A0A077ZP85_TRITR Loading...

DUF1599 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZP85, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 440 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.3	Very low	44.8	Very low	136 Å²	136	100.9 Å²	100.9	67%	0.67	52%	0.524	S	S	*	.				0	120.8	0	-83.2	173.3	147.4	0	0	108.8	V41 F84 H85	M1-V41 HydrophobicContact CB-CG1 4.26Å; M1-F84 HydrophobicContact CE-CB 4.12Å; M1-F84 HydrophobicContact SD-CB 4.07Å; M1-H85 WeakPolarHBondContact CE-O 3.33Å
2	G	32.2	Very low	45.5	Very low	85 Å²	85	94.2 Å²	94.2	88%	0.876	50%	0.497	S	S	*	.			trans	-89	99	164.3	0	0	0	0	0	107.2
3	I	41.4	Very low	46.6	Very low	39 Å²	39	94 Å²	94	20%	0.2	49%	0.487	C	S	.	.			trans	-73.4	126.9	167.5	-57.3	178	0	0	0	105.5	R5 I7 T8 I39 V41 F84	I3-R5 PolarHBondContact O-N 3.2Å; I3-I7 HydrophobicContact CG2-CB 4.12Å; I3-I7 HydrophobicContact CG2-CG2 4.13Å; I3-T8 HydrophobicContact CB-CG2 4.18Å; I3-T8 HydrophobicContact CG2-CG2 3.6Å; I3-I39 HydrophobicContact CD1-CG2 3.42Å; I3-I39 VanDerWaalsContact CD1-CG2 3.42Å; I3-V41 HydrophobicContact CD1-CG1 4.06Å; I3-V41 HydrophobicContact CD1-CG2 3.89Å; I3-V41 HydrophobicContact CG1-CG1 4.34Å; I3-F84 HydrophobicContact CD1-CD2 4.28Å; I3-F84 HydrophobicContact CD1-CE2 4.11Å
4	D	38.2	Very low	47.6	Very low	99 Å²	99	91.2 Å²	91.2	53%	0.529	47%	0.473	S	S	.	.			trans	-58.5	136.1	-177.8	-151.8	-26.8	0	0	0	109.7	E6 I7 T8	D4-E6 PolarHBondContact O-N 3.34Å; D4-I7 HydrophobicContact CB-CD1 3.89Å; D4-I7 HydrophobicContact CB-CG1 4.07Å; D4-I7 WeakPolarHBondContact O-CB 3.34Å; D4-I7 PolarHBondContact O-N 2.83Å; D4-T8 PolarHBondContact O-N 3.18Å
5	R	44.1	Very low	48.1	Very low	164 Å²	164	89.4 Å²	89.4	62%	0.619	46%	0.464	S	S	*	.	H	α-helix	trans	-58.6	-34.9	-178.2	-95.5	-173.8	177.8	179.5	-2.3	110.6	I3 I7 T8 E9	I3-R5 PolarHBondContact O-N 3.2Å; R5-I7 PolarHBondContact O-N 3.43Å; R5-T8 WeakPolarHBondContact CA-OG1 3.34Å; R5-T8 CarbonylContact O-C 3.55Å; R5-T8 PolarHBondContact O-N 2.87Å; R5-T8 PolarHBondContact O-OG1 2.91Å; R5-E9 WeakPolarHBondContact O-CB 3.47Å; R5-E9 WeakPolarHBondContact O-CG 3.42Å; R5-E9 PolarHBondContact O-N 2.73Å
6	E	45.3	Very low	49	Very low	136 Å²	136	84.3 Å²	84.3	64%	0.636	44%	0.437	S	S	*	.	H	α-helix	trans	-61.2	-27.4	176.5	-65.5	-171.3	177.2	0	0	113.5	D4	D4-E6 PolarHBondContact O-N 3.34Å
7	I	47	Very low	49.3	Very low	103 Å²	103	85.6 Å²	85.6	53%	0.528	44%	0.436	S	S	.	.	H	α-helix	trans	-79.1	-35.7	176.1	-61	169.9	0	0	0	110.4	I3 D4 R5	I3-I7 HydrophobicContact CG2-CB 4.12Å; I3-I7 HydrophobicContact CG2-CG2 4.13Å; D4-I7 HydrophobicContact CB-CD1 3.89Å; D4-I7 HydrophobicContact CB-CG1 4.07Å; D4-I7 WeakPolarHBondContact O-CB 3.34Å; D4-I7 PolarHBondContact O-N 2.83Å; R5-I7 PolarHBondContact O-N 3.43Å
8	T	51.5	Low	49.5	Very low	4 Å²	4	81.7 Å²	81.7	3%	0.025	42%	0.42	C	S	.	.	H	α-helix	trans	-84.4	-30.6	-178.5	60.5	0	0	0	0	112.9	I3 D4 R5 P10 Y11 Y13 I39	I3-T8 HydrophobicContact CB-CG2 4.18Å; I3-T8 HydrophobicContact CG2-CG2 3.6Å; D4-T8 PolarHBondContact O-N 3.18Å; R5-T8 WeakPolarHBondContact CA-OG1 3.34Å; R5-T8 CarbonylContact O-C 3.55Å; R5-T8 PolarHBondContact O-N 2.87Å; R5-T8 PolarHBondContact O-OG1 2.91Å; T8-P10 VanDerWaalsContact O-N 3.14Å; T8-Y11 CarbonylContact O-C 3.45Å; T8-Y11 PolarHBondContact O-N 3.28Å; T8-Y13 HydrophobicContact CG2-CD1 4.08Å; T8-Y13 HydrophobicContact CG2-CE1 4.47Å; T8-Y13 HydrophobicContact CG2-CG 4.14Å; T8-Y13 WeakPolarHBondContact OG1-CD1 3.26Å; T8-Y13 VanDerWaalsContact OG1-CE1 3.3Å; T8-Y13 WeakPolarHBondContact OG1-CE1 3.48Å; T8-I39 HydrophobicContact CG2-CD1 3.75Å
9	E	51.8	Low	49.8	Very low	134 Å²	134	84.8 Å²	84.8	63%	0.626	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-29.1	-169.4	-87.4	170.6	-169.7	0	0	116.9	R5 Y11	R5-E9 WeakPolarHBondContact O-CB 3.47Å; R5-E9 WeakPolarHBondContact O-CG 3.42Å; R5-E9 PolarHBondContact O-N 2.73Å; E9-Y11 VanDerWaalsContact C-N 3.28Å; E9-Y11 PolarHBondContact O-N 2.84Å
10	P	55.2	Low	50.2	Low	89 Å²	89	86.4 Å²	86.4	58%	0.578	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-16.9	172.7	-12.9	27.2	0	0	0	114.1	T8	T8-P10 VanDerWaalsContact O-N 3.14Å
11	Y	53.3	Low	51.4	Low	121 Å²	121	87.1 Å²	87.1	48%	0.475	45%	0.448	S	S	.	.	S	Bend	trans	-126.6	131.2	-171.2	-55.8	-76.4	0	0	0	109.6	T8 E9 Y13	T8-Y11 CarbonylContact O-C 3.45Å; T8-Y11 PolarHBondContact O-N 3.28Å; E9-Y11 VanDerWaalsContact C-N 3.28Å; E9-Y11 PolarHBondContact O-N 2.84Å; Y11-Y13 PolarHBondContact O-N 2.83Å
12	G	54.1	Low	53.3	Low	20 Å²	20	85 Å²	85	21%	0.206	44%	0.438	C	S	.	.			trans	-52.8	131.6	173.4	0	0	0	0	0	110.8	T35	G12-T35 WeakPolarHBondContact CA-OG1 3.43Å; G12-T35 PolarHBondContact N-OG1 2.99Å; G12-T35 VanDerWaalsContact N-OG1 3.13Å
13	Y	59.8	Low	55.5	Low	92 Å²	92	88.3 Å²	88.3	36%	0.361	43%	0.431	S	S	.	.	B	Isolated β-bridge	trans	-128.6	149.4	170.9	77.4	-83.9	0	0	0	110.2	T8 Y11	T8-Y13 HydrophobicContact CG2-CD1 4.08Å; T8-Y13 HydrophobicContact CG2-CE1 4.47Å; T8-Y13 HydrophobicContact CG2-CG 4.14Å; T8-Y13 WeakPolarHBondContact OG1-CD1 3.26Å; T8-Y13 VanDerWaalsContact OG1-CE1 3.3Å; T8-Y13 WeakPolarHBondContact OG1-CE1 3.48Å; Y11-Y13 PolarHBondContact O-N 2.83Å
14	D	59.6	Low	57.3	Low	55 Å²	55	89 Å²	89	29%	0.294	44%	0.442	S	S	.	.			trans	-149.4	158.2	173.2	-148.3	-22.9	0	0	0	110.1	F16 K28 L32	D14-F16 HydrophobicContact CB-CD2 4.46Å; D14-F16 HydrophobicContact CB-CE2 3.87Å; D14-F16 HydrophobicContact CB-CZ 4.21Å; D14-K28 HydrophobicContact CB-CG 4.45Å; D14-K28 WeakPolarHBondContact OD2-CE 3.34Å; D14-K28 VanDerWaalsContact OD2-CG 3.24Å; D14-K28 WeakPolarHBondContact OD2-CG 3.49Å; D14-L32 HydrophobicContact CB-CD1 3.75Å
15	L	56.2	Low	59.1	Low	64 Å²	64	84.6 Å²	84.6	34%	0.335	42%	0.418	S	S	.	.			trans	-108	107.1	-176.6	-67.6	163.2	0	0	0	109.4	Y17 V41	L15-Y17 HydrophobicContact CB-CD2 4.11Å; L15-Y17 HydrophobicContact CB-CE2 3.37Å; L15-Y17 HydrophobicContact CD1-CE2 4.23Å; L15-Y17 HydrophobicContact CG-CE2 4.3Å; L15-Y17 PolarHBondContact O-N 3Å; L15-V41 HydrophobicContact CD2-CB 3.64Å; L15-V41 HydrophobicContact CD2-CG2 3.71Å
16	F	61.7	Low	60.7	Low	8 Å²	8	78.1 Å²	78.1	4%	0.035	39%	0.394	C	S	.	.			trans	-93.5	92.3	-176.3	-64.1	-96.3	0	0	0	111.5	D14 Q25 K28 L29 L32 V38 I49	D14-F16 HydrophobicContact CB-CD2 4.46Å; D14-F16 HydrophobicContact CB-CE2 3.87Å; D14-F16 HydrophobicContact CB-CZ 4.21Å; F16-Q25 HydrophobicContact CD1-CB 3.9Å; F16-Q25 HydrophobicContact CD1-CG 3.97Å; F16-Q25 HydrophobicContact CE1-CB 4.07Å; F16-Q25 HydrophobicContact CE1-CG 4.48Å; F16-Q25 WeakPolarHBondContact CE1-O 3.28Å; F16-K28 HydrophobicContact CE1-CB 4.11Å; F16-K28 HydrophobicContact CE1-CG 4.35Å; F16-K28 HydrophobicContact CZ-CB 4.3Å; F16-K28 HydrophobicContact CZ-CG 4.21Å; F16-L29 HydrophobicContact CE1-CD1 4.44Å; F16-L29 HydrophobicContact CE1-CD2 4.09Å; F16-L29 HydrophobicContact CE1-CG 3.77Å; F16-L29 HydrophobicContact CE2-CD2 3.88Å; F16-L29 HydrophobicContact CE2-CG 4.46Å; F16-L29 HydrophobicContact CZ-CD2 3.51Å; F16-L29 HydrophobicContact CZ-CG 3.63Å; F16-L32 HydrophobicContact CE2-CD1 4.06Å; F16-L32 HydrophobicContact CZ-CD1 3.94Å; F16-V38 HydrophobicContact CE2-CG1 4.25Å; F16-I49 HydrophobicContact CB-CD1 3.47Å; F16-I49 VanDerWaalsContact CB-CD1 3.47Å; F16-I49 HydrophobicContact CB-CG1 4.12Å; F16-I49 HydrophobicContact CD1-CD1 4.14Å; F16-I49 HydrophobicContact CD1-CG1 4.38Å; F16-I49 HydrophobicContact CD2-CD1 3.39Å; F16-I49 HydrophobicContact CD2-CG1 4.42Å; F16-I49 HydrophobicContact CE2-CD1 4.07Å; F16-I49 HydrophobicContact CG-CD1 3.4Å; F16-I49 VanDerWaalsContact CG-CD1 3.4Å; F16-I49 HydrophobicContact CG-CG1 4.08Å
17	Y	54.4	Low	62.4	Low	107 Å²	107	78.3 Å²	78.3	42%	0.42	39%	0.393	S	S	.	.			trans	-88.9	144.4	174.4	-58	-76.8	0	0	0	110.9	L15 D19 Q25 Q42	L15-Y17 HydrophobicContact CB-CD2 4.11Å; L15-Y17 HydrophobicContact CB-CE2 3.37Å; L15-Y17 HydrophobicContact CD1-CE2 4.23Å; L15-Y17 HydrophobicContact CG-CE2 4.3Å; L15-Y17 PolarHBondContact O-N 3Å; Y17-D19 PolarHBondContact O-N 2.83Å; Y17-Q25 PolarHBondContact O-NE2 2.82Å; Y17-Q42 HydrophobicContact CE1-CB 4.39Å
18	G	53.3	Low	63.8	Low	14 Å²	14	76.8 Å²	76.8	14%	0.144	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	99.3	-172.5	0	0	0	0	0	109.9	S44	G18-S44 VanDerWaalsContact CA-OG 3.26Å; G18-S44 WeakPolarHBondContact CA-OG 3.36Å; G18-S44 PolarHBondContact N-OG 3.31Å
19	D	54.4	Low	64.9	Low	141 Å²	141	76.7 Å²	76.7	75%	0.754	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-174.9	17.2	142.1	-79.6	-22.1	0	0	0	109.1	Y17 N46	Y17-D19 PolarHBondContact O-N 2.83Å; D19-N46 PolarHBondContact OD1-ND2 2.88Å
20	E	58.8	Low	66.1	Low	117 Å²	117	73.1 Å²	73.1	55%	0.547	37%	0.365	S	S	.	.	S	Bend	trans	-96.8	160.3	-178.1	-59.5	-179	164	0	0	111.1	I22	E20-I22 PolarHBondContact O-N 3.06Å
21	N	73.9	Confident	67	Low	102 Å²	102	72.8 Å²	72.8	55%	0.545	36%	0.356	S	S	.	.			trans	-52	107.7	-178.6	-178.1	-10.1	0	0	0	111.6	E23 A24 Q25	N21-E23 PolarHBondContact O-N 2.86Å; N21-E23 VanDerWaalsContact O-N 3.15Å; N21-E23 VanDerWaalsContact OD1-CB 3.29Å; N21-E23 WeakPolarHBondContact OD1-CB 3.32Å; N21-E23 PolarHBondContact OD1-N 3.24Å; N21-A24 HydrophobicContact CB-CB 3.98Å; N21-A24 WeakPolarHBondContact O-CA 3.1Å; N21-A24 WeakPolarHBondContact O-CB 3.45Å; N21-A24 PolarHBondContact O-N 3.13Å; N21-Q25 PolarHBondContact O-N 3.08Å
22	I	73.2	Confident	67.7	Low	92 Å²	92	67.6 Å²	67.6	47%	0.472	34%	0.336	S	S	.	.	H	α-helix	trans	-52	-37.6	-179.5	-70.6	173.5	0	0	0	111.7	E20 Q25 W26 A48	E20-I22 PolarHBondContact O-N 3.06Å; I22-Q25 PolarHBondContact O-N 2.63Å; I22-W26 PolarHBondContact O-N 2.96Å; I22-A48 HydrophobicContact CG2-CB 4.18Å
23	E	78.2	Confident	68.4	Low	153 Å²	153	72 Å²	72	72%	0.715	35%	0.347	S	S	*	.	H	α-helix	trans	-67.2	-37.6	179.1	-162.3	176.7	-167	0	0	111.7	N21 W26 K27	N21-E23 PolarHBondContact O-N 2.86Å; N21-E23 VanDerWaalsContact O-N 3.15Å; N21-E23 VanDerWaalsContact OD1-CB 3.29Å; N21-E23 WeakPolarHBondContact OD1-CB 3.32Å; N21-E23 PolarHBondContact OD1-N 3.24Å; E23-W26 PolarHBondContact O-N 3.46Å; E23-K27 PolarHBondContact O-N 2.87Å
24	A	79.2	Confident	68.7	Low	54 Å²	54	76.1 Å²	76.1	45%	0.446	37%	0.369	S	S	.	.	H	α-helix	trans	-68.1	-36.7	174	0	0	0	0	0	111.7	N21 K27 K28	N21-A24 HydrophobicContact CB-CB 3.98Å; N21-A24 WeakPolarHBondContact O-CA 3.1Å; N21-A24 WeakPolarHBondContact O-CB 3.45Å; N21-A24 PolarHBondContact O-N 3.13Å; A24-K27 PolarHBondContact O-N 3.02Å; A24-K28 WeakPolarHBondContact O-CB 3.49Å; A24-K28 PolarHBondContact O-N 2.89Å
25	Q	75.3	Confident	68.9	Low	6 Å²	6	76.9 Å²	76.9	3%	0.028	38%	0.376	C	S	.	.	H	α-helix	trans	-66.2	-41.7	175.6	-66.9	-172	-7.6	0	0	111.8	F16 Y17 N21 I22 K28 L29 S47 A48	F16-Q25 HydrophobicContact CD1-CB 3.9Å; F16-Q25 HydrophobicContact CD1-CG 3.97Å; F16-Q25 HydrophobicContact CE1-CB 4.07Å; F16-Q25 HydrophobicContact CE1-CG 4.48Å; F16-Q25 WeakPolarHBondContact CE1-O 3.28Å; Y17-Q25 PolarHBondContact O-NE2 2.82Å; N21-Q25 PolarHBondContact O-N 3.08Å; I22-Q25 PolarHBondContact O-N 2.63Å; Q25-K28 WeakPolarHBondContact O-CB 3.36Å; Q25-K28 PolarHBondContact O-N 3.15Å; Q25-L29 WeakPolarHBondContact O-CG 3.15Å; Q25-L29 PolarHBondContact O-N 2.89Å; Q25-S47 VanDerWaalsContact OE1-CA 3.24Å; Q25-S47 VanDerWaalsContact OE1-CB 3.28Å; Q25-A48 HydrophobicContact CB-CB 3.62Å
26	W	78.8	Confident	68.9	Low	29 Å²	29	76.6 Å²	76.6	11%	0.11	39%	0.389	C	S	.	.	H	α-helix	trans	-62.1	-44.6	173.2	-82.7	121.9	0	0	0	112.7	I22 E23 K28 L29 E30 A48 I52 T73 H76 F79	I22-W26 PolarHBondContact O-N 2.96Å; E23-W26 PolarHBondContact O-N 3.46Å; W26-K28 PolarHBondContact O-N 3.22Å; W26-L29 HydrophobicContact CD2-CD1 4.32Å; W26-L29 HydrophobicContact CE3-CB 4.4Å; W26-L29 HydrophobicContact CE3-CD1 3.7Å; W26-L29 HydrophobicContact CZ3-CD1 3.87Å; W26-L29 PolarHBondContact O-N 2.89Å; W26-E30 PolarHBondContact O-N 3.16Å; W26-A48 HydrophobicContact CD2-CB 4.04Å; W26-A48 HydrophobicContact CG-CB 4.04Å; W26-A48 HydrophobicContact CZ2-CB 4.45Å; W26-A48 WeakPolarHBondContact CZ2-O 3.28Å; W26-I52 HydrophobicContact CH2-CD1 4.07Å; W26-I52 HydrophobicContact CH2-CG1 4.19Å; W26-I52 HydrophobicContact CZ3-CD1 4.05Å; W26-T73 HydrophobicContact CH2-CG2 4.23Å; W26-H76 AromaticContact CD1-NE2 3.92Å; W26-H76 AromaticContact CD2-CD2 3.53Å; W26-H76 AromaticContact CD2-CE1 3.65Å; W26-H76 AromaticContact CD2-NE2 3.22Å; W26-H76 AromaticContact CE2-CD2 3.58Å; W26-H76 AromaticContact CE2-NE2 3.36Å; W26-H76 HydrophobicContact CE3-CB 4.27Å; W26-H76 AromaticContact CE3-CD2 3.37Å; W26-H76 AromaticContact CE3-CE1 3.76Å; W26-H76 AromaticContact CE3-CG 3.55Å; W26-H76 AromaticContact CE3-ND1 3.78Å; W26-H76 AromaticContact CE3-NE2 3.53Å; W26-H76 AromaticContact CG-CE1 3.8Å; W26-H76 AromaticContact CG-NE2 3.63Å; W26-H76 HydrophobicContact CH2-CB 4.48Å; W26-H76 AromaticContact CH2-CD2 3.4Å; W26-H76 VanDerWaalsContact CH2-CD2 3.4Å; W26-H76 WeakPolarHBondContact CH2-CD2 3.46Å; W26-H76 AromaticContact CZ2-CD2 3.53Å; W26-H76 AromaticContact CZ2-NE2 3.8Å; W26-H76 HydrophobicContact CZ3-CB 3.88Å; W26-H76 AromaticContact CZ3-CD2 3.31Å; W26-H76 WeakPolarHBondContact CZ3-CD2 3.24Å; W26-H76 AromaticContact CZ3-CG 3.54Å; W26-H76 AromaticContact CZ3-NE2 3.96Å; W26-H76 AromaticContact NE1-NE2 3.75Å; W26-F79 HydrophobicContact CZ3-CE2 4.14Å; W26-F79 AromaticContact CZ3-CZ 3.91Å; W26-F79 HydrophobicContact CZ3-CZ 3.91Å
27	K	80.9	Confident	68.4	Low	140 Å²	140	77.2 Å²	77.2	61%	0.609	40%	0.397	S	S	*	.	H	α-helix	trans	-56.7	-41.3	174	-174.1	-179.3	175.3	-175.3	0	111.4	E23 A24 E30 E31	E23-K27 PolarHBondContact O-N 2.87Å; A24-K27 PolarHBondContact O-N 3.02Å; K27-E30 PolarHBondContact O-N 2.99Å; K27-E31 WeakPolarHBondContact O-CG 3.24Å; K27-E31 PolarHBondContact O-N 2.76Å
28	K	76.4	Confident	68.3	Low	71 Å²	71	72.6 Å²	72.6	31%	0.309	38%	0.38	S	S	.	.	H	α-helix	trans	-68.1	-39.9	178.7	-164.4	52	163.3	173.1	0	112.7	D14 F16 A24 Q25 W26 E30 E31 L32	D14-K28 HydrophobicContact CB-CG 4.45Å; D14-K28 WeakPolarHBondContact OD2-CE 3.34Å; D14-K28 VanDerWaalsContact OD2-CG 3.24Å; D14-K28 WeakPolarHBondContact OD2-CG 3.49Å; F16-K28 HydrophobicContact CE1-CB 4.11Å; F16-K28 HydrophobicContact CE1-CG 4.35Å; F16-K28 HydrophobicContact CZ-CB 4.3Å; F16-K28 HydrophobicContact CZ-CG 4.21Å; A24-K28 WeakPolarHBondContact O-CB 3.49Å; A24-K28 PolarHBondContact O-N 2.89Å; Q25-K28 WeakPolarHBondContact O-CB 3.36Å; Q25-K28 PolarHBondContact O-N 3.15Å; W26-K28 PolarHBondContact O-N 3.22Å; K28-E30 VanDerWaalsContact C-N 3.33Å; K28-E30 PolarHBondContact O-N 3.49Å; K28-E31 VanDerWaalsContact CD-OE2 3.25Å; K28-E31 WeakPolarHBondContact CD-OE2 3.28Å; K28-E31 IonicContact NZ-OE2 3.79Å; K28-E31 PolarHBondContact NZ-OE2 3.17Å; K28-E31 PolarHBondContact O-N 2.98Å; K28-L32 HydrophobicContact CG-CD1 4.42Å; K28-L32 VanDerWaalsContact O-CG 3.24Å; K28-L32 WeakPolarHBondContact O-CG 3.41Å; K28-L32 PolarHBondContact O-N 3.01Å
29	L	74.1	Confident	68.2	Low	1 Å²	1	72.4 Å²	72.4	1%	0.005	38%	0.375	C	S	.	.	H	α-helix	trans	-60.3	-41.4	173.8	-74.9	165.7	0	0	0	111.9	F16 Q25 W26 L32 R33 V38 A48 I49 I52 F79	F16-L29 HydrophobicContact CE1-CD1 4.44Å; F16-L29 HydrophobicContact CE1-CD2 4.09Å; F16-L29 HydrophobicContact CE1-CG 3.77Å; F16-L29 HydrophobicContact CE2-CD2 3.88Å; F16-L29 HydrophobicContact CE2-CG 4.46Å; F16-L29 HydrophobicContact CZ-CD2 3.51Å; F16-L29 HydrophobicContact CZ-CG 3.63Å; Q25-L29 WeakPolarHBondContact O-CG 3.15Å; Q25-L29 PolarHBondContact O-N 2.89Å; W26-L29 HydrophobicContact CD2-CD1 4.32Å; W26-L29 HydrophobicContact CE3-CB 4.4Å; W26-L29 HydrophobicContact CE3-CD1 3.7Å; W26-L29 HydrophobicContact CZ3-CD1 3.87Å; W26-L29 PolarHBondContact O-N 2.89Å; L29-L32 PolarHBondContact O-N 3.05Å; L29-R33 WeakPolarHBondContact O-CB 3.47Å; L29-R33 PolarHBondContact O-N 3.16Å; L29-V38 HydrophobicContact CD2-CG1 3.96Å; L29-V38 HydrophobicContact CD2-CG2 4.48Å; L29-A48 HydrophobicContact CD1-CB 4.23Å; L29-I49 HydrophobicContact CD1-CG1 4.14Å; L29-I49 HydrophobicContact CD2-CD1 4.45Å; L29-I49 HydrophobicContact CD2-CG1 4.41Å; L29-I52 HydrophobicContact CD1-CD1 4.25Å; L29-F79 HydrophobicContact CB-CE1 4.28Å
30	E	76.3	Confident	68.2	Low	60 Å²	60	66.6 Å²	66.6	28%	0.28	34%	0.344	S	S	.	.	H	α-helix	trans	-68	-38.9	175.5	-66.7	-71.3	-178.2	0	0	112.1	W26 K27 K28 L32 R33 E34 H76	W26-E30 PolarHBondContact O-N 3.16Å; K27-E30 PolarHBondContact O-N 2.99Å; K28-E30 VanDerWaalsContact C-N 3.33Å; K28-E30 PolarHBondContact O-N 3.49Å; E30-L32 VanDerWaalsContact C-N 3.33Å; E30-L32 PolarHBondContact O-N 3.5Å; E30-R33 WeakPolarHBondContact O-CB 3.23Å; E30-R33 PolarHBondContact O-N 2.96Å; E30-R33 IonicContact OE1-NH1 3.75Å; E30-R33 VanDerWaalsContact OE2-CD 3.25Å; E30-R33 WeakPolarHBondContact OE2-CD 3.32Å; E30-R33 IonicContact OE2-CZ 3.17Å; E30-R33 IonicContact OE2-NH1 2.71Å; E30-R33 PolarHBondContact OE2-NH1 3.26Å; E30-E34 PolarHBondContact O-N 3.37Å; E30-H76 IonicContact OE1-CG 3.8Å; E30-H76 IonicContact OE1-ND1 2.79Å
31	E	75.2	Confident	67.7	Low	82 Å²	82	62.4 Å²	62.4	38%	0.383	33%	0.326	S	S	.	.	H	α-helix	trans	-59.7	-42.8	172.5	-73.8	172.4	-169.5	0	0	111.8	K27 K28 E34	K27-E31 WeakPolarHBondContact O-CG 3.24Å; K27-E31 PolarHBondContact O-N 2.76Å; K28-E31 VanDerWaalsContact CD-OE2 3.25Å; K28-E31 WeakPolarHBondContact CD-OE2 3.28Å; K28-E31 IonicContact NZ-OE2 3.79Å; K28-E31 PolarHBondContact NZ-OE2 3.17Å; K28-E31 PolarHBondContact O-N 2.98Å; E31-E34 PolarHBondContact O-N 3.25Å
32	L	68.8	Low	66.6	Low	11 Å²	11	62.7 Å²	62.7	6%	0.058	32%	0.324	C	S	.	.	H	α-helix	trans	-72.5	-30.6	179.9	-63.8	169.2	0	0	0	112	D14 F16 K28 L29 E30 E34 T35 V38	D14-L32 HydrophobicContact CB-CD1 3.75Å; F16-L32 HydrophobicContact CE2-CD1 4.06Å; F16-L32 HydrophobicContact CZ-CD1 3.94Å; K28-L32 HydrophobicContact CG-CD1 4.42Å; K28-L32 VanDerWaalsContact O-CG 3.24Å; K28-L32 WeakPolarHBondContact O-CG 3.41Å; K28-L32 PolarHBondContact O-N 3.01Å; L29-L32 PolarHBondContact O-N 3.05Å; E30-L32 VanDerWaalsContact C-N 3.33Å; E30-L32 PolarHBondContact O-N 3.5Å; L32-E34 PolarHBondContact O-N 3.28Å; L32-T35 WeakPolarHBondContact O-CA 3.21Å; L32-T35 PolarHBondContact O-N 3.46Å; L32-T35 PolarHBondContact O-OG1 3.41Å; L32-V38 HydrophobicContact CB-CG2 3.71Å; L32-V38 HydrophobicContact CD1-CG1 3.99Å; L32-V38 HydrophobicContact CD1-CG2 4.46Å
33	R	67.2	Low	65.7	Low	114 Å²	114	60 Å²	60	43%	0.43	31%	0.313	S	S	.	.	H	α-helix	trans	-57	-36.9	174.3	-175.9	-173	177.6	175.5	6.3	111.9	L29 E30 T35 G36 H76	L29-R33 WeakPolarHBondContact O-CB 3.47Å; L29-R33 PolarHBondContact O-N 3.16Å; E30-R33 WeakPolarHBondContact O-CB 3.23Å; E30-R33 PolarHBondContact O-N 2.96Å; E30-R33 IonicContact OE1-NH1 3.75Å; E30-R33 VanDerWaalsContact OE2-CD 3.25Å; E30-R33 WeakPolarHBondContact OE2-CD 3.32Å; E30-R33 IonicContact OE2-CZ 3.17Å; E30-R33 IonicContact OE2-NH1 2.71Å; E30-R33 PolarHBondContact OE2-NH1 3.26Å; R33-T35 PolarHBondContact O-N 2.86Å; R33-G36 PolarHBondContact O-N 3.45Å; R33-H76 PolarHBondContact NH1-O 2.94Å
34	E	67.7	Low	64.6	Low	178 Å²	178	54.1 Å²	54.1	83%	0.832	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-20.5	175.8	-64.4	-175.7	167.6	0	0	112.9	E30 E31 L32	E30-E34 PolarHBondContact O-N 3.37Å; E31-E34 PolarHBondContact O-N 3.25Å; L32-E34 PolarHBondContact O-N 3.28Å
35	T	63.1	Low	63.5	Low	70 Å²	70	57.7 Å²	57.7	43%	0.429	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	3.8	-178.3	68.7	0	0	0	0	114.6	G12 L32 R33	G12-T35 WeakPolarHBondContact CA-OG1 3.43Å; G12-T35 PolarHBondContact N-OG1 2.99Å; G12-T35 VanDerWaalsContact N-OG1 3.13Å; L32-T35 WeakPolarHBondContact O-CA 3.21Å; L32-T35 PolarHBondContact O-N 3.46Å; L32-T35 PolarHBondContact O-OG1 3.41Å; R33-T35 PolarHBondContact O-N 2.86Å
36	G	55.8	Low	62.8	Low	59 Å²	59	60.7 Å²	60.7	61%	0.608	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.7	13.2	170.4	0	0	0	0	0	116.6	R33	R33-G36 PolarHBondContact O-N 3.45Å
37	G	52.3	Low	62.4	Low	20 Å²	20	59.6 Å²	59.6	21%	0.206	31%	0.309	C	S	.	.			trans	161.6	153.2	170.3	0	0	0	0	0	112.9
38	V	51.8	Low	61.8	Low	10 Å²	10	53.2 Å²	53.2	6%	0.061	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-120.2	122.1	176.3	-173	0	0	0	0	109.2	F16 L29 L32 I40	F16-V38 HydrophobicContact CE2-CG1 4.25Å; L29-V38 HydrophobicContact CD2-CG1 3.96Å; L29-V38 HydrophobicContact CD2-CG2 4.48Å; L32-V38 HydrophobicContact CB-CG2 3.71Å; L32-V38 HydrophobicContact CD1-CG1 3.99Å; L32-V38 HydrophobicContact CD1-CG2 4.46Å; V38-I40 HydrophobicContact CG1-CD1 4.4Å; V38-I40 HydrophobicContact CG1-CG1 3.83Å
39	I	50.1	Low	61.6	Low	11 Å²	11	49.8 Å²	49.8	6%	0.056	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-97.6	112.9	172.8	-61.7	173.6	0	0	0	109.1	I3 T8 V41 F84	I3-I39 HydrophobicContact CD1-CG2 3.42Å; I3-I39 VanDerWaalsContact CD1-CG2 3.42Å; T8-I39 HydrophobicContact CG2-CD1 3.75Å; I39-V41 HydrophobicContact CG2-CG2 4.05Å; I39-F84 HydrophobicContact CG2-CE2 4.26Å
40	I	54.7	Low	61.4	Low	18 Å²	18	55.8 Å²	55.8	9%	0.092	29%	0.29	C	S	.	.			trans	-103.9	104.8	-176.7	-56.5	160.1	0	0	0	108.7	V38 P43 I49 L53 I81	V38-I40 HydrophobicContact CG1-CD1 4.4Å; V38-I40 HydrophobicContact CG1-CG1 3.83Å; I40-P43 HydrophobicContact CG2-CB 4.31Å; I40-I49 HydrophobicContact CB-CD1 4.23Å; I40-I49 HydrophobicContact CD1-CD1 3.82Å; I40-I49 HydrophobicContact CD1-CG2 3.5Å; I40-I49 HydrophobicContact CG1-CD1 3.72Å; I40-I49 HydrophobicContact CG1-CG2 4.42Å; I40-I49 HydrophobicContact CG2-CD1 3.49Å; I40-I49 VanDerWaalsContact CG2-CD1 3.49Å; I40-I49 HydrophobicContact CG2-CG2 4.27Å; I40-L53 HydrophobicContact CG2-CD1 4.49Å; I40-I81 HydrophobicContact CD1-CG2 4.14Å
41	V	47.6	Very low	61.2	Low	29 Å²	29	56.4 Å²	56.4	18%	0.176	29%	0.293	C	S	.	.			trans	-90.2	-24.9	-168.4	-160.2	0	0	0	0	113.2	M1 I3 L15 I39	M1-V41 HydrophobicContact CB-CG1 4.26Å; I3-V41 HydrophobicContact CD1-CG1 4.06Å; I3-V41 HydrophobicContact CD1-CG2 3.89Å; I3-V41 HydrophobicContact CG1-CG1 4.34Å; L15-V41 HydrophobicContact CD2-CB 3.64Å; L15-V41 HydrophobicContact CD2-CG2 3.71Å; I39-V41 HydrophobicContact CG2-CG2 4.05Å
42	Q	51.8	Low	61.2	Low	108 Å²	108	52.5 Å²	52.5	51%	0.505	28%	0.275	S	S	.	.			trans	-161	81.5	-175.9	-155.9	171.2	1.5	0	0	112.9	Y17 S44	Y17-Q42 HydrophobicContact CE1-CB 4.39Å; Q42-S44 PolarHBondContact O-N 3.49Å
43	P	54.5	Low	61.5	Low	37 Å²	37	52.1 Å²	52.1	24%	0.24	27%	0.272	C	S	.	.			trans	-70.8	123.4	-177.4	29.8	-34.2	0	0	0	110.9	I40 L53	I40-P43 HydrophobicContact CG2-CB 4.31Å; P43-L53 HydrophobicContact CB-CD1 3.17Å; P43-L53 HydrophobicContact CG-CD1 3.4Å
44	S	55	Low	61.9	Low	29 Å²	29	51 Å²	51	20%	0.203	28%	0.275	C	S	.	.			trans	-79.3	151.9	165.3	179.6	0	0	0	0	110.8	G18 Q42 N46 S47	G18-S44 VanDerWaalsContact CA-OG 3.26Å; G18-S44 WeakPolarHBondContact CA-OG 3.36Å; G18-S44 PolarHBondContact N-OG 3.31Å; Q42-S44 PolarHBondContact O-N 3.49Å; S44-N46 PolarHBondContact O-N 3.29Å; S44-N46 PolarHBondContact OG-N 3.07Å; S44-S47 PolarHBondContact O-N 2.72Å; S44-S47 PolarHBondContact O-OG 3.29Å
45	H	56.3	Low	62.4	Low	129 Å²	129	46 Å²	46	60%	0.597	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-10.6	175.4	60.7	-79.6	0	0	0	113.8	R50	H45-R50 VanDerWaalsContact O-CD 3.26Å; H45-R50 WeakPolarHBondContact O-CD 2.99Å; H45-R50 PolarHBondContact O-NH1 2.7Å
46	N	61.2	Low	63.1	Low	69 Å²	69	43.9 Å²	43.9	37%	0.369	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.8	21.4	179.4	-67	-12.7	0	0	0	113.8	D19 S44	D19-N46 PolarHBondContact OD1-ND2 2.88Å; S44-N46 PolarHBondContact O-N 3.29Å; S44-N46 PolarHBondContact OG-N 3.07Å
47	S	69	Low	63.7	Low	5 Å²	5	43.2 Å²	43.2	4%	0.035	22%	0.224	C	C	.	.	S	Bend	trans	-99.6	161	177.1	73.7	0	0	0	0	113.2	Q25 S44 I49 R50	Q25-S47 VanDerWaalsContact OE1-CA 3.24Å; Q25-S47 VanDerWaalsContact OE1-CB 3.28Å; S44-S47 PolarHBondContact O-N 2.72Å; S44-S47 PolarHBondContact O-OG 3.29Å; S47-I49 PolarHBondContact O-N 3.01Å; S47-I49 VanDerWaalsContact O-N 3.14Å; S47-R50 WeakPolarHBondContact O-CB 2.93Å; S47-R50 PolarHBondContact O-N 3Å; S47-R50 VanDerWaalsContact O-N 3.08Å
48	A	69.1	Low	64.4	Low	6 Å²	6	43.7 Å²	43.7	5%	0.05	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-26.5	173.6	0	0	0	0	0	113	I22 Q25 W26 L29 R50	I22-A48 HydrophobicContact CG2-CB 4.18Å; Q25-A48 HydrophobicContact CB-CB 3.62Å; W26-A48 HydrophobicContact CD2-CB 4.04Å; W26-A48 HydrophobicContact CG-CB 4.04Å; W26-A48 HydrophobicContact CZ2-CB 4.45Å; W26-A48 WeakPolarHBondContact CZ2-O 3.28Å; L29-A48 HydrophobicContact CD1-CB 4.23Å; A48-R50 PolarHBondContact O-N 3.01Å
49	I	71.9	Confident	65.1	Low	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-9.7	-179.3	-46.5	-174.3	0	0	0	112.2	F16 L29 I40 S47 E51 I52 L53	F16-I49 HydrophobicContact CB-CD1 3.47Å; F16-I49 VanDerWaalsContact CB-CD1 3.47Å; F16-I49 HydrophobicContact CB-CG1 4.12Å; F16-I49 HydrophobicContact CD1-CD1 4.14Å; F16-I49 HydrophobicContact CD1-CG1 4.38Å; F16-I49 HydrophobicContact CD2-CD1 3.39Å; F16-I49 HydrophobicContact CD2-CG1 4.42Å; F16-I49 HydrophobicContact CE2-CD1 4.07Å; F16-I49 HydrophobicContact CG-CD1 3.4Å; F16-I49 VanDerWaalsContact CG-CD1 3.4Å; F16-I49 HydrophobicContact CG-CG1 4.08Å; L29-I49 HydrophobicContact CD1-CG1 4.14Å; L29-I49 HydrophobicContact CD2-CD1 4.45Å; L29-I49 HydrophobicContact CD2-CG1 4.41Å; I40-I49 HydrophobicContact CB-CD1 4.23Å; I40-I49 HydrophobicContact CD1-CD1 3.82Å; I40-I49 HydrophobicContact CD1-CG2 3.5Å; I40-I49 HydrophobicContact CG1-CD1 3.72Å; I40-I49 HydrophobicContact CG1-CG2 4.42Å; I40-I49 HydrophobicContact CG2-CD1 3.49Å; I40-I49 VanDerWaalsContact CG2-CD1 3.49Å; I40-I49 HydrophobicContact CG2-CG2 4.27Å; S47-I49 PolarHBondContact O-N 3.01Å; S47-I49 VanDerWaalsContact O-N 3.14Å; I49-E51 VanDerWaalsContact C-N 3.25Å; I49-E51 PolarHBondContact O-N 3.45Å; I49-I52 HydrophobicContact CG2-CB 4.04Å; I49-I52 HydrophobicContact CG2-CG2 4.33Å; I49-I52 WeakPolarHBondContact O-CA 3.39Å; I49-I52 WeakPolarHBondContact O-CB 3.38Å; I49-I52 PolarHBondContact O-N 2.85Å; I49-L53 HydrophobicContact CB-CD1 4.16Å; I49-L53 HydrophobicContact CG2-CD1 3.39Å; I49-L53 HydrophobicContact CG2-CG 3.61Å; I49-L53 PolarHBondContact O-N 2.77Å
50	R	69.8	Low	65.6	Low	127 Å²	127	51.8 Å²	51.8	48%	0.479	29%	0.291	S	S	.	.	H	α-helix	trans	-56.6	-39.1	178.7	-176.9	165.7	-177.9	162.9	-2.1	112.8	H45 S47 A48 I52 L53 N54	H45-R50 VanDerWaalsContact O-CD 3.26Å; H45-R50 WeakPolarHBondContact O-CD 2.99Å; H45-R50 PolarHBondContact O-NH1 2.7Å; S47-R50 WeakPolarHBondContact O-CB 2.93Å; S47-R50 PolarHBondContact O-N 3Å; S47-R50 VanDerWaalsContact O-N 3.08Å; A48-R50 PolarHBondContact O-N 3.01Å; R50-I52 VanDerWaalsContact C-N 3.31Å; R50-I52 PolarHBondContact O-N 3.3Å; R50-L53 PolarHBondContact O-N 2.82Å; R50-N54 WeakPolarHBondContact CG-OD1 3.14Å; R50-N54 VanDerWaalsContact O-CB 3.3Å; R50-N54 WeakPolarHBondContact O-CB 2.91Å; R50-N54 PolarHBondContact O-N 2.87Å; R50-N54 PolarHBondContact O-ND2 2.52Å; R50-N54 PolarHBondContact O-OD1 2.96Å; R50-N54 VanDerWaalsContact O-OD1 3.14Å
51	E	71.2	Confident	65.7	Low	72 Å²	72	53.5 Å²	53.5	34%	0.336	31%	0.313	S	S	.	.	H	α-helix	trans	-62.7	-42.2	175.9	-170.1	178.6	165.7	0	0	111.2	I49 T73 K74	I49-E51 VanDerWaalsContact C-N 3.25Å; I49-E51 PolarHBondContact O-N 3.45Å; E51-T73 HydrophobicContact CG-CG2 4.33Å; E51-T73 WeakPolarHBondContact OE1-CB 3.38Å; E51-K74 PolarHBondContact OE1-N 3.38Å; E51-K74 VanDerWaalsContact OE1-N 3.13Å
52	I	75.9	Confident	66.2	Low	1 Å²	1	54.2 Å²	54.2	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-66.6	-39.5	179.9	-63.6	172.9	0	0	0	111.4	W26 L29 I49 R50 V71 T73 F79 I81	W26-I52 HydrophobicContact CH2-CD1 4.07Å; W26-I52 HydrophobicContact CH2-CG1 4.19Å; W26-I52 HydrophobicContact CZ3-CD1 4.05Å; L29-I52 HydrophobicContact CD1-CD1 4.25Å; I49-I52 HydrophobicContact CG2-CB 4.04Å; I49-I52 HydrophobicContact CG2-CG2 4.33Å; I49-I52 WeakPolarHBondContact O-CA 3.39Å; I49-I52 WeakPolarHBondContact O-CB 3.38Å; I49-I52 PolarHBondContact O-N 2.85Å; R50-I52 VanDerWaalsContact C-N 3.31Å; R50-I52 PolarHBondContact O-N 3.3Å; I52-V71 HydrophobicContact CG2-CB 4.1Å; I52-V71 HydrophobicContact CG2-CG1 4.16Å; I52-V71 HydrophobicContact CG2-CG2 4.1Å; I52-V71 WeakPolarHBondContact O-CG1 3.16Å; I52-T73 HydrophobicContact CD1-CG2 4.49Å; I52-T73 HydrophobicContact CG1-CG2 3.58Å; I52-F79 HydrophobicContact CD1-CD1 4.16Å; I52-F79 HydrophobicContact CD1-CD2 4.03Å; I52-F79 HydrophobicContact CD1-CE1 4.36Å; I52-F79 HydrophobicContact CD1-CE2 4.25Å; I52-F79 HydrophobicContact CD1-CG 3.99Å; I52-F79 HydrophobicContact CD1-CZ 4.41Å; I52-F79 HydrophobicContact CG1-CD2 4.39Å; I52-I81 HydrophobicContact CG2-CD1 3.79Å; I52-I81 HydrophobicContact CG2-CG2 3.96Å
53	L	74.5	Confident	66.9	Low	2 Å²	2	50.3 Å²	50.3	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-94.2	-13.3	-173.7	-70	167.5	0	0	0	114.5	I40 P43 I49 R50 P55 Y56 I57 I81 L83	I40-L53 HydrophobicContact CG2-CD1 4.49Å; P43-L53 HydrophobicContact CB-CD1 3.17Å; P43-L53 HydrophobicContact CG-CD1 3.4Å; I49-L53 HydrophobicContact CB-CD1 4.16Å; I49-L53 HydrophobicContact CG2-CD1 3.39Å; I49-L53 HydrophobicContact CG2-CG 3.61Å; I49-L53 PolarHBondContact O-N 2.77Å; R50-L53 PolarHBondContact O-N 2.82Å; L53-P55 VanDerWaalsContact C-N 3.28Å; L53-P55 VanDerWaalsContact O-N 3.15Å; L53-Y56 CarbonylContact O-C 3.51Å; L53-Y56 WeakPolarHBondContact O-CA 3.48Å; L53-Y56 PolarHBondContact O-N 3.46Å; L53-I57 HydrophobicContact CB-CD1 3.46Å; L53-I57 VanDerWaalsContact CB-CD1 3.46Å; L53-I57 HydrophobicContact CB-CG1 3.96Å; L53-I57 HydrophobicContact CD1-CD1 4.29Å; L53-I57 HydrophobicContact CG-CD1 4.5Å; L53-I57 WeakPolarHBondContact O-CG1 3.41Å; L53-I57 PolarHBondContact O-N 3.04Å; L53-I81 HydrophobicContact CD2-CD1 4.12Å; L53-L83 HydrophobicContact CD2-CD2 3.44Å; L53-L83 VanDerWaalsContact CD2-CD2 3.44Å
54	N	76.9	Confident	67.6	Low	90 Å²	90	54.6 Å²	54.6	48%	0.481	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.3	-41.6	-179.7	-93.3	-12.4	0	0	0	114.2	R50 Y56	R50-N54 WeakPolarHBondContact CG-OD1 3.14Å; R50-N54 VanDerWaalsContact O-CB 3.3Å; R50-N54 WeakPolarHBondContact O-CB 2.91Å; R50-N54 PolarHBondContact O-N 2.87Å; R50-N54 PolarHBondContact O-ND2 2.52Å; R50-N54 PolarHBondContact O-OD1 2.96Å; R50-N54 VanDerWaalsContact O-OD1 3.14Å; N54-Y56 VanDerWaalsContact C-N 3.26Å; N54-Y56 PolarHBondContact O-N 2.55Å
55	P	78.9	Confident	68.1	Low	74 Å²	74	57.4 Å²	57.4	48%	0.481	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-37.9	176.3	-21.9	33.5	0	0	0	112.5	L53 K64	L53-P55 VanDerWaalsContact C-N 3.28Å; L53-P55 VanDerWaalsContact O-N 3.15Å; P55-K64 PolarHBondContact O-NZ 2.86Å; P55-K64 VanDerWaalsContact O-NZ 3.07Å
56	Y	76	Confident	68.5	Low	26 Å²	26	54.6 Å²	54.6	10%	0.102	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-4.9	-170.2	-49	-75.1	0	0	0	113.6	L53 N54 I63 K64 E65 Q69 V71 I81 L83	L53-Y56 CarbonylContact O-C 3.51Å; L53-Y56 WeakPolarHBondContact O-CA 3.48Å; L53-Y56 PolarHBondContact O-N 3.46Å; N54-Y56 VanDerWaalsContact C-N 3.26Å; N54-Y56 PolarHBondContact O-N 2.55Å; Y56-I63 CarbonylContact O-C 3.41Å; Y56-I63 VanDerWaalsContact O-CA 3.27Å; Y56-I63 WeakPolarHBondContact O-CA 3.5Å; Y56-K64 PolarHBondContact O-N 2.97Å; Y56-E65 HydrophobicContact CD1-CG 3.76Å; Y56-E65 WeakPolarHBondContact CD1-OE1 3.32Å; Y56-E65 HydrophobicContact CE1-CG 4.4Å; Y56-E65 WeakPolarHBondContact CE1-OE1 3.5Å; Y56-Q69 HydrophobicContact CD1-CG 4.3Å; Y56-Q69 HydrophobicContact CE1-CB 4.21Å; Y56-Q69 HydrophobicContact CE1-CG 3.73Å; Y56-Q69 HydrophobicContact CE2-CB 4.3Å; Y56-Q69 PolarHBondContact OH-OE1 2.83Å; Y56-V71 HydrophobicContact CD2-CG2 4.5Å; Y56-V71 HydrophobicContact CE2-CG2 3.51Å; Y56-I81 HydrophobicContact CD2-CD1 4.44Å; Y56-I81 HydrophobicContact CE2-CD1 4.4Å; Y56-L83 HydrophobicContact CD1-CD1 3.59Å; Y56-L83 HydrophobicContact CD2-CD1 3.94Å; Y56-L83 HydrophobicContact CE1-CD1 4.27Å; Y56-L83 HydrophobicContact CG-CD1 3.39Å
57	I	68.7	Low	68.6	Low	44 Å²	44	52.8 Å²	52.8	23%	0.226	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-94.8	128.1	176.3	-68.7	170.6	0	0	0	110.7	L53 F62 K64	L53-I57 HydrophobicContact CB-CD1 3.46Å; L53-I57 VanDerWaalsContact CB-CD1 3.46Å; L53-I57 HydrophobicContact CB-CG1 3.96Å; L53-I57 HydrophobicContact CD1-CD1 4.29Å; L53-I57 HydrophobicContact CG-CD1 4.5Å; L53-I57 WeakPolarHBondContact O-CG1 3.41Å; L53-I57 PolarHBondContact O-N 3.04Å; I57-F62 CarbonylContact C-O 3.49Å; I57-F62 VanDerWaalsContact CA-O 3.26Å; I57-F62 WeakPolarHBondContact CA-O 3.23Å; I57-K64 VanDerWaalsContact C-CE 3.43Å; I57-K64 WeakPolarHBondContact O-CE 3.33Å; I57-K64 PolarHBondContact O-NZ 3.15Å
58	S	67.2	Low	68.5	Low	30 Å²	30	58 Å²	58	21%	0.21	34%	0.339	C	S	.	.			trans	-77.5	163.2	171.9	42.1	0	0	0	0	111.9	N60 G61 F62	S58-N60 WeakPolarHBondContact CB-OD1 3.42Å; S58-N60 PolarHBondContact O-N 2.82Å; S58-N60 PolarHBondContact OG-OD1 2.92Å; S58-G61 PolarHBondContact O-N 2.83Å; S58-F62 PolarHBondContact N-O 2.83Å; S58-F62 PolarHBondContact OG-O 2.65Å
59	G	67.1	Low	68.5	Low	97 Å²	97	59.7 Å²	59.7	100%	1	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-13.1	-178.4	0	0	0	0	0	114.9
60	N	59.5	Low	68.6	Low	95 Å²	95	65.7 Å²	65.7	51%	0.508	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	6.4	174.1	61.6	-2.5	0	0	0	113.8	S58 F62	S58-N60 WeakPolarHBondContact CB-OD1 3.42Å; S58-N60 PolarHBondContact O-N 2.82Å; S58-N60 PolarHBondContact OG-OD1 2.92Å; N60-F62 HydrophobicContact CB-CD2 4.14Å; N60-F62 HydrophobicContact CB-CE2 4.42Å; N60-F62 VanDerWaalsContact O-CD2 3.3Å; N60-F62 WeakPolarHBondContact O-CD2 3.42Å; N60-F62 WeakPolarHBondContact O-CE2 3.45Å
61	G	58.1	Low	68.8	Low	54 Å²	54	60 Å²	60	56%	0.557	36%	0.358	S	S	*	.	S	Bend	trans	89.7	5	173.7	0	0	0	0	0	116.4	S58	S58-G61 PolarHBondContact O-N 2.83Å
62	F	57.8	Low	69.2	Low	43 Å²	43	62.8 Å²	62.8	19%	0.189	37%	0.37	C	S	.	.			trans	-100.6	155.8	-175.8	-64.2	-82	0	0	0	113.1	I57 S58 N60 K64 S88 K90	I57-F62 CarbonylContact C-O 3.49Å; I57-F62 VanDerWaalsContact CA-O 3.26Å; I57-F62 WeakPolarHBondContact CA-O 3.23Å; S58-F62 PolarHBondContact N-O 2.83Å; S58-F62 PolarHBondContact OG-O 2.65Å; N60-F62 HydrophobicContact CB-CD2 4.14Å; N60-F62 HydrophobicContact CB-CE2 4.42Å; N60-F62 VanDerWaalsContact O-CD2 3.3Å; N60-F62 WeakPolarHBondContact O-CD2 3.42Å; N60-F62 WeakPolarHBondContact O-CE2 3.45Å; F62-K64 PolarHBondContact O-N 3.4Å; F62-S88 VanDerWaalsContact CE1-CB 3.46Å; F62-K90 HydrophobicContact CE2-CD 4.42Å
63	I	65.2	Low	69.1	Low	27 Å²	27	62.8 Å²	62.8	14%	0.138	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-71.7	123	174.5	-69.7	172.5	0	0	0	109.2	Y56 E65 L83 F84	Y56-I63 CarbonylContact O-C 3.41Å; Y56-I63 VanDerWaalsContact O-CA 3.27Å; Y56-I63 WeakPolarHBondContact O-CA 3.5Å; I63-E65 WeakPolarHBondContact CG2-O 3.3Å; I63-L83 HydrophobicContact CD1-CD2 4.21Å; I63-L83 HydrophobicContact CG2-CB 4.05Å; I63-L83 HydrophobicContact CG2-CD1 4.23Å; I63-F84 WeakPolarHBondContact CD1-O 3.2Å
64	K	70.4	Confident	69.2	Low	126 Å²	126	71.9 Å²	71.9	55%	0.548	41%	0.41	S	S	.	.	S	Bend	trans	-74.9	-27	-177.7	-67.5	175.2	-169.2	145.8	0	113.6	P55 Y56 I57 F62	P55-K64 PolarHBondContact O-NZ 2.86Å; P55-K64 VanDerWaalsContact O-NZ 3.07Å; Y56-K64 PolarHBondContact O-N 2.97Å; I57-K64 VanDerWaalsContact C-CE 3.43Å; I57-K64 WeakPolarHBondContact O-CE 3.33Å; I57-K64 PolarHBondContact O-NZ 3.15Å; F62-K64 PolarHBondContact O-N 3.4Å
65	E	66	Low	69.2	Low	89 Å²	89	75.2 Å²	75.2	42%	0.416	42%	0.423	S	S	.	.			trans	-151.7	154.6	-174.4	60.2	-178.3	-148.8	0	0	111.7	Y56 I63 Q69 L83	Y56-E65 HydrophobicContact CD1-CG 3.76Å; Y56-E65 WeakPolarHBondContact CD1-OE1 3.32Å; Y56-E65 HydrophobicContact CE1-CG 4.4Å; Y56-E65 WeakPolarHBondContact CE1-OE1 3.5Å; I63-E65 WeakPolarHBondContact CG2-O 3.3Å; E65-Q69 PolarHBondContact OE1-NE2 2.87Å; E65-L83 WeakPolarHBondContact O-CB 3.43Å; E65-L83 WeakPolarHBondContact O-CD1 3.09Å
66	C	64.7	Low	69	Low	70 Å²	70	73.7 Å²	73.7	47%	0.473	41%	0.409	S	S	.	.			trans	-111.6	164.4	-176.7	-58	0	0	0	0	111.2	L83 H85	C66-L83 CarbonylContact C-O 3.59Å; C66-L83 VanDerWaalsContact CA-O 3.3Å; C66-L83 WeakPolarHBondContact CA-O 3.39Å; C66-H85 WeakPolarHBondContact SG-CA 3.05Å; C66-H85 WeakPolarHBondContact SG-CB 3.1Å; C66-H85 PolarHBondContact SG-N 3.19Å
67	G	61.9	Low	69	Low	31 Å²	31	73.4 Å²	73.4	32%	0.32	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	108.8	-173.1	174.5	0	0	0	0	0	113.2	L83	G67-L83 PolarHBondContact N-O 3.38Å; G67-L83 PolarHBondContact O-N 3.07Å
68	L	66.9	Low	69.2	Low	114 Å²	114	76.3 Å²	76.3	60%	0.597	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.1	126.8	-179.8	-166	73	0	0	0	109.8	C80 I81 I82	L68-C80 WeakPolarHBondContact CD1-SG 3.46Å; L68-I81 CarbonylContact C-O 3.51Å; L68-I81 WeakPolarHBondContact CA-O 3.49Å; L68-I82 HydrophobicContact CD1-CD1 4.18Å; L68-I82 HydrophobicContact CD1-CG1 3.46Å; L68-I82 VanDerWaalsContact CD1-CG1 3.46Å
69	Q	69.6	Low	69.2	Low	42 Å²	42	75.2 Å²	75.2	20%	0.196	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	137.6	-179.8	-64	-64	-13.9	0	0	110.4	Y56 E65 V71 C80 I81 L83	Y56-Q69 HydrophobicContact CD1-CG 4.3Å; Y56-Q69 HydrophobicContact CE1-CB 4.21Å; Y56-Q69 HydrophobicContact CE1-CG 3.73Å; Y56-Q69 HydrophobicContact CE2-CB 4.3Å; Y56-Q69 PolarHBondContact OH-OE1 2.83Å; E65-Q69 PolarHBondContact OE1-NE2 2.87Å; Q69-V71 HydrophobicContact CB-CG2 4.48Å; Q69-C80 WeakPolarHBondContact O-CA 3.31Å; Q69-I81 HydrophobicContact CB-CD1 4.42Å; Q69-I81 HydrophobicContact CB-CG1 3.87Å; Q69-I81 PolarHBondContact N-O 3.15Å; Q69-I81 PolarHBondContact O-N 3.22Å; Q69-L83 HydrophobicContact CB-CD1 4.47Å; Q69-L83 HydrophobicContact CG-CD1 3.66Å; Q69-L83 HydrophobicContact CG-CG 4.15Å
70	N	75	Confident	69	Low	125 Å²	125	73.5 Å²	73.5	67%	0.668	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.4	126.3	168.3	-70.2	-32.4	0	0	0	108.6	F79	N70-F79 CarbonylContact C-O 3.48Å; N70-F79 WeakPolarHBondContact CA-O 3.31Å
71	V	74	Confident	69.3	Low	8 Å²	8	69.2 Å²	69.2	5%	0.048	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	124.6	-178	-168.2	0	0	0	0	109.9	I52 Y56 Q69 D78 F79 I81	I52-V71 HydrophobicContact CG2-CB 4.1Å; I52-V71 HydrophobicContact CG2-CG1 4.16Å; I52-V71 HydrophobicContact CG2-CG2 4.1Å; I52-V71 WeakPolarHBondContact O-CG1 3.16Å; Y56-V71 HydrophobicContact CD2-CG2 4.5Å; Y56-V71 HydrophobicContact CE2-CG2 3.51Å; Q69-V71 HydrophobicContact CB-CG2 4.48Å; V71-D78 CarbonylContact O-C 3.55Å; V71-D78 WeakPolarHBondContact O-CA 3.42Å; V71-F79 PolarHBondContact N-O 2.94Å; V71-F79 PolarHBondContact O-N 2.96Å; V71-I81 HydrophobicContact CG2-CD1 3.56Å; V71-I81 HydrophobicContact CG2-CG1 3.97Å
72	H	78.4	Confident	69.4	Low	130 Å²	130	69.9 Å²	69.9	60%	0.602	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96	127.7	173.1	-172.2	81.2	0	0	0	110.3	G77 D78	H72-G77 WeakPolarHBondContact CA-O 3.34Å; H72-D78 WeakPolarHBondContact CB-OD1 3.3Å; H72-D78 IonicContact CE1-OD1 3.72Å; H72-D78 IonicContact CG-OD1 3.82Å; H72-D78 IonicContact ND1-OD1 2.67Å; H72-D78 PolarHBondContact ND1-OD1 3.11Å
73	T	74.9	Confident	69.6	Low	1 Å²	1	68.1 Å²	68.1	1%	0.006	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	149.3	170.4	72	0	0	0	0	109.9	W26 E51 I52 E75 H76 G77 F79	W26-T73 HydrophobicContact CH2-CG2 4.23Å; E51-T73 HydrophobicContact CG-CG2 4.33Å; E51-T73 WeakPolarHBondContact OE1-CB 3.38Å; I52-T73 HydrophobicContact CD1-CG2 4.49Å; I52-T73 HydrophobicContact CG1-CG2 3.58Å; T73-E75 VanDerWaalsContact C-N 3.28Å; T73-E75 PolarHBondContact O-N 3.29Å; T73-H76 WeakPolarHBondContact OG1-CA 3.45Å; T73-H76 VanDerWaalsContact OG1-CB 3.28Å; T73-H76 WeakPolarHBondContact OG1-CB 3.43Å; T73-H76 PolarHBondContact OG1-N 3.33Å; T73-H76 VanDerWaalsContact OG1-N 3.09Å; T73-G77 PolarHBondContact N-O 3.14Å; T73-G77 PolarHBondContact O-N 3.04Å; T73-G77 VanDerWaalsContact O-N 3.14Å; T73-G77 PolarHBondContact OG1-N 3.21Å; T73-G77 PolarHBondContact OG1-O 3.32Å; T73-F79 HydrophobicContact CG2-CD2 4.1Å; T73-F79 HydrophobicContact CG2-CE2 4.18Å
74	K	76.2	Confident	69	Low	194 Å²	194	70.5 Å²	70.5	84%	0.843	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-32.7	-175.6	-73.3	-177	179.4	177.6	0	112.9	E51	E51-K74 PolarHBondContact OE1-N 3.38Å; E51-K74 VanDerWaalsContact OE1-N 3.13Å
75	E	77.5	Confident	68.1	Low	160 Å²	160	68.2 Å²	68.2	75%	0.748	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	-25.6	-172.7	-65.3	-175.1	177.6	0	0	113.2	T73	T73-E75 VanDerWaalsContact C-N 3.28Å; T73-E75 PolarHBondContact O-N 3.29Å
76	H	74.6	Confident	67.4	Low	41 Å²	41	67 Å²	67	19%	0.19	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.2	-7.1	-170.3	-55.2	-82.7	0	0	0	114.5	W26 E30 R33 T73 F79	W26-H76 AromaticContact CD1-NE2 3.92Å; W26-H76 AromaticContact CD2-CD2 3.53Å; W26-H76 AromaticContact CD2-CE1 3.65Å; W26-H76 AromaticContact CD2-NE2 3.22Å; W26-H76 AromaticContact CE2-CD2 3.58Å; W26-H76 AromaticContact CE2-NE2 3.36Å; W26-H76 HydrophobicContact CE3-CB 4.27Å; W26-H76 AromaticContact CE3-CD2 3.37Å; W26-H76 AromaticContact CE3-CE1 3.76Å; W26-H76 AromaticContact CE3-CG 3.55Å; W26-H76 AromaticContact CE3-ND1 3.78Å; W26-H76 AromaticContact CE3-NE2 3.53Å; W26-H76 AromaticContact CG-CE1 3.8Å; W26-H76 AromaticContact CG-NE2 3.63Å; W26-H76 HydrophobicContact CH2-CB 4.48Å; W26-H76 AromaticContact CH2-CD2 3.4Å; W26-H76 VanDerWaalsContact CH2-CD2 3.4Å; W26-H76 WeakPolarHBondContact CH2-CD2 3.46Å; W26-H76 AromaticContact CZ2-CD2 3.53Å; W26-H76 AromaticContact CZ2-NE2 3.8Å; W26-H76 HydrophobicContact CZ3-CB 3.88Å; W26-H76 AromaticContact CZ3-CD2 3.31Å; W26-H76 WeakPolarHBondContact CZ3-CD2 3.24Å; W26-H76 AromaticContact CZ3-CG 3.54Å; W26-H76 AromaticContact CZ3-NE2 3.96Å; W26-H76 AromaticContact NE1-NE2 3.75Å; E30-H76 IonicContact OE1-CG 3.8Å; E30-H76 IonicContact OE1-ND1 2.79Å; R33-H76 PolarHBondContact NH1-O 2.94Å; T73-H76 WeakPolarHBondContact OG1-CA 3.45Å; T73-H76 VanDerWaalsContact OG1-CB 3.28Å; T73-H76 WeakPolarHBondContact OG1-CB 3.43Å; T73-H76 PolarHBondContact OG1-N 3.33Å; T73-H76 VanDerWaalsContact OG1-N 3.09Å; H76-F79 HydrophobicContact CB-CE2 3.64Å; H76-F79 HydrophobicContact CB-CZ 3.84Å
77	G	74.5	Confident	66.4	Low	20 Å²	20	71.1 Å²	71.1	21%	0.206	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	81.5	-148.3	176.6	0	0	0	0	0	113.5	H72 T73	H72-G77 WeakPolarHBondContact CA-O 3.34Å; T73-G77 PolarHBondContact N-O 3.14Å; T73-G77 PolarHBondContact O-N 3.04Å; T73-G77 VanDerWaalsContact O-N 3.14Å; T73-G77 PolarHBondContact OG1-N 3.21Å; T73-G77 PolarHBondContact OG1-O 3.32Å
78	D	72.9	Confident	65.3	Low	105 Å²	105	71.4 Å²	71.4	56%	0.561	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.5	133	-172.1	-59.6	-36.7	0	0	0	113	V71 H72	V71-D78 CarbonylContact O-C 3.55Å; V71-D78 WeakPolarHBondContact O-CA 3.42Å; H72-D78 WeakPolarHBondContact CB-OD1 3.3Å; H72-D78 IonicContact CE1-OD1 3.72Å; H72-D78 IonicContact CG-OD1 3.82Å; H72-D78 IonicContact ND1-OD1 2.67Å; H72-D78 PolarHBondContact ND1-OD1 3.11Å
79	F	68	Low	63.9	Low	8 Å²	8	71 Å²	71	4%	0.035	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	139.3	171.3	-70	-93.7	0	0	0	110	W26 L29 I52 N70 V71 T73 H76 I81	W26-F79 HydrophobicContact CZ3-CE2 4.14Å; W26-F79 AromaticContact CZ3-CZ 3.91Å; W26-F79 HydrophobicContact CZ3-CZ 3.91Å; L29-F79 HydrophobicContact CB-CE1 4.28Å; I52-F79 HydrophobicContact CD1-CD1 4.16Å; I52-F79 HydrophobicContact CD1-CD2 4.03Å; I52-F79 HydrophobicContact CD1-CE1 4.36Å; I52-F79 HydrophobicContact CD1-CE2 4.25Å; I52-F79 HydrophobicContact CD1-CG 3.99Å; I52-F79 HydrophobicContact CD1-CZ 4.41Å; I52-F79 HydrophobicContact CG1-CD2 4.39Å; N70-F79 CarbonylContact C-O 3.48Å; N70-F79 WeakPolarHBondContact CA-O 3.31Å; V71-F79 PolarHBondContact N-O 2.94Å; V71-F79 PolarHBondContact O-N 2.96Å; T73-F79 HydrophobicContact CG2-CD2 4.1Å; T73-F79 HydrophobicContact CG2-CE2 4.18Å; H76-F79 HydrophobicContact CB-CE2 3.64Å; H76-F79 HydrophobicContact CB-CZ 3.84Å; F79-I81 HydrophobicContact CB-CG2 4.23Å
80	C	63.1	Low	62.7	Low	61 Å²	61	74.9 Å²	74.9	41%	0.412	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	118.1	167.1	-169.2	0	0	0	0	108	L68 Q69	L68-C80 WeakPolarHBondContact CD1-SG 3.46Å; Q69-C80 WeakPolarHBondContact O-CA 3.31Å
81	I	65.7	Low	61.4	Low	4 Å²	4	73.6 Å²	73.6	2%	0.021	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	147.4	-176.8	67.5	177.7	0	0	0	110.4	I40 I52 L53 Y56 L68 Q69 V71 F79 L83	I40-I81 HydrophobicContact CD1-CG2 4.14Å; I52-I81 HydrophobicContact CG2-CD1 3.79Å; I52-I81 HydrophobicContact CG2-CG2 3.96Å; L53-I81 HydrophobicContact CD2-CD1 4.12Å; Y56-I81 HydrophobicContact CD2-CD1 4.44Å; Y56-I81 HydrophobicContact CE2-CD1 4.4Å; L68-I81 CarbonylContact C-O 3.51Å; L68-I81 WeakPolarHBondContact CA-O 3.49Å; Q69-I81 HydrophobicContact CB-CD1 4.42Å; Q69-I81 HydrophobicContact CB-CG1 3.87Å; Q69-I81 PolarHBondContact N-O 3.15Å; Q69-I81 PolarHBondContact O-N 3.22Å; V71-I81 HydrophobicContact CG2-CD1 3.56Å; V71-I81 HydrophobicContact CG2-CG1 3.97Å; F79-I81 HydrophobicContact CB-CG2 4.23Å; I81-L83 HydrophobicContact CD1-CD2 3.7Å; I81-L83 HydrophobicContact CD1-CG 4.17Å; I81-L83 HydrophobicContact CG1-CD2 4.27Å; I81-L83 HydrophobicContact CG1-CG 4.36Å
82	I	59.5	Low	60.6	Low	69 Å²	69	79 Å²	79	35%	0.354	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	117.8	168.9	-60.5	173.2	0	0	0	108	L68 F84	L68-I82 HydrophobicContact CD1-CD1 4.18Å; L68-I82 HydrophobicContact CD1-CG1 3.46Å; L68-I82 VanDerWaalsContact CD1-CG1 3.46Å; I82-F84 HydrophobicContact CB-CE2 4.04Å; I82-F84 HydrophobicContact CB-CZ 4.34Å; I82-F84 HydrophobicContact CG2-CD2 4.13Å; I82-F84 HydrophobicContact CG2-CE1 4.05Å; I82-F84 HydrophobicContact CG2-CE2 3.52Å; I82-F84 HydrophobicContact CG2-CZ 3.48Å; I82-F84 VanDerWaalsContact CG2-CZ 3.48Å
83	L	63	Low	60	Low	6 Å²	6	73.5 Å²	73.5	3%	0.031	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	118.8	174.9	-62.4	179.9	0	0	0	109.5	L53 Y56 I63 E65 C66 G67 Q69 I81	L53-L83 HydrophobicContact CD2-CD2 3.44Å; L53-L83 VanDerWaalsContact CD2-CD2 3.44Å; Y56-L83 HydrophobicContact CD1-CD1 3.59Å; Y56-L83 HydrophobicContact CD2-CD1 3.94Å; Y56-L83 HydrophobicContact CE1-CD1 4.27Å; Y56-L83 HydrophobicContact CG-CD1 3.39Å; I63-L83 HydrophobicContact CD1-CD2 4.21Å; I63-L83 HydrophobicContact CG2-CB 4.05Å; I63-L83 HydrophobicContact CG2-CD1 4.23Å; E65-L83 WeakPolarHBondContact O-CB 3.43Å; E65-L83 WeakPolarHBondContact O-CD1 3.09Å; C66-L83 CarbonylContact C-O 3.59Å; C66-L83 VanDerWaalsContact CA-O 3.3Å; C66-L83 WeakPolarHBondContact CA-O 3.39Å; G67-L83 PolarHBondContact N-O 3.38Å; G67-L83 PolarHBondContact O-N 3.07Å; Q69-L83 HydrophobicContact CB-CD1 4.47Å; Q69-L83 HydrophobicContact CG-CD1 3.66Å; Q69-L83 HydrophobicContact CG-CG 4.15Å; I81-L83 HydrophobicContact CD1-CD2 3.7Å; I81-L83 HydrophobicContact CD1-CG 4.17Å; I81-L83 HydrophobicContact CG1-CD2 4.27Å; I81-L83 HydrophobicContact CG1-CG 4.36Å
84	F	51.4	Low	59.8	Low	76 Å²	76	79.2 Å²	79.2	33%	0.333	39%	0.392	S	S	.	.			trans	-96.8	138.7	170	-64	-83.1	0	0	0	109.6	M1 I3 I39 I63 I82 N86	M1-F84 HydrophobicContact CE-CB 4.12Å; M1-F84 HydrophobicContact SD-CB 4.07Å; I3-F84 HydrophobicContact CD1-CD2 4.28Å; I3-F84 HydrophobicContact CD1-CE2 4.11Å; I39-F84 HydrophobicContact CG2-CE2 4.26Å; I63-F84 WeakPolarHBondContact CD1-O 3.2Å; I82-F84 HydrophobicContact CB-CE2 4.04Å; I82-F84 HydrophobicContact CB-CZ 4.34Å; I82-F84 HydrophobicContact CG2-CD2 4.13Å; I82-F84 HydrophobicContact CG2-CE1 4.05Å; I82-F84 HydrophobicContact CG2-CE2 3.52Å; I82-F84 HydrophobicContact CG2-CZ 3.48Å; I82-F84 VanDerWaalsContact CG2-CZ 3.48Å; F84-N86 PolarHBondContact O-N 3.36Å
85	H	52.2	Low	59.7	Low	78 Å²	78	74.6 Å²	74.6	36%	0.361	38%	0.38	S	S	.	.			trans	-56.6	111.6	171.8	179.2	47.2	0	0	0	108.7	M1 C66 Q87	M1-H85 WeakPolarHBondContact CE-O 3.33Å; C66-H85 WeakPolarHBondContact SG-CA 3.05Å; C66-H85 WeakPolarHBondContact SG-CB 3.1Å; C66-H85 PolarHBondContact SG-N 3.19Å; H85-Q87 WeakPolarHBondContact CD2-CG 3.32Å; H85-Q87 WeakPolarHBondContact NE2-CA 3.41Å; H85-Q87 WeakPolarHBondContact NE2-CG 3.43Å; H85-Q87 PolarHBondContact O-N 3.33Å; H85-Q87 VanDerWaalsContact O-N 3.11Å
86	N	51.1	Low	59.7	Low	65 Å²	65	69 Å²	69	35%	0.348	37%	0.365	S	S	.	.			trans	-74.4	103.3	161.4	-139.2	2.8	0	0	0	104.9	F84 S88	F84-N86 PolarHBondContact O-N 3.36Å; N86-S88 VanDerWaalsContact C-N 3.32Å; N86-S88 PolarHBondContact O-N 3.28Å
87	Q	43.7	Very low	60	Low	155 Å²	155	68.4 Å²	68.4	72%	0.724	36%	0.363	S	S	*	.			trans	-52.9	98.5	178.9	-89.6	-175.5	-30	0	0	110	H85	H85-Q87 WeakPolarHBondContact CD2-CG 3.32Å; H85-Q87 WeakPolarHBondContact NE2-CA 3.41Å; H85-Q87 WeakPolarHBondContact NE2-CG 3.43Å; H85-Q87 PolarHBondContact O-N 3.33Å; H85-Q87 VanDerWaalsContact O-N 3.11Å
88	S	39	Very low	60.6	Low	37 Å²	37	72 Å²	72	26%	0.259	37%	0.37	S	S	.	.			trans	-108.1	71.9	158	87.7	0	0	0	0	106.4	F62 N86 K90	F62-S88 VanDerWaalsContact CE1-CB 3.46Å; N86-S88 VanDerWaalsContact C-N 3.32Å; N86-S88 PolarHBondContact O-N 3.28Å; S88-K90 PolarHBondContact O-N 3.29Å
89	D	38.5	Very low	61.2	Low	107 Å²	107	67 Å²	67	57%	0.572	34%	0.344	S	S	*	.			trans	-67.7	73.6	140.3	-69.8	-28.1	0	0	0	105.8	E91	D89-E91 PolarHBondContact O-N 2.85Å
90	K	42.8	Very low	62.2	Low	122 Å²	122	70.3 Å²	70.3	53%	0.53	36%	0.357	S	S	.	.			trans	-71.3	62.7	151.6	-77.8	-170.5	178.9	-172.4	0	106.2	F62 S88 D92	F62-K90 HydrophobicContact CE2-CD 4.42Å; S88-K90 PolarHBondContact O-N 3.29Å; K90-D92 PolarHBondContact O-N 3.42Å
91	E	47.5	Very low	63.3	Low	98 Å²	98	67.5 Å²	67.5	46%	0.458	34%	0.338	S	S	.	.			trans	-63.4	124.4	138.5	-71.3	-164.3	142.8	0	0	104.8	D89 I93 K161	D89-E91 PolarHBondContact O-N 2.85Å; E91-I93 PolarHBondContact O-N 3.43Å; E91-K161 VanDerWaalsContact OE2-CE 3.24Å; E91-K161 WeakPolarHBondContact OE2-CE 3.47Å; E91-K161 IonicContact OE2-NZ 3.52Å; E91-K161 PolarHBondContact OE2-NZ 3.02Å
92	D	57.5	Low	64.4	Low	122 Å²	122	69.3 Å²	69.3	65%	0.652	35%	0.349	S	S	*	.			trans	-42.5	132.9	166.1	-67.8	-43.6	0	0	0	107.7	K90 K94	K90-D92 PolarHBondContact O-N 3.42Å; D92-K94 HydrophobicContact CB-CG 4.41Å; D92-K94 WeakPolarHBondContact O-CG 3.3Å; D92-K94 PolarHBondContact O-N 3.43Å
93	I	66.1	Low	65.7	Low	15 Å²	15	68.2 Å²	68.2	8%	0.077	34%	0.34	C	S	.	.			trans	-55.3	117.9	166.7	-61.4	167.3	0	0	0	104.5	E91 L97 Y135 D152 I155 M156	E91-I93 PolarHBondContact O-N 3.43Å; I93-L97 HydrophobicContact CB-CD2 4.34Å; I93-L97 HydrophobicContact CG1-CD2 4.18Å; I93-L97 HydrophobicContact CG2-CB 4.38Å; I93-L97 HydrophobicContact CG2-CD2 3.71Å; I93-Y135 HydrophobicContact CB-CE2 3.71Å; I93-Y135 HydrophobicContact CD1-CE2 4.22Å; I93-Y135 HydrophobicContact CG2-CD1 4.07Å; I93-Y135 HydrophobicContact CG2-CD2 3.82Å; I93-Y135 HydrophobicContact CG2-CE1 3.58Å; I93-Y135 HydrophobicContact CG2-CE2 3.29Å; I93-Y135 HydrophobicContact CG2-CG 4.2Å; I93-Y135 PolarHBondContact O-OH 3.21Å; I93-D152 HydrophobicContact CD1-CB 3.93Å; I93-I155 HydrophobicContact CD1-CB 3.75Å; I93-I155 HydrophobicContact CD1-CD1 4.2Å; I93-I155 HydrophobicContact CD1-CG1 4.48Å; I93-I155 HydrophobicContact CD1-CG2 3.9Å; I93-I155 HydrophobicContact CG1-CG2 4.35Å; I93-I155 HydrophobicContact CG2-CD1 4.3Å; I93-M156 HydrophobicContact CD1-CE 4.23Å; I93-M156 HydrophobicContact CD1-CG 4.13Å; I93-M156 HydrophobicContact CG1-CE 4.12Å
94	K	71.3	Confident	67	Low	120 Å²	120	73.4 Å²	73.4	52%	0.522	36%	0.363	S	S	.	.			trans	-108.6	152.8	-178.5	-77.3	163.5	-170.8	175.8	0	108.1	D92 G96 L97	D92-K94 HydrophobicContact CB-CG 4.41Å; D92-K94 WeakPolarHBondContact O-CG 3.3Å; D92-K94 PolarHBondContact O-N 3.43Å; K94-G96 PolarHBondContact O-N 2.89Å; K94-L97 VanDerWaalsContact O-CB 3.26Å; K94-L97 WeakPolarHBondContact O-CB 3.36Å; K94-L97 PolarHBondContact O-N 3.48Å
95	V	74.2	Confident	68.9	Low	98 Å²	98	71.3 Å²	71.3	59%	0.594	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	130.3	165.3	178.2	0	0	0	0	108	R129	V95-R129 HydrophobicContact CG2-CB 3.47Å; V95-R129 VanDerWaalsContact CG2-CB 3.47Å
96	G	76.3	Confident	70.6	Confident	41 Å²	41	67.6 Å²	67.6	42%	0.423	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.8	-1.3	-175.1	0	0	0	0	0	114.8	K94 R98 A127	K94-G96 PolarHBondContact O-N 2.89Å; G96-R98 PolarHBondContact O-N 3.45Å; G96-R98 VanDerWaalsContact O-N 3.15Å; G96-A127 PolarHBondContact N-O 3.12Å
97	L	81.3	Confident	72.4	Confident	29 Å²	29	68 Å²	68	15%	0.152	34%	0.339	C	S	.	.			trans	-56.5	122.1	167.8	179.5	72.2	0	0	0	108.6	I93 K94 F99 A127 I155 K161	I93-L97 HydrophobicContact CB-CD2 4.34Å; I93-L97 HydrophobicContact CG1-CD2 4.18Å; I93-L97 HydrophobicContact CG2-CB 4.38Å; I93-L97 HydrophobicContact CG2-CD2 3.71Å; K94-L97 VanDerWaalsContact O-CB 3.26Å; K94-L97 WeakPolarHBondContact O-CB 3.36Å; K94-L97 PolarHBondContact O-N 3.48Å; L97-F99 HydrophobicContact CD2-CD1 4.21Å; L97-F99 HydrophobicContact CG-CD1 4.37Å; L97-A127 HydrophobicContact CB-CB 4.13Å; L97-A127 WeakPolarHBondContact O-CB 3.48Å; L97-A127 PolarHBondContact O-N 2.94Å; L97-I155 HydrophobicContact CD2-CG2 3.96Å; L97-K161 HydrophobicContact CD1-CD 4.15Å; L97-K161 HydrophobicContact CD1-CG 3.8Å
98	R	87.1	Confident	74.6	Confident	95 Å²	95	66.3 Å²	66.3	36%	0.358	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	140.3	165.5	-72.9	-173.5	-110.4	-175.9	-2.4	109.3	G96 L124 F125 N126 F162	G96-R98 PolarHBondContact O-N 3.45Å; G96-R98 VanDerWaalsContact O-N 3.15Å; R98-L124 HydrophobicContact CB-CD1 4.18Å; R98-F125 CarbonylContact C-O 3.59Å; R98-F125 WeakPolarHBondContact CA-O 3.1Å; R98-N126 HydrophobicContact CG-CB 4.22Å; R98-F162 HydrophobicContact CB-CB 3.8Å; R98-F162 HydrophobicContact CB-CD1 3.89Å; R98-F162 HydrophobicContact CB-CG 4.31Å; R98-F162 WeakPolarHBondContact O-CA 3.36Å; R98-F162 WeakPolarHBondContact O-CB 3.4Å; R98-F162 PolarHBondContact O-N 3.01Å
99	F	86.3	Confident	76.8	Confident	1 Å²	1	65 Å²	65	0%	0.004	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	148.6	178.1	65.8	-84.6	0	0	0	111.2	L97 I101 F125 A127 C137 F150 I155 T160	L97-F99 HydrophobicContact CD2-CD1 4.21Å; L97-F99 HydrophobicContact CG-CD1 4.37Å; F99-I101 HydrophobicContact CD2-CB 4.45Å; F99-I101 HydrophobicContact CE2-CB 4.3Å; F99-I101 HydrophobicContact CE2-CG2 4.13Å; F99-F125 HydrophobicContact CD1-CB 4.36Å; F99-F125 HydrophobicContact CE1-CB 3.87Å; F99-F125 HydrophobicContact CE2-CB 4.17Å; F99-F125 HydrophobicContact CE2-CD2 4.43Å; F99-F125 HydrophobicContact CZ-CB 3.76Å; F99-F125 HydrophobicContact CZ-CG 4.38Å; F99-F125 PolarHBondContact N-O 3.44Å; F99-F125 PolarHBondContact O-N 3.48Å; F99-A127 HydrophobicContact CE1-CB 4.18Å; F99-C137 HydrophobicContact CZ-CB 4.36Å; F99-F150 HydrophobicContact CE2-CD2 4.31Å; F99-F150 HydrophobicContact CE2-CE2 4.28Å; F99-F150 AromaticContact CZ-CD2 3.75Å; F99-F150 HydrophobicContact CZ-CD2 3.75Å; F99-F150 HydrophobicContact CZ-CE2 4.02Å; F99-F150 HydrophobicContact CZ-CG 4.47Å; F99-I155 HydrophobicContact CD1-CG2 4.07Å; F99-I155 HydrophobicContact CD2-CG2 4.27Å; F99-I155 HydrophobicContact CE1-CD1 3.86Å; F99-I155 HydrophobicContact CE1-CG1 4.15Å; F99-I155 HydrophobicContact CE1-CG2 4.14Å; F99-I155 HydrophobicContact CE2-CG1 4.24Å; F99-I155 HydrophobicContact CE2-CG2 4.34Å; F99-I155 HydrophobicContact CG-CG2 4.14Å; F99-I155 HydrophobicContact CZ-CD1 3.92Å; F99-I155 HydrophobicContact CZ-CG1 3.79Å; F99-I155 HydrophobicContact CZ-CG2 4.28Å; F99-T160 CarbonylContact C-O 3.54Å; F99-T160 VanDerWaalsContact CA-O 3.23Å; F99-T160 WeakPolarHBondContact CA-O 3.46Å; F99-T160 WeakPolarHBondContact CB-O 3.49Å
100	Y	87.8	Confident	79.2	Confident	78 Å²	78	67.6 Å²	67.6	31%	0.306	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	140.7	169	-69.4	-70.1	0	0	0	110.5	P122 I123 L124 G159 T160 F162	Y100-P122 HydrophobicContact CD1-CB 3.87Å; Y100-P122 HydrophobicContact CG-CB 4.33Å; Y100-I123 WeakPolarHBondContact CA-O 3.27Å; Y100-L124 HydrophobicContact CD1-CB 3.87Å; Y100-L124 HydrophobicContact CD1-CD1 4.05Å; Y100-L124 HydrophobicContact CE1-CB 3.62Å; Y100-L124 HydrophobicContact CE1-CD1 3.91Å; Y100-L124 HydrophobicContact CE1-CD2 4.44Å; Y100-L124 HydrophobicContact CE1-CG 4.19Å; Y100-L124 HydrophobicContact CE2-CD1 4.43Å; Y100-L124 HydrophobicContact CG-CD1 4.36Å; Y100-G159 CarbonylContact O-C 3.55Å; Y100-G159 VanDerWaalsContact O-CA 3.32Å; Y100-G159 WeakPolarHBondContact O-CA 3.39Å; Y100-T160 PolarHBondContact N-O 2.99Å; Y100-T160 PolarHBondContact O-N 2.99Å; Y100-F162 HydrophobicContact CD2-CD2 4.06Å; Y100-F162 HydrophobicContact CE2-CB 4.45Å; Y100-F162 AromaticContact CE2-CD2 3.24Å; Y100-F162 HydrophobicContact CE2-CD2 3.24Å; Y100-F162 AromaticContact CE2-CE2 3.7Å; Y100-F162 HydrophobicContact CE2-CE2 3.7Å; Y100-F162 HydrophobicContact CE2-CG 4.15Å; Y100-F162 AromaticContact CZ-CD2 3.77Å; Y100-F162 AromaticContact CZ-CE2 3.87Å; Y100-F162 VanDerWaalsContact OH-CE2 3.32Å; Y100-F162 WeakPolarHBondContact OH-CE2 3.43Å
101	I	88	Confident	81.4	Confident	2 Å²	2	63.2 Å²	63.2	1%	0.01	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	135.1	164.9	-175.2	169.3	0	0	0	108.2	F99 N105 C106 C109 I123 F125 F150 F158	F99-I101 HydrophobicContact CD2-CB 4.45Å; F99-I101 HydrophobicContact CE2-CB 4.3Å; F99-I101 HydrophobicContact CE2-CG2 4.13Å; I101-N105 HydrophobicContact CD1-CB 4.09Å; I101-N105 HydrophobicContact CG1-CB 3.65Å; I101-C106 WeakPolarHBondContact CG2-SG 3.26Å; I101-C109 VanDerWaalsContact CD1-SG 3.58Å; I101-I123 PolarHBondContact N-O 2.8Å; I101-I123 PolarHBondContact O-N 3.43Å; I101-F125 HydrophobicContact CG2-CD2 3.54Å; I101-F125 HydrophobicContact CG2-CE2 3.57Å; I101-F150 HydrophobicContact CD1-CE1 3.82Å; I101-F150 HydrophobicContact CD1-CZ 4.14Å; I101-F150 HydrophobicContact CG2-CZ 4.06Å; I101-F158 HydrophobicContact CD1-CB 3.71Å; I101-F158 HydrophobicContact CG1-CB 4.16Å
102	T	88.7	Confident	83.4	Confident	41 Å²	41	62.5 Å²	62.5	25%	0.252	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	154	179	58.9	0	0	0	0	110.7	K104 N105 C106 T121	T102-K104 PolarHBondContact O-N 2.98Å; T102-N105 PolarHBondContact O-N 2.98Å; T102-N105 WeakPolarHBondContact OG1-CB 3.35Å; T102-N105 PolarHBondContact OG1-N 3.29Å; T102-N105 PolarHBondContact OG1-ND2 2.97Å; T102-C106 PolarHBondContact O-N 2.73Å; T102-C106 PolarHBondContact O-SG 2.75Å; T102-C106 VanDerWaalsContact O-SG 3.38Å; T102-T121 CarbonylContact C-O 3.53Å; T102-T121 WeakPolarHBondContact CA-O 3.26Å
103	R	86.4	Confident	84.7	Confident	47 Å²	47	56.7 Å²	56.7	18%	0.177	28%	0.283	C	S	.	.	H	α-helix	trans	-48.8	-47.8	172.5	178.5	-171.1	-174.5	-79.3	-16.9	111.8	N105 C106 L107 D112 P113 I116 G118 D119 T121	R103-N105 PolarHBondContact O-N 3.38Å; R103-C106 WeakPolarHBondContact O-CB 3.22Å; R103-C106 PolarHBondContact O-N 3.46Å; R103-L107 PolarHBondContact O-N 3.39Å; R103-D112 IonicContact NH2-OD1 3.38Å; R103-P113 HydrophobicContact CB-CG 4.47Å; R103-P113 HydrophobicContact CG-CG 3.99Å; R103-I116 HydrophobicContact CB-CG2 4.1Å; R103-I116 VanDerWaalsContact CD-O 3.22Å; R103-I116 WeakPolarHBondContact CD-O 3.3Å; R103-I116 HydrophobicContact CG-CG2 4.35Å; R103-I116 PolarHBondContact NE-O 3.27Å; R103-G118 WeakPolarHBondContact CB-O 3.29Å; R103-D119 IonicContact CZ-OD1 3.1Å; R103-D119 PolarHBondContact N-O 3.44Å; R103-D119 IonicContact NH1-OD1 3.81Å; R103-D119 PolarHBondContact NH1-OD1 3.2Å; R103-T121 PolarHBondContact N-O 3.03Å
104	K	90.1	Very high	85.6	Confident	115 Å²	115	62.4 Å²	62.4	50%	0.5	31%	0.313	S	S	.	.	H	α-helix	trans	-57.1	-38.6	178.7	-179	176.6	178.5	177.5	0	112.5	T102 D119	T102-K104 PolarHBondContact O-N 2.98Å; K104-D119 HydrophobicContact CB-CB 4.07Å; K104-D119 WeakPolarHBondContact CB-O 3.42Å; K104-D119 PolarHBondContact N-O 3.14Å
105	N	90.7	Very high	86	Confident	32 Å²	32	58.8 Å²	58.8	17%	0.171	31%	0.309	C	S	.	.	H	α-helix	trans	-80.4	-31	179.5	-75.7	-12.4	0	0	0	112.7	I101 T102 R103 L107 K108 C109 F158	I101-N105 HydrophobicContact CD1-CB 4.09Å; I101-N105 HydrophobicContact CG1-CB 3.65Å; T102-N105 PolarHBondContact O-N 2.98Å; T102-N105 WeakPolarHBondContact OG1-CB 3.35Å; T102-N105 PolarHBondContact OG1-N 3.29Å; T102-N105 PolarHBondContact OG1-ND2 2.97Å; R103-N105 PolarHBondContact O-N 3.38Å; N105-L107 PolarHBondContact O-N 3.07Å; N105-K108 WeakPolarHBondContact O-CB 3.46Å; N105-K108 PolarHBondContact O-N 3.11Å; N105-K108 PolarHBondContact OD1-NZ 2.8Å; N105-C109 PolarHBondContact O-N 2.98Å; N105-C109 VanDerWaalsContact O-N 3.14Å; N105-C109 PolarHBondContact O-SG 3.42Å; N105-F158 HydrophobicContact CB-CB 3.93Å; N105-F158 HydrophobicContact CB-CD1 4.08Å; N105-F158 HydrophobicContact CB-CG 4.15Å
106	C	88.8	Confident	86.4	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-53.5	-44.9	169.1	-70.4	0	0	0	0	111.1	I101 T102 R103 K108 C109 N110 F111 P113	I101-C106 WeakPolarHBondContact CG2-SG 3.26Å; T102-C106 PolarHBondContact O-N 2.73Å; T102-C106 PolarHBondContact O-SG 2.75Å; T102-C106 VanDerWaalsContact O-SG 3.38Å; R103-C106 WeakPolarHBondContact O-CB 3.22Å; R103-C106 PolarHBondContact O-N 3.46Å; C106-K108 PolarHBondContact O-N 2.84Å; C106-C109 CarbonylContact O-C 3.55Å; C106-C109 WeakPolarHBondContact O-CA 3.37Å; C106-C109 WeakPolarHBondContact O-CB 3.4Å; C106-C109 PolarHBondContact O-N 2.93Å; C106-N110 PolarHBondContact O-N 2.94Å; C106-F111 CarbonylContact C-O 3.38Å; C106-F111 HydrophobicContact CB-CD1 3.78Å; C106-F111 VanDerWaalsContact CB-O 3.3Å; C106-F111 WeakPolarHBondContact CB-O 3.43Å; C106-F111 PolarHBondContact O-N 3.28Å; C106-P113 HydrophobicContact CB-CG 4.23Å
107	L	88.6	Confident	86.4	Confident	73 Å²	73	62.4 Å²	62.4	38%	0.382	31%	0.309	S	S	.	.	H	α-helix	trans	-61.4	-33.4	178.2	-65.9	173.3	0	0	0	112.5	R103 N105 C109 N110 F111 D112	R103-L107 PolarHBondContact O-N 3.39Å; N105-L107 PolarHBondContact O-N 3.07Å; L107-C109 VanDerWaalsContact C-N 3.28Å; L107-N110 PolarHBondContact O-N 3.39Å; L107-F111 PolarHBondContact N-O 3.26Å; L107-D112 HydrophobicContact CD2-CB 3.79Å
108	K	89.2	Confident	86.4	Confident	120 Å²	120	62.6 Å²	62.6	52%	0.522	32%	0.318	S	S	.	.	H	α-helix	trans	-70.3	-26.4	174	-61.5	175.4	-174	165.8	0	112.6	N105 C106 N110 F158	N105-K108 WeakPolarHBondContact O-CB 3.46Å; N105-K108 PolarHBondContact O-N 3.11Å; N105-K108 PolarHBondContact OD1-NZ 2.8Å; C106-K108 PolarHBondContact O-N 2.84Å; K108-N110 PolarHBondContact O-N 2.99Å; K108-F158 HydrophobicContact CB-CE1 4.28Å; K108-F158 HydrophobicContact CB-CE2 4.13Å; K108-F158 HydrophobicContact CB-CZ 3.83Å; K108-F158 HydrophobicContact CD-CD1 4.3Å; K108-F158 HydrophobicContact CD-CE1 3.57Å; K108-F158 HydrophobicContact CD-CZ 3.86Å
109	C	86.4	Confident	86.2	Confident	8 Å²	8	61.9 Å²	61.9	5%	0.054	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	16.1	174.3	-49.3	0	0	0	0	112.5	I101 N105 C106 L107 F111 F150 D154 F158	I101-C109 VanDerWaalsContact CD1-SG 3.58Å; N105-C109 PolarHBondContact O-N 2.98Å; N105-C109 VanDerWaalsContact O-N 3.14Å; N105-C109 PolarHBondContact O-SG 3.42Å; C106-C109 CarbonylContact O-C 3.55Å; C106-C109 WeakPolarHBondContact O-CA 3.37Å; C106-C109 WeakPolarHBondContact O-CB 3.4Å; C106-C109 PolarHBondContact O-N 2.93Å; L107-C109 VanDerWaalsContact C-N 3.28Å; C109-F111 PolarHBondContact O-N 3.38Å; C109-F150 HydrophobicContact CB-CD1 3.59Å; C109-F150 HydrophobicContact CB-CE1 3.51Å; C109-D154 HydrophobicContact CB-CB 4.25Å; C109-F158 WeakPolarHBondContact SG-CD2 3.02Å
110	N	88.1	Confident	86.1	Confident	162 Å²	162	66.8 Å²	66.8	87%	0.866	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	32.4	-177.1	-163.2	37.4	0	0	0	113.9	C106 L107 K108	C106-N110 PolarHBondContact O-N 2.94Å; L107-N110 PolarHBondContact O-N 3.39Å; K108-N110 PolarHBondContact O-N 2.99Å
111	F	88.8	Confident	85.8	Confident	30 Å²	30	65.6 Å²	65.6	13%	0.132	36%	0.357	C	S	.	.			trans	-124.4	121.8	175.7	174.5	-109.4	0	0	0	110.6	C106 L107 C109 P113 F125 Y146 A148 F150	C106-F111 CarbonylContact C-O 3.38Å; C106-F111 HydrophobicContact CB-CD1 3.78Å; C106-F111 VanDerWaalsContact CB-O 3.3Å; C106-F111 WeakPolarHBondContact CB-O 3.43Å; C106-F111 PolarHBondContact O-N 3.28Å; L107-F111 PolarHBondContact N-O 3.26Å; C109-F111 PolarHBondContact O-N 3.38Å; F111-P113 HydrophobicContact CE1-CB 3.77Å; F111-P113 HydrophobicContact CE1-CG 4.27Å; F111-P113 HydrophobicContact CZ-CB 4.13Å; F111-P113 WeakPolarHBondContact O-CD 3.22Å; F111-F125 HydrophobicContact CD1-CZ 4.27Å; F111-F125 HydrophobicContact CE1-CE2 4.43Å; F111-F125 AromaticContact CE1-CZ 3.65Å; F111-F125 HydrophobicContact CE1-CZ 3.65Å; F111-F125 HydrophobicContact CZ-CZ 4.27Å; F111-Y146 HydrophobicContact CZ-CD1 4.04Å; F111-Y146 HydrophobicContact CZ-CG 4.12Å; F111-A148 HydrophobicContact CB-CB 4.49Å; F111-A148 HydrophobicContact CD1-CB 3.77Å; F111-A148 HydrophobicContact CD2-CB 3.71Å; F111-A148 HydrophobicContact CE1-CB 3.96Å; F111-A148 HydrophobicContact CE2-CB 3.87Å; F111-A148 HydrophobicContact CG-CB 3.69Å; F111-A148 HydrophobicContact CZ-CB 4.03Å; F111-F150 HydrophobicContact CB-CE1 4.42Å; F111-F150 HydrophobicContact CD1-CZ 4.1Å
112	D	90.3	Very high	85.7	Confident	84 Å²	84	68.9 Å²	68.9	45%	0.449	38%	0.378	S	S	.	.			trans	-106.7	106.6	177	-169.2	1.5	0	0	0	111.2	R103 L107 I114	R103-D112 IonicContact NH2-OD1 3.38Å; L107-D112 HydrophobicContact CD2-CB 3.79Å; D112-I114 VanDerWaalsContact C-N 3.31Å; D112-I114 PolarHBondContact O-N 2.94Å
113	P	85.2	Confident	85.7	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	37%	0.366	C	S	.	.			trans	-77.4	79.6	176.4	31.6	-33.7	0	0	0	110.9	R103 C106 F111 G115 I116 I123 Y146	R103-P113 HydrophobicContact CB-CG 4.47Å; R103-P113 HydrophobicContact CG-CG 3.99Å; C106-P113 HydrophobicContact CB-CG 4.23Å; F111-P113 HydrophobicContact CE1-CB 3.77Å; F111-P113 HydrophobicContact CE1-CG 4.27Å; F111-P113 HydrophobicContact CZ-CB 4.13Å; F111-P113 WeakPolarHBondContact O-CD 3.22Å; P113-G115 PolarHBondContact O-N 3.46Å; P113-I116 HydrophobicContact CB-CG1 4.17Å; P113-I116 PolarHBondContact O-N 3.2Å; P113-I116 VanDerWaalsContact O-N 3.15Å; P113-I123 HydrophobicContact CB-CD1 3.44Å; P113-I123 VanDerWaalsContact CB-CD1 3.44Å; P113-I123 HydrophobicContact CG-CD1 3.47Å; P113-I123 VanDerWaalsContact CG-CD1 3.47Å; P113-Y146 HydrophobicContact CB-CD1 4.23Å; P113-Y146 HydrophobicContact CB-CD2 4.47Å; P113-Y146 HydrophobicContact CB-CE1 3.97Å; P113-Y146 HydrophobicContact CB-CE2 4.22Å; P113-Y146 HydrophobicContact CB-CG 4.48Å
114	I	84.5	Confident	85.8	Confident	135 Å²	135	65.1 Å²	65.1	69%	0.692	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	124.1	178	-58.1	173.9	0	0	0	109.8	D112 Y146	D112-I114 VanDerWaalsContact C-N 3.31Å; D112-I114 PolarHBondContact O-N 2.94Å; I114-Y146 VanDerWaalsContact O-CE1 3.28Å; I114-Y146 WeakPolarHBondContact O-CE1 3.5Å; I114-Y146 PolarHBondContact O-OH 3.13Å
115	G	79.5	Confident	85.8	Confident	44 Å²	44	59.7 Å²	59.7	45%	0.454	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	111	-17.3	-178.5	0	0	0	0	0	114.3	P113	P113-G115 PolarHBondContact O-N 3.46Å
116	I	81.6	Confident	85.7	Confident	25 Å²	25	60 Å²	60	13%	0.128	34%	0.338	C	S	.	.			trans	-91	122.7	170.4	-52.9	-58.3	0	0	0	109	R103 P113 T121 I123 T142 Y146	R103-I116 HydrophobicContact CB-CG2 4.1Å; R103-I116 VanDerWaalsContact CD-O 3.22Å; R103-I116 WeakPolarHBondContact CD-O 3.3Å; R103-I116 HydrophobicContact CG-CG2 4.35Å; R103-I116 PolarHBondContact NE-O 3.27Å; P113-I116 HydrophobicContact CB-CG1 4.17Å; P113-I116 PolarHBondContact O-N 3.2Å; P113-I116 VanDerWaalsContact O-N 3.15Å; I116-T121 HydrophobicContact CG2-CG2 3.79Å; I116-I123 HydrophobicContact CG1-CD1 4.08Å; I116-T142 HydrophobicContact CD1-CG2 4.22Å; I116-Y146 HydrophobicContact CD1-CE2 4.26Å; I116-Y146 HydrophobicContact CG1-CE2 4.1Å
117	Q	77.9	Confident	85.7	Confident	190 Å²	190	60 Å²	60	89%	0.888	34%	0.338	S	S	*	.			trans	-96.8	-26.3	-176.1	-65.3	-173.4	1.7	0	0	114
118	G	81.3	Confident	85.4	Confident	32 Å²	32	61.1 Å²	61.1	33%	0.33	34%	0.341	S	S	.	.			trans	-92.5	125	-177.5	0	0	0	0	0	112.8	R103 S120 T121	R103-G118 WeakPolarHBondContact CB-O 3.29Å; G118-S120 VanDerWaalsContact C-N 3.26Å; G118-S120 PolarHBondContact O-N 2.8Å; G118-T121 WeakPolarHBondContact CA-OG1 3.48Å; G118-T121 WeakPolarHBondContact O-CB 3.26Å; G118-T121 PolarHBondContact O-N 3.21Å; G118-T121 PolarHBondContact O-OG1 2.79Å
119	D	82.5	Confident	84.7	Confident	80 Å²	80	62.2 Å²	62.2	43%	0.428	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-34.4	179.3	-85.5	0.1	0	0	0	114	R103 K104 T121	R103-D119 IonicContact CZ-OD1 3.1Å; R103-D119 PolarHBondContact N-O 3.44Å; R103-D119 IonicContact NH1-OD1 3.81Å; R103-D119 PolarHBondContact NH1-OD1 3.2Å; K104-D119 HydrophobicContact CB-CB 4.07Å; K104-D119 WeakPolarHBondContact CB-O 3.42Å; K104-D119 PolarHBondContact N-O 3.14Å; D119-T121 VanDerWaalsContact C-N 3.32Å
120	S	84.3	Confident	83.9	Confident	104 Å²	104	67.9 Å²	67.9	73%	0.727	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	1.5	178.2	-53.6	0	0	0	0	113.6	G118 P122	G118-S120 VanDerWaalsContact C-N 3.26Å; G118-S120 PolarHBondContact O-N 2.8Å; S120-P122 VanDerWaalsContact O-CD 3.29Å; S120-P122 WeakPolarHBondContact O-CD 3.48Å
121	T	81.8	Confident	82.9	Confident	54 Å²	54	64.8 Å²	64.8	33%	0.331	35%	0.349	S	S	.	.			trans	-68.2	119.1	-179.2	-46.7	0	0	0	0	109.1	T102 R103 I116 G118 D119	T102-T121 CarbonylContact C-O 3.53Å; T102-T121 WeakPolarHBondContact CA-O 3.26Å; R103-T121 PolarHBondContact N-O 3.03Å; I116-T121 HydrophobicContact CG2-CG2 3.79Å; G118-T121 WeakPolarHBondContact CA-OG1 3.48Å; G118-T121 WeakPolarHBondContact O-CB 3.26Å; G118-T121 PolarHBondContact O-N 3.21Å; G118-T121 PolarHBondContact O-OG1 2.79Å; D119-T121 VanDerWaalsContact C-N 3.32Å
122	P	85.4	Confident	81.8	Confident	70 Å²	70	66.6 Å²	66.6	46%	0.455	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	139	176.6	31.5	-33.2	0	0	0	110.5	Y100 S120	Y100-P122 HydrophobicContact CD1-CB 3.87Å; Y100-P122 HydrophobicContact CG-CB 4.33Å; S120-P122 VanDerWaalsContact O-CD 3.29Å; S120-P122 WeakPolarHBondContact O-CD 3.48Å
123	I	87.6	Confident	80.8	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	119.8	173.7	-52.8	175.4	0	0	0	107.1	Y100 I101 P113 I116 F125 T142 Y146	Y100-I123 WeakPolarHBondContact CA-O 3.27Å; I101-I123 PolarHBondContact N-O 2.8Å; I101-I123 PolarHBondContact O-N 3.43Å; P113-I123 HydrophobicContact CB-CD1 3.44Å; P113-I123 VanDerWaalsContact CB-CD1 3.44Å; P113-I123 HydrophobicContact CG-CD1 3.47Å; P113-I123 VanDerWaalsContact CG-CD1 3.47Å; I116-I123 HydrophobicContact CG1-CD1 4.08Å; I123-F125 HydrophobicContact CB-CD2 4.34Å; I123-F125 HydrophobicContact CB-CE2 3.86Å; I123-F125 HydrophobicContact CG2-CD2 3.99Å; I123-F125 HydrophobicContact CG2-CE2 3.48Å; I123-F125 VanDerWaalsContact CG2-CE2 3.48Å; I123-F125 HydrophobicContact CG2-CZ 3.83Å; I123-T142 HydrophobicContact CG2-CG2 4.2Å; I123-Y146 HydrophobicContact CG2-CD2 4.42Å
124	L	89.1	Confident	80.7	Confident	10 Å²	10	69.7 Å²	69.7	5%	0.052	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	119.2	175.5	-175.8	58.8	0	0	0	109.6	R98 Y100 S139 V140 F162	R98-L124 HydrophobicContact CB-CD1 4.18Å; Y100-L124 HydrophobicContact CD1-CB 3.87Å; Y100-L124 HydrophobicContact CD1-CD1 4.05Å; Y100-L124 HydrophobicContact CE1-CB 3.62Å; Y100-L124 HydrophobicContact CE1-CD1 3.91Å; Y100-L124 HydrophobicContact CE1-CD2 4.44Å; Y100-L124 HydrophobicContact CE1-CG 4.19Å; Y100-L124 HydrophobicContact CE2-CD1 4.43Å; Y100-L124 HydrophobicContact CG-CD1 4.36Å; L124-S139 CarbonylContact O-C 3.54Å; L124-S139 VanDerWaalsContact O-CA 3.23Å; L124-S139 WeakPolarHBondContact O-CA 3.25Å; L124-V140 HydrophobicContact CD2-CB 4.08Å; L124-V140 HydrophobicContact CG-CB 4.18Å; L124-V140 HydrophobicContact CG-CG2 4.23Å; L124-V140 PolarHBondContact O-N 2.9Å; L124-F162 HydrophobicContact CD1-CB 3.74Å; L124-F162 HydrophobicContact CD1-CD1 4Å; L124-F162 HydrophobicContact CD1-CD2 4.35Å; L124-F162 HydrophobicContact CD1-CG 3.77Å; L124-F162 HydrophobicContact CD2-CD1 4.32Å; L124-F162 HydrophobicContact CD2-CE1 4.29Å
125	F	90	Very high	80.7	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	147.1	173.8	-79.5	-79	0	0	0	111.5	R98 F99 I101 F111 I123 C137 T138 A148 F150	R98-F125 CarbonylContact C-O 3.59Å; R98-F125 WeakPolarHBondContact CA-O 3.1Å; F99-F125 HydrophobicContact CD1-CB 4.36Å; F99-F125 HydrophobicContact CE1-CB 3.87Å; F99-F125 HydrophobicContact CE2-CB 4.17Å; F99-F125 HydrophobicContact CE2-CD2 4.43Å; F99-F125 HydrophobicContact CZ-CB 3.76Å; F99-F125 HydrophobicContact CZ-CG 4.38Å; F99-F125 PolarHBondContact N-O 3.44Å; F99-F125 PolarHBondContact O-N 3.48Å; I101-F125 HydrophobicContact CG2-CD2 3.54Å; I101-F125 HydrophobicContact CG2-CE2 3.57Å; F111-F125 HydrophobicContact CD1-CZ 4.27Å; F111-F125 HydrophobicContact CE1-CE2 4.43Å; F111-F125 AromaticContact CE1-CZ 3.65Å; F111-F125 HydrophobicContact CE1-CZ 3.65Å; F111-F125 HydrophobicContact CZ-CZ 4.27Å; I123-F125 HydrophobicContact CB-CD2 4.34Å; I123-F125 HydrophobicContact CB-CE2 3.86Å; I123-F125 HydrophobicContact CG2-CD2 3.99Å; I123-F125 HydrophobicContact CG2-CE2 3.48Å; I123-F125 VanDerWaalsContact CG2-CE2 3.48Å; I123-F125 HydrophobicContact CG2-CZ 3.83Å; F125-C137 HydrophobicContact CB-CB 3.93Å; F125-C137 HydrophobicContact CD1-CB 3.54Å; F125-C137 WeakPolarHBondContact CD1-O 3.42Å; F125-C137 HydrophobicContact CE1-CB 4.32Å; F125-C137 HydrophobicContact CG-CB 3.93Å; F125-T138 WeakPolarHBondContact CA-O 3.47Å; F125-A148 HydrophobicContact CD1-CB 4.46Å; F125-A148 HydrophobicContact CE1-CB 3.7Å; F125-A148 HydrophobicContact CZ-CB 3.86Å; F125-F150 HydrophobicContact CD1-CE2 4.32Å; F125-F150 AromaticContact CD2-CE2 3.92Å; F125-F150 HydrophobicContact CD2-CE2 3.92Å; F125-F150 HydrophobicContact CD2-CZ 4.37Å; F125-F150 HydrophobicContact CE1-CE2 4.29Å; F125-F150 AromaticContact CE2-CE2 3.87Å; F125-F150 HydrophobicContact CE2-CE2 3.87Å; F125-F150 AromaticContact CE2-CZ 3.99Å; F125-F150 HydrophobicContact CE2-CZ 3.99Å; F125-F150 HydrophobicContact CG-CE2 4.12Å; F125-F150 HydrophobicContact CZ-CE2 4.06Å; F125-F150 HydrophobicContact CZ-CZ 4.28Å
126	N	89.2	Confident	81	Confident	40 Å²	40	63.5 Å²	63.5	21%	0.214	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	124.7	163.4	-174.7	48.7	0	0	0	109.2	R98 C137 T138 V140	R98-N126 HydrophobicContact CG-CB 4.22Å; N126-C137 VanDerWaalsContact O-CA 3.28Å; N126-C137 WeakPolarHBondContact O-CA 3.41Å; N126-T138 PolarHBondContact N-O 3.18Å; N126-T138 PolarHBondContact O-N 3.24Å; N126-V140 HydrophobicContact CB-CG2 3.86Å
127	A	87.6	Confident	81.3	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	123.9	-176.8	0	0	0	0	0	112	G96 L97 F99 Y135	G96-A127 PolarHBondContact N-O 3.12Å; L97-A127 HydrophobicContact CB-CB 4.13Å; L97-A127 WeakPolarHBondContact O-CB 3.48Å; L97-A127 PolarHBondContact O-N 2.94Å; F99-A127 HydrophobicContact CE1-CB 4.18Å; A127-Y135 HydrophobicContact CB-CD1 3.78Å; A127-Y135 HydrophobicContact CB-CE1 4.5Å; A127-Y135 HydrophobicContact CB-CG 4.26Å
128	E	83.9	Confident	81.8	Confident	95 Å²	95	54 Å²	54	44%	0.444	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	124.8	172	-65.4	176.3	-174.2	0	0	108.8	I136	E128-I136 WeakPolarHBondContact CA-O 3.5Å; E128-I136 WeakPolarHBondContact CB-O 3.3Å; E128-I136 PolarHBondContact N-O 3.18Å; E128-I136 PolarHBondContact O-N 3.03Å
129	R	74.6	Confident	82.1	Confident	143 Å²	143	53 Å²	53	54%	0.54	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	131.2	-175.7	-168.4	174.3	-176.7	-177.3	6.9	110	V95 D131 Y135	V95-R129 HydrophobicContact CG2-CB 3.47Å; V95-R129 VanDerWaalsContact CG2-CB 3.47Å; R129-D131 WeakPolarHBondContact CG-O 3.43Å; R129-D131 PolarHBondContact NE-O 3.12Å; R129-Y135 HydrophobicContact CB-CD1 4.18Å; R129-Y135 HydrophobicContact CB-CE1 3.78Å; R129-Y135 HydrophobicContact CG-CE1 4.11Å
130	K	68.6	Low	81.6	Confident	127 Å²	127	52.9 Å²	52.9	55%	0.552	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.4	-44.1	172.7	-156.9	-157.7	-166.1	-179.9	0	112.3	I136	K130-I136 HydrophobicContact CB-CD1 4Å; K130-I136 HydrophobicContact CB-CG1 4.16Å; K130-I136 HydrophobicContact CD-CD1 3.62Å; K130-I136 HydrophobicContact CD-CG1 4.39Å; K130-I136 HydrophobicContact CG-CD1 3.96Å
131	D	68.1	Low	80.5	Confident	97 Å²	97	51.7 Å²	51.7	52%	0.519	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	176.6	-173.8	-66.4	-53.6	0	0	0	110.8	R129 D133	R129-D131 WeakPolarHBondContact CG-O 3.43Å; R129-D131 PolarHBondContact NE-O 3.12Å; D131-D133 PolarHBondContact O-N 3.41Å
132	A	65.4	Low	79.5	Confident	68 Å²	68	51 Å²	51	56%	0.562	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	121.4	167.3	0	0	0	0	0	108.2	V134	A132-V134 PolarHBondContact O-N 2.88Å
133	D	69.8	Low	78.6	Confident	99 Å²	99	55.8 Å²	55.8	53%	0.529	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.3	4.2	173.7	-36.8	-30.9	0	0	0	117.5	D131 N151 D152	D131-D133 PolarHBondContact O-N 3.41Å; D133-N151 WeakPolarHBondContact O-CA 3.44Å; D133-N151 WeakPolarHBondContact O-CB 3.34Å; D133-D152 VanDerWaalsContact C-OD1 3.27Å; D133-D152 VanDerWaalsContact CA-OD1 3.28Å; D133-D152 WeakPolarHBondContact CA-OD1 3.46Å; D133-D152 PolarHBondContact O-N 2.94Å
134	V	81.8	Confident	77.6	Confident	50 Å²	50	62 Å²	62	30%	0.303	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	125	175.9	-176.1	0	0	0	0	111.7	A132 R149	A132-V134 PolarHBondContact O-N 2.88Å; V134-R149 HydrophobicContact CG1-CB 4.31Å
135	Y	84.1	Confident	77.3	Confident	5 Å²	5	68.6 Å²	68.6	2%	0.02	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	134.4	174.9	-70.3	-88.3	0	0	0	111.3	I93 A127 R129 R149 F150 D152 I155	I93-Y135 HydrophobicContact CB-CE2 3.71Å; I93-Y135 HydrophobicContact CD1-CE2 4.22Å; I93-Y135 HydrophobicContact CG2-CD1 4.07Å; I93-Y135 HydrophobicContact CG2-CD2 3.82Å; I93-Y135 HydrophobicContact CG2-CE1 3.58Å; I93-Y135 HydrophobicContact CG2-CE2 3.29Å; I93-Y135 HydrophobicContact CG2-CG 4.2Å; I93-Y135 PolarHBondContact O-OH 3.21Å; A127-Y135 HydrophobicContact CB-CD1 3.78Å; A127-Y135 HydrophobicContact CB-CE1 4.5Å; A127-Y135 HydrophobicContact CB-CG 4.26Å; R129-Y135 HydrophobicContact CB-CD1 4.18Å; R129-Y135 HydrophobicContact CB-CE1 3.78Å; R129-Y135 HydrophobicContact CG-CE1 4.11Å; Y135-R149 WeakPolarHBondContact O-CA 3.29Å; Y135-F150 PolarHBondContact N-O 3.43Å; Y135-F150 PolarHBondContact O-N 2.98Å; Y135-D152 WeakPolarHBondContact CE2-OD1 3.41Å; Y135-I155 HydrophobicContact CD2-CD1 3.78Å; Y135-I155 HydrophobicContact CG-CD1 3.97Å
136	I	86.9	Confident	77.1	Confident	44 Å²	44	69.6 Å²	69.6	23%	0.226	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	116.7	161.3	-66.9	178.5	0	0	0	106.7	E128 K130 A148	E128-I136 WeakPolarHBondContact CA-O 3.5Å; E128-I136 WeakPolarHBondContact CB-O 3.3Å; E128-I136 PolarHBondContact N-O 3.18Å; E128-I136 PolarHBondContact O-N 3.03Å; K130-I136 HydrophobicContact CB-CD1 4Å; K130-I136 HydrophobicContact CB-CG1 4.16Å; K130-I136 HydrophobicContact CD-CD1 3.62Å; K130-I136 HydrophobicContact CD-CG1 4.39Å; K130-I136 HydrophobicContact CG-CD1 3.96Å; I136-A148 WeakPolarHBondContact CA-O 3.3Å
137	C	87.5	Confident	77.1	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	126.6	-176.1	-68.3	0	0	0	0	109.8	F99 F125 N126 F147 A148 F150	F99-C137 HydrophobicContact CZ-CB 4.36Å; F125-C137 HydrophobicContact CB-CB 3.93Å; F125-C137 HydrophobicContact CD1-CB 3.54Å; F125-C137 WeakPolarHBondContact CD1-O 3.42Å; F125-C137 HydrophobicContact CE1-CB 4.32Å; F125-C137 HydrophobicContact CG-CB 3.93Å; N126-C137 VanDerWaalsContact O-CA 3.28Å; N126-C137 WeakPolarHBondContact O-CA 3.41Å; C137-F147 WeakPolarHBondContact O-CA 3.22Å; C137-A148 HydrophobicContact CB-CB 4.46Å; C137-A148 PolarHBondContact N-O 3.02Å; C137-A148 PolarHBondContact O-N 3.06Å; C137-F150 HydrophobicContact CB-CD2 3.71Å; C137-F150 HydrophobicContact CB-CE2 4Å
138	T	88.2	Confident	77.2	Confident	16 Å²	16	73.7 Å²	73.7	10%	0.098	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	132.1	177.2	-54.9	0	0	0	0	110	F125 N126 K145 Y146 F147	F125-T138 WeakPolarHBondContact CA-O 3.47Å; N126-T138 PolarHBondContact N-O 3.18Å; N126-T138 PolarHBondContact O-N 3.24Å; T138-K145 HydrophobicContact CG2-CD 4.28Å; T138-K145 HydrophobicContact CG2-CG 3.93Å; T138-Y146 VanDerWaalsContact CA-O 3.32Å; T138-Y146 WeakPolarHBondContact CA-O 3.29Å; T138-F147 HydrophobicContact CG2-CD1 4.3Å; T138-F147 HydrophobicContact CG2-CE1 3.9Å; T138-F147 HydrophobicContact CG2-CZ 4.25Å; T138-F147 WeakPolarHBondContact OG1-CE1 3.48Å
139	S	87.4	Confident	77.4	Confident	11 Å²	11	77.6 Å²	77.6	8%	0.077	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	144.6	177.7	68.7	0	0	0	0	112.3	L124 T142 Y144 Y146	L124-S139 CarbonylContact O-C 3.54Å; L124-S139 VanDerWaalsContact O-CA 3.23Å; L124-S139 WeakPolarHBondContact O-CA 3.25Å; S139-T142 PolarHBondContact OG-OG1 2.89Å; S139-Y144 PolarHBondContact OG-O 3.17Å; S139-Y146 PolarHBondContact N-O 3.22Å; S139-Y146 PolarHBondContact OG-N 3.46Å
140	V	73.2	Confident	78.1	Confident	77 Å²	77	70.8 Å²	70.8	47%	0.467	36%	0.358	S	S	.	.	S	Bend	trans	-108.4	-26.4	-172.4	-164.7	0	0	0	0	112.9	L124 N126	L124-V140 HydrophobicContact CD2-CB 4.08Å; L124-V140 HydrophobicContact CG-CB 4.18Å; L124-V140 HydrophobicContact CG-CG2 4.23Å; L124-V140 PolarHBondContact O-N 2.9Å; N126-V140 HydrophobicContact CB-CG2 3.86Å
141	S	60.1	Low	79	Confident	80 Å²	80	67.7 Å²	67.7	56%	0.559	35%	0.348	S	S	*	.	S	Bend	trans	-134.4	30.9	-166.5	80.4	0	0	0	0	115.3
142	T	60.3	Low	79.7	Confident	38 Å²	38	65.1 Å²	65.1	23%	0.233	33%	0.334	C	S	.	.	S	Bend	trans	-119.8	148.7	177.8	47.8	0	0	0	0	110.2	I116 I123 S139 Y144 Y146	I116-T142 HydrophobicContact CD1-CG2 4.22Å; I123-T142 HydrophobicContact CG2-CG2 4.2Å; S139-T142 PolarHBondContact OG-OG1 2.89Å; T142-Y144 WeakPolarHBondContact CB-O 3.29Å; T142-Y144 PolarHBondContact O-N 3.26Å; T142-Y144 PolarHBondContact OG1-O 2.99Å; T142-Y146 HydrophobicContact CG2-CE2 4.29Å
143	D	66.4	Low	80.5	Confident	171 Å²	171	65 Å²	65	91%	0.914	33%	0.333	S	S	*	.	S	Bend	trans	-55.1	-21.6	174	-65.7	-27	0	0	0	112.5
144	Y	67.8	Low	81.4	Confident	130 Å²	130	61.6 Å²	61.6	51%	0.51	32%	0.315	S	S	.	.	S	Bend	trans	-105.4	138.1	173.8	-57.6	-81	0	0	0	110.7	S139 T142 Y146	S139-Y144 PolarHBondContact OG-O 3.17Å; T142-Y144 WeakPolarHBondContact CB-O 3.29Å; T142-Y144 PolarHBondContact O-N 3.26Å; T142-Y144 PolarHBondContact OG1-O 2.99Å; Y144-Y146 WeakPolarHBondContact CD2-OH 3.05Å; Y144-Y146 PolarHBondContact O-N 2.85Å
145	K	82.2	Confident	81.6	Confident	149 Å²	149	59.5 Å²	59.5	65%	0.648	30%	0.302	S	S	*	.			trans	-88.4	107	169.9	-168.3	171	-175	174.3	0	109.5	T138 F147	T138-K145 HydrophobicContact CG2-CD 4.28Å; T138-K145 HydrophobicContact CG2-CG 3.93Å; K145-F147 HydrophobicContact CD-CE2 4.26Å; K145-F147 HydrophobicContact CD-CZ 4.11Å; K145-F147 HydrophobicContact CG-CE2 4.04Å; K145-F147 HydrophobicContact CG-CZ 4.23Å
146	Y	86.4	Confident	81.4	Confident	21 Å²	21	64 Å²	64	8%	0.082	33%	0.325	C	S	.	.			trans	-92.3	144.9	178.4	-64.2	-66.9	0	0	0	111.2	F111 P113 I114 I116 I123 T138 S139 T142 Y144	F111-Y146 HydrophobicContact CZ-CD1 4.04Å; F111-Y146 HydrophobicContact CZ-CG 4.12Å; P113-Y146 HydrophobicContact CB-CD1 4.23Å; P113-Y146 HydrophobicContact CB-CD2 4.47Å; P113-Y146 HydrophobicContact CB-CE1 3.97Å; P113-Y146 HydrophobicContact CB-CE2 4.22Å; P113-Y146 HydrophobicContact CB-CG 4.48Å; I114-Y146 VanDerWaalsContact O-CE1 3.28Å; I114-Y146 WeakPolarHBondContact O-CE1 3.5Å; I114-Y146 PolarHBondContact O-OH 3.13Å; I116-Y146 HydrophobicContact CD1-CE2 4.26Å; I116-Y146 HydrophobicContact CG1-CE2 4.1Å; I123-Y146 HydrophobicContact CG2-CD2 4.42Å; T138-Y146 VanDerWaalsContact CA-O 3.32Å; T138-Y146 WeakPolarHBondContact CA-O 3.29Å; S139-Y146 PolarHBondContact N-O 3.22Å; S139-Y146 PolarHBondContact OG-N 3.46Å; T142-Y146 HydrophobicContact CG2-CE2 4.29Å; Y144-Y146 WeakPolarHBondContact CD2-OH 3.05Å; Y144-Y146 PolarHBondContact O-N 2.85Å
147	F	88.5	Confident	81.3	Confident	124 Å²	124	68.6 Å²	68.6	54%	0.544	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	112.5	169.9	-66.2	-88.8	0	0	0	108.1	C137 T138 K145	C137-F147 WeakPolarHBondContact O-CA 3.22Å; T138-F147 HydrophobicContact CG2-CD1 4.3Å; T138-F147 HydrophobicContact CG2-CE1 3.9Å; T138-F147 HydrophobicContact CG2-CZ 4.25Å; T138-F147 WeakPolarHBondContact OG1-CE1 3.48Å; K145-F147 HydrophobicContact CD-CE2 4.26Å; K145-F147 HydrophobicContact CD-CZ 4.11Å; K145-F147 HydrophobicContact CG-CE2 4.04Å; K145-F147 HydrophobicContact CG-CZ 4.23Å
148	A	89	Confident	81.3	Confident	2 Å²	2	69.9 Å²	69.9	2%	0.017	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	151.4	-179.4	0	0	0	0	0	110.3	F111 F125 I136 C137 F150	F111-A148 HydrophobicContact CB-CB 4.49Å; F111-A148 HydrophobicContact CD1-CB 3.77Å; F111-A148 HydrophobicContact CD2-CB 3.71Å; F111-A148 HydrophobicContact CE1-CB 3.96Å; F111-A148 HydrophobicContact CE2-CB 3.87Å; F111-A148 HydrophobicContact CG-CB 3.69Å; F111-A148 HydrophobicContact CZ-CB 4.03Å; F125-A148 HydrophobicContact CD1-CB 4.46Å; F125-A148 HydrophobicContact CE1-CB 3.7Å; F125-A148 HydrophobicContact CZ-CB 3.86Å; I136-A148 WeakPolarHBondContact CA-O 3.3Å; C137-A148 HydrophobicContact CB-CB 4.46Å; C137-A148 PolarHBondContact N-O 3.02Å; C137-A148 PolarHBondContact O-N 3.06Å; A148-F150 HydrophobicContact CB-CD2 3.86Å; A148-F150 HydrophobicContact CB-CE2 3.29Å; A148-F150 HydrophobicContact CB-CZ 3.66Å
149	R	90.1	Very high	81.1	Confident	177 Å²	177	69.9 Å²	69.9	67%	0.668	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.2	114	167.5	-70.3	-178.8	-174.2	156.6	3.8	107.4	V134 Y135	V134-R149 HydrophobicContact CG1-CB 4.31Å; Y135-R149 WeakPolarHBondContact O-CA 3.29Å
150	F	89.2	Confident	80.8	Confident	0 Å²	0	74 Å²	74	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	138.4	174.3	-63.3	-71.2	0	0	0	108.8	F99 I101 C109 F111 F125 Y135 C137 A148 D154 I155	F99-F150 HydrophobicContact CE2-CD2 4.31Å; F99-F150 HydrophobicContact CE2-CE2 4.28Å; F99-F150 AromaticContact CZ-CD2 3.75Å; F99-F150 HydrophobicContact CZ-CD2 3.75Å; F99-F150 HydrophobicContact CZ-CE2 4.02Å; F99-F150 HydrophobicContact CZ-CG 4.47Å; I101-F150 HydrophobicContact CD1-CE1 3.82Å; I101-F150 HydrophobicContact CD1-CZ 4.14Å; I101-F150 HydrophobicContact CG2-CZ 4.06Å; C109-F150 HydrophobicContact CB-CD1 3.59Å; C109-F150 HydrophobicContact CB-CE1 3.51Å; F111-F150 HydrophobicContact CB-CE1 4.42Å; F111-F150 HydrophobicContact CD1-CZ 4.1Å; F125-F150 HydrophobicContact CD1-CE2 4.32Å; F125-F150 AromaticContact CD2-CE2 3.92Å; F125-F150 HydrophobicContact CD2-CE2 3.92Å; F125-F150 HydrophobicContact CD2-CZ 4.37Å; F125-F150 HydrophobicContact CE1-CE2 4.29Å; F125-F150 AromaticContact CE2-CE2 3.87Å; F125-F150 HydrophobicContact CE2-CE2 3.87Å; F125-F150 AromaticContact CE2-CZ 3.99Å; F125-F150 HydrophobicContact CE2-CZ 3.99Å; F125-F150 HydrophobicContact CG-CE2 4.12Å; F125-F150 HydrophobicContact CZ-CE2 4.06Å; F125-F150 HydrophobicContact CZ-CZ 4.28Å; Y135-F150 PolarHBondContact N-O 3.43Å; Y135-F150 PolarHBondContact O-N 2.98Å; C137-F150 HydrophobicContact CB-CD2 3.71Å; C137-F150 HydrophobicContact CB-CE2 4Å; A148-F150 HydrophobicContact CB-CD2 3.86Å; A148-F150 HydrophobicContact CB-CE2 3.29Å; A148-F150 HydrophobicContact CB-CZ 3.66Å; F150-D154 HydrophobicContact CB-CB 4.39Å; F150-D154 HydrophobicContact CD1-CB 4.28Å; F150-I155 HydrophobicContact CB-CD1 3.92Å; F150-I155 HydrophobicContact CB-CG1 3.54Å; F150-I155 HydrophobicContact CG-CG1 4.28Å
151	N	86.5	Confident	81.2	Confident	63 Å²	63	73.9 Å²	73.9	34%	0.337	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	167.1	167	65.2	53.3	0	0	0	110.4	D133 A153 D154 I155	D133-N151 WeakPolarHBondContact O-CA 3.44Å; D133-N151 WeakPolarHBondContact O-CB 3.34Å; N151-A153 PolarHBondContact O-N 2.95Å; N151-A153 WeakPolarHBondContact OD1-CA 3.46Å; N151-A153 WeakPolarHBondContact OD1-CB 3.39Å; N151-A153 PolarHBondContact OD1-N 3.28Å; N151-D154 VanDerWaalsContact CG-OD2 3.25Å; N151-D154 VanDerWaalsContact ND2-CG 3.35Å; N151-D154 PolarHBondContact ND2-OD2 2.97Å; N151-D154 PolarHBondContact O-N 3.2Å; N151-D154 VanDerWaalsContact OD1-CG 3.25Å; N151-D154 PolarHBondContact OD1-N 3.41Å; N151-D154 PolarHBondContact OD1-OD2 3.35Å; N151-I155 PolarHBondContact O-N 2.89Å; N151-I155 VanDerWaalsContact O-N 3.16Å
152	D	83.3	Confident	81.8	Confident	42 Å²	42	73.1 Å²	73.1	23%	0.225	36%	0.361	C	S	.	.	H	α-helix	trans	-56.6	-40.3	-179.1	-70.5	27.6	0	0	0	112.3	I93 D133 Y135 D154 I155 M156	I93-D152 HydrophobicContact CD1-CB 3.93Å; D133-D152 VanDerWaalsContact C-OD1 3.27Å; D133-D152 VanDerWaalsContact CA-OD1 3.28Å; D133-D152 WeakPolarHBondContact CA-OD1 3.46Å; D133-D152 PolarHBondContact O-N 2.94Å; Y135-D152 WeakPolarHBondContact CE2-OD1 3.41Å; D152-D154 PolarHBondContact O-N 2.76Å; D152-I155 PolarHBondContact O-N 3.32Å; D152-M156 WeakPolarHBondContact O-CB 2.9Å; D152-M156 VanDerWaalsContact O-CG 3.32Å; D152-M156 WeakPolarHBondContact O-CG 3.49Å; D152-M156 PolarHBondContact O-N 3.38Å
153	A	82.3	Confident	81.7	Confident	66 Å²	66	76.4 Å²	76.4	55%	0.545	38%	0.377	S	S	.	.	H	α-helix	trans	-65.3	-39.5	180	0	0	0	0	0	112	N151 M156 M157	N151-A153 PolarHBondContact O-N 2.95Å; N151-A153 WeakPolarHBondContact OD1-CA 3.46Å; N151-A153 WeakPolarHBondContact OD1-CB 3.39Å; N151-A153 PolarHBondContact OD1-N 3.28Å; A153-M156 PolarHBondContact O-N 3.45Å; A153-M157 WeakPolarHBondContact O-CB 3.45Å; A153-M157 PolarHBondContact O-N 2.98Å
154	D	87.4	Confident	80.7	Confident	28 Å²	28	71.1 Å²	71.1	15%	0.15	35%	0.348	C	S	.	.	H	α-helix	trans	-65.5	-45.8	178.3	-69.6	-25.5	0	0	0	111	C109 F150 N151 D152 M157 F158	C109-D154 HydrophobicContact CB-CB 4.25Å; F150-D154 HydrophobicContact CB-CB 4.39Å; F150-D154 HydrophobicContact CD1-CB 4.28Å; N151-D154 VanDerWaalsContact CG-OD2 3.25Å; N151-D154 VanDerWaalsContact ND2-CG 3.35Å; N151-D154 PolarHBondContact ND2-OD2 2.97Å; N151-D154 PolarHBondContact O-N 3.2Å; N151-D154 VanDerWaalsContact OD1-CG 3.25Å; N151-D154 PolarHBondContact OD1-N 3.41Å; N151-D154 PolarHBondContact OD1-OD2 3.35Å; D152-D154 PolarHBondContact O-N 2.76Å; D154-M157 PolarHBondContact O-N 3.35Å; D154-F158 HydrophobicContact CB-CD2 4.39Å; D154-F158 VanDerWaalsContact O-CB 3.31Å; D154-F158 WeakPolarHBondContact O-CB 3.4Å; D154-F158 WeakPolarHBondContact O-CD2 3.35Å; D154-F158 PolarHBondContact O-N 2.87Å
155	I	86.8	Confident	79.3	Confident	6 Å²	6	69.5 Å²	69.5	3%	0.031	35%	0.351	C	S	.	.	H	α-helix	trans	-63.9	-44.9	177.8	-61.1	179.1	0	0	0	109.9	I93 L97 F99 Y135 F150 N151 D152 G159	I93-I155 HydrophobicContact CD1-CB 3.75Å; I93-I155 HydrophobicContact CD1-CD1 4.2Å; I93-I155 HydrophobicContact CD1-CG1 4.48Å; I93-I155 HydrophobicContact CD1-CG2 3.9Å; I93-I155 HydrophobicContact CG1-CG2 4.35Å; I93-I155 HydrophobicContact CG2-CD1 4.3Å; L97-I155 HydrophobicContact CD2-CG2 3.96Å; F99-I155 HydrophobicContact CD1-CG2 4.07Å; F99-I155 HydrophobicContact CD2-CG2 4.27Å; F99-I155 HydrophobicContact CE1-CD1 3.86Å; F99-I155 HydrophobicContact CE1-CG1 4.15Å; F99-I155 HydrophobicContact CE1-CG2 4.14Å; F99-I155 HydrophobicContact CE2-CG1 4.24Å; F99-I155 HydrophobicContact CE2-CG2 4.34Å; F99-I155 HydrophobicContact CG-CG2 4.14Å; F99-I155 HydrophobicContact CZ-CD1 3.92Å; F99-I155 HydrophobicContact CZ-CG1 3.79Å; F99-I155 HydrophobicContact CZ-CG2 4.28Å; Y135-I155 HydrophobicContact CD2-CD1 3.78Å; Y135-I155 HydrophobicContact CG-CD1 3.97Å; F150-I155 HydrophobicContact CB-CD1 3.92Å; F150-I155 HydrophobicContact CB-CG1 3.54Å; F150-I155 HydrophobicContact CG-CG1 4.28Å; N151-I155 PolarHBondContact O-N 2.89Å; N151-I155 VanDerWaalsContact O-N 3.16Å; D152-I155 PolarHBondContact O-N 3.32Å; I155-G159 WeakPolarHBondContact O-CA 3.36Å; I155-G159 PolarHBondContact O-N 3.26Å
156	M	80.8	Confident	76.9	Confident	100 Å²	100	66 Å²	66	49%	0.493	35%	0.351	S	S	.	.	H	α-helix	trans	-67.6	-35.3	179	-71.6	-162.8	-176.6	0	0	113	I93 D152 A153	I93-M156 HydrophobicContact CD1-CE 4.23Å; I93-M156 HydrophobicContact CD1-CG 4.13Å; I93-M156 HydrophobicContact CG1-CE 4.12Å; D152-M156 WeakPolarHBondContact O-CB 2.9Å; D152-M156 VanDerWaalsContact O-CG 3.32Å; D152-M156 WeakPolarHBondContact O-CG 3.49Å; D152-M156 PolarHBondContact O-N 3.38Å; A153-M156 PolarHBondContact O-N 3.45Å
157	M	83.9	Confident	74.4	Confident	139 Å²	139	71.1 Å²	71.1	69%	0.685	39%	0.386	S	S	*	.	H	α-helix	trans	-82	-36.3	-176.1	-177.2	174.9	169.4	0	0	112.7	A153 D154	A153-M157 WeakPolarHBondContact O-CB 3.45Å; A153-M157 PolarHBondContact O-N 2.98Å; D154-M157 PolarHBondContact O-N 3.35Å
158	F	86.7	Confident	71.8	Confident	27 Å²	27	72.2 Å²	72.2	12%	0.118	40%	0.403	C	S	.	.	H	α-helix	trans	-120.1	-19.2	-169.8	-60.5	-59	0	0	0	114.6	I101 N105 K108 C109 D154	I101-F158 HydrophobicContact CD1-CB 3.71Å; I101-F158 HydrophobicContact CG1-CB 4.16Å; N105-F158 HydrophobicContact CB-CB 3.93Å; N105-F158 HydrophobicContact CB-CD1 4.08Å; N105-F158 HydrophobicContact CB-CG 4.15Å; K108-F158 HydrophobicContact CB-CE1 4.28Å; K108-F158 HydrophobicContact CB-CE2 4.13Å; K108-F158 HydrophobicContact CB-CZ 3.83Å; K108-F158 HydrophobicContact CD-CD1 4.3Å; K108-F158 HydrophobicContact CD-CE1 3.57Å; K108-F158 HydrophobicContact CD-CZ 3.86Å; C109-F158 WeakPolarHBondContact SG-CD2 3.02Å; D154-F158 HydrophobicContact CB-CD2 4.39Å; D154-F158 VanDerWaalsContact O-CB 3.31Å; D154-F158 WeakPolarHBondContact O-CB 3.4Å; D154-F158 WeakPolarHBondContact O-CD2 3.35Å; D154-F158 PolarHBondContact O-N 2.87Å
159	G	84.2	Confident	69.3	Low	17 Å²	17	76.1 Å²	76.1	18%	0.175	44%	0.435	C	S	.	.			trans	-79.9	143.9	176.4	0	0	0	0	0	111.4	Y100 I155	Y100-G159 CarbonylContact O-C 3.55Å; Y100-G159 VanDerWaalsContact O-CA 3.32Å; Y100-G159 WeakPolarHBondContact O-CA 3.39Å; I155-G159 WeakPolarHBondContact O-CA 3.36Å; I155-G159 PolarHBondContact O-N 3.26Å
160	T	82.2	Confident	66.4	Low	98 Å²	98	74.5 Å²	74.5	60%	0.601	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.5	115.9	166.8	-54.5	0	0	0	0	106.8	F99 Y100 F162	F99-T160 CarbonylContact C-O 3.54Å; F99-T160 VanDerWaalsContact CA-O 3.23Å; F99-T160 WeakPolarHBondContact CA-O 3.46Å; F99-T160 WeakPolarHBondContact CB-O 3.49Å; Y100-T160 PolarHBondContact N-O 2.99Å; Y100-T160 PolarHBondContact O-N 2.99Å; T160-F162 PolarHBondContact O-N 2.72Å
161	K	80.9	Confident	63.6	Low	73 Å²	73	81 Å²	81	32%	0.317	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.1	131	-179.4	-176.7	174.5	-174.3	-142.6	0	109.8	E91 L97 D163	E91-K161 VanDerWaalsContact OE2-CE 3.24Å; E91-K161 WeakPolarHBondContact OE2-CE 3.47Å; E91-K161 IonicContact OE2-NZ 3.52Å; E91-K161 PolarHBondContact OE2-NZ 3.02Å; L97-K161 HydrophobicContact CD1-CD 4.15Å; L97-K161 HydrophobicContact CD1-CG 3.8Å; K161-D163 WeakPolarHBondContact CD-OD1 3.35Å; K161-D163 WeakPolarHBondContact CE-OD1 3.38Å; K161-D163 WeakPolarHBondContact CG-OD1 3.41Å; K161-D163 IonicContact NZ-OD1 2.7Å; K161-D163 PolarHBondContact NZ-OD1 2.9Å; K161-D163 PolarHBondContact O-N 2.86Å
162	F	73.8	Confident	60.7	Low	64 Å²	64	86.7 Å²	86.7	28%	0.281	50%	0.499	S	S	.	.			trans	-92	92.2	169.3	-173.7	-115.9	0	0	0	106.8	R98 Y100 L124 T160 I164	R98-F162 HydrophobicContact CB-CB 3.8Å; R98-F162 HydrophobicContact CB-CD1 3.89Å; R98-F162 HydrophobicContact CB-CG 4.31Å; R98-F162 WeakPolarHBondContact O-CA 3.36Å; R98-F162 WeakPolarHBondContact O-CB 3.4Å; R98-F162 PolarHBondContact O-N 3.01Å; Y100-F162 HydrophobicContact CD2-CD2 4.06Å; Y100-F162 HydrophobicContact CE2-CB 4.45Å; Y100-F162 AromaticContact CE2-CD2 3.24Å; Y100-F162 HydrophobicContact CE2-CD2 3.24Å; Y100-F162 AromaticContact CE2-CE2 3.7Å; Y100-F162 HydrophobicContact CE2-CE2 3.7Å; Y100-F162 HydrophobicContact CE2-CG 4.15Å; Y100-F162 AromaticContact CZ-CD2 3.77Å; Y100-F162 AromaticContact CZ-CE2 3.87Å; Y100-F162 VanDerWaalsContact OH-CE2 3.32Å; Y100-F162 WeakPolarHBondContact OH-CE2 3.43Å; L124-F162 HydrophobicContact CD1-CB 3.74Å; L124-F162 HydrophobicContact CD1-CD1 4Å; L124-F162 HydrophobicContact CD1-CD2 4.35Å; L124-F162 HydrophobicContact CD1-CG 3.77Å; L124-F162 HydrophobicContact CD2-CD1 4.32Å; L124-F162 HydrophobicContact CD2-CE1 4.29Å; T160-F162 PolarHBondContact O-N 2.72Å; F162-I164 HydrophobicContact CD1-CD1 3.65Å; F162-I164 HydrophobicContact CD1-CG1 3.48Å; F162-I164 VanDerWaalsContact CD1-CG1 3.48Å; F162-I164 HydrophobicContact CE1-CD1 3.45Å; F162-I164 VanDerWaalsContact CE1-CD1 3.45Å; F162-I164 HydrophobicContact CE1-CG1 3.31Å; F162-I164 HydrophobicContact CZ-CG1 4.24Å; F162-I164 PolarHBondContact O-N 3.43Å
163	D	57.8	Low	58.2	Low	108 Å²	108	94.4 Å²	94.4	58%	0.578	53%	0.53	S	S	*	.			trans	-70.7	98.8	175.3	-73	-53.1	0	0	0	109.4	K161	K161-D163 WeakPolarHBondContact CD-OD1 3.35Å; K161-D163 WeakPolarHBondContact CE-OD1 3.38Å; K161-D163 WeakPolarHBondContact CG-OD1 3.41Å; K161-D163 IonicContact NZ-OD1 2.7Å; K161-D163 PolarHBondContact NZ-OD1 2.9Å; K161-D163 PolarHBondContact O-N 2.86Å
164	I	46.1	Very low	55.6	Low	60 Å²	60	99.9 Å²	99.9	31%	0.308	55%	0.548	S	S	.	.	P	Polyproline II helix	trans	-95.4	128.8	152.5	-54.7	169	0	0	0	103.7	F162 A166	F162-I164 HydrophobicContact CD1-CD1 3.65Å; F162-I164 HydrophobicContact CD1-CG1 3.48Å; F162-I164 VanDerWaalsContact CD1-CG1 3.48Å; F162-I164 HydrophobicContact CE1-CD1 3.45Å; F162-I164 VanDerWaalsContact CE1-CD1 3.45Å; F162-I164 HydrophobicContact CE1-CG1 3.31Å; F162-I164 HydrophobicContact CZ-CG1 4.24Å; F162-I164 PolarHBondContact O-N 3.43Å; I164-A166 PolarHBondContact O-N 2.85Å; I164-A166 VanDerWaalsContact O-N 3.08Å
165	V	36.4	Very low	53.1	Low	95 Å²	95	105.4 Å²	105.4	58%	0.576	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-53.4	124.1	178.1	-163.9	0	0	0	0	109	D181	V165-D181 HydrophobicContact CB-CB 4.32Å; V165-D181 VanDerWaalsContact CB-CG 3.44Å; V165-D181 WeakPolarHBondContact CB-OD1 3.24Å; V165-D181 VanDerWaalsContact CG1-CG 3.49Å; V165-D181 WeakPolarHBondContact CG1-OD1 3.41Å; V165-D181 WeakPolarHBondContact CG2-OD1 3.36Å
166	A	32.7	Very low	50.7	Low	77 Å²	77	112.3 Å²	112.3	64%	0.636	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-68	148.8	-150.7	0	0	0	0	0	114	I164	I164-A166 PolarHBondContact O-N 2.85Å; I164-A166 VanDerWaalsContact O-N 3.08Å
167	P	33.6	Very low	49.4	Very low	127 Å²	127	113.2 Å²	113.2	83%	0.825	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-82.2	130.5	168.6	31.1	-27.6	0	0	0	111.1
168	V	34.9	Very low	48.5	Very low	147 Å²	147	109 Å²	109	89%	0.891	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-76.4	128.8	171.2	-178.3	0	0	0	0	109.6
169	A	35.4	Very low	47.5	Very low	84 Å²	84	114.4 Å²	114.4	69%	0.694	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-93.7	140.7	173.9	0	0	0	0	0	112.2
170	D	29.6	Very low	46.8	Very low	144 Å²	144	120 Å²	120	77%	0.77	66%	0.659	S	S	*	*	S	Bend	trans	63.4	92.2	158.4	-80.5	-9.7	0	0	0	120.5
171	N	29.9	Very low	46.1	Very low	136 Å²	136	116.9 Å²	116.9	73%	0.727	64%	0.639	S	S	*	*	S	Bend		152.3	110.4	104.8	-84	-45.5	0	0	0	111.4
172	H	26.6	Very low	45.6	Very low	183 Å²	183	118.1 Å²	118.1	85%	0.847	65%	0.647	S	S	*	*	S	Bend	trans	50.9	77	159.8	-77.8	72.6	0	0	0	116.8
173	K	30.8	Very low	45.9	Very low	203 Å²	203	120.4 Å²	120.4	88%	0.883	66%	0.658	S	S	*	*			trans	-178.5	138.9	140.9	-101.3	161.2	-176.2	-175.5	0	108.9	D175	K173-D175 PolarHBondContact O-N 3.48Å
174	I	27.1	Very low	46.8	Very low	182 Å²	182	116.4 Å²	116.4	93%	0.933	64%	0.643	S	S	*	*			trans	-60.1	112.4	173.3	-62.6	160.5	0	0	0	106.7
175	D	34.4	Very low	48.4	Very low	144 Å²	144	117.8 Å²	117.8	77%	0.77	65%	0.651	S	S	*	*			trans	-122	135.5	176.3	-155.7	5.7	0	0	0	110.4	K173	K173-D175 PolarHBondContact O-N 3.48Å
176	I	37.9	Very low	50.7	Low	151 Å²	151	116.7 Å²	116.7	77%	0.774	64%	0.641	S	S	*	*			trans	-78.1	131.4	-162.7	-5.8	178.4	0	0	0	107.3	S178	I176-S178 PolarHBondContact O-N 3.01Å; I176-S178 VanDerWaalsContact O-N 3.13Å
177	N	52.5	Low	53.3	Low	118 Å²	118	116.9 Å²	116.9	63%	0.631	63%	0.631	S	S	*	*			trans	-42.6	124	169.4	-77.6	-35	0	0	0	108.7	D179	N177-D179 PolarHBondContact O-N 3.14Å
178	S	64.6	Low	55.7	Low	51 Å²	51	115.5 Å²	115.5	36%	0.357	62%	0.616	S	S	.	*			trans	-57.2	136.2	178.9	86.7	0	0	0	0	108.3	I176 I180 D181 M182	I176-S178 PolarHBondContact O-N 3.01Å; I176-S178 VanDerWaalsContact O-N 3.13Å; S178-I180 PolarHBondContact O-N 3.22Å; S178-D181 PolarHBondContact O-N 2.93Å; S178-D181 PolarHBondContact OG-N 3.18Å; S178-D181 PolarHBondContact OG-OD1 3.08Å; S178-D181 PolarHBondContact OG-OD2 3.32Å; S178-M182 PolarHBondContact O-N 3.36Å; S178-M182 VanDerWaalsContact O-N 3.07Å
179	D	66	Low	58.1	Low	141 Å²	141	112.6 Å²	112.6	75%	0.754	60%	0.596	S	S	*	*	H	α-helix	trans	-54.4	-29	-177.6	-69.8	-30.1	0	0	0	111.4	N177 H183	N177-D179 PolarHBondContact O-N 3.14Å; D179-H183 WeakPolarHBondContact O-CB 3.39Å; D179-H183 PolarHBondContact O-N 3.49Å
180	I	68.9	Low	60.7	Low	135 Å²	135	109.2 Å²	109.2	69%	0.692	57%	0.566	S	S	*	*	H	α-helix	trans	-62.3	-46.1	174.7	-60.5	174.8	0	0	0	111.2	S178 H183 G184	S178-I180 PolarHBondContact O-N 3.22Å; I180-H183 PolarHBondContact O-N 3.14Å; I180-G184 PolarHBondContact O-N 3.39Å
181	D	67.6	Low	63.6	Low	31 Å²	31	107.7 Å²	107.7	17%	0.166	55%	0.554	C	S	.	*	H	α-helix	trans	-72.5	-41.9	-177.6	-56.1	-25.4	0	0	0	111.1	V165 S178 H183 G184 N185	V165-D181 HydrophobicContact CB-CB 4.32Å; V165-D181 VanDerWaalsContact CB-CG 3.44Å; V165-D181 WeakPolarHBondContact CB-OD1 3.24Å; V165-D181 VanDerWaalsContact CG1-CG 3.49Å; V165-D181 WeakPolarHBondContact CG1-OD1 3.41Å; V165-D181 WeakPolarHBondContact CG2-OD1 3.36Å; S178-D181 PolarHBondContact O-N 2.93Å; S178-D181 PolarHBondContact OG-N 3.18Å; S178-D181 PolarHBondContact OG-OD1 3.08Å; S178-D181 PolarHBondContact OG-OD2 3.32Å; D181-H183 VanDerWaalsContact C-N 3.33Å; D181-G184 PolarHBondContact O-N 3.38Å; D181-N185 WeakPolarHBondContact O-CB 3.16Å; D181-N185 VanDerWaalsContact O-CG 3.24Å; D181-N185 PolarHBondContact O-N 3.39Å; D181-N185 PolarHBondContact O-ND2 3.01Å
182	M	71.1	Confident	66.3	Low	99 Å²	99	104.9 Å²	104.9	49%	0.488	54%	0.539	S	S	.	.	H	α-helix	trans	-59.5	-47	173.6	-177.5	175.8	-90.9	0	0	110.3	S178 N185 I186	S178-M182 PolarHBondContact O-N 3.36Å; S178-M182 VanDerWaalsContact O-N 3.07Å; M182-N185 PolarHBondContact O-N 2.96Å; M182-I186 HydrophobicContact CG-CD1 4.17Å; M182-I186 WeakPolarHBondContact O-CG1 3.46Å; M182-I186 PolarHBondContact O-N 3.33Å; M182-I186 VanDerWaalsContact O-N 3.12Å
183	H	79.8	Confident	69.1	Low	112 Å²	112	98.3 Å²	98.3	52%	0.519	51%	0.512	S	S	.	.	H	α-helix	trans	-62.5	-46.5	177.5	177.4	-97.1	0	0	0	112.5	D179 I180 D181 N185 I186 L187	D179-H183 WeakPolarHBondContact O-CB 3.39Å; D179-H183 PolarHBondContact O-N 3.49Å; I180-H183 PolarHBondContact O-N 3.14Å; D181-H183 VanDerWaalsContact C-N 3.33Å; H183-N185 VanDerWaalsContact C-N 3.34Å; H183-N185 PolarHBondContact O-N 3.01Å; H183-I186 PolarHBondContact O-N 2.92Å; H183-L187 WeakPolarHBondContact CE1-CD1 3.42Å; H183-L187 PolarHBondContact O-N 3.42Å
184	G	77.3	Confident	71.8	Confident	25 Å²	25	91.7 Å²	91.7	26%	0.258	48%	0.482	S	S	.	.	H	α-helix	trans	-59.3	-43	177.7	0	0	0	0	0	112.8	I180 D181 I186 L187 N188	I180-G184 PolarHBondContact O-N 3.39Å; D181-G184 PolarHBondContact O-N 3.38Å; G184-I186 PolarHBondContact O-N 3.48Å; G184-L187 PolarHBondContact O-N 2.87Å; G184-N188 PolarHBondContact O-N 3.14Å; G184-N188 PolarHBondContact O-ND2 3.23Å
185	N	78.7	Confident	74.7	Confident	88 Å²	88	87.1 Å²	87.1	47%	0.471	46%	0.459	S	S	.	.	H	α-helix	trans	-62.6	-41.2	176	-73	-36.4	0	0	0	112.4	D181 M182 H183 N188 N189	D181-N185 WeakPolarHBondContact O-CB 3.16Å; D181-N185 VanDerWaalsContact O-CG 3.24Å; D181-N185 PolarHBondContact O-N 3.39Å; D181-N185 PolarHBondContact O-ND2 3.01Å; M182-N185 PolarHBondContact O-N 2.96Å; H183-N185 VanDerWaalsContact C-N 3.34Å; H183-N185 PolarHBondContact O-N 3.01Å; N185-N188 PolarHBondContact O-N 2.9Å; N185-N189 WeakPolarHBondContact O-CB 3.34Å; N185-N189 PolarHBondContact O-N 3.3Å; N185-N189 PolarHBondContact O-ND2 3.3Å
186	I	85.3	Confident	77.2	Confident	73 Å²	73	86.6 Å²	86.6	37%	0.374	45%	0.449	S	S	.	.	H	α-helix	trans	-61.3	-45.5	175.6	-69.5	165.1	0	0	0	110.7	M182 H183 G184 N189 L190 L248	M182-I186 HydrophobicContact CG-CD1 4.17Å; M182-I186 WeakPolarHBondContact O-CG1 3.46Å; M182-I186 PolarHBondContact O-N 3.33Å; M182-I186 VanDerWaalsContact O-N 3.12Å; H183-I186 PolarHBondContact O-N 2.92Å; G184-I186 PolarHBondContact O-N 3.48Å; I186-N189 PolarHBondContact O-N 3.45Å; I186-L190 HydrophobicContact CG2-CD1 4.19Å; I186-L190 WeakPolarHBondContact O-CG 3.44Å; I186-L190 PolarHBondContact O-N 2.88Å; I186-L248 HydrophobicContact CG2-CD2 3.97Å
187	L	87.4	Confident	79.4	Confident	80 Å²	80	82.7 Å²	82.7	42%	0.419	43%	0.427	S	S	.	.	H	α-helix	trans	-63.7	-42.1	178.8	-69.9	-176.9	0	0	0	112.7	H183 G184 N189 L190 H191	H183-L187 WeakPolarHBondContact CE1-CD1 3.42Å; H183-L187 PolarHBondContact O-N 3.42Å; G184-L187 PolarHBondContact O-N 2.87Å; L187-N189 VanDerWaalsContact C-N 3.35Å; L187-L190 HydrophobicContact CD2-CD1 4.38Å; L187-L190 WeakPolarHBondContact O-CB 3.07Å; L187-L190 PolarHBondContact O-N 3.37Å; L187-H191 PolarHBondContact O-N 2.71Å
188	N	84.2	Confident	80.9	Confident	98 Å²	98	80.4 Å²	80.4	52%	0.524	41%	0.414	S	S	.	.	H	α-helix	trans	-62.3	-43.7	175.8	-71.4	-23.3	0	0	0	111.2	G184 N185 L190 H191 D192	G184-N188 PolarHBondContact O-N 3.14Å; G184-N188 PolarHBondContact O-ND2 3.23Å; N185-N188 PolarHBondContact O-N 2.9Å; N188-L190 VanDerWaalsContact C-N 3.32Å; N188-L190 PolarHBondContact O-N 3.47Å; N188-H191 PolarHBondContact O-N 2.88Å; N188-D192 PolarHBondContact O-N 3.38Å
189	N	85.8	Confident	81.7	Confident	87 Å²	87	88.3 Å²	88.3	47%	0.465	44%	0.436	S	S	.	.	H	α-helix	trans	-62.7	-37.7	176.1	-71.3	-15.8	0	0	0	112.6	N185 I186 L187 T193	N185-N189 WeakPolarHBondContact O-CB 3.34Å; N185-N189 PolarHBondContact O-N 3.3Å; N185-N189 PolarHBondContact O-ND2 3.3Å; I186-N189 PolarHBondContact O-N 3.45Å; L187-N189 VanDerWaalsContact C-N 3.35Å; N189-T193 VanDerWaalsContact O-CB 3.25Å; N189-T193 WeakPolarHBondContact O-CB 3.37Å; N189-T193 PolarHBondContact O-N 2.88Å; N189-T193 PolarHBondContact O-OG1 3.03Å
190	L	88.7	Confident	82.2	Confident	12 Å²	12	87.5 Å²	87.5	6%	0.063	43%	0.432	C	S	.	.	H	α-helix	trans	-64	-45.3	173.7	-77.4	170.2	0	0	0	111.1	I186 L187 N188 T193 Y194 L248 A251 N252 I255	I186-L190 HydrophobicContact CG2-CD1 4.19Å; I186-L190 WeakPolarHBondContact O-CG 3.44Å; I186-L190 PolarHBondContact O-N 2.88Å; L187-L190 HydrophobicContact CD2-CD1 4.38Å; L187-L190 WeakPolarHBondContact O-CB 3.07Å; L187-L190 PolarHBondContact O-N 3.37Å; N188-L190 VanDerWaalsContact C-N 3.32Å; N188-L190 PolarHBondContact O-N 3.47Å; L190-T193 PolarHBondContact O-N 2.94Å; L190-Y194 PolarHBondContact O-N 2.76Å; L190-L248 HydrophobicContact CD2-CB 4.18Å; L190-L248 HydrophobicContact CD2-CD2 3.93Å; L190-L248 VanDerWaalsContact CD2-O 3.29Å; L190-L248 WeakPolarHBondContact CD2-O 3.3Å; L190-L248 HydrophobicContact CG-CD2 4.05Å; L190-A251 HydrophobicContact CD1-CB 4Å; L190-A251 HydrophobicContact CD2-CB 4.15Å; L190-N252 HydrophobicContact CD2-CB 4.15Å; L190-I255 HydrophobicContact CD1-CD1 4.48Å
191	H	90.4	Very high	82.6	Confident	113 Å²	113	88.9 Å²	88.9	52%	0.523	43%	0.43	S	S	.	.	H	α-helix	trans	-64.1	-44.8	178.8	-169.8	63.2	0	0	0	112.4	L187 N188 T193 Y194 I195	L187-H191 PolarHBondContact O-N 2.71Å; N188-H191 PolarHBondContact O-N 2.88Å; H191-T193 VanDerWaalsContact C-N 3.33Å; H191-T193 PolarHBondContact O-N 3.44Å; H191-Y194 WeakPolarHBondContact O-CB 3.28Å; H191-Y194 PolarHBondContact O-N 2.78Å; H191-I195 WeakPolarHBondContact O-CG1 3.31Å; H191-I195 PolarHBondContact O-N 3.18Å
192	D	87.9	Confident	83.4	Confident	76 Å²	76	89 Å²	89	41%	0.406	44%	0.439	S	S	.	.	H	α-helix	trans	-62.4	-41.9	176	-80.8	-5.5	0	0	0	111.9	N188 Y194 I195 K196	N188-D192 PolarHBondContact O-N 3.38Å; D192-Y194 VanDerWaalsContact C-N 3.34Å; D192-I195 PolarHBondContact O-N 2.88Å; D192-K196 WeakPolarHBondContact O-CB 3.4Å; D192-K196 VanDerWaalsContact O-CG 3.29Å; D192-K196 WeakPolarHBondContact O-CG 3.45Å; D192-K196 PolarHBondContact O-N 3.42Å
193	T	84.8	Confident	84	Confident	46 Å²	46	88.6 Å²	88.6	28%	0.282	44%	0.439	S	S	.	.	H	α-helix	trans	-60.4	-44.3	173.8	-64.3	0	0	0	0	111.3	N189 L190 H191 K196 K197	N189-T193 VanDerWaalsContact O-CB 3.25Å; N189-T193 WeakPolarHBondContact O-CB 3.37Å; N189-T193 PolarHBondContact O-N 2.88Å; N189-T193 PolarHBondContact O-OG1 3.03Å; L190-T193 PolarHBondContact O-N 2.94Å; H191-T193 VanDerWaalsContact C-N 3.33Å; H191-T193 PolarHBondContact O-N 3.44Å; T193-K196 PolarHBondContact O-N 3.43Å; T193-K197 HydrophobicContact CG2-CD 3.87Å; T193-K197 HydrophobicContact CG2-CG 4.22Å; T193-K197 WeakPolarHBondContact O-CB 3.43Å; T193-K197 WeakPolarHBondContact O-CG 3.5Å; T193-K197 PolarHBondContact O-N 3.02Å
194	Y	88.4	Confident	84.4	Confident	63 Å²	63	85 Å²	85	25%	0.247	43%	0.429	C	S	.	.	H	α-helix	trans	-58.5	-49.2	175.1	166.1	-104.6	0	0	0	111.3	L190 H191 D192 K196 K197 N198 L256 M259	L190-Y194 PolarHBondContact O-N 2.76Å; H191-Y194 WeakPolarHBondContact O-CB 3.28Å; H191-Y194 PolarHBondContact O-N 2.78Å; D192-Y194 VanDerWaalsContact C-N 3.34Å; Y194-K196 PolarHBondContact O-N 3.19Å; Y194-K197 PolarHBondContact O-N 3.44Å; Y194-N198 HydrophobicContact CD2-CB 4.42Å; Y194-N198 HydrophobicContact CE2-CB 4.08Å; Y194-N198 WeakPolarHBondContact O-CB 3.41Å; Y194-N198 PolarHBondContact O-N 3.09Å; Y194-L256 HydrophobicContact CD2-CD2 3.89Å; Y194-L256 HydrophobicContact CE2-CD2 3.76Å; Y194-M259 HydrophobicContact CE2-CE 4.46Å
195	I	87.1	Confident	85.1	Confident	87 Å²	87	85 Å²	85	45%	0.446	42%	0.421	S	S	.	.	H	α-helix	trans	-58.5	-48.3	179.1	-68.1	167.8	0	0	0	111	H191 D192 R199	H191-I195 WeakPolarHBondContact O-CG1 3.31Å; H191-I195 PolarHBondContact O-N 3.18Å; D192-I195 PolarHBondContact O-N 2.88Å; I195-R199 WeakPolarHBondContact O-CB 3.48Å; I195-R199 PolarHBondContact O-N 3.15Å
196	K	86.8	Confident	85.6	Confident	132 Å²	132	82.3 Å²	82.3	57%	0.574	41%	0.409	S	S	*	.	H	α-helix	trans	-61.8	-52.6	179.8	-70.5	167.6	-174	167.2	0	111.3	D192 T193 Y194 N198 R199 D200	D192-K196 WeakPolarHBondContact O-CB 3.4Å; D192-K196 VanDerWaalsContact O-CG 3.29Å; D192-K196 WeakPolarHBondContact O-CG 3.45Å; D192-K196 PolarHBondContact O-N 3.42Å; T193-K196 PolarHBondContact O-N 3.43Å; Y194-K196 PolarHBondContact O-N 3.19Å; K196-N198 PolarHBondContact O-N 3.45Å; K196-R199 WeakPolarHBondContact O-CB 3.48Å; K196-R199 PolarHBondContact O-N 2.91Å; K196-D200 PolarHBondContact O-N 3.36Å; K196-D200 VanDerWaalsContact O-N 3.09Å
197	K	83.6	Confident	85.9	Confident	69 Å²	69	83.8 Å²	83.8	30%	0.3	42%	0.415	S	S	.	.	H	α-helix	trans	-64.1	-40	179.6	-72.6	-172.9	177.9	-178.5	0	111.8	T193 Y194 R199 D200 Y201 D249	T193-K197 HydrophobicContact CG2-CD 3.87Å; T193-K197 HydrophobicContact CG2-CG 4.22Å; T193-K197 WeakPolarHBondContact O-CB 3.43Å; T193-K197 WeakPolarHBondContact O-CG 3.5Å; T193-K197 PolarHBondContact O-N 3.02Å; Y194-K197 PolarHBondContact O-N 3.44Å; K197-R199 VanDerWaalsContact C-N 3.26Å; K197-R199 PolarHBondContact O-N 3.13Å; K197-D200 PolarHBondContact O-N 3.14Å; K197-D200 VanDerWaalsContact O-N 3.15Å; K197-Y201 HydrophobicContact CB-CD2 3.97Å; K197-Y201 HydrophobicContact CB-CE2 4.26Å; K197-Y201 HydrophobicContact CG-CD2 4.41Å; K197-Y201 HydrophobicContact CG-CE2 4.18Å; K197-Y201 WeakPolarHBondContact O-CB 3.29Å; K197-Y201 VanDerWaalsContact O-CD2 3.23Å; K197-Y201 WeakPolarHBondContact O-CD2 3.14Å; K197-Y201 PolarHBondContact O-N 3.44Å; K197-D249 IonicContact NZ-OD1 3.75Å; K197-D249 PolarHBondContact NZ-OD1 3.39Å
198	N	84.6	Confident	86.1	Confident	70 Å²	70	83.2 Å²	83.2	37%	0.374	41%	0.411	S	S	.	.	H	α-helix	trans	-67	-29	178.1	-168.8	82.2	0	0	0	111.8	Y194 K196 G202	Y194-N198 HydrophobicContact CD2-CB 4.42Å; Y194-N198 HydrophobicContact CE2-CB 4.08Å; Y194-N198 WeakPolarHBondContact O-CB 3.41Å; Y194-N198 PolarHBondContact O-N 3.09Å; K196-N198 PolarHBondContact O-N 3.45Å; N198-G202 WeakPolarHBondContact O-CA 3.34Å; N198-G202 PolarHBondContact O-N 3.3Å; N198-G202 PolarHBondContact OD1-O 2.86Å
199	R	80.8	Confident	86.4	Confident	217 Å²	217	78.7 Å²	78.7	82%	0.819	39%	0.386	S	S	*	.	H	α-helix	trans	-68.8	-41	169.9	-176.8	-178	179.2	176.9	-0.5	112.2	I195 K196 K197	I195-R199 WeakPolarHBondContact O-CB 3.48Å; I195-R199 PolarHBondContact O-N 3.15Å; K196-R199 WeakPolarHBondContact O-CB 3.48Å; K196-R199 PolarHBondContact O-N 2.91Å; K197-R199 VanDerWaalsContact C-N 3.26Å; K197-R199 PolarHBondContact O-N 3.13Å
200	D	77.1	Confident	86.5	Confident	124 Å²	124	80.4 Å²	80.4	66%	0.663	39%	0.391	S	S	*	.	H	α-helix	trans	-79	-40.2	-175.9	-66	-21.5	0	0	0	113.1	K196 K197	K196-D200 PolarHBondContact O-N 3.36Å; K196-D200 VanDerWaalsContact O-N 3.09Å; K197-D200 PolarHBondContact O-N 3.14Å; K197-D200 VanDerWaalsContact O-N 3.15Å
201	Y	77.5	Confident	86.4	Confident	164 Å²	164	86.9 Å²	86.9	64%	0.643	42%	0.421	S	S	*	.	H	α-helix	trans	-101.4	-10.3	-176.3	-61.5	-71.3	0	0	0	113.9	K197 A204	K197-Y201 HydrophobicContact CB-CD2 3.97Å; K197-Y201 HydrophobicContact CB-CE2 4.26Å; K197-Y201 HydrophobicContact CG-CD2 4.41Å; K197-Y201 HydrophobicContact CG-CE2 4.18Å; K197-Y201 WeakPolarHBondContact O-CB 3.29Å; K197-Y201 VanDerWaalsContact O-CD2 3.23Å; K197-Y201 WeakPolarHBondContact O-CD2 3.14Å; K197-Y201 PolarHBondContact O-N 3.44Å; Y201-A204 WeakPolarHBondContact O-CB 3.48Å; Y201-A204 PolarHBondContact O-N 2.96Å
202	G	84.2	Confident	86.3	Confident	35 Å²	35	85.4 Å²	85.4	36%	0.361	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.6	-138.6	-174.8	0	0	0	0	0	112.7	N198 A204	N198-G202 WeakPolarHBondContact O-CA 3.34Å; N198-G202 PolarHBondContact O-N 3.3Å; N198-G202 PolarHBondContact OD1-O 2.86Å; G202-A204 VanDerWaalsContact C-N 3.31Å; G202-A204 PolarHBondContact O-N 3.47Å
203	N	84	Confident	86.2	Confident	90 Å²	90	83 Å²	83	48%	0.481	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	13.1	-179.2	62.6	-33.4	0	0	0	114.2	F205 S206 E207	N203-F205 VanDerWaalsContact C-N 3.25Å; N203-F205 PolarHBondContact O-N 3.26Å; N203-F205 VanDerWaalsContact O-N 3.1Å; N203-S206 WeakPolarHBondContact O-CA 3.42Å; N203-S206 WeakPolarHBondContact O-CB 3.22Å; N203-S206 PolarHBondContact O-N 3.15Å; N203-E207 WeakPolarHBondContact ND2-CG 3.32Å; N203-E207 PolarHBondContact ND2-OE1 3.41Å; N203-E207 PolarHBondContact O-N 3.09Å; N203-E207 PolarHBondContact OD1-OE1 2.87Å
204	A	88.7	Confident	86.3	Confident	37 Å²	37	85.4 Å²	85.4	31%	0.306	42%	0.42	S	S	.	.	H	α-helix	trans	-54.3	-35.6	-172.9	0	0	0	0	0	114.4	Y201 G202 M208	Y201-A204 WeakPolarHBondContact O-CB 3.48Å; Y201-A204 PolarHBondContact O-N 2.96Å; G202-A204 VanDerWaalsContact C-N 3.31Å; G202-A204 PolarHBondContact O-N 3.47Å; A204-M208 WeakPolarHBondContact O-CG 3.41Å; A204-M208 PolarHBondContact O-N 3.48Å
205	F	90.3	Very high	86.3	Confident	24 Å²	24	88 Å²	88	11%	0.105	44%	0.438	C	S	.	.	H	α-helix	trans	-66.2	-43.8	175.3	-174.3	-86.1	0	0	0	111.9	N203 M208 Y209 Y216 Y253 L256 E260	N203-F205 VanDerWaalsContact C-N 3.25Å; N203-F205 PolarHBondContact O-N 3.26Å; N203-F205 VanDerWaalsContact O-N 3.1Å; F205-M208 PolarHBondContact O-N 3.05Å; F205-Y209 AromaticContact CE1-CD2 3.79Å; F205-Y209 HydrophobicContact CE1-CD2 3.79Å; F205-Y209 HydrophobicContact CZ-CD2 4.13Å; F205-Y209 WeakPolarHBondContact O-CB 3.26Å; F205-Y209 PolarHBondContact O-N 2.93Å; F205-Y216 HydrophobicContact CD2-CD1 4.38Å; F205-Y216 AromaticContact CD2-CE1 3.65Å; F205-Y216 HydrophobicContact CD2-CE1 3.65Å; F205-Y216 HydrophobicContact CE2-CD1 4.1Å; F205-Y216 AromaticContact CE2-CE1 3.75Å; F205-Y216 HydrophobicContact CE2-CE1 3.75Å; F205-Y216 HydrophobicContact CG-CE1 4.23Å; F205-Y216 HydrophobicContact CZ-CD1 4.38Å; F205-Y216 HydrophobicContact CZ-CE1 4.43Å; F205-Y253 HydrophobicContact CD2-CD1 4.22Å; F205-Y253 HydrophobicContact CD2-CE1 4.18Å; F205-Y253 AromaticContact CE2-CD1 3.72Å; F205-Y253 HydrophobicContact CE2-CD1 3.72Å; F205-Y253 HydrophobicContact CE2-CE1 4.07Å; F205-L256 HydrophobicContact CD1-CB 3.86Å; F205-L256 HydrophobicContact CD1-CD1 4.49Å; F205-L256 HydrophobicContact CD2-CB 4.36Å; F205-L256 HydrophobicContact CD2-CD1 3.97Å; F205-L256 HydrophobicContact CE1-CB 3.59Å; F205-L256 HydrophobicContact CE2-CB 4.13Å; F205-L256 HydrophobicContact CE2-CD1 4.32Å; F205-L256 HydrophobicContact CG-CB 4.25Å; F205-L256 HydrophobicContact CG-CD1 4.07Å; F205-L256 HydrophobicContact CZ-CB 3.73Å; F205-E260 HydrophobicContact CD1-CG 3.83Å; F205-E260 HydrophobicContact CE1-CB 4.38Å; F205-E260 HydrophobicContact CE1-CG 3.75Å
206	S	90.5	Very high	86.5	Confident	31 Å²	31	85.9 Å²	85.9	22%	0.217	43%	0.425	C	S	.	.	H	α-helix	trans	-64.3	-40.5	179.9	-59.5	0	0	0	0	111.8	N203 Y209 E210 E260	N203-S206 WeakPolarHBondContact O-CA 3.42Å; N203-S206 WeakPolarHBondContact O-CB 3.22Å; N203-S206 PolarHBondContact O-N 3.15Å; S206-Y209 PolarHBondContact O-N 3.5Å; S206-E210 WeakPolarHBondContact O-CB 3.21Å; S206-E210 PolarHBondContact O-N 2.88Å; S206-E260 WeakPolarHBondContact CB-OE1 3.4Å; S206-E260 PolarHBondContact OG-OE1 3.1Å
207	E	90.4	Very high	86.7	Confident	104 Å²	104	79.6 Å²	79.6	49%	0.486	40%	0.398	S	S	.	.	H	α-helix	trans	-61.3	-51.1	176	-67.9	178.6	168.4	0	0	111.5	N203 Y209 E210 E211	N203-E207 WeakPolarHBondContact ND2-CG 3.32Å; N203-E207 PolarHBondContact ND2-OE1 3.41Å; N203-E207 PolarHBondContact O-N 3.09Å; N203-E207 PolarHBondContact OD1-OE1 2.87Å; E207-Y209 VanDerWaalsContact C-N 3.34Å; E207-Y209 PolarHBondContact O-N 2.95Å; E207-E210 WeakPolarHBondContact O-CB 3.24Å; E207-E210 PolarHBondContact O-N 3.03Å; E207-E211 PolarHBondContact O-N 3.04Å; E207-E211 VanDerWaalsContact O-N 3.12Å
208	M	91.7	Very high	87.1	Confident	68 Å²	68	83.4 Å²	83.4	34%	0.335	41%	0.411	S	S	.	.	H	α-helix	trans	-65	-36.9	179.3	-68.1	-60.9	-56.9	0	0	112.7	A204 F205 E210 E211 L212 Y216	A204-M208 WeakPolarHBondContact O-CG 3.41Å; A204-M208 PolarHBondContact O-N 3.48Å; F205-M208 PolarHBondContact O-N 3.05Å; M208-E210 VanDerWaalsContact C-N 3.31Å; M208-E211 PolarHBondContact O-N 3.17Å; M208-L212 HydrophobicContact CE-CD1 3.78Å; M208-L212 WeakPolarHBondContact O-CB 3.44Å; M208-L212 PolarHBondContact O-N 3.24Å; M208-Y216 HydrophobicContact CB-CD1 3.69Å; M208-Y216 HydrophobicContact CB-CD2 3.95Å; M208-Y216 HydrophobicContact CB-CE1 3.36Å; M208-Y216 HydrophobicContact CB-CE2 3.66Å; M208-Y216 HydrophobicContact CB-CG 3.97Å; M208-Y216 HydrophobicContact CE-CD2 4.31Å; M208-Y216 HydrophobicContact CE-CE2 4.02Å; M208-Y216 HydrophobicContact CG-CE1 4.23Å; M208-Y216 HydrophobicContact CG-CE2 4.06Å
209	Y	91.3	Very high	87.4	Confident	4 Å²	4	81.2 Å²	81.2	2%	0.016	41%	0.405	C	S	.	.	H	α-helix	trans	-66.8	-35.6	173.2	-161.7	-59.4	0	0	0	110.2	F205 S206 E207 E211 G213 T257 E260 R264	F205-Y209 AromaticContact CE1-CD2 3.79Å; F205-Y209 HydrophobicContact CE1-CD2 3.79Å; F205-Y209 HydrophobicContact CZ-CD2 4.13Å; F205-Y209 WeakPolarHBondContact O-CB 3.26Å; F205-Y209 PolarHBondContact O-N 2.93Å; S206-Y209 PolarHBondContact O-N 3.5Å; E207-Y209 VanDerWaalsContact C-N 3.34Å; E207-Y209 PolarHBondContact O-N 2.95Å; Y209-E211 VanDerWaalsContact C-N 3.3Å; Y209-E211 PolarHBondContact O-N 2.9Å; Y209-G213 WeakPolarHBondContact O-CA 3.45Å; Y209-G213 PolarHBondContact O-N 3.19Å; Y209-T257 HydrophobicContact CE2-CG2 3.83Å; Y209-E260 HydrophobicContact CD1-CB 4.1Å; Y209-E260 HydrophobicContact CD2-CB 3.62Å; Y209-E260 HydrophobicContact CD2-CG 4.13Å; Y209-E260 HydrophobicContact CE1-CB 4.2Å; Y209-E260 HydrophobicContact CE2-CB 3.74Å; Y209-E260 HydrophobicContact CG-CB 3.8Å; Y209-E260 HydrophobicContact CG-CG 4.19Å; Y209-R264 VanDerWaalsContact CD1-NE 3.29Å; Y209-R264 VanDerWaalsContact CD1-NH1 3.28Å; Y209-R264 PolarHBondContact O-NH2 2.94Å
210	E	87.5	Confident	88	Confident	122 Å²	122	73.8 Å²	73.8	57%	0.57	38%	0.379	S	S	*	.	H	α-helix	trans	-61.7	-39.8	177.2	-177.2	155.8	-144.3	0	0	112	S206 E207 M208 K267	S206-E210 WeakPolarHBondContact O-CB 3.21Å; S206-E210 PolarHBondContact O-N 2.88Å; E207-E210 WeakPolarHBondContact O-CB 3.24Å; E207-E210 PolarHBondContact O-N 3.03Å; M208-E210 VanDerWaalsContact C-N 3.31Å; E210-K267 IonicContact OE1-NZ 2.82Å; E210-K267 PolarHBondContact OE1-NZ 2.99Å; E210-K267 IonicContact OE2-NZ 3.64Å
211	E	86.9	Confident	88.9	Confident	149 Å²	149	69.7 Å²	69.7	70%	0.696	36%	0.357	S	S	*	.	H	α-helix	trans	-73.2	-43.9	176.9	-172.9	-179.6	171.7	0	0	113.4	E207 M208 Y209	E207-E211 PolarHBondContact O-N 3.04Å; E207-E211 VanDerWaalsContact O-N 3.12Å; M208-E211 PolarHBondContact O-N 3.17Å; Y209-E211 VanDerWaalsContact C-N 3.3Å; Y209-E211 PolarHBondContact O-N 2.9Å
212	L	87.8	Confident	89.7	Confident	81 Å²	81	68 Å²	68	42%	0.424	35%	0.349	S	S	.	.	H	α-helix	trans	-110.4	-4.6	-166.7	-61.5	176.2	0	0	0	114.2	M208 Y216	M208-L212 HydrophobicContact CE-CD1 3.78Å; M208-L212 WeakPolarHBondContact O-CB 3.44Å; M208-L212 PolarHBondContact O-N 3.24Å; L212-Y216 HydrophobicContact CD1-CD2 3.92Å; L212-Y216 HydrophobicContact CD1-CG 4.41Å
213	G	85.3	Confident	90	Very high	25 Å²	25	70.6 Å²	70.6	26%	0.258	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.1	-152.1	-177.3	0	0	0	0	0	113.9	Y209 N215 Y216	Y209-G213 WeakPolarHBondContact O-CA 3.45Å; Y209-G213 PolarHBondContact O-N 3.19Å; G213-N215 PolarHBondContact O-N 3.37Å; G213-N215 VanDerWaalsContact O-N 3.1Å; G213-Y216 PolarHBondContact O-N 3.43Å; G213-Y216 VanDerWaalsContact O-N 3.15Å
214	I	87.7	Confident	90.4	Very high	97 Å²	97	68 Å²	68	50%	0.497	34%	0.339	S	S	.	.	H	α-helix	trans	-58.8	-24.1	-179	-164.6	167.3	0	0	0	113.1	Y216 G217 Y218	I214-Y216 VanDerWaalsContact C-N 3.26Å; I214-Y216 PolarHBondContact O-N 3.04Å; I214-G217 PolarHBondContact O-N 2.95Å; I214-Y218 PolarHBondContact O-N 3.31Å
215	N	89.3	Confident	90.6	Very high	118 Å²	118	69.6 Å²	69.6	63%	0.631	35%	0.345	S	S	*	.	H	α-helix	trans	-62.9	-32	179	-70.2	-33.6	0	0	0	112.5	G213 G219	G213-N215 PolarHBondContact O-N 3.37Å; G213-N215 VanDerWaalsContact O-N 3.1Å; N215-G219 PolarHBondContact O-N 3.38Å
216	Y	91.4	Very high	90.6	Very high	43 Å²	43	71.5 Å²	71.5	17%	0.169	36%	0.356	C	S	.	.	H	α-helix	trans	-66.6	-45.8	174.2	179.7	-110.5	0	0	0	111.8	F205 M208 L212 G213 I214 G219 K220	F205-Y216 HydrophobicContact CD2-CD1 4.38Å; F205-Y216 AromaticContact CD2-CE1 3.65Å; F205-Y216 HydrophobicContact CD2-CE1 3.65Å; F205-Y216 HydrophobicContact CE2-CD1 4.1Å; F205-Y216 AromaticContact CE2-CE1 3.75Å; F205-Y216 HydrophobicContact CE2-CE1 3.75Å; F205-Y216 HydrophobicContact CG-CE1 4.23Å; F205-Y216 HydrophobicContact CZ-CD1 4.38Å; F205-Y216 HydrophobicContact CZ-CE1 4.43Å; M208-Y216 HydrophobicContact CB-CD1 3.69Å; M208-Y216 HydrophobicContact CB-CD2 3.95Å; M208-Y216 HydrophobicContact CB-CE1 3.36Å; M208-Y216 HydrophobicContact CB-CE2 3.66Å; M208-Y216 HydrophobicContact CB-CG 3.97Å; M208-Y216 HydrophobicContact CE-CD2 4.31Å; M208-Y216 HydrophobicContact CE-CE2 4.02Å; M208-Y216 HydrophobicContact CG-CE1 4.23Å; M208-Y216 HydrophobicContact CG-CE2 4.06Å; L212-Y216 HydrophobicContact CD1-CD2 3.92Å; L212-Y216 HydrophobicContact CD1-CG 4.41Å; G213-Y216 PolarHBondContact O-N 3.43Å; G213-Y216 VanDerWaalsContact O-N 3.15Å; I214-Y216 VanDerWaalsContact C-N 3.26Å; I214-Y216 PolarHBondContact O-N 3.04Å; Y216-G219 PolarHBondContact O-N 2.99Å; Y216-K220 HydrophobicContact CE1-CG 4.46Å; Y216-K220 HydrophobicContact CE2-CG 4.44Å; Y216-K220 VanDerWaalsContact CZ-CE 3.47Å; Y216-K220 WeakPolarHBondContact O-CG 3.23Å; Y216-K220 PolarHBondContact O-N 2.91Å; Y216-K220 VanDerWaalsContact O-N 3.11Å; Y216-K220 VanDerWaalsContact OH-CE 3.22Å; Y216-K220 WeakPolarHBondContact OH-CE 3.29Å
217	G	90.1	Very high	90.4	Very high	0 Å²	0	72.6 Å²	72.6	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-59	-48.8	173.7	0	0	0	0	0	111.9	I214 G219 K220 I221 T257	I214-G217 PolarHBondContact O-N 2.95Å; G217-G219 VanDerWaalsContact C-N 3.34Å; G217-G219 PolarHBondContact O-N 3.29Å; G217-K220 PolarHBondContact O-N 3.14Å; G217-I221 VanDerWaalsContact O-CG1 3.29Å; G217-I221 WeakPolarHBondContact O-CG1 3.42Å; G217-I221 PolarHBondContact O-N 3.48Å; G217-T257 WeakPolarHBondContact CA-OG1 3.4Å
218	Y	92.3	Very high	90.5	Very high	148 Å²	148	69.4 Å²	69.4	58%	0.58	34%	0.342	S	S	*	.	H	α-helix	trans	-55.4	-46.3	175.1	170.2	-104.2	0	0	0	112.3	I214 K220 I221 R222	I214-Y218 PolarHBondContact O-N 3.31Å; Y218-K220 PolarHBondContact O-N 2.85Å; Y218-I221 PolarHBondContact O-N 3.22Å; Y218-R222 VanDerWaalsContact O-CB 3.24Å; Y218-R222 WeakPolarHBondContact O-CB 3.39Å; Y218-R222 PolarHBondContact O-N 3.26Å
219	G	91.5	Very high	90.5	Very high	25 Å²	25	72.7 Å²	72.7	26%	0.258	35%	0.354	S	S	.	.	H	α-helix	trans	-57.5	-48.2	177.5	0	0	0	0	0	112.6	N215 Y216 G217 R222 D223	N215-G219 PolarHBondContact O-N 3.38Å; Y216-G219 PolarHBondContact O-N 2.99Å; G217-G219 VanDerWaalsContact C-N 3.34Å; G217-G219 PolarHBondContact O-N 3.29Å; G219-R222 PolarHBondContact O-N 2.69Å; G219-D223 PolarHBondContact O-N 3.05Å
220	K	93	Very high	90.3	Very high	61 Å²	61	75.8 Å²	75.8	27%	0.265	37%	0.373	S	S	.	.	H	α-helix	trans	-63.6	-43.1	178.7	-67.3	-61	-176.5	-175.6	0	113	Y216 G217 Y218 D223 K224 Y253	Y216-K220 HydrophobicContact CE1-CG 4.46Å; Y216-K220 HydrophobicContact CE2-CG 4.44Å; Y216-K220 VanDerWaalsContact CZ-CE 3.47Å; Y216-K220 WeakPolarHBondContact O-CG 3.23Å; Y216-K220 PolarHBondContact O-N 2.91Å; Y216-K220 VanDerWaalsContact O-N 3.11Å; Y216-K220 VanDerWaalsContact OH-CE 3.22Å; Y216-K220 WeakPolarHBondContact OH-CE 3.29Å; G217-K220 PolarHBondContact O-N 3.14Å; Y218-K220 PolarHBondContact O-N 2.85Å; K220-D223 PolarHBondContact O-N 2.92Å; K220-K224 PolarHBondContact O-N 3.44Å; K220-Y253 HydrophobicContact CB-CD1 3.74Å; K220-Y253 HydrophobicContact CB-CD2 3.93Å; K220-Y253 HydrophobicContact CB-CE1 3.92Å; K220-Y253 HydrophobicContact CB-CE2 4.07Å; K220-Y253 HydrophobicContact CB-CG 3.77Å; K220-Y253 HydrophobicContact CD-CE1 4.16Å; K220-Y253 HydrophobicContact CD-CE2 4.48Å; K220-Y253 HydrophobicContact CG-CD1 4.16Å; K220-Y253 HydrophobicContact CG-CE1 3.92Å
221	I	94.9	Very high	90.4	Very high	38 Å²	38	70.7 Å²	70.7	20%	0.195	35%	0.35	C	S	.	.	H	α-helix	trans	-62.6	-47.1	176.2	-66.5	164.4	0	0	0	109.5	G217 Y218 D223 K224 V225	G217-I221 VanDerWaalsContact O-CG1 3.29Å; G217-I221 WeakPolarHBondContact O-CG1 3.42Å; G217-I221 PolarHBondContact O-N 3.48Å; Y218-I221 PolarHBondContact O-N 3.22Å; I221-D223 VanDerWaalsContact C-N 3.33Å; I221-D223 PolarHBondContact O-N 2.94Å; I221-K224 PolarHBondContact O-N 2.86Å; I221-K224 VanDerWaalsContact O-N 3.14Å; I221-V225 HydrophobicContact CG2-CG2 4.22Å; I221-V225 WeakPolarHBondContact O-CG2 3.47Å; I221-V225 PolarHBondContact O-N 3.41Å
222	R	94.2	Very high	90.4	Very high	128 Å²	128	69.9 Å²	69.9	48%	0.483	34%	0.344	S	S	.	.	H	α-helix	trans	-59	-41.6	178.6	-178.7	177.5	176.6	-85.3	2.5	112.4	Y218 G219 K224 V225 N226	Y218-R222 VanDerWaalsContact O-CB 3.24Å; Y218-R222 WeakPolarHBondContact O-CB 3.39Å; Y218-R222 PolarHBondContact O-N 3.26Å; G219-R222 PolarHBondContact O-N 2.69Å; R222-K224 VanDerWaalsContact C-N 3.34Å; R222-K224 PolarHBondContact O-N 2.93Å; R222-V225 PolarHBondContact O-N 3.02Å; R222-N226 WeakPolarHBondContact O-CB 3.5Å; R222-N226 VanDerWaalsContact O-CG 3.25Å; R222-N226 PolarHBondContact O-N 3.18Å; R222-N226 PolarHBondContact O-ND2 2.91Å
223	D	90.9	Very high	90.3	Very high	90 Å²	90	72 Å²	72	48%	0.481	36%	0.356	S	S	.	.	H	α-helix	trans	-60.3	-43.6	176.3	-72.8	-16.1	0	0	0	111.6	G219 K220 I221 N226 R227	G219-D223 PolarHBondContact O-N 3.05Å; K220-D223 PolarHBondContact O-N 2.92Å; I221-D223 VanDerWaalsContact C-N 3.33Å; I221-D223 PolarHBondContact O-N 2.94Å; D223-N226 PolarHBondContact O-N 3.28Å; D223-R227 PolarHBondContact O-N 2.98Å
224	K	92.7	Very high	90.2	Very high	36 Å²	36	77.7 Å²	77.7	16%	0.157	37%	0.373	C	S	.	.	H	α-helix	trans	-71.2	-38.5	177.7	-64.1	-61.4	173.6	174.3	0	113	K220 I221 R222 N226 R227 I228 D249 C250 Y253	K220-K224 PolarHBondContact O-N 3.44Å; I221-K224 PolarHBondContact O-N 2.86Å; I221-K224 VanDerWaalsContact O-N 3.14Å; R222-K224 VanDerWaalsContact C-N 3.34Å; R222-K224 PolarHBondContact O-N 2.93Å; K224-N226 VanDerWaalsContact C-N 3.31Å; K224-N226 PolarHBondContact O-N 3.36Å; K224-R227 WeakPolarHBondContact O-CB 3.33Å; K224-R227 PolarHBondContact O-N 2.8Å; K224-R227 VanDerWaalsContact O-N 3.14Å; K224-I228 WeakPolarHBondContact O-CD1 3.15Å; K224-I228 VanDerWaalsContact O-CG1 3.3Å; K224-I228 WeakPolarHBondContact O-CG1 3.43Å; K224-I228 PolarHBondContact O-N 2.78Å; K224-D249 HydrophobicContact CD-CB 3.68Å; K224-D249 VanDerWaalsContact CE-OD2 3.24Å; K224-D249 WeakPolarHBondContact CE-OD2 3.5Å; K224-D249 HydrophobicContact CG-CB 4.02Å; K224-D249 IonicContact NZ-OD2 3.18Å; K224-D249 PolarHBondContact NZ-OD2 2.89Å; K224-C250 HydrophobicContact CB-CB 3.85Å; K224-Y253 HydrophobicContact CD-CE2 4.49Å; K224-Y253 HydrophobicContact CG-CD2 3.84Å; K224-Y253 HydrophobicContact CG-CE2 3.96Å
225	V	93.2	Very high	89.4	Confident	70 Å²	70	81.8 Å²	81.8	42%	0.424	39%	0.391	S	S	.	.	H	α-helix	trans	-60.1	-41.4	171.8	172.1	0	0	0	0	111.2	I221 R222 R227 I228 K229	I221-V225 HydrophobicContact CG2-CG2 4.22Å; I221-V225 WeakPolarHBondContact O-CG2 3.47Å; I221-V225 PolarHBondContact O-N 3.41Å; R222-V225 PolarHBondContact O-N 3.02Å; V225-R227 VanDerWaalsContact C-N 3.34Å; V225-R227 PolarHBondContact O-N 3.39Å; V225-I228 PolarHBondContact O-N 2.86Å; V225-K229 WeakPolarHBondContact O-CB 3.36Å; V225-K229 PolarHBondContact O-N 2.7Å
226	N	89.5	Confident	88.7	Confident	63 Å²	63	78.3 Å²	78.3	34%	0.337	38%	0.378	S	S	.	.	H	α-helix	trans	-65.1	-37	175.1	-73.9	-31.9	0	0	0	112.4	R222 D223 K224 K229 T230	R222-N226 WeakPolarHBondContact O-CB 3.5Å; R222-N226 VanDerWaalsContact O-CG 3.25Å; R222-N226 PolarHBondContact O-N 3.18Å; R222-N226 PolarHBondContact O-ND2 2.91Å; D223-N226 PolarHBondContact O-N 3.28Å; K224-N226 VanDerWaalsContact C-N 3.31Å; K224-N226 PolarHBondContact O-N 3.36Å; N226-K229 PolarHBondContact O-N 2.77Å; N226-T230 PolarHBondContact O-N 3.43Å; N226-T230 VanDerWaalsContact O-N 3.12Å; N226-T230 PolarHBondContact O-OG1 3.39Å
227	R	87.8	Confident	87.9	Confident	55 Å²	55	85.6 Å²	85.6	21%	0.208	41%	0.414	C	S	.	.	H	α-helix	trans	-63.3	-48.6	173.8	-172.4	68.5	173.6	128.4	11.5	111.1	D223 K224 V225 K229 T230 L231 E241 A246	D223-R227 PolarHBondContact O-N 2.98Å; K224-R227 WeakPolarHBondContact O-CB 3.33Å; K224-R227 PolarHBondContact O-N 2.8Å; K224-R227 VanDerWaalsContact O-N 3.14Å; V225-R227 VanDerWaalsContact C-N 3.34Å; V225-R227 PolarHBondContact O-N 3.39Å; R227-K229 VanDerWaalsContact C-N 3.32Å; R227-K229 PolarHBondContact O-N 2.79Å; R227-T230 WeakPolarHBondContact O-CB 3.3Å; R227-T230 PolarHBondContact O-N 3.18Å; R227-L231 HydrophobicContact CG-CD1 3.92Å; R227-L231 HydrophobicContact CG-CG 4.44Å; R227-L231 WeakPolarHBondContact O-CG 3.23Å; R227-L231 PolarHBondContact O-N 3.48Å; R227-E241 IonicContact CZ-OE2 2.63Å; R227-E241 IonicContact NE-OE2 3.64Å; R227-E241 PolarHBondContact NE-OE2 2.86Å; R227-E241 PolarHBondContact NH2-O 3.03Å; R227-E241 IonicContact NH2-OE2 2.7Å; R227-A246 HydrophobicContact CB-CB 4.25Å; R227-A246 HydrophobicContact CG-CB 3.8Å
228	I	91.8	Very high	87	Confident	37 Å²	37	89.4 Å²	89.4	19%	0.19	44%	0.437	C	S	.	.	H	α-helix	trans	-56.2	-47.1	174.8	-67.7	158.6	0	0	0	110.4	K224 V225 T230 L231 K232 L243 A246 L247 C250	K224-I228 WeakPolarHBondContact O-CD1 3.15Å; K224-I228 VanDerWaalsContact O-CG1 3.3Å; K224-I228 WeakPolarHBondContact O-CG1 3.43Å; K224-I228 PolarHBondContact O-N 2.78Å; V225-I228 PolarHBondContact O-N 2.86Å; I228-T230 PolarHBondContact O-N 3.01Å; I228-L231 PolarHBondContact O-N 3.3Å; I228-K232 WeakPolarHBondContact O-CB 3.4Å; I228-K232 PolarHBondContact O-N 3.19Å; I228-L243 HydrophobicContact CB-CD1 4.37Å; I228-L243 HydrophobicContact CG1-CD1 4.35Å; I228-L243 HydrophobicContact CG2-CD1 4.11Å; I228-A246 HydrophobicContact CG1-CB 3.9Å; I228-L247 HydrophobicContact CD1-CD2 3.76Å; I228-L247 HydrophobicContact CD1-CG 4.35Å; I228-L247 HydrophobicContact CG1-CD2 4.05Å; I228-L247 HydrophobicContact CG1-CG 4.3Å; I228-L247 HydrophobicContact CG2-CD2 4.31Å; I228-C250 HydrophobicContact CD1-CB 4.05Å
229	K	90.7	Very high	85.5	Confident	136 Å²	136	87 Å²	87	59%	0.591	45%	0.447	S	S	*	.	H	α-helix	trans	-57	-32	176.7	-178.1	-179.9	177.2	-179.1	0	112.9	V225 N226 R227 K232	V225-K229 WeakPolarHBondContact O-CB 3.36Å; V225-K229 PolarHBondContact O-N 2.7Å; N226-K229 PolarHBondContact O-N 2.77Å; R227-K229 VanDerWaalsContact C-N 3.32Å; R227-K229 PolarHBondContact O-N 2.79Å; K229-K232 WeakPolarHBondContact O-CG 3.4Å
230	T	88.7	Confident	84.3	Confident	69 Å²	69	92.3 Å²	92.3	42%	0.423	47%	0.47	S	S	.	.	H	α-helix	trans	-81.5	-43.5	178.7	-55.8	0	0	0	0	111.9	N226 R227 I228 K234	N226-T230 PolarHBondContact O-N 3.43Å; N226-T230 VanDerWaalsContact O-N 3.12Å; N226-T230 PolarHBondContact O-OG1 3.39Å; R227-T230 WeakPolarHBondContact O-CB 3.3Å; R227-T230 PolarHBondContact O-N 3.18Å; I228-T230 PolarHBondContact O-N 3.01Å; T230-K234 PolarHBondContact O-N 2.98Å
231	L	89.4	Confident	83.3	Confident	15 Å²	15	93.5 Å²	93.5	8%	0.079	48%	0.476	C	S	.	.	H	α-helix	trans	-79	-19.9	-174.2	-69.9	179.9	0	0	0	114.1	R227 I228 D233 K234 A236 E241 L243 A246	R227-L231 HydrophobicContact CG-CD1 3.92Å; R227-L231 HydrophobicContact CG-CG 4.44Å; R227-L231 WeakPolarHBondContact O-CG 3.23Å; R227-L231 PolarHBondContact O-N 3.48Å; I228-L231 PolarHBondContact O-N 3.3Å; L231-D233 PolarHBondContact O-N 2.89Å; L231-K234 CarbonylContact C-O 3.56Å; L231-K234 WeakPolarHBondContact CA-O 3.49Å; L231-A236 HydrophobicContact CD2-CB 3.71Å; L231-E241 WeakPolarHBondContact CD1-O 3.44Å; L231-L243 HydrophobicContact CB-CB 4.18Å; L231-L243 HydrophobicContact CB-CD1 3.92Å; L231-L243 HydrophobicContact CD1-CB 4.43Å; L231-A246 HydrophobicContact CD1-CB 4.42Å
232	K	87.2	Confident	82.8	Confident	133 Å²	133	94.1 Å²	94.1	58%	0.578	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-29.1	175.8	74.8	174.9	-167	166.4	0	112.8	I228 K229	I228-K232 WeakPolarHBondContact O-CB 3.4Å; I228-K232 PolarHBondContact O-N 3.19Å; K229-K232 WeakPolarHBondContact O-CG 3.4Å
233	D	85.1	Confident	82.5	Confident	126 Å²	126	91.1 Å²	91.1	67%	0.674	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.7	-13.6	-174.6	-60	-40.8	0	0	0	112.8	L231	L231-D233 PolarHBondContact O-N 2.89Å
234	K	82.3	Confident	82.4	Confident	143 Å²	143	93 Å²	93	62%	0.622	48%	0.482	S	S	*	.	S	Bend	trans	-136.3	138.7	-173.1	-60.9	-179.7	-178.3	178.4	0	110.2	T230 L231	T230-K234 PolarHBondContact O-N 2.98Å; L231-K234 CarbonylContact C-O 3.56Å; L231-K234 WeakPolarHBondContact CA-O 3.49Å
235	E	70.9	Confident	82.1	Confident	184 Å²	184	94.6 Å²	94.6	86%	0.86	49%	0.492	S	S	*	.			trans	-59.8	144.7	170.7	-69.8	-173.3	167.6	0	0	111.2	Q237	E235-Q237 PolarHBondContact O-N 3.29Å; E235-Q237 VanDerWaalsContact O-N 3.11Å
236	A	74.4	Confident	82	Confident	44 Å²	44	91.5 Å²	91.5	36%	0.364	47%	0.474	S	S	.	.			trans	-64.7	112.8	176.9	0	0	0	0	0	109.9	L231 V238	L231-A236 HydrophobicContact CD2-CB 3.71Å; A236-V238 PolarHBondContact O-N 3.2Å
237	Q	74.4	Confident	82.1	Confident	196 Å²	196	92.6 Å²	92.6	92%	0.916	48%	0.479	S	S	*	.	S	Bend	trans	-75.8	-16	174	-64.8	-173	-12.4	0	0	113	E235	E235-Q237 PolarHBondContact O-N 3.29Å; E235-Q237 VanDerWaalsContact O-N 3.11Å
238	V	71.5	Confident	82.3	Confident	81 Å²	81	91.8 Å²	91.8	49%	0.491	48%	0.479	S	S	.	.	S	Bend	trans	-103.2	116	175.2	-179.3	0	0	0	0	107.4	A236 N240 E241	A236-V238 PolarHBondContact O-N 3.2Å; V238-N240 PolarHBondContact O-N 2.98Å; V238-N240 VanDerWaalsContact O-N 3.07Å; V238-E241 PolarHBondContact O-N 3.43Å
239	A	62.1	Low	82.3	Confident	96 Å²	96	91.3 Å²	91.3	79%	0.793	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-21	-169.3	0	0	0	0	0	114.8
240	N	64.8	Low	82.4	Confident	137 Å²	137	85.7 Å²	85.7	73%	0.733	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.5	19.3	-170.9	-60.2	-16.7	0	0	0	113.1	V238	V238-N240 PolarHBondContact O-N 2.98Å; V238-N240 VanDerWaalsContact O-N 3.07Å
241	E	73	Confident	82.7	Confident	86 Å²	86	84.2 Å²	84.2	40%	0.402	45%	0.449	S	S	.	.			trans	-141.3	65.7	173.9	-67.3	-172.2	-166.7	0	0	111.3	R227 L231 V238	R227-E241 IonicContact CZ-OE2 2.63Å; R227-E241 IonicContact NE-OE2 3.64Å; R227-E241 PolarHBondContact NE-OE2 2.86Å; R227-E241 PolarHBondContact NH2-O 3.03Å; R227-E241 IonicContact NH2-OE2 2.7Å; L231-E241 WeakPolarHBondContact CD1-O 3.44Å; V238-E241 PolarHBondContact O-N 3.43Å
242	P	84.9	Confident	82.8	Confident	52 Å²	52	84 Å²	84	34%	0.338	45%	0.448	S	S	.	.			trans	-60.7	167.8	172.1	28.2	-37.2	0	0	0	112.6	E244 D245 A246	P242-E244 PolarHBondContact O-N 3.13Å; P242-D245 VanDerWaalsContact CD-OD2 3.24Å; P242-D245 WeakPolarHBondContact CD-OD2 3.24Å; P242-D245 HydrophobicContact CG-CB 4.09Å; P242-D245 WeakPolarHBondContact CG-OD2 3.41Å; P242-D245 PolarHBondContact O-N 3.27Å; P242-A246 PolarHBondContact O-N 2.98Å
243	L	87.7	Confident	83.2	Confident	65 Å²	65	79.9 Å²	79.9	34%	0.34	43%	0.429	S	S	.	.	H	α-helix	trans	-57.7	-39.3	177.9	175.9	61	0	0	0	112	I228 L231 A246 L247	I228-L243 HydrophobicContact CB-CD1 4.37Å; I228-L243 HydrophobicContact CG1-CD1 4.35Å; I228-L243 HydrophobicContact CG2-CD1 4.11Å; L231-L243 HydrophobicContact CB-CB 4.18Å; L231-L243 HydrophobicContact CB-CD1 3.92Å; L231-L243 HydrophobicContact CD1-CB 4.43Å; L243-A246 WeakPolarHBondContact O-CB 2.91Å; L243-A246 PolarHBondContact O-N 2.65Å; L243-L247 HydrophobicContact CD1-CD1 4.43Å; L243-L247 HydrophobicContact CD1-CG 4.43Å; L243-L247 HydrophobicContact CG-CD1 4.1Å; L243-L247 WeakPolarHBondContact O-CG 3.48Å; L243-L247 PolarHBondContact O-N 3.31Å
244	E	87.5	Confident	83.6	Confident	128 Å²	128	76.8 Å²	76.8	60%	0.598	42%	0.416	S	S	*	.	H	α-helix	trans	-59.3	-46.3	178.4	-172.1	174.4	-178.6	0	0	112.1	P242 A246 L247 L248	P242-E244 PolarHBondContact O-N 3.13Å; E244-A246 VanDerWaalsContact C-N 3.29Å; E244-A246 PolarHBondContact O-N 3.27Å; E244-L247 WeakPolarHBondContact O-CB 3.24Å; E244-L247 PolarHBondContact O-N 2.98Å; E244-L247 VanDerWaalsContact O-N 3.13Å; E244-L248 HydrophobicContact CG-CD1 4.12Å; E244-L248 WeakPolarHBondContact O-CG 3.49Å; E244-L248 PolarHBondContact O-N 3.09Å
245	D	87.7	Confident	84.1	Confident	71 Å²	71	73.4 Å²	73.4	38%	0.38	40%	0.404	S	S	.	.	H	α-helix	trans	-61.7	-38.3	176.7	-74.2	-5.6	0	0	0	111.8	P242 L247 L248 D249	P242-D245 VanDerWaalsContact CD-OD2 3.24Å; P242-D245 WeakPolarHBondContact CD-OD2 3.24Å; P242-D245 HydrophobicContact CG-CB 4.09Å; P242-D245 WeakPolarHBondContact CG-OD2 3.41Å; P242-D245 PolarHBondContact O-N 3.27Å; D245-L247 VanDerWaalsContact C-N 3.35Å; D245-L248 PolarHBondContact O-N 2.88Å; D245-D249 VanDerWaalsContact O-CB 3.29Å; D245-D249 WeakPolarHBondContact O-CB 3.45Å; D245-D249 PolarHBondContact O-N 3.21Å
246	A	90.2	Very high	85.2	Confident	4 Å²	4	65.7 Å²	65.7	3%	0.033	37%	0.369	C	S	.	.	H	α-helix	trans	-66.3	-36.8	176.5	0	0	0	0	0	112.4	R227 I228 L231 P242 L243 E244 C250	R227-A246 HydrophobicContact CB-CB 4.25Å; R227-A246 HydrophobicContact CG-CB 3.8Å; I228-A246 HydrophobicContact CG1-CB 3.9Å; L231-A246 HydrophobicContact CD1-CB 4.42Å; P242-A246 PolarHBondContact O-N 2.98Å; L243-A246 WeakPolarHBondContact O-CB 2.91Å; L243-A246 PolarHBondContact O-N 2.65Å; E244-A246 VanDerWaalsContact C-N 3.29Å; E244-A246 PolarHBondContact O-N 3.27Å; A246-C250 WeakPolarHBondContact O-CB 3.25Å; A246-C250 PolarHBondContact O-N 3.12Å
247	L	91.9	Very high	86	Confident	87 Å²	87	64.4 Å²	64.4	46%	0.455	36%	0.356	S	S	.	.	H	α-helix	trans	-67.3	-47.2	174.7	-70.6	165	0	0	0	111.2	I228 L243 E244 D245 C250 A251	I228-L247 HydrophobicContact CD1-CD2 3.76Å; I228-L247 HydrophobicContact CD1-CG 4.35Å; I228-L247 HydrophobicContact CG1-CD2 4.05Å; I228-L247 HydrophobicContact CG1-CG 4.3Å; I228-L247 HydrophobicContact CG2-CD2 4.31Å; L243-L247 HydrophobicContact CD1-CD1 4.43Å; L243-L247 HydrophobicContact CD1-CG 4.43Å; L243-L247 HydrophobicContact CG-CD1 4.1Å; L243-L247 WeakPolarHBondContact O-CG 3.48Å; L243-L247 PolarHBondContact O-N 3.31Å; E244-L247 WeakPolarHBondContact O-CB 3.24Å; E244-L247 PolarHBondContact O-N 2.98Å; E244-L247 VanDerWaalsContact O-N 3.13Å; D245-L247 VanDerWaalsContact C-N 3.35Å; L247-C250 WeakPolarHBondContact O-CB 3.42Å; L247-C250 PolarHBondContact O-N 3.23Å; L247-A251 PolarHBondContact O-N 3.34Å
248	L	91.5	Very high	86.8	Confident	38 Å²	38	59.3 Å²	59.3	20%	0.199	34%	0.335	C	S	.	.	H	α-helix	trans	-64.1	-43.2	178.4	-69.8	172.2	0	0	0	111.8	I186 L190 E244 D245 C250 A251 N252	I186-L248 HydrophobicContact CG2-CD2 3.97Å; L190-L248 HydrophobicContact CD2-CB 4.18Å; L190-L248 HydrophobicContact CD2-CD2 3.93Å; L190-L248 VanDerWaalsContact CD2-O 3.29Å; L190-L248 WeakPolarHBondContact CD2-O 3.3Å; L190-L248 HydrophobicContact CG-CD2 4.05Å; E244-L248 HydrophobicContact CG-CD1 4.12Å; E244-L248 WeakPolarHBondContact O-CG 3.49Å; E244-L248 PolarHBondContact O-N 3.09Å; D245-L248 PolarHBondContact O-N 2.88Å; L248-C250 VanDerWaalsContact C-N 3.32Å; L248-C250 PolarHBondContact O-N 3.39Å; L248-A251 PolarHBondContact O-N 3.11Å; L248-N252 WeakPolarHBondContact O-CB 3.49Å; L248-N252 PolarHBondContact O-N 3.24Å
249	D	91.5	Very high	87.6	Confident	27 Å²	27	58 Å²	58	14%	0.144	33%	0.325	C	S	.	.	H	α-helix	trans	-63.3	-38.7	175.1	-87.7	-17.5	0	0	0	111.7	K197 K224 D245 N252 Y253	K197-D249 IonicContact NZ-OD1 3.75Å; K197-D249 PolarHBondContact NZ-OD1 3.39Å; K224-D249 HydrophobicContact CD-CB 3.68Å; K224-D249 VanDerWaalsContact CE-OD2 3.24Å; K224-D249 WeakPolarHBondContact CE-OD2 3.5Å; K224-D249 HydrophobicContact CG-CB 4.02Å; K224-D249 IonicContact NZ-OD2 3.18Å; K224-D249 PolarHBondContact NZ-OD2 2.89Å; D245-D249 VanDerWaalsContact O-CB 3.29Å; D245-D249 WeakPolarHBondContact O-CB 3.45Å; D245-D249 PolarHBondContact O-N 3.21Å; D249-N252 PolarHBondContact O-N 3.36Å; D249-Y253 WeakPolarHBondContact O-CD2 3.33Å; D249-Y253 PolarHBondContact O-N 2.84Å
250	C	93.3	Very high	89	Confident	18 Å²	18	54 Å²	54	12%	0.122	29%	0.289	C	S	.	.	H	α-helix	trans	-61.6	-47.4	175.6	-168	0	0	0	0	110.8	K224 I228 A246 L247 L248 N252 Y253 C254	K224-C250 HydrophobicContact CB-CB 3.85Å; I228-C250 HydrophobicContact CD1-CB 4.05Å; A246-C250 WeakPolarHBondContact O-CB 3.25Å; A246-C250 PolarHBondContact O-N 3.12Å; L247-C250 WeakPolarHBondContact O-CB 3.42Å; L247-C250 PolarHBondContact O-N 3.23Å; L248-C250 VanDerWaalsContact C-N 3.32Å; L248-C250 PolarHBondContact O-N 3.39Å; C250-N252 PolarHBondContact O-N 3.31Å; C250-Y253 PolarHBondContact O-N 3.46Å; C250-C254 PolarHBondContact O-N 2.98Å; C250-C254 PolarHBondContact O-SG 3.24Å
251	A	95	Very high	90	Very high	37 Å²	37	51.6 Å²	51.6	31%	0.306	27%	0.271	S	S	.	.	H	α-helix	trans	-59.7	-45.1	175.8	0	0	0	0	0	111.6	L190 L247 L248 Y253 C254 I255	L190-A251 HydrophobicContact CD1-CB 4Å; L190-A251 HydrophobicContact CD2-CB 4.15Å; L247-A251 PolarHBondContact O-N 3.34Å; L248-A251 PolarHBondContact O-N 3.11Å; A251-Y253 PolarHBondContact O-N 2.88Å; A251-C254 WeakPolarHBondContact O-CB 3.47Å; A251-C254 PolarHBondContact O-N 3.01Å; A251-I255 WeakPolarHBondContact O-CG1 3.08Å; A251-I255 PolarHBondContact O-N 3.18Å
252	N	92.9	Very high	90.4	Very high	10 Å²	10	51.8 Å²	51.8	5%	0.053	27%	0.271	C	S	.	.	H	α-helix	trans	-63.4	-40.9	178.2	-169.6	56.6	0	0	0	112.2	L190 L248 D249 C250 I255 L256	L190-N252 HydrophobicContact CD2-CB 4.15Å; L248-N252 WeakPolarHBondContact O-CB 3.49Å; L248-N252 PolarHBondContact O-N 3.24Å; D249-N252 PolarHBondContact O-N 3.36Å; C250-N252 PolarHBondContact O-N 3.31Å; N252-I255 PolarHBondContact O-N 3.06Å; N252-L256 WeakPolarHBondContact O-CB 3.47Å; N252-L256 WeakPolarHBondContact O-CG 3.32Å; N252-L256 PolarHBondContact O-N 3.42Å
253	Y	93.9	Very high	90.4	Very high	48 Å²	48	53.6 Å²	53.6	19%	0.188	27%	0.274	C	S	.	.	H	α-helix	trans	-67.2	-35.1	175.3	-77.4	-52.9	0	0	0	113.2	F205 K220 K224 D249 C250 A251 L256 T257	F205-Y253 HydrophobicContact CD2-CD1 4.22Å; F205-Y253 HydrophobicContact CD2-CE1 4.18Å; F205-Y253 AromaticContact CE2-CD1 3.72Å; F205-Y253 HydrophobicContact CE2-CD1 3.72Å; F205-Y253 HydrophobicContact CE2-CE1 4.07Å; K220-Y253 HydrophobicContact CB-CD1 3.74Å; K220-Y253 HydrophobicContact CB-CD2 3.93Å; K220-Y253 HydrophobicContact CB-CE1 3.92Å; K220-Y253 HydrophobicContact CB-CE2 4.07Å; K220-Y253 HydrophobicContact CB-CG 3.77Å; K220-Y253 HydrophobicContact CD-CE1 4.16Å; K220-Y253 HydrophobicContact CD-CE2 4.48Å; K220-Y253 HydrophobicContact CG-CD1 4.16Å; K220-Y253 HydrophobicContact CG-CE1 3.92Å; K224-Y253 HydrophobicContact CD-CE2 4.49Å; K224-Y253 HydrophobicContact CG-CD2 3.84Å; K224-Y253 HydrophobicContact CG-CE2 3.96Å; D249-Y253 WeakPolarHBondContact O-CD2 3.33Å; D249-Y253 PolarHBondContact O-N 2.84Å; C250-Y253 PolarHBondContact O-N 3.46Å; A251-Y253 PolarHBondContact O-N 2.88Å; Y253-L256 HydrophobicContact CD1-CD1 4.24Å; Y253-T257 VanDerWaalsContact O-CB 3.23Å; Y253-T257 WeakPolarHBondContact O-CB 3.33Å; Y253-T257 PolarHBondContact O-N 2.79Å; Y253-T257 PolarHBondContact O-OG1 3.46Å
254	C	94.9	Very high	90.2	Very high	60 Å²	60	52.9 Å²	52.9	41%	0.405	27%	0.267	S	S	.	.	H	α-helix	trans	-60.4	-46	170.8	-69.1	0	0	0	0	111.1	C250 A251 T257 L258	C250-C254 PolarHBondContact O-N 2.98Å; C250-C254 PolarHBondContact O-SG 3.24Å; A251-C254 WeakPolarHBondContact O-CB 3.47Å; A251-C254 PolarHBondContact O-N 3.01Å; C254-T257 PolarHBondContact O-N 3.38Å; C254-L258 WeakPolarHBondContact O-CB 3.22Å; C254-L258 PolarHBondContact O-N 3.32Å
255	I	93.2	Very high	89.9	Confident	72 Å²	72	47.3 Å²	47.3	37%	0.369	24%	0.241	S	C	.	.	H	α-helix	trans	-63.7	-48.5	178.4	-66	165.6	0	0	0	111	L190 A251 N252 T257 L258 M259	L190-I255 HydrophobicContact CD1-CD1 4.48Å; A251-I255 WeakPolarHBondContact O-CG1 3.08Å; A251-I255 PolarHBondContact O-N 3.18Å; N252-I255 PolarHBondContact O-N 3.06Å; I255-T257 VanDerWaalsContact C-N 3.33Å; I255-T257 PolarHBondContact O-N 3.39Å; I255-L258 WeakPolarHBondContact O-CB 3.32Å; I255-L258 PolarHBondContact O-N 2.89Å; I255-M259 HydrophobicContact CG2-CG 4.37Å; I255-M259 HydrophobicContact CG2-SD 3.99Å; I255-M259 VanDerWaalsContact O-CG 3.3Å; I255-M259 WeakPolarHBondContact O-CG 3.38Å; I255-M259 PolarHBondContact O-N 3.32Å
256	L	92.8	Very high	89.6	Confident	23 Å²	23	45.3 Å²	45.3	12%	0.12	23%	0.23	C	C	.	.	H	α-helix	trans	-59.6	-43.1	177.9	-72.9	175	0	0	0	112	Y194 F205 N252 Y253 M259 E260	Y194-L256 HydrophobicContact CD2-CD2 3.89Å; Y194-L256 HydrophobicContact CE2-CD2 3.76Å; F205-L256 HydrophobicContact CD1-CB 3.86Å; F205-L256 HydrophobicContact CD1-CD1 4.49Å; F205-L256 HydrophobicContact CD2-CB 4.36Å; F205-L256 HydrophobicContact CD2-CD1 3.97Å; F205-L256 HydrophobicContact CE1-CB 3.59Å; F205-L256 HydrophobicContact CE2-CB 4.13Å; F205-L256 HydrophobicContact CE2-CD1 4.32Å; F205-L256 HydrophobicContact CG-CB 4.25Å; F205-L256 HydrophobicContact CG-CD1 4.07Å; F205-L256 HydrophobicContact CZ-CB 3.73Å; N252-L256 WeakPolarHBondContact O-CB 3.47Å; N252-L256 WeakPolarHBondContact O-CG 3.32Å; N252-L256 PolarHBondContact O-N 3.42Å; Y253-L256 HydrophobicContact CD1-CD1 4.24Å; L256-M259 HydrophobicContact CD2-SD 4.39Å; L256-M259 PolarHBondContact O-N 3.49Å; L256-E260 WeakPolarHBondContact O-CB 3.49Å; L256-E260 WeakPolarHBondContact O-CG 3.45Å; L256-E260 PolarHBondContact O-N 2.82Å
257	T	92.3	Very high	89.2	Confident	16 Å²	16	50 Å²	50	10%	0.098	25%	0.25	C	C	.	.	H	α-helix	trans	-61.5	-44.7	175.9	-59.7	0	0	0	0	110.6	Y209 G217 Y253 C254 I255 E260 Y261	Y209-T257 HydrophobicContact CE2-CG2 3.83Å; G217-T257 WeakPolarHBondContact CA-OG1 3.4Å; Y253-T257 VanDerWaalsContact O-CB 3.23Å; Y253-T257 WeakPolarHBondContact O-CB 3.33Å; Y253-T257 PolarHBondContact O-N 2.79Å; Y253-T257 PolarHBondContact O-OG1 3.46Å; C254-T257 PolarHBondContact O-N 3.38Å; I255-T257 VanDerWaalsContact C-N 3.33Å; I255-T257 PolarHBondContact O-N 3.39Å; T257-E260 PolarHBondContact O-N 2.63Å; T257-Y261 VanDerWaalsContact O-CB 3.31Å; T257-Y261 WeakPolarHBondContact O-CB 3.31Å; T257-Y261 PolarHBondContact O-N 3.34Å
258	L	90	Very high	88.6	Confident	90 Å²	90	49.8 Å²	49.8	47%	0.471	25%	0.252	S	S	.	.	H	α-helix	trans	-63.7	-43.8	177.5	179.3	62	0	0	0	112.2	C254 I255 E260 Y261 Q262	C254-L258 WeakPolarHBondContact O-CB 3.22Å; C254-L258 PolarHBondContact O-N 3.32Å; I255-L258 WeakPolarHBondContact O-CB 3.32Å; I255-L258 PolarHBondContact O-N 2.89Å; L258-E260 VanDerWaalsContact C-N 3.3Å; L258-E260 PolarHBondContact O-N 3.02Å; L258-Y261 WeakPolarHBondContact O-CB 3.38Å; L258-Y261 PolarHBondContact O-N 2.84Å; L258-Q262 HydrophobicContact CD1-CG 4.19Å; L258-Q262 WeakPolarHBondContact O-CB 3.4Å; L258-Q262 WeakPolarHBondContact O-CG 3.48Å; L258-Q262 PolarHBondContact O-N 2.98Å
259	M	89.8	Confident	88.1	Confident	54 Å²	54	48.2 Å²	48.2	27%	0.266	24%	0.244	S	C	.	.	H	α-helix	trans	-58.2	-45.4	175.7	-71.2	170	66.3	0	0	111.1	Y194 I255 L256 Q262 K263	Y194-M259 HydrophobicContact CE2-CE 4.46Å; I255-M259 HydrophobicContact CG2-CG 4.37Å; I255-M259 HydrophobicContact CG2-SD 3.99Å; I255-M259 VanDerWaalsContact O-CG 3.3Å; I255-M259 WeakPolarHBondContact O-CG 3.38Å; I255-M259 PolarHBondContact O-N 3.32Å; L256-M259 HydrophobicContact CD2-SD 4.39Å; L256-M259 PolarHBondContact O-N 3.49Å; M259-Q262 PolarHBondContact O-N 3.31Å; M259-K263 WeakPolarHBondContact O-CB 3.46Å; M259-K263 VanDerWaalsContact O-CG 3.23Å; M259-K263 WeakPolarHBondContact O-CG 3.45Å; M259-K263 PolarHBondContact O-N 2.89Å
260	E	91.2	Very high	87.3	Confident	12 Å²	12	52.9 Å²	52.9	6%	0.056	27%	0.269	C	S	.	.	H	α-helix	trans	-69.4	-37.6	179.4	-77	-49.3	131.2	0	0	112.6	F205 S206 Y209 L256 T257 L258 K263 R264	F205-E260 HydrophobicContact CD1-CG 3.83Å; F205-E260 HydrophobicContact CE1-CB 4.38Å; F205-E260 HydrophobicContact CE1-CG 3.75Å; S206-E260 WeakPolarHBondContact CB-OE1 3.4Å; S206-E260 PolarHBondContact OG-OE1 3.1Å; Y209-E260 HydrophobicContact CD1-CB 4.1Å; Y209-E260 HydrophobicContact CD2-CB 3.62Å; Y209-E260 HydrophobicContact CD2-CG 4.13Å; Y209-E260 HydrophobicContact CE1-CB 4.2Å; Y209-E260 HydrophobicContact CE2-CB 3.74Å; Y209-E260 HydrophobicContact CG-CB 3.8Å; Y209-E260 HydrophobicContact CG-CG 4.19Å; L256-E260 WeakPolarHBondContact O-CB 3.49Å; L256-E260 WeakPolarHBondContact O-CG 3.45Å; L256-E260 PolarHBondContact O-N 2.82Å; T257-E260 PolarHBondContact O-N 2.63Å; L258-E260 VanDerWaalsContact C-N 3.3Å; L258-E260 PolarHBondContact O-N 3.02Å; E260-K263 IonicContact OE1-NZ 3.77Å; E260-K263 PolarHBondContact OE1-NZ 2.89Å; E260-R264 VanDerWaalsContact C-NH1 3.28Å; E260-R264 WeakPolarHBondContact O-CG 3.37Å; E260-R264 PolarHBondContact O-N 2.91Å; E260-R264 VanDerWaalsContact O-N 3.16Å; E260-R264 PolarHBondContact O-NH1 3.3Å; E260-R264 IonicContact OE2-CZ 3.38Å; E260-R264 IonicContact OE2-NH1 2.76Å; E260-R264 PolarHBondContact OE2-NH1 3.2Å; E260-R264 IonicContact OE2-NH2 3.84Å; E260-R264 PolarHBondContact OE2-NH2 3.3Å
261	Y	86.2	Confident	86.5	Confident	86 Å²	86	55.9 Å²	55.9	34%	0.337	30%	0.303	S	S	.	.	H	α-helix	trans	-59.5	-52.6	171.3	-178.6	-99.6	0	0	0	111.2	T257 L258 K263 R264 L265 D282	T257-Y261 VanDerWaalsContact O-CB 3.31Å; T257-Y261 WeakPolarHBondContact O-CB 3.31Å; T257-Y261 PolarHBondContact O-N 3.34Å; L258-Y261 WeakPolarHBondContact O-CB 3.38Å; L258-Y261 PolarHBondContact O-N 2.84Å; Y261-K263 PolarHBondContact O-N 3.43Å; Y261-R264 PolarHBondContact O-N 3.43Å; Y261-R264 VanDerWaalsContact O-N 3.09Å; Y261-L265 HydrophobicContact CE1-CD1 4.2Å; Y261-L265 PolarHBondContact O-N 3.04Å; Y261-D282 PolarHBondContact OH-OD2 2.88Å
262	Q	81.2	Confident	85.8	Confident	89 Å²	89	55.6 Å²	55.6	42%	0.416	30%	0.296	S	S	.	.	H	α-helix	trans	-62.4	-41.4	179.2	-71.8	176.1	-9.9	0	0	112.7	L258 M259 R264 L265 L266	L258-Q262 HydrophobicContact CD1-CG 4.19Å; L258-Q262 WeakPolarHBondContact O-CB 3.4Å; L258-Q262 WeakPolarHBondContact O-CG 3.48Å; L258-Q262 PolarHBondContact O-N 2.98Å; M259-Q262 PolarHBondContact O-N 3.31Å; Q262-R264 PolarHBondContact O-N 3.24Å; Q262-L265 WeakPolarHBondContact O-CB 3.43Å; Q262-L265 PolarHBondContact O-N 2.94Å; Q262-L266 PolarHBondContact O-N 2.76Å
263	K	83.9	Confident	85.3	Confident	91 Å²	91	59 Å²	59	40%	0.396	31%	0.314	S	S	.	.	H	α-helix	trans	-60.1	-32.2	174.7	-77.2	173.7	-170.1	172.7	0	112.7	M259 E260 Y261 L266 K267	M259-K263 WeakPolarHBondContact O-CB 3.46Å; M259-K263 VanDerWaalsContact O-CG 3.23Å; M259-K263 WeakPolarHBondContact O-CG 3.45Å; M259-K263 PolarHBondContact O-N 2.89Å; E260-K263 IonicContact OE1-NZ 3.77Å; E260-K263 PolarHBondContact OE1-NZ 2.89Å; Y261-K263 PolarHBondContact O-N 3.43Å; K263-L266 PolarHBondContact O-N 2.93Å; K263-K267 PolarHBondContact O-N 2.68Å
264	R	83.2	Confident	84.8	Confident	49 Å²	49	63.3 Å²	63.3	19%	0.185	33%	0.334	C	S	.	.	H	α-helix	trans	-77.7	-30.2	179.5	-77.9	170.7	-176.3	67.3	4.4	112.8	Y209 E260 Y261 Q262 L266 K267 V268	Y209-R264 VanDerWaalsContact CD1-NE 3.29Å; Y209-R264 VanDerWaalsContact CD1-NH1 3.28Å; Y209-R264 PolarHBondContact O-NH2 2.94Å; E260-R264 VanDerWaalsContact C-NH1 3.28Å; E260-R264 WeakPolarHBondContact O-CG 3.37Å; E260-R264 PolarHBondContact O-N 2.91Å; E260-R264 VanDerWaalsContact O-N 3.16Å; E260-R264 PolarHBondContact O-NH1 3.3Å; E260-R264 IonicContact OE2-CZ 3.38Å; E260-R264 IonicContact OE2-NH1 2.76Å; E260-R264 PolarHBondContact OE2-NH1 3.2Å; E260-R264 IonicContact OE2-NH2 3.84Å; E260-R264 PolarHBondContact OE2-NH2 3.3Å; Y261-R264 PolarHBondContact O-N 3.43Å; Y261-R264 VanDerWaalsContact O-N 3.09Å; Q262-R264 PolarHBondContact O-N 3.24Å; R264-L266 PolarHBondContact O-N 3.31Å; R264-K267 HydrophobicContact CG-CD 4.44Å; R264-K267 WeakPolarHBondContact O-CB 3.48Å; R264-K267 PolarHBondContact O-N 3.13Å; R264-V268 PolarHBondContact O-N 3.07Å
265	L	81.3	Confident	84.4	Confident	12 Å²	12	68.9 Å²	68.9	6%	0.063	35%	0.351	C	S	.	.	H	α-helix	trans	-56.3	-39	167.8	-60.7	178.3	0	0	0	111	Y261 Q262 K267 V268 V280 D282 F287	Y261-L265 HydrophobicContact CE1-CD1 4.2Å; Y261-L265 PolarHBondContact O-N 3.04Å; Q262-L265 WeakPolarHBondContact O-CB 3.43Å; Q262-L265 PolarHBondContact O-N 2.94Å; L265-K267 VanDerWaalsContact C-N 3.34Å; L265-K267 PolarHBondContact O-N 3.17Å; L265-V268 WeakPolarHBondContact O-CG2 3.3Å; L265-V280 HydrophobicContact CB-CG1 4.13Å; L265-V280 HydrophobicContact CD1-CG1 4.04Å; L265-D282 HydrophobicContact CD1-CB 3.98Å; L265-F287 HydrophobicContact CB-CD2 4.15Å; L265-F287 HydrophobicContact CB-CE2 4.04Å; L265-F287 HydrophobicContact CB-CG 4.42Å; L265-F287 HydrophobicContact CB-CZ 4.23Å; L265-F287 HydrophobicContact CD1-CB 4.41Å; L265-F287 HydrophobicContact CD1-CG 4.41Å; L265-F287 HydrophobicContact CD2-CD1 3.87Å; L265-F287 HydrophobicContact CD2-CE1 4.03Å; L265-F287 HydrophobicContact CD2-CG 4.28Å; L265-F287 WeakPolarHBondContact O-CE2 3.36Å; L265-F287 VanDerWaalsContact O-CZ 3.31Å; L265-F287 WeakPolarHBondContact O-CZ 3.37Å
266	L	81.9	Confident	84.2	Confident	29 Å²	29	67.8 Å²	67.8	15%	0.152	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-19.7	174.3	-69.4	173.2	0	0	0	114.2	Q262 K263 R264 I272 V277 V280 V289	Q262-L266 PolarHBondContact O-N 2.76Å; K263-L266 PolarHBondContact O-N 2.93Å; R264-L266 PolarHBondContact O-N 3.31Å; L266-I272 HydrophobicContact CB-CD1 4.29Å; L266-I272 HydrophobicContact CD2-CD1 3.56Å; L266-V277 HydrophobicContact CD2-CG1 4.22Å; L266-V277 HydrophobicContact CD2-CG2 4.15Å; L266-V280 HydrophobicContact CD1-CG2 3.95Å; L266-V280 HydrophobicContact CD2-CG2 3.49Å; L266-V280 VanDerWaalsContact CD2-CG2 3.49Å; L266-V280 HydrophobicContact CG-CG2 3.73Å; L266-V289 HydrophobicContact CD2-CG1 3.86Å; L266-V289 HydrophobicContact CD2-CG2 4.07Å
267	K	81.6	Confident	84	Confident	102 Å²	102	68.3 Å²	68.3	44%	0.443	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-25.3	178.6	-77.8	-169.6	175	-176.3	0	112.4	E210 K263 R264 L265 V269	E210-K267 IonicContact OE1-NZ 2.82Å; E210-K267 PolarHBondContact OE1-NZ 2.99Å; E210-K267 IonicContact OE2-NZ 3.64Å; K263-K267 PolarHBondContact O-N 2.68Å; R264-K267 HydrophobicContact CG-CD 4.44Å; R264-K267 WeakPolarHBondContact O-CB 3.48Å; R264-K267 PolarHBondContact O-N 3.13Å; L265-K267 VanDerWaalsContact C-N 3.34Å; L265-K267 PolarHBondContact O-N 3.17Å; K267-V269 VanDerWaalsContact C-N 3.33Å
268	V	79.2	Confident	84	Confident	82 Å²	82	72.5 Å²	72.5	50%	0.497	37%	0.369	S	S	.	.	S	Bend	trans	-84.3	-11.1	179	-56.4	0	0	0	0	113	R264 L265 F287 H298	R264-V268 PolarHBondContact O-N 3.07Å; L265-V268 WeakPolarHBondContact O-CG2 3.3Å; V268-F287 HydrophobicContact CG2-CE1 4.03Å; V268-F287 HydrophobicContact CG2-CZ 3.55Å; V268-H298 PolarHBondContact O-NE2 3.41Å
269	V	80.1	Confident	84.1	Confident	5 Å²	5	69.4 Å²	69.4	3%	0.03	36%	0.355	C	S	.	.	S	Bend	trans	-95.4	110.4	177.8	-178.1	0	0	0	0	109.1	K267 I272 F287 V289 I296 H298 E304	K267-V269 VanDerWaalsContact C-N 3.33Å; V269-I272 HydrophobicContact CB-CD1 4.17Å; V269-I272 HydrophobicContact CG1-CD1 4.19Å; V269-I272 HydrophobicContact CG1-CG1 4.4Å; V269-I272 HydrophobicContact CG1-CG2 3.57Å; V269-F287 HydrophobicContact CG2-CE2 3.62Å; V269-F287 HydrophobicContact CG2-CZ 3.79Å; V269-V289 HydrophobicContact CG2-CG2 4.27Å; V269-I296 HydrophobicContact CG1-CD1 3.66Å; V269-I296 HydrophobicContact CG1-CG2 4.19Å; V269-H298 HydrophobicContact CG2-CB 4.27Å; V269-E304 WeakPolarHBondContact CG1-OE2 3.38Å
270	D	75.4	Confident	84.2	Confident	125 Å²	125	68.5 Å²	68.5	67%	0.668	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	156	-177.3	-77	-29.5	0	0	0	113	I272 R306	D270-I272 VanDerWaalsContact C-N 3.27Å; D270-I272 PolarHBondContact O-N 3.44Å; D270-I272 VanDerWaalsContact O-N 3.1Å; D270-R306 VanDerWaalsContact O-CZ 3.24Å; D270-R306 PolarHBondContact O-NH1 3.38Å; D270-R306 PolarHBondContact O-NH2 3.31Å
271	G	77	Confident	84.3	Confident	82 Å²	82	68.8 Å²	68.8	85%	0.845	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.9	21.5	167.3	0	0	0	0	0	116.6
272	I	80.9	Confident	84.6	Confident	31 Å²	31	66.2 Å²	66.2	16%	0.159	35%	0.347	C	S	.	.			trans	-95	141.6	172.9	58.8	168.6	0	0	0	112	L266 V269 D270 V277 L291 I296	L266-I272 HydrophobicContact CB-CD1 4.29Å; L266-I272 HydrophobicContact CD2-CD1 3.56Å; V269-I272 HydrophobicContact CB-CD1 4.17Å; V269-I272 HydrophobicContact CG1-CD1 4.19Å; V269-I272 HydrophobicContact CG1-CG1 4.4Å; V269-I272 HydrophobicContact CG1-CG2 3.57Å; D270-I272 VanDerWaalsContact C-N 3.27Å; D270-I272 PolarHBondContact O-N 3.44Å; D270-I272 VanDerWaalsContact O-N 3.1Å; I272-V277 HydrophobicContact CD1-CG2 4.31Å; I272-L291 HydrophobicContact CB-CD2 4.25Å; I272-L291 HydrophobicContact CG2-CD2 4.17Å; I272-I296 HydrophobicContact CG2-CD1 3.44Å; I272-I296 VanDerWaalsContact CG2-CD1 3.44Å
273	N	82.4	Confident	85.1	Confident	81 Å²	81	63 Å²	63	43%	0.433	33%	0.331	S	S	.	.			trans	-88.6	112.9	166	178.7	7.8	0	0	0	109.2	K275 D276	N273-K275 PolarHBondContact O-N 3.39Å; N273-K275 PolarHBondContact OD1-N 3.02Å; N273-D276 VanDerWaalsContact CB-OD2 3.3Å; N273-D276 WeakPolarHBondContact CB-OD2 3.5Å; N273-D276 PolarHBondContact ND2-OD2 2.79Å; N273-D276 PolarHBondContact O-N 2.94Å
274	K	83.1	Confident	85.2	Confident	139 Å²	139	61 Å²	61	60%	0.604	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-56.9	-23.6	-177.9	-67.8	-177.4	-179.7	176.9	0	114	D276	K274-D276 VanDerWaalsContact C-N 3.28Å
275	K	86.3	Confident	85.1	Confident	176 Å²	176	64.6 Å²	64.6	77%	0.765	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-72.9	-21.4	177.2	-63.9	-177.6	179	-178.9	0	113.5	N273	N273-K275 PolarHBondContact O-N 3.39Å; N273-K275 PolarHBondContact OD1-N 3.02Å
276	D	88.2	Confident	85.6	Confident	50 Å²	50	64 Å²	64	27%	0.267	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-94.3	-6.3	-179.1	-59.4	-37.7	0	0	0	112	N273 K274 E278 L291 K292	N273-D276 VanDerWaalsContact CB-OD2 3.3Å; N273-D276 WeakPolarHBondContact CB-OD2 3.5Å; N273-D276 PolarHBondContact ND2-OD2 2.79Å; N273-D276 PolarHBondContact O-N 2.94Å; K274-D276 VanDerWaalsContact C-N 3.28Å; D276-E278 PolarHBondContact O-N 3.37Å; D276-L291 HydrophobicContact CB-CD2 4.28Å; D276-L291 CarbonylContact O-C 3.59Å; D276-L291 WeakPolarHBondContact O-CA 3.41Å; D276-L291 WeakPolarHBondContact O-CB 3.48Å; D276-K292 PolarHBondContact O-N 3.09Å
277	V	89.7	Confident	86.1	Confident	33 Å²	33	62.7 Å²	62.7	20%	0.2	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	115.8	177	178.5	0	0	0	0	109.6	L266 I272 V280 V289 L291	L266-V277 HydrophobicContact CD2-CG1 4.22Å; L266-V277 HydrophobicContact CD2-CG2 4.15Å; I272-V277 HydrophobicContact CD1-CG2 4.31Å; V277-V280 HydrophobicContact CG1-CG2 3.83Å; V277-V289 HydrophobicContact CG1-CG1 3.92Å; V277-V289 HydrophobicContact CG2-CG1 4.11Å; V277-L291 HydrophobicContact CG2-CD2 4.27Å; V277-L291 HydrophobicContact CG2-CG 4.31Å
278	E	92.1	Very high	86.7	Confident	104 Å²	104	57.8 Å²	57.8	49%	0.486	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	-37.7	176.7	-61.3	-174	154.2	0	0	111.5	D276 I290 K292	D276-E278 PolarHBondContact O-N 3.37Å; E278-I290 HydrophobicContact CB-CG2 4.3Å; E278-I290 PolarHBondContact N-O 3.5Å; E278-K292 HydrophobicContact CG-CG 4.21Å
279	S	91.5	Very high	87.3	Confident	25 Å²	25	53.9 Å²	53.9	18%	0.175	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	155.7	174.3	66.6	0	0	0	0	113.5	V289 I290	S279-V289 CarbonylContact O-C 3.48Å; S279-V289 WeakPolarHBondContact O-CA 3.43Å; S279-I290 PolarHBondContact N-O 3.19Å; S279-I290 PolarHBondContact O-N 2.97Å
280	V	91.6	Very high	88	Confident	36 Å²	36	53.9 Å²	53.9	22%	0.218	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	120.7	170.6	-174.2	0	0	0	0	107.6	L265 L266 V277 F287 I288 V289	L265-V280 HydrophobicContact CB-CG1 4.13Å; L265-V280 HydrophobicContact CD1-CG1 4.04Å; L266-V280 HydrophobicContact CD1-CG2 3.95Å; L266-V280 HydrophobicContact CD2-CG2 3.49Å; L266-V280 VanDerWaalsContact CD2-CG2 3.49Å; L266-V280 HydrophobicContact CG-CG2 3.73Å; V277-V280 HydrophobicContact CG1-CG2 3.83Å; V280-F287 HydrophobicContact CG1-CD2 4.27Å; V280-I288 CarbonylContact C-O 3.45Å; V280-I288 WeakPolarHBondContact CA-O 3.44Å; V280-V289 HydrophobicContact CG1-CG2 4.4Å; V280-V289 HydrophobicContact CG2-CG1 4.33Å; V280-V289 HydrophobicContact CG2-CG2 4.46Å
281	T	93.1	Very high	88.7	Confident	18 Å²	18	48.3 Å²	48.3	11%	0.11	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	113	-176.3	-53.7	0	0	0	0	109.8	F283 F287 I288 V332 K335	T281-F283 HydrophobicContact CG2-CD2 4.29Å; T281-F283 HydrophobicContact CG2-CE1 4.39Å; T281-F283 HydrophobicContact CG2-CE2 3.54Å; T281-F283 HydrophobicContact CG2-CZ 3.6Å; T281-F283 WeakPolarHBondContact O-CD2 3.19Å; T281-F283 WeakPolarHBondContact O-CE2 3.49Å; T281-F287 CarbonylContact O-C 3.47Å; T281-F287 VanDerWaalsContact O-CA 3.23Å; T281-F287 WeakPolarHBondContact O-CA 3.34Å; T281-F287 WeakPolarHBondContact O-CB 3.25Å; T281-I288 PolarHBondContact N-O 3.37Å; T281-I288 PolarHBondContact O-N 3.38Å; T281-V332 HydrophobicContact CG2-CG2 4.44Å; T281-V332 WeakPolarHBondContact OG1-CG1 3.44Å; T281-K335 HydrophobicContact CG2-CD 3.71Å; T281-K335 HydrophobicContact CG2-CG 4.35Å
282	D	92	Very high	89.2	Confident	31 Å²	31	49 Å²	49	17%	0.166	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	132.3	176.6	-168.7	-10.3	0	0	0	110.9	Y261 L265 G284 F287 H300 K335	Y261-D282 PolarHBondContact OH-OD2 2.88Å; L265-D282 HydrophobicContact CD1-CB 3.98Å; D282-G284 PolarHBondContact OD1-N 2.6Å; D282-F287 HydrophobicContact CB-CB 4.08Å; D282-H300 IonicContact OD1-CE1 3.97Å; D282-H300 IonicContact OD1-NE2 3.5Å; D282-H300 PolarHBondContact OD1-NE2 3.2Å; D282-H300 IonicContact OD2-CE1 3.94Å; D282-H300 PolarHBondContact OD2-CE1 3.11Å; D282-H300 IonicContact OD2-NE2 3.6Å; D282-K335 WeakPolarHBondContact O-CE 3.3Å; D282-K335 PolarHBondContact O-NZ 3.41Å
283	F	92.4	Very high	89.2	Confident	21 Å²	21	50.7 Å²	50.7	9%	0.092	26%	0.26	C	S	.	.			trans	-109.9	11	177.9	-64.7	-94.1	0	0	0	112.8	T281 H285 F286 I288 L331 V332 K335 L357 V361	T281-F283 HydrophobicContact CG2-CD2 4.29Å; T281-F283 HydrophobicContact CG2-CE1 4.39Å; T281-F283 HydrophobicContact CG2-CE2 3.54Å; T281-F283 HydrophobicContact CG2-CZ 3.6Å; T281-F283 WeakPolarHBondContact O-CD2 3.19Å; T281-F283 WeakPolarHBondContact O-CE2 3.49Å; F283-H285 PolarHBondContact O-N 2.79Å; F283-F286 WeakPolarHBondContact CA-O 3.35Å; F283-F286 HydrophobicContact CB-CD2 4.27Å; F283-F286 HydrophobicContact CB-CE1 4.26Å; F283-F286 HydrophobicContact CB-CE2 3.9Å; F283-F286 HydrophobicContact CB-CZ 3.9Å; F283-F286 WeakPolarHBondContact CB-O 3.44Å; F283-F286 HydrophobicContact CD2-CD2 4.04Å; F283-F286 AromaticContact CD2-CE2 3.56Å; F283-F286 HydrophobicContact CD2-CE2 3.56Å; F283-F286 HydrophobicContact CD2-CZ 4.26Å; F283-F286 HydrophobicContact CE2-CE2 4.28Å; F283-F286 HydrophobicContact CG-CD2 4.46Å; F283-F286 AromaticContact CG-CE2 3.81Å; F283-F286 HydrophobicContact CG-CE2 3.81Å; F283-F286 HydrophobicContact CG-CZ 4.05Å; F283-F286 PolarHBondContact N-O 3Å; F283-I288 HydrophobicContact CD2-CD1 4.27Å; F283-I288 HydrophobicContact CD2-CG1 4.29Å; F283-I288 HydrophobicContact CE2-CB 4.23Å; F283-I288 HydrophobicContact CE2-CD1 3.61Å; F283-I288 HydrophobicContact CE2-CG1 3.9Å; F283-I288 HydrophobicContact CZ-CD1 4.2Å; F283-L331 HydrophobicContact CD1-CD1 4.5Å; F283-L331 HydrophobicContact CD1-CG 4.47Å; F283-L331 HydrophobicContact CE1-CD1 3.8Å; F283-L331 HydrophobicContact CE1-CD2 4.13Å; F283-L331 HydrophobicContact CE1-CG 3.62Å; F283-L331 HydrophobicContact CE2-CG 4.45Å; F283-L331 HydrophobicContact CZ-CD1 4.31Å; F283-L331 HydrophobicContact CZ-CD2 4.11Å; F283-L331 HydrophobicContact CZ-CG 3.63Å; F283-V332 HydrophobicContact CE2-CG2 4.37Å; F283-V332 HydrophobicContact CZ-CG2 4.28Å; F283-K335 HydrophobicContact CD1-CD 3.7Å; F283-K335 HydrophobicContact CE1-CB 3.83Å; F283-K335 HydrophobicContact CE1-CD 3.45Å; F283-K335 VanDerWaalsContact CE1-CD 3.45Å; F283-K335 HydrophobicContact CE1-CG 4.26Å; F283-K335 HydrophobicContact CG-CD 4.47Å; F283-K335 HydrophobicContact CZ-CB 4.23Å; F283-K335 HydrophobicContact CZ-CD 3.99Å; F283-L357 HydrophobicContact CE1-CD1 4.26Å; F283-V361 HydrophobicContact CB-CG1 4.41Å; F283-V361 HydrophobicContact CB-CG2 4.37Å; F283-V361 HydrophobicContact CD1-CG2 3.52Å; F283-V361 HydrophobicContact CE1-CG2 4.2Å; F283-V361 HydrophobicContact CG-CG2 4.28Å
284	G	85.8	Confident	89.4	Confident	51 Å²	51	47.4 Å²	47.4	53%	0.526	24%	0.243	S	C	.	.	S	Bend	trans	94.9	-48.5	176.1	0	0	0	0	0	113.2	D282 H300	D282-G284 PolarHBondContact OD1-N 2.6Å; G284-H300 PolarHBondContact O-CD2 3.4Å; G284-H300 PolarHBondContact O-NE2 3.12Å
285	H	82.3	Confident	89.7	Confident	123 Å²	123	40.8 Å²	40.8	57%	0.569	21%	0.214	S	C	*	.	S	Bend	trans	-97.6	-28.9	176.6	-56.6	155.5	0	0	0	113.3	F283 H300 E365	F283-H285 PolarHBondContact O-N 2.79Å; H285-H300 PolarHBondContact O-CD2 3.46Å; H285-H300 PolarHBondContact O-N 2.9Å; H285-E365 IonicContact CG-OE2 3.43Å; H285-E365 IonicContact ND1-OE2 2.7Å; H285-E365 PolarHBondContact ND1-OE2 3.49Å; H285-E365 VanDerWaalsContact ND1-OE2 3.1Å
286	F	90.4	Very high	89.9	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	162.7	176.7	63.8	-92.6	0	0	0	108.8	F283 I288 F297 H298 T299 L331 V361 T364 E365	F283-F286 WeakPolarHBondContact CA-O 3.35Å; F283-F286 HydrophobicContact CB-CD2 4.27Å; F283-F286 HydrophobicContact CB-CE1 4.26Å; F283-F286 HydrophobicContact CB-CE2 3.9Å; F283-F286 HydrophobicContact CB-CZ 3.9Å; F283-F286 WeakPolarHBondContact CB-O 3.44Å; F283-F286 HydrophobicContact CD2-CD2 4.04Å; F283-F286 AromaticContact CD2-CE2 3.56Å; F283-F286 HydrophobicContact CD2-CE2 3.56Å; F283-F286 HydrophobicContact CD2-CZ 4.26Å; F283-F286 HydrophobicContact CE2-CE2 4.28Å; F283-F286 HydrophobicContact CG-CD2 4.46Å; F283-F286 AromaticContact CG-CE2 3.81Å; F283-F286 HydrophobicContact CG-CE2 3.81Å; F283-F286 HydrophobicContact CG-CZ 4.05Å; F283-F286 PolarHBondContact N-O 3Å; F286-I288 HydrophobicContact CD2-CG1 4.14Å; F286-I288 HydrophobicContact CE2-CD1 4.02Å; F286-I288 HydrophobicContact CE2-CG1 4.02Å; F286-F297 HydrophobicContact CB-CD2 4.33Å; F286-F297 HydrophobicContact CB-CE1 4.07Å; F286-F297 HydrophobicContact CB-CE2 3.68Å; F286-F297 HydrophobicContact CB-CZ 3.52Å; F286-F297 AromaticContact CD1-CE2 3.56Å; F286-F297 HydrophobicContact CD1-CE2 3.56Å; F286-F297 AromaticContact CD1-CZ 3.73Å; F286-F297 HydrophobicContact CD1-CZ 3.73Å; F286-F297 AromaticContact CD2-CD2 3.53Å; F286-F297 HydrophobicContact CD2-CD2 3.53Å; F286-F297 AromaticContact CD2-CE2 3.17Å; F286-F297 HydrophobicContact CD2-CE2 3.17Å; F286-F297 AromaticContact CD2-CZ 3.96Å; F286-F297 HydrophobicContact CD2-CZ 3.96Å; F286-F297 AromaticContact CE1-CE2 3.92Å; F286-F297 HydrophobicContact CE1-CE2 3.92Å; F286-F297 HydrophobicContact CE1-CZ 4.42Å; F286-F297 AromaticContact CE2-CD2 3.94Å; F286-F297 HydrophobicContact CE2-CD2 3.94Å; F286-F297 AromaticContact CE2-CE2 3.58Å; F286-F297 HydrophobicContact CE2-CE2 3.58Å; F286-F297 AromaticContact CG-CD2 3.94Å; F286-F297 HydrophobicContact CG-CD2 3.94Å; F286-F297 HydrophobicContact CG-CE1 4.43Å; F286-F297 AromaticContact CG-CE2 3.16Å; F286-F297 HydrophobicContact CG-CE2 3.16Å; F286-F297 AromaticContact CG-CZ 3.46Å; F286-F297 HydrophobicContact CG-CZ 3.46Å; F286-F297 VanDerWaalsContact CG-CZ 3.46Å; F286-F297 AromaticContact CZ-CE2 3.93Å; F286-F297 HydrophobicContact CZ-CE2 3.93Å; F286-H298 CarbonylContact C-O 3.54Å; F286-H298 WeakPolarHBondContact CA-O 3.35Å; F286-H298 WeakPolarHBondContact CB-O 3.35Å; F286-T299 HydrophobicContact CB-CG2 4.27Å; F286-L331 HydrophobicContact CE2-CD2 4.22Å; F286-L331 HydrophobicContact CZ-CD2 4.14Å; F286-V361 HydrophobicContact CE1-CG1 3.74Å; F286-V361 HydrophobicContact CZ-CG1 4Å; F286-T364 HydrophobicContact CE2-CG2 4.36Å; F286-T364 HydrophobicContact CZ-CG2 4.15Å; F286-E365 HydrophobicContact CD1-CB 4.2Å; F286-E365 HydrophobicContact CD1-CG 4.15Å; F286-E365 HydrophobicContact CE1-CB 3.93Å; F286-E365 HydrophobicContact CE1-CG 4.37Å
287	F	92.5	Very high	90	Very high	1 Å²	1	30.1 Å²	30.1	0%	0.004	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	153.9	169.8	62.4	-86.9	0	0	0	109.8	L265 V268 V269 V280 T281 D282 V289 H298 H300	L265-F287 HydrophobicContact CB-CD2 4.15Å; L265-F287 HydrophobicContact CB-CE2 4.04Å; L265-F287 HydrophobicContact CB-CG 4.42Å; L265-F287 HydrophobicContact CB-CZ 4.23Å; L265-F287 HydrophobicContact CD1-CB 4.41Å; L265-F287 HydrophobicContact CD1-CG 4.41Å; L265-F287 HydrophobicContact CD2-CD1 3.87Å; L265-F287 HydrophobicContact CD2-CE1 4.03Å; L265-F287 HydrophobicContact CD2-CG 4.28Å; L265-F287 WeakPolarHBondContact O-CE2 3.36Å; L265-F287 VanDerWaalsContact O-CZ 3.31Å; L265-F287 WeakPolarHBondContact O-CZ 3.37Å; V268-F287 HydrophobicContact CG2-CE1 4.03Å; V268-F287 HydrophobicContact CG2-CZ 3.55Å; V269-F287 HydrophobicContact CG2-CE2 3.62Å; V269-F287 HydrophobicContact CG2-CZ 3.79Å; V280-F287 HydrophobicContact CG1-CD2 4.27Å; T281-F287 CarbonylContact O-C 3.47Å; T281-F287 VanDerWaalsContact O-CA 3.23Å; T281-F287 WeakPolarHBondContact O-CA 3.34Å; T281-F287 WeakPolarHBondContact O-CB 3.25Å; D282-F287 HydrophobicContact CB-CB 4.08Å; F287-V289 HydrophobicContact CD2-CG2 3.93Å; F287-V289 HydrophobicContact CE2-CG2 3.84Å; F287-H298 HydrophobicContact CD1-CB 4.38Å; F287-H298 VanDerWaalsContact CD1-O 3.32Å; F287-H298 WeakPolarHBondContact CD1-O 3.43Å; F287-H298 HydrophobicContact CD2-CB 4.29Å; F287-H298 HydrophobicContact CE1-CB 3.83Å; F287-H298 AromaticContact CE1-CG 3.79Å; F287-H298 AromaticContact CE1-ND1 3.32Å; F287-H298 VanDerWaalsContact CE1-ND1 3.32Å; F287-H298 WeakPolarHBondContact CE1-ND1 3.5Å; F287-H298 HydrophobicContact CE2-CB 3.73Å; F287-H298 HydrophobicContact CZ-CB 3.47Å; F287-H298 VanDerWaalsContact CZ-CB 3.47Å; F287-H298 AromaticContact CZ-CG 3.43Å; F287-H298 VanDerWaalsContact CZ-CG 3.43Å; F287-H298 AromaticContact CZ-ND1 3.37Å; F287-H298 WeakPolarHBondContact CZ-ND1 3.36Å; F287-H298 PolarHBondContact N-O 3.32Å; F287-H298 PolarHBondContact O-N 3.15Å; F287-H300 AromaticContact CD1-CE1 3.89Å
288	I	94.6	Very high	90	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	130	177.6	-62.2	173.7	0	0	0	108.3	V280 T281 F283 F286 I290 I296 L328 L331 V332	V280-I288 CarbonylContact C-O 3.45Å; V280-I288 WeakPolarHBondContact CA-O 3.44Å; T281-I288 PolarHBondContact N-O 3.37Å; T281-I288 PolarHBondContact O-N 3.38Å; F283-I288 HydrophobicContact CD2-CD1 4.27Å; F283-I288 HydrophobicContact CD2-CG1 4.29Å; F283-I288 HydrophobicContact CE2-CB 4.23Å; F283-I288 HydrophobicContact CE2-CD1 3.61Å; F283-I288 HydrophobicContact CE2-CG1 3.9Å; F283-I288 HydrophobicContact CZ-CD1 4.2Å; F286-I288 HydrophobicContact CD2-CG1 4.14Å; F286-I288 HydrophobicContact CE2-CD1 4.02Å; F286-I288 HydrophobicContact CE2-CG1 4.02Å; I288-I290 HydrophobicContact CG2-CD1 3.52Å; I288-I290 HydrophobicContact CG2-CG1 4.09Å; I288-I296 CarbonylContact C-O 3.5Å; I288-I296 VanDerWaalsContact CA-O 3.25Å; I288-I296 WeakPolarHBondContact CA-O 3.34Å; I288-L328 HydrophobicContact CD1-CB 4.17Å; I288-L328 HydrophobicContact CD1-CD2 3.48Å; I288-L328 VanDerWaalsContact CD1-CD2 3.48Å; I288-L328 HydrophobicContact CD1-CG 4.37Å; I288-L328 HydrophobicContact CG1-CD2 4.15Å; I288-L328 HydrophobicContact CG2-CB 4.27Å; I288-L331 HydrophobicContact CD1-CD2 3.82Å; I288-L331 HydrophobicContact CD1-CG 4.36Å; I288-V332 HydrophobicContact CB-CG2 4.11Å; I288-V332 HydrophobicContact CD1-CG2 4.25Å; I288-V332 HydrophobicContact CG2-CG2 3.99Å
289	V	92.7	Very high	89.5	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	114.5	167.7	-172.6	0	0	0	0	107.8	L266 V269 V277 S279 V280 F287 L291 A295 I296	L266-V289 HydrophobicContact CD2-CG1 3.86Å; L266-V289 HydrophobicContact CD2-CG2 4.07Å; V269-V289 HydrophobicContact CG2-CG2 4.27Å; V277-V289 HydrophobicContact CG1-CG1 3.92Å; V277-V289 HydrophobicContact CG2-CG1 4.11Å; S279-V289 CarbonylContact O-C 3.48Å; S279-V289 WeakPolarHBondContact O-CA 3.43Å; V280-V289 HydrophobicContact CG1-CG2 4.4Å; V280-V289 HydrophobicContact CG2-CG1 4.33Å; V280-V289 HydrophobicContact CG2-CG2 4.46Å; F287-V289 HydrophobicContact CD2-CG2 3.93Å; F287-V289 HydrophobicContact CE2-CG2 3.84Å; V289-L291 HydrophobicContact CB-CD1 4.34Å; V289-L291 HydrophobicContact CG1-CD1 3.78Å; V289-L291 HydrophobicContact CG1-CG 4.3Å; V289-A295 CarbonylContact O-C 3.58Å; V289-A295 WeakPolarHBondContact O-CA 3.23Å; V289-I296 HydrophobicContact CB-CB 4.16Å; V289-I296 PolarHBondContact N-O 3.1Å; V289-I296 PolarHBondContact O-N 2.82Å
290	I	93.5	Very high	88.7	Confident	5 Å²	5	27.6 Å²	27.6	3%	0.026	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	124.2	171	-55	-60.1	0	0	0	107.7	E278 S279 I288 A295 E329 V332	E278-I290 HydrophobicContact CB-CG2 4.3Å; E278-I290 PolarHBondContact N-O 3.5Å; S279-I290 PolarHBondContact N-O 3.19Å; S279-I290 PolarHBondContact O-N 2.97Å; I288-I290 HydrophobicContact CG2-CD1 3.52Å; I288-I290 HydrophobicContact CG2-CG1 4.09Å; I290-A295 HydrophobicContact CD1-CB 3.67Å; I290-E329 HydrophobicContact CD1-CG 4.08Å; I290-E329 HydrophobicContact CG2-CG 4.43Å; I290-V332 HydrophobicContact CD1-CG2 4.47Å; I290-V332 HydrophobicContact CG1-CG2 4.23Å
291	L	90.6	Very high	87.8	Confident	7 Å²	7	33.7 Å²	33.7	4%	0.037	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	161.6	170	-59	93.4	0	0	0	109.7	I272 D276 V277 V289 D293 C294 I296	I272-L291 HydrophobicContact CB-CD2 4.25Å; I272-L291 HydrophobicContact CG2-CD2 4.17Å; D276-L291 HydrophobicContact CB-CD2 4.28Å; D276-L291 CarbonylContact O-C 3.59Å; D276-L291 WeakPolarHBondContact O-CA 3.41Å; D276-L291 WeakPolarHBondContact O-CB 3.48Å; V277-L291 HydrophobicContact CG2-CD2 4.27Å; V277-L291 HydrophobicContact CG2-CG 4.31Å; V289-L291 HydrophobicContact CB-CD1 4.34Å; V289-L291 HydrophobicContact CG1-CD1 3.78Å; V289-L291 HydrophobicContact CG1-CG 4.3Å; L291-D293 PolarHBondContact O-N 3.43Å; L291-C294 CarbonylContact C-O 3.59Å; L291-C294 WeakPolarHBondContact CA-O 3.39Å; L291-C294 WeakPolarHBondContact CB-O 3.47Å; L291-C294 PolarHBondContact N-O 2.7Å; L291-C294 PolarHBondContact O-N 2.78Å; L291-I296 HydrophobicContact CD1-CD1 3.65Å; L291-I296 HydrophobicContact CD1-CG1 3.78Å
292	K	86.9	Confident	86.7	Confident	97 Å²	97	35.3 Å²	35.3	42%	0.422	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.5	-35.2	178.5	-68.8	-179.4	177.8	-179.8	0	114.3	D276 E278 R309	D276-K292 PolarHBondContact O-N 3.09Å; E278-K292 HydrophobicContact CG-CG 4.21Å; K292-R309 PolarHBondContact O-NH1 2.92Å
293	D	82	Confident	85.9	Confident	67 Å²	67	37.3 Å²	37.3	36%	0.358	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.2	-6.9	-174.1	81.5	-33.9	0	0	0	115.2	L291 K308 R309	L291-D293 PolarHBondContact O-N 3.43Å; D293-K308 IonicContact OD2-NZ 3.49Å; D293-K308 PolarHBondContact OD2-NZ 3.03Å; D293-R309 WeakPolarHBondContact O-CB 3.01Å; D293-R309 PolarHBondContact O-N 2.85Å
294	C	85.4	Confident	85.6	Confident	12 Å²	12	39.2 Å²	39.2	8%	0.081	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	159.1	-177.8	62.1	0	0	0	0	113.5	L291 F307 K308 F325	L291-C294 CarbonylContact C-O 3.59Å; L291-C294 WeakPolarHBondContact CA-O 3.39Å; L291-C294 WeakPolarHBondContact CB-O 3.47Å; L291-C294 PolarHBondContact N-O 2.7Å; L291-C294 PolarHBondContact O-N 2.78Å; C294-F307 CarbonylContact C-O 3.55Å; C294-F307 WeakPolarHBondContact CA-O 3.41Å; C294-F307 WeakPolarHBondContact CB-O 3.39Å; C294-K308 HydrophobicContact CB-CD 4.21Å; C294-F325 VanDerWaalsContact C-CE2 3.48Å
295	A	90.2	Very high	85.4	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	137.6	170.5	0	0	0	0	0	108.5	V289 I290 F307 F325 L328	V289-A295 CarbonylContact O-C 3.58Å; V289-A295 WeakPolarHBondContact O-CA 3.23Å; I290-A295 HydrophobicContact CD1-CB 3.67Å; A295-F307 PolarHBondContact N-O 3.2Å; A295-F307 PolarHBondContact O-N 2.9Å; A295-F325 HydrophobicContact CB-CD2 3.62Å; A295-F325 HydrophobicContact CB-CE2 4.03Å; A295-L328 HydrophobicContact CB-CB 4.15Å; A295-L328 HydrophobicContact CB-CD1 3.78Å
296	I	90.2	Very high	85.5	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	121.9	177.1	-53.3	178.8	0	0	0	107.7	V269 I272 I288 V289 L291 H298 E304 A305 R306	V269-I296 HydrophobicContact CG1-CD1 3.66Å; V269-I296 HydrophobicContact CG1-CG2 4.19Å; I272-I296 HydrophobicContact CG2-CD1 3.44Å; I272-I296 VanDerWaalsContact CG2-CD1 3.44Å; I288-I296 CarbonylContact C-O 3.5Å; I288-I296 VanDerWaalsContact CA-O 3.25Å; I288-I296 WeakPolarHBondContact CA-O 3.34Å; V289-I296 HydrophobicContact CB-CB 4.16Å; V289-I296 PolarHBondContact N-O 3.1Å; V289-I296 PolarHBondContact O-N 2.82Å; L291-I296 HydrophobicContact CD1-CD1 3.65Å; L291-I296 HydrophobicContact CD1-CG1 3.78Å; I296-H298 HydrophobicContact CG2-CB 4.5Å; I296-E304 HydrophobicContact CG2-CG 3.53Å; I296-A305 CarbonylContact C-O 3.49Å; I296-A305 WeakPolarHBondContact CA-O 3.23Å; I296-R306 HydrophobicContact CD1-CG 4.39Å; I296-R306 HydrophobicContact CG1-CB 4.49Å; I296-R306 HydrophobicContact CG1-CG 4.02Å; I296-R306 HydrophobicContact CG2-CG 4.23Å
297	F	91	Very high	85.2	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	127.3	164.6	174.8	-82.3	0	0	0	107.8	F286 T299 F303 E304 A305 F307 T364 I368	F286-F297 HydrophobicContact CB-CD2 4.33Å; F286-F297 HydrophobicContact CB-CE1 4.07Å; F286-F297 HydrophobicContact CB-CE2 3.68Å; F286-F297 HydrophobicContact CB-CZ 3.52Å; F286-F297 AromaticContact CD1-CE2 3.56Å; F286-F297 HydrophobicContact CD1-CE2 3.56Å; F286-F297 AromaticContact CD1-CZ 3.73Å; F286-F297 HydrophobicContact CD1-CZ 3.73Å; F286-F297 AromaticContact CD2-CD2 3.53Å; F286-F297 HydrophobicContact CD2-CD2 3.53Å; F286-F297 AromaticContact CD2-CE2 3.17Å; F286-F297 HydrophobicContact CD2-CE2 3.17Å; F286-F297 AromaticContact CD2-CZ 3.96Å; F286-F297 HydrophobicContact CD2-CZ 3.96Å; F286-F297 AromaticContact CE1-CE2 3.92Å; F286-F297 HydrophobicContact CE1-CE2 3.92Å; F286-F297 HydrophobicContact CE1-CZ 4.42Å; F286-F297 AromaticContact CE2-CD2 3.94Å; F286-F297 HydrophobicContact CE2-CD2 3.94Å; F286-F297 AromaticContact CE2-CE2 3.58Å; F286-F297 HydrophobicContact CE2-CE2 3.58Å; F286-F297 AromaticContact CG-CD2 3.94Å; F286-F297 HydrophobicContact CG-CD2 3.94Å; F286-F297 HydrophobicContact CG-CE1 4.43Å; F286-F297 AromaticContact CG-CE2 3.16Å; F286-F297 HydrophobicContact CG-CE2 3.16Å; F286-F297 AromaticContact CG-CZ 3.46Å; F286-F297 HydrophobicContact CG-CZ 3.46Å; F286-F297 VanDerWaalsContact CG-CZ 3.46Å; F286-F297 AromaticContact CZ-CE2 3.93Å; F286-F297 HydrophobicContact CZ-CE2 3.93Å; F297-T299 HydrophobicContact CD1-CG2 4.46Å; F297-T299 HydrophobicContact CE1-CG2 3.54Å; F297-T299 HydrophobicContact CZ-CG2 4.12Å; F297-F303 HydrophobicContact CD1-CD1 4.11Å; F297-F303 HydrophobicContact CD1-CE1 4.07Å; F297-F303 AromaticContact CE1-CD1 3.97Å; F297-F303 HydrophobicContact CE1-CD1 3.97Å; F297-F303 HydrophobicContact CE1-CE1 4.11Å; F297-E304 CarbonylContact O-C 3.45Å; F297-E304 VanDerWaalsContact O-CA 3.31Å; F297-E304 WeakPolarHBondContact O-CA 3.34Å; F297-A305 HydrophobicContact CB-CB 4.48Å; F297-A305 PolarHBondContact N-O 2.88Å; F297-A305 PolarHBondContact O-N 3.16Å; F297-F307 HydrophobicContact CB-CE2 4.09Å; F297-T364 HydrophobicContact CD2-CG2 4.2Å; F297-T364 HydrophobicContact CE2-CG2 4.07Å; F297-I368 HydrophobicContact CB-CD1 4.24Å; F297-I368 HydrophobicContact CB-CG2 4.14Å; F297-I368 HydrophobicContact CD1-CB 4.42Å; F297-I368 HydrophobicContact CD1-CG2 3.49Å; F297-I368 VanDerWaalsContact CD1-CG2 3.49Å; F297-I368 HydrophobicContact CD2-CB 4.45Å; F297-I368 HydrophobicContact CD2-CD1 3.85Å; F297-I368 HydrophobicContact CD2-CG2 4.19Å; F297-I368 HydrophobicContact CE1-CB 4.42Å; F297-I368 HydrophobicContact CE1-CG2 3.82Å; F297-I368 HydrophobicContact CE2-CB 4.44Å; F297-I368 HydrophobicContact CE2-CD1 4.4Å; F297-I368 HydrophobicContact CE2-CG2 4.46Å; F297-I368 HydrophobicContact CG-CB 4.44Å; F297-I368 HydrophobicContact CG-CD1 4.12Å; F297-I368 HydrophobicContact CG-CG2 3.7Å; F297-I368 HydrophobicContact CZ-CB 4.44Å; F297-I368 HydrophobicContact CZ-CG2 4.3Å
298	H	88.5	Confident	84.6	Confident	11 Å²	11	45 Å²	45	5%	0.051	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	126.9	179.6	-169.3	-66.3	0	0	0	110.4	V268 V269 F286 F287 I296 F303 E304	V268-H298 PolarHBondContact O-NE2 3.41Å; V269-H298 HydrophobicContact CG2-CB 4.27Å; F286-H298 CarbonylContact C-O 3.54Å; F286-H298 WeakPolarHBondContact CA-O 3.35Å; F286-H298 WeakPolarHBondContact CB-O 3.35Å; F287-H298 HydrophobicContact CD1-CB 4.38Å; F287-H298 VanDerWaalsContact CD1-O 3.32Å; F287-H298 WeakPolarHBondContact CD1-O 3.43Å; F287-H298 HydrophobicContact CD2-CB 4.29Å; F287-H298 HydrophobicContact CE1-CB 3.83Å; F287-H298 AromaticContact CE1-CG 3.79Å; F287-H298 AromaticContact CE1-ND1 3.32Å; F287-H298 VanDerWaalsContact CE1-ND1 3.32Å; F287-H298 WeakPolarHBondContact CE1-ND1 3.5Å; F287-H298 HydrophobicContact CE2-CB 3.73Å; F287-H298 HydrophobicContact CZ-CB 3.47Å; F287-H298 VanDerWaalsContact CZ-CB 3.47Å; F287-H298 AromaticContact CZ-CG 3.43Å; F287-H298 VanDerWaalsContact CZ-CG 3.43Å; F287-H298 AromaticContact CZ-ND1 3.37Å; F287-H298 WeakPolarHBondContact CZ-ND1 3.36Å; F287-H298 PolarHBondContact N-O 3.32Å; F287-H298 PolarHBondContact O-N 3.15Å; I296-H298 HydrophobicContact CG2-CB 4.5Å; H298-F303 CarbonylContact C-O 3.54Å; H298-F303 WeakPolarHBondContact CA-O 3.39Å; H298-E304 IonicContact CD2-OE2 3.59Å
299	T	83.2	Confident	83.6	Confident	12 Å²	12	49.6 Å²	49.6	7%	0.074	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	156	175.9	64.7	0	0	0	0	111	F286 F297 I301 G302 F303	F286-T299 HydrophobicContact CB-CG2 4.27Å; F297-T299 HydrophobicContact CD1-CG2 4.46Å; F297-T299 HydrophobicContact CE1-CG2 3.54Å; F297-T299 HydrophobicContact CZ-CG2 4.12Å; T299-I301 PolarHBondContact O-N 3.25Å; T299-I301 VanDerWaalsContact O-N 3.11Å; T299-I301 WeakPolarHBondContact OG1-CG1 3.34Å; T299-G302 PolarHBondContact O-N 2.9Å; T299-G302 VanDerWaalsContact O-N 3.12Å; T299-G302 PolarHBondContact OG1-N 3.04Å; T299-F303 HydrophobicContact CG2-CB 4.01Å; T299-F303 HydrophobicContact CG2-CD1 4.07Å; T299-F303 HydrophobicContact CG2-CG 4.49Å; T299-F303 PolarHBondContact N-O 3.38Å; T299-F303 WeakPolarHBondContact OG1-CA 3.36Å; T299-F303 WeakPolarHBondContact OG1-CB 3.38Å; T299-F303 PolarHBondContact OG1-N 3.43Å; T299-F303 PolarHBondContact OG1-O 3.48Å
300	H	75.1	Confident	82.1	Confident	87 Å²	87	57.8 Å²	57.8	40%	0.403	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-10.8	176.1	-65	-67.5	0	0	0	114	D282 G284 H285 F287	D282-H300 IonicContact OD1-CE1 3.97Å; D282-H300 IonicContact OD1-NE2 3.5Å; D282-H300 PolarHBondContact OD1-NE2 3.2Å; D282-H300 IonicContact OD2-CE1 3.94Å; D282-H300 PolarHBondContact OD2-CE1 3.11Å; D282-H300 IonicContact OD2-NE2 3.6Å; G284-H300 PolarHBondContact O-CD2 3.4Å; G284-H300 PolarHBondContact O-NE2 3.12Å; H285-H300 PolarHBondContact O-CD2 3.46Å; H285-H300 PolarHBondContact O-N 2.9Å; F287-H300 AromaticContact CD1-CE1 3.89Å
301	I	72.2	Confident	80.2	Confident	164 Å²	164	60.3 Å²	60.3	84%	0.841	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	7.4	175.2	63.3	169.8	0	0	0	113.8	T299	T299-I301 PolarHBondContact O-N 3.25Å; T299-I301 VanDerWaalsContact O-N 3.11Å; T299-I301 WeakPolarHBondContact OG1-CG1 3.34Å
302	G	69.1	Low	78.5	Confident	51 Å²	51	61.1 Å²	61.1	53%	0.526	31%	0.311	S	S	.	.	S	Bend	trans	92.9	3.9	172	0	0	0	0	0	116.5	T299	T299-G302 PolarHBondContact O-N 2.9Å; T299-G302 VanDerWaalsContact O-N 3.12Å; T299-G302 PolarHBondContact OG1-N 3.04Å
303	F	76.4	Confident	77	Confident	74 Å²	74	60.5 Å²	60.5	33%	0.325	32%	0.315	S	S	.	.			trans	-71.4	130.8	166.4	174.5	-86.7	0	0	0	110.1	F297 H298 T299 A305 I368	F297-F303 HydrophobicContact CD1-CD1 4.11Å; F297-F303 HydrophobicContact CD1-CE1 4.07Å; F297-F303 AromaticContact CE1-CD1 3.97Å; F297-F303 HydrophobicContact CE1-CD1 3.97Å; F297-F303 HydrophobicContact CE1-CE1 4.11Å; H298-F303 CarbonylContact C-O 3.54Å; H298-F303 WeakPolarHBondContact CA-O 3.39Å; T299-F303 HydrophobicContact CG2-CB 4.01Å; T299-F303 HydrophobicContact CG2-CD1 4.07Å; T299-F303 HydrophobicContact CG2-CG 4.49Å; T299-F303 PolarHBondContact N-O 3.38Å; T299-F303 WeakPolarHBondContact OG1-CA 3.36Å; T299-F303 WeakPolarHBondContact OG1-CB 3.38Å; T299-F303 PolarHBondContact OG1-N 3.43Å; T299-F303 PolarHBondContact OG1-O 3.48Å; F303-A305 HydrophobicContact CE1-CB 4.04Å; F303-A305 HydrophobicContact CZ-CB 4.31Å; F303-I368 HydrophobicContact CE1-CG2 3.88Å; F303-I368 HydrophobicContact CZ-CG2 4.49Å; F303-I368 WeakPolarHBondContact CZ-O 3.39Å
304	E	84.2	Confident	76.1	Confident	61 Å²	61	60 Å²	60	29%	0.285	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	136.3	-178.9	-170.2	-167.8	84.4	0	0	111.1	V269 I296 F297 H298 R306	V269-E304 WeakPolarHBondContact CG1-OE2 3.38Å; I296-E304 HydrophobicContact CG2-CG 3.53Å; F297-E304 CarbonylContact O-C 3.45Å; F297-E304 VanDerWaalsContact O-CA 3.31Å; F297-E304 WeakPolarHBondContact O-CA 3.34Å; H298-E304 IonicContact CD2-OE2 3.59Å; E304-R306 HydrophobicContact CG-CG 4.46Å; E304-R306 IonicContact OE1-CZ 3.13Å; E304-R306 IonicContact OE1-NE 2.66Å; E304-R306 PolarHBondContact OE1-NE 3.32Å; E304-R306 IonicContact OE1-NH2 2.74Å; E304-R306 PolarHBondContact OE1-NH2 2.85Å; E304-R306 IonicContact OE2-CZ 3.73Å; E304-R306 IonicContact OE2-NE 3.89Å; E304-R306 IonicContact OE2-NH2 2.88Å; E304-R306 PolarHBondContact OE2-NH2 3.44Å
305	A	81.8	Confident	75.4	Confident	18 Å²	18	69.1 Å²	69.1	15%	0.149	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	129.2	170.7	0	0	0	0	0	110.2	I296 F297 F303 F307 I368	I296-A305 CarbonylContact C-O 3.49Å; I296-A305 WeakPolarHBondContact CA-O 3.23Å; F297-A305 HydrophobicContact CB-CB 4.48Å; F297-A305 PolarHBondContact N-O 2.88Å; F297-A305 PolarHBondContact O-N 3.16Å; F303-A305 HydrophobicContact CE1-CB 4.04Å; F303-A305 HydrophobicContact CZ-CB 4.31Å; A305-F307 HydrophobicContact CB-CE2 3.59Å; A305-F307 HydrophobicContact CB-CZ 3.55Å; A305-F307 WeakPolarHBondContact O-CE2 3.48Å; A305-I368 HydrophobicContact CB-CG2 3.81Å
306	R	86	Confident	74.1	Confident	111 Å²	111	76.5 Å²	76.5	42%	0.419	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	128.3	-179.1	-52.9	-168.6	-173.9	-140.4	-10.7	110.7	D270 I296 E304	D270-R306 VanDerWaalsContact O-CZ 3.24Å; D270-R306 PolarHBondContact O-NH1 3.38Å; D270-R306 PolarHBondContact O-NH2 3.31Å; I296-R306 HydrophobicContact CD1-CG 4.39Å; I296-R306 HydrophobicContact CG1-CB 4.49Å; I296-R306 HydrophobicContact CG1-CG 4.02Å; I296-R306 HydrophobicContact CG2-CG 4.23Å; E304-R306 HydrophobicContact CG-CG 4.46Å; E304-R306 IonicContact OE1-CZ 3.13Å; E304-R306 IonicContact OE1-NE 2.66Å; E304-R306 PolarHBondContact OE1-NE 3.32Å; E304-R306 IonicContact OE1-NH2 2.74Å; E304-R306 PolarHBondContact OE1-NH2 2.85Å; E304-R306 IonicContact OE2-CZ 3.73Å; E304-R306 IonicContact OE2-NE 3.89Å; E304-R306 IonicContact OE2-NH2 2.88Å; E304-R306 PolarHBondContact OE2-NH2 3.44Å
307	F	83.4	Confident	72.6	Confident	46 Å²	46	78.7 Å²	78.7	20%	0.202	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	116	-175.6	-54.9	-83.3	0	0	0	109.5	C294 A295 F297 A305 T324 L328 I368	C294-F307 CarbonylContact C-O 3.55Å; C294-F307 WeakPolarHBondContact CA-O 3.41Å; C294-F307 WeakPolarHBondContact CB-O 3.39Å; A295-F307 PolarHBondContact N-O 3.2Å; A295-F307 PolarHBondContact O-N 2.9Å; F297-F307 HydrophobicContact CB-CE2 4.09Å; A305-F307 HydrophobicContact CB-CE2 3.59Å; A305-F307 HydrophobicContact CB-CZ 3.55Å; A305-F307 WeakPolarHBondContact O-CE2 3.48Å; F307-T324 HydrophobicContact CD1-CG2 3.61Å; F307-T324 HydrophobicContact CD2-CG2 4.27Å; F307-T324 HydrophobicContact CE1-CG2 3.53Å; F307-T324 HydrophobicContact CE2-CG2 4.2Å; F307-T324 HydrophobicContact CG-CG2 3.97Å; F307-T324 HydrophobicContact CZ-CG2 3.84Å; F307-L328 HydrophobicContact CD2-CD1 3.44Å; F307-L328 VanDerWaalsContact CD2-CD1 3.44Å; F307-L328 HydrophobicContact CE2-CD1 3.8Å; F307-L328 HydrophobicContact CG-CD1 4.28Å; F307-I368 HydrophobicContact CE2-CD1 3.99Å; F307-I368 HydrophobicContact CE2-CG2 4.41Å; F307-I368 HydrophobicContact CZ-CD1 3.95Å; F307-I368 HydrophobicContact CZ-CG1 4.1Å; F307-I368 HydrophobicContact CZ-CG2 4.07Å
308	K	79.6	Confident	71.1	Confident	121 Å²	121	83.9 Å²	83.9	53%	0.526	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	147.5	173.2	-72.7	-69	-178.7	-168	0	110.2	D293 C294 W310	D293-K308 IonicContact OD2-NZ 3.49Å; D293-K308 PolarHBondContact OD2-NZ 3.03Å; C294-K308 HydrophobicContact CB-CD 4.21Å; K308-W310 PolarHBondContact O-N 3.47Å
309	R	73.3	Confident	69.4	Low	97 Å²	97	85.4 Å²	85.4	37%	0.366	45%	0.452	S	S	.	.	S	Bend	trans	-54.8	-35.2	174.4	-171	165.8	-155.1	171.7	7.1	112.3	K292 D293 G311 F325	K292-R309 PolarHBondContact O-NH1 2.92Å; D293-R309 WeakPolarHBondContact O-CB 3.01Å; D293-R309 PolarHBondContact O-N 2.85Å; R309-G311 PolarHBondContact O-N 3.27Å; R309-F325 HydrophobicContact CB-CD1 4.21Å; R309-F325 HydrophobicContact CB-CD2 4.22Å; R309-F325 HydrophobicContact CB-CE1 4.12Å; R309-F325 HydrophobicContact CB-CE2 4.15Å; R309-F325 HydrophobicContact CB-CG 4.27Å; R309-F325 HydrophobicContact CB-CZ 4.11Å; R309-F325 HydrophobicContact CG-CD1 3.84Å; R309-F325 HydrophobicContact CG-CE1 3.54Å; R309-F325 HydrophobicContact CG-CE2 4.42Å; R309-F325 HydrophobicContact CG-CG 4.4Å; R309-F325 HydrophobicContact CG-CZ 3.88Å
310	W	61.7	Low	68.3	Low	171 Å²	171	88.3 Å²	88.3	65%	0.648	47%	0.467	S	S	*	.			trans	-90.5	74.6	178.6	-35	102.1	0	0	0	110.3	K308 G312 A319	K308-W310 PolarHBondContact O-N 3.47Å; W310-G312 VanDerWaalsContact C-N 3.33Å; W310-A319 HydrophobicContact CE3-CB 4.05Å; W310-A319 HydrophobicContact CZ3-CB 4.23Å
311	G	54.4	Low	67.6	Low	58 Å²	58	90.2 Å²	90.2	60%	0.598	49%	0.485	S	S	*	.	S	Bend	trans	-89	6.1	179.4	0	0	0	0	0	115	R309	R309-G311 PolarHBondContact O-N 3.27Å
312	G	54	Low	67.2	Low	25 Å²	25	88.2 Å²	88.2	26%	0.258	48%	0.481	S	S	.	.			trans	157.8	136.6	-178.4	0	0	0	0	0	108.5	W310 L320	W310-G312 VanDerWaalsContact C-N 3.33Å; G312-L320 PolarHBondContact O-N 3.33Å
313	V	56.1	Low	67.5	Low	83 Å²	83	86.5 Å²	86.5	50%	0.503	46%	0.46	S	S	.	.	B	Isolated β-bridge	trans	-112.5	146.4	170.5	-67.9	0	0	0	0	108.5	G317 H318	V313-G317 WeakPolarHBondContact CG1-O 3.48Å; V313-H318 CarbonylContact C-O 3.54Å; V313-H318 WeakPolarHBondContact CA-O 3.39Å
314	D	63.3	Low	67.8	Low	58 Å²	58	85.9 Å²	85.9	31%	0.31	46%	0.462	S	S	.	.			trans	-66.4	-178.9	165.9	62.9	17.3	0	0	0	111	E316 G317 H318 L320	D314-E316 PolarHBondContact O-N 3.21Å; D314-E316 WeakPolarHBondContact OD1-CA 3.4Å; D314-E316 WeakPolarHBondContact OD1-CB 3.32Å; D314-E316 PolarHBondContact OD1-N 2.77Å; D314-G317 PolarHBondContact O-N 2.87Å; D314-G317 VanDerWaalsContact O-N 3.15Å; D314-G317 PolarHBondContact OD1-N 3.36Å; D314-H318 PolarHBondContact N-O 3.29Å; D314-H318 IonicContact OD1-CD2 3.91Å; D314-H318 PolarHBondContact OD1-N 2.76Å; D314-H318 WeakPolarHBondContact OD2-CB 3.39Å; D314-H318 IonicContact OD2-CD2 2.99Å; D314-H318 IonicContact OD2-CG 2.94Å; D314-L320 HydrophobicContact CB-CD2 4.01Å
315	M	68.9	Low	67.8	Low	203 Å²	203	83.2 Å²	83.2	100%	1	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-8.9	178.4	-69.6	-166.4	-89.7	0	0	113.4
316	E	64.7	Low	67.9	Low	154 Å²	154	83.1 Å²	83.1	72%	0.72	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	-3.2	-178.9	-64.7	171.2	-174.2	0	0	112.2	D314 H318	D314-E316 PolarHBondContact O-N 3.21Å; D314-E316 WeakPolarHBondContact OD1-CA 3.4Å; D314-E316 WeakPolarHBondContact OD1-CB 3.32Å; D314-E316 PolarHBondContact OD1-N 2.77Å; E316-H318 IonicContact OE2-CD2 3.66Å; E316-H318 IonicContact OE2-NE2 2.69Å
317	G	58	Low	68	Low	47 Å²	47	82.5 Å²	82.5	49%	0.485	45%	0.447	S	S	.	.	S	Bend	trans	88.6	5.7	178.6	0	0	0	0	0	114.3	V313 D314	V313-G317 WeakPolarHBondContact CG1-O 3.48Å; D314-G317 PolarHBondContact O-N 2.87Å; D314-G317 VanDerWaalsContact O-N 3.15Å; D314-G317 PolarHBondContact OD1-N 3.36Å
318	H	58.7	Low	68.4	Low	110 Å²	110	80.3 Å²	80.3	51%	0.509	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-80.1	135.9	177	-56.7	-62.8	0	0	0	110.7	V313 D314 E316 L320	V313-H318 CarbonylContact C-O 3.54Å; V313-H318 WeakPolarHBondContact CA-O 3.39Å; D314-H318 PolarHBondContact N-O 3.29Å; D314-H318 IonicContact OD1-CD2 3.91Å; D314-H318 PolarHBondContact OD1-N 2.76Å; D314-H318 WeakPolarHBondContact OD2-CB 3.39Å; D314-H318 IonicContact OD2-CD2 2.99Å; D314-H318 IonicContact OD2-CG 2.94Å; E316-H318 IonicContact OE2-CD2 3.66Å; E316-H318 IonicContact OE2-NE2 2.69Å; H318-L320 PolarHBondContact O-N 3.48Å
319	A	53.6	Low	69	Low	43 Å²	43	77.2 Å²	77.2	36%	0.355	43%	0.425	S	S	.	.	B	Isolated β-bridge	trans	-58.9	126.1	175.7	0	0	0	0	0	110.2	W310 T321	W310-A319 HydrophobicContact CE3-CB 4.05Å; W310-A319 HydrophobicContact CZ3-CB 4.23Å; A319-T321 PolarHBondContact O-N 3.42Å
320	L	59.3	Low	69.8	Low	72 Å²	72	77.3 Å²	77.3	38%	0.377	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-62.6	133.3	175.3	-64.8	173.3	0	0	0	109.3	G312 D314 H318 T322 T323	G312-L320 PolarHBondContact O-N 3.33Å; D314-L320 HydrophobicContact CB-CD2 4.01Å; H318-L320 PolarHBondContact O-N 3.48Å; L320-T322 PolarHBondContact O-N 3.3Å; L320-T323 HydrophobicContact CB-CG2 4.41Å; L320-T323 VanDerWaalsContact O-CG2 3.25Å; L320-T323 WeakPolarHBondContact O-CG2 3.45Å
321	T	60	Low	71.4	Confident	127 Å²	127	69.1 Å²	69.1	78%	0.779	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-12.5	177.9	53.1	0	0	0	0	112.8	A319 A326	A319-T321 PolarHBondContact O-N 3.42Å; T321-A326 WeakPolarHBondContact O-CB 3.32Å
322	T	65.6	Low	73.4	Confident	123 Å²	123	66.6 Å²	66.6	76%	0.755	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	35.8	-178.3	60.2	0	0	0	0	112.8	L320	L320-T322 PolarHBondContact O-N 3.3Å
323	T	74.7	Confident	75.3	Confident	14 Å²	14	67.9 Å²	67.9	9%	0.086	38%	0.382	C	S	.	.	S	Bend	trans	-87	154	176.6	57.1	0	0	0	0	111.5	L320 F325 A326 W327	L320-T323 HydrophobicContact CB-CG2 4.41Å; L320-T323 VanDerWaalsContact O-CG2 3.25Å; L320-T323 WeakPolarHBondContact O-CG2 3.45Å; T323-F325 PolarHBondContact O-N 3.43Å; T323-A326 PolarHBondContact O-N 3.44Å; T323-A326 VanDerWaalsContact O-N 3.11Å; T323-A326 PolarHBondContact OG1-N 2.81Å; T323-W327 PolarHBondContact O-N 3.02Å
324	T	82.2	Confident	77.1	Confident	62 Å²	62	64.9 Å²	64.9	38%	0.38	36%	0.363	S	S	.	.	H	α-helix	trans	-59.2	-31.5	172	-46.8	0	0	0	0	111.7	F307 W327 L328 I368	F307-T324 HydrophobicContact CD1-CG2 3.61Å; F307-T324 HydrophobicContact CD2-CG2 4.27Å; F307-T324 HydrophobicContact CE1-CG2 3.53Å; F307-T324 HydrophobicContact CE2-CG2 4.2Å; F307-T324 HydrophobicContact CG-CG2 3.97Å; F307-T324 HydrophobicContact CZ-CG2 3.84Å; T324-W327 PolarHBondContact O-N 3.34Å; T324-L328 HydrophobicContact CG2-CD1 4.46Å; T324-L328 VanDerWaalsContact O-CG 3.3Å; T324-L328 WeakPolarHBondContact O-CG 3.44Å; T324-L328 PolarHBondContact O-N 2.81Å; T324-I368 HydrophobicContact CG2-CD1 4.28Å
325	F	85	Confident	78.7	Confident	5 Å²	5	65.8 Å²	65.8	2%	0.022	36%	0.364	C	S	.	.	H	α-helix	trans	-58	-53.5	171.5	175.8	-89.9	0	0	0	111.5	C294 A295 R309 T323 W327 L328 E329	C294-F325 VanDerWaalsContact C-CE2 3.48Å; A295-F325 HydrophobicContact CB-CD2 3.62Å; A295-F325 HydrophobicContact CB-CE2 4.03Å; R309-F325 HydrophobicContact CB-CD1 4.21Å; R309-F325 HydrophobicContact CB-CD2 4.22Å; R309-F325 HydrophobicContact CB-CE1 4.12Å; R309-F325 HydrophobicContact CB-CE2 4.15Å; R309-F325 HydrophobicContact CB-CG 4.27Å; R309-F325 HydrophobicContact CB-CZ 4.11Å; R309-F325 HydrophobicContact CG-CD1 3.84Å; R309-F325 HydrophobicContact CG-CE1 3.54Å; R309-F325 HydrophobicContact CG-CE2 4.42Å; R309-F325 HydrophobicContact CG-CG 4.4Å; R309-F325 HydrophobicContact CG-CZ 3.88Å; T323-F325 PolarHBondContact O-N 3.43Å; F325-W327 VanDerWaalsContact C-N 3.29Å; F325-W327 PolarHBondContact O-N 3.41Å; F325-L328 PolarHBondContact O-N 3.26Å; F325-L328 VanDerWaalsContact O-N 3.12Å; F325-E329 HydrophobicContact CD1-CG 4.32Å; F325-E329 HydrophobicContact CE1-CG 3.86Å; F325-E329 WeakPolarHBondContact CE1-OE1 3.35Å; F325-E329 WeakPolarHBondContact CE1-OE2 3.28Å; F325-E329 HydrophobicContact CZ-CG 4.02Å; F325-E329 WeakPolarHBondContact CZ-OE1 3.24Å; F325-E329 PolarHBondContact O-N 3.47Å
326	A	83.5	Confident	79.9	Confident	16 Å²	16	62.6 Å²	62.6	13%	0.132	35%	0.345	C	S	.	.	H	α-helix	trans	-62.2	-35.9	178.5	0	0	0	0	0	112.3	T321 T323 E329 N330	T321-A326 WeakPolarHBondContact O-CB 3.32Å; T323-A326 PolarHBondContact O-N 3.44Å; T323-A326 VanDerWaalsContact O-N 3.11Å; T323-A326 PolarHBondContact OG1-N 2.81Å; A326-E329 PolarHBondContact O-N 3Å; A326-N330 WeakPolarHBondContact O-CB 3.34Å; A326-N330 PolarHBondContact O-N 3.49Å; A326-N330 PolarHBondContact O-ND2 3.38Å
327	W	88.1	Confident	81.3	Confident	97 Å²	97	59.3 Å²	59.3	37%	0.367	33%	0.329	S	S	.	.	H	α-helix	trans	-60.2	-46	172.6	177.2	-84.3	0	0	0	112.2	T323 T324 F325 N330 L331 I363 T364	T323-W327 PolarHBondContact O-N 3.02Å; T324-W327 PolarHBondContact O-N 3.34Å; F325-W327 VanDerWaalsContact C-N 3.29Å; F325-W327 PolarHBondContact O-N 3.41Å; W327-N330 PolarHBondContact O-N 3.1Å; W327-L331 WeakPolarHBondContact O-CB 3.22Å; W327-L331 PolarHBondContact O-N 3.5Å; W327-I363 HydrophobicContact CH2-CG2 4.22Å; W327-I363 HydrophobicContact CZ2-CB 4.42Å; W327-I363 HydrophobicContact CZ2-CG2 3.89Å; W327-T364 PolarHBondContact NE1-OG1 3.41Å
328	L	91.5	Very high	83	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-67.3	-38.8	179	-66.6	174.6	0	0	0	111.9	I288 A295 F307 T324 F325 L331 V332 T364 I368	I288-L328 HydrophobicContact CD1-CB 4.17Å; I288-L328 HydrophobicContact CD1-CD2 3.48Å; I288-L328 VanDerWaalsContact CD1-CD2 3.48Å; I288-L328 HydrophobicContact CD1-CG 4.37Å; I288-L328 HydrophobicContact CG1-CD2 4.15Å; I288-L328 HydrophobicContact CG2-CB 4.27Å; A295-L328 HydrophobicContact CB-CB 4.15Å; A295-L328 HydrophobicContact CB-CD1 3.78Å; F307-L328 HydrophobicContact CD2-CD1 3.44Å; F307-L328 VanDerWaalsContact CD2-CD1 3.44Å; F307-L328 HydrophobicContact CE2-CD1 3.8Å; F307-L328 HydrophobicContact CG-CD1 4.28Å; T324-L328 HydrophobicContact CG2-CD1 4.46Å; T324-L328 VanDerWaalsContact O-CG 3.3Å; T324-L328 WeakPolarHBondContact O-CG 3.44Å; T324-L328 PolarHBondContact O-N 2.81Å; F325-L328 PolarHBondContact O-N 3.26Å; F325-L328 VanDerWaalsContact O-N 3.12Å; L328-L331 PolarHBondContact O-N 2.94Å; L328-V332 WeakPolarHBondContact O-CG2 3.14Å; L328-V332 PolarHBondContact O-N 2.67Å; L328-T364 HydrophobicContact CD2-CG2 3.78Å; L328-I368 HydrophobicContact CD1-CD1 4.46Å; L328-I368 HydrophobicContact CD2-CD1 3.81Å
329	E	91.7	Very high	84.5	Confident	57 Å²	57	60.2 Å²	60.2	27%	0.266	32%	0.319	S	S	.	.	H	α-helix	trans	-60.7	-45.7	171.2	-75.1	-171.4	130.4	0	0	111.7	I290 F325 A326 L331 V332 A333	I290-E329 HydrophobicContact CD1-CG 4.08Å; I290-E329 HydrophobicContact CG2-CG 4.43Å; F325-E329 HydrophobicContact CD1-CG 4.32Å; F325-E329 HydrophobicContact CE1-CG 3.86Å; F325-E329 WeakPolarHBondContact CE1-OE1 3.35Å; F325-E329 WeakPolarHBondContact CE1-OE2 3.28Å; F325-E329 HydrophobicContact CZ-CG 4.02Å; F325-E329 WeakPolarHBondContact CZ-OE1 3.24Å; F325-E329 PolarHBondContact O-N 3.47Å; A326-E329 PolarHBondContact O-N 3Å; E329-L331 VanDerWaalsContact C-N 3.33Å; E329-L331 PolarHBondContact O-N 3.47Å; E329-V332 PolarHBondContact O-N 3.29Å; E329-A333 WeakPolarHBondContact O-CB 3.43Å; E329-A333 PolarHBondContact O-N 3.01Å
330	N	91.9	Very high	86.2	Confident	98 Å²	98	61.2 Å²	61.2	52%	0.524	33%	0.333	S	S	.	.	H	α-helix	trans	-63.6	-37.6	177.7	-75	-24.1	0	0	0	112.1	A326 W327 A333 M334	A326-N330 WeakPolarHBondContact O-CB 3.34Å; A326-N330 PolarHBondContact O-N 3.49Å; A326-N330 PolarHBondContact O-ND2 3.38Å; W327-N330 PolarHBondContact O-N 3.1Å; N330-A333 PolarHBondContact O-N 2.96Å; N330-M334 WeakPolarHBondContact O-CB 3.46Å; N330-M334 PolarHBondContact O-N 2.8Å
331	L	94.5	Very high	87.8	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-64.9	-41.4	174.6	178.4	58.9	0	0	0	111.5	F283 F286 I288 W327 L328 E329 M334 K335 L357 M360 V361 T364	F283-L331 HydrophobicContact CD1-CD1 4.5Å; F283-L331 HydrophobicContact CD1-CG 4.47Å; F283-L331 HydrophobicContact CE1-CD1 3.8Å; F283-L331 HydrophobicContact CE1-CD2 4.13Å; F283-L331 HydrophobicContact CE1-CG 3.62Å; F283-L331 HydrophobicContact CE2-CG 4.45Å; F283-L331 HydrophobicContact CZ-CD1 4.31Å; F283-L331 HydrophobicContact CZ-CD2 4.11Å; F283-L331 HydrophobicContact CZ-CG 3.63Å; F286-L331 HydrophobicContact CE2-CD2 4.22Å; F286-L331 HydrophobicContact CZ-CD2 4.14Å; I288-L331 HydrophobicContact CD1-CD2 3.82Å; I288-L331 HydrophobicContact CD1-CG 4.36Å; W327-L331 WeakPolarHBondContact O-CB 3.22Å; W327-L331 PolarHBondContact O-N 3.5Å; L328-L331 PolarHBondContact O-N 2.94Å; E329-L331 VanDerWaalsContact C-N 3.33Å; E329-L331 PolarHBondContact O-N 3.47Å; L331-M334 PolarHBondContact O-N 3.26Å; L331-K335 PolarHBondContact O-N 3.08Å; L331-L357 HydrophobicContact CD1-CD1 3.85Å; L331-M360 HydrophobicContact CB-CE 4.34Å; L331-M360 HydrophobicContact CD1-CB 3.75Å; L331-M360 HydrophobicContact CD1-CE 4.28Å; L331-V361 HydrophobicContact CD1-CG2 4.13Å; L331-T364 HydrophobicContact CD2-CG2 3.93Å; L331-T364 WeakPolarHBondContact CD2-OG1 3.25Å
332	V	95.3	Very high	89.5	Confident	5 Å²	5	58.7 Å²	58.7	3%	0.03	31%	0.309	C	S	.	.	H	α-helix	trans	-63.5	-41.1	173.5	169.9	0	0	0	0	111.4	T281 F283 I288 I290 L328 E329 K336	T281-V332 HydrophobicContact CG2-CG2 4.44Å; T281-V332 WeakPolarHBondContact OG1-CG1 3.44Å; F283-V332 HydrophobicContact CE2-CG2 4.37Å; F283-V332 HydrophobicContact CZ-CG2 4.28Å; I288-V332 HydrophobicContact CB-CG2 4.11Å; I288-V332 HydrophobicContact CD1-CG2 4.25Å; I288-V332 HydrophobicContact CG2-CG2 3.99Å; I290-V332 HydrophobicContact CD1-CG2 4.47Å; I290-V332 HydrophobicContact CG1-CG2 4.23Å; L328-V332 WeakPolarHBondContact O-CG2 3.14Å; L328-V332 PolarHBondContact O-N 2.67Å; E329-V332 PolarHBondContact O-N 3.29Å; V332-K336 WeakPolarHBondContact O-CG 3.42Å; V332-K336 PolarHBondContact O-N 2.76Å
333	A	94.8	Very high	90.9	Very high	52 Å²	52	59.5 Å²	59.5	43%	0.43	31%	0.309	S	S	.	.	H	α-helix	trans	-65.6	-45.3	176.1	0	0	0	0	0	112	E329 N330 K335 K336 E337	E329-A333 WeakPolarHBondContact O-CB 3.43Å; E329-A333 PolarHBondContact O-N 3.01Å; N330-A333 PolarHBondContact O-N 2.96Å; A333-K335 VanDerWaalsContact C-N 3.33Å; A333-K335 PolarHBondContact O-N 3.31Å; A333-K336 WeakPolarHBondContact O-CA 3.32Å; A333-K336 WeakPolarHBondContact O-CB 3.32Å; A333-K336 PolarHBondContact O-N 3.37Å; A333-E337 PolarHBondContact O-N 3.01Å
334	M	94.6	Very high	91.9	Very high	19 Å²	19	62.9 Å²	62.9	9%	0.094	33%	0.327	C	S	.	.	H	α-helix	trans	-57	-45.8	176.7	-177.9	63.7	81.1	0	0	111	N330 L331 K336 E337 V338 F346 Y353 M356 L357 M360	N330-M334 WeakPolarHBondContact O-CB 3.46Å; N330-M334 PolarHBondContact O-N 2.8Å; L331-M334 PolarHBondContact O-N 3.26Å; M334-K336 PolarHBondContact O-N 3.18Å; M334-E337 PolarHBondContact O-N 2.81Å; M334-V338 HydrophobicContact CG-CG2 4.1Å; M334-V338 WeakPolarHBondContact O-CG2 3.25Å; M334-V338 PolarHBondContact O-N 2.89Å; M334-V338 HydrophobicContact SD-CG2 4.09Å; M334-F346 HydrophobicContact CE-CE2 3.57Å; M334-F346 HydrophobicContact CE-CZ 3.76Å; M334-F346 HydrophobicContact SD-CE2 3.87Å; M334-Y353 HydrophobicContact SD-CD1 4.45Å; M334-M356 HydrophobicContact CE-CG 4.11Å; M334-L357 HydrophobicContact CB-CD1 4.43Å; M334-L357 HydrophobicContact CG-CB 4.35Å; M334-L357 HydrophobicContact CG-CD1 4.04Å; M334-M360 HydrophobicContact CB-CE 4.49Å; M334-M360 HydrophobicContact CB-SD 4.18Å; M334-M360 HydrophobicContact CE-SD 3.73Å; M334-M360 HydrophobicContact CG-SD 3.85Å
335	K	95.3	Very high	92.5	Very high	77 Å²	77	64.8 Å²	64.8	34%	0.335	33%	0.333	S	S	.	.	H	α-helix	trans	-59.8	-33	176.5	-179.1	155.9	179.2	155	0	113.3	T281 D282 F283 L331 A333 L357	T281-K335 HydrophobicContact CG2-CD 3.71Å; T281-K335 HydrophobicContact CG2-CG 4.35Å; D282-K335 WeakPolarHBondContact O-CE 3.3Å; D282-K335 PolarHBondContact O-NZ 3.41Å; F283-K335 HydrophobicContact CD1-CD 3.7Å; F283-K335 HydrophobicContact CE1-CB 3.83Å; F283-K335 HydrophobicContact CE1-CD 3.45Å; F283-K335 VanDerWaalsContact CE1-CD 3.45Å; F283-K335 HydrophobicContact CE1-CG 4.26Å; F283-K335 HydrophobicContact CG-CD 4.47Å; F283-K335 HydrophobicContact CZ-CB 4.23Å; F283-K335 HydrophobicContact CZ-CD 3.99Å; L331-K335 PolarHBondContact O-N 3.08Å; A333-K335 VanDerWaalsContact C-N 3.33Å; A333-K335 PolarHBondContact O-N 3.31Å; K335-L357 HydrophobicContact CB-CD1 4.02Å; K335-L357 HydrophobicContact CB-CD2 4.28Å; K335-L357 HydrophobicContact CG-CD2 4.28Å
336	K	94.3	Very high	92.8	Very high	137 Å²	137	66.5 Å²	66.5	60%	0.596	34%	0.341	S	S	*	.	H	α-helix	trans	-73.4	-39.1	174.1	-67	172.3	-176.1	174.7	0	111.5	V332 A333 M334 K339	V332-K336 WeakPolarHBondContact O-CG 3.42Å; V332-K336 PolarHBondContact O-N 2.76Å; A333-K336 WeakPolarHBondContact O-CA 3.32Å; A333-K336 WeakPolarHBondContact O-CB 3.32Å; A333-K336 PolarHBondContact O-N 3.37Å; M334-K336 PolarHBondContact O-N 3.18Å; K336-K339 WeakPolarHBondContact O-CB 3.41Å; K336-K339 PolarHBondContact O-N 2.79Å
337	E	94.1	Very high	93.2	Very high	84 Å²	84	69.4 Å²	69.4	39%	0.393	36%	0.358	S	S	.	.	H	α-helix	trans	-69.3	-37.8	-179.2	-174.1	176.8	175.3	0	0	113.2	A333 M334 K339 K341 Y353	A333-E337 PolarHBondContact O-N 3.01Å; M334-E337 PolarHBondContact O-N 2.81Å; E337-K339 PolarHBondContact O-N 3.45Å; E337-K341 IonicContact OE1-NZ 3.91Å; E337-K341 PolarHBondContact OE1-NZ 3.12Å; E337-Y353 HydrophobicContact CG-CD1 4.49Å; E337-Y353 HydrophobicContact CG-CE1 3.88Å; E337-Y353 VanDerWaalsContact OE1-CE1 3.32Å; E337-Y353 WeakPolarHBondContact OE1-CE1 3.4Å; E337-Y353 PolarHBondContact OE1-OH 2.94Å
338	V	94.1	Very high	93.2	Very high	3 Å²	3	74.7 Å²	74.7	2%	0.018	39%	0.387	C	S	.	.	S	Bend	trans	-61.6	-26.4	179.2	171.8	0	0	0	0	111.9	M334 G340 K341 E342 Y353 Q354 L357	M334-V338 HydrophobicContact CG-CG2 4.1Å; M334-V338 WeakPolarHBondContact O-CG2 3.25Å; M334-V338 PolarHBondContact O-N 2.89Å; M334-V338 HydrophobicContact SD-CG2 4.09Å; V338-G340 PolarHBondContact O-N 2.96Å; V338-G340 VanDerWaalsContact O-N 3.14Å; V338-K341 CarbonylContact O-C 3.6Å; V338-K341 PolarHBondContact O-N 3.01Å; V338-E342 HydrophobicContact CG1-CG 4.15Å; V338-E342 PolarHBondContact O-N 3.38Å; V338-Y353 HydrophobicContact CG2-CD1 4.14Å; V338-Q354 HydrophobicContact CG1-CB 4.5Å; V338-L357 HydrophobicContact CB-CD2 4.21Å; V338-L357 HydrophobicContact CG1-CD2 4.14Å; V338-L357 HydrophobicContact CG2-CB 3.86Å; V338-L357 HydrophobicContact CG2-CD2 4.06Å; V338-L357 HydrophobicContact CG2-CG 4.47Å
339	K	90	Very high	93.2	Very high	174 Å²	174	77.3 Å²	77.3	76%	0.757	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	115.9	-177.9	-170.7	-178.8	179.3	-176.6	0	111	K336 E337 K341 E342	K336-K339 WeakPolarHBondContact O-CB 3.41Å; K336-K339 PolarHBondContact O-N 2.79Å; E337-K339 PolarHBondContact O-N 3.45Å; K339-K341 VanDerWaalsContact C-N 3.32Å; K339-E342 WeakPolarHBondContact CA-OE1 3.4Å
340	G	90.7	Very high	93.2	Very high	63 Å²	63	81.8 Å²	81.8	65%	0.649	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.5	0.2	-175.7	0	0	0	0	0	114.9	V338 E342	V338-G340 PolarHBondContact O-N 2.96Å; V338-G340 VanDerWaalsContact O-N 3.14Å; G340-E342 VanDerWaalsContact C-OE2 3.29Å; G340-E342 WeakPolarHBondContact CA-OE2 3.25Å; G340-E342 PolarHBondContact N-OE1 2.99Å; G340-E342 PolarHBondContact N-OE2 2.83Å
341	K	93.2	Very high	93.2	Very high	73 Å²	73	79.3 Å²	79.3	32%	0.317	42%	0.417	S	S	.	.			trans	-124.3	16.3	176	-62.2	-174.7	-175	175.8	0	111.8	E337 V338 K339 N343 D344 Y353	E337-K341 IonicContact OE1-NZ 3.91Å; E337-K341 PolarHBondContact OE1-NZ 3.12Å; V338-K341 CarbonylContact O-C 3.6Å; V338-K341 PolarHBondContact O-N 3.01Å; K339-K341 VanDerWaalsContact C-N 3.32Å; K341-N343 PolarHBondContact O-N 3.49Å; K341-D344 HydrophobicContact CB-CB 4.18Å; K341-D344 WeakPolarHBondContact O-CB 3.4Å; K341-D344 PolarHBondContact O-N 2.94Å; K341-Y353 HydrophobicContact CB-CD2 4.13Å; K341-Y353 HydrophobicContact CB-CG 4.21Å; K341-Y353 HydrophobicContact CD-CD2 4.45Å; K341-Y353 HydrophobicContact CD-CE1 4.3Å; K341-Y353 HydrophobicContact CD-CE2 4.08Å; K341-Y353 WeakPolarHBondContact O-CB 3.49Å
342	E	95.2	Very high	93.2	Very high	73 Å²	73	80.6 Å²	80.6	34%	0.341	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-38.5	-166.1	-66.1	80.4	178.8	0	0	112.3	V338 K339 G340 T352 Q354	V338-E342 HydrophobicContact CG1-CG 4.15Å; V338-E342 PolarHBondContact O-N 3.38Å; K339-E342 WeakPolarHBondContact CA-OE1 3.4Å; G340-E342 VanDerWaalsContact C-OE2 3.29Å; G340-E342 WeakPolarHBondContact CA-OE2 3.25Å; G340-E342 PolarHBondContact N-OE1 2.99Å; G340-E342 PolarHBondContact N-OE2 2.83Å; E342-T352 WeakPolarHBondContact O-CB 3.3Å; E342-Q354 HydrophobicContact CB-CB 4.38Å; E342-Q354 VanDerWaalsContact O-CB 3.26Å; E342-Q354 WeakPolarHBondContact O-CB 3.46Å; E342-Q354 PolarHBondContact O-N 3.35Å
343	N	95.3	Very high	93.3	Very high	140 Å²	140	81.2 Å²	81.2	75%	0.749	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	-1.6	-179.1	-57.4	-56.8	0	0	0	113.9	K341	K341-N343 PolarHBondContact O-N 3.49Å
344	D	95.3	Very high	93.2	Very high	86 Å²	86	81.7 Å²	81.7	46%	0.46	42%	0.42	S	S	.	.	S	Bend	trans	-72.8	145.5	177	-68.2	-13	0	0	0	109.3	K341 F346 T352 Y353	K341-D344 HydrophobicContact CB-CB 4.18Å; K341-D344 WeakPolarHBondContact O-CB 3.4Å; K341-D344 PolarHBondContact O-N 2.94Å; D344-F346 PolarHBondContact O-N 3.31Å; D344-T352 CarbonylContact O-C 2.94Å; D344-T352 VanDerWaalsContact O-CA 3.22Å; D344-T352 WeakPolarHBondContact O-CA 3.4Å; D344-Y353 HydrophobicContact CB-CD2 3.99Å; D344-Y353 HydrophobicContact CB-CE2 4.37Å; D344-Y353 WeakPolarHBondContact O-CD2 3.36Å; D344-Y353 PolarHBondContact O-N 3.31Å
345	I	94.8	Very high	93.1	Very high	102 Å²	102	84.3 Å²	84.3	52%	0.523	44%	0.435	S	S	.	.	B	Isolated β-bridge	trans	-72.3	129.9	175.9	-59.8	-60.9	0	0	0	109	T349 T352	I345-T349 WeakPolarHBondContact CG2-O 3.49Å; I345-T352 HydrophobicContact CD1-CG2 4.38Å
346	F	90	Very high	93	Very high	41 Å²	41	83.4 Å²	83.4	18%	0.18	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-67.8	138.1	176.8	-164.6	-90	0	0	0	109.6	M334 D344 E348 T349 V351 Y353 M356	M334-F346 HydrophobicContact CE-CE2 3.57Å; M334-F346 HydrophobicContact CE-CZ 3.76Å; M334-F346 HydrophobicContact SD-CE2 3.87Å; D344-F346 PolarHBondContact O-N 3.31Å; F346-E348 PolarHBondContact O-N 3.37Å; F346-T349 WeakPolarHBondContact CB-OG1 3.47Å; F346-T349 HydrophobicContact CD1-CG2 4.08Å; F346-T349 PolarHBondContact O-N 2.67Å; F346-T349 VanDerWaalsContact O-N 3.12Å; F346-T349 PolarHBondContact O-OG1 3.4Å; F346-T349 VanDerWaalsContact O-OG1 3.13Å; F346-V351 PolarHBondContact N-O 3.42Å; F346-Y353 HydrophobicContact CB-CD2 4.43Å; F346-Y353 AromaticContact CD2-CD1 3.46Å; F346-Y353 HydrophobicContact CD2-CD1 3.46Å; F346-Y353 VanDerWaalsContact CD2-CD1 3.46Å; F346-Y353 HydrophobicContact CD2-CD2 4.1Å; F346-Y353 AromaticContact CD2-CE1 3.42Å; F346-Y353 HydrophobicContact CD2-CE1 3.42Å; F346-Y353 VanDerWaalsContact CD2-CE1 3.42Å; F346-Y353 HydrophobicContact CD2-CE2 4.08Å; F346-Y353 AromaticContact CD2-CG 3.82Å; F346-Y353 HydrophobicContact CD2-CG 3.82Å; F346-Y353 AromaticContact CD2-CZ 3.77Å; F346-Y353 AromaticContact CE2-CD1 3.78Å; F346-Y353 HydrophobicContact CE2-CD1 3.78Å; F346-Y353 AromaticContact CE2-CE1 3.46Å; F346-Y353 HydrophobicContact CE2-CE1 3.46Å; F346-Y353 VanDerWaalsContact CE2-CE1 3.46Å; F346-M356 HydrophobicContact CD2-CB 4.28Å; F346-M356 HydrophobicContact CD2-CG 4.18Å; F346-M356 HydrophobicContact CE2-CG 4.32Å; F346-M356 HydrophobicContact CG-CB 4.45Å; F346-M356 HydrophobicContact CG-CG 4.34Å
347	P	91.8	Very high	93	Very high	76 Å²	76	77.4 Å²	77.4	49%	0.494	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	132.2	-175.8	-28.7	35.3	0	0	0	112.7	T349	P347-T349 PolarHBondContact O-N 3.24Å
348	E	89.9	Confident	92.9	Very high	209 Å²	209	76.7 Å²	76.7	98%	0.977	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.2	13.8	177.7	-50.1	-178.3	175.1	0	0	115.6	F346	F346-E348 PolarHBondContact O-N 3.37Å
349	T	90.7	Very high	92.6	Very high	55 Å²	55	79.3 Å²	79.3	34%	0.337	42%	0.424	S	S	.	.	S	Bend	trans	-124.3	172.9	175	79.8	0	0	0	0	112.1	I345 F346 P347 V351	I345-T349 WeakPolarHBondContact CG2-O 3.49Å; F346-T349 WeakPolarHBondContact CB-OG1 3.47Å; F346-T349 HydrophobicContact CD1-CG2 4.08Å; F346-T349 PolarHBondContact O-N 2.67Å; F346-T349 VanDerWaalsContact O-N 3.12Å; F346-T349 PolarHBondContact O-OG1 3.4Å; F346-T349 VanDerWaalsContact O-OG1 3.13Å; P347-T349 PolarHBondContact O-N 3.24Å; T349-V351 WeakPolarHBondContact OG1-CG2 3.12Å; T349-V351 PolarHBondContact OG1-N 2.76Å; T349-V351 PolarHBondContact OG1-O 3.25Å
350	D	91.5	Very high	92.7	Very high	150 Å²	150	71.9 Å²	71.9	80%	0.802	39%	0.393	S	S	*	.	S	Bend	trans	-102.7	7.2	171.4	62.5	-22.9	0	0	0	113
351	V	91.5	Very high	92.7	Very high	47 Å²	47	69.7 Å²	69.7	29%	0.285	37%	0.366	S	S	.	.	S	Bend	trans	-106.7	152.8	-178.9	-60.2	0	0	0	0	111	F346 T349 D355	F346-V351 PolarHBondContact N-O 3.42Å; T349-V351 WeakPolarHBondContact OG1-CG2 3.12Å; T349-V351 PolarHBondContact OG1-N 2.76Å; T349-V351 PolarHBondContact OG1-O 3.25Å; V351-D355 HydrophobicContact CB-CB 3.87Å
352	T	95.7	Very high	92.2	Very high	27 Å²	27	68.3 Å²	68.3	17%	0.166	36%	0.362	C	S	.	.	B	Isolated β-bridge	trans	-74.3	163.7	176.8	65.2	0	0	0	0	111.7	E342 D344 I345 Q354 D355 M356	E342-T352 WeakPolarHBondContact O-CB 3.3Å; D344-T352 CarbonylContact O-C 2.94Å; D344-T352 VanDerWaalsContact O-CA 3.22Å; D344-T352 WeakPolarHBondContact O-CA 3.4Å; I345-T352 HydrophobicContact CD1-CG2 4.38Å; T352-Q354 PolarHBondContact O-N 2.78Å; T352-D355 WeakPolarHBondContact CB-OD2 3.35Å; T352-D355 PolarHBondContact N-OD2 2.75Å; T352-D355 PolarHBondContact O-N 3.32Å; T352-D355 PolarHBondContact OG1-N 2.96Å; T352-D355 VanDerWaalsContact OG1-N 3.09Å; T352-D355 PolarHBondContact OG1-OD2 2.97Å; T352-M356 PolarHBondContact O-N 3Å
353	Y	95.6	Very high	91.5	Very high	18 Å²	18	67.2 Å²	67.2	7%	0.071	36%	0.358	C	S	.	.	H	α-helix	trans	-54.3	-40.3	168.7	-90.4	-93.1	0	0	0	111.8	M334 E337 V338 K341 D344 F346 M356 L357	M334-Y353 HydrophobicContact SD-CD1 4.45Å; E337-Y353 HydrophobicContact CG-CD1 4.49Å; E337-Y353 HydrophobicContact CG-CE1 3.88Å; E337-Y353 VanDerWaalsContact OE1-CE1 3.32Å; E337-Y353 WeakPolarHBondContact OE1-CE1 3.4Å; E337-Y353 PolarHBondContact OE1-OH 2.94Å; V338-Y353 HydrophobicContact CG2-CD1 4.14Å; K341-Y353 HydrophobicContact CB-CD2 4.13Å; K341-Y353 HydrophobicContact CB-CG 4.21Å; K341-Y353 HydrophobicContact CD-CD2 4.45Å; K341-Y353 HydrophobicContact CD-CE1 4.3Å; K341-Y353 HydrophobicContact CD-CE2 4.08Å; K341-Y353 WeakPolarHBondContact O-CB 3.49Å; D344-Y353 HydrophobicContact CB-CD2 3.99Å; D344-Y353 HydrophobicContact CB-CE2 4.37Å; D344-Y353 WeakPolarHBondContact O-CD2 3.36Å; D344-Y353 PolarHBondContact O-N 3.31Å; F346-Y353 HydrophobicContact CB-CD2 4.43Å; F346-Y353 AromaticContact CD2-CD1 3.46Å; F346-Y353 HydrophobicContact CD2-CD1 3.46Å; F346-Y353 VanDerWaalsContact CD2-CD1 3.46Å; F346-Y353 HydrophobicContact CD2-CD2 4.1Å; F346-Y353 AromaticContact CD2-CE1 3.42Å; F346-Y353 HydrophobicContact CD2-CE1 3.42Å; F346-Y353 VanDerWaalsContact CD2-CE1 3.42Å; F346-Y353 HydrophobicContact CD2-CE2 4.08Å; F346-Y353 AromaticContact CD2-CG 3.82Å; F346-Y353 HydrophobicContact CD2-CG 3.82Å; F346-Y353 AromaticContact CD2-CZ 3.77Å; F346-Y353 AromaticContact CE2-CD1 3.78Å; F346-Y353 HydrophobicContact CE2-CD1 3.78Å; F346-Y353 AromaticContact CE2-CE1 3.46Å; F346-Y353 HydrophobicContact CE2-CE1 3.46Å; F346-Y353 VanDerWaalsContact CE2-CE1 3.46Å; Y353-M356 PolarHBondContact O-N 3.18Å; Y353-L357 PolarHBondContact O-N 2.97Å
354	Q	94.3	Very high	91.1	Very high	61 Å²	61	60.6 Å²	60.6	29%	0.285	32%	0.322	S	S	.	.	H	α-helix	trans	-64.7	-44.8	177.4	-174.8	59.9	52.9	0	0	111.8	V338 E342 T352 M356 L357 D358	V338-Q354 HydrophobicContact CG1-CB 4.5Å; E342-Q354 HydrophobicContact CB-CB 4.38Å; E342-Q354 VanDerWaalsContact O-CB 3.26Å; E342-Q354 WeakPolarHBondContact O-CB 3.46Å; E342-Q354 PolarHBondContact O-N 3.35Å; T352-Q354 PolarHBondContact O-N 2.78Å; Q354-M356 VanDerWaalsContact C-N 3.27Å; Q354-M356 PolarHBondContact O-N 3.03Å; Q354-L357 PolarHBondContact O-N 3.21Å; Q354-D358 PolarHBondContact NE2-OD1 2.69Å; Q354-D358 PolarHBondContact NE2-OD2 3.22Å; Q354-D358 WeakPolarHBondContact O-CB 3.43Å; Q354-D358 VanDerWaalsContact O-CG 3.29Å; Q354-D358 PolarHBondContact O-N 2.82Å
355	D	92.6	Very high	90.5	Very high	75 Å²	75	58.3 Å²	58.3	40%	0.401	31%	0.309	S	S	.	.	H	α-helix	trans	-60.6	-38.7	176.5	-64	-44.9	0	0	0	111.8	V351 T352 S359	V351-D355 HydrophobicContact CB-CB 3.87Å; T352-D355 WeakPolarHBondContact CB-OD2 3.35Å; T352-D355 PolarHBondContact N-OD2 2.75Å; T352-D355 PolarHBondContact O-N 3.32Å; T352-D355 PolarHBondContact OG1-N 2.96Å; T352-D355 VanDerWaalsContact OG1-N 3.09Å; T352-D355 PolarHBondContact OG1-OD2 2.97Å; D355-S359 WeakPolarHBondContact O-CB 3.49Å; D355-S359 PolarHBondContact O-N 3.2Å; D355-S359 PolarHBondContact O-OG 2.84Å
356	M	92.5	Very high	89.5	Confident	58 Å²	58	53.4 Å²	53.4	29%	0.286	28%	0.284	S	S	.	.	H	α-helix	trans	-64.7	-45.9	176.5	-172.9	61.5	178.9	0	0	111.2	M334 F346 T352 Y353 Q354 S359 M360	M334-M356 HydrophobicContact CE-CG 4.11Å; F346-M356 HydrophobicContact CD2-CB 4.28Å; F346-M356 HydrophobicContact CD2-CG 4.18Å; F346-M356 HydrophobicContact CE2-CG 4.32Å; F346-M356 HydrophobicContact CG-CB 4.45Å; F346-M356 HydrophobicContact CG-CG 4.34Å; T352-M356 PolarHBondContact O-N 3Å; Y353-M356 PolarHBondContact O-N 3.18Å; Q354-M356 VanDerWaalsContact C-N 3.27Å; Q354-M356 PolarHBondContact O-N 3.03Å; M356-S359 WeakPolarHBondContact O-CB 3.38Å; M356-S359 PolarHBondContact O-N 3.28Å; M356-M360 WeakPolarHBondContact O-CG 3.45Å; M356-M360 PolarHBondContact O-N 3.36Å
357	L	94.1	Very high	88.7	Confident	10 Å²	10	54.2 Å²	54.2	5%	0.052	29%	0.29	C	S	.	.	H	α-helix	trans	-60.4	-48.4	175.5	175.8	62.1	0	0	0	111.5	F283 L331 M334 K335 V338 Y353 Q354 S359 M360 V361	F283-L357 HydrophobicContact CE1-CD1 4.26Å; L331-L357 HydrophobicContact CD1-CD1 3.85Å; M334-L357 HydrophobicContact CB-CD1 4.43Å; M334-L357 HydrophobicContact CG-CB 4.35Å; M334-L357 HydrophobicContact CG-CD1 4.04Å; K335-L357 HydrophobicContact CB-CD1 4.02Å; K335-L357 HydrophobicContact CB-CD2 4.28Å; K335-L357 HydrophobicContact CG-CD2 4.28Å; V338-L357 HydrophobicContact CB-CD2 4.21Å; V338-L357 HydrophobicContact CG1-CD2 4.14Å; V338-L357 HydrophobicContact CG2-CB 3.86Å; V338-L357 HydrophobicContact CG2-CD2 4.06Å; V338-L357 HydrophobicContact CG2-CG 4.47Å; Y353-L357 PolarHBondContact O-N 2.97Å; Q354-L357 PolarHBondContact O-N 3.21Å; L357-S359 VanDerWaalsContact C-N 3.27Å; L357-S359 PolarHBondContact O-N 3.48Å; L357-M360 PolarHBondContact O-N 3.1Å; L357-M360 VanDerWaalsContact O-N 3.11Å; L357-V361 HydrophobicContact CD1-CG2 4.23Å; L357-V361 HydrophobicContact CG-CG2 4.45Å; L357-V361 WeakPolarHBondContact O-CG2 3.36Å; L357-V361 PolarHBondContact O-N 3Å
358	D	91.9	Very high	88.1	Confident	70 Å²	70	51.4 Å²	51.4	37%	0.374	27%	0.271	S	S	.	.	H	α-helix	trans	-59.9	-41.6	-179.8	-70.2	-18.4	0	0	0	110.8	Q354 M360 V361 I362	Q354-D358 PolarHBondContact NE2-OD1 2.69Å; Q354-D358 PolarHBondContact NE2-OD2 3.22Å; Q354-D358 WeakPolarHBondContact O-CB 3.43Å; Q354-D358 VanDerWaalsContact O-CG 3.29Å; Q354-D358 PolarHBondContact O-N 2.82Å; D358-M360 PolarHBondContact O-N 2.79Å; D358-V361 PolarHBondContact O-N 3.14Å; D358-I362 WeakPolarHBondContact O-CD1 3.48Å; D358-I362 VanDerWaalsContact O-CG1 3.24Å; D358-I362 WeakPolarHBondContact O-CG1 3.41Å; D358-I362 PolarHBondContact O-N 2.9Å
359	S	88.1	Confident	87.1	Confident	58 Å²	58	42.8 Å²	42.8	41%	0.406	24%	0.235	S	C	.	.	H	α-helix	trans	-59.9	-45.8	173.9	-61.1	0	0	0	0	112.1	D355 M356 L357 V361 I362 I363	D355-S359 WeakPolarHBondContact O-CB 3.49Å; D355-S359 PolarHBondContact O-N 3.2Å; D355-S359 PolarHBondContact O-OG 2.84Å; M356-S359 WeakPolarHBondContact O-CB 3.38Å; M356-S359 PolarHBondContact O-N 3.28Å; L357-S359 VanDerWaalsContact C-N 3.27Å; L357-S359 PolarHBondContact O-N 3.48Å; S359-V361 PolarHBondContact O-N 2.91Å; S359-I362 PolarHBondContact O-N 3.25Å; S359-I363 VanDerWaalsContact O-CG1 3.28Å; S359-I363 WeakPolarHBondContact O-CG1 3.41Å; S359-I363 PolarHBondContact O-N 3.01Å
360	M	91.4	Very high	85.7	Confident	18 Å²	18	43.5 Å²	43.5	9%	0.089	24%	0.235	C	C	.	.	H	α-helix	trans	-64.8	-38.7	177.2	-67.9	179.5	68	0	0	112.4	L331 M334 M356 L357 D358 I363 T364	L331-M360 HydrophobicContact CB-CE 4.34Å; L331-M360 HydrophobicContact CD1-CB 3.75Å; L331-M360 HydrophobicContact CD1-CE 4.28Å; M334-M360 HydrophobicContact CB-CE 4.49Å; M334-M360 HydrophobicContact CB-SD 4.18Å; M334-M360 HydrophobicContact CE-SD 3.73Å; M334-M360 HydrophobicContact CG-SD 3.85Å; M356-M360 WeakPolarHBondContact O-CG 3.45Å; M356-M360 PolarHBondContact O-N 3.36Å; L357-M360 PolarHBondContact O-N 3.1Å; L357-M360 VanDerWaalsContact O-N 3.11Å; D358-M360 PolarHBondContact O-N 2.79Å; M360-I363 PolarHBondContact O-N 3.31Å; M360-T364 WeakPolarHBondContact O-CB 3.41Å; M360-T364 PolarHBondContact O-N 3.13Å; M360-T364 PolarHBondContact O-OG1 3.46Å
361	V	91.4	Very high	83.6	Confident	16 Å²	16	40 Å²	40	10%	0.097	22%	0.221	C	C	.	.	H	α-helix	trans	-60.5	-47.8	176	168.9	0	0	0	0	110.4	F283 F286 L331 L357 D358 S359 T364 E365	F283-V361 HydrophobicContact CB-CG1 4.41Å; F283-V361 HydrophobicContact CB-CG2 4.37Å; F283-V361 HydrophobicContact CD1-CG2 3.52Å; F283-V361 HydrophobicContact CE1-CG2 4.2Å; F283-V361 HydrophobicContact CG-CG2 4.28Å; F286-V361 HydrophobicContact CE1-CG1 3.74Å; F286-V361 HydrophobicContact CZ-CG1 4Å; L331-V361 HydrophobicContact CD1-CG2 4.13Å; L357-V361 HydrophobicContact CD1-CG2 4.23Å; L357-V361 HydrophobicContact CG-CG2 4.45Å; L357-V361 WeakPolarHBondContact O-CG2 3.36Å; L357-V361 PolarHBondContact O-N 3Å; D358-V361 PolarHBondContact O-N 3.14Å; S359-V361 PolarHBondContact O-N 2.91Å; V361-T364 PolarHBondContact O-N 3.4Å; V361-E365 PolarHBondContact O-N 2.88Å
362	I	82.3	Confident	81.1	Confident	44 Å²	44	46.3 Å²	46.3	23%	0.226	25%	0.25	C	S	.	.	H	α-helix	trans	-62.9	-46.6	179.7	-67	159.8	0	0	0	111.1	D358 S359 T364 E365 A366 A385 L389	D358-I362 WeakPolarHBondContact O-CD1 3.48Å; D358-I362 VanDerWaalsContact O-CG1 3.24Å; D358-I362 WeakPolarHBondContact O-CG1 3.41Å; D358-I362 PolarHBondContact O-N 2.9Å; S359-I362 PolarHBondContact O-N 3.25Å; I362-T364 VanDerWaalsContact C-N 3.3Å; I362-T364 PolarHBondContact O-N 3.38Å; I362-E365 PolarHBondContact O-N 2.83Å; I362-A366 VanDerWaalsContact O-CB 3.25Å; I362-A366 WeakPolarHBondContact O-CB 3.33Å; I362-A366 PolarHBondContact O-N 3.22Å; I362-A385 HydrophobicContact CG2-CB 3.95Å; I362-L389 HydrophobicContact CD1-CD1 4.05Å; I362-L389 HydrophobicContact CD1-CD2 3.56Å; I362-L389 HydrophobicContact CD1-CG 4.11Å; I362-L389 HydrophobicContact CG1-CD2 4.45Å; I362-L389 HydrophobicContact CG2-CG 4.34Å
363	I	80.5	Confident	78.5	Confident	50 Å²	50	47.4 Å²	47.4	26%	0.256	26%	0.257	S	S	.	.	H	α-helix	trans	-61	-41.6	178.3	-70.2	166.8	0	0	0	110.7	W327 S359 M360 A366 N367	W327-I363 HydrophobicContact CH2-CG2 4.22Å; W327-I363 HydrophobicContact CZ2-CB 4.42Å; W327-I363 HydrophobicContact CZ2-CG2 3.89Å; S359-I363 VanDerWaalsContact O-CG1 3.28Å; S359-I363 WeakPolarHBondContact O-CG1 3.41Å; S359-I363 PolarHBondContact O-N 3.01Å; M360-I363 PolarHBondContact O-N 3.31Å; I363-A366 PolarHBondContact O-N 2.92Å; I363-N367 WeakPolarHBondContact CG2-ND2 3.32Å; I363-N367 WeakPolarHBondContact O-CB 3.34Å; I363-N367 VanDerWaalsContact O-CG 3.27Å; I363-N367 PolarHBondContact O-N 3.1Å; I363-N367 PolarHBondContact O-ND2 2.98Å
364	T	87.6	Confident	75.9	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.006	29%	0.285	C	S	.	.	H	α-helix	trans	-64	-49.9	179.2	-56.6	0	0	0	0	111.4	F286 F297 W327 L328 L331 M360 V361 I362 A366 N367 I368	F286-T364 HydrophobicContact CE2-CG2 4.36Å; F286-T364 HydrophobicContact CZ-CG2 4.15Å; F297-T364 HydrophobicContact CD2-CG2 4.2Å; F297-T364 HydrophobicContact CE2-CG2 4.07Å; W327-T364 PolarHBondContact NE1-OG1 3.41Å; L328-T364 HydrophobicContact CD2-CG2 3.78Å; L331-T364 HydrophobicContact CD2-CG2 3.93Å; L331-T364 WeakPolarHBondContact CD2-OG1 3.25Å; M360-T364 WeakPolarHBondContact O-CB 3.41Å; M360-T364 PolarHBondContact O-N 3.13Å; M360-T364 PolarHBondContact O-OG1 3.46Å; V361-T364 PolarHBondContact O-N 3.4Å; I362-T364 VanDerWaalsContact C-N 3.3Å; I362-T364 PolarHBondContact O-N 3.38Å; T364-A366 VanDerWaalsContact C-N 3.33Å; T364-A366 PolarHBondContact O-N 3.35Å; T364-N367 PolarHBondContact O-N 3.48Å; T364-I368 HydrophobicContact CG2-CD1 3.73Å; T364-I368 WeakPolarHBondContact O-CB 3.38Å; T364-I368 WeakPolarHBondContact O-CG1 3.38Å; T364-I368 PolarHBondContact O-N 3.16Å
365	E	83	Confident	73.3	Confident	38 Å²	38	50.1 Å²	50.1	18%	0.178	28%	0.283	C	S	.	.	H	α-helix	trans	-61.9	-42.9	178.6	-162	-163.4	129.8	0	0	111.2	H285 F286 V361 I362 A369 K388	H285-E365 IonicContact CG-OE2 3.43Å; H285-E365 IonicContact ND1-OE2 2.7Å; H285-E365 PolarHBondContact ND1-OE2 3.49Å; H285-E365 VanDerWaalsContact ND1-OE2 3.1Å; F286-E365 HydrophobicContact CD1-CB 4.2Å; F286-E365 HydrophobicContact CD1-CG 4.15Å; F286-E365 HydrophobicContact CE1-CB 3.93Å; F286-E365 HydrophobicContact CE1-CG 4.37Å; V361-E365 PolarHBondContact O-N 2.88Å; I362-E365 PolarHBondContact O-N 2.83Å; E365-A369 WeakPolarHBondContact O-CB 3.37Å; E365-A369 PolarHBondContact O-N 2.9Å; E365-K388 IonicContact OE1-NZ 2.65Å; E365-K388 PolarHBondContact OE1-NZ 3.39Å
366	A	72.8	Confident	71	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-60	-49.5	176.8	0	0	0	0	0	111.9	I362 I363 T364 H370 F384	I362-A366 VanDerWaalsContact O-CB 3.25Å; I362-A366 WeakPolarHBondContact O-CB 3.33Å; I362-A366 PolarHBondContact O-N 3.22Å; I363-A366 PolarHBondContact O-N 2.92Å; T364-A366 VanDerWaalsContact C-N 3.33Å; T364-A366 PolarHBondContact O-N 3.35Å; A366-H370 WeakPolarHBondContact O-CB 3.48Å; A366-H370 PolarHBondContact O-CD2 3.4Å; A366-H370 PolarHBondContact O-N 2.95Å; A366-F384 HydrophobicContact CB-CD1 3.99Å; A366-F384 HydrophobicContact CB-CE1 4.15Å
367	N	72.7	Confident	69.1	Low	58 Å²	58	53.9 Å²	53.9	31%	0.31	31%	0.31	S	S	.	.	H	α-helix	trans	-72.7	-35.2	-175.4	-72.9	-23.7	0	0	0	113.4	I363 T364 A381	I363-N367 WeakPolarHBondContact CG2-ND2 3.32Å; I363-N367 WeakPolarHBondContact O-CB 3.34Å; I363-N367 VanDerWaalsContact O-CG 3.27Å; I363-N367 PolarHBondContact O-N 3.1Å; I363-N367 PolarHBondContact O-ND2 2.98Å; T364-N367 PolarHBondContact O-N 3.48Å; N367-A381 WeakPolarHBondContact OD1-CB 3.11Å
368	I	79.5	Confident	67.1	Low	16 Å²	16	57.1 Å²	57.1	8%	0.082	34%	0.339	C	S	.	.	H	α-helix	trans	-89.9	-42.4	-174.9	-65	178.2	0	0	0	112.1	F297 F303 A305 F307 T324 L328 T364 H370	F297-I368 HydrophobicContact CB-CD1 4.24Å; F297-I368 HydrophobicContact CB-CG2 4.14Å; F297-I368 HydrophobicContact CD1-CB 4.42Å; F297-I368 HydrophobicContact CD1-CG2 3.49Å; F297-I368 VanDerWaalsContact CD1-CG2 3.49Å; F297-I368 HydrophobicContact CD2-CB 4.45Å; F297-I368 HydrophobicContact CD2-CD1 3.85Å; F297-I368 HydrophobicContact CD2-CG2 4.19Å; F297-I368 HydrophobicContact CE1-CB 4.42Å; F297-I368 HydrophobicContact CE1-CG2 3.82Å; F297-I368 HydrophobicContact CE2-CB 4.44Å; F297-I368 HydrophobicContact CE2-CD1 4.4Å; F297-I368 HydrophobicContact CE2-CG2 4.46Å; F297-I368 HydrophobicContact CG-CB 4.44Å; F297-I368 HydrophobicContact CG-CD1 4.12Å; F297-I368 HydrophobicContact CG-CG2 3.7Å; F297-I368 HydrophobicContact CZ-CB 4.44Å; F297-I368 HydrophobicContact CZ-CG2 4.3Å; F303-I368 HydrophobicContact CE1-CG2 3.88Å; F303-I368 HydrophobicContact CZ-CG2 4.49Å; F303-I368 WeakPolarHBondContact CZ-O 3.39Å; A305-I368 HydrophobicContact CB-CG2 3.81Å; F307-I368 HydrophobicContact CE2-CD1 3.99Å; F307-I368 HydrophobicContact CE2-CG2 4.41Å; F307-I368 HydrophobicContact CZ-CD1 3.95Å; F307-I368 HydrophobicContact CZ-CG1 4.1Å; F307-I368 HydrophobicContact CZ-CG2 4.07Å; T324-I368 HydrophobicContact CG2-CD1 4.28Å; L328-I368 HydrophobicContact CD1-CD1 4.46Å; L328-I368 HydrophobicContact CD2-CD1 3.81Å; T364-I368 HydrophobicContact CG2-CD1 3.73Å; T364-I368 WeakPolarHBondContact O-CB 3.38Å; T364-I368 WeakPolarHBondContact O-CG1 3.38Å; T364-I368 PolarHBondContact O-N 3.16Å; I368-H370 VanDerWaalsContact C-N 3.33Å
369	A	69	Low	65.7	Low	28 Å²	28	59.5 Å²	59.5	23%	0.231	35%	0.351	C	S	.	.	H	α-helix	trans	-81.3	-12.6	-176.2	0	0	0	0	0	113.3	E365 P371	E365-A369 WeakPolarHBondContact O-CB 3.37Å; E365-A369 PolarHBondContact O-N 2.9Å; A369-P371 WeakPolarHBondContact O-CD 3.37Å
370	H	62	Low	64.1	Low	70 Å²	70	60.2 Å²	60.2	32%	0.324	35%	0.35	S	S	.	.			trans	-119.7	57	178	-57.3	-86	0	0	0	112	A366 I368 I372 T373 F384	A366-H370 WeakPolarHBondContact O-CB 3.48Å; A366-H370 PolarHBondContact O-CD2 3.4Å; A366-H370 PolarHBondContact O-N 2.95Å; I368-H370 VanDerWaalsContact C-N 3.33Å; H370-I372 PolarHBondContact O-N 2.91Å; H370-I372 VanDerWaalsContact O-N 3.1Å; H370-T373 CarbonylContact O-C 3.53Å; H370-T373 WeakPolarHBondContact O-CA 3.31Å; H370-T373 WeakPolarHBondContact O-CB 3.21Å; H370-T373 PolarHBondContact O-N 3.38Å; H370-T373 PolarHBondContact O-OG1 3.38Å; H370-F384 HydrophobicContact CB-CE1 4.43Å; H370-F384 HydrophobicContact CB-CZ 4.38Å
371	P	48.1	Very low	62.2	Low	78 Å²	78	59.7 Å²	59.7	51%	0.506	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-67.1	-16	-167.6	27.2	-35.2	0	0	0	114.8	A369 T373 A374	A369-P371 WeakPolarHBondContact O-CD 3.37Å; P371-T373 PolarHBondContact O-N 3.45Å; P371-A374 PolarHBondContact O-N 2.9Å; P371-A374 VanDerWaalsContact O-N 3.16Å
372	I	38.2	Very low	60.8	Low	178 Å²	178	61.4 Å²	61.4	91%	0.913	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-70.3	-17.3	171.9	-60.5	177.1	0	0	0	110.9	H370	H370-I372 PolarHBondContact O-N 2.91Å; H370-I372 VanDerWaalsContact O-N 3.1Å
373	T	41.9	Very low	60.2	Low	51 Å²	51	65 Å²	65	31%	0.313	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-100.5	56.1	164.4	6.1	0	0	0	0	109.2	H370 P371 F375	H370-T373 CarbonylContact O-C 3.53Å; H370-T373 WeakPolarHBondContact O-CA 3.31Å; H370-T373 WeakPolarHBondContact O-CB 3.21Å; H370-T373 PolarHBondContact O-N 3.38Å; H370-T373 PolarHBondContact O-OG1 3.38Å; P371-T373 PolarHBondContact O-N 3.45Å; T373-F375 HydrophobicContact CG2-CE1 3.73Å; T373-F375 HydrophobicContact CG2-CE2 3.98Å; T373-F375 HydrophobicContact CG2-CZ 3.37Å; T373-F375 VanDerWaalsContact O-CD2 3.28Å; T373-F375 WeakPolarHBondContact O-CD2 3.5Å; T373-F375 PolarHBondContact O-N 2.69Å
374	A	39.3	Very low	59.3	Low	78 Å²	78	65.2 Å²	65.2	65%	0.645	38%	0.378	S	S	*	.			trans	-65.5	92.1	165.7	0	0	0	0	0	108	P371 T376	P371-A374 PolarHBondContact O-N 2.9Å; P371-A374 VanDerWaalsContact O-N 3.16Å; A374-T376 PolarHBondContact O-N 3.47Å
375	F	40.1	Very low	58.1	Low	57 Å²	57	65.4 Å²	65.4	25%	0.25	38%	0.38	C	S	.	.			trans	-68.1	104.5	175.5	-64.2	-67.9	0	0	0	108.1	T373 N377 D380 A381 F384	T373-F375 HydrophobicContact CG2-CE1 3.73Å; T373-F375 HydrophobicContact CG2-CE2 3.98Å; T373-F375 HydrophobicContact CG2-CZ 3.37Å; T373-F375 VanDerWaalsContact O-CD2 3.28Å; T373-F375 WeakPolarHBondContact O-CD2 3.5Å; T373-F375 PolarHBondContact O-N 2.69Å; F375-N377 WeakPolarHBondContact CB-O 3.31Å; F375-N377 PolarHBondContact O-N 2.9Å; F375-N377 VanDerWaalsContact O-N 3.13Å; F375-D380 HydrophobicContact CB-CB 4.49Å; F375-D380 VanDerWaalsContact CD1-C 3.48Å; F375-D380 HydrophobicContact CD1-CB 3.22Å; F375-D380 HydrophobicContact CE1-CB 3.63Å; F375-D380 WeakPolarHBondContact CE1-O 3.18Å; F375-D380 HydrophobicContact CG-CB 4.11Å; F375-A381 HydrophobicContact CB-CB 3.83Å; F375-A381 HydrophobicContact CD2-CB 3.6Å; F375-A381 HydrophobicContact CE2-CB 4.38Å; F375-A381 HydrophobicContact CG-CB 3.83Å; F375-F384 HydrophobicContact CE1-CB 4.29Å; F375-F384 HydrophobicContact CE2-CB 3.67Å; F375-F384 HydrophobicContact CE2-CD1 4.09Å; F375-F384 AromaticContact CE2-CG 3.91Å; F375-F384 HydrophobicContact CE2-CG 3.91Å; F375-F384 HydrophobicContact CZ-CB 3.3Å; F375-F384 HydrophobicContact CZ-CD1 4.33Å; F375-F384 HydrophobicContact CZ-CD2 4.14Å; F375-F384 AromaticContact CZ-CG 3.69Å; F375-F384 HydrophobicContact CZ-CG 3.69Å
376	T	44.7	Very low	57.7	Low	150 Å²	150	70.3 Å²	70.3	92%	0.92	40%	0.4	S	S	*	.	S	Bend	trans	-64.8	-4.7	164.8	50.1	0	0	0	0	111.9	A374	A374-T376 PolarHBondContact O-N 3.47Å
377	N	53.3	Low	57.9	Low	62 Å²	62	75.2 Å²	75.2	33%	0.332	42%	0.423	S	S	.	.	S	Bend	trans	-134.2	121.8	-174.1	-177.5	1.4	0	0	0	111.3	F375 D379 D380 A381	F375-N377 WeakPolarHBondContact CB-O 3.31Å; F375-N377 PolarHBondContact O-N 2.9Å; F375-N377 VanDerWaalsContact O-N 3.13Å; N377-D379 PolarHBondContact O-N 3.41Å; N377-D379 PolarHBondContact OD1-N 3.43Å; N377-D379 VanDerWaalsContact OD1-N 3.07Å; N377-D380 HydrophobicContact CB-CB 4.42Å; N377-D380 WeakPolarHBondContact CB-OD2 3.41Å; N377-D380 PolarHBondContact ND2-OD2 3.46Å; N377-D380 PolarHBondContact O-N 3.11Å; N377-D380 VanDerWaalsContact O-N 3.17Å; N377-A381 PolarHBondContact O-N 2.96Å
378	A	51.2	Low	57.7	Low	79 Å²	79	74.4 Å²	74.4	65%	0.653	42%	0.417	S	S	*	.	H	α-helix	trans	-57.7	-31.5	178.4	0	0	0	0	0	113.3	A381 A382	A378-A381 PolarHBondContact O-N 2.93Å; A378-A382 WeakPolarHBondContact O-CB 3.16Å; A378-A382 PolarHBondContact O-N 3.29Å
379	D	61.7	Low	57.3	Low	120 Å²	120	77.7 Å²	77.7	64%	0.642	43%	0.434	S	S	*	.	H	α-helix	trans	-66.5	-39.4	179.1	-68.8	-23	0	0	0	112	N377 A382 K383	N377-D379 PolarHBondContact O-N 3.41Å; N377-D379 PolarHBondContact OD1-N 3.43Å; N377-D379 VanDerWaalsContact OD1-N 3.07Å; D379-A382 PolarHBondContact O-N 3.31Å; D379-K383 WeakPolarHBondContact O-CB 3.41Å; D379-K383 PolarHBondContact O-N 3.11Å
380	D	55.1	Low	57.9	Low	72 Å²	72	80.9 Å²	80.9	39%	0.385	45%	0.448	S	S	.	.	H	α-helix	trans	-71.6	-36.2	179	-67.1	-44.6	0	0	0	110.7	F375 N377 K383 F384	F375-D380 HydrophobicContact CB-CB 4.49Å; F375-D380 VanDerWaalsContact CD1-C 3.48Å; F375-D380 HydrophobicContact CD1-CB 3.22Å; F375-D380 HydrophobicContact CE1-CB 3.63Å; F375-D380 WeakPolarHBondContact CE1-O 3.18Å; F375-D380 HydrophobicContact CG-CB 4.11Å; N377-D380 HydrophobicContact CB-CB 4.42Å; N377-D380 WeakPolarHBondContact CB-OD2 3.41Å; N377-D380 PolarHBondContact ND2-OD2 3.46Å; N377-D380 PolarHBondContact O-N 3.11Å; N377-D380 VanDerWaalsContact O-N 3.17Å; D380-K383 PolarHBondContact O-N 2.84Å; D380-F384 WeakPolarHBondContact O-CB 3.43Å; D380-F384 PolarHBondContact O-N 2.83Å
381	A	52.7	Low	58.5	Low	7 Å²	7	83.4 Å²	83.4	6%	0.058	46%	0.455	C	S	.	.	H	α-helix	trans	-61.4	-47.5	171.1	0	0	0	0	0	111.8	N367 F375 N377 A378 K383 F384 A385	N367-A381 WeakPolarHBondContact OD1-CB 3.11Å; F375-A381 HydrophobicContact CB-CB 3.83Å; F375-A381 HydrophobicContact CD2-CB 3.6Å; F375-A381 HydrophobicContact CE2-CB 4.38Å; F375-A381 HydrophobicContact CG-CB 3.83Å; N377-A381 PolarHBondContact O-N 2.96Å; A378-A381 PolarHBondContact O-N 2.93Å; A381-K383 VanDerWaalsContact C-N 3.32Å; A381-K383 PolarHBondContact O-N 2.81Å; A381-F384 PolarHBondContact O-N 3.12Å; A381-A385 WeakPolarHBondContact O-CB 3.19Å; A381-A385 PolarHBondContact O-N 3.39Å
382	A	61	Low	59.6	Low	52 Å²	52	83 Å²	83	43%	0.43	45%	0.448	S	S	.	.	H	α-helix	trans	-62.2	-40.2	176.9	0	0	0	0	0	111.5	A378 D379 A385 K386	A378-A382 WeakPolarHBondContact O-CB 3.16Å; A378-A382 PolarHBondContact O-N 3.29Å; D379-A382 PolarHBondContact O-N 3.31Å; A382-A385 PolarHBondContact O-N 3.26Å; A382-K386 WeakPolarHBondContact O-CB 3.42Å; A382-K386 PolarHBondContact O-N 2.98Å
383	K	69.5	Low	61.4	Low	121 Å²	121	75.7 Å²	75.7	53%	0.526	42%	0.417	S	S	.	.	H	α-helix	trans	-62.5	-49	175.9	-178.2	-177.2	172	-170.6	0	111.8	D379 D380 A381 K386 E387	D379-K383 WeakPolarHBondContact O-CB 3.41Å; D379-K383 PolarHBondContact O-N 3.11Å; D380-K383 PolarHBondContact O-N 2.84Å; A381-K383 VanDerWaalsContact C-N 3.32Å; A381-K383 PolarHBondContact O-N 2.81Å; K383-K386 WeakPolarHBondContact O-CB 3.38Å; K383-K386 PolarHBondContact O-N 2.84Å; K383-E387 WeakPolarHBondContact CE-OE1 3.34Å; K383-E387 WeakPolarHBondContact O-CG 2.9Å; K383-E387 PolarHBondContact O-N 3.21Å
384	F	61.9	Low	63.6	Low	53 Å²	53	80.3 Å²	80.3	23%	0.232	43%	0.429	C	S	.	.	H	α-helix	trans	-63.8	-41.8	178.2	177.3	-92.5	0	0	0	112.1	A366 H370 F375 D380 A381 K386 E387 K388	A366-F384 HydrophobicContact CB-CD1 3.99Å; A366-F384 HydrophobicContact CB-CE1 4.15Å; H370-F384 HydrophobicContact CB-CE1 4.43Å; H370-F384 HydrophobicContact CB-CZ 4.38Å; F375-F384 HydrophobicContact CE1-CB 4.29Å; F375-F384 HydrophobicContact CE2-CB 3.67Å; F375-F384 HydrophobicContact CE2-CD1 4.09Å; F375-F384 AromaticContact CE2-CG 3.91Å; F375-F384 HydrophobicContact CE2-CG 3.91Å; F375-F384 HydrophobicContact CZ-CB 3.3Å; F375-F384 HydrophobicContact CZ-CD1 4.33Å; F375-F384 HydrophobicContact CZ-CD2 4.14Å; F375-F384 AromaticContact CZ-CG 3.69Å; F375-F384 HydrophobicContact CZ-CG 3.69Å; D380-F384 WeakPolarHBondContact O-CB 3.43Å; D380-F384 PolarHBondContact O-N 2.83Å; A381-F384 PolarHBondContact O-N 3.12Å; F384-K386 VanDerWaalsContact C-N 3.3Å; F384-K386 PolarHBondContact O-N 2.9Å; F384-E387 PolarHBondContact O-N 2.93Å; F384-K388 WeakPolarHBondContact O-CB 3.46Å; F384-K388 PolarHBondContact O-N 2.65Å
385	A	62.8	Low	65.4	Low	6 Å²	6	79.6 Å²	79.6	5%	0.05	41%	0.413	C	S	.	.	H	α-helix	trans	-56.7	-44.7	173.4	0	0	0	0	0	111.5	I362 A381 A382 K388 L389	I362-A385 HydrophobicContact CG2-CB 3.95Å; A381-A385 WeakPolarHBondContact O-CB 3.19Å; A381-A385 PolarHBondContact O-N 3.39Å; A382-A385 PolarHBondContact O-N 3.26Å; A385-K388 PolarHBondContact O-N 2.79Å; A385-L389 WeakPolarHBondContact O-CG 3.1Å; A385-L389 PolarHBondContact O-N 2.93Å
386	K	74.2	Confident	67.2	Low	140 Å²	140	82.5 Å²	82.5	61%	0.609	43%	0.427	S	S	*	.	H	α-helix	trans	-62.6	-45.8	175.3	-175.6	179.1	178.5	177.4	0	112.5	A382 K383 F384 K388 L389 D390	A382-K386 WeakPolarHBondContact O-CB 3.42Å; A382-K386 PolarHBondContact O-N 2.98Å; K383-K386 WeakPolarHBondContact O-CB 3.38Å; K383-K386 PolarHBondContact O-N 2.84Å; F384-K386 VanDerWaalsContact C-N 3.3Å; F384-K386 PolarHBondContact O-N 2.9Å; K386-K388 VanDerWaalsContact C-N 3.28Å; K386-K388 PolarHBondContact O-N 3.26Å; K386-L389 WeakPolarHBondContact O-CB 3.48Å; K386-L389 PolarHBondContact O-N 3.23Å; K386-D390 PolarHBondContact O-N 3.15Å
387	E	76.9	Confident	69.1	Low	103 Å²	103	82.3 Å²	82.3	48%	0.481	41%	0.413	S	S	.	.	H	α-helix	trans	-62.5	-36.7	177.5	-72.3	175	177.7	0	0	111.9	K383 F384 D390 Y391	K383-E387 WeakPolarHBondContact CE-OE1 3.34Å; K383-E387 WeakPolarHBondContact O-CG 2.9Å; K383-E387 PolarHBondContact O-N 3.21Å; F384-E387 PolarHBondContact O-N 2.93Å; E387-D390 PolarHBondContact O-N 3.29Å; E387-Y391 PolarHBondContact O-N 3.09Å
388	K	68.3	Low	70.7	Confident	42 Å²	42	84.6 Å²	84.6	18%	0.183	42%	0.422	C	S	.	.	H	α-helix	trans	-67.5	-42.2	174.2	-169.5	178.9	176.8	-164	0	111.7	E365 F384 A385 K386 Y391 I392	E365-K388 IonicContact OE1-NZ 2.65Å; E365-K388 PolarHBondContact OE1-NZ 3.39Å; F384-K388 WeakPolarHBondContact O-CB 3.46Å; F384-K388 PolarHBondContact O-N 2.65Å; A385-K388 PolarHBondContact O-N 2.79Å; K386-K388 VanDerWaalsContact C-N 3.28Å; K386-K388 PolarHBondContact O-N 3.26Å; K388-Y391 WeakPolarHBondContact O-CB 3.44Å; K388-Y391 PolarHBondContact O-N 2.97Å; K388-I392 HydrophobicContact CG-CD1 4.19Å; K388-I392 WeakPolarHBondContact O-CG1 3.36Å; K388-I392 PolarHBondContact O-N 3.48Å
389	L	70.9	Confident	71.9	Confident	84 Å²	84	85.6 Å²	85.6	44%	0.44	42%	0.416	S	S	.	.	H	α-helix	trans	-58.5	-46.6	172.6	-82	171.6	0	0	0	111.6	I362 A385 K386 Y391 I392 G393	I362-L389 HydrophobicContact CD1-CD1 4.05Å; I362-L389 HydrophobicContact CD1-CD2 3.56Å; I362-L389 HydrophobicContact CD1-CG 4.11Å; I362-L389 HydrophobicContact CG1-CD2 4.45Å; I362-L389 HydrophobicContact CG2-CG 4.34Å; A385-L389 WeakPolarHBondContact O-CG 3.1Å; A385-L389 PolarHBondContact O-N 2.93Å; K386-L389 WeakPolarHBondContact O-CB 3.48Å; K386-L389 PolarHBondContact O-N 3.23Å; L389-Y391 VanDerWaalsContact C-N 3.3Å; L389-Y391 PolarHBondContact O-N 3.05Å; L389-I392 PolarHBondContact O-N 2.9Å; L389-G393 PolarHBondContact O-N 2.97Å
390	D	81	Confident	72.9	Confident	96 Å²	96	85.5 Å²	85.5	51%	0.513	41%	0.412	S	S	.	.	H	α-helix	trans	-61.9	-38	177	-73.4	-19.9	0	0	0	111.7	K386 E387 R394	K386-D390 PolarHBondContact O-N 3.15Å; E387-D390 PolarHBondContact O-N 3.29Å; D390-R394 WeakPolarHBondContact O-CG 3.34Å; D390-R394 PolarHBondContact O-N 3.24Å; D390-R394 VanDerWaalsContact O-N 3.13Å
391	Y	76.4	Confident	74.4	Confident	122 Å²	122	86.5 Å²	86.5	48%	0.478	42%	0.42	S	S	.	.	H	α-helix	trans	-64	-49.5	173	172.6	-100.3	0	0	0	112.3	E387 K388 L389 G393 R394 M395	E387-Y391 PolarHBondContact O-N 3.09Å; K388-Y391 WeakPolarHBondContact O-CB 3.44Å; K388-Y391 PolarHBondContact O-N 2.97Å; L389-Y391 VanDerWaalsContact C-N 3.3Å; L389-Y391 PolarHBondContact O-N 3.05Å; Y391-G393 VanDerWaalsContact C-N 3.32Å; Y391-G393 PolarHBondContact O-N 2.92Å; Y391-R394 WeakPolarHBondContact O-CB 3.45Å; Y391-R394 PolarHBondContact O-N 3.24Å; Y391-R394 VanDerWaalsContact O-N 3.16Å; Y391-M395 HydrophobicContact CD1-CG 4.27Å; Y391-M395 HydrophobicContact CD2-CG 4.37Å; Y391-M395 HydrophobicContact CE1-CG 3.83Å; Y391-M395 HydrophobicContact CE1-SD 4.44Å; Y391-M395 HydrophobicContact CE2-CG 3.95Å; Y391-M395 HydrophobicContact CE2-SD 4Å; Y391-M395 WeakPolarHBondContact O-CG 3.48Å; Y391-M395 PolarHBondContact O-N 3.37Å; Y391-M395 PolarHBondContact OH-SD 3.26Å
392	I	70	Confident	75.7	Confident	70 Å²	70	90.9 Å²	90.9	36%	0.359	45%	0.446	S	S	.	.	H	α-helix	trans	-59.8	-43.6	178.5	-68.9	167.6	0	0	0	110.5	K388 L389 R394 M395 Q396	K388-I392 HydrophobicContact CG-CD1 4.19Å; K388-I392 WeakPolarHBondContact O-CG1 3.36Å; K388-I392 PolarHBondContact O-N 3.48Å; L389-I392 PolarHBondContact O-N 2.9Å; I392-R394 VanDerWaalsContact C-N 3.31Å; I392-R394 PolarHBondContact O-N 3.23Å; I392-M395 PolarHBondContact O-N 3.41Å; I392-M395 VanDerWaalsContact O-N 3.1Å; I392-Q396 HydrophobicContact CG2-CG 4.46Å; I392-Q396 PolarHBondContact O-N 2.93Å
393	G	77.2	Confident	76.3	Confident	25 Å²	25	95.2 Å²	95.2	26%	0.258	46%	0.459	S	S	.	.	H	α-helix	trans	-62.6	-34.7	177.3	0	0	0	0	0	113.4	L389 Y391 K397	L389-G393 PolarHBondContact O-N 2.97Å; Y391-G393 VanDerWaalsContact C-N 3.32Å; Y391-G393 PolarHBondContact O-N 2.92Å; G393-K397 WeakPolarHBondContact O-CG 3.43Å; G393-K397 PolarHBondContact O-N 3.25Å
394	R	86.8	Confident	76.9	Confident	148 Å²	148	95.9 Å²	95.9	56%	0.558	47%	0.469	S	S	*	.	H	α-helix	trans	-66.3	-44.4	170.4	-73.9	-173.1	-64	141.4	-5.2	111.7	D390 Y391 I392 Q396 K397 E398	D390-R394 WeakPolarHBondContact O-CG 3.34Å; D390-R394 PolarHBondContact O-N 3.24Å; D390-R394 VanDerWaalsContact O-N 3.13Å; Y391-R394 WeakPolarHBondContact O-CB 3.45Å; Y391-R394 PolarHBondContact O-N 3.24Å; Y391-R394 VanDerWaalsContact O-N 3.16Å; I392-R394 VanDerWaalsContact C-N 3.31Å; I392-R394 PolarHBondContact O-N 3.23Å; R394-Q396 PolarHBondContact O-N 2.89Å; R394-K397 WeakPolarHBondContact O-CB 3.43Å; R394-K397 PolarHBondContact O-N 3.17Å; R394-E398 PolarHBondContact O-N 2.87Å
395	M	77.1	Confident	77.7	Confident	63 Å²	63	97 Å²	97	31%	0.31	48%	0.48	S	S	.	.	H	α-helix	trans	-65.3	-36.7	179.3	-63.4	-81.5	66.7	0	0	113	Y391 I392 E398 L399	Y391-M395 HydrophobicContact CD1-CG 4.27Å; Y391-M395 HydrophobicContact CD2-CG 4.37Å; Y391-M395 HydrophobicContact CE1-CG 3.83Å; Y391-M395 HydrophobicContact CE1-SD 4.44Å; Y391-M395 HydrophobicContact CE2-CG 3.95Å; Y391-M395 HydrophobicContact CE2-SD 4Å; Y391-M395 WeakPolarHBondContact O-CG 3.48Å; Y391-M395 PolarHBondContact O-N 3.37Å; Y391-M395 PolarHBondContact OH-SD 3.26Å; I392-M395 PolarHBondContact O-N 3.41Å; I392-M395 VanDerWaalsContact O-N 3.1Å; M395-E398 HydrophobicContact CE-CB 4.07Å; M395-E398 HydrophobicContact CE-CG 4.03Å; M395-E398 WeakPolarHBondContact CE-OE1 3.45Å; M395-E398 WeakPolarHBondContact CE-OE2 3.36Å; M395-E398 PolarHBondContact O-N 3.22Å; M395-L399 WeakPolarHBondContact O-CB 3.28Å; M395-L399 PolarHBondContact O-N 3.37Å
396	Q	77.6	Confident	78.2	Confident	118 Å²	118	102.2 Å²	102.2	55%	0.551	51%	0.513	S	S	*	.	H	α-helix	trans	-60.9	-43.6	172	-78.8	179.4	-30.5	0	0	111.7	I392 R394 E398 L399 E400	I392-Q396 HydrophobicContact CG2-CG 4.46Å; I392-Q396 PolarHBondContact O-N 2.93Å; R394-Q396 PolarHBondContact O-N 2.89Å; Q396-E398 VanDerWaalsContact C-N 3.35Å; Q396-E398 PolarHBondContact O-N 3.07Å; Q396-L399 PolarHBondContact O-N 3.28Å; Q396-E400 WeakPolarHBondContact O-CB 3.36Å; Q396-E400 WeakPolarHBondContact O-CG 3.16Å; Q396-E400 PolarHBondContact O-N 3.5Å
397	K	86.1	Confident	77.8	Confident	145 Å²	145	102.6 Å²	102.6	63%	0.63	53%	0.527	S	S	*	.	H	α-helix	trans	-63.6	-39.6	175.7	-73.1	176.2	-179.2	176.5	0	112.5	G393 R394 T401	G393-K397 WeakPolarHBondContact O-CG 3.43Å; G393-K397 PolarHBondContact O-N 3.25Å; R394-K397 WeakPolarHBondContact O-CB 3.43Å; R394-K397 PolarHBondContact O-N 3.17Å; K397-T401 WeakPolarHBondContact O-CB 3.33Å; K397-T401 PolarHBondContact O-N 3.42Å; K397-T401 PolarHBondContact O-OG1 2.94Å
398	E	86.9	Confident	77.4	Confident	110 Å²	110	102.1 Å²	102.1	51%	0.514	54%	0.535	S	S	.	.	H	α-helix	trans	-64.5	-44.3	174.1	-72.6	-177.6	-150.4	0	0	111	R394 M395 Q396 T401 V402	R394-E398 PolarHBondContact O-N 2.87Å; M395-E398 HydrophobicContact CE-CB 4.07Å; M395-E398 HydrophobicContact CE-CG 4.03Å; M395-E398 WeakPolarHBondContact CE-OE1 3.45Å; M395-E398 WeakPolarHBondContact CE-OE2 3.36Å; M395-E398 PolarHBondContact O-N 3.22Å; Q396-E398 VanDerWaalsContact C-N 3.35Å; Q396-E398 PolarHBondContact O-N 3.07Å; E398-T401 WeakPolarHBondContact O-CB 3.49Å; E398-T401 PolarHBondContact O-N 2.97Å; E398-V402 WeakPolarHBondContact O-CG2 3.36Å; E398-V402 PolarHBondContact O-N 3.44Å
399	L	76.7	Confident	77.2	Confident	101 Å²	101	108.9 Å²	108.9	53%	0.529	57%	0.567	S	S	.	*	H	α-helix	trans	-61.8	-46.2	176	-178.6	63.7	0	0	0	112	M395 Q396 T401 V402 M403	M395-L399 WeakPolarHBondContact O-CB 3.28Å; M395-L399 PolarHBondContact O-N 3.37Å; Q396-L399 PolarHBondContact O-N 3.28Å; L399-T401 PolarHBondContact O-N 3.26Å; L399-V402 PolarHBondContact O-N 3.13Å; L399-V402 VanDerWaalsContact O-N 3.14Å; L399-M403 HydrophobicContact CD1-CG 4.23Å; L399-M403 HydrophobicContact CD1-SD 4.41Å; L399-M403 HydrophobicContact CD2-SD 4.49Å; L399-M403 HydrophobicContact CG-CG 4.31Å; L399-M403 HydrophobicContact CG-SD 4.04Å; L399-M403 WeakPolarHBondContact O-CB 3.35Å; L399-M403 VanDerWaalsContact O-CG 3.32Å; L399-M403 WeakPolarHBondContact O-CG 3.38Å; L399-M403 PolarHBondContact O-N 2.88Å
400	E	81.1	Confident	77.1	Confident	118 Å²	118	110 Å²	110	55%	0.551	57%	0.571	S	S	*	*	H	α-helix	trans	-58.4	-39.7	174.2	-78	177.7	177	0	0	111.3	Q396 N404	Q396-E400 WeakPolarHBondContact O-CB 3.36Å; Q396-E400 WeakPolarHBondContact O-CG 3.16Å; Q396-E400 PolarHBondContact O-N 3.5Å; E400-N404 WeakPolarHBondContact O-CB 3.44Å; E400-N404 VanDerWaalsContact O-CG 3.3Å; E400-N404 PolarHBondContact O-N 2.74Å; E400-N404 PolarHBondContact O-ND2 2.95Å
401	T	86.6	Confident	76.9	Confident	92 Å²	92	108.8 Å²	108.8	56%	0.564	57%	0.567	S	S	*	*	H	α-helix	trans	-62.8	-45.9	175.3	-57.6	0	0	0	0	110.7	K397 E398 L399 N404 T405	K397-T401 WeakPolarHBondContact O-CB 3.33Å; K397-T401 PolarHBondContact O-N 3.42Å; K397-T401 PolarHBondContact O-OG1 2.94Å; E398-T401 WeakPolarHBondContact O-CB 3.49Å; E398-T401 PolarHBondContact O-N 2.97Å; L399-T401 PolarHBondContact O-N 3.26Å; T401-N404 PolarHBondContact O-N 2.66Å; T401-T405 PolarHBondContact O-N 3.1Å; T401-T405 PolarHBondContact O-OG1 3.21Å
402	V	81.7	Confident	76.8	Confident	100 Å²	100	111.4 Å²	111.4	61%	0.606	58%	0.583	S	S	*	*	H	α-helix	trans	-63.7	-46	177.7	172.3	0	0	0	0	111.4	E398 L399 N404 T405	E398-V402 WeakPolarHBondContact O-CG2 3.36Å; E398-V402 PolarHBondContact O-N 3.44Å; L399-V402 PolarHBondContact O-N 3.13Å; L399-V402 VanDerWaalsContact O-N 3.14Å; V402-N404 VanDerWaalsContact C-N 3.27Å; V402-N404 PolarHBondContact O-N 2.65Å; V402-T405 WeakPolarHBondContact O-CB 3.4Å; V402-T405 PolarHBondContact O-N 2.66Å; V402-T405 VanDerWaalsContact O-N 3.1Å
403	M	72.8	Confident	77.2	Confident	143 Å²	143	115.6 Å²	115.6	70%	0.704	60%	0.601	S	S	*	*	H	α-helix	trans	-63.5	-32.1	179.5	-73.2	-178.6	65	0	0	113.1	L399	L399-M403 HydrophobicContact CD1-CG 4.23Å; L399-M403 HydrophobicContact CD1-SD 4.41Å; L399-M403 HydrophobicContact CD2-SD 4.49Å; L399-M403 HydrophobicContact CG-CG 4.31Å; L399-M403 HydrophobicContact CG-SD 4.04Å; L399-M403 WeakPolarHBondContact O-CB 3.35Å; L399-M403 VanDerWaalsContact O-CG 3.32Å; L399-M403 WeakPolarHBondContact O-CG 3.38Å; L399-M403 PolarHBondContact O-N 2.88Å
404	N	82.2	Confident	77.1	Confident	134 Å²	134	117.7 Å²	117.7	72%	0.717	61%	0.606	S	S	*	*	H	α-helix	trans	-88.9	-8.2	176.8	-69.2	-49.8	0	0	0	113.2	E400 T401 V402	E400-N404 WeakPolarHBondContact O-CB 3.44Å; E400-N404 VanDerWaalsContact O-CG 3.3Å; E400-N404 PolarHBondContact O-N 2.74Å; E400-N404 PolarHBondContact O-ND2 2.95Å; T401-N404 PolarHBondContact O-N 2.66Å; V402-N404 VanDerWaalsContact C-N 3.27Å; V402-N404 PolarHBondContact O-N 2.65Å
405	T	79	Confident	76.3	Confident	78 Å²	78	115.1 Å²	115.1	48%	0.479	60%	0.603	S	S	.	*	S	Bend	trans	-73.6	127.8	173.4	-60.6	0	0	0	0	108.2	T401 V402 V407	T401-T405 PolarHBondContact O-N 3.1Å; T401-T405 PolarHBondContact O-OG1 3.21Å; V402-T405 WeakPolarHBondContact O-CB 3.4Å; V402-T405 PolarHBondContact O-N 2.66Å; V402-T405 VanDerWaalsContact O-N 3.1Å; T405-V407 PolarHBondContact O-N 3.01Å
406	P	73.2	Confident	76.4	Confident	115 Å²	115	118.3 Å²	118.3	75%	0.747	62%	0.615	S	S	*	*			trans	-55	127.9	176.4	-21.8	31	0	0	0	110	S408	P406-S408 PolarHBondContact O-N 2.97Å
407	V	65.2	Low	76.4	Confident	147 Å²	147	118.8 Å²	118.8	89%	0.891	62%	0.616	S	S	*	*			trans	-60.7	106.7	174.4	-176.7	0	0	0	0	107.6	T405	T405-V407 PolarHBondContact O-N 3.01Å
408	S	69.3	Low	75.7	Confident	93 Å²	93	115.8 Å²	115.8	65%	0.65	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-69.2	145.3	166.5	52.8	0	0	0	0	108.7	P406 E410	P406-S408 PolarHBondContact O-N 2.97Å; S408-E410 PolarHBondContact O-N 3.03Å
409	E	64.2	Low	74.9	Confident	185 Å²	185	117 Å²	117	86%	0.864	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-53.6	128.9	168.5	-71.3	-179.1	165.5	0	0	109	T411	E409-T411 PolarHBondContact O-N 3.15Å
410	E	67.5	Low	74.9	Confident	108 Å²	108	116.4 Å²	116.4	51%	0.505	61%	0.605	S	S	.	*	P	Polyproline II helix	trans	-56.3	128	176.6	-69.4	-172.8	152.1	0	0	109	S408 D414 L415 N418	S408-E410 PolarHBondContact O-N 3.03Å; E410-D414 HydrophobicContact CB-CB 4.11Å; E410-L415 HydrophobicContact CB-CG 4.18Å; E410-L415 WeakPolarHBondContact OE2-CD2 3.32Å; E410-N418 PolarHBondContact OE1-ND2 2.85Å; E410-N418 VanDerWaalsContact OE1-ND2 3.09Å
411	T	77.8	Confident	74.3	Confident	70 Å²	70	116.3 Å²	116.3	43%	0.429	60%	0.604	S	S	.	*	P	Polyproline II helix	trans	-69.4	161.6	174.5	64.8	0	0	0	0	110	E409 E413 D414 L415	E409-T411 PolarHBondContact O-N 3.15Å; T411-E413 PolarHBondContact O-N 3.22Å; T411-E413 VanDerWaalsContact O-N 3.15Å; T411-D414 WeakPolarHBondContact CB-OD2 3.37Å; T411-D414 PolarHBondContact N-OD2 3.45Å; T411-D414 PolarHBondContact O-N 3.24Å; T411-D414 PolarHBondContact OG1-N 3.43Å; T411-D414 PolarHBondContact OG1-OD2 2.94Å; T411-L415 PolarHBondContact O-N 2.83Å
412	E	73	Confident	73.2	Confident	176 Å²	176	113.5 Å²	113.5	82%	0.822	59%	0.594	S	S	*	*	H	α-helix	trans	-57.7	-28.7	174.7	-160.8	174.4	-167.4	0	0	111.8	K416	E412-K416 WeakPolarHBondContact O-CB 3.41Å; E412-K416 PolarHBondContact O-N 3.31Å
413	E	79.6	Confident	72.6	Confident	159 Å²	159	113.7 Å²	113.7	74%	0.743	59%	0.588	S	S	*	*	H	α-helix	trans	-71.6	-39.8	173.2	-73.3	176.8	151.6	0	0	112.8	T411 K416 K417	T411-E413 PolarHBondContact O-N 3.22Å; T411-E413 VanDerWaalsContact O-N 3.15Å; E413-K416 PolarHBondContact O-N 3.5Å; E413-K417 WeakPolarHBondContact O-CB 3.34Å; E413-K417 PolarHBondContact O-N 2.95Å
414	D	73.9	Confident	72.7	Confident	69 Å²	69	112.7 Å²	112.7	37%	0.369	58%	0.581	S	S	.	*	H	α-helix	trans	-64	-44.6	175.6	-63	-47	0	0	0	110.9	E410 T411 K416 K417 N418	E410-D414 HydrophobicContact CB-CB 4.11Å; T411-D414 WeakPolarHBondContact CB-OD2 3.37Å; T411-D414 PolarHBondContact N-OD2 3.45Å; T411-D414 PolarHBondContact O-N 3.24Å; T411-D414 PolarHBondContact OG1-N 3.43Å; T411-D414 PolarHBondContact OG1-OD2 2.94Å; D414-K416 VanDerWaalsContact C-N 3.33Å; D414-K416 PolarHBondContact O-N 3.15Å; D414-K417 PolarHBondContact O-N 3.41Å; D414-N418 WeakPolarHBondContact O-CB 3.46Å; D414-N418 VanDerWaalsContact O-CG 3.3Å; D414-N418 PolarHBondContact O-N 3.1Å
415	L	70.5	Confident	71.8	Confident	93 Å²	93	109.2 Å²	109.2	49%	0.487	57%	0.571	S	S	.	*	H	α-helix	trans	-59.4	-44	174.7	-75.4	167.8	0	0	0	111.7	E410 T411 N418 F419	E410-L415 HydrophobicContact CB-CG 4.18Å; E410-L415 WeakPolarHBondContact OE2-CD2 3.32Å; T411-L415 PolarHBondContact O-N 2.83Å; L415-N418 PolarHBondContact O-N 3Å; L415-F419 WeakPolarHBondContact O-CB 3.4Å; L415-F419 PolarHBondContact O-N 3.16Å
416	K	78.9	Confident	71.3	Confident	131 Å²	131	110 Å²	110	57%	0.57	57%	0.571	S	S	*	*	H	α-helix	trans	-62.3	-43.6	176.6	-175.3	-180	175.3	-173	0	111.5	E412 E413 D414 F419 E420	E412-K416 WeakPolarHBondContact O-CB 3.41Å; E412-K416 PolarHBondContact O-N 3.31Å; E413-K416 PolarHBondContact O-N 3.5Å; D414-K416 VanDerWaalsContact C-N 3.33Å; D414-K416 PolarHBondContact O-N 3.15Å; K416-F419 WeakPolarHBondContact O-CB 3.38Å; K416-F419 PolarHBondContact O-N 2.92Å; K416-E420 WeakPolarHBondContact CE-OE1 3.43Å; K416-E420 WeakPolarHBondContact O-CG 3.48Å; K416-E420 PolarHBondContact O-N 2.89Å
417	K	78.1	Confident	71.4	Confident	128 Å²	128	109.7 Å²	109.7	56%	0.557	56%	0.563	S	S	*	*	H	α-helix	trans	-67	-40.7	179.2	-166.4	179	-179.6	-175.4	0	112.1	E413 D414 F419 E420 H421	E413-K417 WeakPolarHBondContact O-CB 3.34Å; E413-K417 PolarHBondContact O-N 2.95Å; D414-K417 PolarHBondContact O-N 3.41Å; K417-F419 VanDerWaalsContact C-N 3.32Å; K417-F419 PolarHBondContact O-N 3.33Å; K417-E420 PolarHBondContact O-N 2.87Å; K417-H421 PolarHBondContact O-N 3.35Å
418	N	71.2	Confident	71.7	Confident	82 Å²	82	105.7 Å²	105.7	44%	0.439	55%	0.546	S	S	.	.	H	α-helix	trans	-61.9	-41.1	173.6	-74.9	-15.5	0	0	0	111.3	E410 D414 L415 G422	E410-N418 PolarHBondContact OE1-ND2 2.85Å; E410-N418 VanDerWaalsContact OE1-ND2 3.09Å; D414-N418 WeakPolarHBondContact O-CB 3.46Å; D414-N418 VanDerWaalsContact O-CG 3.3Å; D414-N418 PolarHBondContact O-N 3.1Å; L415-N418 PolarHBondContact O-N 3Å; N418-G422 PolarHBondContact O-N 3.3Å
419	F	70.9	Confident	71.8	Confident	136 Å²	136	107.5 Å²	107.5	60%	0.596	54%	0.544	S	S	*	.	H	α-helix	trans	-64.5	-44.6	175.2	-172.6	-94.6	0	0	0	112.4	L415 K416 K417 G422 Q423	L415-F419 WeakPolarHBondContact O-CB 3.4Å; L415-F419 PolarHBondContact O-N 3.16Å; K416-F419 WeakPolarHBondContact O-CB 3.38Å; K416-F419 PolarHBondContact O-N 2.92Å; K417-F419 VanDerWaalsContact C-N 3.32Å; K417-F419 PolarHBondContact O-N 3.33Å; F419-G422 PolarHBondContact O-N 2.97Å; F419-Q423 HydrophobicContact CD1-CG 4.35Å; F419-Q423 HydrophobicContact CE1-CG 4.02Å; F419-Q423 HydrophobicContact CZ-CG 4.46Å; F419-Q423 PolarHBondContact O-N 3.07Å
420	E	76.8	Confident	72.5	Confident	88 Å²	88	104 Å²	104	41%	0.411	53%	0.527	S	S	.	.	H	α-helix	trans	-62.8	-42.7	176.7	-74.4	174.4	-178.5	0	0	112	K416 K417 Q423 Q424	K416-E420 WeakPolarHBondContact CE-OE1 3.43Å; K416-E420 WeakPolarHBondContact O-CG 3.48Å; K416-E420 PolarHBondContact O-N 2.89Å; K417-E420 PolarHBondContact O-N 2.87Å; E420-Q423 PolarHBondContact O-N 2.93Å; E420-Q424 WeakPolarHBondContact O-CG 3.37Å; E420-Q424 PolarHBondContact O-N 3.34Å
421	H	67.3	Low	72.9	Confident	115 Å²	115	101.2 Å²	101.2	53%	0.532	52%	0.523	S	S	.	.	H	α-helix	trans	-61.5	-42.4	172.4	-93.1	-174.7	0	0	0	112.3	K417 Q423 Q424 A425	K417-H421 PolarHBondContact O-N 3.35Å; H421-Q423 VanDerWaalsContact C-N 3.33Å; H421-Q423 PolarHBondContact O-N 2.91Å; H421-Q424 PolarHBondContact O-N 3.02Å; H421-A425 PolarHBondContact O-N 3.45Å
422	G	63.3	Low	72.6	Confident	34 Å²	34	100.2 Å²	100.2	35%	0.351	52%	0.522	S	S	.	.	H	α-helix	trans	-59.3	-42	174.7	0	0	0	0	0	112.6	N418 F419 A425 I426	N418-G422 PolarHBondContact O-N 3.3Å; F419-G422 PolarHBondContact O-N 2.97Å; G422-A425 PolarHBondContact O-N 2.97Å; G422-I426 WeakPolarHBondContact O-CG1 3.33Å; G422-I426 PolarHBondContact O-N 2.96Å; G422-I426 VanDerWaalsContact O-N 3.15Å
423	Q	69.2	Low	72.8	Confident	103 Å²	103	97.3 Å²	97.3	48%	0.481	51%	0.508	S	S	.	.	H	α-helix	trans	-64.4	-40.9	175.1	-73.9	-166.8	-32.7	0	0	112.7	F419 E420 H421 I426 L427	F419-Q423 HydrophobicContact CD1-CG 4.35Å; F419-Q423 HydrophobicContact CE1-CG 4.02Å; F419-Q423 HydrophobicContact CZ-CG 4.46Å; F419-Q423 PolarHBondContact O-N 3.07Å; E420-Q423 PolarHBondContact O-N 2.93Å; H421-Q423 VanDerWaalsContact C-N 3.33Å; H421-Q423 PolarHBondContact O-N 2.91Å; Q423-I426 PolarHBondContact O-N 3.37Å; Q423-L427 WeakPolarHBondContact O-CG 3.46Å; Q423-L427 PolarHBondContact O-N 3.24Å
424	Q	74.7	Confident	72.7	Confident	122 Å²	122	92.7 Å²	92.7	57%	0.57	50%	0.497	S	S	*	.	H	α-helix	trans	-65.4	-38.6	177.3	-71.9	179.1	6.4	0	0	112.3	E420 H421 L427 A428	E420-Q424 WeakPolarHBondContact O-CG 3.37Å; E420-Q424 PolarHBondContact O-N 3.34Å; H421-Q424 PolarHBondContact O-N 3.02Å; Q424-L427 PolarHBondContact O-N 3.44Å; Q424-A428 WeakPolarHBondContact O-CB 3.37Å; Q424-A428 PolarHBondContact O-N 3.06Å
425	A	63.5	Low	72.5	Confident	61 Å²	61	95.2 Å²	95.2	50%	0.504	51%	0.51	S	S	.	.	H	α-helix	trans	-62.7	-45.4	176.2	0	0	0	0	0	111.9	H421 G422 L427 A428 E429	H421-A425 PolarHBondContact O-N 3.45Å; G422-A425 PolarHBondContact O-N 2.97Å; A425-L427 VanDerWaalsContact C-N 3.34Å; A425-L427 PolarHBondContact O-N 2.98Å; A425-A428 PolarHBondContact O-N 3.22Å; A425-E429 PolarHBondContact O-N 2.98Å
426	I	69.8	Low	72.3	Confident	94 Å²	94	96.4 Å²	96.4	48%	0.482	52%	0.517	S	S	.	.	H	α-helix	trans	-60.4	-44.2	176	-66.5	165.1	0	0	0	111	G422 Q423 A428 E429 Q430	G422-I426 WeakPolarHBondContact O-CG1 3.33Å; G422-I426 PolarHBondContact O-N 2.96Å; G422-I426 VanDerWaalsContact O-N 3.15Å; Q423-I426 PolarHBondContact O-N 3.37Å; I426-A428 VanDerWaalsContact C-N 3.33Å; I426-A428 PolarHBondContact O-N 3.01Å; I426-E429 PolarHBondContact O-N 2.99Å; I426-Q430 HydrophobicContact CG2-CG 4.49Å; I426-Q430 WeakPolarHBondContact O-CG 3.36Å; I426-Q430 PolarHBondContact O-N 3.36Å
427	L	75.3	Confident	71.5	Confident	110 Å²	110	97.7 Å²	97.7	58%	0.576	53%	0.525	S	S	*	.	H	α-helix	trans	-63.5	-38.1	177.6	-75.1	167.9	0	0	0	112.3	Q423 Q424 A425 A431	Q423-L427 WeakPolarHBondContact O-CG 3.46Å; Q423-L427 PolarHBondContact O-N 3.24Å; Q424-L427 PolarHBondContact O-N 3.44Å; A425-L427 VanDerWaalsContact C-N 3.34Å; A425-L427 PolarHBondContact O-N 2.98Å; L427-A431 WeakPolarHBondContact O-CB 3.47Å; L427-A431 PolarHBondContact O-N 3.46Å
428	A	70.8	Confident	70.5	Confident	63 Å²	63	94.5 Å²	94.5	52%	0.521	53%	0.529	S	S	.	.	H	α-helix	trans	-67.4	-40.3	177.1	0	0	0	0	0	112	Q424 A425 I426 A431 A432	Q424-A428 WeakPolarHBondContact O-CB 3.37Å; Q424-A428 PolarHBondContact O-N 3.06Å; A425-A428 PolarHBondContact O-N 3.22Å; I426-A428 VanDerWaalsContact C-N 3.33Å; I426-A428 PolarHBondContact O-N 3.01Å; A428-A431 PolarHBondContact O-N 3.44Å; A428-A432 PolarHBondContact O-N 2.97Å
429	E	70.9	Confident	69.5	Low	131 Å²	131	99 Å²	99	61%	0.612	54%	0.544	S	S	*	.	H	α-helix	trans	-65.3	-46.3	176.7	-166.2	169.7	-159.1	0	0	111.4	A425 I426 A431 A432 E433	A425-E429 PolarHBondContact O-N 2.98Å; I426-E429 PolarHBondContact O-N 2.99Å; E429-A431 VanDerWaalsContact C-N 3.31Å; E429-A431 PolarHBondContact O-N 3.36Å; E429-A432 WeakPolarHBondContact O-CB 3.19Å; E429-A432 PolarHBondContact O-N 3.16Å; E429-A432 VanDerWaalsContact O-N 3.13Å; E429-E433 PolarHBondContact O-N 3.13Å
430	Q	78.7	Confident	68	Low	111 Å²	111	104.5 Å²	104.5	52%	0.519	57%	0.572	S	S	.	*	H	α-helix	trans	-60.1	-38.6	174	-72.6	177.5	-12.7	0	0	112.7	I426 A434	I426-Q430 HydrophobicContact CG2-CG 4.49Å; I426-Q430 WeakPolarHBondContact O-CG 3.36Å; I426-Q430 PolarHBondContact O-N 3.36Å; Q430-A434 WeakPolarHBondContact O-CB 3.46Å; Q430-A434 PolarHBondContact O-N 3.37Å
431	A	77.5	Confident	67.5	Low	50 Å²	50	105.4 Å²	105.4	41%	0.413	58%	0.58	S	S	.	*	H	α-helix	trans	-66.9	-38.3	175.7	0	0	0	0	0	112.1	L427 A428 E429 A434 L435	L427-A431 WeakPolarHBondContact O-CB 3.47Å; L427-A431 PolarHBondContact O-N 3.46Å; A428-A431 PolarHBondContact O-N 3.44Å; E429-A431 VanDerWaalsContact C-N 3.31Å; E429-A431 PolarHBondContact O-N 3.36Å; A431-A434 PolarHBondContact O-N 3.37Å; A431-L435 WeakPolarHBondContact O-CB 3.46Å; A431-L435 WeakPolarHBondContact O-CD1 3.45Å; A431-L435 WeakPolarHBondContact O-CG 3.4Å; A431-L435 PolarHBondContact O-N 3.07Å
432	A	71.4	Confident	67.6	Low	49 Å²	49	104.8 Å²	104.8	41%	0.405	58%	0.583	S	S	.	*	H	α-helix	trans	-65.9	-42.3	176	0	0	0	0	0	112	A428 E429 L435 N436	A428-A432 PolarHBondContact O-N 2.97Å; E429-A432 WeakPolarHBondContact O-CB 3.19Å; E429-A432 PolarHBondContact O-N 3.16Å; E429-A432 VanDerWaalsContact O-N 3.13Å; A432-L435 PolarHBondContact O-N 3.36Å; A432-N436 PolarHBondContact O-N 3.48Å; A432-N436 VanDerWaalsContact O-N 3.16Å
433	E	76.5	Confident	67.8	Low	115 Å²	115	108.8 Å²	108.8	54%	0.537	60%	0.595	S	S	.	*	H	α-helix	trans	-60.4	-46.2	173.9	-72.2	-177.3	162.2	0	0	111.8	E429 L435 N436 Q437	E429-E433 PolarHBondContact O-N 3.13Å; E433-L435 VanDerWaalsContact C-N 3.32Å; E433-L435 PolarHBondContact O-N 3.42Å; E433-N436 PolarHBondContact O-N 3.16Å; E433-Q437 PolarHBondContact O-N 3.2Å; E433-Q437 VanDerWaalsContact O-N 3.16Å
434	A	77.7	Confident	67.7	Low	62 Å²	62	109.1 Å²	109.1	51%	0.512	60%	0.602	S	S	.	*	H	α-helix	trans	-63.7	-36.4	178.6	0	0	0	0	0	112.7	Q430 A431 N436 Q437	Q430-A434 WeakPolarHBondContact O-CB 3.46Å; Q430-A434 PolarHBondContact O-N 3.37Å; A431-A434 PolarHBondContact O-N 3.37Å; A434-N436 VanDerWaalsContact C-N 3.33Å; A434-Q437 PolarHBondContact O-N 3.03Å
435	L	69.1	Low	67.3	Low	121 Å²	121	108.3 Å²	108.3	63%	0.634	60%	0.604	S	S	*	*	H	α-helix	trans	-67.7	-30.9	175.9	-83.4	160.9	0	0	0	112.9	A431 A432 E433	A431-L435 WeakPolarHBondContact O-CB 3.46Å; A431-L435 WeakPolarHBondContact O-CD1 3.45Å; A431-L435 WeakPolarHBondContact O-CG 3.4Å; A431-L435 PolarHBondContact O-N 3.07Å; A432-L435 PolarHBondContact O-N 3.36Å; E433-L435 VanDerWaalsContact C-N 3.32Å; E433-L435 PolarHBondContact O-N 3.42Å
436	N	66.1	Low	67.5	Low	119 Å²	119	111.5 Å²	111.5	64%	0.636	61%	0.611	S	S	*	*	H	α-helix	trans	-78.2	-30.7	177.3	-77.3	-22	0	0	0	112.8	A432 E433 A434 G438	A432-N436 PolarHBondContact O-N 3.48Å; A432-N436 VanDerWaalsContact O-N 3.16Å; E433-N436 PolarHBondContact O-N 3.16Å; A434-N436 VanDerWaalsContact C-N 3.33Å; N436-G438 VanDerWaalsContact C-N 3.25Å; N436-G438 PolarHBondContact O-N 3.48Å
437	Q	63.7	Low	67.4	Low	157 Å²	157	112.7 Å²	112.7	73%	0.734	62%	0.62	S	S	*	*	H	α-helix	trans	-72.5	-14.5	175.9	-69.3	177.5	10.7	0	0	113.9	E433 A434	E433-Q437 PolarHBondContact O-N 3.2Å; E433-Q437 VanDerWaalsContact O-N 3.16Å; A434-Q437 PolarHBondContact O-N 3.03Å
438	G	56.7	Low	66.7	Low	62 Å²	62	112.9 Å²	112.9	64%	0.639	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	9.2	179.8	0	0	0	0	0	115.7	N436	N436-G438 VanDerWaalsContact C-N 3.25Å; N436-G438 PolarHBondContact O-N 3.48Å
439	K	50.1	Low	66.4	Low	176 Å²	176	117.1 Å²	117.1	77%	0.765	63%	0.632	S	S	*	*			trans	-114.5	6.4	-175.2	-77.7	-173.6	177.5	176.6	0	115.4
440	E	38.7	Very low	66	Low	252 Å²	252	115.8 Å²	115.8	100%	1.178	63%	0.634	S	S	*	*			trans	-90.8	0	161.2	-68.2	-173.8	164.3	0	0	110.3

Retrieved 440 of 440 residues in 122.6 ms (Link to these results)

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