HydrophobicContact CG2-CG1 4.04Å; V42-V162 HydrophobicContact CB-CG1 4.45Å; V42-V162 HydrophobicContact CB-CG2 3.88Å; V42-V162 HydrophobicContact CG1-CG2 3.84Å; V42-V162 HydrophobicContact CG2-CG1 3.82Å; V42-V162 HydrophobicContact CG2-CG2 4.11Å; V162-V191 WeakPolarHBondContact CA-O 3.46Å; V162-N193 HydrophobicContact CG1-CB 4.12Å
163	S	92.8	Very high	90.8	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.007	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	171.2	176.2	-168	0	0	0	0	110.8	A169 V191 E192 N193	S163-A169 PolarHBondContact OG-O 2.89Å; S163-V191 PolarHBondContact N-O 2.79Å; S163-E192 CarbonylContact O-C 3.56Å; S163-E192 WeakPolarHBondContact O-CA 3.13Å; S163-N193 PolarHBondContact O-N 3.05Å
164	T	88	Confident	91	Very high	3 Å²	3	30.2 Å²	30.2	2%	0.018	17%	0.167	C	C	.	.			trans	-107.4	165.3	161.6	66	0	0	0	0	108.9	V37 Q166 A169 N193 M194 Y209	V37-T164 HydrophobicContact CB-CG2 4.28Å; V37-T164 HydrophobicContact CG1-CG2 4.28Å; T164-Q166 PolarHBondContact O-N 3Å; T164-A169 VanDerWaalsContact OG1-CB 3.27Å; T164-A169 WeakPolarHBondContact OG1-CB 3.34Å; T164-N193 WeakPolarHBondContact CG2-O 3.44Å; T164-M194 HydrophobicContact CG2-CB 4.36Å; T164-M194 HydrophobicContact CG2-SD 4.45Å; T164-Y209 HydrophobicContact CG2-CE2 4.34Å
165	A	83.6	Confident	90.9	Very high	9 Å²	9	37.9 Å²	37.9	7%	0.074	20%	0.196	C	C	.	.	S	Bend	trans	-72.4	4.1	174.4	0	0	0	0	0	114.5	D167 E192 Y209	A165-D167 PolarHBondContact O-N 2.67Å; A165-E192 WeakPolarHBondContact CB-OE1 3.46Å; A165-Y209 HydrophobicContact CB-CD2 4.3Å; A165-Y209 HydrophobicContact CB-CG 4.49Å
166	Q	84.7	Confident	90.7	Very high	70 Å²	70	35.8 Å²	35.8	33%	0.327	18%	0.183	S	C	.	.	S	Bend	trans	-65.9	132	171.9	-65.1	178.3	-17.6	0	0	110.7	T164 V168 A169 L170 Y209	T164-Q166 PolarHBondContact O-N 3Å; Q166-V168 PolarHBondContact O-N 3.28Å; Q166-V168 VanDerWaalsContact O-N 3.1Å; Q166-A169 HydrophobicContact CB-CB 4.14Å; Q166-A169 WeakPolarHBondContact O-CA 3.43Å; Q166-A169 VanDerWaalsContact O-CB 3.31Å; Q166-A169 WeakPolarHBondContact O-CB 3.19Å; Q166-A169 PolarHBondContact O-N 3.37Å; Q166-L170 PolarHBondContact O-N 3.48Å; Q166-Y209 HydrophobicContact CG-CD1 3.43Å; Q166-Y209 VanDerWaalsContact CG-CD1 3.43Å; Q166-Y209 HydrophobicContact CG-CD2 4.11Å; Q166-Y209 HydrophobicContact CG-CE1 3.44Å; Q166-Y209 VanDerWaalsContact CG-CE1 3.44Å; Q166-Y209 HydrophobicContact CG-CE2 4.07Å; Q166-Y209 HydrophobicContact CG-CG 3.8Å; Q166-Y209 VanDerWaalsContact NE2-CZ 3.28Å; Q166-Y209 PolarHBondContact NE2-OH 3.13Å
167	D	84.2	Confident	90.6	Very high	116 Å²	116	34.9 Å²	34.9	62%	0.62	18%	0.178	S	C	*	.	H	α-helix	trans	-50.4	-42.1	-179.4	-69.9	-24.2	0	0	0	113.5	A165 A169 L170 S171	A165-D167 PolarHBondContact O-N 2.67Å; D167-A169 PolarHBondContact O-N 3.29Å; D167-L170 PolarHBondContact O-N 3.18Å; D167-S171 WeakPolarHBondContact O-CB 3.4Å; D167-S171 PolarHBondContact O-N 2.94Å
168	V	85.2	Confident	90.4	Very high	97 Å²	97	33.5 Å²	33.5	59%	0.588	17%	0.169	S	C	*	.	H	α-helix	trans	-62.8	-43.2	177.5	-177.3	0	0	0	0	111	Q166 S171 D172	Q166-V168 PolarHBondContact O-N 3.28Å; Q166-V168 VanDerWaalsContact O-N 3.1Å; V168-S171 PolarHBondContact O-N 2.95Å; V168-D172 PolarHBondContact O-N 2.91Å
169	A	85.8	Confident	90.1	Very high	3 Å²	3	34.7 Å²	34.7	3%	0.025	18%	0.175	C	C	.	.	H	α-helix	trans	-64.1	-42.8	177.7	0	0	0	0	0	111.7	K34 S163 T164 Q166 D167 D172 A173	K34-A169 HydrophobicContact CD-CB 4.34Å; K34-A169 VanDerWaalsContact CE-CB 3.43Å; S163-A169 PolarHBondContact OG-O 2.89Å; T164-A169 VanDerWaalsContact OG1-CB 3.27Å; T164-A169 WeakPolarHBondContact OG1-CB 3.34Å; Q166-A169 HydrophobicContact CB-CB 4.14Å; Q166-A169 WeakPolarHBondContact O-CA 3.43Å; Q166-A169 VanDerWaalsContact O-CB 3.31Å; Q166-A169 WeakPolarHBondContact O-CB 3.19Å; Q166-A169 PolarHBondContact O-N 3.37Å; D167-A169 PolarHBondContact O-N 3.29Å; A169-D172 PolarHBondContact O-N 2.94Å; A169-A173 WeakPolarHBondContact O-CB 3.43Å; A169-A173 PolarHBondContact O-N 3.25Å
170	L	86.8	Confident	90	Very high	10 Å²	10	34.8 Å²	34.8	5%	0.052	18%	0.175	C	C	.	.	H	α-helix	trans	-67	-40.1	178.5	-67.6	177.1	0	0	0	112.3	Q166 D167 D172 A173 R174 Q214 L215	Q166-L170 PolarHBondContact O-N 3.48Å; D167-L170 PolarHBondContact O-N 3.18Å; L170-D172 VanDerWaalsContact C-N 3.32Å; L170-D172 PolarHBondContact O-N 3.43Å; L170-A173 PolarHBondContact O-N 2.82Å; L170-R174 WeakPolarHBondContact O-CB 3.31Å; L170-R174 PolarHBondContact O-N 2.85Å; L170-Q214 HydrophobicContact CD1-CB 3.49Å; L170-Q214 VanDerWaalsContact CD1-CB 3.49Å; L170-L215 HydrophobicContact CD2-CD1 3.64Å
171	S	87.4	Confident	89.7	Confident	58 Å²	58	42.3 Å²	42.3	41%	0.406	20%	0.203	S	C	.	.	H	α-helix	trans	-60.4	-42.4	173.4	173.8	0	0	0	0	111.6	D167 V168 R174 R175	D167-S171 WeakPolarHBondContact O-CB 3.4Å; D167-S171 PolarHBondContact O-N 2.94Å; V168-S171 PolarHBondContact O-N 2.95Å; S171-R174 WeakPolarHBondContact O-CB 3.26Å; S171-R175 PolarHBondContact O-N 3.07Å
172	D	90.1	Very high	89.4	Confident	37 Å²	37	50.3 Å²	50.3	20%	0.198	24%	0.238	C	C	.	.	H	α-helix	trans	-67.5	-45.8	175.1	-68.4	-27.9	0	0	0	110.8	A33 V168 A169 L170 R174 R175 G176	A33-D172 HydrophobicContact CB-CB 3.56Å; A33-D172 WeakPolarHBondContact CB-O 3.3Å; V168-D172 PolarHBondContact O-N 2.91Å; A169-D172 PolarHBondContact O-N 2.94Å; L170-D172 VanDerWaalsContact C-N 3.32Å; L170-D172 PolarHBondContact O-N 3.43Å; D172-R174 PolarHBondContact O-N 3.38Å; D172-R175 WeakPolarHBondContact O-CA 3.07Å; D172-R175 WeakPolarHBondContact O-CB 3.48Å; D172-R175 PolarHBondContact O-N 3.46Å; D172-G176 PolarHBondContact O-N 3.5Å
173	A	90.9	Very high	89.1	Confident	2 Å²	2	51.8 Å²	51.8	2%	0.017	25%	0.247	C	C	.	.	H	α-helix	trans	-56.3	-36.1	178.3	0	0	0	0	0	112	I161 A169 L170 G176 A177 F218	I161-A173 HydrophobicContact CG2-CB 4.15Å; A169-A173 WeakPolarHBondContact O-CB 3.43Å; A169-A173 PolarHBondContact O-N 3.25Å; L170-A173 PolarHBondContact O-N 2.82Å; A173-G176 PolarHBondContact O-N 3.11Å; A173-A177 WeakPolarHBondContact O-CB 3.27Å; A173-A177 PolarHBondContact O-N 2.88Å; A173-F218 HydrophobicContact CB-CE2 4.16Å; A173-F218 HydrophobicContact CB-CZ 4.18Å
174	R	91.8	Very high	89	Confident	76 Å²	76	54.7 Å²	54.7	29%	0.287	28%	0.277	S	S	.	.	H	α-helix	trans	-59.6	-42.9	171.9	-178.5	-178.5	-55.9	-68.4	11.5	113	L170 S171 D172 G176 A177 E178 F218 Q221 F222	L170-R174 WeakPolarHBondContact O-CB 3.31Å; L170-R174 PolarHBondContact O-N 2.85Å; S171-R174 WeakPolarHBondContact O-CB 3.26Å; D172-R174 PolarHBondContact O-N 3.38Å; R174-G176 VanDerWaalsContact C-N 3.34Å; R174-A177 PolarHBondContact O-N 3.07Å; R174-E178 WeakPolarHBondContact O-CB 3.38Å; R174-E178 WeakPolarHBondContact O-CG 3.2Å; R174-E178 PolarHBondContact O-N 3.46Å; R174-F218 HydrophobicContact CB-CD2 4.31Å; R174-F218 HydrophobicContact CB-CE2 4.09Å; R174-Q221 VanDerWaalsContact CZ-OE1 3.25Å; R174-F222 HydrophobicContact CB-CE2 4.28Å; R174-F222 HydrophobicContact CB-CZ 4.46Å; R174-F222 HydrophobicContact CG-CE2 3.89Å; R174-F222 HydrophobicContact CG-CZ 3.82Å
175	R	90.2	Very high	89.3	Confident	161 Å²	161	54.8 Å²	54.8	61%	0.608	28%	0.278	S	S	*	.	H	α-helix	trans	-65.1	-40.9	175.3	-63.5	174.8	177.5	174.5	-2.1	111.2	T143 S171 D172 E178 M179	T143-R175 HydrophobicContact CG2-CB 4.33Å; S171-R175 PolarHBondContact O-N 3.07Å; D172-R175 WeakPolarHBondContact O-CA 3.07Å; D172-R175 WeakPolarHBondContact O-CB 3.48Å; D172-R175 PolarHBondContact O-N 3.46Å; R175-E178 PolarHBondContact O-N 3.16Å; R175-M179 PolarHBondContact O-N 3.32Å
176	G	91.5	Very high	89.8	Confident	5 Å²	5	57.2 Å²	57.2	5%	0.052	29%	0.293	C	S	.	.	H	α-helix	trans	-62.6	-47.3	175.3	0	0	0	0	0	112.9	D172 A173 R174 E178 M179 F180	D172-G176 PolarHBondContact O-N 3.5Å; A173-G176 PolarHBondContact O-N 3.11Å; R174-G176 VanDerWaalsContact C-N 3.34Å; G176-E178 VanDerWaalsContact C-N 3.35Å; G176-E178 PolarHBondContact O-N 2.93Å; G176-M179 WeakPolarHBondContact O-CB 3.44Å; G176-M179 PolarHBondContact O-N 2.93Å; G176-M179 VanDerWaalsContact O-N 3.13Å; G176-F180 WeakPolarHBondContact O-CD2 3.37Å; G176-F180 PolarHBondContact O-N 3.45Å
177	A	92.9	Very high	90.3	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-58.8	-45.2	176.4	0	0	0	0	0	111.8	I161 A173 R174 M179 F180 R181 I187 F218 F222	I161-A177 HydrophobicContact CD1-CB 3.61Å; A173-A177 WeakPolarHBondContact O-CB 3.27Å; A173-A177 PolarHBondContact O-N 2.88Å; R174-A177 PolarHBondContact O-N 3.07Å; A177-M179 VanDerWaalsContact C-N 3.31Å; A177-M179 PolarHBondContact O-N 2.86Å; A177-F180 PolarHBondContact O-N 3.47Å; A177-R181 PolarHBondContact O-N 3.21Å; A177-I187 HydrophobicContact CB-CD1 3.81Å; A177-F218 HydrophobicContact CB-CE2 4.39Å; A177-F218 HydrophobicContact CB-CZ 4.15Å; A177-F222 HydrophobicContact CB-CD1 3.87Å; A177-F222 HydrophobicContact CB-CD2 4.19Å; A177-F222 HydrophobicContact CB-CE1 3.61Å; A177-F222 HydrophobicContact CB-CE2 3.95Å; A177-F222 HydrophobicContact CB-CG 4.16Å; A177-F222 HydrophobicContact CB-CZ 3.66Å
178	E	92.5	Very high	90.8	Very high	46 Å²	46	53.5 Å²	53.5	22%	0.215	27%	0.274	C	S	.	.	H	α-helix	trans	-60.3	-38.8	174.6	-79	-62.1	154.9	0	0	113	R174 R175 G176 R181 K182 F222	R174-E178 WeakPolarHBondContact O-CB 3.38Å; R174-E178 WeakPolarHBondContact O-CG 3.2Å; R174-E178 PolarHBondContact O-N 3.46Å; R175-E178 PolarHBondContact O-N 3.16Å; G176-E178 VanDerWaalsContact C-N 3.35Å; G176-E178 PolarHBondContact O-N 2.93Å; E178-R181 PolarHBondContact O-N 3.33Å; E178-R181 IonicContact OE1-CZ 3.27Å; E178-R181 IonicContact OE1-NE 3.14Å; E178-R181 IonicContact OE1-NH2 2.7Å; E178-R181 PolarHBondContact OE1-NH2 2.79Å; E178-R181 IonicContact OE2-CZ 2.92Å; E178-R181 VanDerWaalsContact OE2-CZ 3.27Å; E178-R181 IonicContact OE2-NE 2.66Å; E178-R181 PolarHBondContact OE2-NE 3.33Å; E178-R181 VanDerWaalsContact OE2-NE 3.14Å; E178-R181 IonicContact OE2-NH2 3.43Å; E178-R181 PolarHBondContact OE2-NH2 3.18Å; E178-K182 WeakPolarHBondContact O-CB 3.31Å; E178-K182 VanDerWaalsContact O-CG 3.3Å; E178-K182 WeakPolarHBondContact O-CG 3.41Å; E178-K182 PolarHBondContact O-N 3.1Å; E178-F222 HydrophobicContact CG-CE1 3.98Å; E178-F222 HydrophobicContact CG-CZ 4Å; E178-F222 WeakPolarHBondContact OE1-CE1 3.35Å
179	M	91.3	Very high	91.2	Very high	26 Å²	26	48.9 Å²	48.9	13%	0.128	25%	0.246	C	C	.	.	H	α-helix	trans	-60.7	-50.5	174.9	-175.7	-165.6	69.4	0	0	111	Q147 R175 G176 A177 R181 K182 V183	Q147-M179 HydrophobicContact CB-CE 4.01Å; Q147-M179 VanDerWaalsContact OE1-CE 3.22Å; R175-M179 PolarHBondContact O-N 3.32Å; G176-M179 WeakPolarHBondContact O-CB 3.44Å; G176-M179 PolarHBondContact O-N 2.93Å; G176-M179 VanDerWaalsContact O-N 3.13Å; A177-M179 VanDerWaalsContact C-N 3.31Å; A177-M179 PolarHBondContact O-N 2.86Å; M179-R181 VanDerWaalsContact C-N 3.33Å; M179-R181 PolarHBondContact O-N 3.1Å; M179-K182 PolarHBondContact O-N 3.03Å; M179-V183 WeakPolarHBondContact O-CG2 3.27Å; M179-V183 PolarHBondContact O-N 2.88Å
180	F	92.9	Very high	91.6	Very high	2 Å²	2	48.7 Å²	48.7	1%	0.009	25%	0.245	C	C	.	.	H	α-helix	trans	-61	-40.8	178.8	-70.2	-62.9	0	0	0	112.4	L29 A31 V151 V159 G176 A177 K182 V183 G184 A185 I187	L29-F180 HydrophobicContact CD1-CE1 4.4Å; A31-F180 HydrophobicContact CB-CE2 3.6Å; A31-F180 HydrophobicContact CB-CZ 3.45Å; A31-F180 VanDerWaalsContact CB-CZ 3.45Å; V151-F180 HydrophobicContact CG2-CD1 4Å; V151-F180 HydrophobicContact CG2-CE1 3.6Å; V159-F180 HydrophobicContact CB-CG 4.5Å; V159-F180 HydrophobicContact CG1-CD1 4.19Å; V159-F180 HydrophobicContact CG1-CD2 3.83Å; V159-F180 HydrophobicContact CG1-CE1 4.01Å; V159-F180 HydrophobicContact CG1-CE2 3.68Å; V159-F180 HydrophobicContact CG1-CG 4.11Å; V159-F180 HydrophobicContact CG1-CZ 3.78Å; V159-F180 HydrophobicContact CG2-CD1 3.79Å; V159-F180 HydrophobicContact CG2-CE1 4.04Å; V159-F180 HydrophobicContact CG2-CG 4.15Å; G176-F180 WeakPolarHBondContact O-CD2 3.37Å; G176-F180 PolarHBondContact O-N 3.45Å; A177-F180 PolarHBondContact O-N 3.47Å; F180-K182 PolarHBondContact O-N 3.34Å; F180-V183 VanDerWaalsContact O-CG2 3.29Å; F180-V183 WeakPolarHBondContact O-CG2 3.34Å; F180-V183 PolarHBondContact O-N 3.38Å; F180-G184 PolarHBondContact O-N 3.49Å; F180-G184 VanDerWaalsContact O-N 3.12Å; F180-A185 HydrophobicContact CB-CB 4.25Å; F180-A185 HydrophobicContact CD1-CB 4Å; F180-A185 PolarHBondContact O-N 3.19Å; F180-I187 HydrophobicContact CB-CD1 4.17Å; F180-I187 HydrophobicContact CB-CG1 3.99Å
181	R	90.7	Very high	91.9	Very high	160 Å²	160	49.2 Å²	49.2	60%	0.604	25%	0.248	S	C	*	.	H	α-helix	trans	-58.9	-45.7	174.1	-171.6	175.4	72.6	152.9	0.7	111.9	A177 E178 M179 V183 G184	A177-R181 PolarHBondContact O-N 3.21Å; E178-R181 PolarHBondContact O-N 3.33Å; E178-R181 IonicContact OE1-CZ 3.27Å; E178-R181 IonicContact OE1-NE 3.14Å; E178-R181 IonicContact OE1-NH2 2.7Å; E178-R181 PolarHBondContact OE1-NH2 2.79Å; E178-R181 IonicContact OE2-CZ 2.92Å; E178-R181 VanDerWaalsContact OE2-CZ 3.27Å; E178-R181 IonicContact OE2-NE 2.66Å; E178-R181 PolarHBondContact OE2-NE 3.33Å; E178-R181 VanDerWaalsContact OE2-NE 3.14Å; E178-R181 IonicContact OE2-NH2 3.43Å; E178-R181 PolarHBondContact OE2-NH2 3.18Å; M179-R181 VanDerWaalsContact C-N 3.33Å; M179-R181 PolarHBondContact O-N 3.1Å; R181-V183 VanDerWaalsContact C-N 3.26Å; R181-V183 PolarHBondContact O-N 3.08Å; R181-G184 PolarHBondContact O-N 3.29Å
182	K	89.4	Confident	92.1	Very high	173 Å²	173	46.6 Å²	46.6	75%	0.752	23%	0.23	S	C	*	.	H	α-helix	trans	-63.5	-29.2	179.5	-76.3	176.3	179.8	-179	0	113.7	E178 M179 F180	E178-K182 WeakPolarHBondContact O-CB 3.31Å; E178-K182 VanDerWaalsContact O-CG 3.3Å; E178-K182 WeakPolarHBondContact O-CG 3.41Å; E178-K182 PolarHBondContact O-N 3.1Å; M179-K182 PolarHBondContact O-N 3.03Å; F180-K182 PolarHBondContact O-N 3.34Å
183	V	89.2	Confident	92.1	Very high	33 Å²	33	45.3 Å²	45.3	20%	0.2	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	6.9	178.9	-56.9	0	0	0	0	113.5	L148 V151 M179 F180 R181 A185	L148-V183 HydrophobicContact CD1-CG1 3.42Å; L148-V183 VanDerWaalsContact CD1-CG1 3.42Å; V151-V183 HydrophobicContact CB-CG2 4.3Å; V151-V183 HydrophobicContact CG1-CB 4.2Å; V151-V183 HydrophobicContact CG1-CG2 3.4Å; V151-V183 VanDerWaalsContact CG1-CG2 3.4Å; M179-V183 WeakPolarHBondContact O-CG2 3.27Å; M179-V183 PolarHBondContact O-N 2.88Å; F180-V183 VanDerWaalsContact O-CG2 3.29Å; F180-V183 WeakPolarHBondContact O-CG2 3.34Å; F180-V183 PolarHBondContact O-N 3.38Å; R181-V183 VanDerWaalsContact C-N 3.26Å; R181-V183 PolarHBondContact O-N 3.08Å; V183-A185 VanDerWaalsContact C-N 3.3Å; V183-A185 HydrophobicContact CG2-CB 4.2Å; V183-A185 PolarHBondContact O-N 2.92Å
184	G	90.5	Very high	91.8	Very high	61 Å²	61	47.2 Å²	47.2	63%	0.629	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.1	25.9	177	0	0	0	0	0	114.2	F180 R181	F180-G184 PolarHBondContact O-N 3.49Å; F180-G184 VanDerWaalsContact O-N 3.12Å; R181-G184 PolarHBondContact O-N 3.29Å
185	A	93.1	Very high	91.5	Very high	5 Å²	5	44 Å²	44	4%	0.041	22%	0.221	C	C	.	.			trans	-86.9	122.3	172.6	0	0	0	0	0	109.4	V151 V156 V159 F180 V183 I187	V151-A185 HydrophobicContact CG1-CB 3.78Å; V156-A185 HydrophobicContact CG1-CB 4.34Å; V159-A185 HydrophobicContact CG2-CB 3.9Å; F180-A185 HydrophobicContact CB-CB 4.25Å; F180-A185 HydrophobicContact CD1-CB 4Å; F180-A185 PolarHBondContact O-N 3.19Å; V183-A185 VanDerWaalsContact C-N 3.3Å; V183-A185 HydrophobicContact CG2-CB 4.2Å; V183-A185 PolarHBondContact O-N 2.92Å; A185-I187 PolarHBondContact O-N 2.62Å
186	P	94.1	Very high	91.1	Very high	61 Å²	61	37.1 Å²	37.1	40%	0.396	20%	0.197	S	C	.	.			trans	-69.8	125	-177.1	27	-32.6	0	0	0	110.4	D157 G158 V159 I188	D157-P186 WeakPolarHBondContact O-CG 3.28Å; G158-P186 CarbonylContact C-O 3.42Å; G158-P186 WeakPolarHBondContact CA-O 3.47Å; V159-P186 PolarHBondContact N-O 2.78Å; P186-I188 PolarHBondContact O-N 3.32Å
187	I	95	Very high	90.9	Very high	34 Å²	34	39.5 Å²	39.5	17%	0.174	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	113	173.4	-53.2	164	0	0	0	107.3	V159 I161 A177 F180 A185 I224	V159-I187 CarbonylContact O-C 3.59Å; V159-I187 WeakPolarHBondContact O-CA 3.49Å; V159-I187 WeakPolarHBondContact O-CG2 3.37Å; I161-I187 HydrophobicContact CD1-CD1 3.99Å; I161-I187 HydrophobicContact CD1-CG1 4.36Å; I161-I187 HydrophobicContact CD1-CG2 3.8Å; I161-I187 HydrophobicContact CG1-CG2 3.96Å; A177-I187 HydrophobicContact CB-CD1 3.81Å; F180-I187 HydrophobicContact CB-CD1 4.17Å; F180-I187 HydrophobicContact CB-CG1 3.99Å; A185-I187 PolarHBondContact O-N 2.62Å; I187-I224 HydrophobicContact CB-CD1 3.99Å; I187-I224 HydrophobicContact CB-CG1 4.09Å; I187-I224 HydrophobicContact CD1-CD1 4.02Å; I187-I224 HydrophobicContact CG2-CD1 3.42Å; I187-I224 VanDerWaalsContact CG2-CD1 3.42Å; I187-I224 HydrophobicContact CG2-CG1 3.78Å; I187-I224 HydrophobicContact CG2-CG2 4.04Å
188	I	94.8	Very high	90.5	Very high	73 Å²	73	42.1 Å²	42.1	37%	0.374	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	-12.8	-173.6	59.3	166	0	0	0	112.5	V28 V159 V160 P186	V28-I188 HydrophobicContact CG1-CD1 4.17Å; V28-I188 HydrophobicContact CG2-CD1 4.11Å; V159-I188 WeakPolarHBondContact O-CG1 3.3Å; V159-I188 PolarHBondContact O-N 2.8Å; V160-I188 HydrophobicContact CG2-CD1 4.05Å; V160-I188 HydrophobicContact CG2-CG1 3.99Å; P186-I188 PolarHBondContact O-N 3.32Å
189	G	94.3	Very high	90.2	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-178.1	162.2	179.4	0	0	0	0	0	115.7	V160 I161 N225	V160-G189 WeakPolarHBondContact CA-O 3.49Å; I161-G189 PolarHBondContact N-O 3.2Å; G189-N225 CarbonylContact C-O 3.55Å; G189-N225 VanDerWaalsContact CA-O 3.26Å; G189-N225 WeakPolarHBondContact CA-O 3.35Å
190	L	93.7	Very high	89.8	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	135	171.4	177.8	65.1	0	0	0	108.7	I161 L215 F218 A219 I224 N225 L226 L227	I161-L190 HydrophobicContact CB-CD1 4.06Å; I161-L190 HydrophobicContact CG2-CD1 3.88Å; I161-L190 CarbonylContact O-C 3.59Å; I161-L190 WeakPolarHBondContact O-CA 3.35Å; I161-L190 WeakPolarHBondContact O-CD1 3.46Å; L190-L215 HydrophobicContact CD2-CD1 3.47Å; L190-L215 VanDerWaalsContact CD2-CD1 3.47Å; L190-L215 HydrophobicContact CD2-CG 3.87Å; L190-L215 HydrophobicContact CG-CD1 4.15Å; L190-F218 HydrophobicContact CD1-CD1 4.33Å; L190-F218 HydrophobicContact CD1-CE1 3.73Å; L190-F218 HydrophobicContact CD2-CD1 3.37Å; L190-F218 HydrophobicContact CD2-CE1 3.55Å; L190-F218 HydrophobicContact CG-CD1 4.42Å; L190-F218 HydrophobicContact CG-CE1 4.15Å; L190-A219 HydrophobicContact CD2-CB 4.35Å; L190-I224 HydrophobicContact CB-CG2 4.1Å; L190-N225 PolarHBondContact N-O 2.91Å; L190-L226 HydrophobicContact CB-CD1 4.42Å; L190-L226 HydrophobicContact CD2-CD1 4.27Å; L190-L226 HydrophobicContact CG-CD1 4.23Å; L190-L227 PolarHBondContact O-N 2.8Å
191	V	93.4	Very high	89.5	Confident	20 Å²	20	52.7 Å²	52.7	12%	0.121	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	122	170.1	176.2	0	0	0	0	107.8	V42 V160 I161 V162 S163 L227	V42-V191 HydrophobicContact CG1-CB 4.21Å; V42-V191 HydrophobicContact CG1-CG1 4.03Å; V42-V191 HydrophobicContact CG1-CG2 4.09Å; V42-V191 HydrophobicContact CG2-CG1 3.89Å; V160-V191 HydrophobicContact CG1-CB 4.47Å; V160-V191 HydrophobicContact CG1-CG2 3.67Å; I161-V191 PolarHBondContact O-N 2.83Å; V162-V191 WeakPolarHBondContact CA-O 3.46Å; S163-V191 PolarHBondContact N-O 2.79Å; V191-L227 HydrophobicContact CG2-CB 4.14Å; V191-L227 HydrophobicContact CG2-CD1 4.28Å
192	E	92.2	Very high	89.5	Confident	4 Å²	4	49 Å²	49	2%	0.019	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	122.1	165.9	-176	-172.3	-160.2	0	0	108.4	S163 A165 A195 L215 G228 S229 A230	S163-E192 CarbonylContact O-C 3.56Å; S163-E192 WeakPolarHBondContact O-CA 3.13Å; A165-E192 WeakPolarHBondContact CB-OE1 3.46Å; E192-A195 VanDerWaalsContact CD-CB 3.42Å; E192-A195 HydrophobicContact CG-CB 3.93Å; E192-A195 WeakPolarHBondContact OE2-CB 3.23Å; E192-L215 HydrophobicContact CB-CD1 4.31Å; E192-L215 HydrophobicContact CB-CD2 3.65Å; E192-L215 HydrophobicContact CG-CD2 4.01Å; E192-G228 PolarHBondContact N-O 2.77Å; E192-G228 VanDerWaalsContact N-O 3.07Å; E192-S229 CarbonylContact O-C 3.57Å; E192-S229 VanDerWaalsContact O-CA 3.24Å; E192-S229 WeakPolarHBondContact O-CA 3.24Å; E192-S229 WeakPolarHBondContact OE2-CB 3.4Å; E192-S229 PolarHBondContact OE2-OG 2.84Å; E192-A230 PolarHBondContact O-N 3.07Å
193	N	89.9	Confident	89.2	Confident	10 Å²	10	46.4 Å²	46.4	5%	0.053	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	157.4	172	-163.4	20	0	0	0	110.5	V37 G38 V42 V162 S163 T164 A195 A230	V37-N193 WeakPolarHBondContact O-CB 3.3Å; V37-N193 PolarHBondContact O-ND2 2.74Å; G38-N193 WeakPolarHBondContact CA-ND2 3.49Å; V42-N193 HydrophobicContact CG2-CB 4.45Å; V162-N193 HydrophobicContact CG1-CB 4.12Å; S163-N193 PolarHBondContact O-N 3.05Å; T164-N193 WeakPolarHBondContact CG2-O 3.44Å; N193-A195 PolarHBondContact O-N 3.47Å; N193-A230 WeakPolarHBondContact OD1-CB 3.45Å
194	M	85.3	Confident	89.2	Confident	41 Å²	41	50.8 Å²	50.8	20%	0.202	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	55.4	38.7	-179.3	-47.1	-177.3	175.5	0	0	112.4	T164 L208 Y209 A230 F232	T164-M194 HydrophobicContact CG2-CB 4.36Å; T164-M194 HydrophobicContact CG2-SD 4.45Å; M194-L208 HydrophobicContact CB-CD1 4.38Å; M194-L208 WeakPolarHBondContact O-CD1 3.32Å; M194-Y209 HydrophobicContact CB-CE2 4.28Å; M194-Y209 VanDerWaalsContact O-CE2 3.3Å; M194-Y209 WeakPolarHBondContact O-CE2 3.1Å; M194-A230 PolarHBondContact N-O 2.72Å; M194-A230 VanDerWaalsContact N-O 3.12Å; M194-F232 HydrophobicContact CB-CB 4.28Å; M194-F232 HydrophobicContact CB-CD2 4.18Å; M194-F232 HydrophobicContact CG-CD2 3.91Å; M194-F232 HydrophobicContact SD-CD2 4.06Å; M194-F232 HydrophobicContact SD-CE2 4.33Å
195	A	83.9	Confident	89	Confident	8 Å²	8	53.7 Å²	53.7	7%	0.066	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	-46.5	-176.6	0	0	0	0	0	111.6	E192 N193 L208 A230	E192-A195 VanDerWaalsContact CD-CB 3.42Å; E192-A195 HydrophobicContact CG-CB 3.93Å; E192-A195 WeakPolarHBondContact OE2-CB 3.23Å; N193-A195 PolarHBondContact O-N 3.47Å; A195-L208 PolarHBondContact O-N 3.15Å; A195-A230 PolarHBondContact N-O 2.85Å
196	T	83.2	Confident	88.6	Confident	17 Å²	17	57 Å²	57	10%	0.104	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	133.1	-172.4	-56.3	0	0	0	0	109.9	E205 T206 L231 F232	T196-E205 HydrophobicContact CG2-CB 3.64Å; T196-E205 HydrophobicContact CG2-CG 3.92Å; T196-T206 CarbonylContact C-O 3.58Å; T196-T206 WeakPolarHBondContact CA-O 3.4Å; T196-L231 HydrophobicContact CG2-CD2 4.11Å; T196-L231 CarbonylContact O-C 3.55Å; T196-L231 WeakPolarHBondContact O-CA 3.48Å; T196-F232 PolarHBondContact O-N 3.4Å
197	F	86	Confident	88.2	Confident	55 Å²	55	59.2 Å²	59.2	24%	0.241	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	126.7	167.2	172.9	-114	0	0	0	109.7	C199 T206 L208 F232	F197-C199 HydrophobicContact CE1-CB 4.28Å; F197-T206 PolarHBondContact N-O 3.44Å; F197-T206 PolarHBondContact O-N 3.45Å; F197-L208 HydrophobicContact CB-CD1 4.33Å; F197-L208 HydrophobicContact CB-CD2 3.87Å; F197-L208 HydrophobicContact CB-CG 4.08Å; F197-F232 AromaticContact CD2-CD1 3.79Å; F197-F232 HydrophobicContact CD2-CD1 3.79Å; F197-F232 HydrophobicContact CD2-CE1 4.48Å; F197-F232 HydrophobicContact CE2-CD1 4.48Å
198	L	85.9	Confident	87.6	Confident	55 Å²	55	60.7 Å²	60.7	29%	0.288	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	115.9	172.3	-174.5	69.8	0	0	0	108.9	P200 N203 E205	L198-P200 WeakPolarHBondContact O-CD 3.41Å; L198-N203 HydrophobicContact CD1-CB 4.27Å; L198-N203 WeakPolarHBondContact CD1-O 3.39Å; L198-E205 HydrophobicContact CD1-CG 3.7Å
199	C	84.8	Confident	86.9	Confident	28 Å²	28	60.9 Å²	60.9	19%	0.189	32%	0.315	C	S	.	.			trans	-65.5	121	179.9	179.8	0	0	0	0	110.4	F197 H201 C202 N203 E204	F197-C199 HydrophobicContact CE1-CB 4.28Å; C199-H201 PolarHBondContact O-N 2.82Å; C199-H201 VanDerWaalsContact O-N 3.13Å; C199-C202 VanDerWaalsContact CB-SG 3.55Å; C199-C202 PolarHBondContact O-N 3.38Å; C199-C202 PolarHBondContact SG-SG 3.05Å; C199-N203 VanDerWaalsContact O-CA 3.24Å; C199-N203 WeakPolarHBondContact O-CA 3.45Å; C199-N203 PolarHBondContact O-N 2.81Å; C199-E204 HydrophobicContact CB-CB 4.39Å; C199-E204 PolarHBondContact N-O 2.81Å
200	P	83.8	Confident	85.9	Confident	91 Å²	91	63 Å²	63	59%	0.591	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-11.5	-176.9	29.4	-36.2	0	0	0	113.8	L198	L198-P200 WeakPolarHBondContact O-CD 3.41Å
201	H	86.4	Confident	85.2	Confident	178 Å²	178	66.7 Å²	66.7	82%	0.824	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-32.6	-178.4	-64.7	-67.3	0	0	0	113.3	C199	C199-H201 PolarHBondContact O-N 2.82Å; C199-H201 VanDerWaalsContact O-N 3.13Å
202	C	90	Very high	84.7	Confident	83 Å²	83	67.3 Å²	67.3	56%	0.561	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.5	-3.2	-175.2	62.6	0	0	0	0	114.6	C199 E204	C199-C202 VanDerWaalsContact CB-SG 3.55Å; C199-C202 PolarHBondContact O-N 3.38Å; C199-C202 PolarHBondContact SG-SG 3.05Å; C202-E204 PolarHBondContact O-N 2.98Å; C202-E204 WeakPolarHBondContact SG-CB 3.44Å
203	N	84.4	Confident	84.4	Confident	118 Å²	118	72 Å²	72	63%	0.631	39%	0.387	S	S	*	.			trans	58.4	17.9	-173	-60.4	-35.7	0	0	0	114.8	L198 C199	L198-N203 HydrophobicContact CD1-CB 4.27Å; L198-N203 WeakPolarHBondContact CD1-O 3.39Å; C199-N203 VanDerWaalsContact O-CA 3.24Å; C199-N203 WeakPolarHBondContact O-CA 3.45Å; C199-N203 PolarHBondContact O-N 2.81Å
204	E	87.8	Confident	84.2	Confident	124 Å²	124	75.8 Å²	75.8	58%	0.579	40%	0.404	S	S	*	.			trans	-67.6	134.4	172.5	-170	65.1	-151.6	0	0	110.1	C199 C202	C199-E204 HydrophobicContact CB-CB 4.39Å; C199-E204 PolarHBondContact N-O 2.81Å; C202-E204 PolarHBondContact O-N 2.98Å; C202-E204 WeakPolarHBondContact SG-CB 3.44Å
205	E	86.8	Confident	84.3	Confident	123 Å²	123	73.9 Å²	73.9	58%	0.575	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.3	125.6	177.1	-76.3	-171.5	-165.1	0	0	110.8	T196 L198	T196-E205 HydrophobicContact CG2-CB 3.64Å; T196-E205 HydrophobicContact CG2-CG 3.92Å; L198-E205 HydrophobicContact CD1-CG 3.7Å
206	T	85.3	Confident	84.5	Confident	74 Å²	74	79.2 Å²	79.2	45%	0.454	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	117.7	176.5	-57.4	0	0	0	0	110.1	T196 F197 L208	T196-T206 CarbonylContact C-O 3.58Å; T196-T206 WeakPolarHBondContact CA-O 3.4Å; F197-T206 PolarHBondContact N-O 3.44Å; F197-T206 PolarHBondContact O-N 3.45Å; T206-L208 PolarHBondContact O-N 3.36Å
207	K	84.9	Confident	84.8	Confident	107 Å²	107	83 Å²	83	47%	0.465	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	122.7	172.6	-71.5	-161.4	169.9	-158.4	0	110.4	G210 D212	K207-G210 VanDerWaalsContact CD-O 3.25Å; K207-G210 WeakPolarHBondContact CD-O 3.37Å; K207-D212 IonicContact NZ-OD1 2.8Å; K207-D212 PolarHBondContact NZ-OD1 3.24Å; K207-D212 IonicContact NZ-OD2 2.71Å; K207-D212 PolarHBondContact NZ-OD2 3.27Å
208	L	81.9	Confident	84.9	Confident	65 Å²	65	80.4 Å²	80.4	34%	0.34	42%	0.42	S	S	.	.	S	Bend	trans	-76	-29.8	-171.7	-75.4	176.6	0	0	0	113.7	M194 A195 F197 T206 F232	M194-L208 HydrophobicContact CB-CD1 4.38Å; M194-L208 WeakPolarHBondContact O-CD1 3.32Å; A195-L208 PolarHBondContact O-N 3.15Å; F197-L208 HydrophobicContact CB-CD1 4.33Å; F197-L208 HydrophobicContact CB-CD2 3.87Å; F197-L208 HydrophobicContact CB-CG 4.08Å; T206-L208 PolarHBondContact O-N 3.36Å; L208-F232 HydrophobicContact CD1-CB 3.51Å; L208-F232 HydrophobicContact CD1-CD1 4.21Å; L208-F232 HydrophobicContact CD1-CD2 4.49Å; L208-F232 HydrophobicContact CD1-CG 3.83Å
209	Y	80.3	Confident	85.2	Confident	78 Å²	78	78 Å²	78	31%	0.306	41%	0.408	S	S	.	.	S	Bend	trans	-125	19.9	-173.3	-52.5	-56.6	0	0	0	113.4	T164 A165 Q166 M194	T164-Y209 HydrophobicContact CG2-CE2 4.34Å; A165-Y209 HydrophobicContact CB-CD2 4.3Å; A165-Y209 HydrophobicContact CB-CG 4.49Å; Q166-Y209 HydrophobicContact CG-CD1 3.43Å; Q166-Y209 VanDerWaalsContact CG-CD1 3.43Å; Q166-Y209 HydrophobicContact CG-CD2 4.11Å; Q166-Y209 HydrophobicContact CG-CE1 3.44Å; Q166-Y209 VanDerWaalsContact CG-CE1 3.44Å; Q166-Y209 HydrophobicContact CG-CE2 4.07Å; Q166-Y209 HydrophobicContact CG-CG 3.8Å; Q166-Y209 VanDerWaalsContact NE2-CZ 3.28Å; Q166-Y209 PolarHBondContact NE2-OH 3.13Å; M194-Y209 HydrophobicContact CB-CE2 4.28Å; M194-Y209 VanDerWaalsContact O-CE2 3.3Å; M194-Y209 WeakPolarHBondContact O-CE2 3.1Å
210	G	74.3	Confident	85.5	Confident	45 Å²	45	82.4 Å²	82.4	46%	0.464	43%	0.43	S	S	.	.	S	Bend	trans	80.5	-125.4	176.8	0	0	0	0	0	113.2	K207	K207-G210 VanDerWaalsContact CD-O 3.25Å; K207-G210 WeakPolarHBondContact CD-O 3.37Å
211	S	79.3	Confident	85.8	Confident	77 Å²	77	83.6 Å²	83.6	54%	0.538	43%	0.428	S	S	.	.			trans	-88.6	140.3	-171.9	177.5	0	0	0	0	112.6	E213	S211-E213 PolarHBondContact O-N 2.65Å; S211-E213 VanDerWaalsContact O-N 3.13Å; S211-E213 WeakPolarHBondContact OG-CB 3.49Å; S211-E213 PolarHBondContact OG-N 2.91Å
212	D	82.3	Confident	85.9	Confident	33 Å²	33	76.4 Å²	76.4	18%	0.176	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	6.3	176.5	-37.5	-20.1	0	0	0	112	K207 Q214 L215 K216	K207-D212 IonicContact NZ-OD1 2.8Å; K207-D212 PolarHBondContact NZ-OD1 3.24Å; K207-D212 IonicContact NZ-OD2 2.71Å; K207-D212 PolarHBondContact NZ-OD2 3.27Å; D212-Q214 VanDerWaalsContact C-N 3.34Å; D212-Q214 PolarHBondContact O-N 2.8Å; D212-L215 WeakPolarHBondContact O-CB 3.31Å; D212-L215 PolarHBondContact O-N 3.06Å; D212-L215 VanDerWaalsContact O-N 3.15Å; D212-K216 WeakPolarHBondContact O-CG 3.46Å; D212-K216 PolarHBondContact O-N 3.25Å
213	E	86	Confident	85.9	Confident	101 Å²	101	81.2 Å²	81.2	47%	0.472	41%	0.408	S	S	.	.	H	α-helix	trans	-58.3	-42.7	-175.3	-171.5	-172.2	157.9	0	0	112.6	S211 L215 K216 K217	S211-E213 PolarHBondContact O-N 2.65Å; S211-E213 VanDerWaalsContact O-N 3.13Å; S211-E213 WeakPolarHBondContact OG-CB 3.49Å; S211-E213 PolarHBondContact OG-N 2.91Å; E213-L215 VanDerWaalsContact C-N 3.32Å; E213-L215 PolarHBondContact O-N 3.11Å; E213-K216 PolarHBondContact O-N 3.2Å; E213-K217 HydrophobicContact CG-CD 4.35Å; E213-K217 WeakPolarHBondContact O-CB 3.36Å; E213-K217 WeakPolarHBondContact O-CG 3.25Å; E213-K217 PolarHBondContact O-N 2.97Å; E213-K217 VanDerWaalsContact OE1-CE 3.3Å; E213-K217 WeakPolarHBondContact OE1-CE 3.43Å; E213-K217 IonicContact OE1-NZ 3.61Å; E213-K217 PolarHBondContact OE1-NZ 3.36Å
214	Q	85.9	Confident	86.2	Confident	90 Å²	90	76 Å²	76	42%	0.421	38%	0.381	S	S	.	.	H	α-helix	trans	-66.8	-36.5	178.3	-65.9	-63.2	-20.1	0	0	111.8	L170 D212 F218	L170-Q214 HydrophobicContact CD1-CB 3.49Å; L170-Q214 VanDerWaalsContact CD1-CB 3.49Å; D212-Q214 VanDerWaalsContact C-N 3.34Å; D212-Q214 PolarHBondContact O-N 2.8Å; Q214-F218 WeakPolarHBondContact O-CB 3.38Å; Q214-F218 PolarHBondContact O-N 3.26Å
215	L	87.1	Confident	86.3	Confident	1 Å²	1	75.9 Å²	75.9	1%	0.005	38%	0.384	C	S	.	.	H	α-helix	trans	-66.6	-43.7	175.9	-174	82	0	0	0	111.1	L170 L190 E192 D212 E213 F218 A219 L226	L170-L215 HydrophobicContact CD2-CD1 3.64Å; L190-L215 HydrophobicContact CD2-CD1 3.47Å; L190-L215 VanDerWaalsContact CD2-CD1 3.47Å; L190-L215 HydrophobicContact CD2-CG 3.87Å; L190-L215 HydrophobicContact CG-CD1 4.15Å; E192-L215 HydrophobicContact CB-CD1 4.31Å; E192-L215 HydrophobicContact CB-CD2 3.65Å; E192-L215 HydrophobicContact CG-CD2 4.01Å; D212-L215 WeakPolarHBondContact O-CB 3.31Å; D212-L215 PolarHBondContact O-N 3.06Å; D212-L215 VanDerWaalsContact O-N 3.15Å; E213-L215 VanDerWaalsContact C-N 3.32Å; E213-L215 PolarHBondContact O-N 3.11Å; L215-F218 WeakPolarHBondContact O-CB 3.4Å; L215-F218 PolarHBondContact O-N 3.17Å; L215-A219 WeakPolarHBondContact O-CB 3.3Å; L215-A219 PolarHBondContact O-N 3.28Å; L215-L226 HydrophobicContact CD2-CD1 3.69Å; L215-L226 HydrophobicContact CD2-CD2 3.89Å; L215-L226 HydrophobicContact CD2-CG 4.47Å; L215-L226 HydrophobicContact CG-CD1 4.35Å
216	K	87.6	Confident	86.3	Confident	120 Å²	120	73.1 Å²	73.1	52%	0.522	37%	0.372	S	S	.	.	H	α-helix	trans	-62	-47.9	174.8	-71.8	177.6	-179	179.4	0	111.5	D212 E213 F218 A219 D220	D212-K216 WeakPolarHBondContact O-CG 3.46Å; D212-K216 PolarHBondContact O-N 3.25Å; E213-K216 PolarHBondContact O-N 3.2Å; K216-F218 VanDerWaalsContact C-N 3.26Å; K216-F218 PolarHBondContact O-N 2.78Å; K216-A219 WeakPolarHBondContact O-CB 3.42Å; K216-A219 PolarHBondContact O-N 3.09Å; K216-D220 WeakPolarHBondContact O-CB 3.39Å; K216-D220 PolarHBondContact O-N 3.42Å
217	K	89.5	Confident	86.4	Confident	97 Å²	97	74.1 Å²	74.1	42%	0.422	37%	0.374	S	S	.	.	H	α-helix	trans	-56.2	-40.6	174	-77.1	172.4	171.5	167.9	0	112.4	E213 Q221	E213-K217 HydrophobicContact CG-CD 4.35Å; E213-K217 WeakPolarHBondContact O-CB 3.36Å; E213-K217 WeakPolarHBondContact O-CG 3.25Å; E213-K217 PolarHBondContact O-N 2.97Å; E213-K217 VanDerWaalsContact OE1-CE 3.3Å; E213-K217 WeakPolarHBondContact OE1-CE 3.43Å; E213-K217 IonicContact OE1-NZ 3.61Å; E213-K217 PolarHBondContact OE1-NZ 3.36Å; K217-Q221 VanDerWaalsContact O-CB 3.26Å; K217-Q221 WeakPolarHBondContact O-CB 3.28Å; K217-Q221 PolarHBondContact O-N 3.25Å
218	F	89.3	Confident	86.3	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-64	-47.8	174.5	167.3	-85.2	0	0	0	111.5	A173 R174 A177 L190 Q214 L215 K216 Q221 F222 I224	A173-F218 HydrophobicContact CB-CE2 4.16Å; A173-F218 HydrophobicContact CB-CZ 4.18Å; R174-F218 HydrophobicContact CB-CD2 4.31Å; R174-F218 HydrophobicContact CB-CE2 4.09Å; A177-F218 HydrophobicContact CB-CE2 4.39Å; A177-F218 HydrophobicContact CB-CZ 4.15Å; L190-F218 HydrophobicContact CD1-CD1 4.33Å; L190-F218 HydrophobicContact CD1-CE1 3.73Å; L190-F218 HydrophobicContact CD2-CD1 3.37Å; L190-F218 HydrophobicContact CD2-CE1 3.55Å; L190-F218 HydrophobicContact CG-CD1 4.42Å; L190-F218 HydrophobicContact CG-CE1 4.15Å; Q214-F218 WeakPolarHBondContact O-CB 3.38Å; Q214-F218 PolarHBondContact O-N 3.26Å; L215-F218 WeakPolarHBondContact O-CB 3.4Å; L215-F218 PolarHBondContact O-N 3.17Å; K216-F218 VanDerWaalsContact C-N 3.26Å; K216-F218 PolarHBondContact O-N 2.78Å; F218-Q221 PolarHBondContact O-N 3.01Å; F218-F222 AromaticContact CD2-CD2 3.89Å; F218-F222 HydrophobicContact CD2-CD2 3.89Å; F218-F222 AromaticContact CD2-CE2 3.77Å; F218-F222 HydrophobicContact CD2-CE2 3.77Å; F218-F222 HydrophobicContact CE1-CD2 4.48Å; F218-F222 AromaticContact CE2-CD2 3.64Å; F218-F222 HydrophobicContact CE2-CD2 3.64Å; F218-F222 AromaticContact CE2-CE2 3.46Å; F218-F222 HydrophobicContact CE2-CE2 3.46Å; F218-F222 VanDerWaalsContact CE2-CE2 3.46Å; F218-F222 HydrophobicContact CG-CD2 4.43Å; F218-F222 AromaticContact CZ-CD2 3.96Å; F218-F222 HydrophobicContact CZ-CD2 3.96Å; F218-F222 HydrophobicContact CZ-CE2 4.16Å; F218-F222 WeakPolarHBondContact O-CD2 3.18Å; F218-F222 PolarHBondContact O-N 3.31Å; F218-I224 HydrophobicContact CE1-CD1 4.38Å
219	A	90.9	Very high	86.4	Confident	4 Å²	4	70.3 Å²	70.3	3%	0.033	37%	0.372	C	S	.	.	H	α-helix	trans	-59.4	-47.7	178.9	0	0	0	0	0	111.2	L190 L215 K216 Q221 F222 E223 I224	L190-A219 HydrophobicContact CD2-CB 4.35Å; L215-A219 WeakPolarHBondContact O-CB 3.3Å; L215-A219 PolarHBondContact O-N 3.28Å; K216-A219 WeakPolarHBondContact O-CB 3.42Å; K216-A219 PolarHBondContact O-N 3.09Å; A219-Q221 PolarHBondContact O-N 3.12Å; A219-F222 PolarHBondContact O-N 2.67Å; A219-E223 PolarHBondContact O-N 3.38Å; A219-I224 WeakPolarHBondContact CB-O 3.38Å; A219-I224 PolarHBondContact O-N 3.33Å
220	D	91.9	Very high	86.5	Confident	122 Å²	122	68.3 Å²	68.3	65%	0.652	37%	0.371	S	S	*	.	H	α-helix	trans	-60.8	-45	177.7	-65.2	-21.7	0	0	0	111.7	K216 F222 E223	K216-D220 WeakPolarHBondContact O-CB 3.39Å; K216-D220 PolarHBondContact O-N 3.42Å; D220-F222 PolarHBondContact O-N 2.79Å; D220-E223 PolarHBondContact O-N 2.95Å; D220-E223 VanDerWaalsContact O-N 3.11Å
221	Q	89.5	Confident	86.8	Confident	115 Å²	115	68.9 Å²	68.9	54%	0.537	36%	0.363	S	S	.	.	H	α-helix	trans	-61.6	-32.1	-178.5	177.2	173	-9.4	0	0	113.4	R174 K217 F218 A219	R174-Q221 VanDerWaalsContact CZ-OE1 3.25Å; K217-Q221 VanDerWaalsContact O-CB 3.26Å; K217-Q221 WeakPolarHBondContact O-CB 3.28Å; K217-Q221 PolarHBondContact O-N 3.25Å; F218-Q221 PolarHBondContact O-N 3.01Å; A219-Q221 PolarHBondContact O-N 3.12Å
222	F	88.3	Confident	86.8	Confident	28 Å²	28	68.8 Å²	68.8	12%	0.123	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101	3.2	178.7	-73.3	-78.6	0	0	0	113.1	R174 A177 E178 F218 A219 D220 I224	R174-F222 HydrophobicContact CB-CE2 4.28Å; R174-F222 HydrophobicContact CB-CZ 4.46Å; R174-F222 HydrophobicContact CG-CE2 3.89Å; R174-F222 HydrophobicContact CG-CZ 3.82Å; A177-F222 HydrophobicContact CB-CD1 3.87Å; A177-F222 HydrophobicContact CB-CD2 4.19Å; A177-F222 HydrophobicContact CB-CE1 3.61Å; A177-F222 HydrophobicContact CB-CE2 3.95Å; A177-F222 HydrophobicContact CB-CG 4.16Å; A177-F222 HydrophobicContact CB-CZ 3.66Å; E178-F222 HydrophobicContact CG-CE1 3.98Å; E178-F222 HydrophobicContact CG-CZ 4Å; E178-F222 WeakPolarHBondContact OE1-CE1 3.35Å; F218-F222 AromaticContact CD2-CD2 3.89Å; F218-F222 HydrophobicContact CD2-CD2 3.89Å; F218-F222 AromaticContact CD2-CE2 3.77Å; F218-F222 HydrophobicContact CD2-CE2 3.77Å; F218-F222 HydrophobicContact CE1-CD2 4.48Å; F218-F222 AromaticContact CE2-CD2 3.64Å; F218-F222 HydrophobicContact CE2-CD2 3.64Å; F218-F222 AromaticContact CE2-CE2 3.46Å; F218-F222 HydrophobicContact CE2-CE2 3.46Å; F218-F222 VanDerWaalsContact CE2-CE2 3.46Å; F218-F222 HydrophobicContact CG-CD2 4.43Å; F218-F222 AromaticContact CZ-CD2 3.96Å; F218-F222 HydrophobicContact CZ-CD2 3.96Å; F218-F222 HydrophobicContact CZ-CE2 4.16Å; F218-F222 WeakPolarHBondContact O-CD2 3.18Å; F218-F222 PolarHBondContact O-N 3.31Å; A219-F222 PolarHBondContact O-N 2.67Å; D220-F222 PolarHBondContact O-N 2.79Å; F222-I224 HydrophobicContact CB-CD1 3.3Å; F222-I224 HydrophobicContact CB-CG1 3.59Å; F222-I224 HydrophobicContact CG-CD1 4.07Å; F222-I224 WeakPolarHBondContact O-CG1 3.45Å; F222-I224 PolarHBondContact O-N 2.8Å
223	E	91	Very high	86	Confident	183 Å²	183	72.2 Å²	72.2	86%	0.855	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	39	-174.9	-57.1	175.8	-176.8	0	0	112.1	A219 D220	A219-E223 PolarHBondContact O-N 3.38Å; D220-E223 PolarHBondContact O-N 2.95Å; D220-E223 VanDerWaalsContact O-N 3.11Å
224	I	90.4	Very high	84.4	Confident	10 Å²	10	71.6 Å²	71.6	5%	0.051	37%	0.374	C	S	.	.			trans	-102.2	137.7	-177.8	-59.2	164.9	0	0	0	109.5	I161 I187 L190 F218 A219 F222	I161-I224 HydrophobicContact CD1-CD1 4.48Å; I187-I224 HydrophobicContact CB-CD1 3.99Å; I187-I224 HydrophobicContact CB-CG1 4.09Å; I187-I224 HydrophobicContact CD1-CD1 4.02Å; I187-I224 HydrophobicContact CG2-CD1 3.42Å; I187-I224 VanDerWaalsContact CG2-CD1 3.42Å; I187-I224 HydrophobicContact CG2-CG1 3.78Å; I187-I224 HydrophobicContact CG2-CG2 4.04Å; L190-I224 HydrophobicContact CB-CG2 4.1Å; F218-I224 HydrophobicContact CE1-CD1 4.38Å; A219-I224 WeakPolarHBondContact CB-O 3.38Å; A219-I224 PolarHBondContact O-N 3.33Å; F222-I224 HydrophobicContact CB-CD1 3.3Å; F222-I224 HydrophobicContact CB-CG1 3.59Å; F222-I224 HydrophobicContact CG-CD1 4.07Å; F222-I224 WeakPolarHBondContact O-CG1 3.45Å; F222-I224 PolarHBondContact O-N 2.8Å
225	N	89.4	Confident	82.8	Confident	121 Å²	121	75.9 Å²	75.9	65%	0.647	39%	0.391	S	S	*	.			trans	-72.5	129.5	170.8	-66.6	-38.4	0	0	0	111.4	G189 L190 L227	G189-N225 CarbonylContact C-O 3.55Å; G189-N225 VanDerWaalsContact CA-O 3.26Å; G189-N225 WeakPolarHBondContact CA-O 3.35Å; L190-N225 PolarHBondContact N-O 2.91Å; N225-L227 HydrophobicContact CB-CD2 4.41Å; N225-L227 PolarHBondContact O-N 2.79Å
226	L	87.5	Confident	80.9	Confident	64 Å²	64	82.7 Å²	82.7	34%	0.335	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	107.7	163.9	-179.9	61.3	0	0	0	108.4	L190 L215 G228	L190-L226 HydrophobicContact CB-CD1 4.42Å; L190-L226 HydrophobicContact CD2-CD1 4.27Å; L190-L226 HydrophobicContact CG-CD1 4.23Å; L215-L226 HydrophobicContact CD2-CD1 3.69Å; L215-L226 HydrophobicContact CD2-CD2 3.89Å; L215-L226 HydrophobicContact CD2-CG 4.47Å; L215-L226 HydrophobicContact CG-CD1 4.35Å; L226-G228 VanDerWaalsContact C-N 3.32Å
227	L	86.3	Confident	78.9	Confident	95 Å²	95	79.5 Å²	79.5	50%	0.497	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	-25.6	-177	-61	-178	0	0	0	112.5	V160 L190 V191 N225	V160-L227 HydrophobicContact CG1-CD1 4.12Å; V160-L227 HydrophobicContact CG2-CD1 4.07Å; L190-L227 PolarHBondContact O-N 2.8Å; V191-L227 HydrophobicContact CG2-CB 4.14Å; V191-L227 HydrophobicContact CG2-CD1 4.28Å; N225-L227 HydrophobicContact CB-CD2 4.41Å; N225-L227 PolarHBondContact O-N 2.79Å
228	G	83.9	Confident	76.3	Confident	31 Å²	31	79.6 Å²	79.6	32%	0.32	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	157.3	175.1	176.9	0	0	0	0	0	113	E192 L226	E192-G228 PolarHBondContact N-O 2.77Å; E192-G228 VanDerWaalsContact N-O 3.07Å; L226-G228 VanDerWaalsContact C-N 3.32Å
229	S	82.6	Confident	73.8	Confident	62 Å²	62	83.9 Å²	83.9	43%	0.434	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	127.1	178.1	-59	0	0	0	0	109.6	E192	E192-S229 CarbonylContact O-C 3.57Å; E192-S229 VanDerWaalsContact O-CA 3.24Å; E192-S229 WeakPolarHBondContact O-CA 3.24Å; E192-S229 WeakPolarHBondContact OE2-CB 3.4Å; E192-S229 PolarHBondContact OE2-OG 2.84Å
230	A	82.8	Confident	71.3	Confident	35 Å²	35	87.6 Å²	87.6	29%	0.289	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	140.5	-179.9	0	0	0	0	0	111.6	E192 N193 M194 A195	E192-A230 PolarHBondContact O-N 3.07Å; N193-A230 WeakPolarHBondContact OD1-CB 3.45Å; M194-A230 PolarHBondContact N-O 2.72Å; M194-A230 VanDerWaalsContact N-O 3.12Å; A195-A230 PolarHBondContact N-O 2.85Å
231	L	81.4	Confident	68.3	Low	57 Å²	57	86.3 Å²	86.3	30%	0.298	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	148	177.9	-62.4	177.1	0	0	0	111.8	T196 F233	T196-L231 HydrophobicContact CG2-CD2 4.11Å; T196-L231 CarbonylContact O-C 3.55Å; T196-L231 WeakPolarHBondContact O-CA 3.48Å; L231-F233 HydrophobicContact CB-CE1 4.46Å; L231-F233 HydrophobicContact CB-CE2 3.96Å; L231-F233 HydrophobicContact CB-CZ 3.93Å; L231-F233 HydrophobicContact CD1-CE1 4.39Å; L231-F233 HydrophobicContact CD1-CZ 4.09Å
232	F	78.5	Confident	65.5	Low	75 Å²	75	92.5 Å²	92.5	33%	0.329	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	117.7	164.7	-178	-104.4	0	0	0	109.8	M194 T196 F197 L208	M194-F232 HydrophobicContact CB-CB 4.28Å; M194-F232 HydrophobicContact CB-CD2 4.18Å; M194-F232 HydrophobicContact CG-CD2 3.91Å; M194-F232 HydrophobicContact SD-CD2 4.06Å; M194-F232 HydrophobicContact SD-CE2 4.33Å; T196-F232 PolarHBondContact O-N 3.4Å; F197-F232 AromaticContact CD2-CD1 3.79Å; F197-F232 HydrophobicContact CD2-CD1 3.79Å; F197-F232 HydrophobicContact CD2-CE1 4.48Å; F197-F232 HydrophobicContact CE2-CD1 4.48Å; L208-F232 HydrophobicContact CD1-CB 3.51Å; L208-F232 HydrophobicContact CD1-CD1 4.21Å; L208-F232 HydrophobicContact CD1-CD2 4.49Å; L208-F232 HydrophobicContact CD1-CG 3.83Å
233	F	66.4	Low	64.3	Low	105 Å²	105	95.8 Å²	95.8	46%	0.461	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-100.2	124.2	173.8	-61.9	-80.7	0	0	0	110.2	L231 K235 P237	L231-F233 HydrophobicContact CB-CE1 4.46Å; L231-F233 HydrophobicContact CB-CE2 3.96Å; L231-F233 HydrophobicContact CB-CZ 3.93Å; L231-F233 HydrophobicContact CD1-CE1 4.39Å; L231-F233 HydrophobicContact CD1-CZ 4.09Å; F233-K235 VanDerWaalsContact CB-O 3.28Å; F233-K235 WeakPolarHBondContact CB-O 3.24Å; F233-K235 PolarHBondContact O-N 2.9Å; F233-P237 HydrophobicContact CD2-CB 4.45Å
234	S	52.4	Low	62.9	Low	88 Å²	88	91.2 Å²	91.2	62%	0.615	50%	0.504	S	S	*	.	S	Bend	trans	-71.7	-16.1	176.9	173.4	0	0	0	0	113.6
235	K	53	Low	61.4	Low	180 Å²	180	95.7 Å²	95.7	78%	0.783	53%	0.529	S	S	*	.	S	Bend	trans	-125.2	156.5	173.5	-67.6	-175.8	178.4	178.9	0	107.8	F233	F233-K235 VanDerWaalsContact CB-O 3.28Å; F233-K235 WeakPolarHBondContact CB-O 3.24Å; F233-K235 PolarHBondContact O-N 2.9Å
236	N	46.2	Very low	59.8	Low	145 Å²	145	94.2 Å²	94.2	78%	0.775	52%	0.522	S	S	*	.			trans	-40.6	132.9	176.9	-86.3	-22	0	0	0	109.8
237	P	44.9	Very low	58	Low	52 Å²	52	96.1 Å²	96.1	34%	0.338	53%	0.534	S	S	.	.			trans	-51	137.2	176.9	22.7	-32.1	0	0	0	107.5	F233 S239	F233-P237 HydrophobicContact CD2-CB 4.45Å; P237-S239 PolarHBondContact O-N 3.19Å
238	P	36.2	Very low	56.1	Low	99 Å²	99	96.1 Å²	96.1	64%	0.643	54%	0.537	S	S	*	.			trans	-51.4	121.5	174.4	21.5	-30.3	0	0	0	106	V240	P238-V240 PolarHBondContact O-N 3.48Å
239	S	36.2	Very low	54.1	Low	91 Å²	91	100.8 Å²	100.8	64%	0.636	55%	0.552	S	S	*	*			trans	-49.2	112.3	175.6	46.5	0	0	0	0	105.8	P237 L241	P237-S239 PolarHBondContact O-N 3.19Å; S239-L241 PolarHBondContact O-N 2.82Å
240	V	37.9	Very low	52	Low	82 Å²	82	103.8 Å²	103.8	50%	0.497	56%	0.561	S	S	.	*			trans	-73.9	79	173.9	-150.7	0	0	0	0	104	R52 P238	R52-V240 VanDerWaalsContact NH1-CB 3.3Å; R52-V240 VanDerWaalsContact NH2-C 3.3Å; R52-V240 PolarHBondContact NH2-O 3.13Å; P238-V240 PolarHBondContact O-N 3.48Å
241	L	29.4	Very low	49.4	Very low	95 Å²	95	109.5 Å²	109.5	50%	0.497	58%	0.584	S	S	.	*			trans	-144.5	63.6	179.4	-83.6	167.4	0	0	0	105.5	F93 S239	F93-L241 HydrophobicContact CD2-CD2 4.03Å; F93-L241 HydrophobicContact CE2-CD2 3.23Å; F93-L241 HydrophobicContact CE2-CG 4.05Å; F93-L241 HydrophobicContact CZ-CD2 3.75Å; S239-L241 PolarHBondContact O-N 2.82Å
242	H	30.1	Very low	46.5	Very low	245 Å²	245	114.3 Å²	114.3	100%	1.134	61%	0.61	S	S	*	*			trans	-126.1	0	147.1	-74.4	-55.2	0	0	0	106.6

Retrieved 242 of 242 residues in 257.3 ms (Link to these results)

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