A0A087X5Z1_POEFO Loading...

PDZ domain containing 1

AlphaFold DB , UniProt , Accession A0A087X5Z1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 382 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	G	50.1	Low	81	Confident	132 Å²	132	82.6 Å²	82.6	100%	1.361	51%	0.514	S	S	*	.				0	-175.5	0	0	0	0	0	0	108.8
2	E	60	Low	81.6	Confident	104 Å²	104	83.9 Å²	83.9	49%	0.486	53%	0.529	S	S	.	.			trans	-69.4	150.5	168.2	-65.9	-170.5	-160.4	0	0	111.1	F6 R68	E2-F6 HydrophobicContact CB-CE2 4.23Å; E2-F6 HydrophobicContact CB-CZ 3.91Å; E2-R68 IonicContact OE2-CZ 3.48Å; E2-R68 IonicContact OE2-NH1 2.71Å; E2-R68 PolarHBondContact OE2-NH1 2.98Å
3	P	70.3	Confident	81.8	Confident	103 Å²	103	81.3 Å²	81.3	67%	0.669	53%	0.528	S	S	*	.	S	Bend	trans	-74.1	133.8	174	30.5	-33.6	0	0	0	110.9	R68	P3-R68 PolarHBondContact O-NH2 2.68Å
4	G	81.3	Confident	82.5	Confident	41 Å²	41	87.1 Å²	87.1	42%	0.423	53%	0.534	S	S	.	.	S	Bend	trans	136.4	176	177.3	0	0	0	0	0	113
5	L	88.3	Confident	83	Confident	37 Å²	37	89.7 Å²	89.7	19%	0.194	55%	0.549	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	133.6	169.5	-67	172.2	0	0	0	108.8	L27 I35 H40 V43	L5-L27 PolarHBondContact O-N 2.78Å; L5-I35 HydrophobicContact CD1-CD1 4.38Å; L5-H40 HydrophobicContact CD2-CB 4.16Å; L5-V43 HydrophobicContact CD1-CB 3.8Å; L5-V43 HydrophobicContact CD1-CG1 3.99Å; L5-V43 HydrophobicContact CD1-CG2 3.56Å
6	F	90.9	Very high	83.4	Confident	70 Å²	70	86.9 Å²	86.9	31%	0.307	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	143.7	-172.5	-61.5	-93.9	0	0	0	110.7	E2 D25 R26	E2-F6 HydrophobicContact CB-CE2 4.23Å; E2-F6 HydrophobicContact CB-CZ 3.91Å; F6-D25 CarbonylContact C-O 3.54Å; F6-D25 WeakPolarHBondContact CA-O 3.43Å; F6-R26 HydrophobicContact CD1-CB 3.74Å; F6-R26 HydrophobicContact CD1-CG 4.05Å; F6-R26 HydrophobicContact CE1-CB 3.68Å; F6-R26 HydrophobicContact CE1-CG 3.76Å; F6-R26 HydrophobicContact CZ-CG 4.17Å
7	M	91.1	Very high	83.7	Confident	33 Å²	33	87.2 Å²	87.2	16%	0.163	53%	0.527	C	S	.	.			trans	-73.6	130.2	177.1	-66.5	-63.5	179	0	0	110.4	V10 V21 R22 E24 D25 L27 F56 L58	M7-V10 HydrophobicContact CB-CG2 4.09Å; M7-V21 HydrophobicContact CB-CG1 4.11Å; M7-V21 HydrophobicContact CG-CG1 3.74Å; M7-V21 HydrophobicContact SD-CG1 4.22Å; M7-R22 VanDerWaalsContact CB-O 3.24Å; M7-R22 WeakPolarHBondContact CB-O 3.43Å; M7-E24 PolarHBondContact O-N 3.27Å; M7-D25 HydrophobicContact CB-CB 4.15Å; M7-D25 HydrophobicContact CG-CB 4.14Å; M7-D25 PolarHBondContact N-O 3.06Å; M7-L27 HydrophobicContact CE-CB 4.5Å; M7-L27 HydrophobicContact CE-CD1 4.17Å; M7-L27 HydrophobicContact CE-CD2 4.44Å; M7-F56 HydrophobicContact CE-CD2 3.69Å; M7-F56 HydrophobicContact CE-CE2 3.67Å; M7-F56 HydrophobicContact CE-CG 4.31Å; M7-F56 HydrophobicContact CE-CZ 4.28Å; M7-L58 HydrophobicContact CE-CD2 3.73Å; M7-L58 HydrophobicContact CG-CD2 4.25Å
8	T	90.6	Very high	84	Confident	105 Å²	105	88.4 Å²	88.4	64%	0.644	53%	0.531	S	S	*	.			trans	-139.7	155.9	179.7	59.8	0	0	0	0	109.8	V10	T8-V10 VanDerWaalsContact C-N 3.28Å; T8-V10 PolarHBondContact O-N 3.34Å
9	Q	89.6	Confident	84.1	Confident	181 Å²	181	86.5 Å²	86.5	85%	0.846	53%	0.525	S	S	*	.			trans	56.6	38.2	-179.6	-53.3	-176.5	3.5	0	0	113.7	D11 N23	Q9-D11 PolarHBondContact O-N 3.14Å; Q9-N23 PolarHBondContact N-OD1 3.03Å
10	V	89.8	Confident	84.3	Confident	22 Å²	22	82.8 Å²	82.8	13%	0.133	51%	0.505	C	S	.	.			trans	-76	90	178.3	-174	0	0	0	0	110.4	M7 T8 S12 A16 V21 N23	M7-V10 HydrophobicContact CB-CG2 4.09Å; T8-V10 VanDerWaalsContact C-N 3.28Å; T8-V10 PolarHBondContact O-N 3.34Å; V10-S12 PolarHBondContact O-N 3.42Å; V10-A16 HydrophobicContact CG1-CB 4.37Å; V10-V21 HydrophobicContact CG1-CB 4.44Å; V10-V21 HydrophobicContact CG1-CG1 4.37Å; V10-V21 WeakPolarHBondContact CG1-O 3.24Å; V10-V21 HydrophobicContact CG2-CG1 4.14Å; V10-N23 PolarHBondContact N-OD1 3.34Å
11	D	89.6	Confident	84.6	Confident	81 Å²	81	79.3 Å²	79.3	43%	0.433	48%	0.484	S	S	.	.			trans	-56.9	128.7	177.1	-86.2	-6.1	0	0	0	112.6	Q9 R14 Y17	Q9-D11 PolarHBondContact O-N 3.14Å; D11-R14 HydrophobicContact CB-CB 4.35Å; D11-R14 HydrophobicContact CB-CG 3.78Å; D11-R14 PolarHBondContact O-N 2.84Å; D11-R14 IonicContact OD2-CZ 3.19Å; D11-R14 IonicContact OD2-NE 2.7Å; D11-R14 PolarHBondContact OD2-NE 3.37Å; D11-R14 IonicContact OD2-NH2 2.78Å; D11-R14 PolarHBondContact OD2-NH2 3.2Å; D11-Y17 VanDerWaalsContact O-CB 3.27Å; D11-Y17 WeakPolarHBondContact O-CB 3.26Å
12	S	88.3	Confident	86.4	Confident	98 Å²	98	77.7 Å²	77.7	69%	0.685	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	141.4	176.2	54	0	0	0	0	112.3	V10 R14	V10-S12 PolarHBondContact O-N 3.42Å; S12-R14 PolarHBondContact O-N 2.88Å
13	G	84.2	Confident	87.8	Confident	50 Å²	50	76.8 Å²	76.8	52%	0.515	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.2	-5.9	-178.9	0	0	0	0	0	115.8	N18	G13-N18 WeakPolarHBondContact CA-OD1 3.35Å; G13-N18 PolarHBondContact O-ND2 3.31Å
14	R	91.1	Very high	88.7	Confident	162 Å²	162	77 Å²	77	61%	0.611	43%	0.428	S	S	*	.	S	Bend	trans	-82	168.1	171.3	-65.4	-157.7	-157.7	-88.9	-0.5	112.4	D11 S12 A16 Y17 N18	D11-R14 HydrophobicContact CB-CB 4.35Å; D11-R14 HydrophobicContact CB-CG 3.78Å; D11-R14 PolarHBondContact O-N 2.84Å; D11-R14 IonicContact OD2-CZ 3.19Å; D11-R14 IonicContact OD2-NE 2.7Å; D11-R14 PolarHBondContact OD2-NE 3.37Å; D11-R14 IonicContact OD2-NH2 2.78Å; D11-R14 PolarHBondContact OD2-NH2 3.2Å; S12-R14 PolarHBondContact O-N 2.88Å; R14-A16 VanDerWaalsContact C-N 3.35Å; R14-A16 PolarHBondContact O-N 3.43Å; R14-Y17 PolarHBondContact O-N 3Å; R14-Y17 VanDerWaalsContact O-N 3.1Å; R14-N18 PolarHBondContact O-N 3.06Å; R14-N18 PolarHBondContact O-ND2 3.39Å; R14-N18 PolarHBondContact O-OD1 3.28Å
15	V	89.9	Confident	89.1	Confident	126 Å²	126	75.9 Å²	75.9	76%	0.764	41%	0.412	S	S	*	.	H	α-helix	trans	-48.6	-49.4	-175	-174.2	0	0	0	0	112.9	N18 A19	V15-N18 PolarHBondContact O-N 2.84Å; V15-A19 VanDerWaalsContact O-CB 3.32Å; V15-A19 WeakPolarHBondContact O-CB 3.48Å; V15-A19 PolarHBondContact O-N 3.39Å
16	A	89.8	Confident	89.2	Confident	45 Å²	45	75.1 Å²	75.1	37%	0.372	41%	0.407	S	S	.	.	H	α-helix	trans	-61.3	-49.8	178.9	0	0	0	0	0	112.3	V10 R14 N18 A19 G20 V21	V10-A16 HydrophobicContact CG1-CB 4.37Å; R14-A16 VanDerWaalsContact C-N 3.35Å; R14-A16 PolarHBondContact O-N 3.43Å; A16-N18 VanDerWaalsContact C-N 3.29Å; A16-N18 PolarHBondContact O-N 3.41Å; A16-A19 CarbonylContact O-C 3.4Å; A16-A19 PolarHBondContact O-N 3.41Å; A16-A19 VanDerWaalsContact O-N 3.11Å; A16-G20 PolarHBondContact O-N 3.22Å; A16-V21 HydrophobicContact CB-CB 4.14Å; A16-V21 HydrophobicContact CB-CG2 4.18Å; A16-V21 VanDerWaalsContact O-CB 3.27Å; A16-V21 WeakPolarHBondContact O-CB 3.31Å; A16-V21 VanDerWaalsContact O-CG2 3.29Å; A16-V21 WeakPolarHBondContact O-CG2 3.48Å; A16-V21 PolarHBondContact O-N 2.7Å; A16-V21 VanDerWaalsContact O-N 3.08Å
17	Y	88.8	Confident	89.2	Confident	92 Å²	92	72.2 Å²	72.2	36%	0.361	39%	0.394	S	S	.	.	H	α-helix	trans	-59.7	-39.9	177.7	-178	-87.6	0	0	0	112.5	D11 R14 A19 G20 R22	D11-Y17 VanDerWaalsContact O-CB 3.27Å; D11-Y17 WeakPolarHBondContact O-CB 3.26Å; R14-Y17 PolarHBondContact O-N 3Å; R14-Y17 VanDerWaalsContact O-N 3.1Å; Y17-A19 VanDerWaalsContact C-N 3.32Å; Y17-G20 PolarHBondContact O-N 2.95Å; Y17-R22 PolarHBondContact O-NH1 3.33Å
18	N	88	Confident	89.1	Confident	109 Å²	109	70.7 Å²	70.7	58%	0.583	39%	0.387	S	S	*	.	H	α-helix	trans	-71.4	-29.1	178.6	-59.7	-13.9	0	0	0	111.8	G13 R14 V15 A16 G20	G13-N18 WeakPolarHBondContact CA-OD1 3.35Å; G13-N18 PolarHBondContact O-ND2 3.31Å; R14-N18 PolarHBondContact O-N 3.06Å; R14-N18 PolarHBondContact O-ND2 3.39Å; R14-N18 PolarHBondContact O-OD1 3.28Å; V15-N18 PolarHBondContact O-N 2.84Å; A16-N18 VanDerWaalsContact C-N 3.29Å; A16-N18 PolarHBondContact O-N 3.41Å; N18-G20 PolarHBondContact O-N 3.13Å
19	A	86.4	Confident	89.1	Confident	52 Å²	52	66.7 Å²	66.7	43%	0.43	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	19.5	171.1	0	0	0	0	0	113.5	V15 A16 Y17 V21	V15-A19 VanDerWaalsContact O-CB 3.32Å; V15-A19 WeakPolarHBondContact O-CB 3.48Å; V15-A19 PolarHBondContact O-N 3.39Å; A16-A19 CarbonylContact O-C 3.4Å; A16-A19 PolarHBondContact O-N 3.41Å; A16-A19 VanDerWaalsContact O-N 3.11Å; Y17-A19 VanDerWaalsContact C-N 3.32Å; A19-V21 PolarHBondContact O-N 2.91Å
20	G	87.8	Confident	89.3	Confident	12 Å²	12	58.1 Å²	58.1	12%	0.124	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.7	-19.3	174.5	0	0	0	0	0	116	A16 Y17 N18 R22	A16-G20 PolarHBondContact O-N 3.22Å; Y17-G20 PolarHBondContact O-N 2.95Å; N18-G20 PolarHBondContact O-N 3.13Å; G20-R22 PolarHBondContact O-NE 3.27Å; G20-R22 PolarHBondContact O-NH1 2.94Å
21	V	90.7	Very high	89.3	Confident	11 Å²	11	58.6 Å²	58.6	7%	0.067	32%	0.322	C	S	.	.			trans	-58.7	138.5	-174.7	-171.8	0	0	0	0	112.1	M7 V10 A16 A19 L58	M7-V21 HydrophobicContact CB-CG1 4.11Å; M7-V21 HydrophobicContact CG-CG1 3.74Å; M7-V21 HydrophobicContact SD-CG1 4.22Å; V10-V21 HydrophobicContact CG1-CB 4.44Å; V10-V21 HydrophobicContact CG1-CG1 4.37Å; V10-V21 WeakPolarHBondContact CG1-O 3.24Å; V10-V21 HydrophobicContact CG2-CG1 4.14Å; A16-V21 HydrophobicContact CB-CB 4.14Å; A16-V21 HydrophobicContact CB-CG2 4.18Å; A16-V21 VanDerWaalsContact O-CB 3.27Å; A16-V21 WeakPolarHBondContact O-CB 3.31Å; A16-V21 VanDerWaalsContact O-CG2 3.29Å; A16-V21 WeakPolarHBondContact O-CG2 3.48Å; A16-V21 PolarHBondContact O-N 2.7Å; A16-V21 VanDerWaalsContact O-N 3.08Å; A19-V21 PolarHBondContact O-N 2.91Å; V21-L58 HydrophobicContact CB-CD1 4.03Å; V21-L58 HydrophobicContact CG1-CD1 3.7Å; V21-L58 HydrophobicContact CG2-CD1 3.68Å
22	R	89	Confident	89.2	Confident	98 Å²	98	55.6 Å²	55.6	37%	0.37	31%	0.311	S	S	.	.			trans	-124.6	168.8	177.2	-54	-62.3	168.8	-117.2	5.4	111.4	M7 Y17 G20 D25	M7-R22 VanDerWaalsContact CB-O 3.24Å; M7-R22 WeakPolarHBondContact CB-O 3.43Å; Y17-R22 PolarHBondContact O-NH1 3.33Å; G20-R22 PolarHBondContact O-NE 3.27Å; G20-R22 PolarHBondContact O-NH1 2.94Å; R22-D25 PolarHBondContact N-OD2 2.79Å
23	N	89.4	Confident	89.2	Confident	85 Å²	85	54.2 Å²	54.2	46%	0.455	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	147.9	168.4	-67.6	-59.4	0	0	0	109.4	Q9 V10 D25	Q9-N23 PolarHBondContact N-OD1 3.03Å; V10-N23 PolarHBondContact N-OD1 3.34Å; N23-D25 PolarHBondContact O-N 2.92Å
24	E	88.7	Confident	89.4	Confident	108 Å²	108	55 Å²	55	51%	0.505	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.7	-3.2	-175.5	-48.8	-168.9	169.9	0	0	115.6	M7 R26 K61	M7-E24 PolarHBondContact O-N 3.27Å; E24-R26 PolarHBondContact O-N 2.9Å; E24-K61 WeakPolarHBondContact OE2-CD 3.34Å; E24-K61 WeakPolarHBondContact OE2-CE 3.4Å; E24-K61 IonicContact OE2-NZ 3.96Å; E24-K61 PolarHBondContact OE2-NZ 2.63Å
25	D	89.9	Confident	89.3	Confident	17 Å²	17	47.4 Å²	47.4	9%	0.091	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-56.6	128.3	166.6	-73.9	-6.4	0	0	0	110.2	F6 M7 R22 N23 L58	F6-D25 CarbonylContact C-O 3.54Å; F6-D25 WeakPolarHBondContact CA-O 3.43Å; M7-D25 HydrophobicContact CB-CB 4.15Å; M7-D25 HydrophobicContact CG-CB 4.14Å; M7-D25 PolarHBondContact N-O 3.06Å; R22-D25 PolarHBondContact N-OD2 2.79Å; N23-D25 PolarHBondContact O-N 2.92Å; D25-L58 HydrophobicContact CB-CB 4.37Å; D25-L58 HydrophobicContact CB-CD1 4.21Å
26	R	89.3	Confident	89.1	Confident	21 Å²	21	45.8 Å²	45.8	8%	0.079	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	131.7	175.5	-172.9	-179.5	171.8	-125.3	-16.2	110.3	F6 E24 L28 E36 L58 V59 D64	F6-R26 HydrophobicContact CD1-CB 3.74Å; F6-R26 HydrophobicContact CD1-CG 4.05Å; F6-R26 HydrophobicContact CE1-CB 3.68Å; F6-R26 HydrophobicContact CE1-CG 3.76Å; F6-R26 HydrophobicContact CZ-CG 4.17Å; E24-R26 PolarHBondContact O-N 2.9Å; R26-L28 HydrophobicContact CG-CD2 4.34Å; R26-E36 IonicContact CZ-OE1 2.68Å; R26-E36 IonicContact NH1-OE1 3.89Å; R26-E36 PolarHBondContact NH1-OE1 2.91Å; R26-E36 IonicContact NH2-OE1 3.7Å; R26-E36 PolarHBondContact NH2-OE1 3.41Å; R26-L58 WeakPolarHBondContact O-CA 3.38Å; R26-V59 HydrophobicContact CB-CG1 3.86Å; R26-V59 PolarHBondContact N-O 3.4Å; R26-V59 PolarHBondContact O-N 3.41Å; R26-D64 VanDerWaalsContact CD-CG 3.48Å; R26-D64 WeakPolarHBondContact CD-OD2 3.3Å; R26-D64 IonicContact CZ-OD1 2.72Å; R26-D64 IonicContact NE-OD2 2.82Å; R26-D64 IonicContact NH1-OD1 2.7Å; R26-D64 PolarHBondContact NH1-OD1 3.4Å; R26-D64 IonicContact NH1-OD2 2.76Å
27	L	91.3	Very high	88.9	Confident	8 Å²	8	48.8 Å²	48.8	4%	0.042	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	129.8	174.4	-175.9	63.6	0	0	0	110.1	L5 M7 E29 V30 I35 V43 F56 L58	L5-L27 PolarHBondContact O-N 2.78Å; M7-L27 HydrophobicContact CE-CB 4.5Å; M7-L27 HydrophobicContact CE-CD1 4.17Å; M7-L27 HydrophobicContact CE-CD2 4.44Å; L27-E29 WeakPolarHBondContact CD1-O 3.27Å; L27-V30 HydrophobicContact CD1-CG2 4.2Å; L27-V30 HydrophobicContact CD2-CG2 3.91Å; L27-V30 HydrophobicContact CG-CG2 4.34Å; L27-I35 HydrophobicContact CB-CD1 4.28Å; L27-I35 HydrophobicContact CD2-CD1 4.23Å; L27-I35 HydrophobicContact CD2-CG1 4.18Å; L27-I35 HydrophobicContact CG-CD1 3.9Å; L27-I35 HydrophobicContact CG-CG1 4Å; L27-I35 WeakPolarHBondContact O-CD1 3.36Å; L27-V43 HydrophobicContact CD2-CG1 3.78Å; L27-F56 HydrophobicContact CD1-CB 3.74Å; L27-F56 HydrophobicContact CD1-CD1 3.6Å; L27-F56 HydrophobicContact CD1-CE1 4.31Å; L27-F56 HydrophobicContact CD1-CG 3.73Å; L27-L58 HydrophobicContact CB-CD2 4.15Å; L27-L58 HydrophobicContact CD1-CD2 3.63Å; L27-L58 HydrophobicContact CG-CD2 4.5Å
28	L	89.1	Confident	88.9	Confident	2 Å²	2	47.7 Å²	47.7	1%	0.01	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	-44.9	-179.7	-59.8	-179.2	0	0	0	112.6	R26 N34 I35 E36 L57 V59 I74	R26-L28 HydrophobicContact CG-CD2 4.34Å; L28-N34 CarbonylContact O-C 3.16Å; L28-N34 WeakPolarHBondContact O-CA 3.29Å; L28-I35 PolarHBondContact O-N 3.47Å; L28-E36 HydrophobicContact CD2-CG 4.23Å; L28-L57 HydrophobicContact CB-CB 4.36Å; L28-L57 HydrophobicContact CB-CD2 4.01Å; L28-L57 HydrophobicContact CB-CG 4.19Å; L28-L57 HydrophobicContact CD1-CD2 3.97Å; L28-L57 HydrophobicContact CD1-CG 4.25Å; L28-L57 PolarHBondContact N-O 3.44Å; L28-V59 HydrophobicContact CD1-CB 3.97Å; L28-V59 HydrophobicContact CD1-CG1 3.66Å; L28-V59 HydrophobicContact CD2-CG1 4.07Å; L28-V59 HydrophobicContact CG-CG1 3.86Å; L28-I74 HydrophobicContact CD1-CB 3.77Å; L28-I74 HydrophobicContact CD1-CD1 4.29Å; L28-I74 HydrophobicContact CD1-CG2 3.64Å
29	E	91.4	Very high	89	Confident	20 Å²	20	46.2 Å²	46.2	9%	0.093	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	146.1	179.9	-54.6	173.7	-159.4	0	0	111.3	L27 E33 N34 F56 L57 G75 S76	L27-E29 WeakPolarHBondContact CD1-O 3.27Å; E29-E33 CarbonylContact C-O 3.53Å; E29-E33 WeakPolarHBondContact CA-O 3.3Å; E29-N34 HydrophobicContact CG-CB 4.48Å; E29-F56 WeakPolarHBondContact O-CA 3.31Å; E29-L57 HydrophobicContact CB-CB 3.65Å; E29-L57 HydrophobicContact CG-CB 3.9Å; E29-L57 HydrophobicContact CG-CD2 3.9Å; E29-L57 PolarHBondContact N-O 2.91Å; E29-L57 PolarHBondContact O-N 2.82Å; E29-L57 WeakPolarHBondContact OE1-CD2 3.43Å; E29-G75 WeakPolarHBondContact OE1-CA 3.44Å; E29-S76 PolarHBondContact OE1-N 2.83Å; E29-S76 VanDerWaalsContact OE1-N 3.08Å; E29-S76 PolarHBondContact OE1-OG 2.8Å; E29-S76 PolarHBondContact OE2-OG 3.45Å
30	V	92.4	Very high	89.1	Confident	2 Å²	2	49.4 Å²	49.4	1%	0.012	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	123.4	167.7	-178.8	0	0	0	0	108	L27 G32 E33 I35 V43 K46 I47 V54 F56	L27-V30 HydrophobicContact CD1-CG2 4.2Å; L27-V30 HydrophobicContact CD2-CG2 3.91Å; L27-V30 HydrophobicContact CG-CG2 4.34Å; V30-G32 VanDerWaalsContact C-N 3.28Å; V30-G32 PolarHBondContact O-N 2.92Å; V30-E33 PolarHBondContact N-O 3.23Å; V30-E33 WeakPolarHBondContact O-CB 3.27Å; V30-E33 PolarHBondContact O-N 3.34Å; V30-I35 HydrophobicContact CB-CG2 4.28Å; V30-I35 HydrophobicContact CG2-CG1 4.17Å; V30-I35 HydrophobicContact CG2-CG2 4.02Å; V30-V43 HydrophobicContact CG2-CG1 4.16Å; V30-K46 HydrophobicContact CG1-CB 4.41Å; V30-I47 HydrophobicContact CG1-CG1 4.2Å; V30-I47 HydrophobicContact CG2-CG1 4.5Å; V30-V54 HydrophobicContact CG1-CG2 3.73Å; V30-F56 HydrophobicContact CB-CD1 4.49Å; V30-F56 HydrophobicContact CG1-CD1 4.36Å; V30-F56 HydrophobicContact CG1-CE1 4.13Å; V30-F56 HydrophobicContact CG2-CD1 3.98Å; V30-F56 HydrophobicContact CG2-CE1 4Å
31	N	90.7	Very high	89.3	Confident	31 Å²	31	54.3 Å²	54.3	17%	0.166	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.8	46.8	-179.2	-60.3	-31.4	0	0	0	113.1	E33 M55 Q177 K179	N31-E33 VanDerWaalsContact C-N 3.31Å; N31-E33 PolarHBondContact O-N 3.36Å; N31-M55 PolarHBondContact N-O 2.85Å; N31-M55 PolarHBondContact OD1-N 3.33Å; N31-Q177 CarbonylContact C-O 3.55Å; N31-Q177 WeakPolarHBondContact CA-O 3.32Å; N31-Q177 HydrophobicContact CB-CG 4.35Å; N31-Q177 WeakPolarHBondContact CB-O 3.49Å; N31-Q177 PolarHBondContact OD1-NE2 3.37Å; N31-K179 VanDerWaalsContact O-CE 3.27Å; N31-K179 WeakPolarHBondContact O-CE 3.37Å; N31-K179 PolarHBondContact O-NZ 3.1Å
32	G	86.3	Confident	89.4	Confident	19 Å²	19	57.9 Å²	57.9	20%	0.196	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.2	28.9	-178.7	0	0	0	0	0	114.4	V30 G178 K179	V30-G32 VanDerWaalsContact C-N 3.28Å; V30-G32 PolarHBondContact O-N 2.92Å; G32-G178 WeakPolarHBondContact CA-O 3.22Å; G32-G178 PolarHBondContact N-O 2.97Å; G32-K179 WeakPolarHBondContact O-CD 3.46Å; G32-K179 WeakPolarHBondContact O-CE 3.41Å; G32-K179 PolarHBondContact O-NZ 3.46Å
33	E	88.8	Confident	89.4	Confident	69 Å²	69	53.4 Å²	53.4	32%	0.322	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	122.5	174.5	-161.5	-175.1	161.5	0	0	109.5	E29 V30 N31 I35 Y38 K46	E29-E33 CarbonylContact C-O 3.53Å; E29-E33 WeakPolarHBondContact CA-O 3.3Å; V30-E33 PolarHBondContact N-O 3.23Å; V30-E33 WeakPolarHBondContact O-CB 3.27Å; V30-E33 PolarHBondContact O-N 3.34Å; N31-E33 VanDerWaalsContact C-N 3.31Å; N31-E33 PolarHBondContact O-N 3.36Å; E33-I35 PolarHBondContact O-N 3.39Å; E33-Y38 PolarHBondContact OE1-OH 2.8Å; E33-K46 IonicContact OE1-NZ 2.73Å; E33-K46 PolarHBondContact OE1-NZ 3.22Å; E33-K46 IonicContact OE2-NZ 2.74Å; E33-K46 PolarHBondContact OE2-NZ 2.8Å
34	N	88.7	Confident	89.5	Confident	66 Å²	66	51.3 Å²	51.3	35%	0.353	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	131.1	178.5	-179.2	-72.9	0	0	0	110.3	L28 E29 E36 Y38	L28-N34 CarbonylContact O-C 3.16Å; L28-N34 WeakPolarHBondContact O-CA 3.29Å; E29-N34 HydrophobicContact CG-CB 4.48Å; N34-E36 PolarHBondContact ND2-OE2 2.91Å; N34-E36 WeakPolarHBondContact OD1-CB 3.33Å; N34-E36 PolarHBondContact OD1-N 3.11Å; N34-Y38 WeakPolarHBondContact O-CE1 3.48Å
35	I	89.6	Confident	89.7	Confident	3 Å²	3	51.9 Å²	51.9	2%	0.015	27%	0.272	C	S	.	.			trans	-112	8.9	-178.1	60.6	60.4	0	0	0	114.1	L5 L27 L28 V30 E33 S37 Y38 V43 K46	L5-I35 HydrophobicContact CD1-CD1 4.38Å; L27-I35 HydrophobicContact CB-CD1 4.28Å; L27-I35 HydrophobicContact CD2-CD1 4.23Å; L27-I35 HydrophobicContact CD2-CG1 4.18Å; L27-I35 HydrophobicContact CG-CD1 3.9Å; L27-I35 HydrophobicContact CG-CG1 4Å; L27-I35 WeakPolarHBondContact O-CD1 3.36Å; L28-I35 PolarHBondContact O-N 3.47Å; V30-I35 HydrophobicContact CB-CG2 4.28Å; V30-I35 HydrophobicContact CG2-CG1 4.17Å; V30-I35 HydrophobicContact CG2-CG2 4.02Å; E33-I35 PolarHBondContact O-N 3.39Å; I35-S37 PolarHBondContact O-N 3.08Å; I35-S37 VanDerWaalsContact O-N 3.07Å; I35-Y38 HydrophobicContact CB-CD1 4.17Å; I35-Y38 HydrophobicContact CG2-CD1 4.32Å; I35-Y38 WeakPolarHBondContact O-CB 3.44Å; I35-Y38 PolarHBondContact O-N 3.42Å; I35-V43 HydrophobicContact CB-CG2 3.69Å; I35-V43 HydrophobicContact CG1-CG2 4.14Å; I35-V43 HydrophobicContact CG2-CG2 3.95Å; I35-K46 HydrophobicContact CG2-CD 4.09Å
36	E	84.6	Confident	89.7	Confident	91 Å²	91	53 Å²	53	43%	0.425	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-19.9	-170.8	-65.7	-177.3	93	0	0	114.2	R26 L28 N34	R26-E36 IonicContact CZ-OE1 2.68Å; R26-E36 IonicContact NH1-OE1 3.89Å; R26-E36 PolarHBondContact NH1-OE1 2.91Å; R26-E36 IonicContact NH2-OE1 3.7Å; R26-E36 PolarHBondContact NH2-OE1 3.41Å; L28-E36 HydrophobicContact CD2-CG 4.23Å; N34-E36 PolarHBondContact ND2-OE2 2.91Å; N34-E36 WeakPolarHBondContact OD1-CB 3.33Å; N34-E36 PolarHBondContact OD1-N 3.11Å
37	S	86.4	Confident	89.8	Confident	108 Å²	108	54.8 Å²	54.8	76%	0.755	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-0.7	175.7	61.5	0	0	0	0	114.8	I35	I35-S37 PolarHBondContact O-N 3.08Å; I35-S37 VanDerWaalsContact O-N 3.07Å
38	Y	88.4	Confident	89.9	Confident	69 Å²	69	61.3 Å²	61.3	27%	0.271	32%	0.315	S	S	.	.			trans	-94.3	154.4	-172.2	-75	80.1	0	0	0	112.7	E33 N34 I35 E42 V43 K46	E33-Y38 PolarHBondContact OE1-OH 2.8Å; N34-Y38 WeakPolarHBondContact O-CE1 3.48Å; I35-Y38 HydrophobicContact CB-CD1 4.17Å; I35-Y38 HydrophobicContact CG2-CD1 4.32Å; I35-Y38 WeakPolarHBondContact O-CB 3.44Å; I35-Y38 PolarHBondContact O-N 3.42Å; Y38-E42 HydrophobicContact CD2-CB 3.74Å; Y38-E42 HydrophobicContact CD2-CG 4.39Å; Y38-V43 HydrophobicContact CG-CG2 4.47Å; Y38-K46 VanDerWaalsContact OH-CE 3.29Å; Y38-K46 WeakPolarHBondContact OH-CE 3.37Å; Y38-K46 PolarHBondContact OH-NZ 3.2Å
39	T	90.6	Very high	89.9	Confident	78 Å²	78	68.2 Å²	68.2	48%	0.479	35%	0.351	S	S	.	.			trans	-75.8	166.1	170.3	66.3	0	0	0	0	111.9	D41 E42 V43	T39-D41 VanDerWaalsContact C-N 3.32Å; T39-D41 PolarHBondContact O-N 2.77Å; T39-E42 VanDerWaalsContact CB-OE2 3.3Å; T39-E42 WeakPolarHBondContact CB-OE2 3.44Å; T39-E42 WeakPolarHBondContact CG2-OE2 3.46Å; T39-E42 PolarHBondContact N-OE2 2.87Å; T39-E42 VanDerWaalsContact OG1-CD 3.31Å; T39-E42 WeakPolarHBondContact OG1-CG 3.22Å; T39-E42 PolarHBondContact OG1-OE2 2.91Å; T39-V43 WeakPolarHBondContact O-CG2 3.39Å; T39-V43 PolarHBondContact O-N 3.02Å
40	H	88.6	Confident	89.5	Confident	120 Å²	120	68.1 Å²	68.1	56%	0.556	36%	0.355	S	S	*	.	H	α-helix	trans	-56.7	-45.2	176.2	-178.8	78.6	0	0	0	112.4	L5 V43 V44	L5-H40 HydrophobicContact CD2-CB 4.16Å; H40-V43 PolarHBondContact O-N 3.26Å; H40-V44 WeakPolarHBondContact O-CB 3.29Å; H40-V44 WeakPolarHBondContact O-CG2 3.41Å; H40-V44 PolarHBondContact O-N 3.07Å
41	D	91.7	Very high	89.3	Confident	115 Å²	115	71.2 Å²	71.2	62%	0.615	39%	0.388	S	S	*	.	H	α-helix	trans	-68.8	-42.5	-173.5	-62.9	-39.2	0	0	0	112	T39 V43 V44 E45	T39-D41 VanDerWaalsContact C-N 3.32Å; T39-D41 PolarHBondContact O-N 2.77Å; D41-V43 VanDerWaalsContact C-N 3.31Å; D41-V43 PolarHBondContact O-N 2.88Å; D41-V44 CarbonylContact O-C 3.6Å; D41-V44 PolarHBondContact O-N 2.99Å; D41-E45 WeakPolarHBondContact O-CG 3.24Å; D41-E45 PolarHBondContact O-N 2.98Å
42	E	91.9	Very high	89.1	Confident	85 Å²	85	80.3 Å²	80.3	40%	0.397	43%	0.426	S	S	.	.	H	α-helix	trans	-62.5	-36.8	175.7	-64.3	163.7	117.1	0	0	112.2	Y38 T39 E45 K46	Y38-E42 HydrophobicContact CD2-CB 3.74Å; Y38-E42 HydrophobicContact CD2-CG 4.39Å; T39-E42 VanDerWaalsContact CB-OE2 3.3Å; T39-E42 WeakPolarHBondContact CB-OE2 3.44Å; T39-E42 WeakPolarHBondContact CG2-OE2 3.46Å; T39-E42 PolarHBondContact N-OE2 2.87Å; T39-E42 VanDerWaalsContact OG1-CD 3.31Å; T39-E42 WeakPolarHBondContact OG1-CG 3.22Å; T39-E42 PolarHBondContact OG1-OE2 2.91Å; E42-E45 PolarHBondContact O-N 3.18Å; E42-K46 PolarHBondContact O-N 2.78Å
43	V	90.6	Very high	89.3	Confident	5 Å²	5	82.5 Å²	82.5	3%	0.03	44%	0.438	C	S	.	.	H	α-helix	trans	-71.2	-39.1	175.5	174.4	0	0	0	0	111.1	L5 L27 V30 I35 Y38 T39 H40 D41 E45 K46 I47	L5-V43 HydrophobicContact CD1-CB 3.8Å; L5-V43 HydrophobicContact CD1-CG1 3.99Å; L5-V43 HydrophobicContact CD1-CG2 3.56Å; L27-V43 HydrophobicContact CD2-CG1 3.78Å; V30-V43 HydrophobicContact CG2-CG1 4.16Å; I35-V43 HydrophobicContact CB-CG2 3.69Å; I35-V43 HydrophobicContact CG1-CG2 4.14Å; I35-V43 HydrophobicContact CG2-CG2 3.95Å; Y38-V43 HydrophobicContact CG-CG2 4.47Å; T39-V43 WeakPolarHBondContact O-CG2 3.39Å; T39-V43 PolarHBondContact O-N 3.02Å; H40-V43 PolarHBondContact O-N 3.26Å; D41-V43 VanDerWaalsContact C-N 3.31Å; D41-V43 PolarHBondContact O-N 2.88Å; V43-E45 VanDerWaalsContact C-N 3.28Å; V43-E45 PolarHBondContact O-N 2.74Å; V43-K46 PolarHBondContact O-N 3.32Å; V43-I47 HydrophobicContact CG1-CD1 4.01Å; V43-I47 VanDerWaalsContact O-CG1 3.26Å; V43-I47 WeakPolarHBondContact O-CG1 3.43Å; V43-I47 PolarHBondContact O-N 3.38Å
44	V	91.2	Very high	89.4	Confident	41 Å²	41	82 Å²	82	25%	0.248	44%	0.439	C	S	.	.	H	α-helix	trans	-62.2	-35.7	171.9	165.4	0	0	0	0	111.3	H40 D41 K48	H40-V44 WeakPolarHBondContact O-CB 3.29Å; H40-V44 WeakPolarHBondContact O-CG2 3.41Å; H40-V44 PolarHBondContact O-N 3.07Å; D41-V44 CarbonylContact O-C 3.6Å; D41-V44 PolarHBondContact O-N 2.99Å; V44-K48 HydrophobicContact CG1-CD 4.2Å; V44-K48 VanDerWaalsContact CG1-CE 3.44Å; V44-K48 WeakPolarHBondContact O-CD 3.09Å; V44-K48 VanDerWaalsContact O-CG 3.24Å; V44-K48 WeakPolarHBondContact O-CG 3.08Å; V44-K48 PolarHBondContact O-N 2.75Å
45	E	92.3	Very high	89.6	Confident	120 Å²	120	80.3 Å²	80.3	56%	0.561	43%	0.43	S	S	*	.	H	α-helix	trans	-66.9	-46.6	171.2	-72.2	-168.6	163.5	0	0	112.5	D41 E42 V43 I47 K48 L49	D41-E45 WeakPolarHBondContact O-CG 3.24Å; D41-E45 PolarHBondContact O-N 2.98Å; E42-E45 PolarHBondContact O-N 3.18Å; V43-E45 VanDerWaalsContact C-N 3.28Å; V43-E45 PolarHBondContact O-N 2.74Å; E45-I47 VanDerWaalsContact C-N 3.27Å; E45-I47 PolarHBondContact O-N 2.73Å; E45-K48 PolarHBondContact O-N 2.88Å; E45-K48 VanDerWaalsContact O-N 3.14Å; E45-L49 VanDerWaalsContact O-CG 3.31Å; E45-L49 WeakPolarHBondContact O-CG 3.29Å; E45-L49 PolarHBondContact O-N 3.25Å
46	K	90.5	Very high	89.7	Confident	40 Å²	40	83.1 Å²	83.1	17%	0.174	44%	0.442	C	S	.	.	H	α-helix	trans	-57.5	-38.1	173.5	-74	-176.6	-173.4	-69.9	0	112.7	V30 E33 I35 Y38 E42 V43 L49 G50	V30-K46 HydrophobicContact CG1-CB 4.41Å; E33-K46 IonicContact OE1-NZ 2.73Å; E33-K46 PolarHBondContact OE1-NZ 3.22Å; E33-K46 IonicContact OE2-NZ 2.74Å; E33-K46 PolarHBondContact OE2-NZ 2.8Å; I35-K46 HydrophobicContact CG2-CD 4.09Å; Y38-K46 VanDerWaalsContact OH-CE 3.29Å; Y38-K46 WeakPolarHBondContact OH-CE 3.37Å; Y38-K46 PolarHBondContact OH-NZ 3.2Å; E42-K46 PolarHBondContact O-N 2.78Å; V43-K46 PolarHBondContact O-N 3.32Å; K46-L49 PolarHBondContact O-N 2.62Å; K46-G50 PolarHBondContact O-N 3.24Å
47	I	91.9	Very high	90	Very high	59 Å²	59	79.7 Å²	79.7	30%	0.303	43%	0.427	S	S	.	.	H	α-helix	trans	-65.2	-46.8	175.3	-69.8	166.8	0	0	0	110.8	V30 V43 E45 L49 G50 F56	V30-I47 HydrophobicContact CG1-CG1 4.2Å; V30-I47 HydrophobicContact CG2-CG1 4.5Å; V43-I47 HydrophobicContact CG1-CD1 4.01Å; V43-I47 VanDerWaalsContact O-CG1 3.26Å; V43-I47 WeakPolarHBondContact O-CG1 3.43Å; V43-I47 PolarHBondContact O-N 3.38Å; E45-I47 VanDerWaalsContact C-N 3.27Å; E45-I47 PolarHBondContact O-N 2.73Å; I47-L49 VanDerWaalsContact C-N 3.29Å; I47-L49 PolarHBondContact O-N 3.34Å; I47-G50 PolarHBondContact O-N 3.4Å; I47-G50 VanDerWaalsContact O-N 3.13Å; I47-F56 HydrophobicContact CD1-CE1 3.98Å; I47-F56 HydrophobicContact CD1-CZ 3.94Å; I47-F56 HydrophobicContact CG1-CE1 3.84Å; I47-F56 HydrophobicContact CG1-CZ 4.07Å
48	K	91.4	Very high	90.2	Very high	145 Å²	145	76.6 Å²	76.6	63%	0.63	40%	0.401	S	S	*	.	H	α-helix	trans	-59.7	-38.9	175.4	-70.8	162	-176.5	167.3	0	112	V44 E45 G50 G51	V44-K48 HydrophobicContact CG1-CD 4.2Å; V44-K48 VanDerWaalsContact CG1-CE 3.44Å; V44-K48 WeakPolarHBondContact O-CD 3.09Å; V44-K48 VanDerWaalsContact O-CG 3.24Å; V44-K48 WeakPolarHBondContact O-CG 3.08Å; V44-K48 PolarHBondContact O-N 2.75Å; E45-K48 PolarHBondContact O-N 2.88Å; E45-K48 VanDerWaalsContact O-N 3.14Å; K48-G50 PolarHBondContact O-N 3.28Å; K48-G51 PolarHBondContact O-N 2.66Å
49	L	90.4	Very high	90.1	Very high	147 Å²	147	73.6 Å²	73.6	77%	0.77	39%	0.39	S	S	*	.	H	α-helix	trans	-66.4	-21	177.4	-71.6	169.2	0	0	0	113.6	E45 K46 I47 G51	E45-L49 VanDerWaalsContact O-CG 3.31Å; E45-L49 WeakPolarHBondContact O-CG 3.29Å; E45-L49 PolarHBondContact O-N 3.25Å; K46-L49 PolarHBondContact O-N 2.62Å; I47-L49 VanDerWaalsContact C-N 3.29Å; I47-L49 PolarHBondContact O-N 3.34Å; L49-G51 PolarHBondContact O-N 3.23Å
50	G	81.9	Confident	89.9	Confident	18 Å²	18	72.7 Å²	72.7	19%	0.186	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-20.5	169.3	0	0	0	0	0	114	K46 I47 K48 K52 S53	K46-G50 PolarHBondContact O-N 3.24Å; I47-G50 PolarHBondContact O-N 3.4Å; I47-G50 VanDerWaalsContact O-N 3.13Å; K48-G50 PolarHBondContact O-N 3.28Å; G50-K52 PolarHBondContact O-N 3.03Å; G50-S53 CarbonylContact C-O 3.58Å
51	G	88.1	Confident	89.6	Confident	67 Å²	67	71.1 Å²	71.1	69%	0.691	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.3	-99.8	174.6	0	0	0	0	0	113.5	K48 L49	K48-G51 PolarHBondContact O-N 2.66Å; L49-G51 PolarHBondContact O-N 3.23Å
52	K	87.6	Confident	89.1	Confident	222 Å²	222	70 Å²	70	97%	0.965	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-19.1	-174	-68.9	-175.5	179.8	179	0	114.2	G50	G50-K52 PolarHBondContact O-N 3.03Å
53	S	89.2	Confident	88.4	Confident	64 Å²	64	67.5 Å²	67.5	45%	0.448	36%	0.356	S	S	.	.			trans	-136.6	145.4	179.9	48.7	0	0	0	0	109.1	G50 Q177	G50-S53 CarbonylContact C-O 3.58Å; S53-Q177 PolarHBondContact O-NE2 3.5Å; S53-Q177 PolarHBondContact OG-OE1 3.11Å
54	V	92.1	Very high	87.9	Confident	59 Å²	59	67.4 Å²	67.4	36%	0.358	36%	0.355	S	S	.	.			trans	-140.9	136.9	171.1	67.5	0	0	0	0	108.4	V30 F56	V30-V54 HydrophobicContact CG1-CG2 3.73Å; V54-F56 HydrophobicContact CB-CE1 4.41Å; V54-F56 HydrophobicContact CG1-CE1 4.03Å; V54-F56 HydrophobicContact CG1-CE2 4.09Å; V54-F56 HydrophobicContact CG1-CZ 3.67Å; V54-F56 HydrophobicContact CG2-CD1 4.05Å; V54-F56 HydrophobicContact CG2-CE1 3.48Å; V54-F56 VanDerWaalsContact CG2-CE1 3.48Å; V54-F56 HydrophobicContact CG2-CZ 3.99Å
55	M	92.2	Very high	87.2	Confident	31 Å²	31	67.6 Å²	67.6	15%	0.153	36%	0.358	C	S	.	.			trans	-105.6	135.3	171.3	-169.3	179.4	-63	0	0	109.1	N31 L84 M174 G178 V180	N31-M55 PolarHBondContact N-O 2.85Å; N31-M55 PolarHBondContact OD1-N 3.33Å; M55-L84 HydrophobicContact CE-CD1 4.48Å; M55-L84 HydrophobicContact CE-CD2 3.86Å; M55-L84 HydrophobicContact CG-CD2 4.46Å; M55-L84 HydrophobicContact SD-CD2 4.17Å; M55-M174 HydrophobicContact CE-CG 3.69Å; M55-M174 WeakPolarHBondContact CE-O 3.39Å; M55-G178 VanDerWaalsContact SD-CA 3.54Å; M55-V180 HydrophobicContact SD-CG2 4.11Å
56	F	93.1	Very high	86.3	Confident	62 Å²	62	67 Å²	67	27%	0.272	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	138.6	174.6	-61.9	-39.3	0	0	0	110.3	M7 L27 E29 V30 I47 V54 L58	M7-F56 HydrophobicContact CE-CD2 3.69Å; M7-F56 HydrophobicContact CE-CE2 3.67Å; M7-F56 HydrophobicContact CE-CG 4.31Å; M7-F56 HydrophobicContact CE-CZ 4.28Å; L27-F56 HydrophobicContact CD1-CB 3.74Å; L27-F56 HydrophobicContact CD1-CD1 3.6Å; L27-F56 HydrophobicContact CD1-CE1 4.31Å; L27-F56 HydrophobicContact CD1-CG 3.73Å; E29-F56 WeakPolarHBondContact O-CA 3.31Å; V30-F56 HydrophobicContact CB-CD1 4.49Å; V30-F56 HydrophobicContact CG1-CD1 4.36Å; V30-F56 HydrophobicContact CG1-CE1 4.13Å; V30-F56 HydrophobicContact CG2-CD1 3.98Å; V30-F56 HydrophobicContact CG2-CE1 4Å; I47-F56 HydrophobicContact CD1-CE1 3.98Å; I47-F56 HydrophobicContact CD1-CZ 3.94Å; I47-F56 HydrophobicContact CG1-CE1 3.84Å; I47-F56 HydrophobicContact CG1-CZ 4.07Å; V54-F56 HydrophobicContact CB-CE1 4.41Å; V54-F56 HydrophobicContact CG1-CE1 4.03Å; V54-F56 HydrophobicContact CG1-CE2 4.09Å; V54-F56 HydrophobicContact CG1-CZ 3.67Å; V54-F56 HydrophobicContact CG2-CD1 4.05Å; V54-F56 HydrophobicContact CG2-CE1 3.48Å; V54-F56 VanDerWaalsContact CG2-CE1 3.48Å; V54-F56 HydrophobicContact CG2-CZ 3.99Å; F56-L58 HydrophobicContact CB-CD2 3.95Å; F56-L58 HydrophobicContact CB-CG 3.94Å
57	L	90.5	Very high	85.3	Confident	19 Å²	19	67.1 Å²	67.1	10%	0.099	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	116.8	151.4	-176.7	66.6	0	0	0	107.8	L28 E29 G75 A79	L28-L57 HydrophobicContact CB-CB 4.36Å; L28-L57 HydrophobicContact CB-CD2 4.01Å; L28-L57 HydrophobicContact CB-CG 4.19Å; L28-L57 HydrophobicContact CD1-CD2 3.97Å; L28-L57 HydrophobicContact CD1-CG 4.25Å; L28-L57 PolarHBondContact N-O 3.44Å; E29-L57 HydrophobicContact CB-CB 3.65Å; E29-L57 HydrophobicContact CG-CB 3.9Å; E29-L57 HydrophobicContact CG-CD2 3.9Å; E29-L57 PolarHBondContact N-O 2.91Å; E29-L57 PolarHBondContact O-N 2.82Å; E29-L57 WeakPolarHBondContact OE1-CD2 3.43Å; L57-G75 VanDerWaalsContact CD2-C 3.44Å; L57-G75 VanDerWaalsContact CD2-CA 3.48Å; L57-A79 HydrophobicContact CD1-CB 3.69Å
58	L	89.6	Confident	84.3	Confident	42 Å²	42	68.1 Å²	68.1	22%	0.22	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	155.3	173	-59.9	-177.5	0	0	0	110	M7 V21 D25 R26 L27 F56	M7-L58 HydrophobicContact CE-CD2 3.73Å; M7-L58 HydrophobicContact CG-CD2 4.25Å; V21-L58 HydrophobicContact CB-CD1 4.03Å; V21-L58 HydrophobicContact CG1-CD1 3.7Å; V21-L58 HydrophobicContact CG2-CD1 3.68Å; D25-L58 HydrophobicContact CB-CB 4.37Å; D25-L58 HydrophobicContact CB-CD1 4.21Å; R26-L58 WeakPolarHBondContact O-CA 3.38Å; L27-L58 HydrophobicContact CB-CD2 4.15Å; L27-L58 HydrophobicContact CD1-CD2 3.63Å; L27-L58 HydrophobicContact CG-CD2 4.5Å; F56-L58 HydrophobicContact CB-CD2 3.95Å; F56-L58 HydrophobicContact CB-CG 3.94Å
59	V	86.6	Confident	82.9	Confident	7 Å²	7	68 Å²	68	4%	0.042	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	136	167.8	62.6	0	0	0	0	109.1	R26 L28 T63 D64 I74	R26-V59 HydrophobicContact CB-CG1 3.86Å; R26-V59 PolarHBondContact N-O 3.4Å; R26-V59 PolarHBondContact O-N 3.41Å; L28-V59 HydrophobicContact CD1-CB 3.97Å; L28-V59 HydrophobicContact CD1-CG1 3.66Å; L28-V59 HydrophobicContact CD2-CG1 4.07Å; L28-V59 HydrophobicContact CG-CG1 3.86Å; V59-T63 HydrophobicContact CG2-CG2 3.49Å; V59-T63 VanDerWaalsContact CG2-CG2 3.49Å; V59-D64 HydrophobicContact CG1-CB 3.78Å; V59-D64 HydrophobicContact CG2-CB 4.08Å; V59-I74 HydrophobicContact CB-CD1 4.39Å; V59-I74 HydrophobicContact CG1-CD1 4.28Å; V59-I74 HydrophobicContact CG2-CD1 3.91Å
60	D	85.9	Confident	81.4	Confident	58 Å²	58	66.3 Å²	66.3	31%	0.31	35%	0.346	S	S	.	.			trans	-70.1	161.2	173.7	63.4	89.5	0	0	0	111.4	E62 T63 D64	D60-E62 VanDerWaalsContact C-N 3.34Å; D60-E62 PolarHBondContact O-N 2.84Å; D60-E62 PolarHBondContact OD1-N 2.84Å; D60-T63 PolarHBondContact O-N 3.48Å; D60-T63 VanDerWaalsContact OD1-CB 3.31Å; D60-T63 WeakPolarHBondContact OD1-CB 3.31Å; D60-T63 PolarHBondContact OD1-N 3.14Å; D60-T63 PolarHBondContact OD1-OG1 2.94Å; D60-T63 WeakPolarHBondContact OD2-CB 3.45Å; D60-T63 PolarHBondContact OD2-OG1 3.46Å; D60-D64 WeakPolarHBondContact O-CB 3.33Å; D60-D64 PolarHBondContact O-N 3.2Å
61	K	83.4	Confident	80.3	Confident	88 Å²	88	75 Å²	75	38%	0.383	38%	0.379	S	S	.	.	H	α-helix	trans	-60.5	-40.8	-174.2	-175.6	-174.8	-165	168	0	113.2	E24 S65	E24-K61 WeakPolarHBondContact OE2-CD 3.34Å; E24-K61 WeakPolarHBondContact OE2-CE 3.4Å; E24-K61 IonicContact OE2-NZ 3.96Å; E24-K61 PolarHBondContact OE2-NZ 2.63Å; K61-S65 VanDerWaalsContact O-CB 3.29Å; K61-S65 WeakPolarHBondContact O-CB 3.3Å; K61-S65 PolarHBondContact O-N 2.89Å; K61-S65 VanDerWaalsContact O-N 3.08Å; K61-S65 PolarHBondContact O-OG 3.39Å
62	E	79.9	Confident	79.2	Confident	90 Å²	90	76.3 Å²	76.3	42%	0.421	37%	0.37	S	S	.	.	H	α-helix	trans	-68	-43.7	-179.3	-70.4	62.2	-137.6	0	0	110.9	D60 F66 Y198	D60-E62 VanDerWaalsContact C-N 3.34Å; D60-E62 PolarHBondContact O-N 2.84Å; D60-E62 PolarHBondContact OD1-N 2.84Å; E62-F66 PolarHBondContact O-N 3.01Å; E62-Y198 HydrophobicContact CB-CD2 4.34Å; E62-Y198 HydrophobicContact CG-CD2 4.12Å; E62-Y198 HydrophobicContact CG-CE2 4.19Å; E62-Y198 HydrophobicContact CG-CG 4.29Å
63	T	77.3	Confident	78	Confident	34 Å²	34	74.3 Å²	74.3	21%	0.209	36%	0.361	C	S	.	.	H	α-helix	trans	-68.7	-46.5	176.6	-60.9	0	0	0	0	112.1	V59 D60 S65 F66 Y67	V59-T63 HydrophobicContact CG2-CG2 3.49Å; V59-T63 VanDerWaalsContact CG2-CG2 3.49Å; D60-T63 PolarHBondContact O-N 3.48Å; D60-T63 VanDerWaalsContact OD1-CB 3.31Å; D60-T63 WeakPolarHBondContact OD1-CB 3.31Å; D60-T63 PolarHBondContact OD1-N 3.14Å; D60-T63 PolarHBondContact OD1-OG1 2.94Å; D60-T63 WeakPolarHBondContact OD2-CB 3.45Å; D60-T63 PolarHBondContact OD2-OG1 3.46Å; T63-S65 VanDerWaalsContact C-N 3.28Å; T63-S65 PolarHBondContact O-N 3.26Å; T63-F66 WeakPolarHBondContact O-CB 3.37Å; T63-F66 PolarHBondContact O-N 3.49Å; T63-F66 VanDerWaalsContact O-N 3.08Å; T63-Y67 HydrophobicContact CG2-CD2 3.68Å; T63-Y67 HydrophobicContact CG2-CE2 3.75Å; T63-Y67 WeakPolarHBondContact O-CD2 3.04Å; T63-Y67 PolarHBondContact O-N 3.41Å
64	D	80	Confident	77.1	Confident	3 Å²	3	72.6 Å²	72.6	2%	0.016	35%	0.347	C	S	.	.	H	α-helix	trans	-57.9	-43.9	176.7	-171.3	45.9	0	0	0	110.5	R26 V59 D60 F66 Y67 R68	R26-D64 VanDerWaalsContact CD-CG 3.48Å; R26-D64 WeakPolarHBondContact CD-OD2 3.3Å; R26-D64 IonicContact CZ-OD1 2.72Å; R26-D64 IonicContact NE-OD2 2.82Å; R26-D64 IonicContact NH1-OD1 2.7Å; R26-D64 PolarHBondContact NH1-OD1 3.4Å; R26-D64 IonicContact NH1-OD2 2.76Å; V59-D64 HydrophobicContact CG1-CB 3.78Å; V59-D64 HydrophobicContact CG2-CB 4.08Å; D60-D64 WeakPolarHBondContact O-CB 3.33Å; D60-D64 PolarHBondContact O-N 3.2Å; D64-F66 PolarHBondContact O-N 3.04Å; D64-Y67 PolarHBondContact O-N 3.2Å; D64-R68 VanDerWaalsContact CG-NE 3.32Å; D64-R68 WeakPolarHBondContact O-CB 3.15Å; D64-R68 WeakPolarHBondContact O-CD 3.17Å; D64-R68 WeakPolarHBondContact O-CG 3.36Å; D64-R68 PolarHBondContact O-N 2.93Å; D64-R68 IonicContact OD1-NE 3.22Å; D64-R68 PolarHBondContact OD1-NE 2.74Å; D64-R68 WeakPolarHBondContact OD2-CD 3.48Å; D64-R68 IonicContact OD2-CZ 3.59Å; D64-R68 IonicContact OD2-NE 2.78Å; D64-R68 PolarHBondContact OD2-NE 3.46Å; D64-R68 IonicContact OD2-NH1 3.6Å; D64-R68 PolarHBondContact OD2-NH1 2.86Å; D64-R68 IonicContact OD2-NH2 3.55Å; D64-R68 PolarHBondContact OD2-NH2 3.28Å
65	S	76.8	Confident	76.3	Confident	45 Å²	45	69.8 Å²	69.8	32%	0.315	33%	0.33	S	S	.	.	H	α-helix	trans	-57.9	-45.1	173.4	-62.4	0	0	0	0	112.6	K61 T63 N69	K61-S65 VanDerWaalsContact O-CB 3.29Å; K61-S65 WeakPolarHBondContact O-CB 3.3Å; K61-S65 PolarHBondContact O-N 2.89Å; K61-S65 VanDerWaalsContact O-N 3.08Å; K61-S65 PolarHBondContact O-OG 3.39Å; T63-S65 VanDerWaalsContact C-N 3.28Å; T63-S65 PolarHBondContact O-N 3.26Å; S65-N69 WeakPolarHBondContact O-CB 3.33Å; S65-N69 VanDerWaalsContact O-CG 3.23Å; S65-N69 PolarHBondContact O-N 2.68Å; S65-N69 PolarHBondContact O-ND2 3.08Å
66	F	73.9	Confident	75.4	Confident	108 Å²	108	69.5 Å²	69.5	47%	0.474	33%	0.331	S	S	.	.	H	α-helix	trans	-64.3	-44.3	179.4	174.8	-91	0	0	0	113	E62 T63 D64 K70	E62-F66 PolarHBondContact O-N 3.01Å; T63-F66 WeakPolarHBondContact O-CB 3.37Å; T63-F66 PolarHBondContact O-N 3.49Å; T63-F66 VanDerWaalsContact O-N 3.08Å; D64-F66 PolarHBondContact O-N 3.04Å; F66-K70 HydrophobicContact CE1-CD 4.29Å; F66-K70 VanDerWaalsContact CE2-NZ 3.31Å; F66-K70 HydrophobicContact CZ-CD 4.47Å
67	Y	69.3	Low	74.4	Confident	42 Å²	42	73.8 Å²	73.8	17%	0.165	35%	0.346	C	S	.	.	H	α-helix	trans	-76.3	-40.7	-178.5	-82.2	-93	0	0	0	112.5	T63 D64 N69 K70 K71 N72 I74 L78	T63-Y67 HydrophobicContact CG2-CD2 3.68Å; T63-Y67 HydrophobicContact CG2-CE2 3.75Å; T63-Y67 WeakPolarHBondContact O-CD2 3.04Å; T63-Y67 PolarHBondContact O-N 3.41Å; D64-Y67 PolarHBondContact O-N 3.2Å; Y67-N69 PolarHBondContact O-N 3.1Å; Y67-K70 CarbonylContact O-C 3.58Å; Y67-K70 PolarHBondContact O-N 3.5Å; Y67-K70 VanDerWaalsContact O-N 3.07Å; Y67-K71 PolarHBondContact O-N 3.12Å; Y67-N72 HydrophobicContact CD1-CB 3.83Å; Y67-N72 PolarHBondContact O-N 3.47Å; Y67-I74 HydrophobicContact CD1-CG1 4.04Å; Y67-I74 HydrophobicContact CD2-CD1 4.29Å; Y67-I74 HydrophobicContact CD2-CG1 4.39Å; Y67-I74 HydrophobicContact CG-CD1 3.99Å; Y67-I74 HydrophobicContact CG-CG1 3.76Å; Y67-L78 HydrophobicContact CE1-CD1 3.75Å
68	R	70.6	Confident	73.4	Confident	79 Å²	79	75.6 Å²	75.6	30%	0.298	36%	0.355	S	S	.	.	H	α-helix	trans	-55	-48.4	173	-77.5	170.7	167.7	-168.3	-1.3	111.9	E2 P3 D64 K70 K71	E2-R68 IonicContact OE2-CZ 3.48Å; E2-R68 IonicContact OE2-NH1 2.71Å; E2-R68 PolarHBondContact OE2-NH1 2.98Å; P3-R68 PolarHBondContact O-NH2 2.68Å; D64-R68 VanDerWaalsContact CG-NE 3.32Å; D64-R68 WeakPolarHBondContact O-CB 3.15Å; D64-R68 WeakPolarHBondContact O-CD 3.17Å; D64-R68 WeakPolarHBondContact O-CG 3.36Å; D64-R68 PolarHBondContact O-N 2.93Å; D64-R68 IonicContact OD1-NE 3.22Å; D64-R68 PolarHBondContact OD1-NE 2.74Å; D64-R68 WeakPolarHBondContact OD2-CD 3.48Å; D64-R68 IonicContact OD2-CZ 3.59Å; D64-R68 IonicContact OD2-NE 2.78Å; D64-R68 PolarHBondContact OD2-NE 3.46Å; D64-R68 IonicContact OD2-NH1 3.6Å; D64-R68 PolarHBondContact OD2-NH1 2.86Å; D64-R68 IonicContact OD2-NH2 3.55Å; D64-R68 PolarHBondContact OD2-NH2 3.28Å; R68-K70 PolarHBondContact O-N 3.38Å; R68-K70 VanDerWaalsContact O-N 3.16Å; R68-K71 PolarHBondContact O-N 2.9Å
69	N	62.6	Low	72.8	Confident	142 Å²	142	75.1 Å²	75.1	76%	0.759	36%	0.357	S	S	*	.	H	α-helix	trans	-60.9	-24.2	178.9	-77.9	-34.4	0	0	0	113.3	S65 Y67	S65-N69 WeakPolarHBondContact O-CB 3.33Å; S65-N69 VanDerWaalsContact O-CG 3.23Å; S65-N69 PolarHBondContact O-N 2.68Å; S65-N69 PolarHBondContact O-ND2 3.08Å; Y67-N69 PolarHBondContact O-N 3.1Å
70	K	58.4	Low	72.5	Confident	113 Å²	113	77.1 Å²	77.1	49%	0.491	37%	0.369	S	S	.	.	H	α-helix	trans	-93.2	-4.8	176.3	-69.8	178.8	175.7	178.8	0	114.1	F66 Y67 R68 N72	F66-K70 HydrophobicContact CE1-CD 4.29Å; F66-K70 VanDerWaalsContact CE2-NZ 3.31Å; F66-K70 HydrophobicContact CZ-CD 4.47Å; Y67-K70 CarbonylContact O-C 3.58Å; Y67-K70 PolarHBondContact O-N 3.5Å; Y67-K70 VanDerWaalsContact O-N 3.07Å; R68-K70 PolarHBondContact O-N 3.38Å; R68-K70 VanDerWaalsContact O-N 3.16Å; K70-N72 HydrophobicContact CB-CB 4.43Å; K70-N72 PolarHBondContact O-N 3.3Å
71	K	60.2	Low	72.4	Confident	199 Å²	199	74.6 Å²	74.6	87%	0.865	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	21.3	-169.6	-56.4	-177.7	178.8	179.6	0	114	Y67 R68	Y67-K71 PolarHBondContact O-N 3.12Å; R68-K71 PolarHBondContact O-N 2.9Å
72	N	63.4	Low	72.4	Confident	95 Å²	95	76.2 Å²	76.2	51%	0.508	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-81.4	136.3	176.9	-77.2	-4.5	0	0	0	109.6	Y67 K70	Y67-N72 HydrophobicContact CD1-CB 3.83Å; Y67-N72 PolarHBondContact O-N 3.47Å; K70-N72 HydrophobicContact CB-CB 4.43Å; K70-N72 PolarHBondContact O-N 3.3Å
73	K	63.1	Low	72.7	Confident	180 Å²	180	77.9 Å²	77.9	78%	0.783	37%	0.369	S	S	*	.	P	Polyproline II helix	trans	-71.3	132.8	170.3	-69.5	-168.3	174.2	-169.1	0	110	W77	K73-W77 HydrophobicContact CB-CH2 4.4Å
74	I	71.1	Confident	73.2	Confident	28 Å²	28	77.8 Å²	77.8	14%	0.144	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-90.6	149.6	164.9	-43.4	179.8	0	0	0	107	L28 V59 Y67	L28-I74 HydrophobicContact CD1-CB 3.77Å; L28-I74 HydrophobicContact CD1-CD1 4.29Å; L28-I74 HydrophobicContact CD1-CG2 3.64Å; V59-I74 HydrophobicContact CB-CD1 4.39Å; V59-I74 HydrophobicContact CG1-CD1 4.28Å; V59-I74 HydrophobicContact CG2-CD1 3.91Å; Y67-I74 HydrophobicContact CD1-CG1 4.04Å; Y67-I74 HydrophobicContact CD2-CD1 4.29Å; Y67-I74 HydrophobicContact CD2-CG1 4.39Å; Y67-I74 HydrophobicContact CG-CD1 3.99Å; Y67-I74 HydrophobicContact CG-CG1 3.76Å
75	G	73.4	Confident	73.6	Confident	1 Å²	1	83.1 Å²	83.1	1%	0.01	40%	0.402	C	S	.	.			trans	-174.5	174.8	173.3	0	0	0	0	0	110.5	E29 L57 W77 L78	E29-G75 WeakPolarHBondContact OE1-CA 3.44Å; L57-G75 VanDerWaalsContact CD2-C 3.44Å; L57-G75 VanDerWaalsContact CD2-CA 3.48Å; G75-W77 VanDerWaalsContact CA-CZ3 3.46Å; G75-W77 PolarHBondContact O-N 2.73Å; G75-L78 PolarHBondContact O-N 3.37Å
76	S	74.8	Confident	74.4	Confident	24 Å²	24	84.1 Å²	84.1	17%	0.168	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-62.1	-14.6	-166.5	43.1	0	0	0	0	116	E29 L78 A79 L184	E29-S76 PolarHBondContact OE1-N 2.83Å; E29-S76 VanDerWaalsContact OE1-N 3.08Å; E29-S76 PolarHBondContact OE1-OG 2.8Å; E29-S76 PolarHBondContact OE2-OG 3.45Å; S76-L78 PolarHBondContact O-N 3.15Å; S76-A79 WeakPolarHBondContact O-CB 3.1Å; S76-A79 PolarHBondContact O-N 2.89Å; S76-L184 WeakPolarHBondContact O-CD1 3.41Å
77	W	72.1	Confident	75.1	Confident	153 Å²	153	83.5 Å²	83.5	58%	0.58	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-72.6	-9.4	172.2	70.9	89	0	0	0	114.6	K73 G75	K73-W77 HydrophobicContact CB-CH2 4.4Å; G75-W77 VanDerWaalsContact CA-CZ3 3.46Å; G75-W77 PolarHBondContact O-N 2.73Å
78	L	68.6	Low	76.2	Confident	56 Å²	56	81.7 Å²	81.7	29%	0.293	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-104.8	2.1	171	-62.6	176.5	0	0	0	112.7	Y67 G75 S76 P195	Y67-L78 HydrophobicContact CE1-CD1 3.75Å; G75-L78 PolarHBondContact O-N 3.37Å; S76-L78 PolarHBondContact O-N 3.15Å; L78-P195 WeakPolarHBondContact O-CG 3.26Å
79	A	77.6	Confident	77.2	Confident	33 Å²	33	80.1 Å²	80.1	27%	0.273	39%	0.39	S	S	.	.			trans	-76.4	137.9	-173.4	0	0	0	0	0	112.1	L57 S76	L57-A79 HydrophobicContact CD1-CB 3.69Å; S76-A79 WeakPolarHBondContact O-CB 3.1Å; S76-A79 PolarHBondContact O-N 2.89Å
80	T	80.6	Confident	78.5	Confident	48 Å²	48	77 Å²	77	29%	0.294	37%	0.37	S	S	.	.			trans	-71.2	134.6	161.4	-178	0	0	0	0	109.6	K82 F83 E188	T80-K82 WeakPolarHBondContact OG1-CB 3.27Å; T80-K82 VanDerWaalsContact OG1-CG 3.28Å; T80-K82 WeakPolarHBondContact OG1-CG 3.16Å; T80-K82 PolarHBondContact OG1-N 3.13Å; T80-F83 HydrophobicContact CG2-CD2 3.9Å; T80-F83 HydrophobicContact CG2-CE2 3.82Å; T80-E188 VanDerWaalsContact CB-OE1 3.31Å; T80-E188 WeakPolarHBondContact CB-OE1 3.28Å; T80-E188 VanDerWaalsContact OG1-CD 3.23Å; T80-E188 PolarHBondContact OG1-OE1 2.98Å; T80-E188 PolarHBondContact OG1-OE2 3.09Å
81	V	83.4	Confident	80.2	Confident	6 Å²	6	71.9 Å²	71.9	4%	0.036	35%	0.348	C	S	.	.			trans	-94.3	1.1	176.5	-66.7	0	0	0	0	112.3	F83 L84 Y175 L184 F185 E188	V81-F83 PolarHBondContact O-N 2.78Å; V81-F83 VanDerWaalsContact O-N 3.09Å; V81-L84 HydrophobicContact CB-CD1 3.94Å; V81-L84 HydrophobicContact CB-CG 4.33Å; V81-L84 HydrophobicContact CG1-CD1 3.94Å; V81-L84 WeakPolarHBondContact O-CB 3.37Å; V81-L84 PolarHBondContact O-N 3.01Å; V81-Y175 HydrophobicContact CG1-CE1 4.34Å; V81-L184 HydrophobicContact CG1-CB 4.02Å; V81-F185 HydrophobicContact CG2-CB 3.93Å; V81-F185 HydrophobicContact CG2-CD2 3.8Å; V81-F185 HydrophobicContact CG2-CG 4.37Å; V81-E188 WeakPolarHBondContact CG2-OE2 3.49Å; V81-E188 PolarHBondContact N-OE2 3.2Å
82	K	83	Confident	81.5	Confident	122 Å²	122	67.4 Å²	67.4	53%	0.53	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-27	178.8	-68.1	-179.8	-174.7	97.1	0	114.4	T80 E188 S194	T80-K82 WeakPolarHBondContact OG1-CB 3.27Å; T80-K82 VanDerWaalsContact OG1-CG 3.28Å; T80-K82 WeakPolarHBondContact OG1-CG 3.16Å; T80-K82 PolarHBondContact OG1-N 3.13Å; K82-E188 IonicContact NZ-OE1 3.83Å; K82-E188 PolarHBondContact NZ-OE1 2.81Å; K82-S194 PolarHBondContact NZ-OG 2.71Å
83	F	86.7	Confident	82.8	Confident	124 Å²	124	63 Å²	63	54%	0.544	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-4.2	179.4	-60.1	-64.3	0	0	0	114.3	T80 V81	T80-F83 HydrophobicContact CG2-CD2 3.9Å; T80-F83 HydrophobicContact CG2-CE2 3.82Å; V81-F83 PolarHBondContact O-N 2.78Å; V81-F83 VanDerWaalsContact O-N 3.09Å
84	L	88.4	Confident	84.1	Confident	32 Å²	32	58.3 Å²	58.3	17%	0.168	30%	0.296	C	S	.	.			trans	-74.1	134.1	175.7	-61.1	-175.9	0	0	0	110.5	M55 V81 L86 M174 Y175	M55-L84 HydrophobicContact CE-CD1 4.48Å; M55-L84 HydrophobicContact CE-CD2 3.86Å; M55-L84 HydrophobicContact CG-CD2 4.46Å; M55-L84 HydrophobicContact SD-CD2 4.17Å; V81-L84 HydrophobicContact CB-CD1 3.94Å; V81-L84 HydrophobicContact CB-CG 4.33Å; V81-L84 HydrophobicContact CG1-CD1 3.94Å; V81-L84 WeakPolarHBondContact O-CB 3.37Å; V81-L84 PolarHBondContact O-N 3.01Å; L84-L86 VanDerWaalsContact C-N 3.26Å; L84-L86 PolarHBondContact O-N 3.34Å; L84-M174 HydrophobicContact CB-CE 3.91Å; L84-M174 HydrophobicContact CB-SD 4.03Å; L84-M174 HydrophobicContact CD1-CE 3.79Å; L84-M174 HydrophobicContact CD2-SD 4.48Å; L84-M174 HydrophobicContact CG-CE 4.35Å; L84-Y175 HydrophobicContact CD1-CE1 4Å; L84-Y175 HydrophobicContact CD1-CE2 4.41Å
85	P	88.6	Confident	85	Confident	115 Å²	115	60.6 Å²	60.6	75%	0.747	31%	0.305	S	S	*	.	S	Bend	trans	-73.6	-16.3	-174.5	29.8	-37	0	0	0	113.9	M174	P85-M174 HydrophobicContact CG-SD 4.11Å
86	L	91.9	Very high	85.7	Confident	67 Å²	67	62.1 Å²	62.1	35%	0.351	32%	0.321	S	S	.	.	S	Bend	trans	-120.5	142.7	175.9	-58.2	178.2	0	0	0	108.9	L84 D170 T171 M174	L84-L86 VanDerWaalsContact C-N 3.26Å; L84-L86 PolarHBondContact O-N 3.34Å; L86-D170 HydrophobicContact CD1-CB 3.96Å; L86-T171 HydrophobicContact CB-CG2 4.23Å; L86-M174 HydrophobicContact CB-CE 4.02Å; L86-M174 HydrophobicContact CB-SD 3.96Å; L86-M174 HydrophobicContact CG-SD 4.4Å; L86-M174 VanDerWaalsContact O-CE 3.31Å; L86-M174 WeakPolarHBondContact O-CE 3.4Å
87	Q	88.8	Confident	86.2	Confident	94 Å²	94	66.9 Å²	66.9	44%	0.439	35%	0.354	S	S	.	.			trans	-131.4	138.7	-175	-67.4	-176.5	8.4	0	0	110.9	F185	Q87-F185 HydrophobicContact CB-CE2 3.81Å; Q87-F185 HydrophobicContact CB-CZ 3.94Å; Q87-F185 HydrophobicContact CG-CE2 3.91Å; Q87-F185 HydrophobicContact CG-CZ 4.47Å
88	P	92.6	Very high	86.8	Confident	5 Å²	5	66.8 Å²	66.8	3%	0.032	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-57.3	150.1	171.6	-24.3	35.4	0	0	0	112.3	L165 V166 V167 Y175 P182 F185	P88-L165 HydrophobicContact CB-CD1 3.56Å; P88-L165 HydrophobicContact CB-CG 4.23Å; P88-V166 CarbonylContact C-O 3.6Å; P88-V166 WeakPolarHBondContact CA-O 3.43Å; P88-V167 HydrophobicContact CB-CG1 3.82Å; P88-V167 HydrophobicContact CG-CG1 3.84Å; P88-Y175 HydrophobicContact CG-CE2 3.84Å; P88-P182 HydrophobicContact CG-CB 3.91Å; P88-F185 HydrophobicContact CB-CD1 3.81Å; P88-F185 HydrophobicContact CB-CE1 4.23Å; P88-F185 HydrophobicContact CB-CG 4.36Å; P88-F185 HydrophobicContact CG-CB 3.88Å; P88-F185 HydrophobicContact CG-CD1 3.92Å; P88-F185 HydrophobicContact CG-CG 3.95Å; P88-F185 WeakPolarHBondContact O-CE1 3.42Å
89	R	92.8	Very high	87.9	Confident	45 Å²	45	65.2 Å²	65.2	17%	0.17	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	128.4	177.5	-75.2	178.1	-85.4	117.3	1.9	110.6	I91 G128 D133 V166 D168	R89-I91 HydrophobicContact CB-CD1 4.04Å; R89-G128 PolarHBondContact NH1-O 2.87Å; R89-D133 IonicContact CZ-OD1 3.37Å; R89-D133 IonicContact CZ-OD2 2.73Å; R89-D133 IonicContact NH1-OD1 3.44Å; R89-D133 PolarHBondContact NH1-OD1 3.38Å; R89-D133 IonicContact NH1-OD2 3.69Å; R89-D133 PolarHBondContact NH1-OD2 2.73Å; R89-D133 IonicContact NH2-OD1 3.79Å; R89-D133 PolarHBondContact NH2-OD1 3.19Å; R89-D133 IonicContact NH2-OD2 2.68Å; R89-V166 HydrophobicContact CB-CG2 3.91Å; R89-V166 PolarHBondContact N-O 2.97Å; R89-V166 PolarHBondContact O-N 2.68Å; R89-D168 IonicContact CZ-OD2 2.68Å; R89-D168 IonicContact NE-OD2 3.61Å; R89-D168 IonicContact NH2-OD2 2.76Å; R89-D168 PolarHBondContact NH2-OD2 2.88Å
90	F	90.1	Very high	88.6	Confident	77 Å²	77	64.6 Å²	64.6	34%	0.338	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	122.7	163.5	-81.1	-108.9	0	0	0	108.8	F164 L165 F185 W186 M189	F90-F164 WeakPolarHBondContact CA-O 3.23Å; F90-L165 HydrophobicContact CD2-CD1 4.24Å; F90-L165 HydrophobicContact CE2-CD1 4.15Å; F90-F185 HydrophobicContact CD2-CD1 4.37Å; F90-F185 AromaticContact CD2-CE1 3.9Å; F90-F185 HydrophobicContact CD2-CE1 3.9Å; F90-F185 AromaticContact CE2-CD1 3.82Å; F90-F185 HydrophobicContact CE2-CD1 3.82Å; F90-F185 AromaticContact CE2-CE1 3.69Å; F90-F185 HydrophobicContact CE2-CE1 3.69Å; F90-W186 AromaticContact CD1-CE3 3.82Å; F90-W186 HydrophobicContact CD1-CE3 3.82Å; F90-W186 HydrophobicContact CD1-CH2 4.33Å; F90-W186 AromaticContact CD1-CZ3 3.55Å; F90-W186 HydrophobicContact CD1-CZ3 3.55Å; F90-W186 AromaticContact CE1-CD2 3.8Å; F90-W186 HydrophobicContact CE1-CD2 3.8Å; F90-W186 AromaticContact CE1-CE3 3.11Å; F90-W186 HydrophobicContact CE1-CE3 3.11Å; F90-W186 AromaticContact CE1-CH2 3.88Å; F90-W186 HydrophobicContact CE1-CH2 3.88Å; F90-W186 HydrophobicContact CE1-CZ2 4.45Å; F90-W186 AromaticContact CE1-CZ3 3.18Å; F90-W186 HydrophobicContact CE1-CZ3 3.18Å; F90-W186 HydrophobicContact CE2-CE3 4.26Å; F90-W186 HydrophobicContact CZ-CB 4.26Å; F90-W186 AromaticContact CZ-CD2 3.83Å; F90-W186 HydrophobicContact CZ-CD2 3.83Å; F90-W186 AromaticContact CZ-CE3 3.38Å; F90-W186 HydrophobicContact CZ-CE3 3.38Å; F90-W186 HydrophobicContact CZ-CG 4.23Å; F90-W186 AromaticContact CZ-CZ3 3.97Å; F90-W186 HydrophobicContact CZ-CZ3 3.97Å; F90-M189 HydrophobicContact CE2-CB 4.13Å; F90-M189 HydrophobicContact CE2-CG 4.18Å; F90-M189 HydrophobicContact CZ-CB 4.06Å
91	I	92.3	Very high	89.2	Confident	5 Å²	5	62.9 Å²	62.9	3%	0.026	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	111.1	178.6	-51.3	-64.7	0	0	0	108.8	R89 L93 A127 L129 S163 F164 V166	R89-I91 HydrophobicContact CB-CD1 4.04Å; I91-L93 HydrophobicContact CG2-CD2 3.78Å; I91-L93 HydrophobicContact CG2-CG 4.16Å; I91-A127 WeakPolarHBondContact CD1-O 3.27Å; I91-A127 HydrophobicContact CG2-CB 3.66Å; I91-L129 HydrophobicContact CB-CD1 4.31Å; I91-L129 HydrophobicContact CG1-CD1 3.96Å; I91-L129 HydrophobicContact CG2-CB 4.12Å; I91-L129 HydrophobicContact CG2-CD1 4.1Å; I91-S163 CarbonylContact O-C 3.56Å; I91-S163 WeakPolarHBondContact O-CA 3.49Å; I91-F164 HydrophobicContact CB-CB 4.37Å; I91-F164 PolarHBondContact N-O 3.08Å; I91-F164 PolarHBondContact O-N 3.08Å; I91-V166 HydrophobicContact CD1-CG2 4.33Å; I91-V166 HydrophobicContact CG1-CG1 4.31Å; I91-V166 HydrophobicContact CG1-CG2 3.71Å
92	N	89.4	Confident	89.7	Confident	105 Å²	105	64.4 Å²	64.4	56%	0.561	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.1	110.8	177.4	-69.3	-31.9	0	0	0	109.8	S163	N92-S163 WeakPolarHBondContact OD1-CB 3.44Å; N92-S163 PolarHBondContact OD1-OG 2.82Å
93	L	90.4	Very high	90.3	Very high	2 Å²	2	62.6 Å²	62.6	1%	0.01	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	132.7	-178.6	-58.4	176.2	0	0	0	110.6	I91 Y100 F102 A124 A127 T161 C162 F164	I91-L93 HydrophobicContact CG2-CD2 3.78Å; I91-L93 HydrophobicContact CG2-CG 4.16Å; L93-Y100 HydrophobicContact CB-CD1 3.73Å; L93-Y100 HydrophobicContact CB-CE1 3.93Å; L93-Y100 HydrophobicContact CD1-CD1 4.44Å; L93-Y100 HydrophobicContact CD1-CG 4.48Å; L93-F102 HydrophobicContact CD1-CD1 4.28Å; L93-F102 HydrophobicContact CD1-CE1 3.75Å; L93-A124 HydrophobicContact CD2-CB 4.1Å; L93-A127 HydrophobicContact CD2-CB 3.79Å; L93-T161 CarbonylContact O-C 3.59Å; L93-T161 VanDerWaalsContact O-CA 3.28Å; L93-T161 WeakPolarHBondContact O-CA 3.44Å; L93-C162 WeakPolarHBondContact CA-O 3.45Å; L93-C162 WeakPolarHBondContact CB-O 3.33Å; L93-C162 PolarHBondContact N-O 3.47Å; L93-C162 PolarHBondContact O-N 2.77Å; L93-F164 HydrophobicContact CD1-CD2 3.89Å; L93-F164 HydrophobicContact CD1-CE2 3.47Å; L93-F164 VanDerWaalsContact CD1-CE2 3.47Å; L93-F164 HydrophobicContact CD1-CZ 3.84Å
94	T	90.1	Very high	90.6	Very high	82 Å²	82	57.5 Å²	57.5	50%	0.503	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	135.7	166.5	-56.3	0	0	0	0	108.7	G96 P123 N160 T161	T94-G96 PolarHBondContact O-N 3.42Å; T94-P123 WeakPolarHBondContact O-CB 3.42Å; T94-P123 VanDerWaalsContact O-CG 3.28Å; T94-P123 WeakPolarHBondContact O-CG 3.44Å; T94-N160 CarbonylContact C-O 3.52Å; T94-N160 WeakPolarHBondContact CA-O 3.36Å; T94-T161 HydrophobicContact CG2-CG2 4.32Å
95	K	88.7	Confident	90.8	Very high	76 Å²	76	60.1 Å²	60.1	33%	0.33	34%	0.336	S	S	.	.			trans	-73	127.7	-172.1	-156.8	171.7	-177.2	167.9	0	110.3	Y100 D159 N160	K95-Y100 HydrophobicContact CB-CD1 4.17Å; K95-Y100 HydrophobicContact CB-CE1 3.67Å; K95-Y100 HydrophobicContact CG-CD1 4.41Å; K95-Y100 HydrophobicContact CG-CE1 4.1Å; K95-Y100 HydrophobicContact CG-CE2 4.42Å; K95-D159 WeakPolarHBondContact CD-O 3.45Å; K95-D159 WeakPolarHBondContact CE-O 3.4Å; K95-D159 PolarHBondContact NZ-O 2.79Å; K95-N160 WeakPolarHBondContact CB-O 3.27Å; K95-N160 PolarHBondContact N-O 2.82Å
96	G	88.5	Confident	90.7	Very high	34 Å²	34	59.4 Å²	59.4	35%	0.351	32%	0.322	S	S	.	.	B	Isolated β-bridge	trans	-87.4	178.6	170.6	0	0	0	0	0	111.8	T94 N98 G99	T94-G96 PolarHBondContact O-N 3.42Å; G96-N98 PolarHBondContact O-N 2.95Å; G96-N98 VanDerWaalsContact O-N 3.08Å; G96-G99 WeakPolarHBondContact CA-O 3.4Å; G96-G99 PolarHBondContact N-O 3.26Å; G96-G99 PolarHBondContact O-N 2.79Å
97	S	86.1	Confident	90.1	Very high	124 Å²	124	58.4 Å²	58.4	87%	0.867	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-30.3	174.6	56.3	0	0	0	0	113.5
98	N	85.4	Confident	88.9	Confident	151 Å²	151	60.2 Å²	60.2	81%	0.807	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.2	21.6	-177.2	-56.3	22.4	0	0	0	111.3	G96	G96-N98 PolarHBondContact O-N 2.95Å; G96-N98 VanDerWaalsContact O-N 3.08Å
99	G	89.9	Confident	87.7	Confident	23 Å²	23	63.4 Å²	63.4	24%	0.237	37%	0.371	C	S	.	.	B	Isolated β-bridge	trans	82.5	-151.6	-173.2	0	0	0	0	0	113.2	G96	G96-G99 WeakPolarHBondContact CA-O 3.4Å; G96-G99 PolarHBondContact N-O 3.26Å; G96-G99 PolarHBondContact O-N 2.79Å
100	Y	92.6	Very high	86.4	Confident	20 Å²	20	66.1 Å²	66.1	8%	0.078	39%	0.385	C	S	.	.	S	Bend	trans	-87	-20	-175	-62.1	-65.9	0	0	0	114.5	L93 K95 F102 P123 A124 I155 C158 C162	L93-Y100 HydrophobicContact CB-CD1 3.73Å; L93-Y100 HydrophobicContact CB-CE1 3.93Å; L93-Y100 HydrophobicContact CD1-CD1 4.44Å; L93-Y100 HydrophobicContact CD1-CG 4.48Å; K95-Y100 HydrophobicContact CB-CD1 4.17Å; K95-Y100 HydrophobicContact CB-CE1 3.67Å; K95-Y100 HydrophobicContact CG-CD1 4.41Å; K95-Y100 HydrophobicContact CG-CE1 4.1Å; K95-Y100 HydrophobicContact CG-CE2 4.42Å; Y100-F102 HydrophobicContact CD2-CE1 4.21Å; Y100-F102 HydrophobicContact CG-CE1 4.12Å; Y100-P123 WeakPolarHBondContact O-CD 3.43Å; Y100-A124 VanDerWaalsContact O-CB 3.31Å; Y100-A124 WeakPolarHBondContact O-CB 3.5Å; Y100-A124 PolarHBondContact O-N 3.01Å; Y100-A124 VanDerWaalsContact O-N 3.08Å; Y100-I155 HydrophobicContact CD2-CG2 4.36Å; Y100-I155 HydrophobicContact CE2-CG2 4.21Å; Y100-C158 PolarHBondContact OH-O 3.17Å; Y100-C162 HydrophobicContact CE1-CB 4.38Å
101	G	93.4	Very high	85.7	Confident	12 Å²	12	64.4 Å²	64.4	12%	0.124	39%	0.389	C	S	.	.			trans	73.4	42.5	178.4	0	0	0	0	0	115.1	D119 S122	G101-D119 VanDerWaalsContact CA-OD2 3.27Å; G101-D119 WeakPolarHBondContact CA-OD2 3.5Å; G101-D119 PolarHBondContact O-N 3.38Å; G101-S122 PolarHBondContact O-OG 2.63Å
102	F	94.9	Very high	85.4	Confident	37 Å²	37	64.7 Å²	64.7	16%	0.162	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	157.2	168.9	74.5	-86.9	0	0	0	110.6	L93 Y100 L104 I115 E117 V118 A124 L129 I155 F164	L93-F102 HydrophobicContact CD1-CD1 4.28Å; L93-F102 HydrophobicContact CD1-CE1 3.75Å; Y100-F102 HydrophobicContact CD2-CE1 4.21Å; Y100-F102 HydrophobicContact CG-CE1 4.12Å; F102-L104 HydrophobicContact CE2-CB 4.19Å; F102-L104 HydrophobicContact CE2-CD1 4.42Å; F102-I115 HydrophobicContact CB-CG2 4.43Å; F102-I115 HydrophobicContact CD2-CD1 3.76Å; F102-I115 HydrophobicContact CE2-CD1 3.97Å; F102-E117 CarbonylContact C-O 3.55Å; F102-E117 VanDerWaalsContact CA-O 3.3Å; F102-E117 WeakPolarHBondContact CA-O 3.43Å; F102-V118 HydrophobicContact CB-CG2 4.26Å; F102-A124 HydrophobicContact CB-CB 3.97Å; F102-A124 HydrophobicContact CD1-CB 4.06Å; F102-A124 HydrophobicContact CG-CB 4.43Å; F102-L129 HydrophobicContact CB-CD2 3.99Å; F102-L129 HydrophobicContact CD1-CD2 4.03Å; F102-L129 HydrophobicContact CD2-CD2 4.26Å; F102-L129 HydrophobicContact CG-CD2 3.82Å; F102-I155 HydrophobicContact CZ-CG2 4.32Å; F102-F164 HydrophobicContact CE1-CE2 4.01Å; F102-F164 HydrophobicContact CE1-CZ 4.18Å; F102-F164 HydrophobicContact CE2-CE2 4.1Å; F102-F164 HydrophobicContact CE2-CZ 4.37Å; F102-F164 AromaticContact CZ-CE2 3.61Å; F102-F164 HydrophobicContact CZ-CE2 3.61Å; F102-F164 AromaticContact CZ-CZ 3.63Å; F102-F164 HydrophobicContact CZ-CZ 3.63Å
103	L	94.2	Very high	85.6	Confident	85 Å²	85	59.9 Å²	59.9	45%	0.445	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	120.7	172.9	175.3	58.5	0	0	0	109.9	K105 G116 E117	L103-K105 HydrophobicContact CG-CG 4.25Å; L103-G116 WeakPolarHBondContact O-CA 3.49Å; L103-G116 PolarHBondContact O-N 3.43Å; L103-E117 PolarHBondContact N-O 2.82Å
104	L	93.6	Very high	85.8	Confident	17 Å²	17	60.7 Å²	60.7	9%	0.089	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	143.6	168	-161.7	69.3	0	0	0	109.9	F102 H113 I115 V135 V151 V152 I155	F102-L104 HydrophobicContact CE2-CB 4.19Å; F102-L104 HydrophobicContact CE2-CD1 4.42Å; L104-H113 HydrophobicContact CD1-CB 4.09Å; L104-H113 HydrophobicContact CD2-CB 4.29Å; L104-H113 HydrophobicContact CG-CB 4.33Å; L104-I115 HydrophobicContact CD1-CD1 3.97Å; L104-V135 HydrophobicContact CD1-CG2 3.94Å; L104-V151 HydrophobicContact CD2-CB 4.47Å; L104-V151 HydrophobicContact CD2-CG1 3.9Å; L104-V152 HydrophobicContact CD2-CG2 3.92Å; L104-I155 HydrophobicContact CD2-CD1 4.05Å
105	K	91.8	Very high	86	Confident	87 Å²	87	56.8 Å²	56.8	38%	0.378	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	158.8	173	-61.5	-176.5	-179.5	174.1	0	109.3	L103 H113 F114 E117	L103-K105 HydrophobicContact CG-CG 4.25Å; K105-H113 CarbonylContact O-C 3.51Å; K105-H113 WeakPolarHBondContact O-CA 3.29Å; K105-F114 PolarHBondContact N-O 3.12Å; K105-F114 PolarHBondContact O-N 2.95Å; K105-E117 IonicContact NZ-OE1 3.38Å
106	E	87.8	Confident	86.2	Confident	99 Å²	99	53.4 Å²	53.4	46%	0.463	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	142.6	169	-171	167	-127	0	0	107.5	P108 H113 H148	E106-P108 WeakPolarHBondContact O-CD 3.49Å; E106-H113 IonicContact OE1-CE1 2.83Å; E106-H113 PolarHBondContact OE1-CE1 2.77Å; E106-H148 HydrophobicContact CB-CB 4.04Å; E106-H148 VanDerWaalsContact CD-CB 3.49Å; E106-H148 HydrophobicContact CG-CB 4.27Å; E106-H148 WeakPolarHBondContact OE1-CB 3.46Å; E106-H148 PolarHBondContact OE1-N 3.35Å; E106-H148 WeakPolarHBondContact OE2-CB 3.25Å
107	D	78.4	Confident	86.5	Confident	47 Å²	47	56.3 Å²	56.3	25%	0.251	34%	0.338	S	S	.	.			trans	-108.2	104.2	173.4	-174	-22.8	0	0	0	109.8	G109 Q110 G111 G112 F114	D107-G109 PolarHBondContact O-N 2.68Å; D107-G109 VanDerWaalsContact O-N 3.15Å; D107-G109 WeakPolarHBondContact OD1-CA 3.42Å; D107-G109 PolarHBondContact OD1-N 2.83Å; D107-Q110 HydrophobicContact CB-CB 4.29Å; D107-Q110 PolarHBondContact O-N 2.8Å; D107-Q110 PolarHBondContact OD1-N 2.81Å; D107-Q110 PolarHBondContact OD2-NE2 2.66Å; D107-G111 PolarHBondContact O-N 3.4Å; D107-G112 PolarHBondContact N-O 3.09Å; D107-F114 HydrophobicContact CB-CD2 3.77Å; D107-F114 HydrophobicContact CB-CE2 3.59Å; D107-F114 HydrophobicContact CB-CZ 4.45Å
108	P	64.7	Low	87	Confident	132 Å²	132	52 Å²	52	86%	0.857	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-18.8	179.7	-23.3	34.4	0	0	0	114.6	E106	E106-P108 WeakPolarHBondContact O-CD 3.49Å
109	G	67.3	Low	87.4	Confident	71 Å²	71	49.6 Å²	49.6	73%	0.732	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-20.2	-179.5	0	0	0	0	0	114.6	D107	D107-G109 PolarHBondContact O-N 2.68Å; D107-G109 VanDerWaalsContact O-N 3.15Å; D107-G109 WeakPolarHBondContact OD1-CA 3.42Å; D107-G109 PolarHBondContact OD1-N 2.83Å
110	Q	65.4	Low	87.7	Confident	103 Å²	103	58.2 Å²	58.2	48%	0.481	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.6	-20	-179.2	-68.1	-174.1	92.6	0	0	114.5	D107 F114	D107-Q110 HydrophobicContact CB-CB 4.29Å; D107-Q110 PolarHBondContact O-N 2.8Å; D107-Q110 PolarHBondContact OD1-N 2.81Å; D107-Q110 PolarHBondContact OD2-NE2 2.66Å; Q110-F114 HydrophobicContact CB-CZ 4.28Å
111	G	75.5	Confident	87.7	Confident	41 Å²	41	59 Å²	59	42%	0.423	34%	0.339	S	S	.	.			trans	77.2	145.6	-174.8	0	0	0	0	0	113.5	D107 F114	D107-G111 PolarHBondContact O-N 3.4Å; G111-F114 WeakPolarHBondContact O-CE2 3.32Å
112	G	86.1	Confident	87.8	Confident	11 Å²	11	59 Å²	59	11%	0.113	34%	0.337	C	S	.	.	S	Bend	trans	84	-173.8	178.6	0	0	0	0	0	114.7	D107 F114	D107-G112 PolarHBondContact N-O 3.09Å; G112-F114 WeakPolarHBondContact O-CD2 3.48Å; G112-F114 WeakPolarHBondContact O-CE2 3.34Å
113	H	92.7	Very high	87.8	Confident	3 Å²	3	59 Å²	59	1%	0.014	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	133.9	-163.1	-51.8	-64.4	0	0	0	111.3	L104 K105 E106 R134 V135 V143 C146 H148	L104-H113 HydrophobicContact CD1-CB 4.09Å; L104-H113 HydrophobicContact CD2-CB 4.29Å; L104-H113 HydrophobicContact CG-CB 4.33Å; K105-H113 CarbonylContact O-C 3.51Å; K105-H113 WeakPolarHBondContact O-CA 3.29Å; E106-H113 IonicContact OE1-CE1 2.83Å; E106-H113 PolarHBondContact OE1-CE1 2.77Å; H113-R134 CarbonylContact O-C 3.6Å; H113-R134 WeakPolarHBondContact O-CA 3.3Å; H113-R134 WeakPolarHBondContact O-CG 3.35Å; H113-V135 PolarHBondContact O-N 3.06Å; H113-V143 PolarHBondContact NE2-O 3.02Å; H113-V143 VanDerWaalsContact NE2-O 3.1Å; H113-C146 PolarHBondContact CE1-O 3.18Å; H113-C146 VanDerWaalsContact CE1-O 3.26Å; H113-C146 PolarHBondContact NE2-O 3.22Å; H113-H148 WeakPolarHBondContact CE1-CA 3.43Å; H113-H148 WeakPolarHBondContact CE1-CB 3.47Å; H113-H148 PolarHBondContact CE1-N 3Å; H113-H148 AromaticContact ND1-ND1 3.49Å; H113-H148 PolarHBondContact ND1-ND1 3.43Å
114	F	94.3	Very high	87.9	Confident	19 Å²	19	54.9 Å²	54.9	8%	0.083	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	146.2	-171.4	-64.3	-96.3	0	0	0	111.5	K105 D107 Q110 G111 G112 G116 D133 R134	K105-F114 PolarHBondContact N-O 3.12Å; K105-F114 PolarHBondContact O-N 2.95Å; D107-F114 HydrophobicContact CB-CD2 3.77Å; D107-F114 HydrophobicContact CB-CE2 3.59Å; D107-F114 HydrophobicContact CB-CZ 4.45Å; Q110-F114 HydrophobicContact CB-CZ 4.28Å; G111-F114 WeakPolarHBondContact O-CE2 3.32Å; G112-F114 WeakPolarHBondContact O-CD2 3.48Å; G112-F114 WeakPolarHBondContact O-CE2 3.34Å; F114-G116 PolarHBondContact O-N 3.08Å; F114-D133 CarbonylContact C-O 3.59Å; F114-D133 WeakPolarHBondContact CA-O 3.21Å; F114-R134 HydrophobicContact CD1-CB 3.76Å; F114-R134 HydrophobicContact CD1-CG 3.93Å; F114-R134 HydrophobicContact CE1-CB 3.59Å; F114-R134 HydrophobicContact CE1-CG 3.58Å; F114-R134 HydrophobicContact CE2-CG 4.2Å; F114-R134 HydrophobicContact CG-CG 4.41Å; F114-R134 HydrophobicContact CZ-CB 4.26Å; F114-R134 VanDerWaalsContact CZ-CD 3.49Å; F114-R134 HydrophobicContact CZ-CG 3.73Å
115	I	95.1	Very high	88	Confident	1 Å²	1	57.5 Å²	57.5	1%	0.005	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	117	173.1	-54.5	-54.2	0	0	0	109.4	F102 L104 V118 L129 R130 M132 D133 V135	F102-I115 HydrophobicContact CB-CG2 4.43Å; F102-I115 HydrophobicContact CD2-CD1 3.76Å; F102-I115 HydrophobicContact CE2-CD1 3.97Å; L104-I115 HydrophobicContact CD1-CD1 3.97Å; I115-V118 HydrophobicContact CG2-CG2 3.42Å; I115-V118 VanDerWaalsContact CG2-CG2 3.42Å; I115-L129 HydrophobicContact CD1-CD1 4.21Å; I115-L129 HydrophobicContact CD1-CD2 3.82Å; I115-L129 HydrophobicContact CD1-CG 4.27Å; I115-L129 HydrophobicContact CG1-CD1 3.88Å; I115-L129 HydrophobicContact CG1-CD2 4.01Å; I115-L129 HydrophobicContact CG1-CG 3.92Å; I115-L129 HydrophobicContact CG2-CD2 4.1Å; I115-L129 HydrophobicContact CG2-CG 4.17Å; I115-R130 WeakPolarHBondContact CB-O 3.31Å; I115-R130 WeakPolarHBondContact CG2-O 3.42Å; I115-M132 PolarHBondContact O-N 2.81Å; I115-D133 HydrophobicContact CB-CB 4.33Å; I115-D133 HydrophobicContact CG1-CB 3.99Å; I115-D133 PolarHBondContact N-O 3.15Å; I115-V135 HydrophobicContact CD1-CG2 3.73Å; I115-V135 HydrophobicContact CG1-CG2 4.28Å
116	G	93.5	Very high	88.1	Confident	4 Å²	4	61.3 Å²	61.3	4%	0.041	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	-82.8	-178.9	0	0	0	0	0	112.9	L103 F114 K131	L103-G116 WeakPolarHBondContact O-CA 3.49Å; L103-G116 PolarHBondContact O-N 3.43Å; F114-G116 PolarHBondContact O-N 3.08Å; G116-K131 WeakPolarHBondContact O-CD 3.34Å; G116-K131 WeakPolarHBondContact O-CE 3.32Å; G116-K131 WeakPolarHBondContact O-CG 3.19Å
117	E	93.6	Very high	88.3	Confident	95 Å²	95	58.1 Å²	58.1	44%	0.444	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	154	172.2	-89.8	111.6	-114.4	0	0	110	F102 L103 K105 K131	F102-E117 CarbonylContact C-O 3.55Å; F102-E117 VanDerWaalsContact CA-O 3.3Å; F102-E117 WeakPolarHBondContact CA-O 3.43Å; L103-E117 PolarHBondContact N-O 2.82Å; K105-E117 IonicContact NZ-OE1 3.38Å; E117-K131 IonicContact OE1-NZ 2.66Å; E117-K131 PolarHBondContact OE1-NZ 2.88Å
118	V	96.1	Very high	89.1	Confident	35 Å²	35	57.4 Å²	57.4	21%	0.212	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	126	178.8	-177.3	0	0	0	0	107.1	F102 I115 A124 D125	F102-V118 HydrophobicContact CB-CG2 4.26Å; I115-V118 HydrophobicContact CG2-CG2 3.42Å; I115-V118 VanDerWaalsContact CG2-CG2 3.42Å; V118-A124 HydrophobicContact CG1-CB 3.78Å; V118-D125 HydrophobicContact CG1-CB 3.98Å
119	D	95.4	Very high	90.5	Very high	100 Å²	100	51.3 Å²	51.3	54%	0.535	30%	0.304	S	S	.	.			trans	-77.3	128	-173.7	-64.1	-47.6	0	0	0	110.4	G101 G121 S122 D125	G101-D119 VanDerWaalsContact CA-OD2 3.27Å; G101-D119 WeakPolarHBondContact CA-OD2 3.5Å; G101-D119 PolarHBondContact O-N 3.38Å; D119-G121 PolarHBondContact O-N 3.37Å; D119-S122 WeakPolarHBondContact O-CB 3.44Å; D119-S122 PolarHBondContact O-N 3.35Å; D119-S122 PolarHBondContact O-OG 3.33Å; D119-D125 WeakPolarHBondContact O-CB 3.06Å
120	K	95.4	Very high	91.8	Very high	204 Å²	204	54.7 Å²	54.7	89%	0.887	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	127.2	-177	-173.2	175.3	-179.4	177.6	0	111.5	S122	K120-S122 VanDerWaalsContact C-N 3.3Å
121	G	93.1	Very high	93.2	Very high	36 Å²	36	55.4 Å²	55.4	37%	0.371	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	80	2.8	-175.8	0	0	0	0	0	115	D119 D125 K126	D119-G121 PolarHBondContact O-N 3.37Å; G121-D125 PolarHBondContact N-OD2 3.28Å; G121-K126 WeakPolarHBondContact O-CE 3.47Å; G121-K126 PolarHBondContact O-NZ 3.39Å
122	S	95.4	Very high	94	Very high	13 Å²	13	58.7 Å²	58.7	9%	0.091	30%	0.302	C	S	.	.	S	Bend	trans	-66.5	169.6	172.5	66.1	0	0	0	0	113.1	G101 D119 K120 A124 D125 K126	G101-S122 PolarHBondContact O-OG 2.63Å; D119-S122 WeakPolarHBondContact O-CB 3.44Å; D119-S122 PolarHBondContact O-N 3.35Å; D119-S122 PolarHBondContact O-OG 3.33Å; K120-S122 VanDerWaalsContact C-N 3.3Å; S122-A124 VanDerWaalsContact C-N 3.27Å; S122-A124 PolarHBondContact O-N 2.75Å; S122-A124 PolarHBondContact OG-N 3.34Å; S122-D125 WeakPolarHBondContact OG-CB 3.31Å; S122-D125 PolarHBondContact OG-N 3.05Å; S122-K126 WeakPolarHBondContact O-CB 3.48Å; S122-K126 WeakPolarHBondContact O-CD 3.28Å; S122-K126 VanDerWaalsContact O-CG 3.29Å; S122-K126 WeakPolarHBondContact O-CG 3.12Å; S122-K126 PolarHBondContact O-N 3.02Å
123	P	95	Very high	94.4	Very high	35 Å²	35	58.3 Å²	58.3	23%	0.227	30%	0.297	C	S	.	.	H	α-helix	trans	-57.1	-37.6	166.5	-24.5	34.4	0	0	0	113.8	T94 Y100 K126 A127	T94-P123 WeakPolarHBondContact O-CB 3.42Å; T94-P123 VanDerWaalsContact O-CG 3.28Å; T94-P123 WeakPolarHBondContact O-CG 3.44Å; Y100-P123 WeakPolarHBondContact O-CD 3.43Å; P123-K126 PolarHBondContact O-N 3.24Å; P123-A127 VanDerWaalsContact O-CB 3.23Å; P123-A127 WeakPolarHBondContact O-CB 3.45Å; P123-A127 PolarHBondContact O-N 3.01Å
124	A	95.5	Very high	94.6	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-66.2	-45.9	178.5	0	0	0	0	0	113.3	L93 Y100 F102 V118 S122 A127 G128 L129	L93-A124 HydrophobicContact CD2-CB 4.1Å; Y100-A124 VanDerWaalsContact O-CB 3.31Å; Y100-A124 WeakPolarHBondContact O-CB 3.5Å; Y100-A124 PolarHBondContact O-N 3.01Å; Y100-A124 VanDerWaalsContact O-N 3.08Å; F102-A124 HydrophobicContact CB-CB 3.97Å; F102-A124 HydrophobicContact CD1-CB 4.06Å; F102-A124 HydrophobicContact CG-CB 4.43Å; V118-A124 HydrophobicContact CG1-CB 3.78Å; S122-A124 VanDerWaalsContact C-N 3.27Å; S122-A124 PolarHBondContact O-N 2.75Å; S122-A124 PolarHBondContact OG-N 3.34Å; A124-A127 PolarHBondContact O-N 3.3Å; A124-G128 PolarHBondContact O-N 3.49Å; A124-L129 HydrophobicContact CB-CB 4.17Å; A124-L129 HydrophobicContact CB-CD2 3.86Å; A124-L129 VanDerWaalsContact O-CB 3.31Å; A124-L129 WeakPolarHBondContact O-CB 3.42Å; A124-L129 PolarHBondContact O-N 3.06Å
125	D	95.1	Very high	94.6	Very high	72 Å²	72	57.7 Å²	57.7	39%	0.385	29%	0.294	S	S	.	.	H	α-helix	trans	-59.2	-47.4	174	-176.5	43.5	0	0	0	110.8	V118 D119 G121 S122 A127 G128	V118-D125 HydrophobicContact CG1-CB 3.98Å; D119-D125 WeakPolarHBondContact O-CB 3.06Å; G121-D125 PolarHBondContact N-OD2 3.28Å; S122-D125 WeakPolarHBondContact OG-CB 3.31Å; S122-D125 PolarHBondContact OG-N 3.05Å; D125-A127 VanDerWaalsContact C-N 3.31Å; D125-A127 PolarHBondContact O-N 3.36Å; D125-G128 PolarHBondContact O-N 3.06Å
126	K	94.1	Very high	94.4	Very high	166 Å²	166	57.7 Å²	57.7	72%	0.722	29%	0.294	S	S	*	.	H	α-helix	trans	-64.8	-30	177.7	-73.5	166.1	176	152.9	0	113.9	G121 S122 P123 G128	G121-K126 WeakPolarHBondContact O-CE 3.47Å; G121-K126 PolarHBondContact O-NZ 3.39Å; S122-K126 WeakPolarHBondContact O-CB 3.48Å; S122-K126 WeakPolarHBondContact O-CD 3.28Å; S122-K126 VanDerWaalsContact O-CG 3.29Å; S122-K126 WeakPolarHBondContact O-CG 3.12Å; S122-K126 PolarHBondContact O-N 3.02Å; P123-K126 PolarHBondContact O-N 3.24Å; K126-G128 VanDerWaalsContact C-N 3.28Å
127	A	93.6	Very high	94.2	Very high	32 Å²	32	57.5 Å²	57.5	26%	0.264	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-3.8	175.3	0	0	0	0	0	113.2	I91 L93 P123 A124 D125	I91-A127 WeakPolarHBondContact CD1-O 3.27Å; I91-A127 HydrophobicContact CG2-CB 3.66Å; L93-A127 HydrophobicContact CD2-CB 3.79Å; P123-A127 VanDerWaalsContact O-CB 3.23Å; P123-A127 WeakPolarHBondContact O-CB 3.45Å; P123-A127 PolarHBondContact O-N 3.01Å; A124-A127 PolarHBondContact O-N 3.3Å; D125-A127 VanDerWaalsContact C-N 3.31Å; D125-A127 PolarHBondContact O-N 3.36Å
128	G	93.3	Very high	93.9	Very high	32 Å²	32	53.2 Å²	53.2	33%	0.33	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.6	20.4	178.3	0	0	0	0	0	114.9	R89 A124 D125 K126	R89-G128 PolarHBondContact NH1-O 2.87Å; A124-G128 PolarHBondContact O-N 3.49Å; D125-G128 PolarHBondContact O-N 3.06Å; K126-G128 VanDerWaalsContact C-N 3.28Å
129	L	95.7	Very high	93.2	Very high	5 Å²	5	55.4 Å²	55.4	3%	0.026	28%	0.283	C	S	.	.			trans	-71.5	135.5	171.2	-162.9	68.5	0	0	0	109.8	I91 F102 I115 A124 F164 V166	I91-L129 HydrophobicContact CB-CD1 4.31Å; I91-L129 HydrophobicContact CG1-CD1 3.96Å; I91-L129 HydrophobicContact CG2-CB 4.12Å; I91-L129 HydrophobicContact CG2-CD1 4.1Å; F102-L129 HydrophobicContact CB-CD2 3.99Å; F102-L129 HydrophobicContact CD1-CD2 4.03Å; F102-L129 HydrophobicContact CD2-CD2 4.26Å; F102-L129 HydrophobicContact CG-CD2 3.82Å; I115-L129 HydrophobicContact CD1-CD1 4.21Å; I115-L129 HydrophobicContact CD1-CD2 3.82Å; I115-L129 HydrophobicContact CD1-CG 4.27Å; I115-L129 HydrophobicContact CG1-CD1 3.88Å; I115-L129 HydrophobicContact CG1-CD2 4.01Å; I115-L129 HydrophobicContact CG1-CG 3.92Å; I115-L129 HydrophobicContact CG2-CD2 4.1Å; I115-L129 HydrophobicContact CG2-CG 4.17Å; A124-L129 HydrophobicContact CB-CB 4.17Å; A124-L129 HydrophobicContact CB-CD2 3.86Å; A124-L129 VanDerWaalsContact O-CB 3.31Å; A124-L129 WeakPolarHBondContact O-CB 3.42Å; A124-L129 PolarHBondContact O-N 3.06Å; L129-F164 HydrophobicContact CD1-CD2 4.17Å; L129-F164 HydrophobicContact CD2-CE2 4.49Å; L129-V166 HydrophobicContact CD1-CG1 3.92Å
130	R	94.5	Very high	92.2	Very high	142 Å²	142	51.6 Å²	51.6	54%	0.536	27%	0.268	S	S	.	.			trans	-123.4	152	-173.6	-53.1	175	-176.5	163.8	-1.3	112.1	I115 D133	I115-R130 WeakPolarHBondContact CB-O 3.31Å; I115-R130 WeakPolarHBondContact CG2-O 3.42Å; R130-D133 WeakPolarHBondContact CB-OD2 3.31Å; R130-D133 PolarHBondContact N-OD2 3.1Å; R130-D133 VanDerWaalsContact O-CB 3.27Å; R130-D133 WeakPolarHBondContact O-CB 3.45Å; R130-D133 VanDerWaalsContact O-CG 3.29Å; R130-D133 PolarHBondContact O-N 2.66Å; R130-D133 VanDerWaalsContact O-N 3.13Å
131	K	94.2	Very high	91.5	Very high	118 Å²	118	45.4 Å²	45.4	51%	0.513	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	135.2	168.3	172.1	153.3	-167.7	160.5	0	110.4	G116 E117 D133	G116-K131 WeakPolarHBondContact O-CD 3.34Å; G116-K131 WeakPolarHBondContact O-CE 3.32Å; G116-K131 WeakPolarHBondContact O-CG 3.19Å; E117-K131 IonicContact OE1-NZ 2.66Å; E117-K131 PolarHBondContact OE1-NZ 2.88Å; K131-D133 VanDerWaalsContact C-N 3.29Å
132	M	92.5	Very high	91	Very high	109 Å²	109	46.5 Å²	46.5	54%	0.537	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.5	8.2	-172.4	-46.8	-58.6	-66.8	0	0	116.2	I115 R134	I115-M132 PolarHBondContact O-N 2.81Å; M132-R134 PolarHBondContact O-N 2.9Å
133	D	95.3	Very high	90.7	Very high	3 Å²	3	45.9 Å²	45.9	2%	0.016	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-63.8	130.8	165.8	-75.8	-12.9	0	0	0	109.7	R89 F114 I115 R130 K131 V166 V167	R89-D133 IonicContact CZ-OD1 3.37Å; R89-D133 IonicContact CZ-OD2 2.73Å; R89-D133 IonicContact NH1-OD1 3.44Å; R89-D133 PolarHBondContact NH1-OD1 3.38Å; R89-D133 IonicContact NH1-OD2 3.69Å; R89-D133 PolarHBondContact NH1-OD2 2.73Å; R89-D133 IonicContact NH2-OD1 3.79Å; R89-D133 PolarHBondContact NH2-OD1 3.19Å; R89-D133 IonicContact NH2-OD2 2.68Å; F114-D133 CarbonylContact C-O 3.59Å; F114-D133 WeakPolarHBondContact CA-O 3.21Å; I115-D133 HydrophobicContact CB-CB 4.33Å; I115-D133 HydrophobicContact CG1-CB 3.99Å; I115-D133 PolarHBondContact N-O 3.15Å; R130-D133 WeakPolarHBondContact CB-OD2 3.31Å; R130-D133 PolarHBondContact N-OD2 3.1Å; R130-D133 VanDerWaalsContact O-CB 3.27Å; R130-D133 WeakPolarHBondContact O-CB 3.45Å; R130-D133 VanDerWaalsContact O-CG 3.29Å; R130-D133 PolarHBondContact O-N 2.66Å; R130-D133 VanDerWaalsContact O-N 3.13Å; K131-D133 VanDerWaalsContact C-N 3.29Å; D133-V166 HydrophobicContact CB-CB 4.15Å; D133-V166 HydrophobicContact CB-CG2 4.19Å; D133-V167 CarbonylContact C-O 3.56Å; D133-V167 WeakPolarHBondContact CA-O 3.31Å
134	R	95.1	Very high	90.1	Very high	10 Å²	10	47.2 Å²	47.2	4%	0.038	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	128.1	171.2	-165.3	175.5	74.2	81.3	-18.9	109.6	H113 F114 M132 D144 V166 V167 D172	H113-R134 CarbonylContact O-C 3.6Å; H113-R134 WeakPolarHBondContact O-CA 3.3Å; H113-R134 WeakPolarHBondContact O-CG 3.35Å; F114-R134 HydrophobicContact CD1-CB 3.76Å; F114-R134 HydrophobicContact CD1-CG 3.93Å; F114-R134 HydrophobicContact CE1-CB 3.59Å; F114-R134 HydrophobicContact CE1-CG 3.58Å; F114-R134 HydrophobicContact CE2-CG 4.2Å; F114-R134 HydrophobicContact CG-CG 4.41Å; F114-R134 HydrophobicContact CZ-CB 4.26Å; F114-R134 VanDerWaalsContact CZ-CD 3.49Å; F114-R134 HydrophobicContact CZ-CG 3.73Å; M132-R134 PolarHBondContact O-N 2.9Å; R134-D144 IonicContact CZ-OD1 2.79Å; R134-D144 IonicContact CZ-OD2 3.78Å; R134-D144 IonicContact NH1-OD1 2.85Å; R134-D144 PolarHBondContact NH1-OD1 2.93Å; R134-D144 IonicContact NH1-OD2 3.73Å; R134-D144 PolarHBondContact NH1-OD2 2.81Å; R134-D144 VanDerWaalsContact NH1-OD2 3.09Å; R134-D144 IonicContact NH2-OD1 2.68Å; R134-D144 IonicContact NH2-OD2 3.4Å; R134-D144 PolarHBondContact NH2-OD2 3.3Å; R134-D144 VanDerWaalsContact NH2-OD2 3.12Å; R134-V166 CarbonylContact O-C 3.57Å; R134-V166 WeakPolarHBondContact O-CA 3.41Å; R134-V166 WeakPolarHBondContact O-CB 3.46Å; R134-V167 HydrophobicContact CB-CG2 3.91Å; R134-V167 PolarHBondContact N-O 2.84Å; R134-V167 PolarHBondContact O-N 2.75Å; R134-D172 IonicContact CZ-OD1 3.26Å; R134-D172 VanDerWaalsContact CZ-OD1 3.31Å; R134-D172 IonicContact NE-OD1 3.17Å; R134-D172 PolarHBondContact NE-OD1 2.75Å; R134-D172 IonicContact NE-OD2 2.38Å; R134-D172 IonicContact NH2-OD1 2.76Å; R134-D172 PolarHBondContact NH2-OD1 2.76Å
135	V	94.4	Very high	89.4	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	122.7	172.8	-173.5	0	0	0	0	108.3	L104 H113 I115 V138 V143 F164 V166	L104-V135 HydrophobicContact CD1-CG2 3.94Å; H113-V135 PolarHBondContact O-N 3.06Å; I115-V135 HydrophobicContact CD1-CG2 3.73Å; I115-V135 HydrophobicContact CG1-CG2 4.28Å; V135-V138 HydrophobicContact CG1-CG2 3.95Å; V135-V143 HydrophobicContact CB-CG2 4.47Å; V135-V143 HydrophobicContact CG1-CG2 4.04Å; V135-V143 WeakPolarHBondContact O-CG2 3.14Å; V135-F164 HydrophobicContact CG1-CD1 4.47Å; V135-F164 HydrophobicContact CG1-CG 4.37Å; V135-F164 HydrophobicContact CG2-CD2 4.46Å; V135-V166 HydrophobicContact CG2-CG1 4.31Å
136	V	92.4	Very high	88.8	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	-32.8	178.4	-172.3	0	0	0	0	110.9	D142 V143 L165 V167 P182 M183	V136-D142 WeakPolarHBondContact O-CA 3.48Å; V136-V143 WeakPolarHBondContact O-CG2 3.46Å; V136-V143 PolarHBondContact O-N 2.88Å; V136-L165 HydrophobicContact CB-CD2 4.13Å; V136-L165 HydrophobicContact CB-CG 4.29Å; V136-L165 HydrophobicContact CG1-CD2 4.21Å; V136-L165 PolarHBondContact N-O 2.9Å; V136-V167 HydrophobicContact CG2-CG1 4.16Å; V136-V167 HydrophobicContact CG2-CG2 3.78Å; V136-P182 HydrophobicContact CG1-CB 4.09Å; V136-P182 HydrophobicContact CG1-CG 4.17Å; V136-P182 HydrophobicContact CG2-CB 4.15Å; V136-P182 HydrophobicContact CG2-CG 4.04Å; V136-M183 HydrophobicContact CG1-CG 4.25Å
137	A	89.6	Confident	88.5	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	151.2	175.9	0	0	0	0	0	113.1	T141 F164 L165 M183	A137-T141 CarbonylContact C-O 3.47Å; A137-T141 WeakPolarHBondContact CA-O 3.39Å; A137-T141 VanDerWaalsContact CB-O 3.32Å; A137-T141 WeakPolarHBondContact CB-O 3.48Å; A137-F164 WeakPolarHBondContact O-CA 3.23Å; A137-L165 HydrophobicContact CB-CB 3.78Å; A137-L165 HydrophobicContact CB-CD2 4.39Å; A137-L165 PolarHBondContact N-O 3.08Å; A137-L165 PolarHBondContact O-N 3.44Å; A137-M183 HydrophobicContact CB-SD 3.65Å
138	V	86.7	Confident	88.2	Confident	5 Å²	5	50 Å²	50	3%	0.03	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	122.1	171.9	177	0	0	0	0	108.5	V135 G140 T141 V143 V151 I155 F164	V135-V138 HydrophobicContact CG1-CG2 3.95Å; V138-G140 PolarHBondContact O-N 3.33Å; V138-T141 PolarHBondContact N-O 2.8Å; V138-T141 WeakPolarHBondContact O-CB 3.34Å; V138-T141 PolarHBondContact O-N 2.86Å; V138-V143 HydrophobicContact CB-CG1 4.19Å; V138-V143 HydrophobicContact CG2-CG1 3.88Å; V138-V151 HydrophobicContact CG2-CG1 4.12Å; V138-I155 HydrophobicContact CG1-CG1 4.11Å; V138-I155 HydrophobicContact CG2-CD1 4.38Å; V138-I155 HydrophobicContact CG2-CG1 4.22Å; V138-F164 HydrophobicContact CB-CD1 4.41Å; V138-F164 HydrophobicContact CB-CE1 4.45Å; V138-F164 HydrophobicContact CG1-CD1 4.36Å; V138-F164 HydrophobicContact CG1-CE1 4.09Å; V138-F164 HydrophobicContact CG2-CD1 3.86Å; V138-F164 HydrophobicContact CG2-CE1 3.78Å
139	N	81.3	Confident	87.9	Confident	81 Å²	81	55.5 Å²	55.5	43%	0.433	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.4	20	-171.4	-62.9	-15.9	0	0	0	114.8	C158 S163	N139-C158 PolarHBondContact ND2-SG 2.7Å; N139-S163 PolarHBondContact N-O 3.23Å; N139-S163 PolarHBondContact OD1-N 2.99Å
140	G	74.9	Confident	87.4	Confident	21 Å²	21	59.8 Å²	59.8	22%	0.216	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.1	7.5	-176	0	0	0	0	0	115.9	V138	V138-G140 PolarHBondContact O-N 3.33Å
141	T	79	Confident	87	Confident	74 Å²	74	53 Å²	53	45%	0.454	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	122.2	163.7	-55.9	0	0	0	0	108.5	A137 V138 W154	A137-T141 CarbonylContact C-O 3.47Å; A137-T141 WeakPolarHBondContact CA-O 3.39Å; A137-T141 VanDerWaalsContact CB-O 3.32Å; A137-T141 WeakPolarHBondContact CB-O 3.48Å; V138-T141 PolarHBondContact N-O 2.8Å; V138-T141 WeakPolarHBondContact O-CB 3.34Å; V138-T141 PolarHBondContact O-N 2.86Å; T141-W154 HydrophobicContact CG2-CE3 4.46Å; T141-W154 HydrophobicContact CG2-CH2 3.64Å; T141-W154 HydrophobicContact CG2-CZ3 3.61Å
142	D	84.5	Confident	86.7	Confident	59 Å²	59	48.9 Å²	48.9	32%	0.316	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.1	133.3	172.2	-176.8	-17.4	0	0	0	110.4	V136 D144 M183	V136-D142 WeakPolarHBondContact O-CA 3.48Å; D142-D144 WeakPolarHBondContact OD1-CB 3.19Å; D142-D144 PolarHBondContact OD1-N 3.21Å; D142-M183 HydrophobicContact CB-CE 4.33Å; D142-M183 HydrophobicContact CB-CG 4.14Å; D142-M183 HydrophobicContact CB-SD 4.23Å
143	V	87.8	Confident	86.2	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.241	C	C	.	.			trans	-112.2	0.3	-179.9	-61.2	0	0	0	0	114.5	H113 V135 V136 V138 K145 C146 V151 W154	H113-V143 PolarHBondContact NE2-O 3.02Å; H113-V143 VanDerWaalsContact NE2-O 3.1Å; V135-V143 HydrophobicContact CB-CG2 4.47Å; V135-V143 HydrophobicContact CG1-CG2 4.04Å; V135-V143 WeakPolarHBondContact O-CG2 3.14Å; V136-V143 WeakPolarHBondContact O-CG2 3.46Å; V136-V143 PolarHBondContact O-N 2.88Å; V138-V143 HydrophobicContact CB-CG1 4.19Å; V138-V143 HydrophobicContact CG2-CG1 3.88Å; V143-K145 PolarHBondContact O-N 3.08Å; V143-C146 HydrophobicContact CB-CB 4.44Å; V143-C146 PolarHBondContact O-N 3.2Å; V143-V151 HydrophobicContact CB-CG2 3.74Å; V143-V151 HydrophobicContact CG1-CG1 4.17Å; V143-V151 HydrophobicContact CG1-CG2 3.83Å; V143-W154 HydrophobicContact CG1-CE3 4.17Å; V143-W154 HydrophobicContact CG1-CZ3 4.03Å
144	D	82.6	Confident	85.6	Confident	63 Å²	63	50.8 Å²	50.8	34%	0.337	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-17.9	-174.7	-79.7	20.9	0	0	0	112.9	R134 D142	R134-D144 IonicContact CZ-OD1 2.79Å; R134-D144 IonicContact CZ-OD2 3.78Å; R134-D144 IonicContact NH1-OD1 2.85Å; R134-D144 PolarHBondContact NH1-OD1 2.93Å; R134-D144 IonicContact NH1-OD2 3.73Å; R134-D144 PolarHBondContact NH1-OD2 2.81Å; R134-D144 VanDerWaalsContact NH1-OD2 3.09Å; R134-D144 IonicContact NH2-OD1 2.68Å; R134-D144 IonicContact NH2-OD2 3.4Å; R134-D144 PolarHBondContact NH2-OD2 3.3Å; R134-D144 VanDerWaalsContact NH2-OD2 3.12Å; D142-D144 WeakPolarHBondContact OD1-CB 3.19Å; D142-D144 PolarHBondContact OD1-N 3.21Å
145	K	80.2	Confident	85.1	Confident	201 Å²	201	51 Å²	51	87%	0.874	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.9	5.7	177.1	-62.7	176.2	-175	168.7	0	113.9	V143	V143-K145 PolarHBondContact O-N 3.08Å
146	C	83.5	Confident	84.4	Confident	23 Å²	23	58.9 Å²	58.9	16%	0.155	29%	0.288	C	S	.	.	S	Bend	trans	-96.1	143.4	-178.4	-63.3	0	0	0	0	111	H113 V143 Q150 V151 W154	H113-C146 PolarHBondContact CE1-O 3.18Å; H113-C146 VanDerWaalsContact CE1-O 3.26Å; H113-C146 PolarHBondContact NE2-O 3.22Å; V143-C146 HydrophobicContact CB-CB 4.44Å; V143-C146 PolarHBondContact O-N 3.2Å; C146-Q150 HydrophobicContact CB-CB 4.43Å; C146-V151 HydrophobicContact CB-CG2 3.63Å; C146-W154 HydrophobicContact CB-CZ3 4.44Å; C146-W154 WeakPolarHBondContact SG-CH2 3.41Å; C146-W154 VanDerWaalsContact SG-CZ3 3.51Å
147	S	87.1	Confident	83.7	Confident	54 Å²	54	65.6 Å²	65.6	38%	0.378	32%	0.324	S	S	.	.			trans	-66.9	150.1	170	64.6	0	0	0	0	111	K149 Q150 V151	S147-K149 PolarHBondContact O-N 3.08Å; S147-K149 VanDerWaalsContact O-N 3.11Å; S147-Q150 PolarHBondContact O-N 3.18Å; S147-Q150 WeakPolarHBondContact OG-CG 3.48Å; S147-Q150 PolarHBondContact OG-N 2.92Å; S147-Q150 PolarHBondContact OG-OE1 2.9Å; S147-V151 PolarHBondContact O-N 2.93Å
148	H	87.8	Confident	83	Confident	49 Å²	49	66 Å²	66	23%	0.227	33%	0.327	C	S	.	.	H	α-helix	trans	-51.5	-37.9	178	-176.3	76.4	0	0	0	113.3	E106 H113 V151 V152	E106-H148 HydrophobicContact CB-CB 4.04Å; E106-H148 VanDerWaalsContact CD-CB 3.49Å; E106-H148 HydrophobicContact CG-CB 4.27Å; E106-H148 WeakPolarHBondContact OE1-CB 3.46Å; E106-H148 PolarHBondContact OE1-N 3.35Å; E106-H148 WeakPolarHBondContact OE2-CB 3.25Å; H113-H148 WeakPolarHBondContact CE1-CA 3.43Å; H113-H148 WeakPolarHBondContact CE1-CB 3.47Å; H113-H148 PolarHBondContact CE1-N 3Å; H113-H148 AromaticContact ND1-ND1 3.49Å; H113-H148 PolarHBondContact ND1-ND1 3.43Å; H148-V151 PolarHBondContact O-N 2.98Å; H148-V152 WeakPolarHBondContact O-CB 3.19Å; H148-V152 VanDerWaalsContact O-CG2 3.31Å; H148-V152 WeakPolarHBondContact O-CG2 3.4Å; H148-V152 PolarHBondContact O-N 3.17Å
149	K	86.1	Confident	82.3	Confident	148 Å²	148	72.5 Å²	72.5	64%	0.643	36%	0.361	S	S	*	.	H	α-helix	trans	-60.6	-48.4	175.4	-176.8	178.5	176.3	-173.5	0	112.3	S147 V151 V152 D153	S147-K149 PolarHBondContact O-N 3.08Å; S147-K149 VanDerWaalsContact O-N 3.11Å; K149-V151 VanDerWaalsContact C-N 3.29Å; K149-V151 PolarHBondContact O-N 3.35Å; K149-V152 PolarHBondContact O-N 3.07Å; K149-D153 WeakPolarHBondContact CE-OD2 3.38Å; K149-D153 WeakPolarHBondContact CG-OD2 3.38Å; K149-D153 WeakPolarHBondContact O-CB 2.94Å; K149-D153 PolarHBondContact O-N 3.44Å
150	Q	85.4	Confident	82.2	Confident	96 Å²	96	73.3 Å²	73.3	45%	0.449	37%	0.365	S	S	.	.	H	α-helix	trans	-59.9	-40.9	179.7	-72.5	163	-59.3	0	0	111.5	C146 S147 D153 W154	C146-Q150 HydrophobicContact CB-CB 4.43Å; S147-Q150 PolarHBondContact O-N 3.18Å; S147-Q150 WeakPolarHBondContact OG-CG 3.48Å; S147-Q150 PolarHBondContact OG-N 2.92Å; S147-Q150 PolarHBondContact OG-OE1 2.9Å; Q150-D153 PolarHBondContact O-N 3.43Å; Q150-W154 WeakPolarHBondContact O-CB 3.44Å; Q150-W154 VanDerWaalsContact O-CG 3.31Å; Q150-W154 PolarHBondContact O-N 3.16Å
151	V	86.1	Confident	82.6	Confident	0 Å²	0	76.6 Å²	76.6	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-67.8	-43.7	178.6	-178.1	0	0	0	0	111.4	L104 V138 V143 C146 S147 H148 K149 D153 W154 I155	L104-V151 HydrophobicContact CD2-CB 4.47Å; L104-V151 HydrophobicContact CD2-CG1 3.9Å; V138-V151 HydrophobicContact CG2-CG1 4.12Å; V143-V151 HydrophobicContact CB-CG2 3.74Å; V143-V151 HydrophobicContact CG1-CG1 4.17Å; V143-V151 HydrophobicContact CG1-CG2 3.83Å; C146-V151 HydrophobicContact CB-CG2 3.63Å; S147-V151 PolarHBondContact O-N 2.93Å; H148-V151 PolarHBondContact O-N 2.98Å; K149-V151 VanDerWaalsContact C-N 3.29Å; K149-V151 PolarHBondContact O-N 3.35Å; V151-D153 VanDerWaalsContact C-N 3.34Å; V151-D153 PolarHBondContact O-N 2.86Å; V151-W154 PolarHBondContact O-N 2.99Å; V151-I155 HydrophobicContact CG1-CD1 3.92Å; V151-I155 WeakPolarHBondContact O-CD1 3.46Å; V151-I155 WeakPolarHBondContact O-CG1 3.47Å; V151-I155 PolarHBondContact O-N 3.25Å
152	V	88.3	Confident	82.9	Confident	30 Å²	30	73.1 Å²	73.1	18%	0.182	36%	0.36	C	S	.	.	H	α-helix	trans	-60.8	-42.2	173.7	168.1	0	0	0	0	111.5	L104 H148 K149 I155 R156	L104-V152 HydrophobicContact CD2-CG2 3.92Å; H148-V152 WeakPolarHBondContact O-CB 3.19Å; H148-V152 VanDerWaalsContact O-CG2 3.31Å; H148-V152 WeakPolarHBondContact O-CG2 3.4Å; H148-V152 PolarHBondContact O-N 3.17Å; K149-V152 PolarHBondContact O-N 3.07Å; V152-I155 PolarHBondContact O-N 2.6Å; V152-R156 VanDerWaalsContact O-CG 3.26Å; V152-R156 WeakPolarHBondContact O-CG 3.46Å; V152-R156 PolarHBondContact O-N 1.95Å
153	D	82.9	Confident	83.1	Confident	57 Å²	57	72 Å²	72	31%	0.305	36%	0.357	S	S	.	.	H	α-helix	trans	-73.1	-33.1	-179.2	-68.8	-23.2	0	0	0	111.9	K149 Q150 V151 R156 L157	K149-D153 WeakPolarHBondContact CE-OD2 3.38Å; K149-D153 WeakPolarHBondContact CG-OD2 3.38Å; K149-D153 WeakPolarHBondContact O-CB 2.94Å; K149-D153 PolarHBondContact O-N 3.44Å; Q150-D153 PolarHBondContact O-N 3.43Å; V151-D153 VanDerWaalsContact C-N 3.34Å; V151-D153 PolarHBondContact O-N 2.86Å; D153-R156 PolarHBondContact O-N 3.26Å; D153-R156 IonicContact OD1-CZ 3.74Å; D153-R156 IonicContact OD1-NH1 3.53Å; D153-R156 PolarHBondContact OD1-NH1 2.38Å; D153-L157 WeakPolarHBondContact O-CB 3.29Å; D153-L157 PolarHBondContact O-N 2.98Å
154	W	81.9	Confident	83.3	Confident	95 Å²	95	72 Å²	72	36%	0.36	36%	0.357	S	S	.	.	H	α-helix	trans	-63.4	-42.1	167.1	-73.1	-14.2	0	0	0	112.8	T141 V143 C146 Q150 V151 R156 L157 C158	T141-W154 HydrophobicContact CG2-CE3 4.46Å; T141-W154 HydrophobicContact CG2-CH2 3.64Å; T141-W154 HydrophobicContact CG2-CZ3 3.61Å; V143-W154 HydrophobicContact CG1-CE3 4.17Å; V143-W154 HydrophobicContact CG1-CZ3 4.03Å; C146-W154 HydrophobicContact CB-CZ3 4.44Å; C146-W154 WeakPolarHBondContact SG-CH2 3.41Å; C146-W154 VanDerWaalsContact SG-CZ3 3.51Å; Q150-W154 WeakPolarHBondContact O-CB 3.44Å; Q150-W154 VanDerWaalsContact O-CG 3.31Å; Q150-W154 PolarHBondContact O-N 3.16Å; V151-W154 PolarHBondContact O-N 2.99Å; W154-R156 VanDerWaalsContact C-N 3.28Å; W154-R156 PolarHBondContact O-N 3.1Å; W154-L157 PolarHBondContact O-N 3.49Å; W154-C158 PolarHBondContact O-N 3.05Å; W154-C158 PolarHBondContact O-SG 2.74Å
155	I	83.7	Confident	83.8	Confident	15 Å²	15	69 Å²	69	8%	0.077	34%	0.341	C	S	.	.	H	α-helix	trans	-65.4	-32.6	175.3	-68.1	164.2	0	0	0	111.3	Y100 F102 L104 V138 V151 V152 C158 F164	Y100-I155 HydrophobicContact CD2-CG2 4.36Å; Y100-I155 HydrophobicContact CE2-CG2 4.21Å; F102-I155 HydrophobicContact CZ-CG2 4.32Å; L104-I155 HydrophobicContact CD2-CD1 4.05Å; V138-I155 HydrophobicContact CG1-CG1 4.11Å; V138-I155 HydrophobicContact CG2-CD1 4.38Å; V138-I155 HydrophobicContact CG2-CG1 4.22Å; V151-I155 HydrophobicContact CG1-CD1 3.92Å; V151-I155 WeakPolarHBondContact O-CD1 3.46Å; V151-I155 WeakPolarHBondContact O-CG1 3.47Å; V151-I155 PolarHBondContact O-N 3.25Å; V152-I155 PolarHBondContact O-N 2.6Å; I155-C158 WeakPolarHBondContact O-CB 3.28Å; I155-C158 PolarHBondContact O-N 3.31Å; I155-F164 HydrophobicContact CD1-CE1 3.98Å; I155-F164 HydrophobicContact CD1-CZ 3.71Å; I155-F164 HydrophobicContact CG1-CE1 3.84Å; I155-F164 HydrophobicContact CG1-CZ 3.93Å; I155-F164 HydrophobicContact CG2-CZ 4.49Å
156	R	81.4	Confident	84.5	Confident	165 Å²	165	59.4 Å²	59.4	62%	0.623	30%	0.299	S	S	*	.	H	α-helix	trans	-72.6	-36.8	174.9	-74.4	164.3	172.5	166.6	-3.3	113.1	V152 D153 W154 C158	V152-R156 VanDerWaalsContact O-CG 3.26Å; V152-R156 WeakPolarHBondContact O-CG 3.46Å; V152-R156 PolarHBondContact O-N 1.95Å; D153-R156 PolarHBondContact O-N 3.26Å; D153-R156 IonicContact OD1-CZ 3.74Å; D153-R156 IonicContact OD1-NH1 3.53Å; D153-R156 PolarHBondContact OD1-NH1 2.38Å; W154-R156 VanDerWaalsContact C-N 3.28Å; W154-R156 PolarHBondContact O-N 3.1Å; R156-C158 PolarHBondContact O-N 3.01Å
157	L	76.7	Confident	85.1	Confident	141 Å²	141	58.4 Å²	58.4	74%	0.738	29%	0.292	S	S	*	.	H	α-helix	trans	-67.7	-15.8	175.6	-167.6	65.1	0	0	0	112.5	D153 W154 D159	D153-L157 WeakPolarHBondContact O-CB 3.29Å; D153-L157 PolarHBondContact O-N 2.98Å; W154-L157 PolarHBondContact O-N 3.49Å; L157-D159 PolarHBondContact O-N 2.86Å
158	C	75.9	Confident	85.4	Confident	10 Å²	10	57.7 Å²	57.7	7%	0.068	28%	0.284	C	S	.	.			trans	-72.4	95.7	167.4	-60.6	0	0	0	0	109.9	Y100 N139 W154 I155 R156 N160 T161 C162	Y100-C158 PolarHBondContact OH-O 3.17Å; N139-C158 PolarHBondContact ND2-SG 2.7Å; W154-C158 PolarHBondContact O-N 3.05Å; W154-C158 PolarHBondContact O-SG 2.74Å; I155-C158 WeakPolarHBondContact O-CB 3.28Å; I155-C158 PolarHBondContact O-N 3.31Å; R156-C158 PolarHBondContact O-N 3.01Å; C158-N160 PolarHBondContact O-N 2.91Å; C158-T161 WeakPolarHBondContact CB-O 3.02Å; C158-C162 HydrophobicContact CB-CB 3.82Å; C158-C162 PolarHBondContact SG-SG 3.39Å
159	D	70.2	Confident	85.7	Confident	140 Å²	140	61.6 Å²	61.6	75%	0.749	30%	0.301	S	S	*	.	S	Bend	trans	-48.3	-54.2	-175.9	-89.8	-33	0	0	0	113.1	K95 L157	K95-D159 WeakPolarHBondContact CD-O 3.45Å; K95-D159 WeakPolarHBondContact CE-O 3.4Å; K95-D159 PolarHBondContact NZ-O 2.79Å; L157-D159 PolarHBondContact O-N 2.86Å
160	N	80.3	Confident	86	Confident	98 Å²	98	59.2 Å²	59.2	52%	0.524	30%	0.295	S	S	.	.	S	Bend	trans	-141.7	-19.3	-170.3	-142.2	28.4	0	0	0	114.6	T94 K95 C158	T94-N160 CarbonylContact C-O 3.52Å; T94-N160 WeakPolarHBondContact CA-O 3.36Å; K95-N160 WeakPolarHBondContact CB-O 3.27Å; K95-N160 PolarHBondContact N-O 2.82Å; C158-N160 PolarHBondContact O-N 2.91Å
161	T	83.9	Confident	86.4	Confident	90 Å²	90	54.7 Å²	54.7	55%	0.552	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.2	138	179.7	50.6	0	0	0	0	111.1	L93 T94 C158	L93-T161 CarbonylContact O-C 3.59Å; L93-T161 VanDerWaalsContact O-CA 3.28Å; L93-T161 WeakPolarHBondContact O-CA 3.44Å; T94-T161 HydrophobicContact CG2-CG2 4.32Å; C158-T161 WeakPolarHBondContact CB-O 3.02Å
162	C	85.3	Confident	86.7	Confident	1 Å²	1	55 Å²	55	1%	0.007	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	136.9	-179.2	-167	0	0	0	0	109.9	L93 Y100 C158 F164	L93-C162 WeakPolarHBondContact CA-O 3.45Å; L93-C162 WeakPolarHBondContact CB-O 3.33Å; L93-C162 PolarHBondContact N-O 3.47Å; L93-C162 PolarHBondContact O-N 2.77Å; Y100-C162 HydrophobicContact CE1-CB 4.38Å; C158-C162 HydrophobicContact CB-CB 3.82Å; C158-C162 PolarHBondContact SG-SG 3.39Å; C162-F164 WeakPolarHBondContact SG-CE1 3.26Å
163	S	88.1	Confident	86.9	Confident	36 Å²	36	58.6 Å²	58.6	25%	0.252	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	121.3	-177.6	-66.7	0	0	0	0	110.5	I91 N92 N139	I91-S163 CarbonylContact O-C 3.56Å; I91-S163 WeakPolarHBondContact O-CA 3.49Å; N92-S163 WeakPolarHBondContact OD1-CB 3.44Å; N92-S163 PolarHBondContact OD1-OG 2.82Å; N139-S163 PolarHBondContact N-O 3.23Å; N139-S163 PolarHBondContact OD1-N 2.99Å
164	F	92.5	Very high	87.4	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	143.1	175.1	-61	-20.5	0	0	0	112.3	F90 I91 L93 F102 L129 V135 A137 V138 I155 C162 V166	F90-F164 WeakPolarHBondContact CA-O 3.23Å; I91-F164 HydrophobicContact CB-CB 4.37Å; I91-F164 PolarHBondContact N-O 3.08Å; I91-F164 PolarHBondContact O-N 3.08Å; L93-F164 HydrophobicContact CD1-CD2 3.89Å; L93-F164 HydrophobicContact CD1-CE2 3.47Å; L93-F164 VanDerWaalsContact CD1-CE2 3.47Å; L93-F164 HydrophobicContact CD1-CZ 3.84Å; F102-F164 HydrophobicContact CE1-CE2 4.01Å; F102-F164 HydrophobicContact CE1-CZ 4.18Å; F102-F164 HydrophobicContact CE2-CE2 4.1Å; F102-F164 HydrophobicContact CE2-CZ 4.37Å; F102-F164 AromaticContact CZ-CE2 3.61Å; F102-F164 HydrophobicContact CZ-CE2 3.61Å; F102-F164 AromaticContact CZ-CZ 3.63Å; F102-F164 HydrophobicContact CZ-CZ 3.63Å; L129-F164 HydrophobicContact CD1-CD2 4.17Å; L129-F164 HydrophobicContact CD2-CE2 4.49Å; V135-F164 HydrophobicContact CG1-CD1 4.47Å; V135-F164 HydrophobicContact CG1-CG 4.37Å; V135-F164 HydrophobicContact CG2-CD2 4.46Å; A137-F164 WeakPolarHBondContact O-CA 3.23Å; V138-F164 HydrophobicContact CB-CD1 4.41Å; V138-F164 HydrophobicContact CB-CE1 4.45Å; V138-F164 HydrophobicContact CG1-CD1 4.36Å; V138-F164 HydrophobicContact CG1-CE1 4.09Å; V138-F164 HydrophobicContact CG2-CD1 3.86Å; V138-F164 HydrophobicContact CG2-CE1 3.78Å; I155-F164 HydrophobicContact CD1-CE1 3.98Å; I155-F164 HydrophobicContact CD1-CZ 3.71Å; I155-F164 HydrophobicContact CG1-CE1 3.84Å; I155-F164 HydrophobicContact CG1-CZ 3.93Å; I155-F164 HydrophobicContact CG2-CZ 4.49Å; C162-F164 WeakPolarHBondContact SG-CE1 3.26Å; F164-V166 HydrophobicContact CB-CG1 3.71Å; F164-V166 HydrophobicContact CD2-CG1 4.43Å
165	L	92.6	Very high	87.8	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	120.4	153.5	-174.9	66.1	0	0	0	107.4	P88 F90 V136 A137 M183 F185 W186	P88-L165 HydrophobicContact CB-CD1 3.56Å; P88-L165 HydrophobicContact CB-CG 4.23Å; F90-L165 HydrophobicContact CD2-CD1 4.24Å; F90-L165 HydrophobicContact CE2-CD1 4.15Å; V136-L165 HydrophobicContact CB-CD2 4.13Å; V136-L165 HydrophobicContact CB-CG 4.29Å; V136-L165 HydrophobicContact CG1-CD2 4.21Å; V136-L165 PolarHBondContact N-O 2.9Å; A137-L165 HydrophobicContact CB-CB 3.78Å; A137-L165 HydrophobicContact CB-CD2 4.39Å; A137-L165 PolarHBondContact N-O 3.08Å; A137-L165 PolarHBondContact O-N 3.44Å; L165-M183 HydrophobicContact CD2-SD 3.89Å; L165-F185 HydrophobicContact CD1-CD1 4.24Å; L165-W186 HydrophobicContact CB-CE3 3.91Å; L165-W186 HydrophobicContact CB-CZ3 4.3Å; L165-W186 HydrophobicContact CD1-CE3 4.22Å; L165-W186 HydrophobicContact CD2-CB 3.95Å; L165-W186 HydrophobicContact CD2-CE3 4.47Å; L165-W186 HydrophobicContact CG-CE3 4.43Å
166	V	95.3	Very high	88.1	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	151.9	177.8	-49.7	0	0	0	0	112.5	P88 R89 I91 L129 D133 R134 V135 F164	P88-V166 CarbonylContact C-O 3.6Å; P88-V166 WeakPolarHBondContact CA-O 3.43Å; R89-V166 HydrophobicContact CB-CG2 3.91Å; R89-V166 PolarHBondContact N-O 2.97Å; R89-V166 PolarHBondContact O-N 2.68Å; I91-V166 HydrophobicContact CD1-CG2 4.33Å; I91-V166 HydrophobicContact CG1-CG1 4.31Å; I91-V166 HydrophobicContact CG1-CG2 3.71Å; L129-V166 HydrophobicContact CD1-CG1 3.92Å; D133-V166 HydrophobicContact CB-CB 4.15Å; D133-V166 HydrophobicContact CB-CG2 4.19Å; R134-V166 CarbonylContact O-C 3.57Å; R134-V166 WeakPolarHBondContact O-CA 3.41Å; R134-V166 WeakPolarHBondContact O-CB 3.46Å; V135-V166 HydrophobicContact CG2-CG1 4.31Å; F164-V166 HydrophobicContact CB-CG1 3.71Å; F164-V166 HydrophobicContact CD2-CG1 4.43Å
167	V	95.4	Very high	88.5	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.006	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	140.1	171	-67.6	0	0	0	0	109.4	P88 D133 R134 V136 T171 D172 P182	P88-V167 HydrophobicContact CB-CG1 3.82Å; P88-V167 HydrophobicContact CG-CG1 3.84Å; D133-V167 CarbonylContact C-O 3.56Å; D133-V167 WeakPolarHBondContact CA-O 3.31Å; R134-V167 HydrophobicContact CB-CG2 3.91Å; R134-V167 PolarHBondContact N-O 2.84Å; R134-V167 PolarHBondContact O-N 2.75Å; V136-V167 HydrophobicContact CG2-CG1 4.16Å; V136-V167 HydrophobicContact CG2-CG2 3.78Å; V167-T171 HydrophobicContact CB-CG2 3.96Å; V167-T171 HydrophobicContact CG1-CG2 3.68Å; V167-D172 HydrophobicContact CB-CB 4.4Å; V167-D172 HydrophobicContact CG2-CB 3.72Å; V167-P182 HydrophobicContact CG1-CB 3.91Å; V167-P182 HydrophobicContact CG1-CG 4.04Å
168	D	94.6	Very high	88.9	Confident	40 Å²	40	44.2 Å²	44.2	21%	0.214	23%	0.228	C	C	.	.			trans	-77.6	169.8	163.2	40.3	63.3	0	0	0	110.6	R89 D170 T171 D172	R89-D168 IonicContact CZ-OD2 2.68Å; R89-D168 IonicContact NE-OD2 3.61Å; R89-D168 IonicContact NH2-OD2 2.76Å; R89-D168 PolarHBondContact NH2-OD2 2.88Å; D168-D170 VanDerWaalsContact C-N 3.3Å; D168-D170 PolarHBondContact O-N 2.93Å; D168-T171 PolarHBondContact O-N 3.12Å; D168-T171 VanDerWaalsContact OD1-CB 3.29Å; D168-T171 WeakPolarHBondContact OD1-CB 3.35Å; D168-T171 PolarHBondContact OD1-N 3.28Å; D168-T171 PolarHBondContact OD1-OG1 2.84Å; D168-D172 WeakPolarHBondContact O-CB 3.44Å; D168-D172 PolarHBondContact O-N 2.86Å
169	K	92.3	Very high	89.5	Confident	130 Å²	130	50.2 Å²	50.2	57%	0.565	25%	0.253	S	S	*	.	H	α-helix	trans	-50.5	-45.8	-176.8	-175.6	-170.7	175.2	-168.8	0	113.5	D172 Q173	K169-D172 PolarHBondContact O-N 2.95Å; K169-Q173 WeakPolarHBondContact O-CB 3.42Å; K169-Q173 VanDerWaalsContact O-CG 3.3Å; K169-Q173 WeakPolarHBondContact O-CG 3.32Å; K169-Q173 PolarHBondContact O-N 3.09Å
170	D	93.5	Very high	90.2	Very high	98 Å²	98	44.6 Å²	44.6	52%	0.524	22%	0.223	S	C	.	.	H	α-helix	trans	-74.8	-36.9	-173.3	-58.4	-14.2	0	0	0	110.3	L86 D168 Q173 M174	L86-D170 HydrophobicContact CD1-CB 3.96Å; D168-D170 VanDerWaalsContact C-N 3.3Å; D168-D170 PolarHBondContact O-N 2.93Å; D170-Q173 PolarHBondContact O-N 3.49Å; D170-M174 PolarHBondContact O-N 2.96Å
171	T	94.1	Very high	90.5	Very high	2 Å²	2	42 Å²	42	1%	0.012	21%	0.213	C	C	.	.	H	α-helix	trans	-62.9	-46.4	170.3	-54.4	0	0	0	0	111.3	L86 V167 D168 Q173 M174 Y175	L86-T171 HydrophobicContact CB-CG2 4.23Å; V167-T171 HydrophobicContact CB-CG2 3.96Å; V167-T171 HydrophobicContact CG1-CG2 3.68Å; D168-T171 PolarHBondContact O-N 3.12Å; D168-T171 VanDerWaalsContact OD1-CB 3.29Å; D168-T171 WeakPolarHBondContact OD1-CB 3.35Å; D168-T171 PolarHBondContact OD1-N 3.28Å; D168-T171 PolarHBondContact OD1-OG1 2.84Å; T171-Q173 PolarHBondContact O-N 2.93Å; T171-M174 WeakPolarHBondContact O-CB 3.16Å; T171-M174 PolarHBondContact O-N 3.29Å; T171-Y175 HydrophobicContact CG2-CD2 3.91Å; T171-Y175 HydrophobicContact CG2-CE2 3.87Å; T171-Y175 WeakPolarHBondContact O-CD2 3.44Å; T171-Y175 PolarHBondContact O-N 3.32Å
172	D	92.3	Very high	90.8	Very high	7 Å²	7	37.8 Å²	37.8	4%	0.037	19%	0.187	C	C	.	.	H	α-helix	trans	-61.7	-42	177.7	-173.4	55.2	0	0	0	112.2	R134 V167 D168 K169 M174 Y175 K176	R134-D172 IonicContact CZ-OD1 3.26Å; R134-D172 VanDerWaalsContact CZ-OD1 3.31Å; R134-D172 IonicContact NE-OD1 3.17Å; R134-D172 PolarHBondContact NE-OD1 2.75Å; R134-D172 IonicContact NE-OD2 2.38Å; R134-D172 IonicContact NH2-OD1 2.76Å; R134-D172 PolarHBondContact NH2-OD1 2.76Å; V167-D172 HydrophobicContact CB-CB 4.4Å; V167-D172 HydrophobicContact CG2-CB 3.72Å; D168-D172 WeakPolarHBondContact O-CB 3.44Å; D168-D172 PolarHBondContact O-N 2.86Å; K169-D172 PolarHBondContact O-N 2.95Å; D172-M174 VanDerWaalsContact C-N 3.34Å; D172-M174 PolarHBondContact O-N 2.94Å; D172-Y175 PolarHBondContact O-N 3.45Å; D172-K176 VanDerWaalsContact O-CB 3.31Å; D172-K176 WeakPolarHBondContact O-CB 3.47Å; D172-K176 VanDerWaalsContact O-CG 3.3Å; D172-K176 WeakPolarHBondContact O-CG 3.36Å; D172-K176 PolarHBondContact O-N 3Å; D172-K176 WeakPolarHBondContact OD1-CE 3.44Å; D172-K176 IonicContact OD1-NZ 3.89Å; D172-K176 WeakPolarHBondContact OD2-CD 3.39Å; D172-K176 WeakPolarHBondContact OD2-CE 3.2Å; D172-K176 IonicContact OD2-NZ 3.56Å; D172-K176 PolarHBondContact OD2-NZ 2.86Å
173	Q	91.9	Very high	90.8	Very high	104 Å²	104	38.7 Å²	38.7	49%	0.486	19%	0.192	S	C	.	.	H	α-helix	trans	-63	-38.6	174.7	-75.7	-174.7	-7.4	0	0	112.2	K169 D170 T171 Q177	K169-Q173 WeakPolarHBondContact O-CB 3.42Å; K169-Q173 VanDerWaalsContact O-CG 3.3Å; K169-Q173 WeakPolarHBondContact O-CG 3.32Å; K169-Q173 PolarHBondContact O-N 3.09Å; D170-Q173 PolarHBondContact O-N 3.49Å; T171-Q173 PolarHBondContact O-N 2.93Å; Q173-Q177 WeakPolarHBondContact O-CB 3.31Å; Q173-Q177 PolarHBondContact O-N 3Å
174	M	92.9	Very high	90.5	Very high	22 Å²	22	38.2 Å²	38.2	11%	0.108	19%	0.186	C	C	.	.	H	α-helix	trans	-63.6	-48.4	174.6	-176.9	-162	65.8	0	0	111.9	M55 L84 P85 L86 D170 T171 D172 K176 Q177 G178	M55-M174 HydrophobicContact CE-CG 3.69Å; M55-M174 WeakPolarHBondContact CE-O 3.39Å; L84-M174 HydrophobicContact CB-CE 3.91Å; L84-M174 HydrophobicContact CB-SD 4.03Å; L84-M174 HydrophobicContact CD1-CE 3.79Å; L84-M174 HydrophobicContact CD2-SD 4.48Å; L84-M174 HydrophobicContact CG-CE 4.35Å; P85-M174 HydrophobicContact CG-SD 4.11Å; L86-M174 HydrophobicContact CB-CE 4.02Å; L86-M174 HydrophobicContact CB-SD 3.96Å; L86-M174 HydrophobicContact CG-SD 4.4Å; L86-M174 VanDerWaalsContact O-CE 3.31Å; L86-M174 WeakPolarHBondContact O-CE 3.4Å; D170-M174 PolarHBondContact O-N 2.96Å; T171-M174 WeakPolarHBondContact O-CB 3.16Å; T171-M174 PolarHBondContact O-N 3.29Å; D172-M174 VanDerWaalsContact C-N 3.34Å; D172-M174 PolarHBondContact O-N 2.94Å; M174-K176 PolarHBondContact O-N 3.41Å; M174-Q177 PolarHBondContact O-N 2.95Å; M174-G178 PolarHBondContact O-N 3.47Å; M174-G178 VanDerWaalsContact O-N 3.14Å
175	Y	91.1	Very high	90	Very high	1 Å²	1	38.8 Å²	38.8	0%	0.004	19%	0.189	C	C	.	.	H	α-helix	trans	-63.7	-41	177.3	-85.2	-84.8	0	0	0	111.9	V81 L84 P88 T171 D172 G178 K179 V180 P182	V81-Y175 HydrophobicContact CG1-CE1 4.34Å; L84-Y175 HydrophobicContact CD1-CE1 4Å; L84-Y175 HydrophobicContact CD1-CE2 4.41Å; P88-Y175 HydrophobicContact CG-CE2 3.84Å; T171-Y175 HydrophobicContact CG2-CD2 3.91Å; T171-Y175 HydrophobicContact CG2-CE2 3.87Å; T171-Y175 WeakPolarHBondContact O-CD2 3.44Å; T171-Y175 PolarHBondContact O-N 3.32Å; D172-Y175 PolarHBondContact O-N 3.45Å; Y175-G178 CarbonylContact O-C 3.44Å; Y175-G178 PolarHBondContact O-N 3.38Å; Y175-K179 PolarHBondContact O-N 2.71Å; Y175-V180 HydrophobicContact CD1-CB 4.27Å; Y175-V180 HydrophobicContact CD1-CG2 3.68Å; Y175-V180 HydrophobicContact CE1-CG2 4.34Å; Y175-V180 HydrophobicContact CG-CG2 4.47Å; Y175-V180 PolarHBondContact O-N 3.22Å; Y175-V180 VanDerWaalsContact O-N 3.1Å; Y175-P182 HydrophobicContact CD1-CB 4.24Å; Y175-P182 HydrophobicContact CD1-CG 4.06Å; Y175-P182 HydrophobicContact CD2-CB 4.28Å; Y175-P182 HydrophobicContact CD2-CG 4.08Å; Y175-P182 HydrophobicContact CE1-CB 4.34Å; Y175-P182 HydrophobicContact CE2-CB 4.37Å; Y175-P182 HydrophobicContact CG-CB 4.23Å; Y175-P182 HydrophobicContact CG-CG 3.77Å
176	K	90.3	Very high	89.2	Confident	94 Å²	94	39.7 Å²	39.7	41%	0.409	19%	0.192	S	C	.	.	H	α-helix	trans	-63.3	-38.4	173.3	-75	171.7	174.5	171.2	0	112.7	D172 M174 G178 K179	D172-K176 VanDerWaalsContact O-CB 3.31Å; D172-K176 WeakPolarHBondContact O-CB 3.47Å; D172-K176 VanDerWaalsContact O-CG 3.3Å; D172-K176 WeakPolarHBondContact O-CG 3.36Å; D172-K176 PolarHBondContact O-N 3Å; D172-K176 WeakPolarHBondContact OD1-CE 3.44Å; D172-K176 IonicContact OD1-NZ 3.89Å; D172-K176 WeakPolarHBondContact OD2-CD 3.39Å; D172-K176 WeakPolarHBondContact OD2-CE 3.2Å; D172-K176 IonicContact OD2-NZ 3.56Å; D172-K176 PolarHBondContact OD2-NZ 2.86Å; M174-K176 PolarHBondContact O-N 3.41Å; K176-G178 VanDerWaalsContact C-N 3.28Å; K176-G178 PolarHBondContact O-N 3.2Å; K176-K179 PolarHBondContact O-N 3.39Å; K176-K179 VanDerWaalsContact O-N 3.08Å
177	Q	89.6	Confident	88	Confident	53 Å²	53	43.5 Å²	43.5	25%	0.248	21%	0.21	C	C	.	.	H	α-helix	trans	-61.1	-36.8	173.5	174.1	169.8	3.6	0	0	111.9	N31 S53 Q173 M174 K179	N31-Q177 CarbonylContact C-O 3.55Å; N31-Q177 WeakPolarHBondContact CA-O 3.32Å; N31-Q177 HydrophobicContact CB-CG 4.35Å; N31-Q177 WeakPolarHBondContact CB-O 3.49Å; N31-Q177 PolarHBondContact OD1-NE2 3.37Å; S53-Q177 PolarHBondContact O-NE2 3.5Å; S53-Q177 PolarHBondContact OG-OE1 3.11Å; Q173-Q177 WeakPolarHBondContact O-CB 3.31Å; Q173-Q177 PolarHBondContact O-N 3Å; M174-Q177 PolarHBondContact O-N 2.95Å; Q177-K179 VanDerWaalsContact C-N 3.35Å
178	G	85.6	Confident	86.8	Confident	2 Å²	2	44.6 Å²	44.6	2%	0.021	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-4.6	174	0	0	0	0	0	115.4	G32 M55 M174 Y175 K176 V180	G32-G178 WeakPolarHBondContact CA-O 3.22Å; G32-G178 PolarHBondContact N-O 2.97Å; M55-G178 VanDerWaalsContact SD-CA 3.54Å; M174-G178 PolarHBondContact O-N 3.47Å; M174-G178 VanDerWaalsContact O-N 3.14Å; Y175-G178 CarbonylContact O-C 3.44Å; Y175-G178 PolarHBondContact O-N 3.38Å; K176-G178 VanDerWaalsContact C-N 3.28Å; K176-G178 PolarHBondContact O-N 3.2Å; G178-V180 PolarHBondContact O-N 3.49Å; G178-V180 VanDerWaalsContact O-N 3.12Å
179	K	87.9	Confident	85.5	Confident	136 Å²	136	48.1 Å²	48.1	59%	0.591	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.2	26.1	-169	-48.9	-178.2	-154.8	142.6	0	113.9	N31 G32 Y175 K176 Q177	N31-K179 VanDerWaalsContact O-CE 3.27Å; N31-K179 WeakPolarHBondContact O-CE 3.37Å; N31-K179 PolarHBondContact O-NZ 3.1Å; G32-K179 WeakPolarHBondContact O-CD 3.46Å; G32-K179 WeakPolarHBondContact O-CE 3.41Å; G32-K179 PolarHBondContact O-NZ 3.46Å; Y175-K179 PolarHBondContact O-N 2.71Å; K176-K179 PolarHBondContact O-N 3.39Å; K176-K179 VanDerWaalsContact O-N 3.08Å; Q177-K179 VanDerWaalsContact C-N 3.35Å
180	V	85.3	Confident	83.8	Confident	21 Å²	21	48.8 Å²	48.8	13%	0.127	23%	0.234	C	C	.	.			trans	-101.4	144.3	-178.9	-82.2	0	0	0	0	110.9	M55 Y175 G178 L184	M55-V180 HydrophobicContact SD-CG2 4.11Å; Y175-V180 HydrophobicContact CD1-CB 4.27Å; Y175-V180 HydrophobicContact CD1-CG2 3.68Å; Y175-V180 HydrophobicContact CE1-CG2 4.34Å; Y175-V180 HydrophobicContact CG-CG2 4.47Å; Y175-V180 PolarHBondContact O-N 3.22Å; Y175-V180 VanDerWaalsContact O-N 3.1Å; G178-V180 PolarHBondContact O-N 3.49Å; G178-V180 VanDerWaalsContact O-N 3.12Å; V180-L184 HydrophobicContact CB-CD1 4.11Å; V180-L184 HydrophobicContact CG1-CD1 4.05Å
181	S	86.7	Confident	81.8	Confident	43 Å²	43	46.9 Å²	46.9	30%	0.301	24%	0.237	S	C	.	.			trans	-78	137.1	173.6	-179.3	0	0	0	0	110.9	M183 L184	S181-M183 PolarHBondContact O-N 3.13Å; S181-M183 VanDerWaalsContact O-N 3.08Å; S181-M183 WeakPolarHBondContact OG-CB 3.48Å; S181-M183 PolarHBondContact OG-N 3.5Å; S181-L184 PolarHBondContact O-N 2.79Å
182	P	88.9	Confident	79.3	Confident	3 Å²	3	52 Å²	52	2%	0.019	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-15.1	169.1	-18.6	29.9	0	0	0	113.7	P88 V136 V167 Y175 L184 F185	P88-P182 HydrophobicContact CG-CB 3.91Å; V136-P182 HydrophobicContact CG1-CB 4.09Å; V136-P182 HydrophobicContact CG1-CG 4.17Å; V136-P182 HydrophobicContact CG2-CB 4.15Å; V136-P182 HydrophobicContact CG2-CG 4.04Å; V167-P182 HydrophobicContact CG1-CB 3.91Å; V167-P182 HydrophobicContact CG1-CG 4.04Å; Y175-P182 HydrophobicContact CD1-CB 4.24Å; Y175-P182 HydrophobicContact CD1-CG 4.06Å; Y175-P182 HydrophobicContact CD2-CB 4.28Å; Y175-P182 HydrophobicContact CD2-CG 4.08Å; Y175-P182 HydrophobicContact CE1-CB 4.34Å; Y175-P182 HydrophobicContact CE2-CB 4.37Å; Y175-P182 HydrophobicContact CG-CB 4.23Å; Y175-P182 HydrophobicContact CG-CG 3.77Å; P182-L184 PolarHBondContact O-N 2.98Å; P182-F185 WeakPolarHBondContact O-CB 3.39Å; P182-F185 PolarHBondContact O-N 2.83Å; P182-F185 VanDerWaalsContact O-N 3.1Å
183	M	86	Confident	76.7	Confident	20 Å²	20	56.6 Å²	56.6	10%	0.099	30%	0.298	C	S	.	.	H	α-helix	trans	-56.4	-27.7	172.3	-74.7	-62.8	-67.5	0	0	113.9	V136 A137 D142 L165 S181 F185 W186 E187	V136-M183 HydrophobicContact CG1-CG 4.25Å; A137-M183 HydrophobicContact CB-SD 3.65Å; D142-M183 HydrophobicContact CB-CE 4.33Å; D142-M183 HydrophobicContact CB-CG 4.14Å; D142-M183 HydrophobicContact CB-SD 4.23Å; L165-M183 HydrophobicContact CD2-SD 3.89Å; S181-M183 PolarHBondContact O-N 3.13Å; S181-M183 VanDerWaalsContact O-N 3.08Å; S181-M183 WeakPolarHBondContact OG-CB 3.48Å; S181-M183 PolarHBondContact OG-N 3.5Å; M183-F185 PolarHBondContact O-N 2.89Å; M183-W186 HydrophobicContact CE-CG 4.44Å; M183-W186 WeakPolarHBondContact O-CA 3.46Å; M183-W186 WeakPolarHBondContact O-CB 3.43Å; M183-W186 PolarHBondContact O-N 2.89Å; M183-E187 PolarHBondContact O-N 3.49Å
184	L	81.5	Confident	74.2	Confident	25 Å²	25	53.6 Å²	53.6	13%	0.131	29%	0.288	C	S	.	.	H	α-helix	trans	-57.7	-32.7	175.8	-64.8	174	0	0	0	112.3	S76 V81 V180 S181 P182 E187 E188	S76-L184 WeakPolarHBondContact O-CD1 3.41Å; V81-L184 HydrophobicContact CG1-CB 4.02Å; V180-L184 HydrophobicContact CB-CD1 4.11Å; V180-L184 HydrophobicContact CG1-CD1 4.05Å; S181-L184 PolarHBondContact O-N 2.79Å; P182-L184 PolarHBondContact O-N 2.98Å; L184-E187 PolarHBondContact O-N 3.08Å; L184-E188 WeakPolarHBondContact O-CB 3.39Å; L184-E188 PolarHBondContact O-N 2.88Å
185	F	82.1	Confident	71.7	Confident	13 Å²	13	54.8 Å²	54.8	6%	0.057	30%	0.298	C	S	.	.	H	α-helix	trans	-67.4	-36.5	174.1	-176.4	-104.2	0	0	0	112.6	V81 Q87 P88 F90 L165 P182 M183 M189	V81-F185 HydrophobicContact CG2-CB 3.93Å; V81-F185 HydrophobicContact CG2-CD2 3.8Å; V81-F185 HydrophobicContact CG2-CG 4.37Å; Q87-F185 HydrophobicContact CB-CE2 3.81Å; Q87-F185 HydrophobicContact CB-CZ 3.94Å; Q87-F185 HydrophobicContact CG-CE2 3.91Å; Q87-F185 HydrophobicContact CG-CZ 4.47Å; P88-F185 HydrophobicContact CB-CD1 3.81Å; P88-F185 HydrophobicContact CB-CE1 4.23Å; P88-F185 HydrophobicContact CB-CG 4.36Å; P88-F185 HydrophobicContact CG-CB 3.88Å; P88-F185 HydrophobicContact CG-CD1 3.92Å; P88-F185 HydrophobicContact CG-CG 3.95Å; P88-F185 WeakPolarHBondContact O-CE1 3.42Å; F90-F185 HydrophobicContact CD2-CD1 4.37Å; F90-F185 AromaticContact CD2-CE1 3.9Å; F90-F185 HydrophobicContact CD2-CE1 3.9Å; F90-F185 AromaticContact CE2-CD1 3.82Å; F90-F185 HydrophobicContact CE2-CD1 3.82Å; F90-F185 AromaticContact CE2-CE1 3.69Å; F90-F185 HydrophobicContact CE2-CE1 3.69Å; L165-F185 HydrophobicContact CD1-CD1 4.24Å; P182-F185 WeakPolarHBondContact O-CB 3.39Å; P182-F185 PolarHBondContact O-N 2.83Å; P182-F185 VanDerWaalsContact O-N 3.1Å; M183-F185 PolarHBondContact O-N 2.89Å; F185-M189 HydrophobicContact CD1-CG 4.34Å; F185-M189 HydrophobicContact CE1-CE 4.34Å; F185-M189 HydrophobicContact CE1-CG 4.13Å; F185-M189 HydrophobicContact CE2-CE 3.58Å; F185-M189 HydrophobicContact CE2-CG 4.35Å; F185-M189 HydrophobicContact CZ-CE 3.49Å; F185-M189 VanDerWaalsContact CZ-CE 3.49Å; F185-M189 HydrophobicContact CZ-CG 4.14Å; F185-M189 VanDerWaalsContact O-CB 3.26Å; F185-M189 WeakPolarHBondContact O-CB 3.39Å; F185-M189 VanDerWaalsContact O-CG 3.23Å; F185-M189 WeakPolarHBondContact O-CG 3.49Å; F185-M189 PolarHBondContact O-N 3.01Å
186	W	76.4	Confident	69.1	Low	19 Å²	19	59.3 Å²	59.3	7%	0.072	33%	0.327	C	S	.	.	H	α-helix	trans	-71.6	-37.3	177.3	176.2	-78.7	0	0	0	111.8	F90 L165 M183 K190	F90-W186 AromaticContact CD1-CE3 3.82Å; F90-W186 HydrophobicContact CD1-CE3 3.82Å; F90-W186 HydrophobicContact CD1-CH2 4.33Å; F90-W186 AromaticContact CD1-CZ3 3.55Å; F90-W186 HydrophobicContact CD1-CZ3 3.55Å; F90-W186 AromaticContact CE1-CD2 3.8Å; F90-W186 HydrophobicContact CE1-CD2 3.8Å; F90-W186 AromaticContact CE1-CE3 3.11Å; F90-W186 HydrophobicContact CE1-CE3 3.11Å; F90-W186 AromaticContact CE1-CH2 3.88Å; F90-W186 HydrophobicContact CE1-CH2 3.88Å; F90-W186 HydrophobicContact CE1-CZ2 4.45Å; F90-W186 AromaticContact CE1-CZ3 3.18Å; F90-W186 HydrophobicContact CE1-CZ3 3.18Å; F90-W186 HydrophobicContact CE2-CE3 4.26Å; F90-W186 HydrophobicContact CZ-CB 4.26Å; F90-W186 AromaticContact CZ-CD2 3.83Å; F90-W186 HydrophobicContact CZ-CD2 3.83Å; F90-W186 AromaticContact CZ-CE3 3.38Å; F90-W186 HydrophobicContact CZ-CE3 3.38Å; F90-W186 HydrophobicContact CZ-CG 4.23Å; F90-W186 AromaticContact CZ-CZ3 3.97Å; F90-W186 HydrophobicContact CZ-CZ3 3.97Å; L165-W186 HydrophobicContact CB-CE3 3.91Å; L165-W186 HydrophobicContact CB-CZ3 4.3Å; L165-W186 HydrophobicContact CD1-CE3 4.22Å; L165-W186 HydrophobicContact CD2-CB 3.95Å; L165-W186 HydrophobicContact CD2-CE3 4.47Å; L165-W186 HydrophobicContact CG-CE3 4.43Å; M183-W186 HydrophobicContact CE-CG 4.44Å; M183-W186 WeakPolarHBondContact O-CA 3.46Å; M183-W186 WeakPolarHBondContact O-CB 3.43Å; M183-W186 PolarHBondContact O-N 2.89Å; W186-K190 VanDerWaalsContact NE1-CE 3.3Å; W186-K190 WeakPolarHBondContact O-CB 3.4Å; W186-K190 WeakPolarHBondContact O-CG 3.46Å; W186-K190 PolarHBondContact O-N 2.79Å; W186-K190 VanDerWaalsContact O-N 3.09Å
187	E	70.3	Confident	66.8	Low	79 Å²	79	57.8 Å²	57.8	37%	0.369	33%	0.328	S	S	.	.	H	α-helix	trans	-68.8	-41.5	174.4	-67.9	178.4	-162.4	0	0	112.3	M183 L184 K190	M183-E187 PolarHBondContact O-N 3.49Å; L184-E187 PolarHBondContact O-N 3.08Å; E187-K190 PolarHBondContact O-N 3.14Å
188	E	70.3	Confident	64.5	Low	25 Å²	25	61.1 Å²	61.1	12%	0.117	34%	0.34	C	S	.	.	H	α-helix	trans	-65.9	-45.5	174.8	-179.5	151.1	-128.1	0	0	111.7	T80 V81 K82 L184 K190 G191 S194	T80-E188 VanDerWaalsContact CB-OE1 3.31Å; T80-E188 WeakPolarHBondContact CB-OE1 3.28Å; T80-E188 VanDerWaalsContact OG1-CD 3.23Å; T80-E188 PolarHBondContact OG1-OE1 2.98Å; T80-E188 PolarHBondContact OG1-OE2 3.09Å; V81-E188 WeakPolarHBondContact CG2-OE2 3.49Å; V81-E188 PolarHBondContact N-OE2 3.2Å; K82-E188 IonicContact NZ-OE1 3.83Å; K82-E188 PolarHBondContact NZ-OE1 2.81Å; L184-E188 WeakPolarHBondContact O-CB 3.39Å; L184-E188 PolarHBondContact O-N 2.88Å; E188-K190 VanDerWaalsContact C-N 3.27Å; E188-K190 PolarHBondContact O-N 3.48Å; E188-G191 PolarHBondContact O-N 3.19Å; E188-G191 VanDerWaalsContact O-N 3.12Å; E188-S194 PolarHBondContact OE1-OG 2.93Å
189	M	65.8	Low	62.4	Low	114 Å²	114	65.6 Å²	65.6	56%	0.562	37%	0.367	S	S	*	.	H	α-helix	trans	-67.1	-22.8	177.8	-75.1	-67.9	-177.6	0	0	114	F90 F185 G191	F90-M189 HydrophobicContact CE2-CB 4.13Å; F90-M189 HydrophobicContact CE2-CG 4.18Å; F90-M189 HydrophobicContact CZ-CB 4.06Å; F185-M189 HydrophobicContact CD1-CG 4.34Å; F185-M189 HydrophobicContact CE1-CE 4.34Å; F185-M189 HydrophobicContact CE1-CG 4.13Å; F185-M189 HydrophobicContact CE2-CE 3.58Å; F185-M189 HydrophobicContact CE2-CG 4.35Å; F185-M189 HydrophobicContact CZ-CE 3.49Å; F185-M189 VanDerWaalsContact CZ-CE 3.49Å; F185-M189 HydrophobicContact CZ-CG 4.14Å; F185-M189 VanDerWaalsContact O-CB 3.26Å; F185-M189 WeakPolarHBondContact O-CB 3.39Å; F185-M189 VanDerWaalsContact O-CG 3.23Å; F185-M189 WeakPolarHBondContact O-CG 3.49Å; F185-M189 PolarHBondContact O-N 3.01Å; M189-G191 VanDerWaalsContact C-N 3.29Å
190	K	57.4	Low	60.2	Low	144 Å²	144	64.6 Å²	64.6	63%	0.626	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-8.8	173.1	-83.8	-169.4	171.1	-169.8	0	114.3	W186 E187 E188	W186-K190 VanDerWaalsContact NE1-CE 3.3Å; W186-K190 WeakPolarHBondContact O-CB 3.4Å; W186-K190 WeakPolarHBondContact O-CG 3.46Å; W186-K190 PolarHBondContact O-N 2.79Å; W186-K190 VanDerWaalsContact O-N 3.09Å; E187-K190 PolarHBondContact O-N 3.14Å; E188-K190 VanDerWaalsContact C-N 3.27Å; E188-K190 PolarHBondContact O-N 3.48Å
191	G	50.4	Low	58.1	Low	57 Å²	57	65.9 Å²	65.9	59%	0.588	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.7	59	163.4	0	0	0	0	0	116.2	E188 M189	E188-G191 PolarHBondContact O-N 3.19Å; E188-G191 VanDerWaalsContact O-N 3.12Å; M189-G191 VanDerWaalsContact C-N 3.29Å
192	S	42.1	Very low	55.8	Low	111 Å²	111	69.2 Å²	69.2	78%	0.776	39%	0.391	S	S	*	.	S	Bend	trans	-150.9	-22.1	159	-81.2	0	0	0	0	114.9
193	N	38.4	Very low	53.4	Low	102 Å²	102	73.7 Å²	73.7	55%	0.545	42%	0.422	S	S	.	.			trans	-99.1	1.5	-167.2	-76.9	7.6	0	0	0	116.4	P195	N193-P195 WeakPolarHBondContact O-CD 3.42Å
194	S	38.5	Very low	50.9	Low	41 Å²	41	78.8 Å²	78.8	29%	0.287	45%	0.449	S	S	.	.	S	Bend	trans	-63.6	127.4	167.3	-63.4	0	0	0	0	109.2	K82 E188	K82-S194 PolarHBondContact NZ-OG 2.71Å; E188-S194 PolarHBondContact OE1-OG 2.93Å
195	P	40.8	Very low	48.6	Very low	48 Å²	48	83.4 Å²	83.4	31%	0.312	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-55.9	133	162.1	-19.9	32	0	0	0	108.4	L78 N193 S197	L78-P195 WeakPolarHBondContact O-CG 3.26Å; N193-P195 WeakPolarHBondContact O-CD 3.42Å; P195-S197 PolarHBondContact O-N 3.32Å
196	P	36.3	Very low	46.6	Very low	95 Å²	95	87 Å²	87	62%	0.617	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-63.3	127.6	-177.4	25.7	-33.7	0	0	0	109.4
197	S	42.4	Very low	44.7	Very low	62 Å²	62	92.1 Å²	92.1	43%	0.434	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-64.9	145.9	175.2	-168.4	0	0	0	0	109.5	P195 T199 E200 A201	P195-S197 PolarHBondContact O-N 3.32Å; S197-T199 PolarHBondContact O-N 2.94Å; S197-T199 VanDerWaalsContact O-N 3.08Å; S197-T199 PolarHBondContact OG-OG1 3.34Å; S197-E200 PolarHBondContact N-OE2 3.32Å; S197-E200 WeakPolarHBondContact O-CA 3.38Å; S197-E200 WeakPolarHBondContact O-CB 3.13Å; S197-E200 PolarHBondContact O-N 2.95Å; S197-A201 PolarHBondContact O-N 2.88Å
198	Y	42.2	Very low	43	Very low	124 Å²	124	92.8 Å²	92.8	49%	0.486	57%	0.567	S	S	.	*	H	α-helix	trans	-55.9	-29.7	179.2	-178.1	-113.4	0	0	0	112.8	E62 A201 L202	E62-Y198 HydrophobicContact CB-CD2 4.34Å; E62-Y198 HydrophobicContact CG-CD2 4.12Å; E62-Y198 HydrophobicContact CG-CE2 4.19Å; E62-Y198 HydrophobicContact CG-CG 4.29Å; Y198-A201 PolarHBondContact O-N 2.76Å; Y198-L202 HydrophobicContact CD1-CD1 3.98Å; Y198-L202 HydrophobicContact CD1-CG 4.36Å; Y198-L202 HydrophobicContact CD2-CG 4.5Å; Y198-L202 HydrophobicContact CE1-CD1 3.39Å; Y198-L202 HydrophobicContact CE1-CG 3.94Å; Y198-L202 HydrophobicContact CE2-CD1 4.42Å; Y198-L202 HydrophobicContact CE2-CD2 4.26Å; Y198-L202 HydrophobicContact CE2-CG 4.08Å; Y198-L202 WeakPolarHBondContact O-CB 3.34Å; Y198-L202 WeakPolarHBondContact O-CG 3.46Å; Y198-L202 PolarHBondContact O-N 3.38Å
199	T	40.8	Very low	41.8	Very low	95 Å²	95	100.9 Å²	100.9	58%	0.583	61%	0.605	S	S	*	*	H	α-helix	trans	-68.5	-33.3	173	47	0	0	0	0	113.6	S197 S203	S197-T199 PolarHBondContact O-N 2.94Å; S197-T199 VanDerWaalsContact O-N 3.08Å; S197-T199 PolarHBondContact OG-OG1 3.34Å; T199-S203 WeakPolarHBondContact O-CB 3.3Å; T199-S203 PolarHBondContact O-N 3.43Å; T199-S203 PolarHBondContact O-OG 3.48Å
200	E	41.9	Very low	40.2	Very low	116 Å²	116	105.2 Å²	105.2	54%	0.542	62%	0.621	S	S	.	*	H	α-helix	trans	-71.7	-42.4	172	-61.3	173.7	122.9	0	0	110.1	S197 L202 S203 L204	S197-E200 PolarHBondContact N-OE2 3.32Å; S197-E200 WeakPolarHBondContact O-CA 3.38Å; S197-E200 WeakPolarHBondContact O-CB 3.13Å; S197-E200 PolarHBondContact O-N 2.95Å; E200-L202 PolarHBondContact O-N 2.92Å; E200-S203 PolarHBondContact O-N 3.39Å; E200-S203 VanDerWaalsContact O-N 3.13Å; E200-L204 PolarHBondContact O-N 3.11Å
201	A	40.8	Very low	39.4	Very low	48 Å²	48	103.8 Å²	103.8	40%	0.397	63%	0.629	S	S	.	*	H	α-helix	trans	-63	-38.9	177.7	0	0	0	0	0	113.2	S197 Y198 S203	S197-A201 PolarHBondContact O-N 2.88Å; Y198-A201 PolarHBondContact O-N 2.76Å; A201-S203 VanDerWaalsContact C-N 3.34Å
202	L	39.2	Very low	38.5	Very low	113 Å²	113	109.3 Å²	109.3	59%	0.592	64%	0.642	S	S	*	*	H	α-helix	trans	-73.6	-21.8	173.3	-76.1	-175.4	0	0	0	113.9	Y198 E200 L204	Y198-L202 HydrophobicContact CD1-CD1 3.98Å; Y198-L202 HydrophobicContact CD1-CG 4.36Å; Y198-L202 HydrophobicContact CD2-CG 4.5Å; Y198-L202 HydrophobicContact CE1-CD1 3.39Å; Y198-L202 HydrophobicContact CE1-CG 3.94Å; Y198-L202 HydrophobicContact CE2-CD1 4.42Å; Y198-L202 HydrophobicContact CE2-CD2 4.26Å; Y198-L202 HydrophobicContact CE2-CG 4.08Å; Y198-L202 WeakPolarHBondContact O-CB 3.34Å; Y198-L202 WeakPolarHBondContact O-CG 3.46Å; Y198-L202 PolarHBondContact O-N 3.38Å; E200-L202 PolarHBondContact O-N 2.92Å; L202-L204 VanDerWaalsContact C-N 3.27Å
203	S	37.1	Very low	38.4	Very low	96 Å²	96	109 Å²	109	67%	0.671	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	-8.2	178.6	-62.7	0	0	0	0	113.1	T199 E200 A201 P205	T199-S203 WeakPolarHBondContact O-CB 3.3Å; T199-S203 PolarHBondContact O-N 3.43Å; T199-S203 PolarHBondContact O-OG 3.48Å; E200-S203 PolarHBondContact O-N 3.39Å; E200-S203 VanDerWaalsContact O-N 3.13Å; A201-S203 VanDerWaalsContact C-N 3.34Å; S203-P205 WeakPolarHBondContact O-CD 3.49Å
204	L	35.1	Very low	38.1	Very low	128 Å²	128	107.7 Å²	107.7	67%	0.67	66%	0.656	S	S	*	*	S	Bend	trans	-74.5	121.5	173.6	-66.4	172.3	0	0	0	110.4	E200 L202 A206	E200-L204 PolarHBondContact O-N 3.11Å; L202-L204 VanDerWaalsContact C-N 3.27Å; L204-A206 PolarHBondContact O-N 2.88Å
205	P	32.4	Very low	38.1	Very low	122 Å²	122	118 Å²	118	79%	0.792	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-60.8	133.5	171.5	-21.5	33.6	0	0	0	110.6	S203	S203-P205 WeakPolarHBondContact O-CD 3.49Å
206	A	39.1	Very low	37.8	Very low	88 Å²	88	120.7 Å²	120.7	73%	0.727	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-55.2	136.8	173.3	0	0	0	0	0	110.2	L204 A208	L204-A206 PolarHBondContact O-N 2.88Å; A206-A208 VanDerWaalsContact C-N 3.31Å; A206-A208 PolarHBondContact O-N 3.41Å
207	P	37.9	Very low	38.2	Very low	127 Å²	127	124.6 Å²	124.6	83%	0.825	71%	0.708	S	S	*	*			trans	-74.5	77.8	-166.4	29.1	-36.4	0	0	0	113	Q209	P207-Q209 PolarHBondContact O-N 3.04Å
208	A	33.3	Very low	38.1	Very low	93 Å²	93	125.9 Å²	125.9	77%	0.769	71%	0.713	S	S	*	*			trans	-64.5	117.3	164.8	0	0	0	0	0	109.2	A206 K210	A206-A208 VanDerWaalsContact C-N 3.31Å; A206-A208 PolarHBondContact O-N 3.41Å; A208-K210 PolarHBondContact O-N 3.4Å
209	Q	46	Very low	38.2	Very low	195 Å²	195	127.1 Å²	127.1	91%	0.911	72%	0.723	S	S	*	*			trans	-62.9	102	-174.5	-64.7	178.4	-73.8	0	0	112.4	P207	P207-Q209 PolarHBondContact O-N 3.04Å
210	K	31.7	Very low	38.7	Very low	204 Å²	204	127.9 Å²	127.9	89%	0.887	72%	0.72	S	S	*	*			trans	-134.7	122.7	156.4	-70.6	-168	177.6	179.8	0	109.8	A208	A208-K210 PolarHBondContact O-N 3.4Å
211	S	40.4	Very low	39.3	Very low	114 Å²	114	127 Å²	127	80%	0.797	72%	0.719	S	S	*	*			trans	-70.2	137.8	177	43.3	0	0	0	0	111.4
212	M	32.3	Very low	40.4	Very low	174 Å²	174	130.3 Å²	130.3	86%	0.857	72%	0.721	S	S	*	*				-178.4	124.4	122.7	-94.6	-66.9	-90.6	0	0	110.8	G214	M212-G214 PolarHBondContact O-N 3.33Å
213	A	40.3	Very low	42.1	Very low	103 Å²	103	125.3 Å²	125.3	85%	0.851	70%	0.696	S	S	*	*			trans	41.8	64.8	157.4	0	0	0	0	0	119.3
214	G	32.3	Very low	44.4	Very low	75 Å²	75	122.9 Å²	122.9	77%	0.773	67%	0.673	S	S	*	*			trans	-106.6	128.7	153.3	0	0	0	0	0	109.6	M212	M212-G214 PolarHBondContact O-N 3.33Å
215	R	37.4	Very low	46.7	Very low	257 Å²	257	119.9 Å²	119.9	97%	0.97	66%	0.657	S	S	*	*			trans	-81.2	126.6	-178.3	-156.3	173.2	-168.8	154.6	-0.1	109.7	K217	R215-K217 PolarHBondContact O-N 3.26Å
216	D	35.7	Very low	49.2	Very low	105 Å²	105	114.1 Å²	114.1	56%	0.561	62%	0.62	S	S	*	*			trans	-71.4	125.7	-170.8	-165	-11	0	0	0	111.8	T218	D216-T218 VanDerWaalsContact C-N 3.33Å; D216-T218 WeakPolarHBondContact OD1-CB 3.47Å; D216-T218 PolarHBondContact OD1-N 3.14Å; D216-T218 PolarHBondContact OD1-OG1 2.76Å
217	K	43.8	Very low	51.4	Low	178 Å²	178	117.2 Å²	117.2	77%	0.774	61%	0.612	S	S	*	*	S	Bend	trans	-84.2	-7.2	174.7	-73.1	-168.8	173	-170.8	0	113.1	R215	R215-K217 PolarHBondContact O-N 3.26Å
218	T	40.4	Very low	53.9	Low	88 Å²	88	111.5 Å²	111.5	54%	0.54	58%	0.575	S	S	.	*	S	Bend	trans	-79.8	-15.5	-172.2	-38	0	0	0	0	113.3	D216	D216-T218 VanDerWaalsContact C-N 3.33Å; D216-T218 WeakPolarHBondContact OD1-CB 3.47Å; D216-T218 PolarHBondContact OD1-N 3.14Å; D216-T218 PolarHBondContact OD1-OG1 2.76Å
219	E	44.6	Very low	56.2	Low	150 Å²	150	113.1 Å²	113.1	70%	0.701	57%	0.567	S	S	*	*	S	Bend	trans	-78.9	-26.5	174.9	-62	-151.5	126.4	0	0	113.2	L221 R222	E219-L221 PolarHBondContact O-N 2.74Å; E219-L221 VanDerWaalsContact O-N 3.09Å; E219-R222 PolarHBondContact O-N 3.3Å
220	E	50.3	Low	57.8	Low	111 Å²	111	108.6 Å²	108.6	52%	0.519	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-2.1	-169	-98	-165.9	-124	0	0	115.8	R303 V306	E220-R303 PolarHBondContact O-NH2 2.81Å; E220-R303 IonicContact OE2-CZ 2.66Å; E220-R303 IonicContact OE2-NH1 2.77Å; E220-R303 PolarHBondContact OE2-NH1 3.36Å; E220-R303 IonicContact OE2-NH2 3.09Å; E220-R303 PolarHBondContact OE2-NH2 2.67Å; E220-V306 WeakPolarHBondContact O-CG2 3.01Å
221	L	56.1	Low	60.2	Low	99 Å²	99	102.2 Å²	102.2	52%	0.518	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.8	19.5	-177.8	-64.1	177.8	0	0	0	113.8	E219 V306	E219-L221 PolarHBondContact O-N 2.74Å; E219-L221 VanDerWaalsContact O-N 3.09Å; L221-V306 HydrophobicContact CD2-CG2 4.2Å
222	R	64.1	Low	61.7	Low	117 Å²	117	103.5 Å²	103.5	44%	0.442	53%	0.531	S	S	.	.	S	Bend	trans	-114.9	147.7	179.2	-61.7	-175.9	-174.6	175.1	2.5	111.8	E219	E219-R222 PolarHBondContact O-N 3.3Å
223	P	74.3	Confident	63.6	Low	8 Å²	8	99.3 Å²	99.3	5%	0.052	52%	0.524	C	S	.	.			trans	-55.9	146.7	161.6	-22.4	33.9	0	0	0	111.1	L300 V301 A302 L310 T317 L322	P223-L300 HydrophobicContact CB-CD1 3.82Å; P223-L300 HydrophobicContact CB-CG 4.19Å; P223-V301 CarbonylContact C-O 3.56Å; P223-V301 VanDerWaalsContact CA-O 3.27Å; P223-V301 WeakPolarHBondContact CA-O 3.49Å; P223-A302 HydrophobicContact CB-CB 4.33Å; P223-L310 HydrophobicContact CG-CD1 3.57Å; P223-T317 HydrophobicContact CB-CG2 4.4Å; P223-T317 HydrophobicContact CG-CG2 3.63Å; P223-L322 WeakPolarHBondContact O-CD2 3.45Å
224	K	84.1	Confident	65.5	Low	44 Å²	44	95.4 Å²	95.4	19%	0.191	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	129.1	174	-49.3	172.6	-175.7	171.7	0	108.5	C226 G263 E265 D268 L300 V301	K224-C226 PolarHBondContact O-N 3.07Å; K224-G263 VanDerWaalsContact CD-O 3.25Å; K224-G263 WeakPolarHBondContact CD-O 3.2Å; K224-G263 WeakPolarHBondContact CE-O 3.34Å; K224-G263 PolarHBondContact NZ-O 3.28Å; K224-E265 IonicContact NZ-OE1 2.67Å; K224-E265 PolarHBondContact NZ-OE1 2.64Å; K224-D268 IonicContact NZ-OD1 2.75Å; K224-D268 PolarHBondContact NZ-OD1 3.44Å; K224-D268 IonicContact NZ-OD2 3.02Å; K224-D268 PolarHBondContact NZ-OD2 3.02Å; K224-L300 WeakPolarHBondContact O-CA 3.28Å; K224-V301 HydrophobicContact CB-CG2 3.97Å; K224-V301 HydrophobicContact CD-CG2 4.23Å; K224-V301 PolarHBondContact N-O 2.96Å; K224-V301 PolarHBondContact O-N 3.32Å
225	L	84	Confident	67.8	Low	66 Å²	66	92.9 Å²	92.9	35%	0.346	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	92.3	167.4	-174.9	65.4	0	0	0	108.7	R227 E298 L300 L322	L225-R227 PolarHBondContact O-N 3.04Å; L225-E298 HydrophobicContact CD1-CG 3.69Å; L225-E298 HydrophobicContact CG-CG 4.13Å; L225-L300 HydrophobicContact CB-CD1 4.31Å; L225-L300 HydrophobicContact CD1-CB 4.43Å; L225-L300 HydrophobicContact CD1-CD1 4.24Å; L225-L322 HydrophobicContact CB-CD1 3.65Å; L225-L322 HydrophobicContact CD2-CD1 4.25Å
226	C	85.4	Confident	69.9	Low	0 Å²	0	81.4 Å²	81.4	0%	0	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	99.8	-175.4	-63.8	0	0	0	0	110	K224 M228 A262 M264 M299	K224-C226 PolarHBondContact O-N 3.07Å; C226-M228 HydrophobicContact CB-CE 4.18Å; C226-M228 WeakPolarHBondContact O-CE 3.22Å; C226-A262 HydrophobicContact CB-CB 4.05Å; C226-A262 PolarHBondContact SG-O 3.11Å; C226-M264 HydrophobicContact CB-CG 3.65Å; C226-M264 HydrophobicContact CB-SD 4.23Å; C226-M264 VanDerWaalsContact SG-CG 3.52Å; C226-M299 PolarHBondContact N-O 2.94Å; C226-M299 PolarHBondContact O-N 3.26Å
227	R	86	Confident	72.4	Confident	153 Å²	153	77.6 Å²	77.6	58%	0.577	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.8	128.5	171.1	178.7	173.4	162.6	166.2	-3.9	110.8	L225 L297 E298	L225-R227 PolarHBondContact O-N 3.04Å; R227-L297 WeakPolarHBondContact CA-O 3.34Å; R227-E298 HydrophobicContact CB-CG 4.32Å; R227-E298 WeakPolarHBondContact CD-OE2 3.46Å
228	M	89.6	Confident	74.1	Confident	7 Å²	7	74 Å²	74	3%	0.034	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	158.4	-174.7	72.8	-159.4	82.6	0	0	112.3	C226 Y235 F237 A258 A262 M264 L297 M299	C226-M228 HydrophobicContact CB-CE 4.18Å; C226-M228 WeakPolarHBondContact O-CE 3.22Å; M228-Y235 HydrophobicContact CG-CD1 3.7Å; M228-Y235 HydrophobicContact CG-CE1 4.16Å; M228-Y235 HydrophobicContact CG-CG 4.48Å; M228-Y235 HydrophobicContact SD-CD1 4Å; M228-Y235 HydrophobicContact SD-CG 4.21Å; M228-F237 HydrophobicContact SD-CD1 4.3Å; M228-F237 HydrophobicContact SD-CE1 3.98Å; M228-A258 HydrophobicContact CB-CB 4.21Å; M228-A262 HydrophobicContact CB-CB 4.02Å; M228-M264 HydrophobicContact CE-CE 4.43Å; M228-M264 HydrophobicContact CE-SD 3.34Å; M228-M264 WeakPolarHBondContact CE-SD 3.45Å; M228-M264 HydrophobicContact SD-SD 3.98Å; M228-L297 HydrophobicContact CE-CD2 4.27Å; M228-L297 HydrophobicContact CE-CG 4.43Å; M228-L297 HydrophobicContact CG-CB 3.97Å; M228-L297 PolarHBondContact N-O 3Å; M228-L297 PolarHBondContact O-N 3.37Å; M228-L297 HydrophobicContact SD-CB 4.49Å; M228-L297 HydrophobicContact SD-CD2 4.03Å; M228-M299 HydrophobicContact CE-CG 4.47Å; M228-M299 HydrophobicContact CE-SD 4.22Å
229	E	81.9	Confident	76.2	Confident	128 Å²	128	71.2 Å²	71.2	60%	0.598	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116	145	176.1	-66.3	-177.3	175.2	0	0	110.6	T231 A258 N295	E229-T231 PolarHBondContact O-N 3.32Å; E229-A258 WeakPolarHBondContact O-CB 3.4Å; E229-N295 CarbonylContact C-O 3.6Å; E229-N295 WeakPolarHBondContact CA-O 3.04Å
230	K	79.4	Confident	77.7	Confident	100 Å²	100	67.1 Å²	67.1	44%	0.435	35%	0.352	S	S	.	.			trans	-78.1	119.7	-171.8	-167.5	173.7	175.5	-176.8	0	111	Y235 G294 N295	K230-Y235 HydrophobicContact CB-CD1 4.04Å; K230-Y235 HydrophobicContact CB-CE1 3.47Å; K230-Y235 VanDerWaalsContact CB-CE1 3.47Å; K230-Y235 HydrophobicContact CD-CE1 4.43Å; K230-Y235 HydrophobicContact CD-CE2 4.26Å; K230-Y235 HydrophobicContact CG-CD1 4.34Å; K230-Y235 HydrophobicContact CG-CE1 3.99Å; K230-Y235 HydrophobicContact CG-CE2 4.38Å; K230-G294 WeakPolarHBondContact CD-O 3.21Å; K230-G294 PolarHBondContact NZ-O 3.47Å; K230-N295 HydrophobicContact CB-CB 4.49Å; K230-N295 WeakPolarHBondContact CB-O 3.42Å; K230-N295 PolarHBondContact N-O 2.96Å
231	T	81.5	Confident	78.5	Confident	69 Å²	69	62.9 Å²	62.9	42%	0.423	34%	0.338	S	S	.	.	B	Isolated β-bridge	trans	-84.2	175	174.4	73.9	0	0	0	0	111.3	E229 A233 G234 A258	E229-T231 PolarHBondContact O-N 3.32Å; T231-A233 PolarHBondContact O-N 3.23Å; T231-A233 PolarHBondContact OG1-N 3.44Å; T231-A233 VanDerWaalsContact OG1-N 3.1Å; T231-G234 WeakPolarHBondContact CB-O 3.43Å; T231-G234 PolarHBondContact N-O 3.47Å; T231-G234 WeakPolarHBondContact O-CA 3.18Å; T231-G234 PolarHBondContact O-N 3.32Å; T231-G234 PolarHBondContact OG1-N 2.95Å; T231-G234 PolarHBondContact OG1-O 2.7Å; T231-A258 HydrophobicContact CG2-CB 4.28Å
232	S	73.3	Confident	78.7	Confident	141 Å²	141	62.6 Å²	62.6	99%	0.986	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-21.5	167.7	47.9	0	0	0	0	113.7
233	A	71.1	Confident	77.8	Confident	87 Å²	87	66.5 Å²	66.5	72%	0.719	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	15.2	171.9	0	0	0	0	0	113	T231	T231-A233 PolarHBondContact O-N 3.23Å; T231-A233 PolarHBondContact OG1-N 3.44Å; T231-A233 VanDerWaalsContact OG1-N 3.1Å
234	G	80.3	Confident	76.2	Confident	20 Å²	20	70.2 Å²	70.2	21%	0.206	40%	0.399	C	S	.	.	B	Isolated β-bridge	trans	77.1	-146.5	-174.1	0	0	0	0	0	112.8	T231	T231-G234 WeakPolarHBondContact CB-O 3.43Å; T231-G234 PolarHBondContact N-O 3.47Å; T231-G234 WeakPolarHBondContact O-CA 3.18Å; T231-G234 PolarHBondContact O-N 3.32Å; T231-G234 PolarHBondContact OG1-N 2.95Å; T231-G234 PolarHBondContact OG1-O 2.7Å
235	Y	81.3	Confident	74.8	Confident	22 Å²	22	72.2 Å²	72.2	9%	0.086	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-17.5	-176.8	-62.3	-64.2	0	0	0	114	M228 K230 F237 A258 A259 I290 G294 L297	M228-Y235 HydrophobicContact CG-CD1 3.7Å; M228-Y235 HydrophobicContact CG-CE1 4.16Å; M228-Y235 HydrophobicContact CG-CG 4.48Å; M228-Y235 HydrophobicContact SD-CD1 4Å; M228-Y235 HydrophobicContact SD-CG 4.21Å; K230-Y235 HydrophobicContact CB-CD1 4.04Å; K230-Y235 HydrophobicContact CB-CE1 3.47Å; K230-Y235 VanDerWaalsContact CB-CE1 3.47Å; K230-Y235 HydrophobicContact CD-CE1 4.43Å; K230-Y235 HydrophobicContact CD-CE2 4.26Å; K230-Y235 HydrophobicContact CG-CD1 4.34Å; K230-Y235 HydrophobicContact CG-CE1 3.99Å; K230-Y235 HydrophobicContact CG-CE2 4.38Å; Y235-F237 HydrophobicContact CD2-CE1 4.33Å; Y235-F237 HydrophobicContact CG-CE1 4.19Å; Y235-A258 WeakPolarHBondContact O-CB 3.15Å; Y235-A258 PolarHBondContact O-N 2.96Å; Y235-A259 PolarHBondContact O-N 3.13Å; Y235-I290 HydrophobicContact CD2-CG2 4.46Å; Y235-I290 HydrophobicContact CE2-CG2 4.21Å; Y235-G294 PolarHBondContact OH-O 3.04Å; Y235-L297 HydrophobicContact CD1-CB 4.32Å; Y235-L297 HydrophobicContact CD1-CD2 4.38Å; Y235-L297 HydrophobicContact CD2-CD2 3.88Å; Y235-L297 HydrophobicContact CE1-CB 3.69Å; Y235-L297 HydrophobicContact CE1-CD2 4.35Å; Y235-L297 HydrophobicContact CE2-CB 4.29Å; Y235-L297 HydrophobicContact CE2-CD2 3.85Å; Y235-L297 HydrophobicContact CG-CD2 4.15Å
236	G	81.8	Confident	73.3	Confident	17 Å²	17	74.5 Å²	74.5	18%	0.175	43%	0.426	C	S	.	.	S	Bend	trans	76.2	35.3	177.9	0	0	0	0	0	114.8	V254	G236-V254 PolarHBondContact O-N 3.39Å
237	F	87.6	Confident	72.3	Confident	24 Å²	24	74.9 Å²	74.9	11%	0.105	43%	0.431	C	S	.	.			trans	-144.6	156.1	167.8	74	-88.2	0	0	0	109.6	M228 Y235 L239 I250 V253 A259 M264 I290 L297 M299	M228-F237 HydrophobicContact SD-CD1 4.3Å; M228-F237 HydrophobicContact SD-CE1 3.98Å; Y235-F237 HydrophobicContact CD2-CE1 4.33Å; Y235-F237 HydrophobicContact CG-CE1 4.19Å; F237-L239 HydrophobicContact CE2-CB 4.35Å; F237-I250 HydrophobicContact CB-CG2 4.12Å; F237-I250 HydrophobicContact CD2-CD1 3.71Å; F237-I250 HydrophobicContact CD2-CG2 4.41Å; F237-I250 HydrophobicContact CE2-CD1 3.81Å; F237-V253 HydrophobicContact CB-CG2 4.28Å; F237-A259 HydrophobicContact CB-CB 3.82Å; F237-A259 HydrophobicContact CD1-CB 3.95Å; F237-A259 HydrophobicContact CG-CB 4.31Å; F237-M264 HydrophobicContact CB-CE 4.47Å; F237-M264 HydrophobicContact CD1-CE 4.06Å; F237-M264 HydrophobicContact CD1-SD 4.27Å; F237-M264 HydrophobicContact CD2-CE 4.12Å; F237-M264 HydrophobicContact CE1-CE 4.27Å; F237-M264 HydrophobicContact CE2-CE 4.34Å; F237-M264 HydrophobicContact CG-CE 3.96Å; F237-M264 HydrophobicContact CZ-CE 4.41Å; F237-I290 HydrophobicContact CZ-CD1 4.31Å; F237-L297 HydrophobicContact CE1-CD2 3.88Å; F237-L297 HydrophobicContact CZ-CD2 3.99Å; F237-M299 HydrophobicContact CE1-SD 4.24Å; F237-M299 HydrophobicContact CE2-CE 4.41Å; F237-M299 HydrophobicContact CE2-SD 4.4Å; F237-M299 HydrophobicContact CZ-CE 4.28Å; F237-M299 HydrophobicContact CZ-SD 3.73Å
238	H	80.2	Confident	72	Confident	104 Å²	104	67.9 Å²	67.9	48%	0.481	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	137.4	169.9	-71.9	-171	0	0	0	109.5	T251 E252	H238-T251 WeakPolarHBondContact CB-OG1 3.46Å; H238-T251 PolarHBondContact N-O 2.83Å; H238-T251 PolarHBondContact O-N 2.62Å; H238-T251 PolarHBondContact O-OG1 2.76Å; H238-E252 HydrophobicContact CB-CB 4.19Å; H238-E252 IonicContact CE1-OE2 3.02Å; H238-E252 PolarHBondContact CE1-OE2 2.76Å; H238-E252 IonicContact CG-OE2 3.69Å; H238-E252 IonicContact ND1-OE2 2.71Å; H238-E252 PolarHBondContact ND1-OE2 2.86Å
239	L	83.4	Confident	71.8	Confident	29 Å²	29	69.8 Å²	69.8	15%	0.152	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	132.3	172.3	-171.5	77	0	0	0	108	F237 Q248 I250 V270 H283 V286 V287 I290	F237-L239 HydrophobicContact CE2-CB 4.35Å; L239-Q248 HydrophobicContact CD1-CB 3.77Å; L239-Q248 HydrophobicContact CD2-CB 4.37Å; L239-Q248 HydrophobicContact CD2-CG 4.32Å; L239-Q248 HydrophobicContact CG-CB 4.13Å; L239-I250 HydrophobicContact CD1-CD1 4.19Å; L239-V270 HydrophobicContact CD1-CG2 3.81Å; L239-H283 PolarHBondContact O-CE1 3.02Å; L239-V286 HydrophobicContact CD2-CB 3.97Å; L239-V286 HydrophobicContact CD2-CG1 3.7Å; L239-V287 HydrophobicContact CD2-CG2 3.93Å; L239-I290 HydrophobicContact CD2-CD1 4.07Å
240	N	75.8	Confident	72.1	Confident	64 Å²	64	63.7 Å²	63.7	34%	0.342	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	153.9	176.1	-159.9	4.7	0	0	0	111.4	Q248 Y249 T251	N240-Q248 WeakPolarHBondContact O-CA 3.37Å; N240-Q248 PolarHBondContact O-OE1 3Å; N240-Y249 HydrophobicContact CB-CD2 4.32Å; N240-Y249 HydrophobicContact CB-CE1 4.19Å; N240-Y249 HydrophobicContact CB-CE2 3.96Å; N240-Y249 PolarHBondContact N-O 2.95Å; N240-Y249 PolarHBondContact ND2-OH 3.28Å; N240-Y249 VanDerWaalsContact ND2-OH 3.16Å; N240-Y249 WeakPolarHBondContact O-CD1 3.27Å; N240-Y249 PolarHBondContact O-N 2.85Å; N240-T251 HydrophobicContact CB-CG2 3.95Å
241	G	67.5	Low	72.2	Confident	22 Å²	22	60.2 Å²	60.2	23%	0.227	37%	0.371	C	S	.	.			trans	-149.4	138	178	0	0	0	0	0	109.9
242	I	60.5	Low	72	Confident	92 Å²	92	62.8 Å²	62.8	47%	0.472	38%	0.378	S	S	.	.			trans	-90.3	128.3	179.2	-68.7	154.6	0	0	0	108.5	G244 V245 Y249	I242-G244 PolarHBondContact O-N 3.31Å; I242-V245 HydrophobicContact CB-CB 3.99Å; I242-V245 HydrophobicContact CB-CG2 4.11Å; I242-V245 HydrophobicContact CG2-CB 4.04Å; I242-V245 HydrophobicContact CG2-CG2 3.61Å; I242-V245 PolarHBondContact O-N 3.36Å; I242-Y249 HydrophobicContact CD1-CE1 3.89Å; I242-Y249 HydrophobicContact CG1-CE1 3.92Å
243	E	45.6	Very low	72.6	Confident	199 Å²	199	56.9 Å²	56.9	93%	0.93	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	127.1	178.6	-170.2	168.7	-150.7	0	0	110.9	V245	E243-V245 VanDerWaalsContact C-N 3.33Å
244	G	41	Very low	73	Confident	86 Å²	86	56.6 Å²	56.6	89%	0.887	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.7	0.5	-174.6	0	0	0	0	0	116	I242	I242-G244 PolarHBondContact O-N 3.31Å
245	V	54.1	Low	73.1	Confident	87 Å²	87	63.3 Å²	63.3	53%	0.527	35%	0.348	S	S	.	.			trans	-112.7	139	175	179.5	0	0	0	0	110.3	I242 E243	I242-V245 HydrophobicContact CB-CB 3.99Å; I242-V245 HydrophobicContact CB-CG2 4.11Å; I242-V245 HydrophobicContact CG2-CB 4.04Å; I242-V245 HydrophobicContact CG2-CG2 3.61Å; I242-V245 PolarHBondContact O-N 3.36Å; E243-V245 VanDerWaalsContact C-N 3.33Å
246	L	51.2	Low	72.8	Confident	113 Å²	113	64.2 Å²	64.2	59%	0.592	36%	0.364	S	S	*	.	S	Bend	trans	-87.5	135.5	179.9	-64.5	165.3	0	0	0	111
247	G	65.1	Low	72.7	Confident	9 Å²	9	64.1 Å²	64.1	9%	0.093	36%	0.364	C	S	.	.	S	Bend	trans	104.6	154.2	-175.4	0	0	0	0	0	113.3	E279	G247-E279 PolarHBondContact N-O 2.89Å
248	Q	79.1	Confident	72.4	Confident	6 Å²	6	63.6 Å²	63.6	3%	0.028	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	155.5	176.5	-51.2	-61.4	-52.6	0	0	109.5	L239 N240 V270 S281 H283 V286	L239-Q248 HydrophobicContact CD1-CB 3.77Å; L239-Q248 HydrophobicContact CD2-CB 4.37Å; L239-Q248 HydrophobicContact CD2-CG 4.32Å; L239-Q248 HydrophobicContact CG-CB 4.13Å; N240-Q248 WeakPolarHBondContact O-CA 3.37Å; N240-Q248 PolarHBondContact O-OE1 3Å; Q248-V270 HydrophobicContact CB-CB 4.45Å; Q248-V270 HydrophobicContact CB-CG2 4.47Å; Q248-V270 PolarHBondContact O-N 2.72Å; Q248-S281 PolarHBondContact NE2-O 3.47Å; Q248-H283 PolarHBondContact OE1-ND1 2.99Å; Q248-V286 HydrophobicContact CG-CB 4.1Å; Q248-V286 HydrophobicContact CG-CG1 4.28Å; Q248-V286 HydrophobicContact CG-CG2 3.73Å
249	Y	86.1	Confident	72.6	Confident	47 Å²	47	58.7 Å²	58.7	18%	0.184	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	159.9	178.8	59.8	-77.9	0	0	0	112.2	N240 I242 T251 D268	N240-Y249 HydrophobicContact CB-CD2 4.32Å; N240-Y249 HydrophobicContact CB-CE1 4.19Å; N240-Y249 HydrophobicContact CB-CE2 3.96Å; N240-Y249 PolarHBondContact N-O 2.95Å; N240-Y249 PolarHBondContact ND2-OH 3.28Å; N240-Y249 VanDerWaalsContact ND2-OH 3.16Å; N240-Y249 WeakPolarHBondContact O-CD1 3.27Å; N240-Y249 PolarHBondContact O-N 2.85Å; I242-Y249 HydrophobicContact CD1-CE1 3.89Å; I242-Y249 HydrophobicContact CG1-CE1 3.92Å; Y249-T251 HydrophobicContact CD2-CG2 3.92Å; Y249-T251 HydrophobicContact CE2-CG2 3.81Å; Y249-D268 CarbonylContact C-O 3.57Å; Y249-D268 WeakPolarHBondContact CA-O 3.42Å
250	I	87.8	Confident	72.5	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	135.2	-175.3	-57.1	-55.4	0	0	0	110.4	F237 L239 V253 M264 E265 N266 D267 D268 V270 M299	F237-I250 HydrophobicContact CB-CG2 4.12Å; F237-I250 HydrophobicContact CD2-CD1 3.71Å; F237-I250 HydrophobicContact CD2-CG2 4.41Å; F237-I250 HydrophobicContact CE2-CD1 3.81Å; L239-I250 HydrophobicContact CD1-CD1 4.19Å; I250-V253 HydrophobicContact CG2-CG2 3.42Å; I250-V253 VanDerWaalsContact CG2-CG2 3.42Å; I250-M264 HydrophobicContact CB-CE 4.48Å; I250-M264 HydrophobicContact CD1-CE 3.38Å; I250-M264 HydrophobicContact CG1-CE 3.62Å; I250-M264 HydrophobicContact CG2-CE 4.03Å; I250-E265 WeakPolarHBondContact CG2-O 3.18Å; I250-N266 CarbonylContact O-C 3.5Å; I250-N266 WeakPolarHBondContact O-CA 3.49Å; I250-D267 PolarHBondContact O-N 3.49Å; I250-D268 HydrophobicContact CB-CB 4.3Å; I250-D268 HydrophobicContact CG1-CB 4.17Å; I250-D268 WeakPolarHBondContact CG1-O 3.38Å; I250-D268 PolarHBondContact N-O 3.14Å; I250-V270 HydrophobicContact CD1-CG2 3.59Å; I250-V270 HydrophobicContact CG1-CG2 4.07Å; I250-M299 HydrophobicContact CD1-CE 4.03Å
251	T	81.3	Confident	72.7	Confident	27 Å²	27	64.1 Å²	64.1	17%	0.166	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	165.4	174.4	57	0	0	0	0	110.8	H238 N240 Y249 V253	H238-T251 WeakPolarHBondContact CB-OG1 3.46Å; H238-T251 PolarHBondContact N-O 2.83Å; H238-T251 PolarHBondContact O-N 2.62Å; H238-T251 PolarHBondContact O-OG1 2.76Å; N240-T251 HydrophobicContact CB-CG2 3.95Å; Y249-T251 HydrophobicContact CD2-CG2 3.92Å; Y249-T251 HydrophobicContact CE2-CG2 3.81Å; T251-V253 VanDerWaalsContact C-N 3.29Å; T251-V253 PolarHBondContact O-N 3.09Å; T251-V253 VanDerWaalsContact O-N 3.14Å
252	E	78.5	Confident	73.3	Confident	122 Å²	122	64.3 Å²	64.3	57%	0.57	36%	0.362	S	S	*	.			trans	49.7	42.8	172	-57.2	-175.1	174.8	0	0	114.4	H238 V254 N266	H238-E252 HydrophobicContact CB-CB 4.19Å; H238-E252 IonicContact CE1-OE2 3.02Å; H238-E252 PolarHBondContact CE1-OE2 2.76Å; H238-E252 IonicContact CG-OE2 3.69Å; H238-E252 IonicContact ND1-OE2 2.71Å; H238-E252 PolarHBondContact ND1-OE2 2.86Å; E252-V254 PolarHBondContact O-N 2.86Å; E252-V254 VanDerWaalsContact O-N 3.15Å; E252-N266 PolarHBondContact N-OD1 3.41Å; E252-N266 VanDerWaalsContact N-OD1 3.13Å
253	V	85	Confident	74.4	Confident	17 Å²	17	61.6 Å²	61.6	10%	0.103	36%	0.356	C	S	.	.			trans	-63.5	115.4	175.8	178.6	0	0	0	0	110.5	F237 I250 T251 K255 A259 D260 M264 N266	F237-V253 HydrophobicContact CB-CG2 4.28Å; I250-V253 HydrophobicContact CG2-CG2 3.42Å; I250-V253 VanDerWaalsContact CG2-CG2 3.42Å; T251-V253 VanDerWaalsContact C-N 3.29Å; T251-V253 PolarHBondContact O-N 3.09Å; T251-V253 VanDerWaalsContact O-N 3.14Å; V253-K255 PolarHBondContact O-N 2.79Å; V253-A259 HydrophobicContact CG1-CB 4.14Å; V253-D260 HydrophobicContact CG1-CB 3.83Å; V253-M264 HydrophobicContact CG2-CB 4.45Å; V253-N266 PolarHBondContact N-OD1 3.47Å
254	V	79.7	Confident	76.4	Confident	82 Å²	82	52.1 Å²	52.1	50%	0.497	31%	0.312	S	S	.	.			trans	-74.2	114.1	-177.3	-179.6	0	0	0	0	109.7	G236 E252 G256 G257 D260	G236-V254 PolarHBondContact O-N 3.39Å; E252-V254 PolarHBondContact O-N 2.86Å; E252-V254 VanDerWaalsContact O-N 3.15Å; V254-G256 PolarHBondContact O-N 3.01Å; V254-G257 WeakPolarHBondContact O-CA 3.41Å; V254-G257 PolarHBondContact O-N 3.45Å; V254-D260 WeakPolarHBondContact O-CB 3.35Å
255	K	81.6	Confident	78.5	Confident	160 Å²	160	52.4 Å²	52.4	70%	0.696	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	129.5	178.5	-70.5	-73.2	151	-159.9	0	111.5	V253 G257 D260	V253-K255 PolarHBondContact O-N 2.79Å; K255-G257 PolarHBondContact O-N 3.2Å; K255-D260 WeakPolarHBondContact CA-OD2 3.4Å; K255-D260 WeakPolarHBondContact CD-OD1 3.33Å; K255-D260 WeakPolarHBondContact CE-OD1 3.47Å; K255-D260 IonicContact NZ-OD1 3.12Å; K255-D260 PolarHBondContact NZ-OD1 3.12Å
256	G	77	Confident	79.8	Confident	41 Å²	41	52.3 Å²	52.3	42%	0.423	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.4	-1	-170.7	0	0	0	0	0	115.2	V254 D260 K261	V254-G256 PolarHBondContact O-N 3.01Å; G256-D260 PolarHBondContact N-OD2 3.16Å; G256-K261 WeakPolarHBondContact O-CE 3.5Å; G256-K261 PolarHBondContact O-NZ 3.4Å
257	G	78.6	Confident	81.3	Confident	16 Å²	16	51.1 Å²	51.1	17%	0.165	28%	0.281	C	S	.	.	S	Bend	trans	-73	-178.6	173.8	0	0	0	0	0	113.4	V254 K255 K261	V254-G257 WeakPolarHBondContact O-CA 3.41Å; V254-G257 PolarHBondContact O-N 3.45Å; K255-G257 PolarHBondContact O-N 3.2Å; G257-K261 WeakPolarHBondContact O-CB 3.3Å; G257-K261 WeakPolarHBondContact O-CD 3.34Å; G257-K261 VanDerWaalsContact O-CG 3.29Å; G257-K261 WeakPolarHBondContact O-CG 3.48Å; G257-K261 PolarHBondContact O-N 2.86Å; G257-K261 VanDerWaalsContact O-N 3.13Å
258	A	81.3	Confident	82.3	Confident	13 Å²	13	50.7 Å²	50.7	11%	0.107	28%	0.277	C	S	.	.	H	α-helix	trans	-70.9	-40.7	-177.3	0	0	0	0	0	112.3	M228 E229 T231 Y235 K261 A262	M228-A258 HydrophobicContact CB-CB 4.21Å; E229-A258 WeakPolarHBondContact O-CB 3.4Å; T231-A258 HydrophobicContact CG2-CB 4.28Å; Y235-A258 WeakPolarHBondContact O-CB 3.15Å; Y235-A258 PolarHBondContact O-N 2.96Å; A258-K261 PolarHBondContact O-N 2.93Å; A258-A262 WeakPolarHBondContact O-CB 3.25Å; A258-A262 PolarHBondContact O-N 3.06Å
259	A	84.6	Confident	82.7	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-60.1	-48.9	173.6	0	0	0	0	0	113.3	Y235 F237 V253 K261 A262 G263 M264	Y235-A259 PolarHBondContact O-N 3.13Å; F237-A259 HydrophobicContact CB-CB 3.82Å; F237-A259 HydrophobicContact CD1-CB 3.95Å; F237-A259 HydrophobicContact CG-CB 4.31Å; V253-A259 HydrophobicContact CG1-CB 4.14Å; A259-K261 VanDerWaalsContact C-N 3.33Å; A259-K261 PolarHBondContact O-N 3.48Å; A259-A262 CarbonylContact O-C 3.47Å; A259-A262 WeakPolarHBondContact O-CA 3.46Å; A259-A262 WeakPolarHBondContact O-CB 3.44Å; A259-A262 PolarHBondContact O-N 3.05Å; A259-G263 PolarHBondContact O-N 3.18Å; A259-M264 HydrophobicContact CB-CB 4.16Å; A259-M264 HydrophobicContact CB-CG 4.32Å; A259-M264 HydrophobicContact CB-SD 3.53Å; A259-M264 VanDerWaalsContact CB-SD 3.53Å; A259-M264 WeakPolarHBondContact O-CB 3.33Å; A259-M264 PolarHBondContact O-N 3.48Å
260	D	80.9	Confident	82.7	Confident	43 Å²	43	48.8 Å²	48.8	23%	0.23	27%	0.27	C	S	.	.	H	α-helix	trans	-60.1	-41.9	177.7	-172	61.1	0	0	0	111.7	V253 V254 K255 G256 A262 G263	V253-D260 HydrophobicContact CG1-CB 3.83Å; V254-D260 WeakPolarHBondContact O-CB 3.35Å; K255-D260 WeakPolarHBondContact CA-OD2 3.4Å; K255-D260 WeakPolarHBondContact CD-OD1 3.33Å; K255-D260 WeakPolarHBondContact CE-OD1 3.47Å; K255-D260 IonicContact NZ-OD1 3.12Å; K255-D260 PolarHBondContact NZ-OD1 3.12Å; G256-D260 PolarHBondContact N-OD2 3.16Å; D260-A262 VanDerWaalsContact C-N 3.29Å; D260-A262 PolarHBondContact O-N 3.12Å; D260-G263 PolarHBondContact O-N 2.92Å; D260-G263 VanDerWaalsContact O-N 3.14Å
261	K	79.8	Confident	82.6	Confident	165 Å²	165	48.8 Å²	48.8	72%	0.717	27%	0.27	S	S	*	.	H	α-helix	trans	-68.3	-24.4	173.7	-75.3	167.6	175.5	150.4	0	113.8	G256 G257 A258 A259 G263	G256-K261 WeakPolarHBondContact O-CE 3.5Å; G256-K261 PolarHBondContact O-NZ 3.4Å; G257-K261 WeakPolarHBondContact O-CB 3.3Å; G257-K261 WeakPolarHBondContact O-CD 3.34Å; G257-K261 VanDerWaalsContact O-CG 3.29Å; G257-K261 WeakPolarHBondContact O-CG 3.48Å; G257-K261 PolarHBondContact O-N 2.86Å; G257-K261 VanDerWaalsContact O-N 3.13Å; A258-K261 PolarHBondContact O-N 2.93Å; A259-K261 VanDerWaalsContact C-N 3.33Å; A259-K261 PolarHBondContact O-N 3.48Å; K261-G263 VanDerWaalsContact C-N 3.3Å
262	A	81.6	Confident	82.8	Confident	25 Å²	25	48.3 Å²	48.3	21%	0.207	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	1.5	173.1	0	0	0	0	0	113.1	C226 M228 A258 A259 D260	C226-A262 HydrophobicContact CB-CB 4.05Å; C226-A262 PolarHBondContact SG-O 3.11Å; M228-A262 HydrophobicContact CB-CB 4.02Å; A258-A262 WeakPolarHBondContact O-CB 3.25Å; A258-A262 PolarHBondContact O-N 3.06Å; A259-A262 CarbonylContact O-C 3.47Å; A259-A262 WeakPolarHBondContact O-CA 3.46Å; A259-A262 WeakPolarHBondContact O-CB 3.44Å; A259-A262 PolarHBondContact O-N 3.05Å; D260-A262 VanDerWaalsContact C-N 3.29Å; D260-A262 PolarHBondContact O-N 3.12Å
263	G	83.3	Confident	83.1	Confident	35 Å²	35	42.5 Å²	42.5	36%	0.361	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.8	9.4	177	0	0	0	0	0	115.4	K224 A259 D260 K261	K224-G263 VanDerWaalsContact CD-O 3.25Å; K224-G263 WeakPolarHBondContact CD-O 3.2Å; K224-G263 WeakPolarHBondContact CE-O 3.34Å; K224-G263 PolarHBondContact NZ-O 3.28Å; A259-G263 PolarHBondContact O-N 3.18Å; D260-G263 PolarHBondContact O-N 2.92Å; D260-G263 VanDerWaalsContact O-N 3.14Å; K261-G263 VanDerWaalsContact C-N 3.3Å
264	M	86.1	Confident	83	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.005	25%	0.253	C	S	.	.			trans	-69.1	140.4	175.6	-59.9	173.7	75.4	0	0	110.8	C226 M228 F237 I250 V253 A259 M299	C226-M264 HydrophobicContact CB-CG 3.65Å; C226-M264 HydrophobicContact CB-SD 4.23Å; C226-M264 VanDerWaalsContact SG-CG 3.52Å; M228-M264 HydrophobicContact CE-CE 4.43Å; M228-M264 HydrophobicContact CE-SD 3.34Å; M228-M264 WeakPolarHBondContact CE-SD 3.45Å; M228-M264 HydrophobicContact SD-SD 3.98Å; F237-M264 HydrophobicContact CB-CE 4.47Å; F237-M264 HydrophobicContact CD1-CE 4.06Å; F237-M264 HydrophobicContact CD1-SD 4.27Å; F237-M264 HydrophobicContact CD2-CE 4.12Å; F237-M264 HydrophobicContact CE1-CE 4.27Å; F237-M264 HydrophobicContact CE2-CE 4.34Å; F237-M264 HydrophobicContact CG-CE 3.96Å; F237-M264 HydrophobicContact CZ-CE 4.41Å; I250-M264 HydrophobicContact CB-CE 4.48Å; I250-M264 HydrophobicContact CD1-CE 3.38Å; I250-M264 HydrophobicContact CG1-CE 3.62Å; I250-M264 HydrophobicContact CG2-CE 4.03Å; V253-M264 HydrophobicContact CG2-CB 4.45Å; A259-M264 HydrophobicContact CB-CB 4.16Å; A259-M264 HydrophobicContact CB-CG 4.32Å; A259-M264 HydrophobicContact CB-SD 3.53Å; A259-M264 VanDerWaalsContact CB-SD 3.53Å; A259-M264 WeakPolarHBondContact O-CB 3.33Å; A259-M264 PolarHBondContact O-N 3.48Å; M264-M299 HydrophobicContact CE-CE 4.38Å; M264-M299 HydrophobicContact CE-SD 4.13Å
265	E	86.6	Confident	82.5	Confident	91 Å²	91	44 Å²	44	43%	0.425	26%	0.257	S	S	.	.			trans	-119.5	167.4	172.8	-72	167.8	-105.5	0	0	110.2	K224 I250 D268	K224-E265 IonicContact NZ-OE1 2.67Å; K224-E265 PolarHBondContact NZ-OE1 2.64Å; I250-E265 WeakPolarHBondContact CG2-O 3.18Å; E265-D268 PolarHBondContact N-OD2 3.43Å
266	N	80.1	Confident	82.2	Confident	85 Å²	85	41.6 Å²	41.6	46%	0.455	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	151.3	166.4	-65.9	-13.6	0	0	0	109.3	I250 E252 V253 D268	I250-N266 CarbonylContact O-C 3.5Å; I250-N266 WeakPolarHBondContact O-CA 3.49Å; E252-N266 PolarHBondContact N-OD1 3.41Å; E252-N266 VanDerWaalsContact N-OD1 3.13Å; V253-N266 PolarHBondContact N-OD1 3.47Å; N266-D268 PolarHBondContact O-N 2.79Å; N266-D268 VanDerWaalsContact O-N 3.14Å
267	D	82.9	Confident	82.4	Confident	89 Å²	89	43.1 Å²	43.1	48%	0.476	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.9	8.4	-179.4	-49.4	-55.1	0	0	0	115.2	I250 V269 Q304	I250-D267 PolarHBondContact O-N 3.49Å; D267-V269 PolarHBondContact O-N 2.68Å; D267-Q304 PolarHBondContact O-N 3.3Å
268	D	86.3	Confident	82.6	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	126.7	159.3	-87.4	-32.9	0	0	0	109.2	K224 Y249 I250 E265 N266 V301 R303	K224-D268 IonicContact NZ-OD1 2.75Å; K224-D268 PolarHBondContact NZ-OD1 3.44Å; K224-D268 IonicContact NZ-OD2 3.02Å; K224-D268 PolarHBondContact NZ-OD2 3.02Å; Y249-D268 CarbonylContact C-O 3.57Å; Y249-D268 WeakPolarHBondContact CA-O 3.42Å; I250-D268 HydrophobicContact CB-CB 4.3Å; I250-D268 HydrophobicContact CG1-CB 4.17Å; I250-D268 WeakPolarHBondContact CG1-O 3.38Å; I250-D268 PolarHBondContact N-O 3.14Å; E265-D268 PolarHBondContact N-OD2 3.43Å; N266-D268 PolarHBondContact O-N 2.79Å; N266-D268 VanDerWaalsContact O-N 3.14Å; D268-V301 HydrophobicContact CB-CB 4.12Å; D268-V301 HydrophobicContact CB-CG2 4.01Å; D268-R303 WeakPolarHBondContact OD1-CA 3.43Å; D268-R303 WeakPolarHBondContact OD1-CG 3.42Å; D268-R303 PolarHBondContact OD1-N 3.1Å
269	V	87.1	Confident	82.5	Confident	12 Å²	12	42.4 Å²	42.4	7%	0.073	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	134.7	177.1	-176.9	0	0	0	0	109.5	D267 V301 A302 Q304 Y307	D267-V269 PolarHBondContact O-N 2.68Å; V269-V301 CarbonylContact O-C 3.59Å; V269-V301 WeakPolarHBondContact O-CA 3.39Å; V269-V301 WeakPolarHBondContact O-CB 3.45Å; V269-A302 PolarHBondContact N-O 2.85Å; V269-A302 PolarHBondContact O-N 2.83Å; V269-Q304 HydrophobicContact CG2-CB 4.19Å; V269-Q304 HydrophobicContact CG2-CG 3.83Å; V269-Y307 HydrophobicContact CB-CD1 4.31Å; V269-Y307 HydrophobicContact CB-CD2 3.87Å; V269-Y307 HydrophobicContact CB-CE2 4.37Å; V269-Y307 HydrophobicContact CB-CG 3.84Å; V269-Y307 HydrophobicContact CG1-CD1 4Å; V269-Y307 HydrophobicContact CG1-CD2 3.63Å; V269-Y307 HydrophobicContact CG1-CE1 3.98Å; V269-Y307 HydrophobicContact CG1-CE2 3.61Å; V269-Y307 HydrophobicContact CG1-CG 3.83Å; V269-Y307 HydrophobicContact CG2-CD1 4.22Å; V269-Y307 HydrophobicContact CG2-CG 4.07Å
270	V	87	Confident	82.1	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	126.8	179.8	-170.8	0	0	0	0	110.6	L239 Q248 I250 V273 V278 M299 V301	L239-V270 HydrophobicContact CD1-CG2 3.81Å; Q248-V270 HydrophobicContact CB-CB 4.45Å; Q248-V270 HydrophobicContact CB-CG2 4.47Å; Q248-V270 PolarHBondContact O-N 2.72Å; I250-V270 HydrophobicContact CD1-CG2 3.59Å; I250-V270 HydrophobicContact CG1-CG2 4.07Å; V270-V273 HydrophobicContact CG1-CG2 3.89Å; V270-V278 HydrophobicContact CB-CG2 4.36Å; V270-V278 HydrophobicContact CG1-CG2 3.64Å; V270-M299 HydrophobicContact CB-CE 4.26Å; V270-M299 HydrophobicContact CG1-CE 3.52Å; V270-M299 HydrophobicContact CG2-CE 3.64Å; V270-V301 HydrophobicContact CG2-CG1 4.34Å
271	I	85.7	Confident	81.9	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	-52.1	-175.4	-50.5	178	0	0	0	109.8	N277 V278 E279 L300 A302 Y307 T317	I271-N277 WeakPolarHBondContact O-CA 3.44Å; I271-V278 PolarHBondContact O-N 2.76Å; I271-E279 HydrophobicContact CB-CG 4.44Å; I271-E279 HydrophobicContact CG2-CG 4.05Å; I271-L300 WeakPolarHBondContact CA-O 3.43Å; I271-L300 HydrophobicContact CB-CB 4.39Å; I271-L300 HydrophobicContact CB-CD2 4.44Å; I271-L300 HydrophobicContact CB-CG 4.4Å; I271-L300 WeakPolarHBondContact CB-O 3.19Å; I271-L300 HydrophobicContact CG2-CD2 4.23Å; I271-L300 PolarHBondContact N-O 3.39Å; I271-A302 HydrophobicContact CD1-CB 3.83Å; I271-Y307 HydrophobicContact CD1-CD2 4.14Å; I271-Y307 HydrophobicContact CG1-CD2 3.99Å; I271-Y307 HydrophobicContact CG1-CE2 4.09Å; I271-T317 HydrophobicContact CD1-CG2 3.76Å; I271-T317 HydrophobicContact CG2-CG2 4.21Å
272	E	84.9	Confident	81.8	Confident	17 Å²	17	43.7 Å²	43.7	8%	0.079	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	150.4	178.1	-53.1	179.9	158.2	0	0	111.2	E276 N277 M299 L300 P319	E272-E276 CarbonylContact C-O 3.56Å; E272-E276 WeakPolarHBondContact CA-O 3.42Å; E272-N277 HydrophobicContact CG-CB 4.43Å; E272-M299 CarbonylContact O-C 3.6Å; E272-M299 WeakPolarHBondContact O-CA 3.49Å; E272-L300 HydrophobicContact CB-CB 3.79Å; E272-L300 HydrophobicContact CG-CB 4.09Å; E272-L300 HydrophobicContact CG-CD2 4.01Å; E272-L300 PolarHBondContact N-O 3.37Å; E272-L300 PolarHBondContact O-N 2.95Å; E272-P319 WeakPolarHBondContact OE2-CD 3.07Å
273	V	85.2	Confident	81.6	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	118	168.4	-174.3	0	0	0	0	108.3	V270 G275 E276 V278 V286 I289 I290 L297 M299	V270-V273 HydrophobicContact CG1-CG2 3.89Å; V273-G275 PolarHBondContact O-N 2.85Å; V273-G275 VanDerWaalsContact O-N 3.16Å; V273-E276 PolarHBondContact N-O 2.96Å; V273-E276 WeakPolarHBondContact O-CB 3.46Å; V273-E276 PolarHBondContact O-N 2.75Å; V273-V278 HydrophobicContact CB-CG1 4.44Å; V273-V278 HydrophobicContact CG2-CG1 4.12Å; V273-V278 HydrophobicContact CG2-CG2 4.02Å; V273-V286 HydrophobicContact CG2-CG1 4.21Å; V273-I289 HydrophobicContact CB-CG2 3.92Å; V273-I289 HydrophobicContact CG1-CG2 3.73Å; V273-I290 HydrophobicContact CG1-CG1 4.01Å; V273-I290 HydrophobicContact CG2-CG1 4.46Å; V273-L297 HydrophobicContact CG1-CD1 3.66Å; V273-M299 HydrophobicContact CG1-CG 4.36Å; V273-M299 HydrophobicContact CG2-CE 4.29Å; V273-M299 HydrophobicContact CG2-CG 4.33Å
274	N	82.1	Confident	81.3	Confident	76 Å²	76	47.6 Å²	47.6	41%	0.406	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.4	33.2	-172.7	-49.1	-37	0	0	0	114.1	S293 E298	N274-S293 PolarHBondContact ND2-OG 3.14Å; N274-E298 PolarHBondContact N-O 3.02Å; N274-E298 PolarHBondContact OD1-N 2.84Å; N274-E298 PolarHBondContact OD1-O 2.98Å
275	G	69.6	Low	81.1	Confident	55 Å²	55	52.1 Å²	52.1	57%	0.567	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.2	2.5	-177	0	0	0	0	0	115.7	V273	V273-G275 PolarHBondContact O-N 2.85Å; V273-G275 VanDerWaalsContact O-N 3.16Å
276	E	76.1	Confident	80.9	Confident	110 Å²	110	47.8 Å²	47.8	51%	0.514	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	121.1	167.6	-173.5	168.6	-158.3	0	0	109.3	E272 V273 V278 I289	E272-E276 CarbonylContact C-O 3.56Å; E272-E276 WeakPolarHBondContact CA-O 3.42Å; V273-E276 PolarHBondContact N-O 2.96Å; V273-E276 WeakPolarHBondContact O-CB 3.46Å; V273-E276 PolarHBondContact O-N 2.75Å; E276-V278 PolarHBondContact O-N 3.49Å; E276-I289 HydrophobicContact CG-CD1 4.41Å; E276-I289 WeakPolarHBondContact OE2-CD1 3.19Å
277	N	79.8	Confident	81	Confident	72 Å²	72	45.2 Å²	45.2	39%	0.385	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	126.5	178.3	-178.9	-72.3	0	0	0	110.4	I271 E272 E279	I271-N277 WeakPolarHBondContact O-CA 3.44Å; E272-N277 HydrophobicContact CG-CB 4.43Å; N277-E279 PolarHBondContact ND2-OE2 2.86Å; N277-E279 WeakPolarHBondContact OD1-CB 3.39Å; N277-E279 PolarHBondContact OD1-N 2.87Å; N277-E279 PolarHBondContact OD1-OE2 3.18Å
278	V	83.2	Confident	80.9	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.25	C	C	.	.			trans	-115.4	9.2	-173.5	-66.3	0	0	0	0	113.7	V270 I271 V273 E276 Q280 S281 V286 I289	V270-V278 HydrophobicContact CB-CG2 4.36Å; V270-V278 HydrophobicContact CG1-CG2 3.64Å; I271-V278 PolarHBondContact O-N 2.76Å; V273-V278 HydrophobicContact CB-CG1 4.44Å; V273-V278 HydrophobicContact CG2-CG1 4.12Å; V273-V278 HydrophobicContact CG2-CG2 4.02Å; E276-V278 PolarHBondContact O-N 3.49Å; V278-Q280 PolarHBondContact O-N 2.94Å; V278-S281 PolarHBondContact O-N 2.93Å; V278-V286 HydrophobicContact CB-CG1 4.41Å; V278-V286 HydrophobicContact CB-CG2 3.72Å; V278-V286 HydrophobicContact CG1-CG1 4.39Å; V278-V286 HydrophobicContact CG1-CG2 4.02Å; V278-V286 HydrophobicContact CG2-CG1 4.34Å; V278-V286 HydrophobicContact CG2-CG2 4.35Å; V278-I289 HydrophobicContact CG1-CD1 3.79Å
279	E	79.5	Confident	80.8	Confident	14 Å²	14	45.1 Å²	45.1	7%	0.065	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-15.9	-174.3	-60.3	178	111.9	0	0	113.5	G247 I271 N277 Y307 K311	G247-E279 PolarHBondContact N-O 2.89Å; I271-E279 HydrophobicContact CB-CG 4.44Å; I271-E279 HydrophobicContact CG2-CG 4.05Å; N277-E279 PolarHBondContact ND2-OE2 2.86Å; N277-E279 WeakPolarHBondContact OD1-CB 3.39Å; N277-E279 PolarHBondContact OD1-N 2.87Å; N277-E279 PolarHBondContact OD1-OE2 3.18Å; E279-Y307 HydrophobicContact CG-CE2 4.4Å; E279-Y307 WeakPolarHBondContact OE1-CE2 3.41Å; E279-Y307 PolarHBondContact OE1-OH 3.45Å; E279-K311 WeakPolarHBondContact OE1-CE 3.39Å; E279-K311 IonicContact OE1-NZ 3.44Å; E279-K311 PolarHBondContact OE1-NZ 3.33Å; E279-K311 IonicContact OE2-NZ 3.31Å; E279-K311 PolarHBondContact OE2-NZ 3.03Å
280	Q	77	Confident	80.7	Confident	132 Å²	132	45.5 Å²	45.5	62%	0.617	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.5	3.9	177.3	-57.1	-67.5	-96.5	0	0	112.8	V278	V278-Q280 PolarHBondContact O-N 2.94Å
281	S	76.8	Confident	80.5	Confident	25 Å²	25	54.2 Å²	54.2	18%	0.175	29%	0.289	C	S	.	.			trans	-82.8	146.8	-179.2	-58.1	0	0	0	0	112	Q248 V278	Q248-S281 PolarHBondContact NE2-O 3.47Å; V278-S281 PolarHBondContact O-N 2.93Å
282	T	77.9	Confident	80.3	Confident	79 Å²	79	64 Å²	64	49%	0.485	33%	0.325	S	S	.	.			trans	-67.7	155.9	171.2	66.9	0	0	0	0	111	A284 E285 V286	T282-A284 PolarHBondContact O-N 3.44Å; T282-E285 VanDerWaalsContact CB-OE2 3.3Å; T282-E285 WeakPolarHBondContact CB-OE2 3.46Å; T282-E285 WeakPolarHBondContact CG2-OE2 3.34Å; T282-E285 PolarHBondContact N-OE2 2.87Å; T282-E285 PolarHBondContact O-N 3.04Å; T282-E285 VanDerWaalsContact OG1-CD 3.23Å; T282-E285 WeakPolarHBondContact OG1-CG 3.34Å; T282-E285 PolarHBondContact OG1-N 3.16Å; T282-E285 PolarHBondContact OG1-OE2 3.46Å; T282-V286 PolarHBondContact O-N 2.86Å; T282-V286 VanDerWaalsContact O-N 3.16Å
283	H	77	Confident	80	Confident	81 Å²	81	64.3 Å²	64.3	38%	0.375	33%	0.329	S	S	.	.	H	α-helix	trans	-53	-41.1	177.8	-177.9	79.3	0	0	0	112.7	L239 Q248 E285 V286 V287	L239-H283 PolarHBondContact O-CE1 3.02Å; Q248-H283 PolarHBondContact OE1-ND1 2.99Å; H283-E285 PolarHBondContact O-N 3.45Å; H283-V286 PolarHBondContact O-N 3.04Å; H283-V287 WeakPolarHBondContact O-CB 3.47Å; H283-V287 VanDerWaalsContact O-CG2 3.29Å; H283-V287 WeakPolarHBondContact O-CG2 3.38Å; H283-V287 PolarHBondContact O-N 3.19Å
284	A	76.9	Confident	79.8	Confident	60 Å²	60	65.8 Å²	65.8	50%	0.496	35%	0.345	S	S	.	.	H	α-helix	trans	-64	-37.6	178.6	0	0	0	0	0	113	T282 N288	T282-A284 PolarHBondContact O-N 3.44Å; A284-N288 WeakPolarHBondContact O-CB 3.33Å; A284-N288 PolarHBondContact O-N 3.16Å; A284-N288 PolarHBondContact O-ND2 2.9Å
285	E	80.9	Confident	79.6	Confident	97 Å²	97	67.6 Å²	67.6	45%	0.453	36%	0.355	S	S	.	.	H	α-helix	trans	-68	-46.5	177.2	-71.3	160.7	138.7	0	0	111.2	T282 H283 V287 N288 I289	T282-E285 VanDerWaalsContact CB-OE2 3.3Å; T282-E285 WeakPolarHBondContact CB-OE2 3.46Å; T282-E285 WeakPolarHBondContact CG2-OE2 3.34Å; T282-E285 PolarHBondContact N-OE2 2.87Å; T282-E285 PolarHBondContact O-N 3.04Å; T282-E285 VanDerWaalsContact OG1-CD 3.23Å; T282-E285 WeakPolarHBondContact OG1-CG 3.34Å; T282-E285 PolarHBondContact OG1-N 3.16Å; T282-E285 PolarHBondContact OG1-OE2 3.46Å; H283-E285 PolarHBondContact O-N 3.45Å; E285-V287 PolarHBondContact O-N 3.04Å; E285-N288 CarbonylContact O-C 3.6Å; E285-N288 WeakPolarHBondContact O-CA 3.44Å; E285-N288 WeakPolarHBondContact O-CB 3.46Å; E285-N288 PolarHBondContact O-N 3.13Å; E285-I289 WeakPolarHBondContact O-CG1 3.29Å; E285-I289 PolarHBondContact O-N 2.81Å
286	V	82.5	Confident	80.2	Confident	0 Å²	0	68 Å²	68	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-63.6	-42.1	178.5	-171.5	0	0	0	0	111.5	L239 Q248 V273 V278 T282 H283 N288 I289 I290	L239-V286 HydrophobicContact CD2-CB 3.97Å; L239-V286 HydrophobicContact CD2-CG1 3.7Å; Q248-V286 HydrophobicContact CG-CB 4.1Å; Q248-V286 HydrophobicContact CG-CG1 4.28Å; Q248-V286 HydrophobicContact CG-CG2 3.73Å; V273-V286 HydrophobicContact CG2-CG1 4.21Å; V278-V286 HydrophobicContact CB-CG1 4.41Å; V278-V286 HydrophobicContact CB-CG2 3.72Å; V278-V286 HydrophobicContact CG1-CG1 4.39Å; V278-V286 HydrophobicContact CG1-CG2 4.02Å; V278-V286 HydrophobicContact CG2-CG1 4.34Å; V278-V286 HydrophobicContact CG2-CG2 4.35Å; T282-V286 PolarHBondContact O-N 2.86Å; T282-V286 VanDerWaalsContact O-N 3.16Å; H283-V286 PolarHBondContact O-N 3.04Å; V286-N288 VanDerWaalsContact C-N 3.27Å; V286-N288 PolarHBondContact O-N 3.49Å; V286-I289 PolarHBondContact O-N 2.84Å; V286-I290 HydrophobicContact CG1-CD1 4.01Å; V286-I290 WeakPolarHBondContact O-CG1 3.39Å; V286-I290 PolarHBondContact O-N 3.3Å
287	V	83.4	Confident	80.7	Confident	30 Å²	30	62.7 Å²	62.7	18%	0.182	32%	0.321	C	S	.	.	H	α-helix	trans	-59.6	-37.8	172.1	168.6	0	0	0	0	111.6	L239 H283 E285 R291	L239-V287 HydrophobicContact CD2-CG2 3.93Å; H283-V287 WeakPolarHBondContact O-CB 3.47Å; H283-V287 VanDerWaalsContact O-CG2 3.29Å; H283-V287 WeakPolarHBondContact O-CG2 3.38Å; H283-V287 PolarHBondContact O-N 3.19Å; E285-V287 PolarHBondContact O-N 3.04Å; V287-R291 HydrophobicContact CG1-CG 4.44Å; V287-R291 WeakPolarHBondContact O-CB 3.34Å; V287-R291 WeakPolarHBondContact O-CG 3.47Å; V287-R291 PolarHBondContact O-N 3.03Å
288	N	80.8	Confident	80.9	Confident	70 Å²	70	62.4 Å²	62.4	37%	0.374	32%	0.318	S	S	.	.	H	α-helix	trans	-70.1	-38.7	176.7	-76.7	-35.2	0	0	0	112.9	A284 E285 V286 R291 R292	A284-N288 WeakPolarHBondContact O-CB 3.33Å; A284-N288 PolarHBondContact O-N 3.16Å; A284-N288 PolarHBondContact O-ND2 2.9Å; E285-N288 CarbonylContact O-C 3.6Å; E285-N288 WeakPolarHBondContact O-CA 3.44Å; E285-N288 WeakPolarHBondContact O-CB 3.46Å; E285-N288 PolarHBondContact O-N 3.13Å; V286-N288 VanDerWaalsContact C-N 3.27Å; V286-N288 PolarHBondContact O-N 3.49Å; N288-R291 PolarHBondContact O-N 3.14Å; N288-R292 WeakPolarHBondContact O-CB 3.22Å; N288-R292 WeakPolarHBondContact O-CD 3.5Å; N288-R292 WeakPolarHBondContact O-CG 3.44Å; N288-R292 PolarHBondContact O-N 3.33Å
289	I	83.1	Confident	81.1	Confident	18 Å²	18	62.4 Å²	62.4	9%	0.092	32%	0.318	C	S	.	.	H	α-helix	trans	-63.3	-48.5	174.6	-62.8	161.4	0	0	0	110.1	V273 E276 V278 E285 V286 R291 R292 S293	V273-I289 HydrophobicContact CB-CG2 3.92Å; V273-I289 HydrophobicContact CG1-CG2 3.73Å; E276-I289 HydrophobicContact CG-CD1 4.41Å; E276-I289 WeakPolarHBondContact OE2-CD1 3.19Å; V278-I289 HydrophobicContact CG1-CD1 3.79Å; E285-I289 WeakPolarHBondContact O-CG1 3.29Å; E285-I289 PolarHBondContact O-N 2.81Å; V286-I289 PolarHBondContact O-N 2.84Å; I289-R291 VanDerWaalsContact C-N 3.32Å; I289-R291 PolarHBondContact O-N 2.88Å; I289-R292 PolarHBondContact O-N 3.17Å; I289-S293 PolarHBondContact O-N 2.81Å; I289-S293 VanDerWaalsContact O-N 3.1Å; I289-S293 PolarHBondContact O-OG 3.38Å
290	I	85.7	Confident	81.3	Confident	20 Å²	20	61.9 Å²	61.9	10%	0.103	32%	0.315	C	S	.	.	H	α-helix	trans	-59.3	-41.9	176.3	-66.5	167	0	0	0	111.2	Y235 F237 L239 V273 V286 S293 L297 M299	Y235-I290 HydrophobicContact CD2-CG2 4.46Å; Y235-I290 HydrophobicContact CE2-CG2 4.21Å; F237-I290 HydrophobicContact CZ-CD1 4.31Å; L239-I290 HydrophobicContact CD2-CD1 4.07Å; V273-I290 HydrophobicContact CG1-CG1 4.01Å; V273-I290 HydrophobicContact CG2-CG1 4.46Å; V286-I290 HydrophobicContact CG1-CD1 4.01Å; V286-I290 WeakPolarHBondContact O-CG1 3.39Å; V286-I290 PolarHBondContact O-N 3.3Å; I290-S293 VanDerWaalsContact O-CB 3.27Å; I290-S293 WeakPolarHBondContact O-CB 3.34Å; I290-S293 PolarHBondContact O-N 3.42Å; I290-S293 PolarHBondContact O-OG 2.93Å; I290-L297 HydrophobicContact CB-CD1 4.5Å; I290-L297 HydrophobicContact CG1-CD1 4.23Å; I290-L297 HydrophobicContact CG2-CD1 4.34Å; I290-L297 HydrophobicContact CG2-CD2 3.98Å; I290-M299 HydrophobicContact CD1-CE 4.44Å
291	R	82.8	Confident	81.7	Confident	183 Å²	183	55.6 Å²	55.6	69%	0.691	29%	0.286	S	S	*	.	H	α-helix	trans	-65.6	-38.1	176.6	-76.2	171.4	179.6	-175	1.1	113	V287 N288 I289 S293	V287-R291 HydrophobicContact CG1-CG 4.44Å; V287-R291 WeakPolarHBondContact O-CB 3.34Å; V287-R291 WeakPolarHBondContact O-CG 3.47Å; V287-R291 PolarHBondContact O-N 3.03Å; N288-R291 PolarHBondContact O-N 3.14Å; I289-R291 VanDerWaalsContact C-N 3.32Å; I289-R291 PolarHBondContact O-N 2.88Å; R291-S293 VanDerWaalsContact C-N 3.25Å; R291-S293 PolarHBondContact O-N 3.36Å
292	R	81.9	Confident	82	Confident	204 Å²	204	54.4 Å²	54.4	77%	0.77	28%	0.277	S	S	*	.	H	α-helix	trans	-69	-20.2	175.7	-72.8	167.3	-177.2	174.4	1.6	113.5	N288 I289 G294	N288-R292 WeakPolarHBondContact O-CB 3.22Å; N288-R292 WeakPolarHBondContact O-CD 3.5Å; N288-R292 WeakPolarHBondContact O-CG 3.44Å; N288-R292 PolarHBondContact O-N 3.33Å; I289-R292 PolarHBondContact O-N 3.17Å; R292-G294 PolarHBondContact O-N 2.77Å
293	S	78.6	Confident	82.3	Confident	24 Å²	24	53.5 Å²	53.5	17%	0.168	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-14.8	179.6	-51.3	0	0	0	0	113.7	N274 I289 I290 R291 N295 T296 L297	N274-S293 PolarHBondContact ND2-OG 3.14Å; I289-S293 PolarHBondContact O-N 2.81Å; I289-S293 VanDerWaalsContact O-N 3.1Å; I289-S293 PolarHBondContact O-OG 3.38Å; I290-S293 VanDerWaalsContact O-CB 3.27Å; I290-S293 WeakPolarHBondContact O-CB 3.34Å; I290-S293 PolarHBondContact O-N 3.42Å; I290-S293 PolarHBondContact O-OG 2.93Å; R291-S293 VanDerWaalsContact C-N 3.25Å; R291-S293 PolarHBondContact O-N 3.36Å; S293-N295 PolarHBondContact O-N 2.96Å; S293-N295 VanDerWaalsContact O-N 3.11Å; S293-T296 WeakPolarHBondContact CB-O 3.47Å; S293-T296 VanDerWaalsContact O-O 3.08Å; S293-L297 WeakPolarHBondContact OG-CD1 3.32Å
294	G	79.6	Confident	82.2	Confident	32 Å²	32	53.6 Å²	53.6	33%	0.33	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.1	-101	172.5	0	0	0	0	0	112.9	K230 Y235 R292	K230-G294 WeakPolarHBondContact CD-O 3.21Å; K230-G294 PolarHBondContact NZ-O 3.47Å; Y235-G294 PolarHBondContact OH-O 3.04Å; R292-G294 PolarHBondContact O-N 2.77Å
295	N	79.1	Confident	82	Confident	114 Å²	114	54.2 Å²	54.2	61%	0.61	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.9	-15.7	-175.7	-75.7	-4.2	0	0	0	114.6	E229 K230 S293	E229-N295 CarbonylContact C-O 3.6Å; E229-N295 WeakPolarHBondContact CA-O 3.04Å; K230-N295 HydrophobicContact CB-CB 4.49Å; K230-N295 WeakPolarHBondContact CB-O 3.42Å; K230-N295 PolarHBondContact N-O 2.96Å; S293-N295 PolarHBondContact O-N 2.96Å; S293-N295 VanDerWaalsContact O-N 3.11Å
296	T	82.1	Confident	81.8	Confident	62 Å²	62	49.7 Å²	49.7	38%	0.38	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	136.8	178.6	-49.9	0	0	0	0	107.7	S293	S293-T296 WeakPolarHBondContact CB-O 3.47Å; S293-T296 VanDerWaalsContact O-O 3.08Å
297	L	85.8	Confident	81.4	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	129.8	-179.1	-176.5	67.1	0	0	0	109.1	R227 M228 Y235 F237 V273 I290 S293 M299	R227-L297 WeakPolarHBondContact CA-O 3.34Å; M228-L297 HydrophobicContact CE-CD2 4.27Å; M228-L297 HydrophobicContact CE-CG 4.43Å; M228-L297 HydrophobicContact CG-CB 3.97Å; M228-L297 PolarHBondContact N-O 3Å; M228-L297 PolarHBondContact O-N 3.37Å; M228-L297 HydrophobicContact SD-CB 4.49Å; M228-L297 HydrophobicContact SD-CD2 4.03Å; Y235-L297 HydrophobicContact CD1-CB 4.32Å; Y235-L297 HydrophobicContact CD1-CD2 4.38Å; Y235-L297 HydrophobicContact CD2-CD2 3.88Å; Y235-L297 HydrophobicContact CE1-CB 3.69Å; Y235-L297 HydrophobicContact CE1-CD2 4.35Å; Y235-L297 HydrophobicContact CE2-CB 4.29Å; Y235-L297 HydrophobicContact CE2-CD2 3.85Å; Y235-L297 HydrophobicContact CG-CD2 4.15Å; F237-L297 HydrophobicContact CE1-CD2 3.88Å; F237-L297 HydrophobicContact CZ-CD2 3.99Å; V273-L297 HydrophobicContact CG1-CD1 3.66Å; I290-L297 HydrophobicContact CB-CD1 4.5Å; I290-L297 HydrophobicContact CG1-CD1 4.23Å; I290-L297 HydrophobicContact CG2-CD1 4.34Å; I290-L297 HydrophobicContact CG2-CD2 3.98Å; S293-L297 WeakPolarHBondContact OG-CD1 3.32Å; L297-M299 HydrophobicContact CD1-CG 4.29Å; L297-M299 HydrophobicContact CD2-CG 4.23Å; L297-M299 HydrophobicContact CD2-SD 3.64Å; L297-M299 HydrophobicContact CG-CG 3.95Å; L297-M299 HydrophobicContact CG-SD 4.05Å
298	E	84.6	Confident	81	Confident	66 Å²	66	55.4 Å²	55.4	31%	0.308	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	124.3	175	-172.6	165.4	97.2	0	0	108.1	L225 R227 N274	L225-E298 HydrophobicContact CD1-CG 3.69Å; L225-E298 HydrophobicContact CG-CG 4.13Å; R227-E298 HydrophobicContact CB-CG 4.32Å; R227-E298 WeakPolarHBondContact CD-OE2 3.46Å; N274-E298 PolarHBondContact N-O 3.02Å; N274-E298 PolarHBondContact OD1-N 2.84Å; N274-E298 PolarHBondContact OD1-O 2.98Å
299	M	86.3	Confident	80.4	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	129.3	-177.2	-65.1	176.8	69.2	0	0	110.3	C226 M228 F237 I250 M264 V270 E272 V273 I290 L297 V301	C226-M299 PolarHBondContact N-O 2.94Å; C226-M299 PolarHBondContact O-N 3.26Å; M228-M299 HydrophobicContact CE-CG 4.47Å; M228-M299 HydrophobicContact CE-SD 4.22Å; F237-M299 HydrophobicContact CE1-SD 4.24Å; F237-M299 HydrophobicContact CE2-CE 4.41Å; F237-M299 HydrophobicContact CE2-SD 4.4Å; F237-M299 HydrophobicContact CZ-CE 4.28Å; F237-M299 HydrophobicContact CZ-SD 3.73Å; I250-M299 HydrophobicContact CD1-CE 4.03Å; M264-M299 HydrophobicContact CE-CE 4.38Å; M264-M299 HydrophobicContact CE-SD 4.13Å; V270-M299 HydrophobicContact CB-CE 4.26Å; V270-M299 HydrophobicContact CG1-CE 3.52Å; V270-M299 HydrophobicContact CG2-CE 3.64Å; E272-M299 CarbonylContact O-C 3.6Å; E272-M299 WeakPolarHBondContact O-CA 3.49Å; V273-M299 HydrophobicContact CG1-CG 4.36Å; V273-M299 HydrophobicContact CG2-CE 4.29Å; V273-M299 HydrophobicContact CG2-CG 4.33Å; I290-M299 HydrophobicContact CD1-CE 4.44Å; L297-M299 HydrophobicContact CD1-CG 4.29Å; L297-M299 HydrophobicContact CD2-CG 4.23Å; L297-M299 HydrophobicContact CD2-SD 3.64Å; L297-M299 HydrophobicContact CG-CG 3.95Å; L297-M299 HydrophobicContact CG-SD 4.05Å; M299-V301 HydrophobicContact CB-CG1 4Å; M299-V301 HydrophobicContact CE-CG1 4.43Å
300	L	84	Confident	79.6	Confident	2 Å²	2	56.7 Å²	56.7	1%	0.01	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	115.7	165.6	-167.4	67.5	0	0	0	107.3	P223 K224 L225 I271 E272 T317	P223-L300 HydrophobicContact CB-CD1 3.82Å; P223-L300 HydrophobicContact CB-CG 4.19Å; K224-L300 WeakPolarHBondContact O-CA 3.28Å; L225-L300 HydrophobicContact CB-CD1 4.31Å; L225-L300 HydrophobicContact CD1-CB 4.43Å; L225-L300 HydrophobicContact CD1-CD1 4.24Å; I271-L300 WeakPolarHBondContact CA-O 3.43Å; I271-L300 HydrophobicContact CB-CB 4.39Å; I271-L300 HydrophobicContact CB-CD2 4.44Å; I271-L300 HydrophobicContact CB-CG 4.4Å; I271-L300 WeakPolarHBondContact CB-O 3.19Å; I271-L300 HydrophobicContact CG2-CD2 4.23Å; I271-L300 PolarHBondContact N-O 3.39Å; E272-L300 HydrophobicContact CB-CB 3.79Å; E272-L300 HydrophobicContact CG-CB 4.09Å; E272-L300 HydrophobicContact CG-CD2 4.01Å; E272-L300 PolarHBondContact N-O 3.37Å; E272-L300 PolarHBondContact O-N 2.95Å; L300-T317 HydrophobicContact CD2-CG2 4.22Å
301	V	86.3	Confident	78.7	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	159.6	179.2	-52.6	0	0	0	0	110.7	P223 K224 D268 V269 V270 M299	P223-V301 CarbonylContact C-O 3.56Å; P223-V301 VanDerWaalsContact CA-O 3.27Å; P223-V301 WeakPolarHBondContact CA-O 3.49Å; K224-V301 HydrophobicContact CB-CG2 3.97Å; K224-V301 HydrophobicContact CD-CG2 4.23Å; K224-V301 PolarHBondContact N-O 2.96Å; K224-V301 PolarHBondContact O-N 3.32Å; D268-V301 HydrophobicContact CB-CB 4.12Å; D268-V301 HydrophobicContact CB-CG2 4.01Å; V269-V301 CarbonylContact O-C 3.59Å; V269-V301 WeakPolarHBondContact O-CA 3.39Å; V269-V301 WeakPolarHBondContact O-CB 3.45Å; V270-V301 HydrophobicContact CG2-CG1 4.34Å; M299-V301 HydrophobicContact CB-CG1 4Å; M299-V301 HydrophobicContact CE-CG1 4.43Å
302	A	83.6	Confident	77.5	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	143.6	170.5	0	0	0	0	0	111.3	P223 V269 I271 V306	P223-A302 HydrophobicContact CB-CB 4.33Å; V269-A302 PolarHBondContact N-O 2.85Å; V269-A302 PolarHBondContact O-N 2.83Å; I271-A302 HydrophobicContact CD1-CB 3.83Å; A302-V306 HydrophobicContact CB-CB 4.31Å; A302-V306 HydrophobicContact CB-CG1 4.15Å
303	R	82.6	Confident	76.1	Confident	60 Å²	60	50.7 Å²	50.7	23%	0.226	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.3	144.7	173.8	-62.4	-167.1	-54.5	-172.4	0.8	110.3	E220 D268 D305 V306 Y307	E220-R303 PolarHBondContact O-NH2 2.81Å; E220-R303 IonicContact OE2-CZ 2.66Å; E220-R303 IonicContact OE2-NH1 2.77Å; E220-R303 PolarHBondContact OE2-NH1 3.36Å; E220-R303 IonicContact OE2-NH2 3.09Å; E220-R303 PolarHBondContact OE2-NH2 2.67Å; D268-R303 WeakPolarHBondContact OD1-CA 3.43Å; D268-R303 WeakPolarHBondContact OD1-CG 3.42Å; D268-R303 PolarHBondContact OD1-N 3.1Å; R303-D305 WeakPolarHBondContact CB-OD1 3.41Å; R303-D305 IonicContact NE-OD1 2.68Å; R303-D305 PolarHBondContact O-N 2.82Å; R303-V306 HydrophobicContact CB-CG2 4.31Å; R303-V306 PolarHBondContact O-N 3.17Å; R303-Y307 PolarHBondContact O-N 3.17Å
304	Q	75.3	Confident	74.4	Confident	84 Å²	84	52.7 Å²	52.7	39%	0.393	30%	0.299	S	S	.	.	H	α-helix	trans	-57.5	-26.9	-168.6	-152.4	-163.8	76.2	0	0	114.5	D267 V269 K308	D267-Q304 PolarHBondContact O-N 3.3Å; V269-Q304 HydrophobicContact CG2-CB 4.19Å; V269-Q304 HydrophobicContact CG2-CG 3.83Å; Q304-K308 VanDerWaalsContact O-CD 3.28Å; Q304-K308 WeakPolarHBondContact O-CD 3.41Å; Q304-K308 WeakPolarHBondContact O-CG 3.18Å; Q304-K308 PolarHBondContact O-N 2.77Å
305	D	73.8	Confident	73.1	Confident	72 Å²	72	54.5 Å²	54.5	39%	0.385	30%	0.303	S	S	.	.	H	α-helix	trans	-75	-44.3	173.4	65.2	-39.8	0	0	0	112.7	R303 K308 Q309	R303-D305 WeakPolarHBondContact CB-OD1 3.41Å; R303-D305 IonicContact NE-OD1 2.68Å; R303-D305 PolarHBondContact O-N 2.82Å; D305-K308 PolarHBondContact O-N 3.38Å; D305-Q309 WeakPolarHBondContact O-CG 3.29Å; D305-Q309 PolarHBondContact O-N 3.14Å; D305-Q309 VanDerWaalsContact O-N 3.11Å; D305-Q309 PolarHBondContact O-NE2 3.15Å
306	V	75.1	Confident	71.7	Confident	3 Å²	3	57.7 Å²	57.7	2%	0.018	31%	0.312	C	S	.	.	H	α-helix	trans	-64.6	-42.4	175.2	179.8	0	0	0	0	110.5	E220 L221 A302 R303 K308 Q309 L310	E220-V306 WeakPolarHBondContact O-CG2 3.01Å; L221-V306 HydrophobicContact CD2-CG2 4.2Å; A302-V306 HydrophobicContact CB-CB 4.31Å; A302-V306 HydrophobicContact CB-CG1 4.15Å; R303-V306 HydrophobicContact CB-CG2 4.31Å; R303-V306 PolarHBondContact O-N 3.17Å; V306-K308 PolarHBondContact O-N 3.43Å; V306-Q309 PolarHBondContact O-N 3.02Å; V306-L310 HydrophobicContact CG1-CD1 3.85Å; V306-L310 HydrophobicContact CG1-CG 4.45Å; V306-L310 WeakPolarHBondContact O-CG 3.27Å; V306-L310 PolarHBondContact O-N 3.13Å
307	Y	75.7	Confident	70.2	Confident	32 Å²	32	55.1 Å²	55.1	13%	0.125	30%	0.296	C	S	.	.	H	α-helix	trans	-57.2	-46.4	174.5	-179.2	-96.9	0	0	0	112	V269 I271 E279 R303 Q309 L310 K311	V269-Y307 HydrophobicContact CB-CD1 4.31Å; V269-Y307 HydrophobicContact CB-CD2 3.87Å; V269-Y307 HydrophobicContact CB-CE2 4.37Å; V269-Y307 HydrophobicContact CB-CG 3.84Å; V269-Y307 HydrophobicContact CG1-CD1 4Å; V269-Y307 HydrophobicContact CG1-CD2 3.63Å; V269-Y307 HydrophobicContact CG1-CE1 3.98Å; V269-Y307 HydrophobicContact CG1-CE2 3.61Å; V269-Y307 HydrophobicContact CG1-CG 3.83Å; V269-Y307 HydrophobicContact CG2-CD1 4.22Å; V269-Y307 HydrophobicContact CG2-CG 4.07Å; I271-Y307 HydrophobicContact CD1-CD2 4.14Å; I271-Y307 HydrophobicContact CG1-CD2 3.99Å; I271-Y307 HydrophobicContact CG1-CE2 4.09Å; E279-Y307 HydrophobicContact CG-CE2 4.4Å; E279-Y307 WeakPolarHBondContact OE1-CE2 3.41Å; E279-Y307 PolarHBondContact OE1-OH 3.45Å; R303-Y307 PolarHBondContact O-N 3.17Å; Y307-Q309 PolarHBondContact O-N 2.71Å; Y307-L310 PolarHBondContact O-N 3.42Å; Y307-K311 HydrophobicContact CD1-CG 4.35Å; Y307-K311 HydrophobicContact CE1-CG 3.94Å; Y307-K311 HydrophobicContact CE2-CG 4.47Å; Y307-K311 PolarHBondContact O-N 3.47Å; Y307-K311 VanDerWaalsContact OH-CE 3.22Å; Y307-K311 WeakPolarHBondContact OH-CE 3.33Å
308	K	75.4	Confident	68.7	Low	117 Å²	117	57.4 Å²	57.4	51%	0.509	31%	0.31	S	S	.	.	H	α-helix	trans	-61.8	-41.4	176.6	-73.4	165	-169.7	168.1	0	112.1	Q304 D305 V306 K311 A312	Q304-K308 VanDerWaalsContact O-CD 3.28Å; Q304-K308 WeakPolarHBondContact O-CD 3.41Å; Q304-K308 WeakPolarHBondContact O-CG 3.18Å; Q304-K308 PolarHBondContact O-N 2.77Å; D305-K308 PolarHBondContact O-N 3.38Å; V306-K308 PolarHBondContact O-N 3.43Å; K308-K311 PolarHBondContact O-N 3.33Å; K308-A312 VanDerWaalsContact O-CB 3.3Å; K308-A312 WeakPolarHBondContact O-CB 3.49Å; K308-A312 PolarHBondContact O-N 2.99Å
309	Q	67.3	Low	67	Low	90 Å²	90	57 Å²	57	42%	0.421	31%	0.313	S	S	.	.	H	α-helix	trans	-64.6	-40.8	176.3	-71	166.4	69.9	0	0	112.6	D305 V306 Y307 A312 T313	D305-Q309 WeakPolarHBondContact O-CG 3.29Å; D305-Q309 PolarHBondContact O-N 3.14Å; D305-Q309 VanDerWaalsContact O-N 3.11Å; D305-Q309 PolarHBondContact O-NE2 3.15Å; V306-Q309 PolarHBondContact O-N 3.02Å; Y307-Q309 PolarHBondContact O-N 2.71Å; Q309-A312 PolarHBondContact O-N 2.87Å; Q309-T313 WeakPolarHBondContact O-CG2 3.49Å; Q309-T313 PolarHBondContact O-N 3.41Å; Q309-T313 PolarHBondContact O-OG1 3.18Å
310	L	66	Low	65	Low	25 Å²	25	64.7 Å²	64.7	13%	0.131	35%	0.353	C	S	.	.	H	α-helix	trans	-68	-41	177.4	-70	164.7	0	0	0	111.9	P223 V306 Y307 T313 G314 T317 L321	P223-L310 HydrophobicContact CG-CD1 3.57Å; V306-L310 HydrophobicContact CG1-CD1 3.85Å; V306-L310 HydrophobicContact CG1-CG 4.45Å; V306-L310 WeakPolarHBondContact O-CG 3.27Å; V306-L310 PolarHBondContact O-N 3.13Å; Y307-L310 PolarHBondContact O-N 3.42Å; L310-T313 WeakPolarHBondContact CA-OG1 3.44Å; L310-T313 PolarHBondContact O-N 3.36Å; L310-T313 PolarHBondContact O-OG1 3.4Å; L310-T313 VanDerWaalsContact O-OG1 3.11Å; L310-G314 PolarHBondContact O-N 2.87Å; L310-T317 HydrophobicContact CD1-CG2 3.97Å; L310-L321 HydrophobicContact CD2-CD1 4.28Å
311	K	66.4	Low	63.3	Low	95 Å²	95	68 Å²	68	41%	0.413	37%	0.37	S	S	.	.	H	α-helix	trans	-63.3	-42.4	171.7	-72.3	-52.5	-157.7	-169.2	0	112.5	E279 Y307 K308 T313 G314	E279-K311 WeakPolarHBondContact OE1-CE 3.39Å; E279-K311 IonicContact OE1-NZ 3.44Å; E279-K311 PolarHBondContact OE1-NZ 3.33Å; E279-K311 IonicContact OE2-NZ 3.31Å; E279-K311 PolarHBondContact OE2-NZ 3.03Å; Y307-K311 HydrophobicContact CD1-CG 4.35Å; Y307-K311 HydrophobicContact CE1-CG 3.94Å; Y307-K311 HydrophobicContact CE2-CG 4.47Å; Y307-K311 PolarHBondContact O-N 3.47Å; Y307-K311 VanDerWaalsContact OH-CE 3.22Å; Y307-K311 WeakPolarHBondContact OH-CE 3.33Å; K308-K311 PolarHBondContact O-N 3.33Å; K311-T313 VanDerWaalsContact C-N 3.3Å; K311-T313 PolarHBondContact O-N 3.28Å; K311-G314 PolarHBondContact O-N 2.97Å
312	A	58.9	Low	61.5	Low	90 Å²	90	71.1 Å²	71.1	74%	0.744	39%	0.387	S	S	*	.	H	α-helix	trans	-65.7	-29.7	178.8	0	0	0	0	0	113.4	K308 Q309	K308-A312 VanDerWaalsContact O-CB 3.3Å; K308-A312 WeakPolarHBondContact O-CB 3.49Å; K308-A312 PolarHBondContact O-N 2.99Å; Q309-A312 PolarHBondContact O-N 2.87Å
313	T	50.9	Low	59.2	Low	96 Å²	96	73.3 Å²	73.3	59%	0.589	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-5	177.8	48.8	0	0	0	0	114.1	Q309 L310 K311 V315	Q309-T313 WeakPolarHBondContact O-CG2 3.49Å; Q309-T313 PolarHBondContact O-N 3.41Å; Q309-T313 PolarHBondContact O-OG1 3.18Å; L310-T313 WeakPolarHBondContact CA-OG1 3.44Å; L310-T313 PolarHBondContact O-N 3.36Å; L310-T313 PolarHBondContact O-OG1 3.4Å; L310-T313 VanDerWaalsContact O-OG1 3.11Å; K311-T313 VanDerWaalsContact C-N 3.3Å; K311-T313 PolarHBondContact O-N 3.28Å; T313-V315 PolarHBondContact O-N 2.73Å; T313-V315 VanDerWaalsContact O-N 3.14Å
314	G	43.8	Very low	57	Low	66 Å²	66	79.9 Å²	79.9	68%	0.68	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	67	10.7	175.1	0	0	0	0	0	115.1	L310 K311	L310-G314 PolarHBondContact O-N 2.87Å; K311-G314 PolarHBondContact O-N 2.97Å
315	V	51.4	Low	54.8	Low	70 Å²	70	82.2 Å²	82.2	42%	0.424	46%	0.463	S	S	.	.			trans	-73.4	136.4	179.1	-176.9	0	0	0	0	109.2	T313 T317 L321	T313-V315 PolarHBondContact O-N 2.73Å; T313-V315 VanDerWaalsContact O-N 3.14Å; V315-T317 PolarHBondContact O-N 3.44Å; V315-L321 HydrophobicContact CG1-CD1 4.04Å; V315-L321 HydrophobicContact CG1-CD2 4.17Å
316	K	50.1	Low	52.7	Low	182 Å²	182	89 Å²	89	79%	0.791	49%	0.49	S	S	*	.			trans	-69.8	96.5	169.5	-75.6	-167.8	174.4	-171.1	0	109.6	T318	K316-T318 PolarHBondContact O-N 2.73Å; K316-T318 PolarHBondContact O-OG1 2.91Å; K316-T318 VanDerWaalsContact O-OG1 3.13Å
317	T	51.3	Low	50.5	Low	8 Å²	8	99.2 Å²	99.2	5%	0.049	53%	0.534	C	S	.	.			trans	-58.3	109.8	174.6	-36.7	0	0	0	0	109.4	P223 I271 L300 L310 V315 L321	P223-T317 HydrophobicContact CB-CG2 4.4Å; P223-T317 HydrophobicContact CG-CG2 3.63Å; I271-T317 HydrophobicContact CD1-CG2 3.76Å; I271-T317 HydrophobicContact CG2-CG2 4.21Å; L300-T317 HydrophobicContact CD2-CG2 4.22Å; L310-T317 HydrophobicContact CD1-CG2 3.97Å; V315-T317 PolarHBondContact O-N 3.44Å; T317-L321 HydrophobicContact CG2-CD1 4.3Å
318	T	53.4	Low	48.3	Very low	47 Å²	47	100.9 Å²	100.9	29%	0.288	56%	0.56	S	S	.	*			trans	-144.1	162.6	-177.3	48.1	0	0	0	0	107.9	K316 L320 L321	K316-T318 PolarHBondContact O-N 2.73Å; K316-T318 PolarHBondContact O-OG1 2.91Å; K316-T318 VanDerWaalsContact O-OG1 3.13Å; T318-L320 PolarHBondContact O-N 2.91Å; T318-L321 PolarHBondContact O-N 2.81Å; T318-L321 VanDerWaalsContact O-N 3.12Å
319	P	49.3	Very low	46	Very low	57 Å²	57	105 Å²	105	37%	0.37	58%	0.578	S	S	.	*	G	3₁₀ helix	trans	-57.1	-17.6	-179.4	-28.3	37.1	0	0	0	114.8	E272 L321 L322	E272-P319 WeakPolarHBondContact OE2-CD 3.07Å; P319-L321 PolarHBondContact O-N 3.45Å; P319-L322 WeakPolarHBondContact O-CB 3.36Å; P319-L322 PolarHBondContact O-N 3.05Å; P319-L322 VanDerWaalsContact O-N 3.12Å
320	L	43.8	Very low	43.9	Very low	162 Å²	162	107 Å²	107	85%	0.848	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-67.9	-7.9	177.1	-62.1	173.4	0	0	0	114.6	T318 L322	T318-L320 PolarHBondContact O-N 2.91Å; L320-L322 VanDerWaalsContact C-N 3.29Å
321	L	48.4	Very low	42.1	Very low	71 Å²	71	117.7 Å²	117.7	37%	0.372	64%	0.636	S	S	.	*	G	3₁₀ helix	trans	-81.7	-6.5	170.3	-67.7	173.6	0	0	0	113.4	L310 V315 T317 T318 P319 G323	L310-L321 HydrophobicContact CD2-CD1 4.28Å; V315-L321 HydrophobicContact CG1-CD1 4.04Å; V315-L321 HydrophobicContact CG1-CD2 4.17Å; T317-L321 HydrophobicContact CG2-CD1 4.3Å; T318-L321 PolarHBondContact O-N 2.81Å; T318-L321 VanDerWaalsContact O-N 3.12Å; P319-L321 PolarHBondContact O-N 3.45Å; L321-G323 PolarHBondContact O-N 2.96Å
322	L	48.7	Very low	40.3	Very low	67 Å²	67	119.9 Å²	119.9	35%	0.351	66%	0.657	S	S	.	*	S	Bend	trans	-85.4	101.8	173	-64.3	168.4	0	0	0	109.7	P223 L225 P319 L320	P223-L322 WeakPolarHBondContact O-CD2 3.45Å; L225-L322 HydrophobicContact CB-CD1 3.65Å; L225-L322 HydrophobicContact CD2-CD1 4.25Å; P319-L322 WeakPolarHBondContact O-CB 3.36Å; P319-L322 PolarHBondContact O-N 3.05Å; P319-L322 VanDerWaalsContact O-N 3.12Å; L320-L322 VanDerWaalsContact C-N 3.29Å
323	G	35.1	Very low	38.8	Very low	46 Å²	46	120.1 Å²	120.1	47%	0.474	66%	0.659	S	S	.	*			trans	-54.6	145.7	-179.1	0	0	0	0	0	114	L321 T325	L321-G323 PolarHBondContact O-N 2.96Å; G323-T325 PolarHBondContact O-N 3.11Å; G323-T325 VanDerWaalsContact O-N 3.14Å
324	E	37	Very low	37.7	Very low	197 Å²	197	124.1 Å²	124.1	92%	0.921	67%	0.671	S	S	*	*			trans	-58.7	105.5	-161.8	-57.5	178	117.9	0	0	116
325	T	28.9	Very low	37	Very low	134 Å²	134	126.5 Å²	126.5	82%	0.822	68%	0.677	S	S	*	*			trans	-133	44.4	167.2	61.3	0	0	0	0	115	G323 K327	G323-T325 PolarHBondContact O-N 3.11Å; G323-T325 VanDerWaalsContact O-N 3.14Å; T325-K327 PolarHBondContact O-N 3.42Å
326	F	30.6	Very low	35.9	Very low	215 Å²	215	128.9 Å²	128.9	94%	0.943	69%	0.694	S	S	*	*			trans	-95.3	74.3	166.2	-99.5	-80.7	0	0	0	112.6	G328	F326-G328 VanDerWaalsContact C-N 3.33Å; F326-G328 PolarHBondContact O-N 3.1Å
327	K	29	Very low	34.9	Very low	216 Å²	216	129.7 Å²	129.7	94%	0.939	70%	0.698	S	S	*	*			trans	-91.4	62.7	167.5	-86.5	-170.9	174.2	176.8	0	112.5	T325 K329	T325-K327 PolarHBondContact O-N 3.42Å; K327-K329 PolarHBondContact O-N 3.21Å
328	G	27.8	Very low	34.1	Very low	67 Å²	67	134.6 Å²	134.6	69%	0.691	73%	0.73	S	S	*	*			trans	-90.8	59.9	178.3	0	0	0	0	0	115.1	F326	F326-G328 VanDerWaalsContact C-N 3.33Å; F326-G328 PolarHBondContact O-N 3.1Å
329	K	27.5	Very low	32.7	Very low	204 Å²	204	139 Å²	139	89%	0.887	75%	0.752	S	S	*	*			trans	53.4	117.1	172.9	-71.2	179.8	177.8	174.6	0	118.2	K327	K327-K329 PolarHBondContact O-N 3.21Å
330	T	24.5	Very low	31.7	Very low	133 Å²	133	146.2 Å²	146.2	82%	0.816	77%	0.772	S	S	*	*			trans	-51.9	138.6	161.6	47	0	0	0	0	114
331	R	27.7	Very low	30.8	Very low	248 Å²	248	146 Å²	146	94%	0.936	76%	0.764	S	S	*	*			trans	-123.3	134.5	135.7	-75.6	-171.2	69.1	159.5	-0.3	108.9
332	T	28.3	Very low	29.8	Very low	141 Å²	141	150 Å²	150	87%	0.865	78%	0.78	S	S	*	*			trans	-80	144.4	-177.1	35.3	0	0	0	0	112.8
333	A	27.1	Very low	28.9	Very low	95 Å²	95	153.8 Å²	153.8	79%	0.785	80%	0.797	S	S	*	*			trans	-159	145.6	144.7	0	0	0	0	0	107.9
334	E	27.6	Very low	28.5	Very low	181 Å²	181	158.3 Å²	158.3	85%	0.846	80%	0.803	S	S	*	*			trans	-75.9	162.4	-176.4	-65.1	110.2	129.7	0	0	114.8
335	S	29.3	Very low	28.1	Very low	115 Å²	115	158 Å²	158	80%	0.804	80%	0.802	S	S	*	*			trans	-68.9	143.1	158.4	-59.4	0	0	0	0	109.3
336	P	27.9	Very low	28.1	Very low	121 Å²	121	158.3 Å²	158.3	79%	0.786	79%	0.794	S	S	*	*				-146.1	160.3	88.4	37.4	-21.5	0	0	0	116.5
337	K	29.7	Very low	28	Very low	198 Å²	198	154.4 Å²	154.4	86%	0.861	78%	0.778	S	S	*	*			trans	-110.2	151.5	145.7	-77.9	-179.6	177.6	178.4	0	105.6
338	P	35.7	Very low	28.1	Very low	112 Å²	112	150.6 Å²	150.6	73%	0.727	76%	0.764	S	S	*	*			cis	-150.3	-176.9	46.7	41.9	-21.6	0	0	0	118.2
339	N	24	Very low	28.2	Very low	140 Å²	140	156 Å²	156	75%	0.749	77%	0.771	S	S	*	*			trans	79.5	110.2	147.7	-94.3	-11.3	0	0	0	122
340	R	27.1	Very low	28.3	Very low	207 Å²	207	154.9 Å²	154.9	78%	0.781	77%	0.769	S	S	*	*				83.4	124.4	110.2	-161.3	-173.3	-162.3	-169.7	6.7	118.5
341	K	25.5	Very low	28.5	Very low	157 Å²	157	155.8 Å²	155.8	68%	0.683	77%	0.769	S	S	*	*			trans	69.4	161.4	171	-73.7	156.3	152.1	-91.5	0	114
342	E	28.1	Very low	28.7	Very low	155 Å²	155	152.3 Å²	152.3	72%	0.724	76%	0.763	S	S	*	*			cis	-132.9	-178.3	9.2	-146.9	98.5	-112	0	0	111.5
343	E	27.8	Very low	28.8	Very low	148 Å²	148	150 Å²	150	69%	0.692	76%	0.759	S	S	*	*			trans	-97.2	166.4	179.7	-59.6	-174.9	116	0	0	114
344	K	27.6	Very low	29	Very low	140 Å²	140	156.6 Å²	156.6	61%	0.609	76%	0.764	S	S	*	*			trans	57.5	117	147.3	-70.3	151.8	-171.8	157.2	0	120.1
345	Q	29.2	Very low	30.2	Very low	190 Å²	190	152.7 Å²	152.7	89%	0.888	75%	0.754	S	S	*	*				-126.7	132.9	118.8	-65.5	179.4	-26.8	0	0	105.6
346	Q	28.9	Very low	30.3	Very low	142 Å²	142	156 Å²	156	66%	0.664	76%	0.757	S	S	*	*			cis	69.3	129.1	37.7	-69.2	-176.8	-65.4	0	0	112.5
347	Q	28.4	Very low	30.6	Very low	132 Å²	132	156.2 Å²	156.2	62%	0.617	76%	0.756	S	S	*	*			cis	-162.4	-170.8	-1.1	-151.1	161.8	-97.6	0	0	111.1
348	E	30.6	Very low	31.9	Very low	137 Å²	137	152 Å²	152	64%	0.64	75%	0.749	S	S	*	*			trans	63.5	140.5	171.6	-71.8	98.6	-122.9	0	0	116.1
349	E	29.8	Very low	32.1	Very low	179 Å²	179	152.8 Å²	152.8	84%	0.836	75%	0.754	S	S	*	*			cis	-146.4	-176.3	-5	-107.9	157.9	162	0	0	106.7
350	E	30.3	Very low	32.8	Very low	181 Å²	181	154 Å²	154	85%	0.846	76%	0.755	S	S	*	*			cis	-150.9	-176.3	18.9	-153.5	-178.9	156.8	0	0	109.4
351	D	28.6	Very low	33.2	Very low	152 Å²	152	151.1 Å²	151.1	81%	0.813	75%	0.75	S	S	*	*			trans	-81.7	178.6	175.6	-71.9	-52.9	0	0	0	113.2
352	E	30.4	Very low	33.7	Very low	175 Å²	175	149.1 Å²	149.1	82%	0.818	74%	0.744	S	S	*	*			cis	-155.6	-176.6	-1.2	-141	-164.7	173.1	0	0	111.6
353	A	31.8	Very low	34.1	Very low	94 Å²	94	151.1 Å²	151.1	78%	0.777	75%	0.745	S	S	*	*			trans	79.9	156.7	150.4	0	0	0	0	0	122.2
354	R	30.1	Very low	34.6	Very low	233 Å²	233	152.4 Å²	152.4	88%	0.879	75%	0.75	S	S	*	*			trans	-171.3	165.1	-167.4	-166	-130	176.1	173.2	-3.7	107.4
355	P	54.1	Low	34.9	Very low	98 Å²	98	157.6 Å²	157.6	64%	0.636	77%	0.766	S	S	*	*			cis	-115.1	-160.7	-20.8	38.5	-20.9	0	0	0	111.9
356	E	30.8	Very low	35.2	Very low	186 Å²	186	154.2 Å²	154.2	87%	0.869	76%	0.759	S	S	*	*			trans	-173.7	153.5	139.4	-92.2	-99.4	125.2	0	0	110.9
357	T	33.2	Very low	36.2	Very low	124 Å²	124	153.1 Å²	153.1	76%	0.761	76%	0.764	S	S	*	*			trans	-170.1	160.9	-175.1	-40.8	0	0	0	0	110.2
358	P	58.9	Low	36.5	Very low	111 Å²	111	151.5 Å²	151.5	72%	0.721	77%	0.767	S	S	*	*			cis	-106.1	-151.7	-46.3	35.2	-16.8	0	0	0	110.6
359	P	39.2	Very low	36.8	Very low	128 Å²	128	151.3 Å²	151.3	83%	0.831	78%	0.775	S	S	*	*				-145.7	-178	106.6	40.4	-26.2	0	0	0	116.5
360	Q	38.9	Very low	37	Very low	165 Å²	165	148.8 Å²	148.8	77%	0.771	78%	0.777	S	S	*	*			trans	-98.7	-176.4	178.9	-108	177.1	15.9	0	0	111.2
361	Q	35.8	Very low	37.3	Very low	146 Å²	146	145.6 Å²	145.6	68%	0.682	78%	0.775	S	S	*	*			cis	-162.7	-166	19.9	-125.2	164.1	40	0	0	106.7
362	E	35.5	Very low	37.6	Very low	116 Å²	116	144.2 Å²	144.2	54%	0.542	78%	0.777	S	S	.	*			cis	-157.9	167.5	-0.3	-124.1	-148	161.2	0	0	113
363	R	35.4	Very low	37.9	Very low	197 Å²	197	143.7 Å²	143.7	74%	0.743	78%	0.779	S	S	*	*			trans	43.8	110.4	149	-71.5	-177.3	-158.8	171.8	29.9	126.2
364	Q	39.5	Very low	38.3	Very low	174 Å²	174	145.2 Å²	145.2	81%	0.813	78%	0.784	S	S	*	*				-0.3	153.5	119.7	-60.3	174.8	-24.8	0	0	122.2
365	R	33.3	Very low	39	Very low	250 Å²	250	143 Å²	143	94%	0.943	78%	0.783	S	S	*	*				-148.1	167.7	127.1	-112.8	179.6	-172.3	-160.7	1.4	113
366	T	36.5	Very low	38.4	Very low	119 Å²	119	146.5 Å²	146.5	73%	0.73	80%	0.797	S	S	*	*			trans	-118.4	-166.7	-166.5	55.1	0	0	0	0	110.2
367	P	48.4	Very low	38.7	Very low	118 Å²	118	140.8 Å²	140.8	77%	0.766	79%	0.788	S	S	*	*			cis	-141.1	-165.3	5.7	44.2	-22.6	0	0	0	117.1
368	S	36.2	Very low	39.3	Very low	99 Å²	99	143.5 Å²	143.5	69%	0.692	80%	0.796	S	S	*	*			trans	-92.2	163.6	179.9	51.3	0	0	0	0	114.6
369	V	36.1	Very low	38.7	Very low	133 Å²	133	145.5 Å²	145.5	81%	0.806	80%	0.801	S	S	*	*				174.8	147.5	107.7	-81.9	0	0	0	0	112.8
370	S	33.5	Very low	39.2	Very low	125 Å²	125	147.7 Å²	147.7	87%	0.874	80%	0.8	S	S	*	*				170.4	159.1	126.7	44.9	0	0	0	0	111.8
371	S	37.8	Very low	40	Very low	115 Å²	115	150.9 Å²	150.9	80%	0.804	81%	0.805	S	S	*	*			trans	-158.7	143.1	-178	55.9	0	0	0	0	110.9
372	S	34.3	Very low	40.7	Very low	122 Å²	122	155.6 Å²	155.6	85%	0.853	83%	0.833	S	S	*	*			trans	-149.2	151.7	173.3	-60	0	0	0	0	110.9
373	L	37.1	Very low	40.9	Very low	165 Å²	165	157.6 Å²	157.6	86%	0.864	85%	0.848	S	S	*	*			trans	-89.7	155	165.9	-69.9	72.2	0	0	0	109.4
374	S	39.9	Very low	41.2	Very low	125 Å²	125	155.5 Å²	155.5	87%	0.874	85%	0.854	S	S	*	*			trans	-144.8	131.6	147.8	-68.3	0	0	0	0	108.9
375	E	45	Very low	41.3	Very low	186 Å²	186	154.5 Å²	154.5	87%	0.869	86%	0.856	S	S	*	*			trans	-83.9	150.4	159.3	-61.6	167.5	119	0	0	108
376	D	41.6	Very low	41.8	Very low	172 Å²	172	148.9 Å²	148.9	92%	0.92	85%	0.851	S	S	*	*			trans	-158.2	138.1	148	-115.5	-31.4	0	0	0	109.7
377	G	37.5	Very low	42.1	Very low	67 Å²	67	150.8 Å²	150.8	69%	0.691	86%	0.858	S	S	*	*			trans	-109.7	157	179.5	0	0	0	0	0	111.5
378	I	46	Very low	41.7	Very low	181 Å²	181	152.9 Å²	152.9	93%	0.928	86%	0.864	S	S	*	*			trans	-128.9	115.1	168.4	-52.9	-178.6	0	0	0	107.6
379	D	45.4	Very low	42.1	Very low	152 Å²	152	156.8 Å²	156.8	81%	0.813	88%	0.877	S	S	*	*			trans	-128.8	170.5	176.6	-164.7	10.4	0	0	0	109.3
380	E	49.7	Very low	42.6	Very low	174 Å²	174	158.6 Å²	158.6	81%	0.813	88%	0.882	S	S	*	*			trans	-59.1	135.3	-165.3	-59.4	-177.2	143.7	0	0	115.8
381	R	55.1	Low	43.3	Very low	232 Å²	232	161.4 Å²	161.4	88%	0.875	88%	0.883	S	S	*	*				172.1	116.3	118.3	-96.9	168.5	171.7	176.7	-1.1	114.5
382	L	50.7	Low	43.8	Very low	246 Å²	246	165.6 Å²	165.6	100%	1.288	89%	0.89	S	S	*	*				-175.8	0	102	-105.4	165.2	0	0	0	112.1

Retrieved 382 of 382 residues in 496.6 ms (Link to these results)

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