A0A087WTB1_HUMAN Loading...

Zinc finger protein 772

May be involved in transcriptional regulation.

AlphaFold DB , UniProt , Accession A0A087WTB1, Species HUMAN (Homo sapiens, Human), Gene ZNF772, Length 417 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	39.5	Very low	33.3	Very low	239 Å²	239	151 Å²	151	100%	1.177	82%	0.815	S	S	*	*				0	79.3	0	-72.9	170.6	167	0	0	108
2	N	27.9	Very low	33.9	Very low	154 Å²	154	143.1 Å²	143.1	82%	0.824	80%	0.796	S	S	*	*			trans	-121.2	111.7	167.4	-76.2	2.5	0	0	0	105	E4	N2-E4 PolarHBondContact O-N 3.35Å
3	S	30.5	Very low	34.7	Very low	121 Å²	121	142.5 Å²	142.5	85%	0.846	78%	0.783	S	S	*	*			trans	-93.2	93.3	174.5	-58.4	0	0	0	0	107.3	V5	S3-V5 PolarHBondContact O-N 3.5Å
4	E	29.6	Very low	35.5	Very low	174 Å²	174	133.6 Å²	133.6	81%	0.813	74%	0.735	S	S	*	*			trans	-65.1	118	172.3	-71.3	178.1	145.2	0	0	108.7	N2 I6	N2-E4 PolarHBondContact O-N 3.35Å; E4-I6 PolarHBondContact O-N 3.18Å; E4-I6 VanDerWaalsContact O-N 3.11Å
5	V	33.3	Very low	36.7	Very low	126 Å²	126	128.9 Å²	128.9	76%	0.764	71%	0.709	S	S	*	*			trans	-74.1	100.7	170.5	177.6	0	0	0	0	106.6	S3 V7	S3-V5 PolarHBondContact O-N 3.5Å; V5-V7 HydrophobicContact CG1-CG2 4.27Å; V5-V7 PolarHBondContact O-N 2.88Å; V5-V7 VanDerWaalsContact O-N 3.15Å
6	I	29.4	Very low	37.6	Very low	147 Å²	147	121.1 Å²	121.1	75%	0.754	67%	0.665	S	S	*	*			trans	-66.7	111.2	170.7	-58.8	175.8	0	0	0	106.7	E4	E4-I6 PolarHBondContact O-N 3.18Å; E4-I6 VanDerWaalsContact O-N 3.11Å
7	V	31.8	Very low	38.6	Very low	119 Å²	119	120.1 Å²	120.1	72%	0.721	66%	0.655	S	S	*	*			trans	-91.7	113.1	173.7	178.8	0	0	0	0	107.2	V5 P9	V5-V7 HydrophobicContact CG1-CG2 4.27Å; V5-V7 PolarHBondContact O-N 2.88Å; V5-V7 VanDerWaalsContact O-N 3.15Å; V7-P9 WeakPolarHBondContact O-CD 3Å
8	D	26.7	Very low	39.3	Very low	130 Å²	130	117.4 Å²	117.4	70%	0.695	64%	0.64	S	S	*	*			trans	-63.2	123.6	178.7	-82.8	-45.6	0	0	0	111.5	I10	D8-I10 PolarHBondContact O-N 3.16Å; D8-I10 VanDerWaalsContact O-N 3.11Å
9	P	35.3	Very low	39.9	Very low	108 Å²	108	111.4 Å²	111.4	70%	0.701	61%	0.607	S	S	*	*			trans	-87.1	76.5	-178.5	34.9	-34.4	0	0	0	111.3	V7 Q11	V7-P9 WeakPolarHBondContact O-CD 3Å; P9-Q11 PolarHBondContact O-N 3.26Å
10	I	35.6	Very low	40.6	Very low	159 Å²	159	105.9 Å²	105.9	82%	0.815	58%	0.577	S	S	*	*			trans	-74.9	81.5	167.1	-53.9	-179.6	0	0	0	108.8	D8 G12	D8-I10 PolarHBondContact O-N 3.16Å; D8-I10 VanDerWaalsContact O-N 3.11Å; I10-G12 PolarHBondContact O-N 3.04Å
11	Q	47.1	Very low	41.5	Very low	184 Å²	184	103.2 Å²	103.2	86%	0.86	56%	0.564	S	S	*	*			trans	-74	86.3	172.4	-74.9	-174.7	-32	0	0	110.5	P9 Q13	P9-Q11 PolarHBondContact O-N 3.26Å; Q11-Q13 PolarHBondContact O-N 3.37Å
12	G	40.2	Very low	42.3	Very low	56 Å²	56	96.4 Å²	96.4	58%	0.577	53%	0.526	S	S	*	.			trans	-72.8	105.6	174.6	0	0	0	0	0	112.4	I10 V14	I10-G12 PolarHBondContact O-N 3.04Å; G12-V14 PolarHBondContact O-N 3.44Å
13	Q	44.2	Very low	43.5	Very low	136 Å²	136	91.3 Å²	91.3	64%	0.636	50%	0.496	S	S	*	.			trans	-64.8	112.8	167.4	-179.7	177.5	-4.8	0	0	109.4	Q11 N15	Q11-Q13 PolarHBondContact O-N 3.37Å; Q13-N15 PolarHBondContact O-N 2.95Å
14	V	46.1	Very low	44.6	Very low	18 Å²	18	86.9 Å²	86.9	11%	0.109	47%	0.466	C	S	.	.			trans	-61.9	110.5	-178.2	-180	0	0	0	0	109.8	G12 D18 V19 M50 W325	G12-V14 PolarHBondContact O-N 3.44Å; V14-D18 HydrophobicContact CG1-CB 4.07Å; V14-V19 HydrophobicContact CG1-CG2 3.77Å; V14-M50 HydrophobicContact CB-CE 4.05Å; V14-M50 HydrophobicContact CG1-CE 3.77Å; V14-M50 HydrophobicContact CG1-SD 4.45Å; V14-M50 WeakPolarHBondContact O-CE 3.3Å; V14-W325 HydrophobicContact CB-CZ2 4.49Å; V14-W325 HydrophobicContact CG2-CZ2 4.05Å
15	N	52.6	Low	45.3	Very low	63 Å²	63	81 Å²	81	34%	0.337	44%	0.438	S	S	.	.			trans	-92.6	173.3	179.5	71.2	48	0	0	0	111	Q13 E17 D18 V19	Q13-N15 PolarHBondContact O-N 2.95Å; N15-E17 VanDerWaalsContact C-N 3.29Å; N15-E17 PolarHBondContact O-N 3Å; N15-E17 VanDerWaalsContact OD1-CA 3.23Å; N15-E17 WeakPolarHBondContact OD1-CA 3.34Å; N15-E17 WeakPolarHBondContact OD1-CB 3.39Å; N15-E17 PolarHBondContact OD1-N 3.48Å; N15-D18 PolarHBondContact N-OD2 3.47Å; N15-D18 PolarHBondContact ND2-OD2 2.95Å; N15-D18 WeakPolarHBondContact O-CB 3.44Å; N15-D18 PolarHBondContact O-N 2.84Å; N15-D18 PolarHBondContact OD1-N 3.14Å; N15-D18 PolarHBondContact OD1-OD2 3.1Å; N15-V19 WeakPolarHBondContact O-CG2 3.22Å; N15-V19 PolarHBondContact O-N 2.86Å
16	F	51.9	Low	45.8	Very low	3 Å²	3	80.1 Å²	80.1	1%	0.013	43%	0.426	C	S	.	.	S	Bend	trans	-69.3	-26.9	179.6	-173.3	-97.3	0	0	0	113.2	D18 V19 F20 F47 I62 V63 L66	F16-D18 VanDerWaalsContact C-N 3.26Å; F16-D18 PolarHBondContact O-N 3.05Å; F16-V19 HydrophobicContact CD2-CB 4.21Å; F16-V19 HydrophobicContact CD2-CG1 4.09Å; F16-V19 HydrophobicContact CE2-CG1 4.06Å; F16-V19 CarbonylContact O-C 3.57Å; F16-V19 WeakPolarHBondContact O-CA 3.28Å; F16-V19 WeakPolarHBondContact O-CB 3.11Å; F16-V19 PolarHBondContact O-N 3.45Å; F16-F20 HydrophobicContact CD1-CB 4.16Å; F16-F20 HydrophobicContact CE1-CB 3.82Å; F16-F20 AromaticContact CE1-CD2 3.74Å; F16-F20 HydrophobicContact CE1-CD2 3.74Å; F16-F20 HydrophobicContact CE1-CG 4.15Å; F16-F20 HydrophobicContact CZ-CB 4.37Å; F16-F20 HydrophobicContact CZ-CD2 4.12Å; F16-F20 WeakPolarHBondContact O-CB 3.35Å; F16-F20 PolarHBondContact O-N 3.19Å; F16-F47 HydrophobicContact CD2-CB 4.35Å; F16-F47 AromaticContact CD2-CD2 3.82Å; F16-F47 HydrophobicContact CD2-CD2 3.82Å; F16-F47 HydrophobicContact CE2-CB 3.73Å; F16-F47 AromaticContact CE2-CD2 3.96Å; F16-F47 HydrophobicContact CE2-CD2 3.96Å; F16-F47 HydrophobicContact CE2-CG 4.3Å; F16-F47 HydrophobicContact CZ-CB 4.5Å; F16-I62 HydrophobicContact CE1-CB 4.5Å; F16-I62 HydrophobicContact CE1-CG2 4.12Å; F16-V63 HydrophobicContact CB-CG2 4.31Å; F16-V63 HydrophobicContact CD1-CG2 3.29Å; F16-V63 HydrophobicContact CD2-CG2 3.84Å; F16-V63 HydrophobicContact CE1-CG2 3.39Å; F16-V63 HydrophobicContact CE2-CG2 3.95Å; F16-V63 HydrophobicContact CG-CG2 3.51Å; F16-V63 HydrophobicContact CZ-CG2 3.73Å; F16-L66 HydrophobicContact CE1-CD1 4.13Å; F16-L66 HydrophobicContact CZ-CD1 3.82Å
17	E	54	Low	46.6	Very low	104 Å²	104	77 Å²	77	49%	0.486	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-32.8	173.9	-59	-174.9	172.9	0	0	110.5	N15 V19 Y22 K318	N15-E17 VanDerWaalsContact C-N 3.29Å; N15-E17 PolarHBondContact O-N 3Å; N15-E17 VanDerWaalsContact OD1-CA 3.23Å; N15-E17 WeakPolarHBondContact OD1-CA 3.34Å; N15-E17 WeakPolarHBondContact OD1-CB 3.39Å; N15-E17 PolarHBondContact OD1-N 3.48Å; E17-V19 PolarHBondContact O-N 3.12Å; E17-Y22 WeakPolarHBondContact CA-OH 3.49Å; E17-Y22 VanDerWaalsContact CB-OH 3.22Å; E17-Y22 WeakPolarHBondContact CB-OH 3.43Å; E17-Y22 PolarHBondContact O-OH 3.35Å; E17-K318 PolarHBondContact O-NZ 3.39Å
18	D	51.7	Low	48	Very low	73 Å²	73	71.7 Å²	71.7	39%	0.39	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-7.8	169.3	-55.4	-39	0	0	0	114.1	V14 N15 F16 K318	V14-D18 HydrophobicContact CG1-CB 4.07Å; N15-D18 PolarHBondContact N-OD2 3.47Å; N15-D18 PolarHBondContact ND2-OD2 2.95Å; N15-D18 WeakPolarHBondContact O-CB 3.44Å; N15-D18 PolarHBondContact O-N 2.84Å; N15-D18 PolarHBondContact OD1-N 3.14Å; N15-D18 PolarHBondContact OD1-OD2 3.1Å; F16-D18 VanDerWaalsContact C-N 3.26Å; F16-D18 PolarHBondContact O-N 3.05Å; D18-K318 WeakPolarHBondContact O-CD 3.27Å; D18-K318 WeakPolarHBondContact O-CE 3.34Å; D18-K318 WeakPolarHBondContact O-CG 2.98Å; D18-K318 PolarHBondContact O-NZ 3.15Å; D18-K318 VanDerWaalsContact O-NZ 3.11Å
19	V	51.8	Low	49.4	Very low	2 Å²	2	68.8 Å²	68.8	1%	0.012	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	-27	178.6	169.8	0	0	0	0	112.5	V14 N15 F16 E17 N46 M50 K318 I322	V14-V19 HydrophobicContact CG1-CG2 3.77Å; N15-V19 WeakPolarHBondContact O-CG2 3.22Å; N15-V19 PolarHBondContact O-N 2.86Å; F16-V19 HydrophobicContact CD2-CB 4.21Å; F16-V19 HydrophobicContact CD2-CG1 4.09Å; F16-V19 HydrophobicContact CE2-CG1 4.06Å; F16-V19 CarbonylContact O-C 3.57Å; F16-V19 WeakPolarHBondContact O-CA 3.28Å; F16-V19 WeakPolarHBondContact O-CB 3.11Å; F16-V19 PolarHBondContact O-N 3.45Å; E17-V19 PolarHBondContact O-N 3.12Å; V19-N46 HydrophobicContact CG1-CB 3.67Å; V19-M50 HydrophobicContact CG1-CG 4.14Å; V19-M50 HydrophobicContact CG2-CE 4.08Å; V19-M50 HydrophobicContact CG2-CG 3.87Å; V19-M50 HydrophobicContact CG2-SD 3.84Å; V19-K318 VanDerWaalsContact CA-CE 3.41Å; V19-K318 VanDerWaalsContact O-CE 3.23Å; V19-K318 WeakPolarHBondContact O-CE 3.38Å; V19-I322 HydrophobicContact CB-CD1 4.32Å; V19-I322 HydrophobicContact CG1-CD1 3.7Å; V19-I322 HydrophobicContact CG1-CG1 4.2Å; V19-I322 HydrophobicContact CG2-CD1 4.49Å; V19-I322 HydrophobicContact CG2-CG1 4.43Å
20	F	53.1	Low	50.2	Low	1 Å²	1	68 Å²	68	0%	0.004	35%	0.351	C	S	.	.	S	Bend	trans	-77.3	124.9	179.7	-173.6	-99	0	0	0	114.2	F16 Y22 Y39 M43 I62 L66 P72 K318	F16-F20 HydrophobicContact CD1-CB 4.16Å; F16-F20 HydrophobicContact CE1-CB 3.82Å; F16-F20 AromaticContact CE1-CD2 3.74Å; F16-F20 HydrophobicContact CE1-CD2 3.74Å; F16-F20 HydrophobicContact CE1-CG 4.15Å; F16-F20 HydrophobicContact CZ-CB 4.37Å; F16-F20 HydrophobicContact CZ-CD2 4.12Å; F16-F20 WeakPolarHBondContact O-CB 3.35Å; F16-F20 PolarHBondContact O-N 3.19Å; F20-Y22 AromaticContact CD1-CD1 3.49Å; F20-Y22 HydrophobicContact CD1-CD1 3.49Å; F20-Y22 VanDerWaalsContact CD1-CD1 3.49Å; F20-Y22 HydrophobicContact CD1-CD2 4.36Å; F20-Y22 AromaticContact CD1-CE1 3.4Å; F20-Y22 HydrophobicContact CD1-CE1 3.4Å; F20-Y22 VanDerWaalsContact CD1-CE1 3.4Å; F20-Y22 HydrophobicContact CD1-CE2 4.28Å; F20-Y22 AromaticContact CD1-CG 3.98Å; F20-Y22 HydrophobicContact CD1-CG 3.98Å; F20-Y22 AromaticContact CD1-CZ 3.81Å; F20-Y22 AromaticContact CE1-CD1 3.57Å; F20-Y22 HydrophobicContact CE1-CD1 3.57Å; F20-Y22 AromaticContact CE1-CE1 3.82Å; F20-Y22 HydrophobicContact CE1-CE1 3.82Å; F20-Y22 HydrophobicContact CE1-CG 4.22Å; F20-Y22 PolarHBondContact O-N 3.28Å; F20-Y39 WeakPolarHBondContact CE1-OH 3.47Å; F20-Y39 HydrophobicContact CE2-CE1 4.23Å; F20-Y39 AromaticContact CE2-CZ 3.92Å; F20-Y39 WeakPolarHBondContact CE2-OH 3.32Å; F20-Y39 HydrophobicContact CZ-CE1 4.49Å; F20-Y39 WeakPolarHBondContact CZ-OH 3.5Å; F20-M43 HydrophobicContact CD2-CG 4.28Å; F20-M43 HydrophobicContact CD2-SD 4.16Å; F20-M43 HydrophobicContact CE2-CG 4.43Å; F20-I62 HydrophobicContact CD1-CD1 4.25Å; F20-I62 HydrophobicContact CD1-CG2 4Å; F20-I62 HydrophobicContact CD2-CG2 3.32Å; F20-I62 HydrophobicContact CE1-CD1 4.39Å; F20-I62 HydrophobicContact CE1-CG2 3.85Å; F20-I62 HydrophobicContact CE2-CG2 3.13Å; F20-I62 HydrophobicContact CG-CG2 3.73Å; F20-I62 HydrophobicContact CZ-CG2 3.41Å; F20-I62 VanDerWaalsContact CZ-CG2 3.41Å; F20-L66 HydrophobicContact CD2-CD1 4.07Å; F20-L66 HydrophobicContact CE2-CD1 3.92Å; F20-L66 HydrophobicContact CE2-CG 4.41Å; F20-P72 HydrophobicContact CE2-CB 3.98Å; F20-P72 HydrophobicContact CE2-CG 4Å; F20-P72 HydrophobicContact CZ-CB 3.65Å; F20-P72 HydrophobicContact CZ-CG 3.84Å; F20-P72 WeakPolarHBondContact CZ-O 3.31Å; F20-K318 VanDerWaalsContact N-CE 3.27Å; F20-K318 WeakPolarHBondContact O-CE 3.26Å; F20-K318 PolarHBondContact O-NZ 2.9Å
21	V	59.9	Low	51.1	Low	50 Å²	50	61.7 Å²	61.7	30%	0.303	32%	0.319	S	S	.	.			trans	-87.4	103.2	177.5	170.5	0	0	0	0	109.3	Y39 M43	V21-Y39 HydrophobicContact CB-CE2 4Å; V21-Y39 HydrophobicContact CG1-CE2 4.39Å; V21-Y39 VanDerWaalsContact O-CE2 3.27Å; V21-Y39 WeakPolarHBondContact O-CE2 3.23Å; V21-Y39 PolarHBondContact O-OH 3.23Å; V21-M43 HydrophobicContact CB-CE 4.09Å; V21-M43 HydrophobicContact CB-SD 4.42Å; V21-M43 HydrophobicContact CG2-CE 4.01Å
22	Y	56.6	Low	51.3	Low	96 Å²	96	53.9 Å²	53.9	38%	0.376	28%	0.283	S	S	.	.			trans	-65.4	146.3	177.7	-57.7	-80.5	0	0	0	112.3	E17 F20 I62 V74	E17-Y22 WeakPolarHBondContact CA-OH 3.49Å; E17-Y22 VanDerWaalsContact CB-OH 3.22Å; E17-Y22 WeakPolarHBondContact CB-OH 3.43Å; E17-Y22 PolarHBondContact O-OH 3.35Å; F20-Y22 AromaticContact CD1-CD1 3.49Å; F20-Y22 HydrophobicContact CD1-CD1 3.49Å; F20-Y22 VanDerWaalsContact CD1-CD1 3.49Å; F20-Y22 HydrophobicContact CD1-CD2 4.36Å; F20-Y22 AromaticContact CD1-CE1 3.4Å; F20-Y22 HydrophobicContact CD1-CE1 3.4Å; F20-Y22 VanDerWaalsContact CD1-CE1 3.4Å; F20-Y22 HydrophobicContact CD1-CE2 4.28Å; F20-Y22 AromaticContact CD1-CG 3.98Å; F20-Y22 HydrophobicContact CD1-CG 3.98Å; F20-Y22 AromaticContact CD1-CZ 3.81Å; F20-Y22 AromaticContact CE1-CD1 3.57Å; F20-Y22 HydrophobicContact CE1-CD1 3.57Å; F20-Y22 AromaticContact CE1-CE1 3.82Å; F20-Y22 HydrophobicContact CE1-CE1 3.82Å; F20-Y22 HydrophobicContact CE1-CG 4.22Å; F20-Y22 PolarHBondContact O-N 3.28Å; Y22-I62 HydrophobicContact CE1-CD1 3.97Å; Y22-V74 HydrophobicContact CD1-CB 4.02Å; Y22-V74 HydrophobicContact CD1-CG2 3.56Å; Y22-V74 HydrophobicContact CE1-CB 4.38Å; Y22-V74 HydrophobicContact CE1-CG2 3.56Å
23	F	53	Low	51.6	Low	47 Å²	47	52.1 Å²	52.1	21%	0.206	26%	0.26	C	S	.	.			trans	-124.4	142.3	164.7	-71.7	-79.4	0	0	0	108.3	E27 W28 L31 Y39	F23-E27 HydrophobicContact CB-CB 4.21Å; F23-E27 HydrophobicContact CD1-CB 3.98Å; F23-W28 HydrophobicContact CB-CB 3.96Å; F23-W28 HydrophobicContact CB-CE3 4.07Å; F23-W28 AromaticContact CD2-CE3 3.45Å; F23-W28 HydrophobicContact CD2-CE3 3.45Å; F23-W28 VanDerWaalsContact CD2-CE3 3.45Å; F23-W28 AromaticContact CD2-CZ3 3.73Å; F23-W28 HydrophobicContact CD2-CZ3 3.73Å; F23-W28 HydrophobicContact CE2-CE3 4.11Å; F23-W28 HydrophobicContact CE2-CZ3 4.04Å; F23-W28 AromaticContact CG-CE3 3.99Å; F23-W28 HydrophobicContact CG-CE3 3.99Å; F23-L31 HydrophobicContact CD1-CD1 4.3Å; F23-L31 HydrophobicContact CD2-CD1 4.01Å; F23-L31 HydrophobicContact CE1-CD1 3.96Å; F23-L31 HydrophobicContact CE1-CD2 4.19Å; F23-L31 HydrophobicContact CE1-CG 4.45Å; F23-L31 HydrophobicContact CE2-CD1 3.6Å; F23-L31 HydrophobicContact CG-CD1 4.31Å; F23-L31 HydrophobicContact CZ-CD1 3.59Å; F23-L31 HydrophobicContact CZ-CD2 4.25Å; F23-L31 HydrophobicContact CZ-CG 4.46Å; F23-Y39 HydrophobicContact CD2-CD2 4.44Å; F23-Y39 AromaticContact CD2-CE2 3.95Å; F23-Y39 HydrophobicContact CD2-CE2 3.95Å; F23-Y39 AromaticContact CE2-CD2 3.53Å; F23-Y39 HydrophobicContact CE2-CD2 3.53Å; F23-Y39 AromaticContact CE2-CE2 3.4Å; F23-Y39 HydrophobicContact CE2-CE2 3.4Å; F23-Y39 VanDerWaalsContact CE2-CE2 3.4Å; F23-Y39 HydrophobicContact CE2-CG 4.19Å; F23-Y39 HydrophobicContact CZ-CD2 4.33Å; F23-Y39 HydrophobicContact CZ-CE2 4.45Å
24	S	51.9	Low	51.7	Low	29 Å²	29	49.2 Å²	49.2	20%	0.203	26%	0.259	C	S	.	.			trans	-62.6	163.4	165.9	97.2	0	0	0	0	110.3	E26 E27 W28	S24-E26 WeakPolarHBondContact CB-OE2 3.27Å; S24-E26 PolarHBondContact O-N 3.11Å; S24-E26 PolarHBondContact OG-N 3.37Å; S24-E26 PolarHBondContact OG-OE2 3.35Å; S24-E27 PolarHBondContact N-OE2 3.5Å; S24-E27 PolarHBondContact O-N 3.03Å; S24-E27 PolarHBondContact OG-N 3.42Å; S24-E27 VanDerWaalsContact OG-N 3.14Å; S24-W28 WeakPolarHBondContact O-CB 3.44Å; S24-W28 PolarHBondContact O-N 3.08Å
25	Q	44.3	Very low	52	Low	50 Å²	50	52.2 Å²	52.2	23%	0.234	27%	0.271	C	S	.	.	H	α-helix	trans	-60.2	-34.3	177.4	-179.5	156.7	73.1	0	0	111.6	V29	Q25-V29 WeakPolarHBondContact O-CB 3.28Å; Q25-V29 WeakPolarHBondContact O-CG2 3.33Å; Q25-V29 PolarHBondContact O-N 2.83Å
26	E	44.2	Very low	52.6	Low	108 Å²	108	50.7 Å²	50.7	51%	0.505	26%	0.261	S	S	.	.	H	α-helix	trans	-70.1	-44.9	175	-56.2	67.7	-146.9	0	0	111.4	S24 V29 L30	S24-E26 WeakPolarHBondContact CB-OE2 3.27Å; S24-E26 PolarHBondContact O-N 3.11Å; S24-E26 PolarHBondContact OG-N 3.37Å; S24-E26 PolarHBondContact OG-OE2 3.35Å; E26-V29 PolarHBondContact O-N 3.28Å; E26-L30 VanDerWaalsContact O-CG 3.29Å; E26-L30 WeakPolarHBondContact O-CG 3.25Å; E26-L30 PolarHBondContact O-N 3.41Å
27	E	46.8	Very low	53	Low	80 Å²	80	53.3 Å²	53.3	37%	0.374	28%	0.275	S	S	.	.	H	α-helix	trans	-67.6	-39.1	180	-66.3	-176.9	136.9	0	0	112.5	F23 S24 V29 L30 L31	F23-E27 HydrophobicContact CB-CB 4.21Å; F23-E27 HydrophobicContact CD1-CB 3.98Å; S24-E27 PolarHBondContact N-OE2 3.5Å; S24-E27 PolarHBondContact O-N 3.03Å; S24-E27 PolarHBondContact OG-N 3.42Å; S24-E27 VanDerWaalsContact OG-N 3.14Å; E27-V29 VanDerWaalsContact C-N 3.35Å; E27-L30 WeakPolarHBondContact O-CB 3.45Å; E27-L30 PolarHBondContact O-N 2.93Å; E27-L30 VanDerWaalsContact O-N 3.14Å; E27-L31 PolarHBondContact O-N 3.21Å
28	W	61	Low	53.2	Low	9 Å²	9	53.6 Å²	53.6	3%	0.034	28%	0.279	C	S	.	.	H	α-helix	trans	-63.9	-40.6	176.1	-175.3	-102.5	0	0	0	111.8	F23 S24 L30 L31 R36 Y39 E71 P72	F23-W28 HydrophobicContact CB-CB 3.96Å; F23-W28 HydrophobicContact CB-CE3 4.07Å; F23-W28 AromaticContact CD2-CE3 3.45Å; F23-W28 HydrophobicContact CD2-CE3 3.45Å; F23-W28 VanDerWaalsContact CD2-CE3 3.45Å; F23-W28 AromaticContact CD2-CZ3 3.73Å; F23-W28 HydrophobicContact CD2-CZ3 3.73Å; F23-W28 HydrophobicContact CE2-CE3 4.11Å; F23-W28 HydrophobicContact CE2-CZ3 4.04Å; F23-W28 AromaticContact CG-CE3 3.99Å; F23-W28 HydrophobicContact CG-CE3 3.99Å; S24-W28 WeakPolarHBondContact O-CB 3.44Å; S24-W28 PolarHBondContact O-N 3.08Å; W28-L30 PolarHBondContact O-N 3.36Å; W28-L31 HydrophobicContact CD2-CD1 4.43Å; W28-L31 HydrophobicContact CE3-CD1 3.69Å; W28-L31 HydrophobicContact CZ3-CD1 3.89Å; W28-L31 PolarHBondContact O-N 2.8Å; W28-L31 VanDerWaalsContact O-N 3.16Å; W28-R36 HydrophobicContact CH2-CB 4.21Å; W28-R36 HydrophobicContact CH2-CG 4.02Å; W28-R36 HydrophobicContact CZ2-CB 4.21Å; W28-R36 HydrophobicContact CZ2-CG 3.85Å; W28-R36 HydrophobicContact CZ3-CG 4.49Å; W28-R36 PolarHBondContact O-NE 3.24Å; W28-R36 VanDerWaalsContact O-NE 3.13Å; W28-R36 PolarHBondContact O-NH2 3.02Å; W28-Y39 AromaticContact CH2-CD1 3.54Å; W28-Y39 HydrophobicContact CH2-CD1 3.54Å; W28-Y39 AromaticContact CH2-CE1 3.65Å; W28-Y39 HydrophobicContact CH2-CE1 3.65Å; W28-Y39 HydrophobicContact CH2-CG 4.43Å; W28-Y39 AromaticContact CZ3-CD1 3.51Å; W28-Y39 HydrophobicContact CZ3-CD1 3.51Å; W28-Y39 AromaticContact CZ3-CE1 3.45Å; W28-Y39 HydrophobicContact CZ3-CE1 3.45Å; W28-Y39 VanDerWaalsContact CZ3-CE1 3.45Å; W28-Y39 HydrophobicContact CZ3-CG 4.11Å; W28-Y39 AromaticContact CZ3-CZ 3.98Å; W28-E71 HydrophobicContact CZ2-CB 4.41Å; W28-E71 HydrophobicContact CZ2-CG 4.38Å; W28-E71 PolarHBondContact NE1-OE2 2.82Å; W28-P72 HydrophobicContact CH2-CG 4.18Å; W28-P72 HydrophobicContact CZ2-CG 4.47Å
29	V	56.2	Low	54.1	Low	69 Å²	69	51 Å²	51	42%	0.418	26%	0.264	S	S	.	.	H	α-helix	trans	-61.8	-28.9	174.4	166.7	0	0	0	0	112.1	Q25 E26 E27 R36	Q25-V29 WeakPolarHBondContact O-CB 3.28Å; Q25-V29 WeakPolarHBondContact O-CG2 3.33Å; Q25-V29 PolarHBondContact O-N 2.83Å; E26-V29 PolarHBondContact O-N 3.28Å; E27-V29 VanDerWaalsContact C-N 3.35Å; V29-R36 PolarHBondContact O-NH2 2.81Å
30	L	52.6	Low	54.7	Low	92 Å²	92	54 Å²	54	48%	0.482	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-9.9	177.2	-66.9	168.8	0	0	0	114.7	E26 E27 W28 N264	E26-L30 VanDerWaalsContact O-CG 3.29Å; E26-L30 WeakPolarHBondContact O-CG 3.25Å; E26-L30 PolarHBondContact O-N 3.41Å; E27-L30 WeakPolarHBondContact O-CB 3.45Å; E27-L30 PolarHBondContact O-N 2.93Å; E27-L30 VanDerWaalsContact O-N 3.14Å; W28-L30 PolarHBondContact O-N 3.36Å; L30-N264 PolarHBondContact O-ND2 3.04Å; L30-N264 PolarHBondContact O-OD1 3.08Å
31	L	53.2	Low	55.1	Low	26 Å²	26	58.3 Å²	58.3	14%	0.136	30%	0.298	C	S	.	.	S	Bend	trans	-79.7	136.1	172.4	-57.2	176.7	0	0	0	110.8	F23 E27 W28 Q35 R36 H261	F23-L31 HydrophobicContact CD1-CD1 4.3Å; F23-L31 HydrophobicContact CD2-CD1 4.01Å; F23-L31 HydrophobicContact CE1-CD1 3.96Å; F23-L31 HydrophobicContact CE1-CD2 4.19Å; F23-L31 HydrophobicContact CE1-CG 4.45Å; F23-L31 HydrophobicContact CE2-CD1 3.6Å; F23-L31 HydrophobicContact CG-CD1 4.31Å; F23-L31 HydrophobicContact CZ-CD1 3.59Å; F23-L31 HydrophobicContact CZ-CD2 4.25Å; F23-L31 HydrophobicContact CZ-CG 4.46Å; E27-L31 PolarHBondContact O-N 3.21Å; W28-L31 HydrophobicContact CD2-CD1 4.43Å; W28-L31 HydrophobicContact CE3-CD1 3.69Å; W28-L31 HydrophobicContact CZ3-CD1 3.89Å; W28-L31 PolarHBondContact O-N 2.8Å; W28-L31 VanDerWaalsContact O-N 3.16Å; L31-Q35 HydrophobicContact CB-CB 4.16Å; L31-Q35 HydrophobicContact CD2-CB 4.27Å; L31-R36 HydrophobicContact CB-CG 3.65Å; L31-R36 HydrophobicContact CD1-CG 4.17Å; L31-R36 VanDerWaalsContact O-CZ 3.28Å; L31-R36 PolarHBondContact O-NE 3Å; L31-R36 PolarHBondContact O-NH2 2.85Å; L31-R36 VanDerWaalsContact O-NH2 3.08Å; L31-H261 PolarHBondContact O-CE1 2.92Å; L31-H261 PolarHBondContact O-ND1 3.37Å
32	D	51.2	Low	55.5	Low	20 Å²	20	57.5 Å²	57.5	11%	0.107	29%	0.293	C	S	.	.			trans	-76.8	170.1	164.6	54.2	62.5	0	0	0	110.7	A34 Q35 R36 N260 N264	D32-A34 VanDerWaalsContact C-N 3.34Å; D32-A34 PolarHBondContact O-N 3.43Å; D32-A34 PolarHBondContact OD1-N 2.92Å; D32-Q35 VanDerWaalsContact CG-CD 3.49Å; D32-Q35 VanDerWaalsContact N-OE1 3.13Å; D32-Q35 WeakPolarHBondContact O-CB 3.49Å; D32-Q35 PolarHBondContact O-N 2.88Å; D32-Q35 WeakPolarHBondContact OD1-CB 3.47Å; D32-Q35 VanDerWaalsContact OD1-CG 3.24Å; D32-Q35 WeakPolarHBondContact OD1-CG 3.47Å; D32-Q35 PolarHBondContact OD1-N 3.1Å; D32-Q35 PolarHBondContact OD2-NE2 3.16Å; D32-Q35 VanDerWaalsContact OD2-NE2 3.09Å; D32-Q35 PolarHBondContact OD2-OE1 3.41Å; D32-R36 WeakPolarHBondContact O-CG 3.47Å; D32-R36 PolarHBondContact O-N 3.12Å; D32-N260 VanDerWaalsContact CB-OD1 3.27Å; D32-N260 WeakPolarHBondContact CB-OD1 3.12Å; D32-N264 VanDerWaalsContact CB-ND2 3.29Å; D32-N264 WeakPolarHBondContact CB-ND2 3.24Å; D32-N264 PolarHBondContact N-ND2 3.24Å; D32-N264 PolarHBondContact OD2-ND2 3.13Å
33	E	47.9	Very low	56.3	Low	19 Å²	19	53.2 Å²	53.2	9%	0.089	28%	0.277	C	S	.	.	H	α-helix	trans	-74	-25.2	-176.2	-144	-141.3	-157	0	0	113.1	Q35 R36 L37 K229 H240 I243	E33-Q35 PolarHBondContact O-N 3.39Å; E33-R36 PolarHBondContact O-N 3.22Å; E33-L37 HydrophobicContact CG-CG 4.19Å; E33-L37 WeakPolarHBondContact O-CB 3.44Å; E33-L37 WeakPolarHBondContact O-CG 3.29Å; E33-L37 PolarHBondContact O-N 3.15Å; E33-L37 VanDerWaalsContact OE2-CD1 3.23Å; E33-L37 WeakPolarHBondContact OE2-CD1 3.43Å; E33-K229 IonicContact OE1-NZ 3.94Å; E33-K229 PolarHBondContact OE1-NZ 3.24Å; E33-H240 IonicContact OE1-CE1 3.32Å; E33-H240 PolarHBondContact OE1-CE1 3.11Å; E33-H240 IonicContact OE1-ND1 3.5Å; E33-I243 HydrophobicContact CB-CD1 3.49Å; E33-I243 VanDerWaalsContact CB-CD1 3.49Å; E33-I243 HydrophobicContact CB-CG1 3.58Å; E33-I243 HydrophobicContact CG-CD1 3.47Å; E33-I243 VanDerWaalsContact CG-CD1 3.47Å; E33-I243 HydrophobicContact CG-CG1 3.93Å; E33-I243 WeakPolarHBondContact OE2-CG1 3.18Å; E33-I243 WeakPolarHBondContact OE2-CG2 3.43Å
34	A	45.5	Very low	56.8	Low	74 Å²	74	53.3 Å²	53.3	61%	0.612	28%	0.279	S	S	*	.	H	α-helix	trans	-63.4	-36.4	170.7	0	0	0	0	0	110.7	D32 L38	D32-A34 VanDerWaalsContact C-N 3.34Å; D32-A34 PolarHBondContact O-N 3.43Å; D32-A34 PolarHBondContact OD1-N 2.92Å; A34-L38 WeakPolarHBondContact O-CB 3.49Å; A34-L38 PolarHBondContact O-N 2.93Å
35	Q	53	Low	57.4	Low	81 Å²	81	53.9 Å²	53.9	38%	0.379	28%	0.279	S	S	.	.	H	α-helix	trans	-72.2	-39.1	172.1	-68.9	163	1.3	0	0	113.1	L31 D32 E33 Y39	L31-Q35 HydrophobicContact CB-CB 4.16Å; L31-Q35 HydrophobicContact CD2-CB 4.27Å; D32-Q35 VanDerWaalsContact CG-CD 3.49Å; D32-Q35 VanDerWaalsContact N-OE1 3.13Å; D32-Q35 WeakPolarHBondContact O-CB 3.49Å; D32-Q35 PolarHBondContact O-N 2.88Å; D32-Q35 WeakPolarHBondContact OD1-CB 3.47Å; D32-Q35 VanDerWaalsContact OD1-CG 3.24Å; D32-Q35 WeakPolarHBondContact OD1-CG 3.47Å; D32-Q35 PolarHBondContact OD1-N 3.1Å; D32-Q35 PolarHBondContact OD2-NE2 3.16Å; D32-Q35 VanDerWaalsContact OD2-NE2 3.09Å; D32-Q35 PolarHBondContact OD2-OE1 3.41Å; E33-Q35 PolarHBondContact O-N 3.39Å; Q35-Y39 WeakPolarHBondContact O-CB 3.21Å; Q35-Y39 PolarHBondContact O-N 3.38Å
36	R	65.7	Low	58.3	Low	32 Å²	32	51.6 Å²	51.6	12%	0.121	27%	0.268	C	S	.	.	H	α-helix	trans	-72.2	-34.8	176.8	-66.4	178.5	-171.4	156.3	7.4	112.8	W28 V29 L31 D32 E33 R40	W28-R36 HydrophobicContact CH2-CB 4.21Å; W28-R36 HydrophobicContact CH2-CG 4.02Å; W28-R36 HydrophobicContact CZ2-CB 4.21Å; W28-R36 HydrophobicContact CZ2-CG 3.85Å; W28-R36 HydrophobicContact CZ3-CG 4.49Å; W28-R36 PolarHBondContact O-NE 3.24Å; W28-R36 VanDerWaalsContact O-NE 3.13Å; W28-R36 PolarHBondContact O-NH2 3.02Å; V29-R36 PolarHBondContact O-NH2 2.81Å; L31-R36 HydrophobicContact CB-CG 3.65Å; L31-R36 HydrophobicContact CD1-CG 4.17Å; L31-R36 VanDerWaalsContact O-CZ 3.28Å; L31-R36 PolarHBondContact O-NE 3Å; L31-R36 PolarHBondContact O-NH2 2.85Å; L31-R36 VanDerWaalsContact O-NH2 3.08Å; D32-R36 WeakPolarHBondContact O-CG 3.47Å; D32-R36 PolarHBondContact O-N 3.12Å; E33-R36 PolarHBondContact O-N 3.22Å; R36-R40 VanDerWaalsContact O-CB 3.25Å; R36-R40 WeakPolarHBondContact O-CB 3.45Å; R36-R40 PolarHBondContact O-N 3.34Å
37	L	59.4	Low	59.3	Low	58 Å²	58	48.4 Å²	48.4	30%	0.304	25%	0.253	S	S	.	.	H	α-helix	trans	-67.8	-52.2	171	-73	174.2	0	0	0	109.7	E33 Y39 R40 D41	E33-L37 HydrophobicContact CG-CG 4.19Å; E33-L37 WeakPolarHBondContact O-CB 3.44Å; E33-L37 WeakPolarHBondContact O-CG 3.29Å; E33-L37 PolarHBondContact O-N 3.15Å; E33-L37 VanDerWaalsContact OE2-CD1 3.23Å; E33-L37 WeakPolarHBondContact OE2-CD1 3.43Å; L37-Y39 PolarHBondContact O-N 3.11Å; L37-R40 CarbonylContact O-C 3.57Å; L37-R40 WeakPolarHBondContact O-CA 3.27Å; L37-R40 WeakPolarHBondContact O-CB 3.48Å; L37-R40 PolarHBondContact O-N 3.33Å; L37-D41 WeakPolarHBondContact O-CB 3.46Å; L37-D41 PolarHBondContact O-N 3.39Å
38	L	59.3	Low	60	Low	110 Å²	110	47.3 Å²	47.3	58%	0.576	26%	0.257	S	S	*	.	H	α-helix	trans	-54.9	-40.2	174	176.6	63.4	0	0	0	111.8	A34 V42	A34-L38 WeakPolarHBondContact O-CB 3.49Å; A34-L38 PolarHBondContact O-N 2.93Å; L38-V42 HydrophobicContact CD1-CG2 4.13Å; L38-V42 VanDerWaalsContact O-CB 3.3Å; L38-V42 WeakPolarHBondContact O-CB 3.43Å; L38-V42 WeakPolarHBondContact O-CG2 3.29Å; L38-V42 PolarHBondContact O-N 3.36Å
39	Y	70.5	Confident	60.1	Low	18 Å²	18	47.6 Å²	47.6	7%	0.071	26%	0.259	C	S	.	.	H	α-helix	trans	-64.9	-46.9	173.7	169.5	-91.8	0	0	0	112.3	F20 V21 F23 W28 Q35 L37 V42 M43 L66 P72	F20-Y39 WeakPolarHBondContact CE1-OH 3.47Å; F20-Y39 HydrophobicContact CE2-CE1 4.23Å; F20-Y39 AromaticContact CE2-CZ 3.92Å; F20-Y39 WeakPolarHBondContact CE2-OH 3.32Å; F20-Y39 HydrophobicContact CZ-CE1 4.49Å; F20-Y39 WeakPolarHBondContact CZ-OH 3.5Å; V21-Y39 HydrophobicContact CB-CE2 4Å; V21-Y39 HydrophobicContact CG1-CE2 4.39Å; V21-Y39 VanDerWaalsContact O-CE2 3.27Å; V21-Y39 WeakPolarHBondContact O-CE2 3.23Å; V21-Y39 PolarHBondContact O-OH 3.23Å; F23-Y39 HydrophobicContact CD2-CD2 4.44Å; F23-Y39 AromaticContact CD2-CE2 3.95Å; F23-Y39 HydrophobicContact CD2-CE2 3.95Å; F23-Y39 AromaticContact CE2-CD2 3.53Å; F23-Y39 HydrophobicContact CE2-CD2 3.53Å; F23-Y39 AromaticContact CE2-CE2 3.4Å; F23-Y39 HydrophobicContact CE2-CE2 3.4Å; F23-Y39 VanDerWaalsContact CE2-CE2 3.4Å; F23-Y39 HydrophobicContact CE2-CG 4.19Å; F23-Y39 HydrophobicContact CZ-CD2 4.33Å; F23-Y39 HydrophobicContact CZ-CE2 4.45Å; W28-Y39 AromaticContact CH2-CD1 3.54Å; W28-Y39 HydrophobicContact CH2-CD1 3.54Å; W28-Y39 AromaticContact CH2-CE1 3.65Å; W28-Y39 HydrophobicContact CH2-CE1 3.65Å; W28-Y39 HydrophobicContact CH2-CG 4.43Å; W28-Y39 AromaticContact CZ3-CD1 3.51Å; W28-Y39 HydrophobicContact CZ3-CD1 3.51Å; W28-Y39 AromaticContact CZ3-CE1 3.45Å; W28-Y39 HydrophobicContact CZ3-CE1 3.45Å; W28-Y39 VanDerWaalsContact CZ3-CE1 3.45Å; W28-Y39 HydrophobicContact CZ3-CG 4.11Å; W28-Y39 AromaticContact CZ3-CZ 3.98Å; Q35-Y39 WeakPolarHBondContact O-CB 3.21Å; Q35-Y39 PolarHBondContact O-N 3.38Å; L37-Y39 PolarHBondContact O-N 3.11Å; Y39-V42 PolarHBondContact O-N 2.9Å; Y39-M43 HydrophobicContact CD1-CG 4.09Å; Y39-M43 HydrophobicContact CD2-CE 4.14Å; Y39-M43 HydrophobicContact CD2-CG 4.05Å; Y39-M43 HydrophobicContact CE1-CG 3.69Å; Y39-M43 HydrophobicContact CE2-CE 3.96Å; Y39-M43 HydrophobicContact CE2-CG 3.68Å; Y39-M43 HydrophobicContact CE2-SD 4.03Å; Y39-M43 HydrophobicContact CG-CG 4.28Å; Y39-M43 WeakPolarHBondContact O-CB 3.37Å; Y39-M43 VanDerWaalsContact O-CG 3.29Å; Y39-M43 WeakPolarHBondContact O-CG 3.39Å; Y39-M43 PolarHBondContact O-N 3.31Å; Y39-L66 HydrophobicContact CE1-CD2 4.32Å; Y39-P72 HydrophobicContact CE1-CG 4.1Å
40	R	63.9	Low	60.3	Low	64 Å²	64	44.6 Å²	44.6	24%	0.242	24%	0.241	C	C	.	.	H	α-helix	trans	-60.5	-46.6	178	-175.4	-172.9	-173.8	-150.5	0.8	110.6	R36 L37 M43 L44 L66 V67 G69	R36-R40 VanDerWaalsContact O-CB 3.25Å; R36-R40 WeakPolarHBondContact O-CB 3.45Å; R36-R40 PolarHBondContact O-N 3.34Å; L37-R40 CarbonylContact O-C 3.57Å; L37-R40 WeakPolarHBondContact O-CA 3.27Å; L37-R40 WeakPolarHBondContact O-CB 3.48Å; L37-R40 PolarHBondContact O-N 3.33Å; R40-M43 PolarHBondContact O-N 3.15Å; R40-L44 HydrophobicContact CG-CD1 3.87Å; R40-L44 HydrophobicContact CG-CG 4.37Å; R40-L44 VanDerWaalsContact O-CB 3.32Å; R40-L44 WeakPolarHBondContact O-CB 3.46Å; R40-L44 VanDerWaalsContact O-CG 3.26Å; R40-L44 WeakPolarHBondContact O-CG 3.36Å; R40-L44 PolarHBondContact O-N 3.05Å; R40-L66 HydrophobicContact CB-CD2 4.42Å; R40-L66 HydrophobicContact CG-CD2 4.04Å; R40-L66 VanDerWaalsContact CZ-O 3.24Å; R40-L66 PolarHBondContact NE-O 2.79Å; R40-L66 PolarHBondContact NH2-O 2.83Å; R40-V67 PolarHBondContact NH2-O 3.24Å; R40-G69 VanDerWaalsContact NH2-CA 3.31Å
41	D	61.4	Low	60.7	Low	93 Å²	93	42.8 Å²	42.8	50%	0.497	24%	0.24	S	C	.	.	H	α-helix	trans	-60.5	-46.6	177.1	-63.5	-14.8	0	0	0	110.5	L37 L44 E45	L37-D41 WeakPolarHBondContact O-CB 3.46Å; L37-D41 PolarHBondContact O-N 3.39Å; D41-L44 PolarHBondContact O-N 3.34Å; D41-E45 WeakPolarHBondContact O-CB 3.42Å; D41-E45 PolarHBondContact O-N 2.91Å
42	V	67.4	Low	60.7	Low	33 Å²	33	45.3 Å²	45.3	20%	0.2	26%	0.259	C	S	.	.	H	α-helix	trans	-66.8	-38.2	175.9	172.5	0	0	0	0	111.7	L38 Y39 N46	L38-V42 HydrophobicContact CD1-CG2 4.13Å; L38-V42 VanDerWaalsContact O-CB 3.3Å; L38-V42 WeakPolarHBondContact O-CB 3.43Å; L38-V42 WeakPolarHBondContact O-CG2 3.29Å; L38-V42 PolarHBondContact O-N 3.36Å; Y39-V42 PolarHBondContact O-N 2.9Å; V42-N46 VanDerWaalsContact O-CB 3.26Å; V42-N46 WeakPolarHBondContact O-CB 3.47Å; V42-N46 PolarHBondContact O-N 3.12Å; V42-N46 PolarHBondContact O-ND2 3.02Å; V42-N46 VanDerWaalsContact O-ND2 3.08Å; V42-N46 PolarHBondContact O-OD1 3.5Å
43	M	73.6	Confident	60.7	Low	5 Å²	5	46.5 Å²	46.5	3%	0.025	27%	0.265	C	S	.	.	H	α-helix	trans	-70.8	-34.4	176.7	-69.8	-54.7	109.2	0	0	112.4	F20 V21 Y39 R40 N46 F47 L66	F20-M43 HydrophobicContact CD2-CG 4.28Å; F20-M43 HydrophobicContact CD2-SD 4.16Å; F20-M43 HydrophobicContact CE2-CG 4.43Å; V21-M43 HydrophobicContact CB-CE 4.09Å; V21-M43 HydrophobicContact CB-SD 4.42Å; V21-M43 HydrophobicContact CG2-CE 4.01Å; Y39-M43 HydrophobicContact CD1-CG 4.09Å; Y39-M43 HydrophobicContact CD2-CE 4.14Å; Y39-M43 HydrophobicContact CD2-CG 4.05Å; Y39-M43 HydrophobicContact CE1-CG 3.69Å; Y39-M43 HydrophobicContact CE2-CE 3.96Å; Y39-M43 HydrophobicContact CE2-CG 3.68Å; Y39-M43 HydrophobicContact CE2-SD 4.03Å; Y39-M43 HydrophobicContact CG-CG 4.28Å; Y39-M43 WeakPolarHBondContact O-CB 3.37Å; Y39-M43 VanDerWaalsContact O-CG 3.29Å; Y39-M43 WeakPolarHBondContact O-CG 3.39Å; Y39-M43 PolarHBondContact O-N 3.31Å; R40-M43 PolarHBondContact O-N 3.15Å; M43-N46 WeakPolarHBondContact CE-ND2 3.35Å; M43-F47 WeakPolarHBondContact O-CB 3.47Å; M43-F47 PolarHBondContact O-N 3.43Å; M43-L66 HydrophobicContact CB-CD1 3.7Å; M43-L66 HydrophobicContact CB-CD2 4.15Å; M43-L66 HydrophobicContact CG-CD1 4.44Å
44	L	64.1	Low	60.8	Low	49 Å²	49	48.3 Å²	48.3	26%	0.257	29%	0.289	S	S	.	.	H	α-helix	trans	-74.1	-36.5	173.7	-71.3	173.7	0	0	0	111.8	R40 D41 F47 A48 L66 V67	R40-L44 HydrophobicContact CG-CD1 3.87Å; R40-L44 HydrophobicContact CG-CG 4.37Å; R40-L44 VanDerWaalsContact O-CB 3.32Å; R40-L44 WeakPolarHBondContact O-CB 3.46Å; R40-L44 VanDerWaalsContact O-CG 3.26Å; R40-L44 WeakPolarHBondContact O-CG 3.36Å; R40-L44 PolarHBondContact O-N 3.05Å; D41-L44 PolarHBondContact O-N 3.34Å; L44-F47 PolarHBondContact O-N 3.02Å; L44-A48 WeakPolarHBondContact O-CB 3.36Å; L44-A48 PolarHBondContact O-N 3.4Å; L44-L66 HydrophobicContact CD2-CB 4.04Å; L44-V67 HydrophobicContact CD2-CG2 3.88Å
45	E	63.9	Low	61.1	Low	41 Å²	41	46.9 Å²	46.9	19%	0.192	27%	0.27	C	S	.	.	H	α-helix	trans	-61	-47.1	169	179.9	-174.5	-165.4	0	0	110.3	D41 F47 A48 L49 Y334	D41-E45 WeakPolarHBondContact O-CB 3.42Å; D41-E45 PolarHBondContact O-N 2.91Å; E45-F47 VanDerWaalsContact C-N 3.33Å; E45-F47 PolarHBondContact O-N 3.32Å; E45-A48 PolarHBondContact O-N 3.09Å; E45-L49 HydrophobicContact CG-CD1 4.28Å; E45-L49 VanDerWaalsContact O-CG 3.3Å; E45-L49 WeakPolarHBondContact O-CG 3.43Å; E45-L49 PolarHBondContact O-N 3.3Å; E45-Y334 WeakPolarHBondContact OE1-CE2 3.2Å; E45-Y334 VanDerWaalsContact OE1-CZ 3.29Å; E45-Y334 PolarHBondContact OE1-OH 3.33Å; E45-Y334 PolarHBondContact OE2-OH 3.12Å
46	N	63.1	Low	60.7	Low	3 Å²	3	49 Å²	49	2%	0.016	29%	0.289	C	S	.	.	H	α-helix	trans	-60.4	-42.1	174.6	-65.4	-20.6	0	0	0	111.5	V19 V42 M43 L49 M50 I322	V19-N46 HydrophobicContact CG1-CB 3.67Å; V42-N46 VanDerWaalsContact O-CB 3.26Å; V42-N46 WeakPolarHBondContact O-CB 3.47Å; V42-N46 PolarHBondContact O-N 3.12Å; V42-N46 PolarHBondContact O-ND2 3.02Å; V42-N46 VanDerWaalsContact O-ND2 3.08Å; V42-N46 PolarHBondContact O-OD1 3.5Å; M43-N46 WeakPolarHBondContact CE-ND2 3.35Å; N46-L49 PolarHBondContact O-N 3.48Å; N46-M50 WeakPolarHBondContact O-CG 3.46Å; N46-M50 PolarHBondContact O-N 2.79Å; N46-I322 HydrophobicContact CB-CD1 4.19Å; N46-I322 HydrophobicContact CB-CG2 3.86Å; N46-I322 WeakPolarHBondContact OD1-CG2 3.24Å
47	F	64.9	Low	59.9	Low	40 Å²	40	49 Å²	49	18%	0.175	29%	0.293	C	S	.	.	H	α-helix	trans	-62.9	-46.8	175.1	179.2	-108.8	0	0	0	112	F16 M43 L44 E45 L49 M50 A51 M59 V63	F16-F47 HydrophobicContact CD2-CB 4.35Å; F16-F47 AromaticContact CD2-CD2 3.82Å; F16-F47 HydrophobicContact CD2-CD2 3.82Å; F16-F47 HydrophobicContact CE2-CB 3.73Å; F16-F47 AromaticContact CE2-CD2 3.96Å; F16-F47 HydrophobicContact CE2-CD2 3.96Å; F16-F47 HydrophobicContact CE2-CG 4.3Å; F16-F47 HydrophobicContact CZ-CB 4.5Å; M43-F47 WeakPolarHBondContact O-CB 3.47Å; M43-F47 PolarHBondContact O-N 3.43Å; L44-F47 PolarHBondContact O-N 3.02Å; E45-F47 VanDerWaalsContact C-N 3.33Å; E45-F47 PolarHBondContact O-N 3.32Å; F47-L49 VanDerWaalsContact C-N 3.29Å; F47-L49 PolarHBondContact O-N 2.99Å; F47-M50 CarbonylContact O-C 3.58Å; F47-M50 PolarHBondContact O-N 3.1Å; F47-M50 VanDerWaalsContact O-N 3.14Å; F47-A51 WeakPolarHBondContact O-CB 3.06Å; F47-A51 PolarHBondContact O-N 3.22Å; F47-M59 HydrophobicContact CE1-CE 4.31Å; F47-M59 HydrophobicContact CZ-CE 4.18Å; F47-V63 HydrophobicContact CD1-CG1 4Å; F47-V63 HydrophobicContact CD2-CB 4.42Å; F47-V63 HydrophobicContact CD2-CG1 3.76Å; F47-V63 HydrophobicContact CD2-CG2 3.67Å; F47-V63 HydrophobicContact CE1-CG1 3.87Å; F47-V63 HydrophobicContact CE2-CB 4.36Å; F47-V63 HydrophobicContact CE2-CG1 3.64Å; F47-V63 HydrophobicContact CE2-CG2 3.83Å; F47-V63 HydrophobicContact CG-CG1 3.95Å; F47-V63 HydrophobicContact CG-CG2 4.42Å; F47-V63 HydrophobicContact CZ-CG1 3.7Å
48	A	62.2	Low	59.1	Low	57 Å²	57	55 Å²	55	47%	0.471	32%	0.318	S	S	.	.	H	α-helix	trans	-61.7	-37.7	178	0	0	0	0	0	112.1	L44 E45 A51 S52	L44-A48 WeakPolarHBondContact O-CB 3.36Å; L44-A48 PolarHBondContact O-N 3.4Å; E45-A48 PolarHBondContact O-N 3.09Å; A48-A51 PolarHBondContact O-N 2.89Å; A48-S52 WeakPolarHBondContact O-CB 3.46Å; A48-S52 PolarHBondContact O-N 3.13Å; A48-S52 PolarHBondContact O-OG 3.07Å
49	L	63.2	Low	58.5	Low	15 Å²	15	55.3 Å²	55.3	8%	0.079	32%	0.317	C	S	.	.	H	α-helix	trans	-62.8	-47	171.6	-70.7	167.3	0	0	0	111.4	E45 N46 F47 A51 S52 L53 I322 A331	E45-L49 HydrophobicContact CG-CD1 4.28Å; E45-L49 VanDerWaalsContact O-CG 3.3Å; E45-L49 WeakPolarHBondContact O-CG 3.43Å; E45-L49 PolarHBondContact O-N 3.3Å; N46-L49 PolarHBondContact O-N 3.48Å; F47-L49 VanDerWaalsContact C-N 3.29Å; F47-L49 PolarHBondContact O-N 2.99Å; L49-A51 PolarHBondContact O-N 3.08Å; L49-S52 PolarHBondContact O-N 3.45Å; L49-S52 PolarHBondContact O-OG 3.23Å; L49-L53 WeakPolarHBondContact O-CD1 3.25Å; L49-L53 WeakPolarHBondContact O-CG 3.23Å; L49-L53 PolarHBondContact O-N 3.47Å; L49-I322 HydrophobicContact CD1-CG2 4.02Å; L49-A331 HydrophobicContact CD2-CB 3.75Å
50	M	60.3	Low	57.7	Low	6 Å²	6	55.3 Å²	55.3	3%	0.03	32%	0.32	C	S	.	.	H	α-helix	trans	-64.4	-35.2	176.3	-68.1	-61.4	-65.5	0	0	113.5	V14 V19 N46 F47 L53 H55	V14-M50 HydrophobicContact CB-CE 4.05Å; V14-M50 HydrophobicContact CG1-CE 3.77Å; V14-M50 HydrophobicContact CG1-SD 4.45Å; V14-M50 WeakPolarHBondContact O-CE 3.3Å; V19-M50 HydrophobicContact CG1-CG 4.14Å; V19-M50 HydrophobicContact CG2-CE 4.08Å; V19-M50 HydrophobicContact CG2-CG 3.87Å; V19-M50 HydrophobicContact CG2-SD 3.84Å; N46-M50 WeakPolarHBondContact O-CG 3.46Å; N46-M50 PolarHBondContact O-N 2.79Å; F47-M50 CarbonylContact O-C 3.58Å; F47-M50 PolarHBondContact O-N 3.1Å; F47-M50 VanDerWaalsContact O-N 3.14Å; M50-L53 WeakPolarHBondContact O-CB 3.01Å; M50-L53 PolarHBondContact O-N 3.41Å; M50-L53 HydrophobicContact SD-CD1 4.19Å; M50-H55 HydrophobicContact CE-CB 4.04Å
51	A	60.1	Low	57	Low	55 Å²	55	59.2 Å²	59.2	46%	0.455	34%	0.341	S	S	.	.	H	α-helix	trans	-68	-40	174.1	0	0	0	0	0	111.6	F47 A48 L49 L53 G54	F47-A51 WeakPolarHBondContact O-CB 3.06Å; F47-A51 PolarHBondContact O-N 3.22Å; A48-A51 PolarHBondContact O-N 2.89Å; L49-A51 PolarHBondContact O-N 3.08Å; A51-L53 PolarHBondContact O-N 2.85Å; A51-L53 VanDerWaalsContact O-N 3.12Å; A51-G54 PolarHBondContact O-N 3.17Å
52	S	54.6	Low	56.5	Low	78 Å²	78	55.7 Å²	55.7	55%	0.545	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-9.7	174.5	74.8	0	0	0	0	114.2	A48 L49	A48-S52 WeakPolarHBondContact O-CB 3.46Å; A48-S52 PolarHBondContact O-N 3.13Å; A48-S52 PolarHBondContact O-OG 3.07Å; L49-S52 PolarHBondContact O-N 3.45Å; L49-S52 PolarHBondContact O-OG 3.23Å
53	L	51.2	Low	55.9	Low	45 Å²	45	54.1 Å²	54.1	24%	0.236	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	0.4	-179.2	-85.3	162.9	0	0	0	114.5	L49 M50 A51 H55 W325 T329	L49-L53 WeakPolarHBondContact O-CD1 3.25Å; L49-L53 WeakPolarHBondContact O-CG 3.23Å; L49-L53 PolarHBondContact O-N 3.47Å; M50-L53 WeakPolarHBondContact O-CB 3.01Å; M50-L53 PolarHBondContact O-N 3.41Å; M50-L53 HydrophobicContact SD-CD1 4.19Å; A51-L53 PolarHBondContact O-N 2.85Å; A51-L53 VanDerWaalsContact O-N 3.12Å; L53-H55 PolarHBondContact O-N 2.88Å; L53-W325 HydrophobicContact CD1-CB 4.4Å; L53-W325 HydrophobicContact CD1-CD2 3.92Å; L53-W325 HydrophobicContact CD1-CE3 3.26Å; L53-W325 HydrophobicContact CD1-CG 4.46Å; L53-W325 HydrophobicContact CD1-CZ3 3.65Å; L53-W325 HydrophobicContact CD2-CE3 3.54Å; L53-W325 HydrophobicContact CD2-CZ3 3.53Å; L53-W325 HydrophobicContact CG-CE3 4.02Å; L53-W325 HydrophobicContact CG-CZ3 4.15Å; L53-T329 HydrophobicContact CD1-CG2 4.2Å; L53-T329 HydrophobicContact CD2-CG2 3.18Å; L53-T329 HydrophobicContact CG-CG2 3.57Å
54	G	49.4	Very low	55	Low	58 Å²	58	55.7 Å²	55.7	60%	0.598	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.6	1.8	-176.1	0	0	0	0	0	114.4	A51 T56	A51-G54 PolarHBondContact O-N 3.17Å; G54-T56 VanDerWaalsContact C-N 3.33Å; G54-T56 PolarHBondContact O-N 2.75Å
55	H	52.2	Low	54.6	Low	43 Å²	43	54 Å²	54	20%	0.199	32%	0.318	C	S	.	.			trans	-74.9	87	168.5	-69.2	-55.8	0	0	0	109.7	M50 L53 S57 W325	M50-H55 HydrophobicContact CE-CB 4.04Å; L53-H55 PolarHBondContact O-N 2.88Å; H55-S57 PolarHBondContact O-N 3Å; H55-W325 AromaticContact NE2-CH2 3.46Å; H55-W325 WeakPolarHBondContact NE2-CH2 3.36Å; H55-W325 AromaticContact NE2-CZ3 3.97Å
56	T	45.5	Very low	54.3	Low	126 Å²	126	52.1 Å²	52.1	77%	0.773	31%	0.309	S	S	*	.			trans	-71.4	64.7	168.1	47.3	0	0	0	0	110.9	G54 F58	G54-T56 VanDerWaalsContact C-N 3.33Å; G54-T56 PolarHBondContact O-N 2.75Å; T56-F58 PolarHBondContact O-N 2.52Å; T56-F58 VanDerWaalsContact O-N 3.15Å
57	S	46.8	Very low	53.6	Low	32 Å²	32	55.7 Å²	55.7	22%	0.224	33%	0.331	C	S	.	.			trans	-55.9	124.3	157.2	63.9	0	0	0	0	106.8	H55 M59	H55-S57 PolarHBondContact O-N 3Å; S57-M59 PolarHBondContact O-N 2.61Å
58	F	44.1	Very low	52.7	Low	185 Å²	185	61.2 Å²	61.2	81%	0.811	36%	0.359	S	S	*	.			trans	-40.6	139.8	165.8	-114.7	-100.2	0	0	0	108.8	T56 S60	T56-F58 PolarHBondContact O-N 2.52Å; T56-F58 VanDerWaalsContact O-N 3.15Å; F58-S60 PolarHBondContact O-N 3.37Å
59	M	46.1	Very low	52	Low	115 Å²	115	59 Å²	59	57%	0.567	34%	0.342	S	S	*	.			trans	-53.2	91.3	173.2	-96.4	-85.4	-173.9	0	0	108.4	F47 S57 V63	F47-M59 HydrophobicContact CE1-CE 4.31Å; F47-M59 HydrophobicContact CZ-CE 4.18Å; S57-M59 PolarHBondContact O-N 2.61Å; M59-V63 HydrophobicContact CE-CG1 4.24Å; M59-V63 HydrophobicContact SD-CB 4.08Å; M59-V63 HydrophobicContact SD-CG1 3.51Å; M59-V63 VanDerWaalsContact SD-CG1 3.51Å
60	S	53.5	Low	51.4	Low	19 Å²	19	59.1 Å²	59.1	13%	0.133	34%	0.344	C	S	.	.			trans	-65.3	150.1	-175.5	72.7	0	0	0	0	107.1	F58 I62 V63 A64	F58-S60 PolarHBondContact O-N 3.37Å; S60-I62 CarbonylContact O-C 3.55Å; S60-I62 PolarHBondContact O-N 3.35Å; S60-V63 PolarHBondContact O-N 3.26Å; S60-V63 PolarHBondContact OG-N 3.48Å; S60-A64 PolarHBondContact O-N 3.39Å
61	H	49.8	Very low	50.8	Low	145 Å²	145	59.9 Å²	59.9	67%	0.671	35%	0.347	S	S	*	.	H	α-helix	trans	-51.9	-25.9	178.6	-179.4	-99.4	0	0	0	111.9	S65	H61-S65 VanDerWaalsContact O-CB 3.23Å; H61-S65 WeakPolarHBondContact O-CB 3.29Å; H61-S65 PolarHBondContact O-N 3.08Å; H61-S65 PolarHBondContact O-OG 3.38Å
62	I	49.5	Very low	50.3	Low	20 Å²	20	57.7 Å²	57.7	10%	0.103	33%	0.329	C	S	.	.	H	α-helix	trans	-72.5	-46.3	174	-52.8	-178.6	0	0	0	112.9	F16 F20 Y22 S60 S65 L66 P72 V74	F16-I62 HydrophobicContact CE1-CB 4.5Å; F16-I62 HydrophobicContact CE1-CG2 4.12Å; F20-I62 HydrophobicContact CD1-CD1 4.25Å; F20-I62 HydrophobicContact CD1-CG2 4Å; F20-I62 HydrophobicContact CD2-CG2 3.32Å; F20-I62 HydrophobicContact CE1-CD1 4.39Å; F20-I62 HydrophobicContact CE1-CG2 3.85Å; F20-I62 HydrophobicContact CE2-CG2 3.13Å; F20-I62 HydrophobicContact CG-CG2 3.73Å; F20-I62 HydrophobicContact CZ-CG2 3.41Å; F20-I62 VanDerWaalsContact CZ-CG2 3.41Å; Y22-I62 HydrophobicContact CE1-CD1 3.97Å; S60-I62 CarbonylContact O-C 3.55Å; S60-I62 PolarHBondContact O-N 3.35Å; I62-S65 PolarHBondContact O-N 3Å; I62-L66 HydrophobicContact CG2-CD1 4.49Å; I62-L66 WeakPolarHBondContact O-CG 3.36Å; I62-L66 PolarHBondContact O-N 2.84Å; I62-P72 HydrophobicContact CG2-CB 4.09Å; I62-V74 HydrophobicContact CD1-CG2 4.17Å
63	V	55.8	Low	49.9	Very low	0 Å²	0	55.6 Å²	55.6	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-63	-47.7	172.3	-179.8	0	0	0	0	110.3	F16 F47 M59 S60 S65 L66 V67	F16-V63 HydrophobicContact CB-CG2 4.31Å; F16-V63 HydrophobicContact CD1-CG2 3.29Å; F16-V63 HydrophobicContact CD2-CG2 3.84Å; F16-V63 HydrophobicContact CE1-CG2 3.39Å; F16-V63 HydrophobicContact CE2-CG2 3.95Å; F16-V63 HydrophobicContact CG-CG2 3.51Å; F16-V63 HydrophobicContact CZ-CG2 3.73Å; F47-V63 HydrophobicContact CD1-CG1 4Å; F47-V63 HydrophobicContact CD2-CB 4.42Å; F47-V63 HydrophobicContact CD2-CG1 3.76Å; F47-V63 HydrophobicContact CD2-CG2 3.67Å; F47-V63 HydrophobicContact CE1-CG1 3.87Å; F47-V63 HydrophobicContact CE2-CB 4.36Å; F47-V63 HydrophobicContact CE2-CG1 3.64Å; F47-V63 HydrophobicContact CE2-CG2 3.83Å; F47-V63 HydrophobicContact CG-CG1 3.95Å; F47-V63 HydrophobicContact CG-CG2 4.42Å; F47-V63 HydrophobicContact CZ-CG1 3.7Å; M59-V63 HydrophobicContact CE-CG1 4.24Å; M59-V63 HydrophobicContact SD-CB 4.08Å; M59-V63 HydrophobicContact SD-CG1 3.51Å; M59-V63 VanDerWaalsContact SD-CG1 3.51Å; S60-V63 PolarHBondContact O-N 3.26Å; S60-V63 PolarHBondContact OG-N 3.48Å; V63-S65 PolarHBondContact O-N 3.22Å; V63-L66 WeakPolarHBondContact O-CB 3.27Å; V63-L66 PolarHBondContact O-N 2.82Å; V63-L66 VanDerWaalsContact O-N 3.11Å; V63-V67 HydrophobicContact CG1-CG2 4.18Å; V63-V67 WeakPolarHBondContact O-CG2 3.45Å; V63-V67 PolarHBondContact O-N 3.27Å
64	A	54.8	Low	49.4	Very low	37 Å²	37	56 Å²	56	31%	0.306	31%	0.313	S	S	.	.	H	α-helix	trans	-55.4	-42.4	176.3	0	0	0	0	0	110.7	S60 V67 M68	S60-A64 PolarHBondContact O-N 3.39Å; A64-V67 PolarHBondContact O-N 2.4Å; A64-M68 WeakPolarHBondContact O-CB 3.46Å; A64-M68 WeakPolarHBondContact O-CG 3.17Å; A64-M68 PolarHBondContact O-N 3.22Å
65	S	55.4	Low	48.6	Very low	13 Å²	13	55.5 Å²	55.5	9%	0.091	30%	0.299	C	S	.	.	H	α-helix	trans	-64.3	-46.3	174.8	-67.4	0	0	0	0	113.3	H61 I62 V63 V67 M68 G69 S70	H61-S65 VanDerWaalsContact O-CB 3.23Å; H61-S65 WeakPolarHBondContact O-CB 3.29Å; H61-S65 PolarHBondContact O-N 3.08Å; H61-S65 PolarHBondContact O-OG 3.38Å; I62-S65 PolarHBondContact O-N 3Å; V63-S65 PolarHBondContact O-N 3.22Å; S65-V67 VanDerWaalsContact C-N 3.33Å; S65-V67 PolarHBondContact O-N 2.55Å; S65-M68 CarbonylContact O-C 3.49Å; S65-M68 PolarHBondContact O-N 3.07Å; S65-G69 PolarHBondContact O-N 3.32Å; S65-S70 WeakPolarHBondContact CA-OG 3.33Å; S65-S70 WeakPolarHBondContact CB-OG 3.33Å; S65-S70 PolarHBondContact O-N 2.99Å; S65-S70 PolarHBondContact O-OG 3.37Å; S65-S70 PolarHBondContact OG-OG 3.12Å
66	L	57	Low	47.6	Very low	3 Å²	3	56.2 Å²	56.2	2%	0.016	31%	0.305	C	S	.	.	H	α-helix	trans	-58.8	-42.3	176.1	-77.5	166.4	0	0	0	112.1	F16 F20 Y39 R40 M43 L44 I62 V63 G69 P72	F16-L66 HydrophobicContact CE1-CD1 4.13Å; F16-L66 HydrophobicContact CZ-CD1 3.82Å; F20-L66 HydrophobicContact CD2-CD1 4.07Å; F20-L66 HydrophobicContact CE2-CD1 3.92Å; F20-L66 HydrophobicContact CE2-CG 4.41Å; Y39-L66 HydrophobicContact CE1-CD2 4.32Å; R40-L66 HydrophobicContact CB-CD2 4.42Å; R40-L66 HydrophobicContact CG-CD2 4.04Å; R40-L66 VanDerWaalsContact CZ-O 3.24Å; R40-L66 PolarHBondContact NE-O 2.79Å; R40-L66 PolarHBondContact NH2-O 2.83Å; M43-L66 HydrophobicContact CB-CD1 3.7Å; M43-L66 HydrophobicContact CB-CD2 4.15Å; M43-L66 HydrophobicContact CG-CD1 4.44Å; L44-L66 HydrophobicContact CD2-CB 4.04Å; I62-L66 HydrophobicContact CG2-CD1 4.49Å; I62-L66 WeakPolarHBondContact O-CG 3.36Å; I62-L66 PolarHBondContact O-N 2.84Å; V63-L66 WeakPolarHBondContact O-CB 3.27Å; V63-L66 PolarHBondContact O-N 2.82Å; V63-L66 VanDerWaalsContact O-N 3.11Å; L66-G69 PolarHBondContact O-N 3.27Å; L66-P72 HydrophobicContact CD2-CG 3.84Å; L66-P72 HydrophobicContact CG-CG 4.24Å
67	V	48.6	Very low	46.8	Very low	77 Å²	77	61.9 Å²	61.9	47%	0.467	31%	0.312	S	S	.	.	H	α-helix	trans	-68.5	-48.6	177.6	173.7	0	0	0	0	110.5	R40 L44 V63 A64 S65 G69	R40-V67 PolarHBondContact NH2-O 3.24Å; L44-V67 HydrophobicContact CD2-CG2 3.88Å; V63-V67 HydrophobicContact CG1-CG2 4.18Å; V63-V67 WeakPolarHBondContact O-CG2 3.45Å; V63-V67 PolarHBondContact O-N 3.27Å; A64-V67 PolarHBondContact O-N 2.4Å; S65-V67 VanDerWaalsContact C-N 3.33Å; S65-V67 PolarHBondContact O-N 2.55Å; V67-G69 PolarHBondContact O-N 2.91Å; V67-G69 VanDerWaalsContact O-N 3.15Å
68	M	47.1	Very low	45.8	Very low	156 Å²	156	64.7 Å²	64.7	77%	0.768	33%	0.327	S	S	*	.	H	α-helix	trans	-67.4	-9.9	176.7	-67	-74.7	-77.3	0	0	114	A64 S65 S70	A64-M68 WeakPolarHBondContact O-CB 3.46Å; A64-M68 WeakPolarHBondContact O-CG 3.17Å; A64-M68 PolarHBondContact O-N 3.22Å; S65-M68 CarbonylContact O-C 3.49Å; S65-M68 PolarHBondContact O-N 3.07Å; M68-S70 VanDerWaalsContact C-N 3.29Å; M68-S70 PolarHBondContact O-N 3.45Å
69	G	46.3	Very low	45.1	Very low	10 Å²	10	61.2 Å²	61.2	10%	0.103	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.1	12.2	179	0	0	0	0	0	114.5	R40 S65 L66 V67 K229	R40-G69 VanDerWaalsContact NH2-CA 3.31Å; S65-G69 PolarHBondContact O-N 3.32Å; L66-G69 PolarHBondContact O-N 3.27Å; V67-G69 PolarHBondContact O-N 2.91Å; V67-G69 VanDerWaalsContact O-N 3.15Å; G69-K229 WeakPolarHBondContact O-CG 3.46Å
70	S	51.1	Low	44.2	Very low	18 Å²	18	64.1 Å²	64.1	13%	0.126	33%	0.332	C	S	.	.			trans	-76.5	147.7	168.8	49	0	0	0	0	110.9	S65 M68	S65-S70 WeakPolarHBondContact CA-OG 3.33Å; S65-S70 WeakPolarHBondContact CB-OG 3.33Å; S65-S70 PolarHBondContact O-N 2.99Å; S65-S70 PolarHBondContact O-OG 3.37Å; S65-S70 PolarHBondContact OG-OG 3.12Å; M68-S70 VanDerWaalsContact C-N 3.29Å; M68-S70 PolarHBondContact O-N 3.45Å
71	E	48.3	Very low	42.9	Very low	22 Å²	22	68.3 Å²	68.3	10%	0.103	36%	0.357	C	S	.	.			trans	-68.3	128.1	179.8	-69.9	176.6	-113.7	0	0	111.5	W28 W73 R220 F231 I236	W28-E71 HydrophobicContact CZ2-CB 4.41Å; W28-E71 HydrophobicContact CZ2-CG 4.38Å; W28-E71 PolarHBondContact NE1-OE2 2.82Å; E71-W73 HydrophobicContact CB-CE3 3.63Å; E71-W73 HydrophobicContact CB-CZ3 3.45Å; E71-W73 VanDerWaalsContact CB-CZ3 3.45Å; E71-W73 HydrophobicContact CG-CZ3 4.28Å; E71-R220 PolarHBondContact O-NH1 3.36Å; E71-R220 VanDerWaalsContact O-NH1 3.16Å; E71-R220 IonicContact OE1-NH2 3.48Å; E71-F231 WeakPolarHBondContact OE1-CD1 3.34Å; E71-F231 VanDerWaalsContact OE1-CE1 3.25Å; E71-F231 WeakPolarHBondContact OE1-CE1 3.34Å; E71-I236 WeakPolarHBondContact OE1-CG2 3.32Å
72	P	48.4	Very low	41.9	Very low	10 Å²	10	69.1 Å²	69.1	7%	0.065	37%	0.365	C	S	.	.			trans	-103.6	84.6	-175.9	39.6	-30.5	0	0	0	110.6	F20 W28 Y39 I62 L66	F20-P72 HydrophobicContact CE2-CB 3.98Å; F20-P72 HydrophobicContact CE2-CG 4Å; F20-P72 HydrophobicContact CZ-CB 3.65Å; F20-P72 HydrophobicContact CZ-CG 3.84Å; F20-P72 WeakPolarHBondContact CZ-O 3.31Å; W28-P72 HydrophobicContact CH2-CG 4.18Å; W28-P72 HydrophobicContact CZ2-CG 4.47Å; Y39-P72 HydrophobicContact CE1-CG 4.1Å; I62-P72 HydrophobicContact CG2-CB 4.09Å; L66-P72 HydrophobicContact CD2-CG 3.84Å; L66-P72 HydrophobicContact CG-CG 4.24Å
73	W	47.1	Very low	40.9	Very low	33 Å²	33	72.6 Å²	72.6	13%	0.125	40%	0.397	C	S	.	.			trans	-106.2	149.5	167.5	67.8	74.6	0	0	0	109.4	E71 V215	E71-W73 HydrophobicContact CB-CE3 3.63Å; E71-W73 HydrophobicContact CB-CZ3 3.45Å; E71-W73 VanDerWaalsContact CB-CZ3 3.45Å; E71-W73 HydrophobicContact CG-CZ3 4.28Å; W73-V215 HydrophobicContact CZ2-CG2 4.26Å
74	V	39.6	Very low	39.6	Very low	55 Å²	55	79.8 Å²	79.8	33%	0.333	44%	0.44	S	S	.	.			trans	-107.5	141.5	173	173.6	0	0	0	0	108.7	Y22 I62 D76	Y22-V74 HydrophobicContact CD1-CB 4.02Å; Y22-V74 HydrophobicContact CD1-CG2 3.56Å; Y22-V74 HydrophobicContact CE1-CB 4.38Å; Y22-V74 HydrophobicContact CE1-CG2 3.56Å; I62-V74 HydrophobicContact CD1-CG2 4.17Å; V74-D76 PolarHBondContact O-N 2.98Å
75	P	32.7	Very low	38.3	Very low	46 Å²	46	82 Å²	82	30%	0.299	46%	0.458	S	S	.	.			trans	-58.5	136.1	174.1	-21.2	32.1	0	0	0	111.2	W77 V215	P75-W77 PolarHBondContact O-N 3.2Å; P75-V215 HydrophobicContact CG-CG1 3.83Å
76	D	32.7	Very low	36.9	Very low	59 Å²	59	87.8 Å²	87.8	32%	0.316	49%	0.493	S	S	.	.			trans	-51.7	129.3	-179.7	-39.3	-63.2	0	0	0	111.9	V74 V78 K201	V74-D76 PolarHBondContact O-N 2.98Å; D76-V78 PolarHBondContact O-N 3.47Å; D76-K201 IonicContact OD2-NZ 3.48Å; D76-K201 PolarHBondContact OD2-NZ 2.81Å
77	W	27.5	Very low	35.3	Very low	244 Å²	244	96.1 Å²	96.1	92%	0.924	53%	0.532	S	S	*	.			trans	-68.4	87.8	-177.2	-164.1	-49.8	0	0	0	110.3	P75	P75-W77 PolarHBondContact O-N 3.2Å
78	V	26.1	Very low	34.3	Very low	91 Å²	91	99.2 Å²	99.2	55%	0.552	55%	0.551	S	S	*	*			trans	-88.3	115.3	162.5	-81	0	0	0	0	108.8	D76 M80	D76-V78 PolarHBondContact O-N 3.47Å; V78-M80 PolarHBondContact O-N 3.45Å
79	D	28.8	Very low	33.3	Very low	113 Å²	113	97.8 Å²	97.8	60%	0.604	55%	0.554	S	S	*	*			trans	-15.2	105.2	174	-163.9	-9.1	0	0	0	116	T81	D79-T81 VanDerWaalsContact C-N 3.26Å; D79-T81 PolarHBondContact O-N 2.81Å; D79-T81 WeakPolarHBondContact OD1-CB 3.19Å; D79-T81 WeakPolarHBondContact OD1-CG2 3.37Å; D79-T81 PolarHBondContact OD1-N 2.9Å; D79-T81 PolarHBondContact OD1-OG1 2.81Å
80	M	27.4	Very low	32.3	Very low	175 Å²	175	101 Å²	101	86%	0.862	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	34.1	-179.6	-149	-157.8	-106.5	0	0	112.5	V78	V78-M80 PolarHBondContact O-N 3.45Å
81	T	27.2	Very low	30.9	Very low	107 Å²	107	103.2 Å²	103.2	66%	0.656	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.7	-6.3	178.4	62.8	0	0	0	0	115.3	D79	D79-T81 VanDerWaalsContact C-N 3.26Å; D79-T81 PolarHBondContact O-N 2.81Å; D79-T81 WeakPolarHBondContact OD1-CB 3.19Å; D79-T81 WeakPolarHBondContact OD1-CG2 3.37Å; D79-T81 PolarHBondContact OD1-N 2.9Å; D79-T81 PolarHBondContact OD1-OG1 2.81Å
82	L	29.5	Very low	29.8	Very low	163 Å²	163	108.1 Å²	108.1	85%	0.853	65%	0.65	S	S	*	*	S	Bend	trans	-113.6	67	179.7	-103.9	84.2	0	0	0	113.8
83	A	27.9	Very low	28.7	Very low	92 Å²	92	113.2 Å²	113.2	76%	0.76	68%	0.684	S	S	*	*			trans	-153.4	22.2	171.3	0	0	0	0	0	116.9
84	V	27.6	Very low	27.5	Very low	151 Å²	151	122.1 Å²	122.1	92%	0.915	72%	0.718	S	S	*	*			trans	-137.4	82.4	167.2	-169.6	0	0	0	0	111.8
85	A	28.1	Very low	26.9	Very low	83 Å²	83	128 Å²	128	69%	0.686	74%	0.742	S	S	*	*			trans	-155.3	136.4	155.7	0	0	0	0	0	108.1
86	T	25.5	Very low	26.4	Very low	135 Å²	135	129.2 Å²	129.2	83%	0.828	76%	0.762	S	S	*	*			trans	64.2	117	-170.2	75.4	0	0	0	0	112.1
87	E	24.8	Very low	26	Very low	179 Å²	179	135 Å²	135	84%	0.836	79%	0.79	S	S	*	*			cis	-154	145.4	36.4	-70.3	175.2	166.9	0	0	111.8
88	T	26.2	Very low	25.9	Very low	141 Å²	141	131.8 Å²	131.8	87%	0.865	79%	0.785	S	S	*	*			trans	-85.2	135.6	161.1	41.3	0	0	0	0	110.7
89	P	26.2	Very low	25.7	Very low	126 Å²	126	134.9 Å²	134.9	82%	0.818	80%	0.798	S	S	*	*				-126.7	151.8	129.9	14.7	5.2	0	0	0	110.2
90	G	24.6	Very low	25.5	Very low	77 Å²	77	138.7 Å²	138.7	79%	0.794	81%	0.812	S	S	*	*			cis	129	42.9	17.5	0	0	0	0	0	113
91	G	23.6	Very low	25.4	Very low	66 Å²	66	139.5 Å²	139.5	68%	0.68	81%	0.814	S	S	*	*			trans	72	125.4	152.6	0	0	0	0	0	120.8
92	S	24.9	Very low	25.3	Very low	124 Å²	124	141.8 Å²	141.8	87%	0.867	82%	0.821	S	S	*	*			trans	69.6	152.8	157.7	76.2	0	0	0	0	117.6
93	C	24.5	Very low	25	Very low	118 Å²	118	139.8 Å²	139.8	80%	0.797	82%	0.817	S	S	*	*			cis	-147.3	-172.8	11.1	-150.4	0	0	0	0	113.4
94	W	21.9	Very low	24.8	Very low	219 Å²	219	145 Å²	145	83%	0.83	82%	0.823	S	S	*	*			trans	-87.2	172	-154.6	-83.8	76	0	0	0	119.8
95	H	27.2	Very low	24.6	Very low	180 Å²	180	145.7 Å²	145.7	83%	0.833	82%	0.817	S	S	*	*			trans	97.6	130.9	161.9	-52	87.9	0	0	0	115.7
96	G	21.8	Very low	24.4	Very low	70 Å²	70	149.6 Å²	149.6	72%	0.722	82%	0.82	S	S	*	*			cis	136.6	107.8	-6.8	0	0	0	0	0	112.9
97	M	24.9	Very low	24.3	Very low	182 Å²	182	147.8 Å²	147.8	90%	0.897	81%	0.813	S	S	*	*			trans	-172.1	107.9	161.3	-110.2	165.9	178.5	0	0	112.4
98	E	24.6	Very low	24.2	Very low	175 Å²	175	147.5 Å²	147.5	82%	0.818	81%	0.81	S	S	*	*			trans	30.4	111.2	140.2	-64.6	165.9	174.9	0	0	121.7
99	D	23.4	Very low	24	Very low	157 Å²	157	146.2 Å²	146.2	84%	0.84	81%	0.807	S	S	*	*				29.2	107.4	126.9	-50.4	-22.5	0	0	0	121.3
100	E	24.5	Very low	24	Very low	193 Å²	193	147.1 Å²	147.1	90%	0.902	80%	0.803	S	S	*	*			trans	-138.9	128.5	135.7	-89.2	-155.9	146.2	0	0	110.3
101	E	24	Very low	23.8	Very low	192 Å²	192	147 Å²	147	90%	0.897	80%	0.801	S	S	*	*			trans	-80	130.6	176	-63.4	-175.5	146.7	0	0	111.2
102	I	25	Very low	23.8	Very low	155 Å²	155	151.7 Å²	151.7	80%	0.795	81%	0.809	S	S	*	*			trans	-110.3	113.5	171.9	-59	177.2	0	0	0	109.3	F104	I102-F104 PolarHBondContact O-N 3.14Å
103	P	24	Very low	23.8	Very low	121 Å²	121	150.1 Å²	150.1	79%	0.786	80%	0.803	S	S	*	*			trans	-73.5	124.9	172.3	-14.4	29.5	0	0	0	111.1
104	F	23.3	Very low	23.9	Very low	201 Å²	201	152 Å²	152	88%	0.882	81%	0.806	S	S	*	*			trans	-102.4	85.8	174.8	-163.3	-90.9	0	0	0	111.2	I102	I102-F104 PolarHBondContact O-N 3.14Å
105	E	22.8	Very low	24	Very low	166 Å²	166	149.8 Å²	149.8	78%	0.776	81%	0.809	S	S	*	*			trans	-137.6	91.9	172.4	-100	-78.3	171.9	0	0	108.4
106	Q	25.8	Very low	23.9	Very low	164 Å²	164	149.9 Å²	149.9	77%	0.766	81%	0.81	S	S	*	*			trans	-135.2	98.1	161.9	-77.4	-161.8	-6.2	0	0	110.5
107	S	23.4	Very low	24.2	Very low	97 Å²	97	154.7 Å²	154.7	68%	0.678	81%	0.813	S	S	*	*			trans	-67.9	124.2	169.2	34.4	0	0	0	0	111
108	F	21.7	Very low	24.1	Very low	174 Å²	174	154.6 Å²	154.6	76%	0.763	81%	0.81	S	S	*	*			trans	-97.2	96.1	169.1	-88.2	-83.6	0	0	0	110.8
109	S	22.7	Very low	24.3	Very low	114 Å²	114	155.4 Å²	155.4	80%	0.797	81%	0.814	S	S	*	*			trans	-80.2	116.3	167	-59.8	0	0	0	0	109.8
110	I	24.8	Very low	24.5	Very low	145 Å²	145	156.5 Å²	156.5	74%	0.744	81%	0.812	S	S	*	*			trans	-115.7	107.9	170.9	-59.5	-177.4	0	0	0	108.7
111	G	21.3	Very low	24.7	Very low	73 Å²	73	156.7 Å²	156.7	75%	0.753	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-82.5	138.7	175	0	0	0	0	0	112.1
112	I	24.3	Very low	24.8	Very low	165 Å²	165	155.4 Å²	155.4	85%	0.846	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-90.8	116.3	172.8	-61.2	-63.7	0	0	0	109.5
113	A	24.6	Very low	24.7	Very low	91 Å²	91	153.7 Å²	153.7	75%	0.752	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-90.3	148.3	171.1	0	0	0	0	0	111.5
114	N	26.4	Very low	24.6	Very low	159 Å²	159	151.4 Å²	151.4	85%	0.85	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-60.4	145	-172.6	-65.7	-66.8	0	0	0	114.6
115	L	24.1	Very low	24.6	Very low	172 Å²	172	151.3 Å²	151.3	90%	0.901	81%	0.808	S	S	*	*			trans	-132.4	104.7	151.7	-168.5	68.3	0	0	0	110.3
116	H	25.3	Very low	24.6	Very low	181 Å²	181	153 Å²	153	84%	0.838	81%	0.813	S	S	*	*			trans	-124.1	158.6	167.8	-114.9	97.5	0	0	0	108.8
117	Q	26.8	Very low	25	Very low	172 Å²	172	150.4 Å²	150.4	80%	0.804	81%	0.811	S	S	*	*			trans	79.8	92.8	165.6	-165.1	176.1	0.5	0	0	118
118	H	24	Very low	24.8	Very low	180 Å²	180	154.7 Å²	154.7	83%	0.833	82%	0.817	S	S	*	*				-158.1	106.8	117.2	-131.3	-96.1	0	0	0	113.9
119	Q	28.4	Very low	24.8	Very low	191 Å²	191	156 Å²	156	89%	0.893	82%	0.817	S	S	*	*			trans	-162	118.5	155.4	-124.3	-173.2	17.2	0	0	111.4
120	K	28.5	Very low	24.8	Very low	181 Å²	181	155.6 Å²	155.6	79%	0.787	82%	0.815	S	S	*	*			trans	172.5	128.9	145.4	-103.1	172.5	-176.4	179.3	0	111.3
121	Q	27	Very low	24.7	Very low	197 Å²	197	155.8 Å²	155.8	92%	0.921	82%	0.817	S	S	*	*				-162.1	156.1	123.8	-105.4	169.7	10	0	0	110.6
122	H	26.5	Very low	25	Very low	164 Å²	164	161.3 Å²	161.3	76%	0.759	82%	0.82	S	S	*	*			trans	-86.6	-178.5	-173.7	-65.9	-111.5	0	0	0	110.6
123	S	23.2	Very low	25	Very low	120 Å²	120	159.1 Å²	159.1	84%	0.839	82%	0.819	S	S	*	*			cis	-171.2	159.6	7.7	13.7	0	0	0	0	108.3
124	G	21.4	Very low	24.9	Very low	72 Å²	72	166.3 Å²	166.3	74%	0.742	83%	0.827	S	S	*	*			trans	171.8	89.7	165.9	0	0	0	0	0	118.5
125	E	23.8	Very low	24.9	Very low	200 Å²	200	164 Å²	164	94%	0.935	82%	0.821	S	S	*	*			trans	64.7	170.4	147.9	-53	-163.2	153.5	0	0	122.3
126	K	22.4	Very low	24.8	Very low	201 Å²	201	165.4 Å²	165.4	87%	0.874	82%	0.82	S	S	*	*			trans	-143.1	-178.2	-165.2	-78.9	-178.8	179.2	175	0	108.1
127	P	33.7	Very low	24.8	Very low	110 Å²	110	164.4 Å²	164.4	71%	0.714	82%	0.82	S	S	*	*			cis	-131.3	163.7	-44.5	35.7	-21.2	0	0	0	112.7
128	F	19.6	Very low	24.7	Very low	187 Å²	187	163.9 Å²	163.9	82%	0.82	82%	0.822	S	S	*	*			trans	-159.2	-179.9	141.7	-135.6	-113.5	0	0	0	115.5
129	R	21.3	Very low	24.7	Very low	200 Å²	200	162.7 Å²	162.7	76%	0.755	82%	0.822	S	S	*	*			trans	-85.9	150.5	-151.5	-64.9	175.8	166.1	176.3	-5.4	117.9
130	S	23.1	Very low	24.5	Very low	107 Å²	107	161.1 Å²	161.1	75%	0.748	82%	0.82	S	S	*	*			trans	44.1	120.5	138.1	67.9	0	0	0	0	121.8
131	D	22.2	Very low	24.2	Very low	149 Å²	149	158 Å²	158	80%	0.797	82%	0.819	S	S	*	*				-154.5	178.4	106.6	-147.7	-13.9	0	0	0	112.2
132	K	28.1	Very low	24	Very low	189 Å²	189	153.5 Å²	153.5	82%	0.822	82%	0.816	S	S	*	*			trans	-93.1	115	-167	-57	154.1	-175.9	164.1	0	113
133	S	24.8	Very low	23.9	Very low	118 Å²	118	152.2 Å²	152.2	83%	0.825	82%	0.819	S	S	*	*			trans	-173.5	137.5	141.8	47.3	0	0	0	0	109.4
134	R	22.8	Very low	23.9	Very low	242 Å²	242	155.7 Å²	155.7	91%	0.913	82%	0.822	S	S	*	*			trans	-131.7	103.9	-174	-163.2	-174.3	-158	-142.3	6.5	111.2
135	P	26.3	Very low	23.9	Very low	112 Å²	112	157.9 Å²	157.9	73%	0.727	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-76.1	155.1	163.1	-10.7	28.2	0	0	0	110.9
136	F	22.1	Very low	23.9	Very low	200 Å²	200	157.5 Å²	157.5	88%	0.877	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-76.3	135.5	173.3	-81.2	-111	0	0	0	110.5
137	L	25.1	Very low	23.8	Very low	161 Å²	161	156.9 Å²	156.9	84%	0.843	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-100.1	125.7	162.8	-69.6	173.4	0	0	0	108.7
138	L	24.7	Very low	23.3	Very low	161 Å²	161	160.7 Å²	160.7	84%	0.843	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-74.9	129	160.1	-82.1	96.8	0	0	0	108.1
139	N	24.5	Very low	23.4	Very low	154 Å²	154	156.4 Å²	156.4	82%	0.824	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-88.9	126.3	165	-86.2	-5.5	0	0	0	109
140	N	23.8	Very low	23.3	Very low	159 Å²	159	155.8 Å²	155.8	85%	0.85	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-67	133.7	172.5	-67.6	-16.6	0	0	0	110.4
141	C	22.8	Very low	23.3	Very low	115 Å²	115	157 Å²	157	78%	0.777	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-90.5	125.3	161	-81.6	0	0	0	0	109.1
142	A	21.4	Very low	23.3	Very low	102 Å²	102	156.1 Å²	156.1	84%	0.843	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-81.9	135.6	167	0	0	0	0	0	109.6
143	V	24.5	Very low	23	Very low	138 Å²	138	150.9 Å²	150.9	84%	0.836	84%	0.837	S	S	*	*			trans	-108.8	123.3	172.8	179	0	0	0	0	107.7
144	Q	22.9	Very low	23	Very low	192 Å²	192	154.6 Å²	154.6	90%	0.897	84%	0.841	S	S	*	*			trans	-87.6	132	170	-76.1	179.7	-38.2	0	0	109.5
145	S	22.9	Very low	23.1	Very low	119 Å²	119	146.7 Å²	146.7	83%	0.832	83%	0.827	S	S	*	*			trans	-86.3	143.3	175.4	49.7	0	0	0	0	111.3
146	M	22.8	Very low	22.9	Very low	191 Å²	191	146.9 Å²	146.9	94%	0.941	83%	0.83	S	S	*	*			trans	-116.6	132.6	176.7	-165.8	155.6	172.5	0	0	109.5
147	E	20.8	Very low	22.9	Very low	188 Å²	188	146.1 Å²	146.1	88%	0.879	83%	0.826	S	S	*	*			trans	-85.2	143.3	-174.1	-62.2	-179.8	149.9	0	0	112.3
148	M	21.8	Very low	22.8	Very low	191 Å²	191	145.3 Å²	145.3	94%	0.941	82%	0.823	S	S	*	*			trans	-147	148.8	169	-97.6	171.5	58.4	0	0	109.8
149	S	21.8	Very low	22.6	Very low	97 Å²	97	146.3 Å²	146.3	68%	0.678	82%	0.82	S	S	*	*			trans	-136.2	165.9	-167.2	49	0	0	0	0	113.7
150	F	21.2	Very low	22.5	Very low	186 Å²	186	145.6 Å²	145.6	82%	0.816	82%	0.816	S	S	*	*			trans	104.4	126.6	162	-65.8	-78.9	0	0	0	121.2
151	V	22.4	Very low	22.4	Very low	133 Å²	133	142.6 Å²	142.6	81%	0.806	81%	0.813	S	S	*	*			trans	69.8	130.8	136.7	177.8	0	0	0	0	121
152	T	22.6	Very low	22.4	Very low	131 Å²	131	143 Å²	143	80%	0.804	82%	0.817	S	S	*	*			trans	-109.5	156.1	-178.2	47.1	0	0	0	0	113.1
153	G	22	Very low	22.5	Very low	79 Å²	79	143.7 Å²	143.7	81%	0.814	82%	0.816	S	S	*	*			trans	-160.7	159	172.2	0	0	0	0	0	113.4
154	E	24.7	Very low	22.5	Very low	196 Å²	196	143.1 Å²	143.1	92%	0.916	82%	0.818	S	S	*	*			trans	-116.3	163	-162.9	-81.8	-160.6	87.3	0	0	114.1
155	A	23.5	Very low	22.6	Very low	75 Å²	75	140.6 Å²	140.6	62%	0.62	81%	0.809	S	S	*	*			cis	-171.1	-155.6	-15	0	0	0	0	0	110.1
156	C	22	Very low	22.5	Very low	117 Å²	117	144 Å²	144	79%	0.791	81%	0.81	S	S	*	*			trans	88.4	130.1	167.1	-65.7	0	0	0	0	116.3
157	K	22.3	Very low	22.6	Very low	183 Å²	183	142 Å²	142	80%	0.796	80%	0.798	S	S	*	*			cis	109.7	127.5	32.6	-91.1	-169.7	-179.9	179	0	112
158	D	23.1	Very low	22.9	Very low	145 Å²	145	141.3 Å²	141.3	78%	0.775	79%	0.794	S	S	*	*			trans	102.1	129.7	149.3	-57	-20.4	0	0	0	123
159	F	21.1	Very low	23.1	Very low	181 Å²	181	140.6 Å²	140.6	79%	0.794	79%	0.788	S	S	*	*			trans	92.8	84.5	146	-106.9	-95.4	0	0	0	125.1
160	L	22.3	Very low	23.2	Very low	140 Å²	140	140.6 Å²	140.6	73%	0.733	79%	0.794	S	S	*	*				36	123.2	121	-64.9	174	0	0	0	123.8
161	A	22.5	Very low	23.8	Very low	95 Å²	95	137.8 Å²	137.8	79%	0.785	80%	0.795	S	S	*	*				76.5	118.3	123.6	0	0	0	0	0	122.8
162	S	22.7	Very low	24.1	Very low	123 Å²	123	140.6 Å²	140.6	86%	0.86	80%	0.798	S	S	*	*				-155.7	154.5	120.4	58.3	0	0	0	0	111.3
163	S	22.5	Very low	24.3	Very low	117 Å²	117	142 Å²	142	82%	0.818	80%	0.801	S	S	*	*			trans	-121.4	155.5	-177.8	-56.4	0	0	0	0	111.2
164	S	24	Very low	24.4	Very low	126 Å²	126	144.9 Å²	144.9	88%	0.881	79%	0.793	S	S	*	*			trans	-152.2	143.4	150.3	35.9	0	0	0	0	111.8
165	I	24.6	Very low	24.3	Very low	140 Å²	140	147.8 Å²	147.8	72%	0.718	80%	0.796	S	S	*	*			trans	-98.2	150.2	-165.8	-67.2	156.4	0	0	0	110	E167	I165-E167 HydrophobicContact CG2-CG 4.02Å
166	F	22.1	Very low	24.4	Very low	191 Å²	191	151.4 Å²	151.4	84%	0.838	80%	0.798	S	S	*	*			trans	-136.7	117.9	150.8	-113.1	-86.8	0	0	0	111
167	E	23.9	Very low	24.6	Very low	148 Å²	148	151.7 Å²	151.7	69%	0.692	80%	0.798	S	S	*	*			trans	-89.7	144.1	172.1	-62.1	-176.8	136.9	0	0	110.4	I165	I165-E167 HydrophobicContact CG2-CG 4.02Å
168	H	28.3	Very low	25	Very low	173 Å²	173	151.7 Å²	151.7	80%	0.801	80%	0.801	S	S	*	*			trans	-140	118.6	159.2	-86.4	-68.4	0	0	0	111.9
169	H	25.4	Very low	25.3	Very low	177 Å²	177	149.5 Å²	149.5	82%	0.819	80%	0.797	S	S	*	*			trans	-88.1	141.1	167.9	-82.3	80.2	0	0	0	111
170	A	24.4	Very low	25.5	Very low	97 Å²	97	147.6 Å²	147.6	80%	0.802	80%	0.795	S	S	*	*			trans	-168.2	169.9	147.4	0	0	0	0	0	110.4
171	P	32.6	Very low	25.9	Very low	127 Å²	127	147.5 Å²	147.5	83%	0.825	80%	0.8	S	S	*	*				-114.9	164	-126.2	21.6	-0.1	0	0	0	115.9
172	H	28.6	Very low	26.1	Very low	191 Å²	191	151.4 Å²	151.4	88%	0.884	80%	0.799	S	S	*	*			trans	-74.2	141.6	170.5	-85.8	-94.9	0	0	0	112.3
173	N	27	Very low	26.3	Very low	162 Å²	162	151.3 Å²	151.3	87%	0.866	80%	0.797	S	S	*	*			trans	-125.8	142.9	161.6	-116.2	-8.1	0	0	0	111.3
174	E	25.5	Very low	26.6	Very low	139 Å²	139	154 Å²	154	65%	0.65	80%	0.797	S	S	*	*			trans	-55.2	139.2	-161.8	-54.6	179.4	112.3	0	0	117.1	K176	E174-K176 WeakPolarHBondContact OE1-CE 3.49Å; E174-K176 IonicContact OE1-NZ 3.87Å; E174-K176 PolarHBondContact OE1-NZ 3.21Å; E174-K176 IonicContact OE2-NZ 2.58Å
175	W	22.7	Very low	27	Very low	257 Å²	257	156.9 Å²	156.9	97%	0.973	80%	0.797	S	S	*	*			trans	-134.2	117.2	145.9	-115.3	62.7	0	0	0	108.4
176	K	24.7	Very low	27.6	Very low	151 Å²	151	155.3 Å²	155.3	66%	0.657	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-92.7	126.5	-176.2	-71.9	174.8	178.7	149.6	0	111	E174	E174-K176 WeakPolarHBondContact OE1-CE 3.49Å; E174-K176 IonicContact OE1-NZ 3.87Å; E174-K176 PolarHBondContact OE1-NZ 3.21Å; E174-K176 IonicContact OE2-NZ 2.58Å
177	P	27.2	Very low	28	Very low	122 Å²	122	151.9 Å²	151.9	79%	0.792	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-76.9	140.5	161.4	-3.8	21.5	0	0	0	109.7
178	H	29.3	Very low	29	Very low	184 Å²	184	154.5 Å²	154.5	85%	0.852	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-72.1	146.1	171.1	-82.4	-92.6	0	0	0	111.7
179	S	29.1	Very low	29.3	Very low	99 Å²	99	151.5 Å²	151.5	69%	0.692	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-49.4	161.2	170.2	52.3	0	0	0	0	112.6
180	N	26.5	Very low	30.2	Very low	140 Å²	140	146.4 Å²	146.4	75%	0.749	81%	0.809	S	S	*	*			cis	-170	123.1	44.2	-156.3	6.7	0	0	0	113.6
181	T	29.9	Very low	31.7	Very low	139 Å²	139	149.4 Å²	149.4	85%	0.853	80%	0.804	S	S	*	*			trans	-154.3	126.3	140	32.8	0	0	0	0	107.1
182	K	27.9	Very low	32.9	Very low	176 Å²	176	153.2 Å²	153.2	77%	0.765	80%	0.802	S	S	*	*			trans	-56.5	135	-174.2	-74.2	175.7	167.4	-175.5	0	112.5
183	C	25.2	Very low	35.2	Very low	121 Å²	121	150.1 Å²	150.1	82%	0.818	79%	0.787	S	S	*	*			trans	-76.2	128.2	149.7	-63.1	0	0	0	0	108.2
184	E	29.6	Very low	37.8	Very low	173 Å²	173	146.4 Å²	146.4	81%	0.808	76%	0.762	S	S	*	*			trans	-104.2	132.1	151.3	-74.9	179.7	165.7	0	0	106.8
185	E	32.8	Very low	40.6	Very low	187 Å²	187	146.6 Å²	146.6	87%	0.874	76%	0.76	S	S	*	*			trans	-82.2	164.6	-172.1	-67.3	178.8	123.4	0	0	112.2
186	A	36.5	Very low	43.6	Very low	107 Å²	107	134.4 Å²	134.4	88%	0.884	71%	0.714	S	S	*	*			trans	71.1	75.6	172	0	0	0	0	0	117.9
187	S	31.6	Very low	46.4	Very low	120 Å²	120	132.1 Å²	132.1	84%	0.839	72%	0.717	S	S	*	*			trans	-142.4	121.3	136.4	62.1	0	0	0	0	112.2	C189	S187-C189 PolarHBondContact O-N 3.38Å
188	H	45.1	Very low	48.8	Very low	202 Å²	202	131.4 Å²	131.4	94%	0.935	70%	0.703	S	S	*	*			trans	-77.5	118.9	179.5	-148.6	58.8	0	0	0	109
189	C	33.5	Very low	51.1	Low	111 Å²	111	124 Å²	124	75%	0.75	67%	0.672	S	S	*	*			trans	-129.8	107.6	170.4	-170.7	0	0	0	0	109.7	S187 K191	S187-C189 PolarHBondContact O-N 3.38Å; C189-K191 PolarHBondContact O-N 3.22Å
190	G	45.4	Very low	53.5	Low	69 Å²	69	120.9 Å²	120.9	71%	0.711	66%	0.655	S	S	*	*			trans	-69	85.6	-172.4	0	0	0	0	0	113.5	R192	G190-R192 PolarHBondContact O-N 3.25Å
191	K	54.9	Low	55.9	Low	161 Å²	161	116.4 Å²	116.4	70%	0.7	63%	0.629	S	S	*	*			trans	-65.2	99	163.7	-69.5	-179.4	-177.1	172.8	0	108.4	C189 H193	C189-K191 PolarHBondContact O-N 3.22Å; K191-H193 PolarHBondContact O-N 3.41Å; K191-H193 PolarHBondContact O-ND1 2.85Å
192	R	57.4	Low	58.3	Low	207 Å²	207	114.1 Å²	114.1	78%	0.781	62%	0.615	S	S	*	*			trans	-59.6	106.4	171.1	-71.5	175.4	69.5	170.3	3.2	108.3	G190 Y194	G190-R192 PolarHBondContact O-N 3.25Å; R192-Y194 VanDerWaalsContact O-CD2 3.28Å; R192-Y194 WeakPolarHBondContact O-CD2 3.29Å; R192-Y194 VanDerWaalsContact O-CE2 3.27Å; R192-Y194 WeakPolarHBondContact O-CE2 3.31Å; R192-Y194 PolarHBondContact O-N 3.16Å
193	H	77.3	Confident	61	Low	126 Å²	126	107.8 Å²	107.8	58%	0.583	59%	0.587	S	S	*	*			trans	-70.5	125.2	172.5	-66.2	92.4	0	0	0	108.8	K191 K195	K191-H193 PolarHBondContact O-N 3.41Å; K191-H193 PolarHBondContact O-ND1 2.85Å; H193-K195 PolarHBondContact O-N 3.26Å
194	Y	81.6	Confident	63.9	Low	84 Å²	84	106.1 Å²	106.1	33%	0.329	58%	0.577	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-86.7	105.9	179.6	-63.8	-86.6	0	0	0	108.2	R192 F203 K206	R192-Y194 VanDerWaalsContact O-CD2 3.28Å; R192-Y194 WeakPolarHBondContact O-CD2 3.29Å; R192-Y194 VanDerWaalsContact O-CE2 3.27Å; R192-Y194 WeakPolarHBondContact O-CE2 3.31Å; R192-Y194 PolarHBondContact O-N 3.16Å; Y194-F203 PolarHBondContact N-O 3.41Å; Y194-F203 WeakPolarHBondContact O-CD2 3.35Å; Y194-F203 PolarHBondContact O-N 3.15Å; Y194-K206 HydrophobicContact CD1-CB 3.89Å; Y194-K206 HydrophobicContact CD1-CG 3.97Å; Y194-K206 HydrophobicContact CD2-CB 4.26Å; Y194-K206 VanDerWaalsContact CD2-N 3.29Å; Y194-K206 HydrophobicContact CE1-CB 3.65Å; Y194-K206 HydrophobicContact CE1-CD 4.18Å; Y194-K206 HydrophobicContact CE1-CG 3.88Å; Y194-K206 HydrophobicContact CE2-CB 4.03Å; Y194-K206 HydrophobicContact CG-CB 4.19Å
195	K	85.3	Confident	66.5	Low	143 Å²	143	104.6 Å²	104.6	62%	0.622	56%	0.564	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-85.6	134.9	-179.1	-169.5	179	176.9	-177.6	0	110.7	H193 G200 T202	H193-K195 PolarHBondContact O-N 3.26Å; K195-G200 WeakPolarHBondContact CE-O 3.49Å; K195-G200 WeakPolarHBondContact CG-O 3.18Å; K195-T202 HydrophobicContact CB-CG2 4.21Å; K195-T202 HydrophobicContact CG-CG2 4.13Å
196	C	84.1	Confident	69	Low	1 Å²	1	102 Å²	102	1%	0.007	55%	0.55	C	S	.	*			trans	-73.2	128.2	166.3	179	0	0	0	0	109.8	E198 C199 G200 K201 F203 L209 H216	C196-E198 VanDerWaalsContact C-N 3.32Å; C196-E198 PolarHBondContact SG-N 3.05Å; C196-C199 VanDerWaalsContact SG-SG 3.69Å; C196-G200 VanDerWaalsContact O-CA 3.25Å; C196-G200 WeakPolarHBondContact O-CA 3.31Å; C196-G200 PolarHBondContact O-N 3.2Å; C196-K201 PolarHBondContact N-O 2.87Å; C196-F203 HydrophobicContact CB-CE2 4.35Å; C196-L209 HydrophobicContact CB-CD1 3.67Å; C196-H216 PolarHBondContact SG-NE2 2.92Å
197	S	83.4	Confident	71.2	Confident	103 Å²	103	101 Å²	101	72%	0.72	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-34.1	175.9	37.8	0	0	0	0	113
198	E	77.4	Confident	73.6	Confident	106 Å²	106	96.9 Å²	96.9	50%	0.495	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-32.9	-167.4	-66.1	159.8	-104.1	0	0	113.7	C196 H216	C196-E198 VanDerWaalsContact C-N 3.32Å; C196-E198 PolarHBondContact SG-N 3.05Å; E198-H216 IonicContact OE1-CD2 3.79Å; E198-H216 WeakPolarHBondContact OE2-CB 3.39Å; E198-H216 IonicContact OE2-CD2 3.86Å; E198-H216 IonicContact OE2-CG 2.78Å
199	C	78.8	Confident	75.3	Confident	30 Å²	30	88.1 Å²	88.1	20%	0.203	46%	0.461	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.6	9.9	179.3	73.8	0	0	0	0	114.3	C196 K201 H212	C196-C199 VanDerWaalsContact SG-SG 3.69Å; C199-K201 PolarHBondContact O-N 3.47Å; C199-H212 VanDerWaalsContact SG-CE1 3.58Å; C199-H212 PolarHBondContact SG-NE2 2.91Å
200	G	78.7	Confident	77.7	Confident	32 Å²	32	86 Å²	86	33%	0.33	44%	0.444	S	S	.	.			trans	69.6	-11.5	175.5	0	0	0	0	0	117.1	K195 C196	K195-G200 WeakPolarHBondContact CE-O 3.49Å; K195-G200 WeakPolarHBondContact CG-O 3.18Å; C196-G200 VanDerWaalsContact O-CA 3.25Å; C196-G200 WeakPolarHBondContact O-CA 3.31Å; C196-G200 PolarHBondContact O-N 3.2Å
201	K	77.6	Confident	79.2	Confident	47 Å²	47	85.9 Å²	85.9	20%	0.204	43%	0.425	C	S	.	.			trans	-56.4	137.7	-179	-72.2	-179.1	174.5	-179.8	0	112.3	D76 C196 C199 F203	D76-K201 IonicContact OD2-NZ 3.48Å; D76-K201 PolarHBondContact OD2-NZ 2.81Å; C196-K201 PolarHBondContact N-O 2.87Å; C199-K201 PolarHBondContact O-N 3.47Å; K201-F203 HydrophobicContact CB-CE2 3.85Å; K201-F203 HydrophobicContact CB-CZ 3.96Å; K201-F203 WeakPolarHBondContact O-CE2 3.31Å
202	T	80.1	Confident	80.3	Confident	90 Å²	90	78.7 Å²	78.7	55%	0.552	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107	139.5	-177.9	54.8	0	0	0	0	111.8	K195	K195-T202 HydrophobicContact CB-CG2 4.21Å; K195-T202 HydrophobicContact CG-CG2 4.13Å
203	F	85.4	Confident	81.2	Confident	43 Å²	43	71.7 Å²	71.7	19%	0.189	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	139.5	-177.2	-60.9	-86.3	0	0	0	110.7	Y194 C196 K201 R205 L209 H212	Y194-F203 PolarHBondContact N-O 3.41Å; Y194-F203 WeakPolarHBondContact O-CD2 3.35Å; Y194-F203 PolarHBondContact O-N 3.15Å; C196-F203 HydrophobicContact CB-CE2 4.35Å; K201-F203 HydrophobicContact CB-CE2 3.85Å; K201-F203 HydrophobicContact CB-CZ 3.96Å; K201-F203 WeakPolarHBondContact O-CE2 3.31Å; F203-R205 PolarHBondContact O-N 2.98Å; F203-L209 HydrophobicContact CB-CB 4.22Å; F203-L209 HydrophobicContact CD2-CB 3.88Å; F203-L209 HydrophobicContact CD2-CD1 3.75Å; F203-L209 HydrophobicContact CD2-CG 4.41Å; F203-L209 HydrophobicContact CE2-CD1 3.93Å; F203-L209 HydrophobicContact CG-CB 4.2Å; F203-H212 HydrophobicContact CE1-CB 3.88Å; F203-H212 HydrophobicContact CE2-CB 3.94Å; F203-H212 AromaticContact CE2-CD2 3.45Å; F203-H212 VanDerWaalsContact CE2-CD2 3.45Å; F203-H212 WeakPolarHBondContact CE2-CD2 3.13Å; F203-H212 AromaticContact CE2-CG 3.67Å; F203-H212 HydrophobicContact CZ-CB 3.45Å; F203-H212 VanDerWaalsContact CZ-CB 3.45Å; F203-H212 AromaticContact CZ-CD2 3.49Å; F203-H212 VanDerWaalsContact CZ-CD2 3.49Å; F203-H212 WeakPolarHBondContact CZ-CD2 3.42Å; F203-H212 AromaticContact CZ-CG 3.22Å; F203-H212 AromaticContact CZ-ND1 3.73Å
204	S	85.5	Confident	81.2	Confident	87 Å²	87	68 Å²	68	61%	0.608	35%	0.352	S	S	*	.	S	Bend	trans	-72	-10.6	177.2	56.6	0	0	0	0	113.7
205	R	84.9	Confident	80.7	Confident	140 Å²	140	65.3 Å²	65.3	53%	0.528	34%	0.344	S	S	.	.	S	Bend	trans	-142.7	148.6	-179.1	-55.5	163.2	52.3	144.3	-5.6	111.6	F203 D207 S208 L209	F203-R205 PolarHBondContact O-N 2.98Å; R205-D207 WeakPolarHBondContact CB-OD1 3.46Å; R205-D207 IonicContact CZ-OD1 3.61Å; R205-D207 IonicContact CZ-OD2 3.71Å; R205-D207 IonicContact NE-OD1 3.8Å; R205-D207 PolarHBondContact NE-OD1 2.85Å; R205-D207 IonicContact NE-OD2 3.5Å; R205-D207 PolarHBondContact NE-OD2 3.31Å; R205-D207 IonicContact NH2-OD1 3.66Å; R205-D207 PolarHBondContact NH2-OD1 3.16Å; R205-D207 IonicContact NH2-OD2 3.95Å; R205-D207 PolarHBondContact NH2-OD2 3.02Å; R205-S208 PolarHBondContact O-N 3.1Å; R205-L209 PolarHBondContact O-N 3.11Å
206	K	83.6	Confident	80.1	Confident	134 Å²	134	61.1 Å²	61.1	58%	0.583	33%	0.326	S	S	*	.	H	α-helix	trans	-66.4	-39.3	-179.5	-167.8	179.5	177.3	-175.7	0	112.7	Y194 S208 L209 V210	Y194-K206 HydrophobicContact CD1-CB 3.89Å; Y194-K206 HydrophobicContact CD1-CG 3.97Å; Y194-K206 HydrophobicContact CD2-CB 4.26Å; Y194-K206 VanDerWaalsContact CD2-N 3.29Å; Y194-K206 HydrophobicContact CE1-CB 3.65Å; Y194-K206 HydrophobicContact CE1-CD 4.18Å; Y194-K206 HydrophobicContact CE1-CG 3.88Å; Y194-K206 HydrophobicContact CE2-CB 4.03Å; Y194-K206 HydrophobicContact CG-CB 4.19Å; K206-S208 VanDerWaalsContact C-N 3.31Å; K206-S208 PolarHBondContact O-N 3.47Å; K206-L209 PolarHBondContact O-N 3.02Å; K206-V210 WeakPolarHBondContact O-CG2 3.4Å; K206-V210 PolarHBondContact O-N 3.33Å
207	D	82.8	Confident	79.6	Confident	84 Å²	84	65 Å²	65	45%	0.449	35%	0.35	S	S	.	.	H	α-helix	trans	-66.7	-33.3	179.3	63.2	-47.9	0	0	0	112.1	R205 V210 Q211	R205-D207 WeakPolarHBondContact CB-OD1 3.46Å; R205-D207 IonicContact CZ-OD1 3.61Å; R205-D207 IonicContact CZ-OD2 3.71Å; R205-D207 IonicContact NE-OD1 3.8Å; R205-D207 PolarHBondContact NE-OD1 2.85Å; R205-D207 IonicContact NE-OD2 3.5Å; R205-D207 PolarHBondContact NE-OD2 3.31Å; R205-D207 IonicContact NH2-OD1 3.66Å; R205-D207 PolarHBondContact NH2-OD1 3.16Å; R205-D207 IonicContact NH2-OD2 3.95Å; R205-D207 PolarHBondContact NH2-OD2 3.02Å; D207-V210 PolarHBondContact O-N 3.34Å; D207-Q211 VanDerWaalsContact O-CB 3.23Å; D207-Q211 WeakPolarHBondContact O-CB 3.42Å; D207-Q211 PolarHBondContact O-N 3.19Å
208	S	82.3	Confident	79.2	Confident	34 Å²	34	61.9 Å²	61.9	24%	0.238	33%	0.333	C	S	.	.	H	α-helix	trans	-66.3	-39.4	171.4	-52.2	0	0	0	0	112.2	R205 K206 H212	R205-S208 PolarHBondContact O-N 3.1Å; K206-S208 VanDerWaalsContact C-N 3.31Å; K206-S208 PolarHBondContact O-N 3.47Å; S208-H212 WeakPolarHBondContact O-CB 3.48Å; S208-H212 PolarHBondContact O-N 3.31Å
209	L	81.9	Confident	79	Confident	19 Å²	19	61.7 Å²	61.7	10%	0.099	33%	0.333	C	S	.	.	H	α-helix	trans	-63.2	-49.6	172	172.3	61.4	0	0	0	111.3	C196 F203 R205 K206 Q211 H212 Q213	C196-L209 HydrophobicContact CB-CD1 3.67Å; F203-L209 HydrophobicContact CB-CB 4.22Å; F203-L209 HydrophobicContact CD2-CB 3.88Å; F203-L209 HydrophobicContact CD2-CD1 3.75Å; F203-L209 HydrophobicContact CD2-CG 4.41Å; F203-L209 HydrophobicContact CE2-CD1 3.93Å; F203-L209 HydrophobicContact CG-CB 4.2Å; R205-L209 PolarHBondContact O-N 3.11Å; K206-L209 PolarHBondContact O-N 3.02Å; L209-Q211 VanDerWaalsContact C-N 3.28Å; L209-Q211 PolarHBondContact O-N 2.8Å; L209-H212 CarbonylContact O-C 3.58Å; L209-H212 WeakPolarHBondContact O-CA 3.39Å; L209-H212 WeakPolarHBondContact O-CB 3.49Å; L209-H212 PolarHBondContact O-N 3.47Å; L209-Q213 HydrophobicContact CD1-CG 4.08Å; L209-Q213 HydrophobicContact CG-CG 4.4Å; L209-Q213 WeakPolarHBondContact O-CG 3.5Å; L209-Q213 PolarHBondContact O-N 3.3Å
210	V	82.8	Confident	79	Confident	66 Å²	66	62.3 Å²	62.3	40%	0.4	33%	0.331	S	S	.	.	H	α-helix	trans	-59.9	-40.1	179.5	171.7	0	0	0	0	111.3	K206 D207 H212 Q213	K206-V210 WeakPolarHBondContact O-CG2 3.4Å; K206-V210 PolarHBondContact O-N 3.33Å; D207-V210 PolarHBondContact O-N 3.34Å; V210-H212 VanDerWaalsContact C-N 3.31Å; V210-H212 PolarHBondContact O-N 2.71Å; V210-Q213 PolarHBondContact O-N 3.05Å
211	Q	77.4	Confident	79.2	Confident	67 Å²	67	64.1 Å²	64.1	31%	0.313	34%	0.337	S	S	.	.	H	α-helix	trans	-67.8	-29.7	174.8	-177.8	176.1	79.4	0	0	113.1	D207 L209 R233	D207-Q211 VanDerWaalsContact O-CB 3.23Å; D207-Q211 WeakPolarHBondContact O-CB 3.42Å; D207-Q211 PolarHBondContact O-N 3.19Å; L209-Q211 VanDerWaalsContact C-N 3.28Å; L209-Q211 PolarHBondContact O-N 2.8Å; Q211-R233 VanDerWaalsContact CD-CZ 3.5Å; Q211-R233 VanDerWaalsContact CD-NE 3.29Å; Q211-R233 HydrophobicContact CG-CG 4.1Å
212	H	78.9	Confident	79.4	Confident	10 Å²	10	64.8 Å²	64.8	5%	0.046	34%	0.338	C	S	.	.	H	α-helix	trans	-76.5	-36.2	174.1	165.7	73	0	0	0	112.5	C199 F203 S208 L209 V210 R214 V215 H216	C199-H212 VanDerWaalsContact SG-CE1 3.58Å; C199-H212 PolarHBondContact SG-NE2 2.91Å; F203-H212 HydrophobicContact CE1-CB 3.88Å; F203-H212 HydrophobicContact CE2-CB 3.94Å; F203-H212 AromaticContact CE2-CD2 3.45Å; F203-H212 VanDerWaalsContact CE2-CD2 3.45Å; F203-H212 WeakPolarHBondContact CE2-CD2 3.13Å; F203-H212 AromaticContact CE2-CG 3.67Å; F203-H212 HydrophobicContact CZ-CB 3.45Å; F203-H212 VanDerWaalsContact CZ-CB 3.45Å; F203-H212 AromaticContact CZ-CD2 3.49Å; F203-H212 VanDerWaalsContact CZ-CD2 3.49Å; F203-H212 WeakPolarHBondContact CZ-CD2 3.42Å; F203-H212 AromaticContact CZ-CG 3.22Å; F203-H212 AromaticContact CZ-ND1 3.73Å; S208-H212 WeakPolarHBondContact O-CB 3.48Å; S208-H212 PolarHBondContact O-N 3.31Å; L209-H212 CarbonylContact O-C 3.58Å; L209-H212 WeakPolarHBondContact O-CA 3.39Å; L209-H212 WeakPolarHBondContact O-CB 3.49Å; L209-H212 PolarHBondContact O-N 3.47Å; V210-H212 VanDerWaalsContact C-N 3.31Å; V210-H212 PolarHBondContact O-N 2.71Å; H212-R214 PolarHBondContact O-N 2.97Å; H212-R214 VanDerWaalsContact O-N 3.14Å; H212-V215 VanDerWaalsContact O-CB 3.22Å; H212-V215 WeakPolarHBondContact O-CB 3.38Å; H212-V215 WeakPolarHBondContact O-CG2 3.46Å; H212-V215 PolarHBondContact O-N 3.3Å; H212-H216 AromaticContact CD2-NE2 3.93Å; H212-H216 AromaticContact CE1-CE1 3.9Å; H212-H216 AromaticContact CE1-NE2 3.52Å; H212-H216 AromaticContact NE2-CE1 3.83Å; H212-H216 AromaticContact NE2-NE2 3.06Å; H212-H216 PolarHBondContact NE2-NE2 3.38Å
213	Q	74.8	Confident	79.4	Confident	60 Å²	60	66.6 Å²	66.6	28%	0.28	34%	0.34	S	S	.	.	H	α-helix	trans	-57.4	-29.8	177.3	-73.5	175.4	-68.7	0	0	112.6	L209 V210 V215 H216 T217	L209-Q213 HydrophobicContact CD1-CG 4.08Å; L209-Q213 HydrophobicContact CG-CG 4.4Å; L209-Q213 WeakPolarHBondContact O-CG 3.5Å; L209-Q213 PolarHBondContact O-N 3.3Å; V210-Q213 PolarHBondContact O-N 3.05Å; Q213-V215 PolarHBondContact O-N 3.31Å; Q213-V215 VanDerWaalsContact O-N 3.08Å; Q213-H216 PolarHBondContact O-N 2.97Å; Q213-T217 PolarHBondContact O-N 3.3Å; Q213-T217 PolarHBondContact O-OG1 2.77Å
214	R	78.3	Confident	79.2	Confident	49 Å²	49	64.6 Å²	64.6	19%	0.185	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-18.2	171.1	-62.2	-169	174.7	157.8	4.5	115.2	H212 T217 G218 E219 S232	H212-R214 PolarHBondContact O-N 2.97Å; H212-R214 VanDerWaalsContact O-N 3.14Å; R214-T217 WeakPolarHBondContact CA-OG1 3.38Å; R214-G218 PolarHBondContact O-N 3.39Å; R214-E219 HydrophobicContact CB-CB 4.14Å; R214-E219 HydrophobicContact CG-CB 3.9Å; R214-E219 IonicContact NE-OE2 2.91Å; R214-E219 PolarHBondContact NE-OE2 3.06Å; R214-E219 PolarHBondContact O-N 2.67Å; R214-S232 PolarHBondContact NH1-O 3.48Å
215	V	71.4	Confident	79.1	Confident	27 Å²	27	64.3 Å²	64.3	16%	0.164	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-35.8	173.6	177.3	0	0	0	0	110.9	W73 P75 H212 Q213	W73-V215 HydrophobicContact CZ2-CG2 4.26Å; P75-V215 HydrophobicContact CG-CG1 3.83Å; H212-V215 VanDerWaalsContact O-CB 3.22Å; H212-V215 WeakPolarHBondContact O-CB 3.38Å; H212-V215 WeakPolarHBondContact O-CG2 3.46Å; H212-V215 PolarHBondContact O-N 3.3Å; Q213-V215 PolarHBondContact O-N 3.31Å; Q213-V215 VanDerWaalsContact O-N 3.08Å
216	H	71.6	Confident	78.7	Confident	55 Å²	55	63.5 Å²	63.5	26%	0.255	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-40	-179.6	-46.5	-54.2	0	0	0	111.8	C196 E198 H212 Q213 G218	C196-H216 PolarHBondContact SG-NE2 2.92Å; E198-H216 IonicContact OE1-CD2 3.79Å; E198-H216 WeakPolarHBondContact OE2-CB 3.39Å; E198-H216 IonicContact OE2-CD2 3.86Å; E198-H216 IonicContact OE2-CG 2.78Å; H212-H216 AromaticContact CD2-NE2 3.93Å; H212-H216 AromaticContact CE1-CE1 3.9Å; H212-H216 AromaticContact CE1-NE2 3.52Å; H212-H216 AromaticContact NE2-CE1 3.83Å; H212-H216 AromaticContact NE2-NE2 3.06Å; H212-H216 PolarHBondContact NE2-NE2 3.38Å; Q213-H216 PolarHBondContact O-N 2.97Å; H216-G218 PolarHBondContact O-N 2.75Å
217	T	74.1	Confident	78.2	Confident	83 Å²	83	59.6 Å²	59.6	51%	0.509	33%	0.334	S	S	.	.	S	Bend	trans	-75.1	-8.6	177.5	66.6	0	0	0	0	114	Q213 R214 E219	Q213-T217 PolarHBondContact O-N 3.3Å; Q213-T217 PolarHBondContact O-OG1 2.77Å; R214-T217 WeakPolarHBondContact CA-OG1 3.38Å; T217-E219 PolarHBondContact O-N 3.15Å; T217-E219 VanDerWaalsContact O-N 3.15Å; T217-E219 WeakPolarHBondContact OG1-CG 3.34Å; T217-E219 PolarHBondContact OG1-N 3.16Å
218	G	74.3	Confident	77.8	Confident	36 Å²	36	57.5 Å²	57.5	37%	0.371	33%	0.332	S	S	.	.			trans	67.6	6.8	-175.7	0	0	0	0	0	114.7	R214 H216 R220	R214-G218 PolarHBondContact O-N 3.39Å; H216-G218 PolarHBondContact O-N 2.75Å; G218-R220 WeakPolarHBondContact O-CG 3.38Å; G218-R220 PolarHBondContact O-N 3.28Å
219	E	73.2	Confident	77.1	Confident	102 Å²	102	57.3 Å²	57.3	48%	0.477	33%	0.327	S	S	.	.			trans	-60.5	119.1	-178.9	-85.8	-173.7	-168.2	0	0	112.4	R214 T217 P221	R214-E219 HydrophobicContact CB-CB 4.14Å; R214-E219 HydrophobicContact CG-CB 3.9Å; R214-E219 IonicContact NE-OE2 2.91Å; R214-E219 PolarHBondContact NE-OE2 3.06Å; R214-E219 PolarHBondContact O-N 2.67Å; T217-E219 PolarHBondContact O-N 3.15Å; T217-E219 VanDerWaalsContact O-N 3.15Å; T217-E219 WeakPolarHBondContact OG1-CG 3.34Å; T217-E219 PolarHBondContact OG1-N 3.16Å; E219-P221 WeakPolarHBondContact O-CD 3.34Å
220	R	79.4	Confident	76.5	Confident	44 Å²	44	58.5 Å²	58.5	17%	0.166	34%	0.335	C	S	.	.			trans	-126.2	71.7	178.5	-65.3	171.5	83.6	102.2	11.4	110.9	E71 G218 Y222 T230 F231	E71-R220 PolarHBondContact O-NH1 3.36Å; E71-R220 VanDerWaalsContact O-NH1 3.16Å; E71-R220 IonicContact OE1-NH2 3.48Å; G218-R220 WeakPolarHBondContact O-CG 3.38Å; G218-R220 PolarHBondContact O-N 3.28Å; R220-Y222 PolarHBondContact O-N 3Å; R220-T230 WeakPolarHBondContact CB-OG1 3.33Å; R220-T230 VanDerWaalsContact CZ-O 3.23Å; R220-T230 PolarHBondContact NE-O 3.12Å; R220-T230 PolarHBondContact NE-OG1 3.07Å; R220-T230 PolarHBondContact NH2-O 3.25Å; R220-T230 WeakPolarHBondContact O-CB 3.49Å; R220-F231 CarbonylContact C-O 3.23Å; R220-F231 WeakPolarHBondContact CA-O 3.38Å
221	P	83	Confident	76.2	Confident	70 Å²	70	55.7 Å²	55.7	46%	0.455	32%	0.317	S	S	.	.			trans	-73.6	4.9	-166.3	-18.2	34.1	0	0	0	116.3	E219	E219-P221 WeakPolarHBondContact O-CD 3.34Å
222	Y	82	Confident	76.1	Confident	60 Å²	60	52.7 Å²	52.7	24%	0.235	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	103	-175.3	-51.1	-61.2	0	0	0	109.9	R220 T230 F231 S232 K234	R220-Y222 PolarHBondContact O-N 3Å; Y222-T230 CarbonylContact O-C 3.5Å; Y222-T230 WeakPolarHBondContact O-CA 3.24Å; Y222-F231 WeakPolarHBondContact CD2-O 3.26Å; Y222-F231 PolarHBondContact N-O 3.47Å; Y222-F231 VanDerWaalsContact N-O 3.12Å; Y222-F231 WeakPolarHBondContact O-CD2 3.47Å; Y222-F231 PolarHBondContact O-N 2.85Å; Y222-S232 WeakPolarHBondContact CE2-O 3.35Å; Y222-K234 HydrophobicContact CD1-CD 4.35Å; Y222-K234 HydrophobicContact CD1-CG 3.51Å; Y222-K234 HydrophobicContact CD2-CG 4.09Å; Y222-K234 VanDerWaalsContact CD2-N 3.3Å; Y222-K234 HydrophobicContact CE1-CD 4.02Å; Y222-K234 VanDerWaalsContact CE1-CE 3.4Å; Y222-K234 HydrophobicContact CE1-CG 3.39Å; Y222-K234 HydrophobicContact CE2-CG 3.96Å; Y222-K234 HydrophobicContact CG-CG 3.87Å
223	E	80.3	Confident	75.9	Confident	128 Å²	128	55.6 Å²	55.6	60%	0.598	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.9	143.6	-178.8	-168.4	179.5	157.1	0	0	112.1	T230 L237	E223-T230 HydrophobicContact CB-CG2 4.24Å; E223-T230 HydrophobicContact CG-CG2 4.11Å; E223-L237 WeakPolarHBondContact O-CD2 3.27Å
224	C	80.4	Confident	76	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.007	33%	0.33	C	S	.	.			trans	-88.3	109.3	168.5	-175.9	0	0	0	0	110.4	E226 C227 G228 K229 F231 L237 H244	C224-E226 PolarHBondContact O-N 3.26Å; C224-C227 PolarHBondContact O-N 3.41Å; C224-C227 VanDerWaalsContact SG-SG 3.64Å; C224-G228 WeakPolarHBondContact O-CA 3.32Å; C224-G228 PolarHBondContact O-N 3.09Å; C224-K229 PolarHBondContact N-O 3.1Å; C224-F231 HydrophobicContact CB-CE2 4.19Å; C224-L237 HydrophobicContact CB-CD1 3.57Å; C224-H244 PolarHBondContact SG-NE2 2.88Å; C224-H244 VanDerWaalsContact SG-NE2 3.37Å
225	G	83.9	Confident	76	Confident	81 Å²	81	61.7 Å²	61.7	84%	0.835	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-6	-179.2	0	0	0	0	0	116.1
226	E	76.8	Confident	76.1	Confident	123 Å²	123	61.8 Å²	61.8	58%	0.575	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-24.7	177.5	-65.2	-179.8	-113.1	0	0	113.3	C224 H244	C224-E226 PolarHBondContact O-N 3.26Å; E226-H244 IonicContact OE1-CD2 2.87Å; E226-H244 WeakPolarHBondContact OE2-CB 3.09Å; E226-H244 IonicContact OE2-CD2 3.59Å; E226-H244 IonicContact OE2-CG 3.43Å
227	C	73.6	Confident	76.4	Confident	52 Å²	52	60.3 Å²	60.3	35%	0.351	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.8	3.3	-173.6	72	0	0	0	0	114.9	C224 K229 H240	C224-C227 PolarHBondContact O-N 3.41Å; C224-C227 VanDerWaalsContact SG-SG 3.64Å; C227-K229 PolarHBondContact O-N 3.46Å; C227-K229 VanDerWaalsContact SG-CG 3.56Å; C227-H240 PolarHBondContact SG-NE2 3.07Å
228	G	73.4	Confident	76.5	Confident	40 Å²	40	58.7 Å²	58.7	41%	0.412	34%	0.34	S	S	.	.			trans	68.2	-4.6	-179.2	0	0	0	0	0	115.4	C224 T230	C224-G228 WeakPolarHBondContact O-CA 3.32Å; C224-G228 PolarHBondContact O-N 3.09Å; G228-T230 PolarHBondContact O-N 3.18Å
229	K	67.9	Low	76.6	Confident	31 Å²	31	59.4 Å²	59.4	14%	0.135	33%	0.333	C	S	.	.			trans	-64.2	131.1	179.9	-67.5	-177.9	-172.4	175.2	0	110.3	E33 G69 C224 C227 F231	E33-K229 IonicContact OE1-NZ 3.94Å; E33-K229 PolarHBondContact OE1-NZ 3.24Å; G69-K229 WeakPolarHBondContact O-CG 3.46Å; C224-K229 PolarHBondContact N-O 3.1Å; C227-K229 PolarHBondContact O-N 3.46Å; C227-K229 VanDerWaalsContact SG-CG 3.56Å; K229-F231 HydrophobicContact CB-CE2 3.79Å; K229-F231 HydrophobicContact CB-CZ 3.84Å; K229-F231 HydrophobicContact CD-CZ 4.47Å; K229-F231 WeakPolarHBondContact O-CD2 3.04Å; K229-F231 VanDerWaalsContact O-CE2 3.23Å; K229-F231 WeakPolarHBondContact O-CE2 3.48Å
230	T	68.6	Low	76.8	Confident	44 Å²	44	55.1 Å²	55.1	27%	0.27	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	150.6	179.4	60.1	0	0	0	0	111.9	R220 Y222 E223 G228	R220-T230 WeakPolarHBondContact CB-OG1 3.33Å; R220-T230 VanDerWaalsContact CZ-O 3.23Å; R220-T230 PolarHBondContact NE-O 3.12Å; R220-T230 PolarHBondContact NE-OG1 3.07Å; R220-T230 PolarHBondContact NH2-O 3.25Å; R220-T230 WeakPolarHBondContact O-CB 3.49Å; Y222-T230 CarbonylContact O-C 3.5Å; Y222-T230 WeakPolarHBondContact O-CA 3.24Å; E223-T230 HydrophobicContact CB-CG2 4.24Å; E223-T230 HydrophobicContact CG-CG2 4.11Å; G228-T230 PolarHBondContact O-N 3.18Å
231	F	76.3	Confident	76.6	Confident	6 Å²	6	56.9 Å²	56.9	3%	0.026	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	146.2	-176.1	-59.4	-85.3	0	0	0	111.7	E71 R220 Y222 C224 K229 R233 I236 L237 H240	E71-F231 WeakPolarHBondContact OE1-CD1 3.34Å; E71-F231 VanDerWaalsContact OE1-CE1 3.25Å; E71-F231 WeakPolarHBondContact OE1-CE1 3.34Å; R220-F231 CarbonylContact C-O 3.23Å; R220-F231 WeakPolarHBondContact CA-O 3.38Å; Y222-F231 WeakPolarHBondContact CD2-O 3.26Å; Y222-F231 PolarHBondContact N-O 3.47Å; Y222-F231 VanDerWaalsContact N-O 3.12Å; Y222-F231 WeakPolarHBondContact O-CD2 3.47Å; Y222-F231 PolarHBondContact O-N 2.85Å; C224-F231 HydrophobicContact CB-CE2 4.19Å; K229-F231 HydrophobicContact CB-CE2 3.79Å; K229-F231 HydrophobicContact CB-CZ 3.84Å; K229-F231 HydrophobicContact CD-CZ 4.47Å; K229-F231 WeakPolarHBondContact O-CD2 3.04Å; K229-F231 VanDerWaalsContact O-CE2 3.23Å; K229-F231 WeakPolarHBondContact O-CE2 3.48Å; F231-R233 VanDerWaalsContact C-N 3.35Å; F231-I236 HydrophobicContact CD1-CB 4.4Å; F231-I236 HydrophobicContact CD1-CG2 3.62Å; F231-I236 HydrophobicContact CE1-CG2 4.2Å; F231-I236 HydrophobicContact CG-CG2 4.44Å; F231-L237 HydrophobicContact CB-CB 4.24Å; F231-L237 HydrophobicContact CD2-CB 3.92Å; F231-L237 HydrophobicContact CD2-CD1 3.73Å; F231-L237 HydrophobicContact CD2-CG 4.39Å; F231-L237 HydrophobicContact CE2-CD1 3.91Å; F231-L237 HydrophobicContact CG-CB 4.21Å; F231-H240 HydrophobicContact CE1-CB 3.99Å; F231-H240 HydrophobicContact CE2-CB 3.99Å; F231-H240 AromaticContact CE2-CD2 3.46Å; F231-H240 VanDerWaalsContact CE2-CD2 3.46Å; F231-H240 WeakPolarHBondContact CE2-CD2 3.24Å; F231-H240 AromaticContact CE2-CG 3.74Å; F231-H240 HydrophobicContact CZ-CB 3.55Å; F231-H240 AromaticContact CZ-CD2 3.4Å; F231-H240 VanDerWaalsContact CZ-CD2 3.4Å; F231-H240 WeakPolarHBondContact CZ-CD2 3.4Å; F231-H240 AromaticContact CZ-CG 3.25Å; F231-H240 AromaticContact CZ-ND1 3.85Å
232	S	75.6	Confident	76.4	Confident	4 Å²	4	56.8 Å²	56.8	3%	0.028	31%	0.314	C	S	.	.	S	Bend	trans	-78.9	-14.5	179.6	59.7	0	0	0	0	114.1	R214 Y222	R214-S232 PolarHBondContact NH1-O 3.48Å; Y222-S232 WeakPolarHBondContact CE2-O 3.35Å
233	R	75.5	Confident	75.9	Confident	72 Å²	72	56.3 Å²	56.3	27%	0.272	32%	0.315	S	S	.	.	S	Bend	trans	-140.9	134.5	-176.7	-48.8	-176.1	-174.1	-169	-3.5	112.5	Q211 F231 I236 L237	Q211-R233 VanDerWaalsContact CD-CZ 3.5Å; Q211-R233 VanDerWaalsContact CD-NE 3.29Å; Q211-R233 HydrophobicContact CG-CG 4.1Å; F231-R233 VanDerWaalsContact C-N 3.35Å; R233-I236 HydrophobicContact CB-CD1 4Å; R233-I236 HydrophobicContact CB-CG1 4.1Å; R233-I236 HydrophobicContact CG-CD1 4.08Å; R233-I236 PolarHBondContact O-N 3.2Å; R233-I236 VanDerWaalsContact O-N 3.1Å; R233-L237 PolarHBondContact O-N 3.46Å
234	K	76.6	Confident	75.7	Confident	141 Å²	141	53.5 Å²	53.5	61%	0.613	30%	0.301	S	S	*	.	H	α-helix	trans	-53.7	-42.2	177.2	-68.8	-167.7	177.5	-171.5	0	114.7	Y222 I236 L237 A238	Y222-K234 HydrophobicContact CD1-CD 4.35Å; Y222-K234 HydrophobicContact CD1-CG 3.51Å; Y222-K234 HydrophobicContact CD2-CG 4.09Å; Y222-K234 VanDerWaalsContact CD2-N 3.3Å; Y222-K234 HydrophobicContact CE1-CD 4.02Å; Y222-K234 VanDerWaalsContact CE1-CE 3.4Å; Y222-K234 HydrophobicContact CE1-CG 3.39Å; Y222-K234 HydrophobicContact CE2-CG 3.96Å; Y222-K234 HydrophobicContact CG-CG 3.87Å; K234-I236 VanDerWaalsContact C-N 3.26Å; K234-I236 PolarHBondContact O-N 3.11Å; K234-L237 PolarHBondContact O-N 3.39Å; K234-A238 PolarHBondContact O-N 3.37Å
235	P	77.6	Confident	75.6	Confident	96 Å²	96	57.4 Å²	57.4	62%	0.623	33%	0.325	S	S	*	.	H	α-helix	trans	-64.2	-29.6	179.1	-24.7	36.3	0	0	0	113.5	Q239	P235-Q239 VanDerWaalsContact O-CB 3.24Å; P235-Q239 WeakPolarHBondContact O-CB 3.29Å; P235-Q239 PolarHBondContact O-N 3.42Å
236	I	73.8	Confident	75.3	Confident	29 Å²	29	56 Å²	56	15%	0.149	31%	0.311	C	S	.	.	H	α-helix	trans	-72.8	-40.3	176.3	-56.4	176.1	0	0	0	109.9	E71 F231 R233 K234 Q239 H240	E71-I236 WeakPolarHBondContact OE1-CG2 3.32Å; F231-I236 HydrophobicContact CD1-CB 4.4Å; F231-I236 HydrophobicContact CD1-CG2 3.62Å; F231-I236 HydrophobicContact CE1-CG2 4.2Å; F231-I236 HydrophobicContact CG-CG2 4.44Å; R233-I236 HydrophobicContact CB-CD1 4Å; R233-I236 HydrophobicContact CB-CG1 4.1Å; R233-I236 HydrophobicContact CG-CD1 4.08Å; R233-I236 PolarHBondContact O-N 3.2Å; R233-I236 VanDerWaalsContact O-N 3.1Å; K234-I236 VanDerWaalsContact C-N 3.26Å; K234-I236 PolarHBondContact O-N 3.11Å; I236-Q239 PolarHBondContact O-N 3.31Å; I236-H240 WeakPolarHBondContact O-CB 3.46Å; I236-H240 PolarHBondContact O-N 2.95Å
237	L	77.4	Confident	75.3	Confident	23 Å²	23	55.3 Å²	55.3	12%	0.12	31%	0.308	C	S	.	.	H	α-helix	trans	-60.3	-47.1	170.4	171.6	60.8	0	0	0	111.7	E223 C224 F231 R233 K234 Q239 H240 Q241	E223-L237 WeakPolarHBondContact O-CD2 3.27Å; C224-L237 HydrophobicContact CB-CD1 3.57Å; F231-L237 HydrophobicContact CB-CB 4.24Å; F231-L237 HydrophobicContact CD2-CB 3.92Å; F231-L237 HydrophobicContact CD2-CD1 3.73Å; F231-L237 HydrophobicContact CD2-CG 4.39Å; F231-L237 HydrophobicContact CE2-CD1 3.91Å; F231-L237 HydrophobicContact CG-CB 4.21Å; R233-L237 PolarHBondContact O-N 3.46Å; K234-L237 PolarHBondContact O-N 3.39Å; L237-Q239 VanDerWaalsContact C-N 3.3Å; L237-Q239 PolarHBondContact O-N 2.57Å; L237-H240 CarbonylContact O-C 3.59Å; L237-H240 WeakPolarHBondContact O-CA 3.4Å; L237-H240 WeakPolarHBondContact O-CB 3.44Å; L237-H240 PolarHBondContact O-N 3.26Å; L237-Q241 HydrophobicContact CD1-CG 4.19Å; L237-Q241 WeakPolarHBondContact O-CG 3.33Å; L237-Q241 PolarHBondContact O-N 2.72Å
238	A	77.2	Confident	75.7	Confident	50 Å²	50	57 Å²	57	41%	0.413	31%	0.312	S	S	.	.	H	α-helix	trans	-63.8	-35	178.7	0	0	0	0	0	112.6	K234	K234-A238 PolarHBondContact O-N 3.37Å
239	Q	76	Confident	76.1	Confident	51 Å²	51	58.7 Å²	58.7	24%	0.238	32%	0.316	C	S	.	.	H	α-helix	trans	-67.9	-36.1	170.5	-178.2	175.7	17.2	0	0	111.8	P235 I236 L237 R242 H261	P235-Q239 VanDerWaalsContact O-CB 3.24Å; P235-Q239 WeakPolarHBondContact O-CB 3.29Å; P235-Q239 PolarHBondContact O-N 3.42Å; I236-Q239 PolarHBondContact O-N 3.31Å; L237-Q239 VanDerWaalsContact C-N 3.3Å; L237-Q239 PolarHBondContact O-N 2.57Å; Q239-R242 WeakPolarHBondContact O-CB 3.13Å; Q239-H261 PolarHBondContact NE2-CD2 3.06Å; Q239-H261 PolarHBondContact NE2-CE1 3.38Å; Q239-H261 PolarHBondContact NE2-NE2 2.9Å
240	H	76.9	Confident	77	Confident	11 Å²	11	60.9 Å²	60.9	5%	0.051	32%	0.323	C	S	.	.	H	α-helix	trans	-68.7	-36.6	175.3	174.9	61.5	0	0	0	112.6	E33 C227 F231 I236 L237 R242 I243 H244	E33-H240 IonicContact OE1-CE1 3.32Å; E33-H240 PolarHBondContact OE1-CE1 3.11Å; E33-H240 IonicContact OE1-ND1 3.5Å; C227-H240 PolarHBondContact SG-NE2 3.07Å; F231-H240 HydrophobicContact CE1-CB 3.99Å; F231-H240 HydrophobicContact CE2-CB 3.99Å; F231-H240 AromaticContact CE2-CD2 3.46Å; F231-H240 VanDerWaalsContact CE2-CD2 3.46Å; F231-H240 WeakPolarHBondContact CE2-CD2 3.24Å; F231-H240 AromaticContact CE2-CG 3.74Å; F231-H240 HydrophobicContact CZ-CB 3.55Å; F231-H240 AromaticContact CZ-CD2 3.4Å; F231-H240 VanDerWaalsContact CZ-CD2 3.4Å; F231-H240 WeakPolarHBondContact CZ-CD2 3.4Å; F231-H240 AromaticContact CZ-CG 3.25Å; F231-H240 AromaticContact CZ-ND1 3.85Å; I236-H240 WeakPolarHBondContact O-CB 3.46Å; I236-H240 PolarHBondContact O-N 2.95Å; L237-H240 CarbonylContact O-C 3.59Å; L237-H240 WeakPolarHBondContact O-CA 3.4Å; L237-H240 WeakPolarHBondContact O-CB 3.44Å; L237-H240 PolarHBondContact O-N 3.26Å; H240-R242 PolarHBondContact O-N 2.89Å; H240-R242 VanDerWaalsContact O-N 3.11Å; H240-I243 WeakPolarHBondContact ND1-CD1 3.35Å; H240-I243 WeakPolarHBondContact O-CB 3.2Å; H240-I243 WeakPolarHBondContact O-CD1 3.5Å; H240-I243 PolarHBondContact O-N 3.42Å; H240-I243 VanDerWaalsContact O-N 3.07Å; H240-H244 AromaticContact CD2-NE2 3.93Å; H240-H244 AromaticContact CE1-CE1 3.97Å; H240-H244 AromaticContact CE1-NE2 3.75Å; H240-H244 AromaticContact NE2-CE1 3.73Å; H240-H244 AromaticContact NE2-NE2 3.14Å; H240-H244 PolarHBondContact NE2-NE2 3.37Å; H240-H244 VanDerWaalsContact NE2-NE2 3.14Å
241	Q	76.2	Confident	77.9	Confident	81 Å²	81	64.6 Å²	64.6	38%	0.379	34%	0.338	S	S	.	.	H	α-helix	trans	-60.7	-24.8	179	-73.4	172.7	-61.3	0	0	113.2	L237 I243 H244 T245	L237-Q241 HydrophobicContact CD1-CG 4.19Å; L237-Q241 WeakPolarHBondContact O-CG 3.33Å; L237-Q241 PolarHBondContact O-N 2.72Å; Q241-I243 PolarHBondContact O-N 3.25Å; Q241-I243 VanDerWaalsContact O-N 3.12Å; Q241-H244 PolarHBondContact O-N 3.24Å; Q241-T245 PolarHBondContact O-N 3.47Å; Q241-T245 PolarHBondContact O-OG1 2.23Å
242	R	78.1	Confident	78.5	Confident	68 Å²	68	64.4 Å²	64.4	26%	0.257	34%	0.337	S	S	.	.	H	α-helix	trans	-59.8	-20.7	174.7	-64.2	-173.6	-177.4	159.7	4.5	114.8	Q239 H240 T245 G246 E247 N260	Q239-R242 WeakPolarHBondContact O-CB 3.13Å; H240-R242 PolarHBondContact O-N 2.89Å; H240-R242 VanDerWaalsContact O-N 3.11Å; R242-T245 WeakPolarHBondContact CA-OG1 3.07Å; R242-G246 CarbonylContact O-C 3.59Å; R242-G246 WeakPolarHBondContact O-CA 3.23Å; R242-G246 PolarHBondContact O-N 3.09Å; R242-E247 HydrophobicContact CB-CB 4.1Å; R242-E247 HydrophobicContact CG-CB 4.09Å; R242-E247 PolarHBondContact O-N 2.66Å; R242-N260 PolarHBondContact NH1-O 3.3Å
243	I	72.3	Confident	79.2	Confident	51 Å²	51	68 Å²	68	26%	0.262	38%	0.375	S	S	.	.	H	α-helix	trans	-68.7	-48.1	176.5	-75.1	129.2	0	0	0	110.7	E33 H240 Q241 G246	E33-I243 HydrophobicContact CB-CD1 3.49Å; E33-I243 VanDerWaalsContact CB-CD1 3.49Å; E33-I243 HydrophobicContact CB-CG1 3.58Å; E33-I243 HydrophobicContact CG-CD1 3.47Å; E33-I243 VanDerWaalsContact CG-CD1 3.47Å; E33-I243 HydrophobicContact CG-CG1 3.93Å; E33-I243 WeakPolarHBondContact OE2-CG1 3.18Å; E33-I243 WeakPolarHBondContact OE2-CG2 3.43Å; H240-I243 WeakPolarHBondContact ND1-CD1 3.35Å; H240-I243 WeakPolarHBondContact O-CB 3.2Å; H240-I243 WeakPolarHBondContact O-CD1 3.5Å; H240-I243 PolarHBondContact O-N 3.42Å; H240-I243 VanDerWaalsContact O-N 3.07Å; Q241-I243 PolarHBondContact O-N 3.25Å; Q241-I243 VanDerWaalsContact O-N 3.12Å; I243-G246 PolarHBondContact O-N 3.18Å
244	H	75.6	Confident	79.7	Confident	68 Å²	68	70.1 Å²	70.1	32%	0.315	39%	0.391	S	S	.	.	H	α-helix	trans	-73.8	-35.8	-177.3	-47.3	-51.7	0	0	0	111.4	C224 E226 H240 Q241 G246	C224-H244 PolarHBondContact SG-NE2 2.88Å; C224-H244 VanDerWaalsContact SG-NE2 3.37Å; E226-H244 IonicContact OE1-CD2 2.87Å; E226-H244 WeakPolarHBondContact OE2-CB 3.09Å; E226-H244 IonicContact OE2-CD2 3.59Å; E226-H244 IonicContact OE2-CG 3.43Å; H240-H244 AromaticContact CD2-NE2 3.93Å; H240-H244 AromaticContact CE1-CE1 3.97Å; H240-H244 AromaticContact CE1-NE2 3.75Å; H240-H244 AromaticContact NE2-CE1 3.73Å; H240-H244 AromaticContact NE2-NE2 3.14Å; H240-H244 PolarHBondContact NE2-NE2 3.37Å; H240-H244 VanDerWaalsContact NE2-NE2 3.14Å; Q241-H244 PolarHBondContact O-N 3.24Å; H244-G246 VanDerWaalsContact C-N 3.28Å; H244-G246 PolarHBondContact O-N 3Å
245	T	78.6	Confident	80.2	Confident	83 Å²	83	65.9 Å²	65.9	51%	0.509	38%	0.378	S	S	.	.	H	α-helix	trans	-76.6	-13.5	173.8	65.9	0	0	0	0	113.6	Q241 R242 E247	Q241-T245 PolarHBondContact O-N 3.47Å; Q241-T245 PolarHBondContact O-OG1 2.23Å; R242-T245 WeakPolarHBondContact CA-OG1 3.07Å; T245-E247 PolarHBondContact O-N 3.46Å; T245-E247 WeakPolarHBondContact OG1-CG 3.34Å; T245-E247 PolarHBondContact OG1-N 3.3Å
246	G	77.4	Confident	80.4	Confident	52 Å²	52	63.2 Å²	63.2	54%	0.536	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.8	11.2	-174.4	0	0	0	0	0	114.7	R242 I243 H244 M248	R242-G246 CarbonylContact O-C 3.59Å; R242-G246 WeakPolarHBondContact O-CA 3.23Å; R242-G246 PolarHBondContact O-N 3.09Å; I243-G246 PolarHBondContact O-N 3.18Å; H244-G246 VanDerWaalsContact C-N 3.28Å; H244-G246 PolarHBondContact O-N 3Å; G246-M248 PolarHBondContact O-N 3.25Å; G246-M248 VanDerWaalsContact O-N 3.16Å
247	E	77.4	Confident	80.7	Confident	108 Å²	108	67.9 Å²	67.9	51%	0.505	39%	0.387	S	S	.	.			trans	-63.4	114.1	-179.8	-81.5	-177.2	-171	0	0	111.8	R242 T245 P249	R242-E247 HydrophobicContact CB-CB 4.1Å; R242-E247 HydrophobicContact CG-CB 4.09Å; R242-E247 PolarHBondContact O-N 2.66Å; T245-E247 PolarHBondContact O-N 3.46Å; T245-E247 WeakPolarHBondContact OG1-CG 3.34Å; T245-E247 PolarHBondContact OG1-N 3.3Å; E247-P249 WeakPolarHBondContact O-CD 3.44Å
248	M	80.4	Confident	80.9	Confident	89 Å²	89	69.8 Å²	69.8	44%	0.438	40%	0.399	S	S	.	.			trans	-122.2	80.7	173.1	-69.7	-146.3	-85.7	0	0	111.1	G246 Y250 V258 F259 N260	G246-M248 PolarHBondContact O-N 3.25Å; G246-M248 VanDerWaalsContact O-N 3.16Å; M248-Y250 PolarHBondContact O-N 2.95Å; M248-Y250 VanDerWaalsContact O-N 3.1Å; M248-V258 HydrophobicContact CB-CB 3.75Å; M248-V258 HydrophobicContact CB-CG2 4Å; M248-V258 HydrophobicContact CE-CG2 3.68Å; M248-V258 HydrophobicContact SD-CG2 4.49Å; M248-F259 CarbonylContact C-O 3.57Å; M248-F259 VanDerWaalsContact C-O 3.23Å; M248-F259 WeakPolarHBondContact CA-O 3.44Å; M248-N260 HydrophobicContact CG-CB 4.13Å; M248-N260 HydrophobicContact SD-CB 4.4Å
249	P	83.7	Confident	81	Confident	75 Å²	75	68.8 Å²	68.8	49%	0.487	39%	0.386	S	S	.	.			trans	-69.5	-8.9	-168.3	-20.7	34.3	0	0	0	115.6	E247	E247-P249 WeakPolarHBondContact O-CD 3.44Å
250	Y	85.2	Confident	80.8	Confident	77 Å²	77	66.9 Å²	66.9	30%	0.302	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	92.2	-171	-56.6	-73.3	0	0	0	110.8	M248 V258 F259 N260 S262	M248-Y250 PolarHBondContact O-N 2.95Å; M248-Y250 VanDerWaalsContact O-N 3.1Å; Y250-V258 CarbonylContact O-C 3.54Å; Y250-V258 WeakPolarHBondContact O-CA 3.36Å; Y250-F259 WeakPolarHBondContact CB-O 3.35Å; Y250-F259 WeakPolarHBondContact CD2-O 3.29Å; Y250-F259 PolarHBondContact N-O 3.11Å; Y250-F259 VanDerWaalsContact N-O 3.11Å; Y250-F259 WeakPolarHBondContact O-CD2 3.49Å; Y250-F259 PolarHBondContact O-N 2.85Å; Y250-N260 WeakPolarHBondContact CD2-O 3.43Å; Y250-N260 WeakPolarHBondContact CE2-O 3.32Å; Y250-S262 VanDerWaalsContact CD2-N 3.32Å
251	E	88.6	Confident	80.6	Confident	122 Å²	122	66.8 Å²	66.8	57%	0.57	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.8	138.4	178.6	-167.6	179.8	161.7	0	0	113	G253 V258 L265	E251-G253 PolarHBondContact O-N 2.89Å; E251-V258 HydrophobicContact CB-CG1 3.95Å; E251-V258 HydrophobicContact CG-CG1 3.9Å; E251-L265 WeakPolarHBondContact O-CD2 3.49Å
252	C	88.8	Confident	80.6	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.007	38%	0.377	C	S	.	.			trans	-83.4	100.2	168	-172.3	0	0	0	0	111.2	I254 C255 G256 K257 F259 L265 H272	C252-I254 PolarHBondContact O-N 2.93Å; C252-C255 PolarHBondContact O-N 3.24Å; C252-G256 PolarHBondContact O-N 2.97Å; C252-K257 HydrophobicContact CB-CB 4.44Å; C252-K257 VanDerWaalsContact CB-O 3.3Å; C252-K257 WeakPolarHBondContact CB-O 3.14Å; C252-K257 PolarHBondContact N-O 3.26Å; C252-F259 HydrophobicContact CB-CE2 4.28Å; C252-L265 HydrophobicContact CB-CD1 3.54Å; C252-H272 VanDerWaalsContact SG-CD2 3.58Å; C252-H272 PolarHBondContact SG-NE2 2.98Å
253	G	89.5	Confident	80.5	Confident	81 Å²	81	63.7 Å²	63.7	84%	0.835	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	4.1	177.6	0	0	0	0	0	117.1	E251	E251-G253 PolarHBondContact O-N 2.89Å
254	I	86.3	Confident	80.8	Confident	116 Å²	116	61.8 Å²	61.8	60%	0.595	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-32.4	172	-59.6	175	0	0	0	111.7	C252 H272	C252-I254 PolarHBondContact O-N 2.93Å; I254-H272 HydrophobicContact CD1-CB 3.64Å; I254-H272 HydrophobicContact CG2-CB 4.22Å
255	C	86.3	Confident	81.1	Confident	51 Å²	51	59.5 Å²	59.5	35%	0.345	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.3	7.5	-173.5	69.8	0	0	0	0	115.4	C252 K257 H268 H272	C252-C255 PolarHBondContact O-N 3.24Å; C255-K257 PolarHBondContact O-N 3.27Å; C255-K257 VanDerWaalsContact O-N 3.11Å; C255-H268 PolarHBondContact SG-NE2 2.83Å; C255-H272 WeakPolarHBondContact CB-CE1 3.48Å; C255-H272 PolarHBondContact SG-CE1 2.76Å; C255-H272 PolarHBondContact SG-NE2 3.2Å
256	G	82.8	Confident	81.2	Confident	40 Å²	40	60 Å²	60	41%	0.412	35%	0.354	S	S	.	.			trans	66.7	6.9	179.9	0	0	0	0	0	114.9	C252 V258	C252-G256 PolarHBondContact O-N 2.97Å; G256-V258 PolarHBondContact O-N 2.94Å
257	K	80.4	Confident	81.2	Confident	127 Å²	127	59.3 Å²	59.3	55%	0.552	34%	0.339	S	S	*	.			trans	-71.6	121.5	176.4	-76.6	-170.6	173.4	-168.7	0	110.2	C252 C255 F259	C252-K257 HydrophobicContact CB-CB 4.44Å; C252-K257 VanDerWaalsContact CB-O 3.3Å; C252-K257 WeakPolarHBondContact CB-O 3.14Å; C252-K257 PolarHBondContact N-O 3.26Å; C255-K257 PolarHBondContact O-N 3.27Å; C255-K257 VanDerWaalsContact O-N 3.11Å; K257-F259 HydrophobicContact CB-CE2 3.84Å; K257-F259 HydrophobicContact CB-CZ 4.04Å; K257-F259 WeakPolarHBondContact O-CD2 3.42Å; K257-F259 VanDerWaalsContact O-CE2 3.25Å; K257-F259 WeakPolarHBondContact O-CE2 3.38Å
258	V	80.8	Confident	81.4	Confident	63 Å²	63	55.4 Å²	55.4	38%	0.382	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	147.6	176.6	-73.5	0	0	0	0	111.6	M248 Y250 E251 G256	M248-V258 HydrophobicContact CB-CB 3.75Å; M248-V258 HydrophobicContact CB-CG2 4Å; M248-V258 HydrophobicContact CE-CG2 3.68Å; M248-V258 HydrophobicContact SD-CG2 4.49Å; Y250-V258 CarbonylContact O-C 3.54Å; Y250-V258 WeakPolarHBondContact O-CA 3.36Å; E251-V258 HydrophobicContact CB-CG1 3.95Å; E251-V258 HydrophobicContact CG-CG1 3.9Å; G256-V258 PolarHBondContact O-N 2.94Å
259	F	78.8	Confident	81.5	Confident	29 Å²	29	54.9 Å²	54.9	13%	0.127	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	146.2	-179.9	-60.7	-89.7	0	0	0	110.1	M248 Y250 C252 K257 N264 L265 H268	M248-F259 CarbonylContact C-O 3.57Å; M248-F259 VanDerWaalsContact C-O 3.23Å; M248-F259 WeakPolarHBondContact CA-O 3.44Å; Y250-F259 WeakPolarHBondContact CB-O 3.35Å; Y250-F259 WeakPolarHBondContact CD2-O 3.29Å; Y250-F259 PolarHBondContact N-O 3.11Å; Y250-F259 VanDerWaalsContact N-O 3.11Å; Y250-F259 WeakPolarHBondContact O-CD2 3.49Å; Y250-F259 PolarHBondContact O-N 2.85Å; C252-F259 HydrophobicContact CB-CE2 4.28Å; K257-F259 HydrophobicContact CB-CE2 3.84Å; K257-F259 HydrophobicContact CB-CZ 4.04Å; K257-F259 WeakPolarHBondContact O-CD2 3.42Å; K257-F259 VanDerWaalsContact O-CE2 3.25Å; K257-F259 WeakPolarHBondContact O-CE2 3.38Å; F259-N264 HydrophobicContact CB-CB 4.45Å; F259-N264 HydrophobicContact CD1-CB 3.92Å; F259-N264 HydrophobicContact CG-CB 4.44Å; F259-L265 HydrophobicContact CB-CB 4.4Å; F259-L265 HydrophobicContact CD2-CB 3.91Å; F259-L265 HydrophobicContact CD2-CD1 3.98Å; F259-L265 HydrophobicContact CE2-CD1 4.11Å; F259-L265 HydrophobicContact CG-CB 4.28Å; F259-H268 HydrophobicContact CE1-CB 3.93Å; F259-H268 HydrophobicContact CE2-CB 3.89Å; F259-H268 AromaticContact CE2-CD2 3.42Å; F259-H268 VanDerWaalsContact CE2-CD2 3.42Å; F259-H268 WeakPolarHBondContact CE2-CD2 3.38Å; F259-H268 AromaticContact CE2-CG 3.7Å; F259-H268 HydrophobicContact CZ-CB 3.41Å; F259-H268 VanDerWaalsContact CZ-CB 3.41Å; F259-H268 AromaticContact CZ-CD2 3.4Å; F259-H268 VanDerWaalsContact CZ-CD2 3.4Å; F259-H268 WeakPolarHBondContact CZ-CD2 3.4Å; F259-H268 AromaticContact CZ-CG 3.22Å; F259-H268 AromaticContact CZ-ND1 3.85Å
260	N	71.9	Confident	81.6	Confident	12 Å²	12	54 Å²	54	6%	0.064	30%	0.304	C	S	.	.	S	Bend	trans	-76	-24.4	174.8	67.2	-14.1	0	0	0	112.8	D32 R242 M248 Y250	D32-N260 VanDerWaalsContact CB-OD1 3.27Å; D32-N260 WeakPolarHBondContact CB-OD1 3.12Å; R242-N260 PolarHBondContact NH1-O 3.3Å; M248-N260 HydrophobicContact CG-CB 4.13Å; M248-N260 HydrophobicContact SD-CB 4.4Å; Y250-N260 WeakPolarHBondContact CD2-O 3.43Å; Y250-N260 WeakPolarHBondContact CE2-O 3.32Å
261	H	73.3	Confident	81.6	Confident	9 Å²	9	55.4 Å²	55.4	4%	0.042	32%	0.32	C	S	.	.	S	Bend	trans	-122.2	140.1	-178.9	-58.8	177.4	0	0	0	112.1	L31 Q239 S263 N264 L265	L31-H261 PolarHBondContact O-CE1 2.92Å; L31-H261 PolarHBondContact O-ND1 3.37Å; Q239-H261 PolarHBondContact NE2-CD2 3.06Å; Q239-H261 PolarHBondContact NE2-CE1 3.38Å; Q239-H261 PolarHBondContact NE2-NE2 2.9Å; H261-S263 PolarHBondContact O-N 3.16Å; H261-N264 HydrophobicContact CB-CB 4.38Å; H261-N264 PolarHBondContact O-N 3.31Å; H261-L265 PolarHBondContact O-N 2.88Å
262	S	75.9	Confident	81.5	Confident	55 Å²	55	53.3 Å²	53.3	39%	0.385	31%	0.311	S	S	.	.	H	α-helix	trans	-66.5	-34.7	177.4	54.5	0	0	0	0	113.4	Y250 N264 L265 I266	Y250-S262 VanDerWaalsContact CD2-N 3.32Å; S262-N264 PolarHBondContact O-N 3.24Å; S262-L265 PolarHBondContact O-N 3.18Å; S262-I266 WeakPolarHBondContact O-CG1 3.24Å; S262-I266 PolarHBondContact O-N 3.44Å
263	S	77.2	Confident	81.4	Confident	28 Å²	28	58 Å²	58	20%	0.196	34%	0.339	C	S	.	.	H	α-helix	trans	-53.8	-41.6	172.8	45.8	0	0	0	0	112.1	H261 I266 V267	H261-S263 PolarHBondContact O-N 3.16Å; S263-I266 PolarHBondContact O-N 2.87Å; S263-V267 WeakPolarHBondContact O-CB 3.31Å; S263-V267 WeakPolarHBondContact O-CG2 3.35Å; S263-V267 PolarHBondContact O-N 3.02Å
264	N	78.4	Confident	81.2	Confident	11 Å²	11	56.6 Å²	56.6	6%	0.059	33%	0.325	C	S	.	.	H	α-helix	trans	-76.8	-34.4	-173.3	-63.5	43.7	0	0	0	110	L30 D32 F259 H261 S262 H268	L30-N264 PolarHBondContact O-ND2 3.04Å; L30-N264 PolarHBondContact O-OD1 3.08Å; D32-N264 VanDerWaalsContact CB-ND2 3.29Å; D32-N264 WeakPolarHBondContact CB-ND2 3.24Å; D32-N264 PolarHBondContact N-ND2 3.24Å; D32-N264 PolarHBondContact OD2-ND2 3.13Å; F259-N264 HydrophobicContact CB-CB 4.45Å; F259-N264 HydrophobicContact CD1-CB 3.92Å; F259-N264 HydrophobicContact CG-CB 4.44Å; H261-N264 HydrophobicContact CB-CB 4.38Å; H261-N264 PolarHBondContact O-N 3.31Å; S262-N264 PolarHBondContact O-N 3.24Å; N264-H268 WeakPolarHBondContact O-CB 3.38Å; N264-H268 PolarHBondContact O-N 2.86Å
265	L	81.4	Confident	81.2	Confident	20 Å²	20	52.9 Å²	52.9	11%	0.105	31%	0.311	C	S	.	.	H	α-helix	trans	-61.4	-47.9	166.4	173.9	59.3	0	0	0	112.1	E251 C252 F259 H261 S262 V267 H268 Q269	E251-L265 WeakPolarHBondContact O-CD2 3.49Å; C252-L265 HydrophobicContact CB-CD1 3.54Å; F259-L265 HydrophobicContact CB-CB 4.4Å; F259-L265 HydrophobicContact CD2-CB 3.91Å; F259-L265 HydrophobicContact CD2-CD1 3.98Å; F259-L265 HydrophobicContact CE2-CD1 4.11Å; F259-L265 HydrophobicContact CG-CB 4.28Å; H261-L265 PolarHBondContact O-N 2.88Å; S262-L265 PolarHBondContact O-N 3.18Å; L265-V267 VanDerWaalsContact C-N 3.32Å; L265-V267 PolarHBondContact O-N 3.16Å; L265-H268 PolarHBondContact O-N 3.48Å; L265-H268 VanDerWaalsContact O-N 3.16Å; L265-Q269 HydrophobicContact CD1-CG 4.14Å; L265-Q269 VanDerWaalsContact O-CG 3.31Å; L265-Q269 WeakPolarHBondContact O-CG 3.46Å; L265-Q269 PolarHBondContact O-N 3.2Å
266	I	80.8	Confident	81.3	Confident	95 Å²	95	57.1 Å²	57.1	49%	0.487	32%	0.32	S	S	.	.	H	α-helix	trans	-61.2	-41.2	179.1	-68.9	163.8	0	0	0	111.4	S262 S263	S262-I266 WeakPolarHBondContact O-CG1 3.24Å; S262-I266 PolarHBondContact O-N 3.44Å; S263-I266 PolarHBondContact O-N 2.87Å
267	V	78.2	Confident	81.4	Confident	37 Å²	37	59 Å²	59	22%	0.224	33%	0.325	C	S	.	.	H	α-helix	trans	-67.8	-41.8	174.5	168.3	0	0	0	0	110.9	S263 L265 Q269 R270 H289	S263-V267 WeakPolarHBondContact O-CB 3.31Å; S263-V267 WeakPolarHBondContact O-CG2 3.35Å; S263-V267 PolarHBondContact O-N 3.02Å; L265-V267 VanDerWaalsContact C-N 3.32Å; L265-V267 PolarHBondContact O-N 3.16Å; V267-Q269 PolarHBondContact O-N 2.85Å; V267-R270 WeakPolarHBondContact O-CB 3.17Å; V267-R270 VanDerWaalsContact O-CG 3.31Å; V267-R270 WeakPolarHBondContact O-CG 3.14Å; V267-R270 PolarHBondContact O-N 2.98Å; V267-H289 WeakPolarHBondContact CG1-CE1 3.14Å; V267-H289 WeakPolarHBondContact CG1-NE2 3.43Å
268	H	81.5	Confident	81.7	Confident	25 Å²	25	56.5 Å²	56.5	12%	0.116	31%	0.313	C	S	.	.	H	α-helix	trans	-63.6	-38	177.4	173.3	60.4	0	0	0	113	C255 F259 N264 L265 R270 V271 H272	C255-H268 PolarHBondContact SG-NE2 2.83Å; F259-H268 HydrophobicContact CE1-CB 3.93Å; F259-H268 HydrophobicContact CE2-CB 3.89Å; F259-H268 AromaticContact CE2-CD2 3.42Å; F259-H268 VanDerWaalsContact CE2-CD2 3.42Å; F259-H268 WeakPolarHBondContact CE2-CD2 3.38Å; F259-H268 AromaticContact CE2-CG 3.7Å; F259-H268 HydrophobicContact CZ-CB 3.41Å; F259-H268 VanDerWaalsContact CZ-CB 3.41Å; F259-H268 AromaticContact CZ-CD2 3.4Å; F259-H268 VanDerWaalsContact CZ-CD2 3.4Å; F259-H268 WeakPolarHBondContact CZ-CD2 3.4Å; F259-H268 AromaticContact CZ-CG 3.22Å; F259-H268 AromaticContact CZ-ND1 3.85Å; N264-H268 WeakPolarHBondContact O-CB 3.38Å; N264-H268 PolarHBondContact O-N 2.86Å; L265-H268 PolarHBondContact O-N 3.48Å; L265-H268 VanDerWaalsContact O-N 3.16Å; H268-R270 PolarHBondContact O-N 3.37Å; H268-V271 VanDerWaalsContact O-CB 3.23Å; H268-V271 WeakPolarHBondContact O-CB 3.13Å; H268-V271 WeakPolarHBondContact O-CG2 3.42Å; H268-V271 PolarHBondContact O-N 3.17Å; H268-H272 AromaticContact CD2-NE2 3.27Å; H268-H272 PolarHBondContact CD2-NE2 2.82Å; H268-H272 VanDerWaalsContact CD2-NE2 3.27Å; H268-H272 AromaticContact CE1-NE2 3.24Å; H268-H272 PolarHBondContact CE1-NE2 2.76Å; H268-H272 AromaticContact NE2-CD2 3.94Å; H268-H272 AromaticContact NE2-NE2 2.4Å; H268-H272 PolarHBondContact NE2-NE2 3.26Å
269	Q	81	Confident	82.2	Confident	79 Å²	79	60.8 Å²	60.8	37%	0.369	33%	0.326	S	S	.	.	H	α-helix	trans	-56	-24.9	176	-76.4	168.2	-12.7	0	0	112.8	L265 V267 V271 H272 T273	L265-Q269 HydrophobicContact CD1-CG 4.14Å; L265-Q269 VanDerWaalsContact O-CG 3.31Å; L265-Q269 WeakPolarHBondContact O-CG 3.46Å; L265-Q269 PolarHBondContact O-N 3.2Å; V267-Q269 PolarHBondContact O-N 2.85Å; Q269-V271 PolarHBondContact O-N 3.48Å; Q269-H272 PolarHBondContact O-N 2.91Å; Q269-H272 VanDerWaalsContact O-N 3.07Å; Q269-T273 PolarHBondContact O-N 3.33Å; Q269-T273 VanDerWaalsContact O-N 3.08Å; Q269-T273 PolarHBondContact O-OG1 3.16Å
270	R	87.3	Confident	82.8	Confident	55 Å²	55	59.6 Å²	59.6	21%	0.208	32%	0.321	C	S	.	.	H	α-helix	trans	-62.1	-23.8	173	-55.8	177.2	-173.9	173	1.6	113.3	V267 H268 H272 T273 G274 A275 S288	V267-R270 WeakPolarHBondContact O-CB 3.17Å; V267-R270 VanDerWaalsContact O-CG 3.31Å; V267-R270 WeakPolarHBondContact O-CG 3.14Å; V267-R270 PolarHBondContact O-N 2.98Å; H268-R270 PolarHBondContact O-N 3.37Å; R270-H272 VanDerWaalsContact C-N 3.34Å; R270-T273 WeakPolarHBondContact CA-OG1 3.25Å; R270-G274 CarbonylContact O-C 3.54Å; R270-G274 VanDerWaalsContact O-CA 3.31Å; R270-G274 WeakPolarHBondContact O-CA 3.49Å; R270-G274 PolarHBondContact O-N 3.08Å; R270-A275 HydrophobicContact CB-CB 4.28Å; R270-A275 WeakPolarHBondContact CB-O 3.42Å; R270-A275 HydrophobicContact CG-CB 4.25Å; R270-A275 PolarHBondContact O-N 2.79Å; R270-S288 PolarHBondContact NH1-O 3.14Å
271	V	84.3	Confident	83.7	Confident	107 Å²	107	63.6 Å²	63.6	65%	0.648	35%	0.35	S	S	*	.	H	α-helix	trans	-68.7	-34.9	174	-178.5	0	0	0	0	111.2	H268 Q269	H268-V271 VanDerWaalsContact O-CB 3.23Å; H268-V271 WeakPolarHBondContact O-CB 3.13Å; H268-V271 WeakPolarHBondContact O-CG2 3.42Å; H268-V271 PolarHBondContact O-N 3.17Å; Q269-V271 PolarHBondContact O-N 3.48Å
272	H	86.7	Confident	84.4	Confident	79 Å²	79	69.7 Å²	69.7	37%	0.366	38%	0.378	S	S	.	.	H	α-helix	trans	-83.9	-40.3	179.8	-60	-57.6	0	0	0	112.5	C252 I254 C255 H268 Q269 R270 G274	C252-H272 VanDerWaalsContact SG-CD2 3.58Å; C252-H272 PolarHBondContact SG-NE2 2.98Å; I254-H272 HydrophobicContact CD1-CB 3.64Å; I254-H272 HydrophobicContact CG2-CB 4.22Å; C255-H272 WeakPolarHBondContact CB-CE1 3.48Å; C255-H272 PolarHBondContact SG-CE1 2.76Å; C255-H272 PolarHBondContact SG-NE2 3.2Å; H268-H272 AromaticContact CD2-NE2 3.27Å; H268-H272 PolarHBondContact CD2-NE2 2.82Å; H268-H272 VanDerWaalsContact CD2-NE2 3.27Å; H268-H272 AromaticContact CE1-NE2 3.24Å; H268-H272 PolarHBondContact CE1-NE2 2.76Å; H268-H272 AromaticContact NE2-CD2 3.94Å; H268-H272 AromaticContact NE2-NE2 2.4Å; H268-H272 PolarHBondContact NE2-NE2 3.26Å; Q269-H272 PolarHBondContact O-N 2.91Å; Q269-H272 VanDerWaalsContact O-N 3.07Å; R270-H272 VanDerWaalsContact C-N 3.34Å; H272-G274 VanDerWaalsContact C-N 3.32Å
273	T	87.1	Confident	85.1	Confident	100 Å²	100	69.3 Å²	69.3	61%	0.613	38%	0.375	S	S	*	.	H	α-helix	trans	-81.6	-10.7	179	58.3	0	0	0	0	113.6	Q269 R270 A275	Q269-T273 PolarHBondContact O-N 3.33Å; Q269-T273 VanDerWaalsContact O-N 3.08Å; Q269-T273 PolarHBondContact O-OG1 3.16Å; R270-T273 WeakPolarHBondContact CA-OG1 3.25Å; T273-A275 PolarHBondContact O-N 2.94Å; T273-A275 VanDerWaalsContact OG1-CB 3.29Å; T273-A275 WeakPolarHBondContact OG1-CB 3.4Å; T273-A275 PolarHBondContact OG1-N 3.17Å
274	G	85.9	Confident	85.6	Confident	51 Å²	51	70.5 Å²	70.5	53%	0.526	39%	0.392	S	S	.	.			trans	65.7	11.2	-170.4	0	0	0	0	0	113.9	R270 H272 R276	R270-G274 CarbonylContact O-C 3.54Å; R270-G274 VanDerWaalsContact O-CA 3.31Å; R270-G274 WeakPolarHBondContact O-CA 3.49Å; R270-G274 PolarHBondContact O-N 3.08Å; H272-G274 VanDerWaalsContact C-N 3.32Å; G274-R276 PolarHBondContact O-N 2.96Å
275	A	85.9	Confident	86	Confident	38 Å²	38	75.2 Å²	75.2	31%	0.314	41%	0.412	S	S	.	.			trans	-63.2	121	-173.6	0	0	0	0	0	111.8	R270 T273	R270-A275 HydrophobicContact CB-CB 4.28Å; R270-A275 WeakPolarHBondContact CB-O 3.42Å; R270-A275 HydrophobicContact CG-CB 4.25Å; R270-A275 PolarHBondContact O-N 2.79Å; T273-A275 PolarHBondContact O-N 2.94Å; T273-A275 VanDerWaalsContact OG1-CB 3.29Å; T273-A275 WeakPolarHBondContact OG1-CB 3.4Å; T273-A275 PolarHBondContact OG1-N 3.17Å
276	R	87.1	Confident	86.4	Confident	140 Å²	140	75.1 Å²	75.1	53%	0.528	41%	0.414	S	S	.	.			trans	-127.8	81	179.6	-70	173.3	118.7	-165	-9.6	109.2	G274 Y278 A286 Y287	G274-R276 PolarHBondContact O-N 2.96Å; R276-Y278 VanDerWaalsContact C-N 3.29Å; R276-Y278 PolarHBondContact O-N 3.42Å; R276-A286 HydrophobicContact CB-CB 3.51Å; R276-A286 PolarHBondContact NE-O 2.79Å; R276-A286 PolarHBondContact NH1-O 3.2Å; R276-A286 PolarHBondContact NH2-O 2.86Å; R276-A286 VanDerWaalsContact NH2-O 3.15Å; R276-Y287 CarbonylContact C-O 3.37Å; R276-Y287 VanDerWaalsContact C-O 3.24Å; R276-Y287 VanDerWaalsContact CA-O 3.24Å; R276-Y287 WeakPolarHBondContact CA-O 3.29Å
277	P	84.8	Confident	86.5	Confident	78 Å²	78	72.3 Å²	72.3	51%	0.506	40%	0.398	S	S	.	.			trans	-67.4	-28.3	-171.3	-21	34	0	0	0	113.7
278	Y	87.8	Confident	86.4	Confident	76 Å²	76	72.5 Å²	72.5	30%	0.298	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	104.1	-171.3	-52.1	-77.9	0	0	0	109.5	R276 A286 Y287 K290	R276-Y278 VanDerWaalsContact C-N 3.29Å; R276-Y278 PolarHBondContact O-N 3.42Å; Y278-A286 CarbonylContact O-C 3.57Å; Y278-A286 WeakPolarHBondContact O-CA 3.3Å; Y278-Y287 WeakPolarHBondContact CD2-O 3.4Å; Y278-Y287 PolarHBondContact N-O 3.33Å; Y278-Y287 PolarHBondContact O-N 3.2Å; Y278-K290 HydrophobicContact CD1-CB 3.86Å; Y278-K290 HydrophobicContact CD1-CG 4.24Å; Y278-K290 HydrophobicContact CE1-CB 3.72Å; Y278-K290 HydrophobicContact CE1-CG 4.31Å; Y278-K290 HydrophobicContact CG-CB 4.34Å
279	K	91	Very high	86.2	Confident	153 Å²	153	75 Å²	75	67%	0.665	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.7	134.2	-179.2	-64.9	-179.9	179.9	177.1	0	110.8	A286	K279-A286 HydrophobicContact CG-CB 3.92Å
280	C	90.8	Very high	86	Confident	3 Å²	3	77.4 Å²	77.4	2%	0.02	42%	0.422	C	S	.	.			trans	-72.7	130.8	169	178.3	0	0	0	0	110.2	G284 K285 L293 H300	C280-G284 VanDerWaalsContact O-CA 3.26Å; C280-G284 WeakPolarHBondContact O-CA 3.15Å; C280-G284 PolarHBondContact O-N 3.23Å; C280-K285 WeakPolarHBondContact CB-O 3.3Å; C280-K285 PolarHBondContact N-O 3.25Å; C280-L293 HydrophobicContact CB-CD1 3.57Å; C280-H300 PolarHBondContact SG-NE2 3.3Å
281	S	91	Very high	85.5	Confident	96 Å²	96	78 Å²	78	67%	0.671	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-49.3	173.8	52.1	0	0	0	0	111.6	C283	S281-C283 PolarHBondContact O-N 2.97Å
282	E	87.9	Confident	85.2	Confident	137 Å²	137	75.2 Å²	75.2	64%	0.64	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-37.9	-166.9	-59.1	-45.4	113	0	0	114.3	H300	E282-H300 HydrophobicContact CB-CB 4.4Å; E282-H300 HydrophobicContact CG-CB 4.14Å
283	C	90.2	Very high	85	Confident	47 Å²	47	72.2 Å²	72.2	32%	0.318	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.8	9.4	-175.3	72.9	0	0	0	0	114.8	S281 K285 H296 H300	S281-C283 PolarHBondContact O-N 2.97Å; C283-K285 PolarHBondContact O-N 3.32Å; C283-K285 VanDerWaalsContact SG-CG 3.59Å; C283-H296 PolarHBondContact SG-NE2 2.89Å; C283-H300 WeakPolarHBondContact CB-CE1 3.4Å; C283-H300 PolarHBondContact SG-CE1 3.12Å; C283-H300 PolarHBondContact SG-NE2 2.81Å
284	G	87.9	Confident	84.6	Confident	53 Å²	53	71.2 Å²	71.2	55%	0.546	40%	0.398	S	S	.	.			trans	65.7	0.3	177.5	0	0	0	0	0	115.9	C280 A286	C280-G284 VanDerWaalsContact O-CA 3.26Å; C280-G284 WeakPolarHBondContact O-CA 3.15Å; C280-G284 PolarHBondContact O-N 3.23Å; G284-A286 PolarHBondContact O-N 2.5Å
285	K	88.3	Confident	84	Confident	110 Å²	110	72.3 Å²	72.3	48%	0.478	39%	0.389	S	S	.	.			trans	-64	130.7	178.9	-73.3	176.9	-169	157.4	0	110.4	C280 C283 Y287	C280-K285 WeakPolarHBondContact CB-O 3.3Å; C280-K285 PolarHBondContact N-O 3.25Å; C283-K285 PolarHBondContact O-N 3.32Å; C283-K285 VanDerWaalsContact SG-CG 3.59Å; K285-Y287 HydrophobicContact CB-CE2 3.73Å; K285-Y287 WeakPolarHBondContact O-CE2 3.26Å
286	A	88.6	Confident	83.8	Confident	19 Å²	19	71 Å²	71	16%	0.157	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	146	-177.8	0	0	0	0	0	111.6	R276 Y278 K279 G284	R276-A286 HydrophobicContact CB-CB 3.51Å; R276-A286 PolarHBondContact NE-O 2.79Å; R276-A286 PolarHBondContact NH1-O 3.2Å; R276-A286 PolarHBondContact NH2-O 2.86Å; R276-A286 VanDerWaalsContact NH2-O 3.15Å; Y278-A286 CarbonylContact O-C 3.57Å; Y278-A286 WeakPolarHBondContact O-CA 3.3Å; K279-A286 HydrophobicContact CG-CB 3.92Å; G284-A286 PolarHBondContact O-N 2.5Å
287	Y	82.6	Confident	83.5	Confident	35 Å²	35	67.4 Å²	67.4	14%	0.137	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	151.5	-175.8	-62.7	-88.3	0	0	0	111.2	R276 Y278 K285 T292 L293 H296	R276-Y287 CarbonylContact C-O 3.37Å; R276-Y287 VanDerWaalsContact C-O 3.24Å; R276-Y287 VanDerWaalsContact CA-O 3.24Å; R276-Y287 WeakPolarHBondContact CA-O 3.29Å; Y278-Y287 WeakPolarHBondContact CD2-O 3.4Å; Y278-Y287 PolarHBondContact N-O 3.33Å; Y278-Y287 PolarHBondContact O-N 3.2Å; K285-Y287 HydrophobicContact CB-CE2 3.73Å; K285-Y287 WeakPolarHBondContact O-CE2 3.26Å; Y287-T292 HydrophobicContact CD1-CG2 3.55Å; Y287-T292 HydrophobicContact CE1-CG2 4.07Å; Y287-T292 HydrophobicContact CG-CG2 4.43Å; Y287-L293 HydrophobicContact CD2-CB 4.15Å; Y287-L293 HydrophobicContact CD2-CD1 3.93Å; Y287-L293 HydrophobicContact CE2-CD1 4.26Å; Y287-L293 HydrophobicContact CG-CB 4.45Å; Y287-H296 HydrophobicContact CE1-CB 4.26Å; Y287-H296 HydrophobicContact CE2-CB 3.96Å; Y287-H296 AromaticContact CE2-CD2 3.34Å; Y287-H296 WeakPolarHBondContact CE2-CD2 3.2Å; Y287-H296 AromaticContact CE2-CG 3.79Å; Y287-H296 AromaticContact CZ-CD2 3.5Å; Y287-H296 AromaticContact CZ-CG 3.53Å; Y287-H296 PolarHBondContact OH-CD2 3.14Å; Y287-H296 PolarHBondContact OH-ND1 3.28Å; Y287-H296 PolarHBondContact OH-NE2 3.3Å
288	S	76.9	Confident	83.2	Confident	42 Å²	42	64.7 Å²	64.7	29%	0.294	35%	0.348	S	S	.	.	S	Bend	trans	-83.2	-14.5	178.5	45	0	0	0	0	113.5	R270	R270-S288 PolarHBondContact NH1-O 3.14Å
289	H	77.4	Confident	82.8	Confident	76 Å²	76	66.6 Å²	66.6	35%	0.352	36%	0.363	S	S	.	.	S	Bend	trans	-131.8	148.3	176.8	-64.4	-114.2	0	0	0	111	V267 T292 L293	V267-H289 WeakPolarHBondContact CG1-CE1 3.14Å; V267-H289 WeakPolarHBondContact CG1-NE2 3.43Å; H289-T292 PolarHBondContact O-N 2.94Å; H289-L293 PolarHBondContact O-N 3.31Å
290	K	77.1	Confident	82.4	Confident	131 Å²	131	63.4 Å²	63.4	57%	0.57	35%	0.35	S	S	*	.	H	α-helix	trans	-64.3	-44.4	175.4	-170.8	-173.5	175.8	-168.9	0	111.7	Y278 T292 L293 V294	Y278-K290 HydrophobicContact CD1-CB 3.86Å; Y278-K290 HydrophobicContact CD1-CG 4.24Å; Y278-K290 HydrophobicContact CE1-CB 3.72Å; Y278-K290 HydrophobicContact CE1-CG 4.31Å; Y278-K290 HydrophobicContact CG-CB 4.34Å; K290-T292 VanDerWaalsContact C-N 3.26Å; K290-T292 PolarHBondContact O-N 3.32Å; K290-L293 WeakPolarHBondContact O-CA 3.26Å; K290-L293 WeakPolarHBondContact O-CB 3.32Å; K290-L293 PolarHBondContact O-N 2.96Å; K290-V294 HydrophobicContact CG-CG2 4.42Å; K290-V294 PolarHBondContact O-N 3.05Å
291	S	75.7	Confident	81.8	Confident	68 Å²	68	67.3 Å²	67.3	48%	0.476	37%	0.374	S	S	.	.	H	α-helix	trans	-57.6	-36.9	178.8	53.8	0	0	0	0	112.8	Q295	S291-Q295 WeakPolarHBondContact O-CB 3.33Å; S291-Q295 PolarHBondContact O-N 3.29Å
292	T	77.4	Confident	81	Confident	47 Å²	47	65.2 Å²	65.2	29%	0.288	37%	0.367	S	S	.	.	H	α-helix	trans	-72.5	-26.7	174.8	-38.2	0	0	0	0	113.2	Y287 H289 K290 H296	Y287-T292 HydrophobicContact CD1-CG2 3.55Å; Y287-T292 HydrophobicContact CE1-CG2 4.07Å; Y287-T292 HydrophobicContact CG-CG2 4.43Å; H289-T292 PolarHBondContact O-N 2.94Å; K290-T292 VanDerWaalsContact C-N 3.26Å; K290-T292 PolarHBondContact O-N 3.32Å; T292-H296 VanDerWaalsContact O-CB 3.32Å; T292-H296 WeakPolarHBondContact O-CB 3.2Å; T292-H296 PolarHBondContact O-N 3.13Å; T292-H296 VanDerWaalsContact O-N 3.11Å
293	L	82.5	Confident	80.3	Confident	17 Å²	17	64.1 Å²	64.1	9%	0.089	36%	0.362	C	S	.	.	H	α-helix	trans	-70.6	-52	171.4	171.8	61.5	0	0	0	110.6	C280 Y287 H289 K290 Q295 H296 E297	C280-L293 HydrophobicContact CB-CD1 3.57Å; Y287-L293 HydrophobicContact CD2-CB 4.15Å; Y287-L293 HydrophobicContact CD2-CD1 3.93Å; Y287-L293 HydrophobicContact CE2-CD1 4.26Å; Y287-L293 HydrophobicContact CG-CB 4.45Å; H289-L293 PolarHBondContact O-N 3.31Å; K290-L293 WeakPolarHBondContact O-CA 3.26Å; K290-L293 WeakPolarHBondContact O-CB 3.32Å; K290-L293 PolarHBondContact O-N 2.96Å; L293-Q295 VanDerWaalsContact C-N 3.27Å; L293-Q295 PolarHBondContact O-N 3.03Å; L293-H296 CarbonylContact O-C 3.56Å; L293-H296 WeakPolarHBondContact O-CA 3.31Å; L293-H296 VanDerWaalsContact O-CB 3.31Å; L293-H296 WeakPolarHBondContact O-CB 3.23Å; L293-H296 PolarHBondContact O-N 3.22Å; L293-E297 HydrophobicContact CD1-CG 4.09Å; L293-E297 WeakPolarHBondContact CD1-OE1 3.26Å; L293-E297 HydrophobicContact CG-CG 4.46Å; L293-E297 WeakPolarHBondContact CG-OE1 3.18Å; L293-E297 WeakPolarHBondContact O-CG 3.3Å; L293-E297 PolarHBondContact O-N 3.17Å
294	V	79.8	Confident	79.4	Confident	79 Å²	79	69.1 Å²	69.1	48%	0.479	37%	0.374	S	S	.	.	H	α-helix	trans	-57.2	-43.2	177	177.3	0	0	0	0	110.8	K290 H296 E297 S298	K290-V294 HydrophobicContact CG-CG2 4.42Å; K290-V294 PolarHBondContact O-N 3.05Å; V294-H296 PolarHBondContact O-N 3.43Å; V294-E297 WeakPolarHBondContact CA-OE2 3.46Å; V294-E297 PolarHBondContact O-N 3.5Å; V294-S298 PolarHBondContact O-N 3.24Å
295	Q	73.3	Confident	78.8	Confident	74 Å²	74	70.9 Å²	70.9	35%	0.346	38%	0.376	S	S	.	.	H	α-helix	trans	-61.3	-29.6	173.1	-177.5	179.9	64.5	0	0	113.7	S291 L293 H317	S291-Q295 WeakPolarHBondContact O-CB 3.33Å; S291-Q295 PolarHBondContact O-N 3.29Å; L293-Q295 VanDerWaalsContact C-N 3.27Å; L293-Q295 PolarHBondContact O-N 3.03Å; Q295-H317 WeakPolarHBondContact CG-CE1 3.2Å
296	H	81.4	Confident	78.3	Confident	11 Å²	11	69.4 Å²	69.4	5%	0.051	37%	0.368	C	S	.	.	H	α-helix	trans	-80.1	-35.8	176.5	171.5	43	0	0	0	112	C283 Y287 T292 L293 V294 S298 I299 H300	C283-H296 PolarHBondContact SG-NE2 2.89Å; Y287-H296 HydrophobicContact CE1-CB 4.26Å; Y287-H296 HydrophobicContact CE2-CB 3.96Å; Y287-H296 AromaticContact CE2-CD2 3.34Å; Y287-H296 WeakPolarHBondContact CE2-CD2 3.2Å; Y287-H296 AromaticContact CE2-CG 3.79Å; Y287-H296 AromaticContact CZ-CD2 3.5Å; Y287-H296 AromaticContact CZ-CG 3.53Å; Y287-H296 PolarHBondContact OH-CD2 3.14Å; Y287-H296 PolarHBondContact OH-ND1 3.28Å; Y287-H296 PolarHBondContact OH-NE2 3.3Å; T292-H296 VanDerWaalsContact O-CB 3.32Å; T292-H296 WeakPolarHBondContact O-CB 3.2Å; T292-H296 PolarHBondContact O-N 3.13Å; T292-H296 VanDerWaalsContact O-N 3.11Å; L293-H296 CarbonylContact O-C 3.56Å; L293-H296 WeakPolarHBondContact O-CA 3.31Å; L293-H296 VanDerWaalsContact O-CB 3.31Å; L293-H296 WeakPolarHBondContact O-CB 3.23Å; L293-H296 PolarHBondContact O-N 3.22Å; V294-H296 PolarHBondContact O-N 3.43Å; H296-S298 PolarHBondContact O-N 3.23Å; H296-I299 VanDerWaalsContact O-CB 3.24Å; H296-I299 WeakPolarHBondContact O-CB 3.29Å; H296-I299 PolarHBondContact O-N 3.3Å; H296-H300 AromaticContact CD2-NE2 3.18Å; H296-H300 PolarHBondContact CD2-NE2 3.41Å; H296-H300 AromaticContact CE1-NE2 2.66Å; H296-H300 PolarHBondContact CE1-NE2 3.31Å; H296-H300 AromaticContact CG-NE2 3.97Å; H296-H300 AromaticContact ND1-NE2 3.7Å; H296-H300 AromaticContact NE2-CD2 3.96Å; H296-H300 AromaticContact NE2-NE2 2.23Å; H296-H300 PolarHBondContact NE2-NE2 3.14Å
297	E	80.9	Confident	77.8	Confident	63 Å²	63	72.4 Å²	72.4	29%	0.294	38%	0.379	S	S	.	.	H	α-helix	trans	-60.7	-30.8	-179.3	-74	161.8	164.7	0	0	112	L293 V294 I299 H300 T301	L293-E297 HydrophobicContact CD1-CG 4.09Å; L293-E297 WeakPolarHBondContact CD1-OE1 3.26Å; L293-E297 HydrophobicContact CG-CG 4.46Å; L293-E297 WeakPolarHBondContact CG-OE1 3.18Å; L293-E297 WeakPolarHBondContact O-CG 3.3Å; L293-E297 PolarHBondContact O-N 3.17Å; V294-E297 WeakPolarHBondContact CA-OE2 3.46Å; V294-E297 PolarHBondContact O-N 3.5Å; E297-I299 PolarHBondContact O-N 3.35Å; E297-H300 PolarHBondContact O-N 2.77Å; E297-T301 PolarHBondContact O-N 3.16Å; E297-T301 VanDerWaalsContact O-N 3.16Å
298	S	78.9	Confident	77.7	Confident	21 Å²	21	70.7 Å²	70.7	15%	0.147	37%	0.372	C	S	.	.	H	α-helix	trans	-62.2	-14.4	172.1	99.5	0	0	0	0	114.7	V294 H296 T301 G302 E303	V294-S298 PolarHBondContact O-N 3.24Å; H296-S298 PolarHBondContact O-N 3.23Å; S298-T301 WeakPolarHBondContact CA-OG1 3.13Å; S298-G302 CarbonylContact O-C 3.5Å; S298-G302 PolarHBondContact O-N 3.33Å; S298-E303 PolarHBondContact O-N 2.81Å
299	I	79.9	Confident	77.7	Confident	116 Å²	116	71.9 Å²	71.9	60%	0.595	38%	0.381	S	S	*	.	H	α-helix	trans	-77.7	-26.5	172.5	-61.7	169.3	0	0	0	111	H296 E297	H296-I299 VanDerWaalsContact O-CB 3.24Å; H296-I299 WeakPolarHBondContact O-CB 3.29Å; H296-I299 PolarHBondContact O-N 3.3Å; E297-I299 PolarHBondContact O-N 3.35Å
300	H	80.8	Confident	77.6	Confident	86 Å²	86	74 Å²	74	40%	0.398	39%	0.391	S	S	.	.	H	α-helix	trans	-87.9	-39.9	178.2	-60.5	-64.3	0	0	0	112	C280 E282 C283 H296 E297 G302	C280-H300 PolarHBondContact SG-NE2 3.3Å; E282-H300 HydrophobicContact CB-CB 4.4Å; E282-H300 HydrophobicContact CG-CB 4.14Å; C283-H300 WeakPolarHBondContact CB-CE1 3.4Å; C283-H300 PolarHBondContact SG-CE1 3.12Å; C283-H300 PolarHBondContact SG-NE2 2.81Å; H296-H300 AromaticContact CD2-NE2 3.18Å; H296-H300 PolarHBondContact CD2-NE2 3.41Å; H296-H300 AromaticContact CE1-NE2 2.66Å; H296-H300 PolarHBondContact CE1-NE2 3.31Å; H296-H300 AromaticContact CG-NE2 3.97Å; H296-H300 AromaticContact ND1-NE2 3.7Å; H296-H300 AromaticContact NE2-CD2 3.96Å; H296-H300 AromaticContact NE2-NE2 2.23Å; H296-H300 PolarHBondContact NE2-NE2 3.14Å; E297-H300 PolarHBondContact O-N 2.77Å; H300-G302 PolarHBondContact O-N 3.27Å
301	T	79.3	Confident	77.8	Confident	85 Å²	85	69.9 Å²	69.9	52%	0.521	38%	0.378	S	S	.	.	H	α-helix	trans	-69.2	-19.4	172.4	62.6	0	0	0	0	112.1	E297 S298 E303	E297-T301 PolarHBondContact O-N 3.16Å; E297-T301 VanDerWaalsContact O-N 3.16Å; S298-T301 WeakPolarHBondContact CA-OG1 3.13Å; T301-E303 WeakPolarHBondContact CB-OE2 3.46Å; T301-E303 PolarHBondContact O-N 3.28Å; T301-E303 WeakPolarHBondContact OG1-CB 3.43Å; T301-E303 VanDerWaalsContact OG1-CD 3.26Å; T301-E303 VanDerWaalsContact OG1-CG 3.27Å; T301-E303 WeakPolarHBondContact OG1-CG 3.45Å; T301-E303 PolarHBondContact OG1-N 2.92Å; T301-E303 PolarHBondContact OG1-OE2 3.22Å
302	G	73.3	Confident	77.8	Confident	52 Å²	52	68.3 Å²	68.3	54%	0.536	37%	0.372	S	S	.	.			trans	74.7	-0.6	-173.5	0	0	0	0	0	113.4	S298 H300 R304	S298-G302 CarbonylContact O-C 3.5Å; S298-G302 PolarHBondContact O-N 3.33Å; H300-G302 PolarHBondContact O-N 3.27Å; G302-R304 PolarHBondContact O-N 3.1Å
303	E	74.1	Confident	77.8	Confident	115 Å²	115	71.2 Å²	71.2	54%	0.537	38%	0.381	S	S	.	.			trans	-59.7	124.8	-179	-71.3	165.6	150.8	0	0	110.9	S298 T301 P305	S298-E303 PolarHBondContact O-N 2.81Å; T301-E303 WeakPolarHBondContact CB-OE2 3.46Å; T301-E303 PolarHBondContact O-N 3.28Å; T301-E303 WeakPolarHBondContact OG1-CB 3.43Å; T301-E303 VanDerWaalsContact OG1-CD 3.26Å; T301-E303 VanDerWaalsContact OG1-CG 3.27Å; T301-E303 WeakPolarHBondContact OG1-CG 3.45Å; T301-E303 PolarHBondContact OG1-N 2.92Å; T301-E303 PolarHBondContact OG1-OE2 3.22Å; E303-P305 HydrophobicContact CB-CG 4.47Å
304	R	72.3	Confident	77.6	Confident	151 Å²	151	75.8 Å²	75.8	57%	0.57	40%	0.398	S	S	*	.			trans	-129.7	75.8	172.2	-68	179	169.9	-152.3	11.6	108.2	G302 Y306 Y314 F315	G302-R304 PolarHBondContact O-N 3.1Å; R304-Y306 PolarHBondContact O-N 2.87Å; R304-Y314 WeakPolarHBondContact CD-O 3.44Å; R304-Y314 PolarHBondContact NH1-O 2.82Å; R304-Y314 WeakPolarHBondContact O-CD1 3.17Å; R304-F315 CarbonylContact C-O 3.59Å; R304-F315 WeakPolarHBondContact CA-O 3.35Å
305	P	74.4	Confident	77.5	Confident	91 Å²	91	73.9 Å²	73.9	59%	0.591	38%	0.383	S	S	*	.			trans	-65.3	-6.2	-167.7	-22.2	34.8	0	0	0	114.9	E303	E303-P305 HydrophobicContact CB-CG 4.47Å
306	Y	77.6	Confident	77.4	Confident	78 Å²	78	71.2 Å²	71.2	31%	0.306	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	96.7	-170.8	-51.2	-67	0	0	0	110.2	R304 Y314 F315 H317 K318	R304-Y306 PolarHBondContact O-N 2.87Å; Y306-Y314 CarbonylContact O-C 3.15Å; Y306-Y314 WeakPolarHBondContact O-CA 3.36Å; Y306-F315 WeakPolarHBondContact CD2-O 3.37Å; Y306-F315 PolarHBondContact N-O 2.85Å; Y306-F315 PolarHBondContact O-N 3.18Å; Y306-H317 VanDerWaalsContact CD2-C 3.44Å; Y306-K318 HydrophobicContact CD1-CB 3.97Å; Y306-K318 HydrophobicContact CD1-CD 4.12Å; Y306-K318 HydrophobicContact CD1-CG 4.23Å; Y306-K318 HydrophobicContact CD2-CB 4.21Å; Y306-K318 HydrophobicContact CE1-CB 3.84Å; Y306-K318 HydrophobicContact CE1-CD 3.55Å; Y306-K318 HydrophobicContact CE1-CG 4.1Å; Y306-K318 HydrophobicContact CE2-CB 4.04Å; Y306-K318 HydrophobicContact CG-CB 4.15Å
307	E	78.1	Confident	76.9	Confident	82 Å²	82	71.6 Å²	71.6	38%	0.383	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	147.8	176.2	-169	171.3	168.6	0	0	112.2	Y314 L321	E307-Y314 HydrophobicContact CB-CD1 3.77Å; E307-Y314 HydrophobicContact CB-CE1 3.6Å; E307-Y314 VanDerWaalsContact CD-CE1 3.49Å; E307-Y314 HydrophobicContact CG-CD1 4.01Å; E307-Y314 HydrophobicContact CG-CE1 3.63Å; E307-Y314 PolarHBondContact OE1-OH 3.4Å; E307-Y314 WeakPolarHBondContact OE2-CE1 3.45Å; E307-Y314 PolarHBondContact OE2-OH 3.28Å; E307-L321 WeakPolarHBondContact O-CD1 3.39Å; E307-L321 WeakPolarHBondContact O-CD2 3.46Å
308	C	80.4	Confident	76.2	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	107.9	167.2	-177.4	0	0	0	0	110	E310 C311 G312 K313 F315 L321 H328	C308-E310 PolarHBondContact O-N 3.33Å; C308-E310 VanDerWaalsContact O-N 3.16Å; C308-C311 PolarHBondContact O-N 2.75Å; C308-G312 PolarHBondContact O-N 2.62Å; C308-K313 HydrophobicContact CB-CB 4.39Å; C308-K313 PolarHBondContact N-O 3.34Å; C308-F315 HydrophobicContact CB-CE2 4.18Å; C308-L321 HydrophobicContact CB-CD1 3.51Å; C308-H328 VanDerWaalsContact SG-CD2 3.58Å; C308-H328 PolarHBondContact SG-NE2 3.46Å
309	S	78.1	Confident	75.8	Confident	67 Å²	67	72.8 Å²	72.8	47%	0.469	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-38	179.2	51.6	0	0	0	0	113.4	C311 W325	S309-C311 VanDerWaalsContact C-N 3.3Å; S309-C311 PolarHBondContact O-N 3.17Å; S309-W325 WeakPolarHBondContact OG-CH2 3.38Å; S309-W325 VanDerWaalsContact OG-CZ2 3.24Å; S309-W325 WeakPolarHBondContact OG-CZ2 3.38Å
310	E	74.6	Confident	75.7	Confident	119 Å²	119	72.9 Å²	72.9	56%	0.556	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-18.9	-178.3	-63.1	-55.2	122.9	0	0	114.8	C308 W325 H328	C308-E310 PolarHBondContact O-N 3.33Å; C308-E310 VanDerWaalsContact O-N 3.16Å; E310-W325 HydrophobicContact CG-CE3 4.31Å; E310-W325 HydrophobicContact CG-CH2 4.42Å; E310-W325 HydrophobicContact CG-CZ3 3.99Å; E310-H328 HydrophobicContact CB-CB 4.36Å; E310-H328 HydrophobicContact CG-CB 4.21Å
311	C	81.3	Confident	75.5	Confident	45 Å²	45	69.1 Å²	69.1	30%	0.304	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-153	13.9	-175.8	68.7	0	0	0	0	116.8	C308 S309 K313 H324 H328	C308-C311 PolarHBondContact O-N 2.75Å; S309-C311 VanDerWaalsContact C-N 3.3Å; S309-C311 PolarHBondContact O-N 3.17Å; C311-K313 PolarHBondContact O-N 2.89Å; C311-K313 VanDerWaalsContact O-N 3.1Å; C311-H324 PolarHBondContact SG-NE2 3.15Å; C311-H328 WeakPolarHBondContact CB-CE1 3.27Å; C311-H328 PolarHBondContact SG-CE1 3.36Å; C311-H328 PolarHBondContact SG-NE2 3.39Å
312	G	76.5	Confident	75.3	Confident	35 Å²	35	65.3 Å²	65.3	36%	0.361	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.8	19.2	178.5	0	0	0	0	0	114.6	C308 Y314	C308-G312 PolarHBondContact O-N 2.62Å; G312-Y314 WeakPolarHBondContact O-CD2 3.47Å
313	K	77	Confident	75.3	Confident	108 Å²	108	66.7 Å²	66.7	47%	0.47	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	118	-178	-76.8	178.9	-170.1	150.3	0	110.8	C308 C311 F315	C308-K313 HydrophobicContact CB-CB 4.39Å; C308-K313 PolarHBondContact N-O 3.34Å; C311-K313 PolarHBondContact O-N 2.89Å; C311-K313 VanDerWaalsContact O-N 3.1Å; K313-F315 HydrophobicContact CB-CE2 3.72Å; K313-F315 HydrophobicContact CB-CZ 4.08Å; K313-F315 WeakPolarHBondContact O-CD2 3.37Å; K313-F315 WeakPolarHBondContact O-CE2 3.23Å
314	Y	78.1	Confident	75.7	Confident	114 Å²	114	62.4 Å²	62.4	45%	0.447	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	138.1	174.8	-60.7	-85.1	0	0	0	112.9	R304 Y306 E307 G312	R304-Y314 WeakPolarHBondContact CD-O 3.44Å; R304-Y314 PolarHBondContact NH1-O 2.82Å; R304-Y314 WeakPolarHBondContact O-CD1 3.17Å; Y306-Y314 CarbonylContact O-C 3.15Å; Y306-Y314 WeakPolarHBondContact O-CA 3.36Å; E307-Y314 HydrophobicContact CB-CD1 3.77Å; E307-Y314 HydrophobicContact CB-CE1 3.6Å; E307-Y314 VanDerWaalsContact CD-CE1 3.49Å; E307-Y314 HydrophobicContact CG-CD1 4.01Å; E307-Y314 HydrophobicContact CG-CE1 3.63Å; E307-Y314 PolarHBondContact OE1-OH 3.4Å; E307-Y314 WeakPolarHBondContact OE2-CE1 3.45Å; E307-Y314 PolarHBondContact OE2-OH 3.28Å; G312-Y314 WeakPolarHBondContact O-CD2 3.47Å
315	F	77	Confident	75.6	Confident	38 Å²	38	55.5 Å²	55.5	17%	0.167	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	139.2	178	-64.2	-91.8	0	0	0	110.9	R304 Y306 C308 K313 H317 R320 L321 H324	R304-F315 CarbonylContact C-O 3.59Å; R304-F315 WeakPolarHBondContact CA-O 3.35Å; Y306-F315 WeakPolarHBondContact CD2-O 3.37Å; Y306-F315 PolarHBondContact N-O 2.85Å; Y306-F315 PolarHBondContact O-N 3.18Å; C308-F315 HydrophobicContact CB-CE2 4.18Å; K313-F315 HydrophobicContact CB-CE2 3.72Å; K313-F315 HydrophobicContact CB-CZ 4.08Å; K313-F315 WeakPolarHBondContact O-CD2 3.37Å; K313-F315 WeakPolarHBondContact O-CE2 3.23Å; F315-H317 PolarHBondContact O-N 2.84Å; F315-R320 HydrophobicContact CB-CB 4.46Å; F315-R320 HydrophobicContact CD1-CB 3.86Å; F315-R320 HydrophobicContact CG-CB 4.47Å; F315-L321 HydrophobicContact CB-CB 4.26Å; F315-L321 HydrophobicContact CD2-CB 4.02Å; F315-L321 HydrophobicContact CD2-CD1 3.77Å; F315-L321 HydrophobicContact CE2-CD1 4.02Å; F315-L321 HydrophobicContact CG-CB 4.21Å; F315-H324 HydrophobicContact CE1-CB 3.91Å; F315-H324 HydrophobicContact CE2-CB 4.07Å; F315-H324 AromaticContact CE2-CD2 3.33Å; F315-H324 WeakPolarHBondContact CE2-CD2 3.25Å; F315-H324 AromaticContact CE2-CG 3.85Å; F315-H324 HydrophobicContact CZ-CB 3.52Å; F315-H324 AromaticContact CZ-CD2 3.2Å; F315-H324 WeakPolarHBondContact CZ-CD2 3.48Å; F315-H324 AromaticContact CZ-CG 3.3Å; F315-H324 AromaticContact CZ-NE2 3.95Å
316	G	71.2	Confident	75.7	Confident	18 Å²	18	51.7 Å²	51.7	19%	0.186	25%	0.25	C	C	.	.	S	Bend	trans	-70.4	-15.6	173.2	0	0	0	0	0	113.8
317	H	70.6	Confident	75.7	Confident	20 Å²	20	52.8 Å²	52.8	9%	0.093	26%	0.264	C	S	.	.	S	Bend	trans	-139.9	133.7	178.7	-37.6	-39.1	0	0	0	111.8	Q295 Y306 F315 Y319 R320 L321	Q295-H317 WeakPolarHBondContact CG-CE1 3.2Å; Y306-H317 VanDerWaalsContact CD2-C 3.44Å; F315-H317 PolarHBondContact O-N 2.84Å; H317-Y319 HydrophobicContact CB-CD1 3.62Å; H317-Y319 HydrophobicContact CB-CE1 3.62Å; H317-Y319 AromaticContact CD2-CE1 3.52Å; H317-Y319 AromaticContact CG-CE1 3.85Å; H317-Y319 PolarHBondContact O-N 3.03Å; H317-R320 HydrophobicContact CB-CG 4.35Å; H317-R320 PolarHBondContact CD2-NE 3.4Å; H317-R320 PolarHBondContact CD2-NH2 3.45Å; H317-R320 PolarHBondContact NE2-NH2 2.79Å; H317-R320 VanDerWaalsContact NE2-NH2 3.2Å; H317-R320 WeakPolarHBondContact O-CA 3.49Å; H317-R320 WeakPolarHBondContact O-CB 3.16Å; H317-R320 PolarHBondContact O-N 3.08Å; H317-L321 PolarHBondContact O-N 2.96Å
318	K	67.1	Low	75.6	Confident	19 Å²	19	52.6 Å²	52.6	8%	0.083	26%	0.263	C	S	.	.	H	α-helix	trans	-46.3	-49	173.6	-166.2	149.6	153.9	157.1	0	114.2	E17 D18 V19 F20 Y306 R320 L321 I322	E17-K318 PolarHBondContact O-NZ 3.39Å; D18-K318 WeakPolarHBondContact O-CD 3.27Å; D18-K318 WeakPolarHBondContact O-CE 3.34Å; D18-K318 WeakPolarHBondContact O-CG 2.98Å; D18-K318 PolarHBondContact O-NZ 3.15Å; D18-K318 VanDerWaalsContact O-NZ 3.11Å; V19-K318 VanDerWaalsContact CA-CE 3.41Å; V19-K318 VanDerWaalsContact O-CE 3.23Å; V19-K318 WeakPolarHBondContact O-CE 3.38Å; F20-K318 VanDerWaalsContact N-CE 3.27Å; F20-K318 WeakPolarHBondContact O-CE 3.26Å; F20-K318 PolarHBondContact O-NZ 2.9Å; Y306-K318 HydrophobicContact CD1-CB 3.97Å; Y306-K318 HydrophobicContact CD1-CD 4.12Å; Y306-K318 HydrophobicContact CD1-CG 4.23Å; Y306-K318 HydrophobicContact CD2-CB 4.21Å; Y306-K318 HydrophobicContact CE1-CB 3.84Å; Y306-K318 HydrophobicContact CE1-CD 3.55Å; Y306-K318 HydrophobicContact CE1-CG 4.1Å; Y306-K318 HydrophobicContact CE2-CB 4.04Å; Y306-K318 HydrophobicContact CG-CB 4.15Å; K318-R320 PolarHBondContact O-N 3.44Å; K318-R320 VanDerWaalsContact O-N 3.16Å; K318-L321 WeakPolarHBondContact O-CB 3.48Å; K318-L321 PolarHBondContact O-N 2.86Å; K318-L321 VanDerWaalsContact O-N 3.08Å; K318-I322 HydrophobicContact CG-CD1 4.18Å; K318-I322 WeakPolarHBondContact O-CD1 3.47Å; K318-I322 WeakPolarHBondContact O-CG1 2.86Å; K318-I322 PolarHBondContact O-N 2.92Å
319	Y	71.3	Confident	75.3	Confident	89 Å²	89	55 Å²	55	35%	0.349	28%	0.279	S	S	.	.	H	α-helix	trans	-61.8	-26	175.9	88.1	-93.2	0	0	0	113.8	H317 K323	H317-Y319 HydrophobicContact CB-CD1 3.62Å; H317-Y319 HydrophobicContact CB-CE1 3.62Å; H317-Y319 AromaticContact CD2-CE1 3.52Å; H317-Y319 AromaticContact CG-CE1 3.85Å; H317-Y319 PolarHBondContact O-N 3.03Å; Y319-K323 HydrophobicContact CD2-CD 4.32Å; Y319-K323 WeakPolarHBondContact O-CB 3.44Å; Y319-K323 VanDerWaalsContact O-CG 3.3Å; Y319-K323 WeakPolarHBondContact O-CG 3.43Å; Y319-K323 PolarHBondContact O-N 2.87Å
320	R	77.4	Confident	75.1	Confident	119 Å²	119	54.1 Å²	54.1	45%	0.449	28%	0.28	S	S	.	.	H	α-helix	trans	-80.7	-34.3	175.3	-64.5	-171.3	-176.2	155.6	12.2	111.7	F315 H317 K318 H324	F315-R320 HydrophobicContact CB-CB 4.46Å; F315-R320 HydrophobicContact CD1-CB 3.86Å; F315-R320 HydrophobicContact CG-CB 4.47Å; H317-R320 HydrophobicContact CB-CG 4.35Å; H317-R320 PolarHBondContact CD2-NE 3.4Å; H317-R320 PolarHBondContact CD2-NH2 3.45Å; H317-R320 PolarHBondContact NE2-NH2 2.79Å; H317-R320 VanDerWaalsContact NE2-NH2 3.2Å; H317-R320 WeakPolarHBondContact O-CA 3.49Å; H317-R320 WeakPolarHBondContact O-CB 3.16Å; H317-R320 PolarHBondContact O-N 3.08Å; K318-R320 PolarHBondContact O-N 3.44Å; K318-R320 VanDerWaalsContact O-N 3.16Å; R320-H324 VanDerWaalsContact O-CB 3.26Å; R320-H324 WeakPolarHBondContact O-CB 3.41Å; R320-H324 PolarHBondContact O-N 2.93Å
321	L	76.5	Confident	75	Confident	7 Å²	7	49.4 Å²	49.4	4%	0.037	26%	0.261	C	S	.	.	H	α-helix	trans	-59	-53.7	169.1	173	62	0	0	0	109.3	E307 C308 F315 H317 K318 K323 H324 W325	E307-L321 WeakPolarHBondContact O-CD1 3.39Å; E307-L321 WeakPolarHBondContact O-CD2 3.46Å; C308-L321 HydrophobicContact CB-CD1 3.51Å; F315-L321 HydrophobicContact CB-CB 4.26Å; F315-L321 HydrophobicContact CD2-CB 4.02Å; F315-L321 HydrophobicContact CD2-CD1 3.77Å; F315-L321 HydrophobicContact CE2-CD1 4.02Å; F315-L321 HydrophobicContact CG-CB 4.21Å; H317-L321 PolarHBondContact O-N 2.96Å; K318-L321 WeakPolarHBondContact O-CB 3.48Å; K318-L321 PolarHBondContact O-N 2.86Å; K318-L321 VanDerWaalsContact O-N 3.08Å; L321-K323 VanDerWaalsContact C-N 3.34Å; L321-K323 PolarHBondContact O-N 2.87Å; L321-H324 CarbonylContact O-C 3.6Å; L321-H324 VanDerWaalsContact O-CA 3.29Å; L321-H324 WeakPolarHBondContact O-CA 3.47Å; L321-H324 VanDerWaalsContact O-CB 3.23Å; L321-H324 WeakPolarHBondContact O-CB 3.38Å; L321-H324 PolarHBondContact O-N 3.33Å; L321-W325 VanDerWaalsContact O-CD1 3.28Å; L321-W325 PolarHBondContact O-N 3.06Å
322	I	74.3	Confident	74.7	Confident	5 Å²	5	53.9 Å²	53.9	3%	0.026	27%	0.272	C	S	.	.	H	α-helix	trans	-62.8	-40.8	-176	-56.2	147.9	0	0	0	111.6	V19 N46 L49 K318 H324 W325	V19-I322 HydrophobicContact CB-CD1 4.32Å; V19-I322 HydrophobicContact CG1-CD1 3.7Å; V19-I322 HydrophobicContact CG1-CG1 4.2Å; V19-I322 HydrophobicContact CG2-CD1 4.49Å; V19-I322 HydrophobicContact CG2-CG1 4.43Å; N46-I322 HydrophobicContact CB-CD1 4.19Å; N46-I322 HydrophobicContact CB-CG2 3.86Å; N46-I322 WeakPolarHBondContact OD1-CG2 3.24Å; L49-I322 HydrophobicContact CD1-CG2 4.02Å; K318-I322 HydrophobicContact CG-CD1 4.18Å; K318-I322 WeakPolarHBondContact O-CD1 3.47Å; K318-I322 WeakPolarHBondContact O-CG1 2.86Å; K318-I322 PolarHBondContact O-N 2.92Å; I322-H324 PolarHBondContact O-N 2.83Å; I322-W325 PolarHBondContact O-N 2.79Å
323	K	74.4	Confident	74.5	Confident	81 Å²	81	55.9 Å²	55.9	35%	0.352	28%	0.278	S	S	.	.	H	α-helix	trans	-65.4	-21.5	169.9	-73.6	-174.4	177.5	-163.2	0	114.4	Y319 L321 S326	Y319-K323 HydrophobicContact CD2-CD 4.32Å; Y319-K323 WeakPolarHBondContact O-CB 3.44Å; Y319-K323 VanDerWaalsContact O-CG 3.3Å; Y319-K323 WeakPolarHBondContact O-CG 3.43Å; Y319-K323 PolarHBondContact O-N 2.87Å; L321-K323 VanDerWaalsContact C-N 3.34Å; L321-K323 PolarHBondContact O-N 2.87Å; K323-S326 PolarHBondContact O-OG 3.45Å
324	H	81.3	Confident	74.5	Confident	24 Å²	24	53.1 Å²	53.1	11%	0.111	27%	0.265	C	S	.	.	H	α-helix	trans	-80.3	-34	173.8	173.7	49.3	0	0	0	112.2	C311 F315 R320 L321 I322 S326 V327 H328	C311-H324 PolarHBondContact SG-NE2 3.15Å; F315-H324 HydrophobicContact CE1-CB 3.91Å; F315-H324 HydrophobicContact CE2-CB 4.07Å; F315-H324 AromaticContact CE2-CD2 3.33Å; F315-H324 WeakPolarHBondContact CE2-CD2 3.25Å; F315-H324 AromaticContact CE2-CG 3.85Å; F315-H324 HydrophobicContact CZ-CB 3.52Å; F315-H324 AromaticContact CZ-CD2 3.2Å; F315-H324 WeakPolarHBondContact CZ-CD2 3.48Å; F315-H324 AromaticContact CZ-CG 3.3Å; F315-H324 AromaticContact CZ-NE2 3.95Å; R320-H324 VanDerWaalsContact O-CB 3.26Å; R320-H324 WeakPolarHBondContact O-CB 3.41Å; R320-H324 PolarHBondContact O-N 2.93Å; L321-H324 CarbonylContact O-C 3.6Å; L321-H324 VanDerWaalsContact O-CA 3.29Å; L321-H324 WeakPolarHBondContact O-CA 3.47Å; L321-H324 VanDerWaalsContact O-CB 3.23Å; L321-H324 WeakPolarHBondContact O-CB 3.38Å; L321-H324 PolarHBondContact O-N 3.33Å; I322-H324 PolarHBondContact O-N 2.83Å; H324-S326 PolarHBondContact O-N 3.44Å; H324-S326 VanDerWaalsContact O-N 3.12Å; H324-V327 WeakPolarHBondContact O-CB 3.37Å; H324-V327 VanDerWaalsContact O-CG2 3.31Å; H324-V327 WeakPolarHBondContact O-CG2 3.23Å; H324-V327 PolarHBondContact O-N 3Å; H324-H328 AromaticContact CD2-NE2 3.28Å; H324-H328 PolarHBondContact CD2-NE2 2.58Å; H324-H328 VanDerWaalsContact CD2-NE2 3.28Å; H324-H328 AromaticContact CE1-NE2 3.2Å; H324-H328 PolarHBondContact CE1-NE2 2.75Å; H324-H328 AromaticContact NE2-NE2 2.5Å; H324-H328 PolarHBondContact NE2-NE2 3.16Å
325	W	71.6	Confident	74.5	Confident	6 Å²	6	52 Å²	52	2%	0.023	26%	0.264	C	S	.	.	H	α-helix	trans	-57.7	-26.3	177.5	-84.7	81.7	0	0	0	113.3	V14 L53 H55 S309 E310 L321 I322 V327 H328 T329	V14-W325 HydrophobicContact CB-CZ2 4.49Å; V14-W325 HydrophobicContact CG2-CZ2 4.05Å; L53-W325 HydrophobicContact CD1-CB 4.4Å; L53-W325 HydrophobicContact CD1-CD2 3.92Å; L53-W325 HydrophobicContact CD1-CE3 3.26Å; L53-W325 HydrophobicContact CD1-CG 4.46Å; L53-W325 HydrophobicContact CD1-CZ3 3.65Å; L53-W325 HydrophobicContact CD2-CE3 3.54Å; L53-W325 HydrophobicContact CD2-CZ3 3.53Å; L53-W325 HydrophobicContact CG-CE3 4.02Å; L53-W325 HydrophobicContact CG-CZ3 4.15Å; H55-W325 AromaticContact NE2-CH2 3.46Å; H55-W325 WeakPolarHBondContact NE2-CH2 3.36Å; H55-W325 AromaticContact NE2-CZ3 3.97Å; S309-W325 WeakPolarHBondContact OG-CH2 3.38Å; S309-W325 VanDerWaalsContact OG-CZ2 3.24Å; S309-W325 WeakPolarHBondContact OG-CZ2 3.38Å; E310-W325 HydrophobicContact CG-CE3 4.31Å; E310-W325 HydrophobicContact CG-CH2 4.42Å; E310-W325 HydrophobicContact CG-CZ3 3.99Å; L321-W325 VanDerWaalsContact O-CD1 3.28Å; L321-W325 PolarHBondContact O-N 3.06Å; I322-W325 PolarHBondContact O-N 2.79Å; W325-V327 PolarHBondContact O-N 2.81Å; W325-H328 PolarHBondContact O-N 2.82Å; W325-T329 PolarHBondContact O-N 3.1Å; W325-T329 VanDerWaalsContact O-N 3.13Å; W325-T329 PolarHBondContact O-OG1 2.84Å
326	S	74.8	Confident	74.9	Confident	11 Å²	11	50.3 Å²	50.3	8%	0.077	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-16.8	171.7	86.9	0	0	0	0	114.1	K323 H324 T329 G330 S344	K323-S326 PolarHBondContact O-OG 3.45Å; H324-S326 PolarHBondContact O-N 3.44Å; H324-S326 VanDerWaalsContact O-N 3.12Å; S326-T329 WeakPolarHBondContact CA-OG1 3.36Å; S326-G330 WeakPolarHBondContact O-CA 3.21Å; S326-G330 PolarHBondContact O-N 3.47Å; S326-S344 WeakPolarHBondContact OG-CB 3.41Å
327	V	79.2	Confident	75.6	Confident	101 Å²	101	56.7 Å²	56.7	61%	0.612	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-31.1	175.1	-179.5	0	0	0	0	111.2	H324 W325	H324-V327 WeakPolarHBondContact O-CB 3.37Å; H324-V327 VanDerWaalsContact O-CG2 3.31Å; H324-V327 WeakPolarHBondContact O-CG2 3.23Å; H324-V327 PolarHBondContact O-N 3Å; W325-V327 PolarHBondContact O-N 2.81Å
328	H	75.8	Confident	76.2	Confident	78 Å²	78	59.1 Å²	59.1	36%	0.361	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-43.8	-179.7	-61.2	-60.7	0	0	0	111.6	C308 E310 C311 H324 W325 G330	C308-H328 VanDerWaalsContact SG-CD2 3.58Å; C308-H328 PolarHBondContact SG-NE2 3.46Å; E310-H328 HydrophobicContact CB-CB 4.36Å; E310-H328 HydrophobicContact CG-CB 4.21Å; C311-H328 WeakPolarHBondContact CB-CE1 3.27Å; C311-H328 PolarHBondContact SG-CE1 3.36Å; C311-H328 PolarHBondContact SG-NE2 3.39Å; H324-H328 AromaticContact CD2-NE2 3.28Å; H324-H328 PolarHBondContact CD2-NE2 2.58Å; H324-H328 VanDerWaalsContact CD2-NE2 3.28Å; H324-H328 AromaticContact CE1-NE2 3.2Å; H324-H328 PolarHBondContact CE1-NE2 2.75Å; H324-H328 AromaticContact NE2-NE2 2.5Å; H324-H328 PolarHBondContact NE2-NE2 3.16Å; W325-H328 PolarHBondContact O-N 2.82Å; H328-G330 VanDerWaalsContact C-N 3.29Å; H328-G330 PolarHBondContact O-N 2.95Å
329	T	74	Confident	77.2	Confident	52 Å²	52	60.4 Å²	60.4	32%	0.319	32%	0.32	S	S	.	.	S	Bend	trans	-72.8	-20.9	176.4	54.6	0	0	0	0	114.1	L53 W325 S326 A331	L53-T329 HydrophobicContact CD1-CG2 4.2Å; L53-T329 HydrophobicContact CD2-CG2 3.18Å; L53-T329 HydrophobicContact CG-CG2 3.57Å; W325-T329 PolarHBondContact O-N 3.1Å; W325-T329 VanDerWaalsContact O-N 3.13Å; W325-T329 PolarHBondContact O-OG1 2.84Å; S326-T329 WeakPolarHBondContact CA-OG1 3.36Å; T329-A331 PolarHBondContact O-N 3.46Å; T329-A331 WeakPolarHBondContact OG1-CB 3.2Å; T329-A331 PolarHBondContact OG1-N 3.14Å
330	G	73.3	Confident	77.8	Confident	48 Å²	48	57.9 Å²	57.9	50%	0.495	32%	0.32	S	S	.	.			trans	64	12.7	-163.8	0	0	0	0	0	113.7	S326 H328 R332	S326-G330 WeakPolarHBondContact O-CA 3.21Å; S326-G330 PolarHBondContact O-N 3.47Å; H328-G330 VanDerWaalsContact C-N 3.29Å; H328-G330 PolarHBondContact O-N 2.95Å; G330-R332 WeakPolarHBondContact O-CG 3.49Å; G330-R332 PolarHBondContact O-N 3.29Å
331	A	72.6	Confident	78.1	Confident	20 Å²	20	57.9 Å²	57.9	17%	0.165	32%	0.323	C	S	.	.			trans	-59.5	124	-178.9	0	0	0	0	0	110.7	L49 T329	L49-A331 HydrophobicContact CD2-CB 3.75Å; T329-A331 PolarHBondContact O-N 3.46Å; T329-A331 WeakPolarHBondContact OG1-CB 3.2Å; T329-A331 PolarHBondContact OG1-N 3.14Å
332	R	74.2	Confident	78.3	Confident	139 Å²	139	62 Å²	62	53%	0.525	34%	0.341	S	S	.	.			trans	-131.2	74.1	179.6	-67.7	165.3	77.1	162	5.9	109.5	G330 Y334 F342 F343	G330-R332 WeakPolarHBondContact O-CG 3.49Å; G330-R332 PolarHBondContact O-N 3.29Å; R332-Y334 PolarHBondContact O-N 2.69Å; R332-Y334 VanDerWaalsContact O-N 3.07Å; R332-F342 HydrophobicContact CB-CB 3.6Å; R332-F342 PolarHBondContact NE-O 2.8Å; R332-F342 PolarHBondContact NH2-O 3.16Å; R332-F342 WeakPolarHBondContact O-CD1 2.98Å; R332-F343 CarbonylContact C-O 3.23Å; R332-F343 WeakPolarHBondContact CA-O 3.45Å; R332-F343 WeakPolarHBondContact CB-O 3.42Å
333	P	72.6	Confident	78.5	Confident	77 Å²	77	63.4 Å²	63.4	50%	0.5	35%	0.347	S	S	.	.			trans	-64.2	-16.3	-171.5	-21.5	34.1	0	0	0	114.6
334	Y	76.6	Confident	78.5	Confident	50 Å²	50	61.6 Å²	61.6	20%	0.196	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	94.6	-167.3	-62.8	-77.4	0	0	0	112.1	E45 R332 F342 F343 Q345 S346	E45-Y334 WeakPolarHBondContact OE1-CE2 3.2Å; E45-Y334 VanDerWaalsContact OE1-CZ 3.29Å; E45-Y334 PolarHBondContact OE1-OH 3.33Å; E45-Y334 PolarHBondContact OE2-OH 3.12Å; R332-Y334 PolarHBondContact O-N 2.69Å; R332-Y334 VanDerWaalsContact O-N 3.07Å; Y334-F342 CarbonylContact O-C 3.57Å; Y334-F342 WeakPolarHBondContact O-CA 3.49Å; Y334-F343 WeakPolarHBondContact CB-O 3.47Å; Y334-F343 WeakPolarHBondContact CD2-O 3.41Å; Y334-F343 PolarHBondContact N-O 3.37Å; Y334-F343 VanDerWaalsContact N-O 3.11Å; Y334-F343 PolarHBondContact O-N 3.26Å; Y334-Q345 VanDerWaalsContact CD2-C 3.47Å; Y334-S346 VanDerWaalsContact CE1-CB 3.47Å
335	E	78.1	Confident	78.3	Confident	91 Å²	91	63.6 Å²	63.6	43%	0.425	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	136.2	177.4	-163.4	-176.9	162.3	0	0	113.3	I337 F342 L349	E335-I337 PolarHBondContact O-N 2.63Å; E335-F342 HydrophobicContact CB-CD1 3.82Å; E335-F342 HydrophobicContact CB-CE1 3.6Å; E335-F342 HydrophobicContact CB-CZ 4.23Å; E335-F342 HydrophobicContact CG-CD1 4.02Å; E335-F342 HydrophobicContact CG-CE1 3.62Å; E335-F342 HydrophobicContact CG-CE2 4.23Å; E335-F342 HydrophobicContact CG-CG 4.49Å; E335-F342 HydrophobicContact CG-CZ 3.72Å; E335-L349 WeakPolarHBondContact O-CD2 3.38Å
336	C	85.8	Confident	78.4	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.007	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	97	164.8	-171.7	0	0	0	0	110.8	A338 C339 G340 K341 F343 L349 H352 H356	C336-A338 PolarHBondContact O-N 2.77Å; C336-C339 CarbonylContact O-C 3.33Å; C336-C339 PolarHBondContact O-N 3.26Å; C336-G340 PolarHBondContact O-N 3.21Å; C336-K341 HydrophobicContact CB-CB 4.39Å; C336-K341 VanDerWaalsContact CB-O 3.31Å; C336-K341 WeakPolarHBondContact CB-O 3.32Å; C336-K341 PolarHBondContact N-O 2.78Å; C336-F343 HydrophobicContact CB-CE2 4.11Å; C336-L349 HydrophobicContact CB-CD1 3.51Å; C336-H352 PolarHBondContact SG-CD2 3.25Å; C336-H352 PolarHBondContact SG-NE2 3.36Å; C336-H356 PolarHBondContact SG-NE2 3.43Å
337	I	86.2	Confident	78.6	Confident	153 Å²	153	67.9 Å²	67.9	79%	0.785	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.9	-31.9	178.9	-55.8	172	0	0	0	112.7	E335 C339	E335-I337 PolarHBondContact O-N 2.63Å; I337-C339 VanDerWaalsContact C-N 3.31Å; I337-C339 PolarHBondContact O-N 3.01Å
338	A	83.9	Confident	78.9	Confident	71 Å²	71	66.5 Å²	66.5	59%	0.587	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-15	179.9	0	0	0	0	0	114.9	C336	C336-A338 PolarHBondContact O-N 2.77Å
339	C	88.4	Confident	79.3	Confident	46 Å²	46	63.8 Å²	63.8	31%	0.311	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-154.8	12.6	-179.2	66.6	0	0	0	0	116.4	C336 I337 K341 H352 H356	C336-C339 CarbonylContact O-C 3.33Å; C336-C339 PolarHBondContact O-N 3.26Å; I337-C339 VanDerWaalsContact C-N 3.31Å; I337-C339 PolarHBondContact O-N 3.01Å; C339-K341 PolarHBondContact O-N 3.12Å; C339-K341 VanDerWaalsContact O-N 3.14Å; C339-H352 PolarHBondContact SG-NE2 2.98Å; C339-H356 WeakPolarHBondContact CB-CE1 3.15Å; C339-H356 WeakPolarHBondContact CB-NE2 3.23Å; C339-H356 PolarHBondContact SG-CE1 2.71Å; C339-H356 PolarHBondContact SG-NE2 3.37Å
340	G	83.3	Confident	79.7	Confident	35 Å²	35	65.6 Å²	65.6	36%	0.361	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.3	15.3	179.6	0	0	0	0	0	115	C336 F342	C336-G340 PolarHBondContact O-N 3.21Å; G340-F342 WeakPolarHBondContact O-CD2 3.39Å; G340-F342 WeakPolarHBondContact O-CE2 3.44Å
341	K	82.9	Confident	80.1	Confident	119 Å²	119	63.9 Å²	63.9	52%	0.517	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	120.8	-179	-73.8	-175.7	179.7	178.9	0	110.8	C336 C339 F343	C336-K341 HydrophobicContact CB-CB 4.39Å; C336-K341 VanDerWaalsContact CB-O 3.31Å; C336-K341 WeakPolarHBondContact CB-O 3.32Å; C336-K341 PolarHBondContact N-O 2.78Å; C339-K341 PolarHBondContact O-N 3.12Å; C339-K341 VanDerWaalsContact O-N 3.14Å; K341-F343 HydrophobicContact CB-CE2 3.84Å; K341-F343 HydrophobicContact CB-CZ 4.14Å; K341-F343 WeakPolarHBondContact O-CD2 3.42Å; K341-F343 WeakPolarHBondContact O-CE2 3.35Å
342	F	81.7	Confident	80.9	Confident	93 Å²	93	64.3 Å²	64.3	41%	0.408	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	150.7	176.2	-63.9	-89.9	0	0	0	112.2	R332 Y334 E335 G340	R332-F342 HydrophobicContact CB-CB 3.6Å; R332-F342 PolarHBondContact NE-O 2.8Å; R332-F342 PolarHBondContact NH2-O 3.16Å; R332-F342 WeakPolarHBondContact O-CD1 2.98Å; Y334-F342 CarbonylContact O-C 3.57Å; Y334-F342 WeakPolarHBondContact O-CA 3.49Å; E335-F342 HydrophobicContact CB-CD1 3.82Å; E335-F342 HydrophobicContact CB-CE1 3.6Å; E335-F342 HydrophobicContact CB-CZ 4.23Å; E335-F342 HydrophobicContact CG-CD1 4.02Å; E335-F342 HydrophobicContact CG-CE1 3.62Å; E335-F342 HydrophobicContact CG-CE2 4.23Å; E335-F342 HydrophobicContact CG-CG 4.49Å; E335-F342 HydrophobicContact CG-CZ 3.72Å; G340-F342 WeakPolarHBondContact O-CD2 3.39Å; G340-F342 WeakPolarHBondContact O-CE2 3.44Å
343	F	78.9	Confident	81.4	Confident	36 Å²	36	61.5 Å²	61.5	16%	0.158	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	149.8	177	-63.5	-91.8	0	0	0	110.3	R332 Y334 C336 K341 Q345 D348 L349 H352	R332-F343 CarbonylContact C-O 3.23Å; R332-F343 WeakPolarHBondContact CA-O 3.45Å; R332-F343 WeakPolarHBondContact CB-O 3.42Å; Y334-F343 WeakPolarHBondContact CB-O 3.47Å; Y334-F343 WeakPolarHBondContact CD2-O 3.41Å; Y334-F343 PolarHBondContact N-O 3.37Å; Y334-F343 VanDerWaalsContact N-O 3.11Å; Y334-F343 PolarHBondContact O-N 3.26Å; C336-F343 HydrophobicContact CB-CE2 4.11Å; K341-F343 HydrophobicContact CB-CE2 3.84Å; K341-F343 HydrophobicContact CB-CZ 4.14Å; K341-F343 WeakPolarHBondContact O-CD2 3.42Å; K341-F343 WeakPolarHBondContact O-CE2 3.35Å; F343-Q345 VanDerWaalsContact C-N 3.34Å; F343-D348 HydrophobicContact CB-CB 4.4Å; F343-D348 HydrophobicContact CD1-CB 3.91Å; F343-D348 HydrophobicContact CG-CB 4.46Å; F343-L349 HydrophobicContact CB-CB 4.26Å; F343-L349 HydrophobicContact CD2-CB 4Å; F343-L349 HydrophobicContact CD2-CD1 3.95Å; F343-L349 HydrophobicContact CE2-CD1 4.18Å; F343-L349 HydrophobicContact CG-CB 4.24Å; F343-H352 HydrophobicContact CE1-CB 3.88Å; F343-H352 HydrophobicContact CE2-CB 4.02Å; F343-H352 AromaticContact CE2-CD2 3.37Å; F343-H352 WeakPolarHBondContact CE2-CD2 2.93Å; F343-H352 AromaticContact CE2-CG 3.75Å; F343-H352 HydrophobicContact CZ-CB 3.48Å; F343-H352 VanDerWaalsContact CZ-CB 3.48Å; F343-H352 AromaticContact CZ-CD2 3.33Å; F343-H352 WeakPolarHBondContact CZ-CD2 3.09Å; F343-H352 AromaticContact CZ-CG 3.24Å; F343-H352 AromaticContact CZ-ND1 3.9Å
344	S	73.4	Confident	82.1	Confident	43 Å²	43	60.1 Å²	60.1	30%	0.301	33%	0.326	S	S	.	.	S	Bend	trans	-83.4	-9.5	175.5	49.7	0	0	0	0	113.4	S326	S326-S344 WeakPolarHBondContact OG-CB 3.41Å
345	Q	76.4	Confident	82.7	Confident	66 Å²	66	62.8 Å²	62.8	31%	0.308	35%	0.347	S	S	.	.	S	Bend	trans	-138.9	137.8	178	-54.2	-173.9	36.4	0	0	111.2	Y334 F343 S347 D348 L349	Y334-Q345 VanDerWaalsContact CD2-C 3.47Å; F343-Q345 VanDerWaalsContact C-N 3.34Å; Q345-S347 VanDerWaalsContact C-N 3.25Å; Q345-S347 PolarHBondContact O-N 2.79Å; Q345-D348 HydrophobicContact CB-CB 4.46Å; Q345-D348 PolarHBondContact O-N 3.37Å; Q345-L349 PolarHBondContact O-N 2.78Å
346	S	75.3	Confident	83.1	Confident	48 Å²	48	63.2 Å²	63.2	34%	0.336	35%	0.349	S	S	.	.	H	α-helix	trans	-55.7	-37.8	173.8	49.6	0	0	0	0	113	Y334 D348 L349 I350	Y334-S346 VanDerWaalsContact CE1-CB 3.47Å; S346-D348 VanDerWaalsContact C-N 3.25Å; S346-D348 PolarHBondContact O-N 2.92Å; S346-L349 PolarHBondContact O-N 3.49Å; S346-I350 VanDerWaalsContact O-CG1 3.29Å; S346-I350 WeakPolarHBondContact O-CG1 3.45Å; S346-I350 PolarHBondContact O-N 3.34Å
347	S	79.2	Confident	83.1	Confident	59 Å²	59	67.3 Å²	67.3	41%	0.413	37%	0.371	S	S	.	.	H	α-helix	trans	-61.1	-34.1	176.7	52.4	0	0	0	0	113.1	Q345 A351	Q345-S347 VanDerWaalsContact C-N 3.25Å; Q345-S347 PolarHBondContact O-N 2.79Å; S347-A351 VanDerWaalsContact O-CB 3.27Å; S347-A351 WeakPolarHBondContact O-CB 3.37Å; S347-A351 PolarHBondContact O-N 2.97Å
348	D	83.6	Confident	83.1	Confident	72 Å²	72	62.2 Å²	62.2	39%	0.385	36%	0.357	S	S	.	.	H	α-helix	trans	-79.3	-36.9	-179.1	-62.9	-20.5	0	0	0	110.6	F343 Q345 S346 A351 H352	F343-D348 HydrophobicContact CB-CB 4.4Å; F343-D348 HydrophobicContact CD1-CB 3.91Å; F343-D348 HydrophobicContact CG-CB 4.46Å; Q345-D348 HydrophobicContact CB-CB 4.46Å; Q345-D348 PolarHBondContact O-N 3.37Å; S346-D348 VanDerWaalsContact C-N 3.25Å; S346-D348 PolarHBondContact O-N 2.92Å; D348-A351 PolarHBondContact O-N 2.73Å; D348-H352 WeakPolarHBondContact O-CB 3.47Å; D348-H352 PolarHBondContact O-N 2.66Å
349	L	85.1	Confident	83.2	Confident	21 Å²	21	63.8 Å²	63.8	11%	0.11	35%	0.352	C	S	.	.	H	α-helix	trans	-59.6	-51.1	168.5	172.1	59.9	0	0	0	111.4	E335 C336 F343 Q345 S346 A351 H352 Q353	E335-L349 WeakPolarHBondContact O-CD2 3.38Å; C336-L349 HydrophobicContact CB-CD1 3.51Å; F343-L349 HydrophobicContact CB-CB 4.26Å; F343-L349 HydrophobicContact CD2-CB 4Å; F343-L349 HydrophobicContact CD2-CD1 3.95Å; F343-L349 HydrophobicContact CE2-CD1 4.18Å; F343-L349 HydrophobicContact CG-CB 4.24Å; Q345-L349 PolarHBondContact O-N 2.78Å; S346-L349 PolarHBondContact O-N 3.49Å; L349-A351 VanDerWaalsContact C-N 3.3Å; L349-A351 PolarHBondContact O-N 2.79Å; L349-H352 CarbonylContact O-C 3.55Å; L349-H352 WeakPolarHBondContact O-CB 3.47Å; L349-H352 PolarHBondContact O-N 3.17Å; L349-H352 VanDerWaalsContact O-N 3.12Å; L349-Q353 HydrophobicContact CD1-CG 4.17Å; L349-Q353 WeakPolarHBondContact O-CG 3.48Å; L349-Q353 PolarHBondContact O-N 3.44Å
350	I	82.9	Confident	83.2	Confident	89 Å²	89	67.4 Å²	67.4	46%	0.456	36%	0.362	S	S	.	.	H	α-helix	trans	-60.3	-41.3	178.9	-68.8	164.2	0	0	0	110.9	S346 Q353	S346-I350 VanDerWaalsContact O-CG1 3.29Å; S346-I350 WeakPolarHBondContact O-CG1 3.45Å; S346-I350 PolarHBondContact O-N 3.34Å; I350-Q353 PolarHBondContact O-N 3.44Å
351	A	82.1	Confident	83.4	Confident	12 Å²	12	69.4 Å²	69.4	10%	0.099	37%	0.369	C	S	.	.	H	α-helix	trans	-70.4	-33.5	177.1	0	0	0	0	0	112.4	S347 D348 L349 R354	S347-A351 VanDerWaalsContact O-CB 3.27Å; S347-A351 WeakPolarHBondContact O-CB 3.37Å; S347-A351 PolarHBondContact O-N 2.97Å; D348-A351 PolarHBondContact O-N 2.73Å; L349-A351 VanDerWaalsContact C-N 3.3Å; L349-A351 PolarHBondContact O-N 2.79Å; A351-R354 WeakPolarHBondContact O-CB 3.35Å; A351-R354 PolarHBondContact O-N 3.34Å
352	H	87.6	Confident	83.7	Confident	29 Å²	29	67.4 Å²	67.4	13%	0.134	36%	0.358	C	S	.	.	H	α-helix	trans	-68.7	-37.9	173.7	170.1	60.3	0	0	0	112.7	C336 C339 F343 D348 L349 R354 V355 H356	C336-H352 PolarHBondContact SG-CD2 3.25Å; C336-H352 PolarHBondContact SG-NE2 3.36Å; C339-H352 PolarHBondContact SG-NE2 2.98Å; F343-H352 HydrophobicContact CE1-CB 3.88Å; F343-H352 HydrophobicContact CE2-CB 4.02Å; F343-H352 AromaticContact CE2-CD2 3.37Å; F343-H352 WeakPolarHBondContact CE2-CD2 2.93Å; F343-H352 AromaticContact CE2-CG 3.75Å; F343-H352 HydrophobicContact CZ-CB 3.48Å; F343-H352 VanDerWaalsContact CZ-CB 3.48Å; F343-H352 AromaticContact CZ-CD2 3.33Å; F343-H352 WeakPolarHBondContact CZ-CD2 3.09Å; F343-H352 AromaticContact CZ-CG 3.24Å; F343-H352 AromaticContact CZ-ND1 3.9Å; D348-H352 WeakPolarHBondContact O-CB 3.47Å; D348-H352 PolarHBondContact O-N 2.66Å; L349-H352 CarbonylContact O-C 3.55Å; L349-H352 WeakPolarHBondContact O-CB 3.47Å; L349-H352 PolarHBondContact O-N 3.17Å; L349-H352 VanDerWaalsContact O-N 3.12Å; H352-R354 PolarHBondContact O-N 3.34Å; H352-R354 VanDerWaalsContact O-N 3.08Å; H352-V355 VanDerWaalsContact O-CB 3.24Å; H352-V355 WeakPolarHBondContact O-CB 3.46Å; H352-V355 WeakPolarHBondContact O-CG2 3.08Å; H352-V355 PolarHBondContact O-N 2.81Å; H352-H356 AromaticContact CD2-NE2 3.54Å; H352-H356 AromaticContact CE1-NE2 3.37Å; H352-H356 PolarHBondContact CE1-NE2 2.88Å; H352-H356 AromaticContact NE2-CD2 3.96Å; H352-H356 AromaticContact NE2-NE2 2.61Å; H352-H356 PolarHBondContact NE2-NE2 3.11Å
353	Q	85.1	Confident	84.1	Confident	81 Å²	81	67.1 Å²	67.1	38%	0.379	36%	0.364	S	S	.	.	H	α-helix	trans	-56.2	-26.6	175.7	-75.5	169.4	-14.3	0	0	112.6	L349 I350 V355 H356 N357	L349-Q353 HydrophobicContact CD1-CG 4.17Å; L349-Q353 WeakPolarHBondContact O-CG 3.48Å; L349-Q353 PolarHBondContact O-N 3.44Å; I350-Q353 PolarHBondContact O-N 3.44Å; Q353-V355 PolarHBondContact O-N 3.11Å; Q353-H356 PolarHBondContact O-N 3.21Å; Q353-N357 PolarHBondContact O-N 2.88Å
354	R	88	Confident	84.8	Confident	48 Å²	48	65.4 Å²	65.4	18%	0.181	36%	0.357	C	S	.	.	H	α-helix	trans	-61.4	-20.2	172.8	-59.1	-175.2	-172.7	138.9	13.3	114.6	A351 H352 N357 G358 E359 S372	A351-R354 WeakPolarHBondContact O-CB 3.35Å; A351-R354 PolarHBondContact O-N 3.34Å; H352-R354 PolarHBondContact O-N 3.34Å; H352-R354 VanDerWaalsContact O-N 3.08Å; R354-N357 VanDerWaalsContact CA-OD1 3.23Å; R354-N357 WeakPolarHBondContact CA-OD1 3.33Å; R354-N357 PolarHBondContact O-OD1 3.28Å; R354-G358 CarbonylContact O-C 3.08Å; R354-G358 WeakPolarHBondContact O-CA 3.48Å; R354-G358 PolarHBondContact O-N 2.93Å; R354-G358 VanDerWaalsContact O-N 3.12Å; R354-E359 HydrophobicContact CB-CB 4.4Å; R354-E359 HydrophobicContact CG-CB 4.26Å; R354-E359 PolarHBondContact O-N 2.91Å; R354-S372 PolarHBondContact NH1-O 3.48Å
355	V	88.2	Confident	85.7	Confident	105 Å²	105	68.6 Å²	68.6	64%	0.636	38%	0.379	S	S	*	.	H	α-helix	trans	-72.8	-32.8	174.3	-177.3	0	0	0	0	110.9	H352 Q353	H352-V355 VanDerWaalsContact O-CB 3.24Å; H352-V355 WeakPolarHBondContact O-CB 3.46Å; H352-V355 WeakPolarHBondContact O-CG2 3.08Å; H352-V355 PolarHBondContact O-N 2.81Å; Q353-V355 PolarHBondContact O-N 3.11Å
356	H	86.6	Confident	86.5	Confident	101 Å²	101	70.7 Å²	70.7	47%	0.468	39%	0.389	S	S	.	.	H	α-helix	trans	-82.1	-43.6	-178.5	-64.6	-59.4	0	0	0	112.7	C336 C339 H352 Q353	C336-H356 PolarHBondContact SG-NE2 3.43Å; C339-H356 WeakPolarHBondContact CB-CE1 3.15Å; C339-H356 WeakPolarHBondContact CB-NE2 3.23Å; C339-H356 PolarHBondContact SG-CE1 2.71Å; C339-H356 PolarHBondContact SG-NE2 3.37Å; H352-H356 AromaticContact CD2-NE2 3.54Å; H352-H356 AromaticContact CE1-NE2 3.37Å; H352-H356 PolarHBondContact CE1-NE2 2.88Å; H352-H356 AromaticContact NE2-CD2 3.96Å; H352-H356 AromaticContact NE2-NE2 2.61Å; H352-H356 PolarHBondContact NE2-NE2 3.11Å; Q353-H356 PolarHBondContact O-N 3.21Å
357	N	86.3	Confident	87.4	Confident	87 Å²	87	70.7 Å²	70.7	47%	0.465	39%	0.388	S	S	.	.	H	α-helix	trans	-87.3	-8.3	179.9	69.3	13	0	0	0	113.6	Q353 R354 E359	Q353-N357 PolarHBondContact O-N 2.88Å; R354-N357 VanDerWaalsContact CA-OD1 3.23Å; R354-N357 WeakPolarHBondContact CA-OD1 3.33Å; R354-N357 PolarHBondContact O-OD1 3.28Å; N357-E359 VanDerWaalsContact C-N 3.28Å; N357-E359 PolarHBondContact ND2-OE1 2.83Å; N357-E359 PolarHBondContact ND2-OE2 3.26Å; N357-E359 PolarHBondContact O-N 3.29Å; N357-E359 WeakPolarHBondContact OD1-CB 3.43Å; N357-E359 VanDerWaalsContact OD1-CG 3.29Å; N357-E359 WeakPolarHBondContact OD1-CG 2.86Å; N357-E359 PolarHBondContact OD1-N 2.86Å
358	G	86.4	Confident	87.9	Confident	46 Å²	46	70.4 Å²	70.4	47%	0.474	40%	0.395	S	S	.	.			trans	73.9	9	-179.5	0	0	0	0	0	115.3	R354 K360	R354-G358 CarbonylContact O-C 3.08Å; R354-G358 WeakPolarHBondContact O-CA 3.48Å; R354-G358 PolarHBondContact O-N 2.93Å; R354-G358 VanDerWaalsContact O-N 3.12Å; G358-K360 PolarHBondContact O-N 3.33Å
359	E	86.3	Confident	88.3	Confident	104 Å²	104	72.9 Å²	72.9	49%	0.486	40%	0.402	S	S	.	.			trans	-62.2	126.9	-176.9	-78.6	175	169.1	0	0	112.5	R354 N357	R354-E359 HydrophobicContact CB-CB 4.4Å; R354-E359 HydrophobicContact CG-CB 4.26Å; R354-E359 PolarHBondContact O-N 2.91Å; N357-E359 VanDerWaalsContact C-N 3.28Å; N357-E359 PolarHBondContact ND2-OE1 2.83Å; N357-E359 PolarHBondContact ND2-OE2 3.26Å; N357-E359 PolarHBondContact O-N 3.29Å; N357-E359 WeakPolarHBondContact OD1-CB 3.43Å; N357-E359 VanDerWaalsContact OD1-CG 3.29Å; N357-E359 WeakPolarHBondContact OD1-CG 2.86Å; N357-E359 PolarHBondContact OD1-N 2.86Å
360	K	88.8	Confident	88.6	Confident	122 Å²	122	73.7 Å²	73.7	53%	0.53	41%	0.412	S	S	.	.			trans	-128.5	75.5	177.6	-67.9	175	-171.9	177.7	0	110.3	G358 Y362 A370 F371	G358-K360 PolarHBondContact O-N 3.33Å; K360-Y362 PolarHBondContact O-N 3.32Å; K360-Y362 VanDerWaalsContact O-N 3.11Å; K360-A370 HydrophobicContact CB-CB 3.57Å; K360-A370 HydrophobicContact CD-CB 4.29Å; K360-F371 CarbonylContact C-O 3.6Å; K360-F371 VanDerWaalsContact C-O 3.23Å; K360-F371 VanDerWaalsContact CA-O 3.27Å; K360-F371 WeakPolarHBondContact CA-O 3.09Å
361	P	86.6	Confident	88.9	Confident	77 Å²	77	71.3 Å²	71.3	50%	0.5	40%	0.398	S	S	.	.			trans	-66.3	-15.1	-172	-21.2	34.1	0	0	0	114.6
362	Y	89.4	Confident	88.9	Confident	76 Å²	76	72.4 Å²	72.4	30%	0.298	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	92.7	-171.7	-55.9	-74.3	0	0	0	110.3	K360 A370 F371 S372 K374	K360-Y362 PolarHBondContact O-N 3.32Å; K360-Y362 VanDerWaalsContact O-N 3.11Å; Y362-A370 CarbonylContact O-C 3.41Å; Y362-A370 WeakPolarHBondContact O-CA 3.42Å; Y362-F371 WeakPolarHBondContact CD2-O 3.2Å; Y362-F371 PolarHBondContact N-O 3.08Å; Y362-F371 VanDerWaalsContact N-O 3.16Å; Y362-F371 PolarHBondContact O-N 2.87Å; Y362-S372 WeakPolarHBondContact CE2-O 3.19Å; Y362-K374 HydrophobicContact CD1-CB 3.86Å; Y362-K374 HydrophobicContact CD1-CG 4.23Å; Y362-K374 HydrophobicContact CE1-CB 3.7Å; Y362-K374 HydrophobicContact CE1-CD 4.46Å; Y362-K374 HydrophobicContact CE1-CG 4.23Å; Y362-K374 HydrophobicContact CE2-CB 4.41Å; Y362-K374 HydrophobicContact CG-CB 4.3Å
363	V	91.1	Very high	88.5	Confident	87 Å²	87	74.2 Å²	74.2	53%	0.527	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	134.7	-179.1	-172	0	0	0	0	110.9	A370	V363-A370 HydrophobicContact CG2-CB 4.06Å
364	C	93.1	Very high	88.6	Confident	1 Å²	1	77 Å²	77	1%	0.007	43%	0.425	C	S	.	.			trans	-77.8	121.6	169.9	-176	0	0	0	0	110.5	E366 G368 K369 F371 L377 H381	C364-E366 VanDerWaalsContact C-N 3.26Å; C364-E366 PolarHBondContact O-N 2.69Å; C364-G368 VanDerWaalsContact O-CA 3.28Å; C364-G368 WeakPolarHBondContact O-CA 3.05Å; C364-G368 PolarHBondContact O-N 3Å; C364-K369 WeakPolarHBondContact CB-O 3.13Å; C364-K369 PolarHBondContact N-O 3.21Å; C364-F371 HydrophobicContact CB-CE2 4.47Å; C364-L377 HydrophobicContact CB-CD1 3.59Å; C364-H381 PolarHBondContact SG-NE2 3.29Å; C364-H381 VanDerWaalsContact SG-NE2 3.44Å
365	S	92.8	Very high	88.4	Confident	110 Å²	110	80.4 Å²	80.4	77%	0.769	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-28.2	178.7	47	0	0	0	0	113.7
366	E	92.2	Very high	88.4	Confident	110 Å²	110	77.7 Å²	77.7	51%	0.514	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-26.7	-173.3	-63.7	174.3	-123.1	0	0	113.5	C364 H384	C364-E366 VanDerWaalsContact C-N 3.26Å; C364-E366 PolarHBondContact O-N 2.69Å; E366-H384 IonicContact OE1-CD2 3.45Å; E366-H384 WeakPolarHBondContact OE2-CB 3.22Å; E366-H384 IonicContact OE2-CD2 3.43Å; E366-H384 PolarHBondContact OE2-CD2 3.45Å; E366-H384 IonicContact OE2-CG 2.69Å; E366-H384 VanDerWaalsContact OE2-CG 3.32Å
367	C	93.3	Very high	88.6	Confident	47 Å²	47	74 Å²	74	32%	0.318	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139	7.6	-176.4	73.4	0	0	0	0	115.4	K369 H380 H384	C367-K369 PolarHBondContact O-N 3.43Å; C367-H380 PolarHBondContact SG-NE2 2.87Å; C367-H384 WeakPolarHBondContact CB-NE2 3.39Å; C367-H384 PolarHBondContact SG-NE2 2.58Å
368	G	91.3	Very high	88.7	Confident	54 Å²	54	73.5 Å²	73.5	56%	0.557	41%	0.409	S	S	*	.			trans	68.8	-2	178.4	0	0	0	0	0	115.8	C364 A370	C364-G368 VanDerWaalsContact O-CA 3.28Å; C364-G368 WeakPolarHBondContact O-CA 3.05Å; C364-G368 PolarHBondContact O-N 3Å; G368-A370 PolarHBondContact O-N 3.48Å
369	K	92.1	Very high	88.9	Confident	124 Å²	124	74.6 Å²	74.6	54%	0.539	40%	0.402	S	S	.	.			trans	-68.9	126.4	-178	-72	-179.8	179.4	176.4	0	111.2	C364 C367 F371	C364-K369 WeakPolarHBondContact CB-O 3.13Å; C364-K369 PolarHBondContact N-O 3.21Å; C367-K369 PolarHBondContact O-N 3.43Å; K369-F371 HydrophobicContact CB-CE2 3.98Å; K369-F371 HydrophobicContact CB-CZ 3.94Å; K369-F371 VanDerWaalsContact O-CE2 3.28Å; K369-F371 WeakPolarHBondContact O-CE2 3.39Å
370	A	91.2	Very high	89.1	Confident	38 Å²	38	70.5 Å²	70.5	31%	0.314	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	145.3	-179.5	0	0	0	0	0	112.3	K360 Y362 V363 G368	K360-A370 HydrophobicContact CB-CB 3.57Å; K360-A370 HydrophobicContact CD-CB 4.29Å; Y362-A370 CarbonylContact O-C 3.41Å; Y362-A370 WeakPolarHBondContact O-CA 3.42Å; V363-A370 HydrophobicContact CG2-CB 4.06Å; G368-A370 PolarHBondContact O-N 3.48Å
371	F	87.8	Confident	89.2	Confident	39 Å²	39	67.2 Å²	67.2	17%	0.171	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	151.7	-178.9	-55	-84.9	0	0	0	111.9	K360 Y362 C364 K369 V376 L377 H380	K360-F371 CarbonylContact C-O 3.6Å; K360-F371 VanDerWaalsContact C-O 3.23Å; K360-F371 VanDerWaalsContact CA-O 3.27Å; K360-F371 WeakPolarHBondContact CA-O 3.09Å; Y362-F371 WeakPolarHBondContact CD2-O 3.2Å; Y362-F371 PolarHBondContact N-O 3.08Å; Y362-F371 VanDerWaalsContact N-O 3.16Å; Y362-F371 PolarHBondContact O-N 2.87Å; C364-F371 HydrophobicContact CB-CE2 4.47Å; K369-F371 HydrophobicContact CB-CE2 3.98Å; K369-F371 HydrophobicContact CB-CZ 3.94Å; K369-F371 VanDerWaalsContact O-CE2 3.28Å; K369-F371 WeakPolarHBondContact O-CE2 3.39Å; F371-V376 HydrophobicContact CB-CB 4.31Å; F371-V376 HydrophobicContact CB-CG1 4.42Å; F371-V376 HydrophobicContact CD1-CB 4.23Å; F371-V376 HydrophobicContact CD1-CG1 3.46Å; F371-V376 VanDerWaalsContact CD1-CG1 3.46Å; F371-V376 HydrophobicContact CE1-CG1 4Å; F371-V376 HydrophobicContact CG-CB 4.42Å; F371-V376 HydrophobicContact CG-CG1 4.11Å; F371-L377 HydrophobicContact CD2-CB 3.98Å; F371-L377 HydrophobicContact CD2-CD1 3.73Å; F371-L377 HydrophobicContact CD2-CG 4.47Å; F371-L377 HydrophobicContact CE2-CD1 3.84Å; F371-H380 HydrophobicContact CE1-CB 4.32Å; F371-H380 HydrophobicContact CE2-CB 3.91Å; F371-H380 AromaticContact CE2-CD2 3.57Å; F371-H380 AromaticContact CE2-CG 3.69Å; F371-H380 HydrophobicContact CZ-CB 3.65Å; F371-H380 AromaticContact CZ-CD2 3.6Å; F371-H380 AromaticContact CZ-CG 3.33Å; F371-H380 AromaticContact CZ-ND1 3.68Å
372	S	82.6	Confident	89.5	Confident	35 Å²	35	65.8 Å²	65.8	25%	0.245	35%	0.354	C	S	.	.	S	Bend	trans	-79.4	-18.3	178.5	50.3	0	0	0	0	114.1	R354 Y362	R354-S372 PolarHBondContact NH1-O 3.48Å; Y362-S372 WeakPolarHBondContact CE2-O 3.19Å
373	H	80.5	Confident	89.6	Confident	67 Å²	67	66.1 Å²	66.1	31%	0.31	36%	0.36	S	S	.	.	S	Bend	trans	-133	141.4	177.6	-57.6	-104.3	0	0	0	112.7	H375 V376 L377	H373-H375 VanDerWaalsContact C-N 3.34Å; H373-H375 AromaticContact CG-CE1 3.95Å; H373-H375 PolarHBondContact O-N 3.15Å; H373-V376 HydrophobicContact CB-CG2 4.17Å; H373-V376 PolarHBondContact O-N 3.25Å; H373-L377 PolarHBondContact O-N 3.43Å
374	K	85.6	Confident	89.6	Confident	140 Å²	140	66 Å²	66	61%	0.609	35%	0.354	S	S	*	.	H	α-helix	trans	-58.1	-38.5	178.4	-170.9	175.3	179.4	177.4	0	113.9	Y362 V376 L377 V378	Y362-K374 HydrophobicContact CD1-CB 3.86Å; Y362-K374 HydrophobicContact CD1-CG 4.23Å; Y362-K374 HydrophobicContact CE1-CB 3.7Å; Y362-K374 HydrophobicContact CE1-CD 4.46Å; Y362-K374 HydrophobicContact CE1-CG 4.23Å; Y362-K374 HydrophobicContact CE2-CB 4.41Å; Y362-K374 HydrophobicContact CG-CB 4.3Å; K374-V376 VanDerWaalsContact C-N 3.29Å; K374-V376 PolarHBondContact O-N 3.21Å; K374-L377 WeakPolarHBondContact O-CB 3.24Å; K374-L377 PolarHBondContact O-N 3.5Å; K374-V378 WeakPolarHBondContact O-CG2 3.46Å; K374-V378 PolarHBondContact O-N 3.26Å
375	H	84.1	Confident	89.5	Confident	119 Å²	119	69.7 Å²	69.7	55%	0.551	38%	0.376	S	S	*	.	H	α-helix	trans	-65.9	-33	-178.3	73	-100.6	0	0	0	112.2	H373 V378 Q379	H373-H375 VanDerWaalsContact C-N 3.34Å; H373-H375 AromaticContact CG-CE1 3.95Å; H373-H375 PolarHBondContact O-N 3.15Å; H375-V378 PolarHBondContact O-N 2.88Å; H375-Q379 WeakPolarHBondContact O-CB 3.44Å; H375-Q379 PolarHBondContact O-N 3.41Å
376	V	88.3	Confident	89.4	Confident	48 Å²	48	66.1 Å²	66.1	29%	0.291	36%	0.357	S	S	.	.	H	α-helix	trans	-68.4	-39.7	175.9	-173.6	0	0	0	0	110.4	F371 H373 K374 Q379 H380	F371-V376 HydrophobicContact CB-CB 4.31Å; F371-V376 HydrophobicContact CB-CG1 4.42Å; F371-V376 HydrophobicContact CD1-CB 4.23Å; F371-V376 HydrophobicContact CD1-CG1 3.46Å; F371-V376 VanDerWaalsContact CD1-CG1 3.46Å; F371-V376 HydrophobicContact CE1-CG1 4Å; F371-V376 HydrophobicContact CG-CB 4.42Å; F371-V376 HydrophobicContact CG-CG1 4.11Å; H373-V376 HydrophobicContact CB-CG2 4.17Å; H373-V376 PolarHBondContact O-N 3.25Å; K374-V376 VanDerWaalsContact C-N 3.29Å; K374-V376 PolarHBondContact O-N 3.21Å; V376-Q379 PolarHBondContact O-N 2.81Å; V376-H380 VanDerWaalsContact O-CB 3.26Å; V376-H380 WeakPolarHBondContact O-CB 3.23Å; V376-H380 PolarHBondContact O-N 2.98Å
377	L	90.6	Very high	89.4	Confident	23 Å²	23	65.9 Å²	65.9	12%	0.12	36%	0.356	C	S	.	.	H	α-helix	trans	-61	-47.2	172.9	177.3	64.5	0	0	0	111.8	C364 F371 H373 K374 Q379 H380 H381	C364-L377 HydrophobicContact CB-CD1 3.59Å; F371-L377 HydrophobicContact CD2-CB 3.98Å; F371-L377 HydrophobicContact CD2-CD1 3.73Å; F371-L377 HydrophobicContact CD2-CG 4.47Å; F371-L377 HydrophobicContact CE2-CD1 3.84Å; H373-L377 PolarHBondContact O-N 3.43Å; K374-L377 WeakPolarHBondContact O-CB 3.24Å; K374-L377 PolarHBondContact O-N 3.5Å; L377-Q379 VanDerWaalsContact C-N 3.32Å; L377-Q379 PolarHBondContact O-N 3.28Å; L377-H380 WeakPolarHBondContact O-CA 3.17Å; L377-H380 WeakPolarHBondContact O-CB 3.35Å; L377-H380 PolarHBondContact O-N 3.03Å; L377-H380 VanDerWaalsContact O-N 3.08Å; L377-H381 VanDerWaalsContact CD1-NE2 3.34Å; L377-H381 WeakPolarHBondContact CD1-NE2 3.42Å; L377-H381 PolarHBondContact O-CD2 3.4Å; L377-H381 PolarHBondContact O-N 3.25Å
378	V	89.4	Confident	89.3	Confident	77 Å²	77	70.5 Å²	70.5	47%	0.467	37%	0.367	S	S	.	.	H	α-helix	trans	-61.6	-40.6	176.9	173.9	0	0	0	0	111.5	K374 H375 H380 H381	K374-V378 WeakPolarHBondContact O-CG2 3.46Å; K374-V378 PolarHBondContact O-N 3.26Å; H375-V378 PolarHBondContact O-N 2.88Å; V378-H380 VanDerWaalsContact C-N 3.31Å; V378-H380 PolarHBondContact O-N 2.65Å; V378-H381 PolarHBondContact O-N 3Å
379	Q	89.2	Confident	89.3	Confident	69 Å²	69	71.2 Å²	71.2	32%	0.322	36%	0.361	S	S	.	.	H	α-helix	trans	-67.1	-32	174.3	177.7	174.5	-31.9	0	0	112.6	H375 V376 L377 Q401	H375-Q379 WeakPolarHBondContact O-CB 3.44Å; H375-Q379 PolarHBondContact O-N 3.41Å; V376-Q379 PolarHBondContact O-N 2.81Å; L377-Q379 VanDerWaalsContact C-N 3.32Å; L377-Q379 PolarHBondContact O-N 3.28Å; Q379-Q401 HydrophobicContact CG-CG 4.23Å
380	H	91.4	Very high	89.3	Confident	18 Å²	18	68.8 Å²	68.8	8%	0.083	35%	0.349	C	S	.	.	H	α-helix	trans	-69.9	-40.6	175.5	175.8	67.9	0	0	0	112.2	C367 F371 V376 L377 V378 R382 I383	C367-H380 PolarHBondContact SG-NE2 2.87Å; F371-H380 HydrophobicContact CE1-CB 4.32Å; F371-H380 HydrophobicContact CE2-CB 3.91Å; F371-H380 AromaticContact CE2-CD2 3.57Å; F371-H380 AromaticContact CE2-CG 3.69Å; F371-H380 HydrophobicContact CZ-CB 3.65Å; F371-H380 AromaticContact CZ-CD2 3.6Å; F371-H380 AromaticContact CZ-CG 3.33Å; F371-H380 AromaticContact CZ-ND1 3.68Å; V376-H380 VanDerWaalsContact O-CB 3.26Å; V376-H380 WeakPolarHBondContact O-CB 3.23Å; V376-H380 PolarHBondContact O-N 2.98Å; L377-H380 WeakPolarHBondContact O-CA 3.17Å; L377-H380 WeakPolarHBondContact O-CB 3.35Å; L377-H380 PolarHBondContact O-N 3.03Å; L377-H380 VanDerWaalsContact O-N 3.08Å; V378-H380 VanDerWaalsContact C-N 3.31Å; V378-H380 PolarHBondContact O-N 2.65Å; H380-R382 PolarHBondContact O-N 3.05Å; H380-R382 VanDerWaalsContact O-N 3.1Å; H380-I383 VanDerWaalsContact O-CB 3.22Å; H380-I383 WeakPolarHBondContact O-CB 3.22Å; H380-I383 WeakPolarHBondContact O-CG1 3.5Å; H380-I383 PolarHBondContact O-N 3.23Å
381	H	90.7	Very high	89.3	Confident	53 Å²	53	74.3 Å²	74.3	25%	0.245	37%	0.366	C	S	.	.	H	α-helix	trans	-56	-30.1	177.9	-78.7	-143	0	0	0	112.9	C364 L377 V378 I383 H384 T385	C364-H381 PolarHBondContact SG-NE2 3.29Å; C364-H381 VanDerWaalsContact SG-NE2 3.44Å; L377-H381 VanDerWaalsContact CD1-NE2 3.34Å; L377-H381 WeakPolarHBondContact CD1-NE2 3.42Å; L377-H381 PolarHBondContact O-CD2 3.4Å; L377-H381 PolarHBondContact O-N 3.25Å; V378-H381 PolarHBondContact O-N 3Å; H381-I383 PolarHBondContact O-N 3.4Å; H381-H384 PolarHBondContact O-N 3.15Å; H381-T385 PolarHBondContact O-N 2.98Å; H381-T385 PolarHBondContact O-OG1 3.28Å
382	R	92.1	Very high	89.6	Confident	46 Å²	46	72.8 Å²	72.8	17%	0.174	36%	0.36	C	S	.	.	H	α-helix	trans	-61.1	-13.4	173.1	-58.7	-178	179.8	158.6	3.9	114.6	H380 G386 E387 R400	H380-R382 PolarHBondContact O-N 3.05Å; H380-R382 VanDerWaalsContact O-N 3.1Å; R382-G386 CarbonylContact O-C 3.45Å; R382-G386 PolarHBondContact O-N 2.9Å; R382-E387 HydrophobicContact CB-CB 4.26Å; R382-E387 HydrophobicContact CG-CB 4.11Å; R382-R400 PolarHBondContact NH1-O 3.45Å; R382-R400 WeakPolarHBondContact O-CD 3.47Å; R382-R400 PolarHBondContact O-NE 2.84Å
383	I	91.6	Very high	90	Very high	83 Å²	83	75.6 Å²	75.6	43%	0.426	38%	0.38	S	S	.	.	H	α-helix	trans	-72.8	-43.8	171.2	-62.9	175.6	0	0	0	109.8	H380 H381 R400	H380-I383 VanDerWaalsContact O-CB 3.22Å; H380-I383 WeakPolarHBondContact O-CB 3.22Å; H380-I383 WeakPolarHBondContact O-CG1 3.5Å; H380-I383 PolarHBondContact O-N 3.23Å; H381-I383 PolarHBondContact O-N 3.4Å; I383-R400 PolarHBondContact O-NH2 2.85Å
384	H	92.3	Very high	90.4	Very high	86 Å²	86	78.4 Å²	78.4	40%	0.398	39%	0.393	S	S	.	.	H	α-helix	trans	-77.6	-49.1	-179.9	-50.4	-54.2	0	0	0	112.1	E366 C367 H381 G386	E366-H384 IonicContact OE1-CD2 3.45Å; E366-H384 WeakPolarHBondContact OE2-CB 3.22Å; E366-H384 IonicContact OE2-CD2 3.43Å; E366-H384 PolarHBondContact OE2-CD2 3.45Å; E366-H384 IonicContact OE2-CG 2.69Å; E366-H384 VanDerWaalsContact OE2-CG 3.32Å; C367-H384 WeakPolarHBondContact CB-NE2 3.39Å; C367-H384 PolarHBondContact SG-NE2 2.58Å; H381-H384 PolarHBondContact O-N 3.15Å; H384-G386 PolarHBondContact O-N 3.34Å
385	T	91.2	Very high	90.7	Very high	77 Å²	77	74.3 Å²	74.3	47%	0.472	38%	0.381	S	S	.	.	S	Bend	trans	-70.9	-10.9	179.2	66.6	0	0	0	0	113.7	H381 E387	H381-T385 PolarHBondContact O-N 2.98Å; H381-T385 PolarHBondContact O-OG1 3.28Å; T385-E387 PolarHBondContact O-N 2.94Å; T385-E387 VanDerWaalsContact O-N 3.12Å; T385-E387 WeakPolarHBondContact OG1-CG 3.36Å; T385-E387 PolarHBondContact OG1-N 2.85Å
386	G	90.3	Very high	91	Very high	36 Å²	36	71.1 Å²	71.1	37%	0.371	38%	0.381	S	S	.	.			trans	72	-4.6	-176.3	0	0	0	0	0	115.1	R382 H384 R388	R382-G386 CarbonylContact O-C 3.45Å; R382-G386 PolarHBondContact O-N 2.9Å; H384-G386 PolarHBondContact O-N 3.34Å; G386-R388 PolarHBondContact O-N 3.47Å
387	E	92.2	Very high	91.2	Very high	104 Å²	104	74.8 Å²	74.8	49%	0.486	39%	0.393	S	S	.	.			trans	-51	128.7	-174.3	-83.3	178.4	-157.5	0	0	113.9	R382 T385 R400	R382-E387 HydrophobicContact CB-CB 4.26Å; R382-E387 HydrophobicContact CG-CB 4.11Å; T385-E387 PolarHBondContact O-N 2.94Å; T385-E387 VanDerWaalsContact O-N 3.12Å; T385-E387 WeakPolarHBondContact OG1-CG 3.36Å; T385-E387 PolarHBondContact OG1-N 2.85Å; E387-R400 WeakPolarHBondContact O-CG 3.18Å
388	R	91.1	Very high	91.3	Very high	145 Å²	145	74.8 Å²	74.8	55%	0.547	40%	0.396	S	S	.	.			trans	-127.2	77.1	176.1	-75	171.1	151.5	-169.6	-7.2	111	G386 Y390 A398 F399 R400	G386-R388 PolarHBondContact O-N 3.47Å; R388-Y390 VanDerWaalsContact C-N 3.27Å; R388-Y390 PolarHBondContact O-N 2.99Å; R388-A398 HydrophobicContact CB-CB 3.66Å; R388-A398 VanDerWaalsContact CD-O 3.27Å; R388-A398 WeakPolarHBondContact CD-O 3.08Å; R388-A398 PolarHBondContact NE-O 3.21Å; R388-F399 CarbonylContact C-O 3.24Å; R388-F399 WeakPolarHBondContact CA-O 3.23Å; R388-R400 HydrophobicContact CG-CG 3.88Å
389	P	90.3	Very high	91.3	Very high	69 Å²	69	73.2 Å²	73.2	45%	0.448	38%	0.383	S	S	.	.			trans	-67	-23.5	-172.9	-22	34.7	0	0	0	114.5
390	Y	92.4	Very high	91.3	Very high	73 Å²	73	74.2 Å²	74.2	29%	0.286	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	97.6	-172	-51.5	-76.4	0	0	0	110.2	R388 A398 F399 R402	R388-Y390 VanDerWaalsContact C-N 3.27Å; R388-Y390 PolarHBondContact O-N 2.99Å; Y390-A398 CarbonylContact O-C 3.48Å; Y390-A398 WeakPolarHBondContact O-CA 3.42Å; Y390-F399 WeakPolarHBondContact CD2-O 3.34Å; Y390-F399 PolarHBondContact N-O 3.14Å; Y390-F399 PolarHBondContact O-N 3.41Å; Y390-R402 HydrophobicContact CD1-CB 4.06Å; Y390-R402 HydrophobicContact CE1-CB 3.89Å; Y390-R402 HydrophobicContact CE2-CB 4.47Å; Y390-R402 HydrophobicContact CG-CB 4.44Å
391	K	92.7	Very high	91.1	Very high	154 Å²	154	77.1 Å²	77.1	67%	0.67	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.6	141.6	176.4	-62.3	-178.4	179.9	179.1	0	110.8	A398	K391-A398 HydrophobicContact CG-CB 3.96Å
392	C	92.8	Very high	91.1	Very high	6 Å²	6	82.9 Å²	82.9	4%	0.041	42%	0.417	C	S	.	.			trans	-79	132.3	167.8	-177.7	0	0	0	0	109.8	G396 K397 L405 H412	C392-G396 VanDerWaalsContact O-CA 3.25Å; C392-G396 WeakPolarHBondContact O-CA 3.48Å; C392-G396 PolarHBondContact O-N 3.12Å; C392-K397 WeakPolarHBondContact CB-O 3.42Å; C392-K397 PolarHBondContact N-O 3.27Å; C392-L405 HydrophobicContact CB-CD1 3.69Å; C392-H412 PolarHBondContact SG-NE2 2.97Å
393	S	91.1	Very high	91	Very high	94 Å²	94	83.9 Å²	83.9	66%	0.657	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-51.3	173.6	42.7	0	0	0	0	111.5	C395	S393-C395 PolarHBondContact O-N 3.47Å
394	E	88.9	Confident	90.9	Very high	127 Å²	127	81.3 Å²	81.3	59%	0.593	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-34.9	-169.4	-49.4	-41.7	117.4	0	0	114.3
395	C	92.6	Very high	90.9	Very high	53 Å²	53	78.8 Å²	78.8	36%	0.358	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.3	8.3	-170.7	76.3	0	0	0	0	114.7	S393 K397 H408	S393-C395 PolarHBondContact O-N 3.47Å; C395-K397 PolarHBondContact O-N 2.89Å; C395-K397 VanDerWaalsContact SG-CG 3.59Å; C395-H408 PolarHBondContact SG-NE2 3.46Å
396	G	90.1	Very high	90.9	Very high	52 Å²	52	79.3 Å²	79.3	54%	0.536	41%	0.413	S	S	.	.			trans	67.1	-7.8	178.9	0	0	0	0	0	116.5	C392 A398	C392-G396 VanDerWaalsContact O-CA 3.25Å; C392-G396 WeakPolarHBondContact O-CA 3.48Å; C392-G396 PolarHBondContact O-N 3.12Å; G396-A398 PolarHBondContact O-N 3.06Å
397	K	92	Very high	90.8	Very high	126 Å²	126	86.4 Å²	86.4	55%	0.548	43%	0.428	S	S	.	.			trans	-59.7	129.6	-176.5	-72.8	177.8	-178	172.1	0	111.4	C392 C395 F399	C392-K397 WeakPolarHBondContact CB-O 3.42Å; C392-K397 PolarHBondContact N-O 3.27Å; C395-K397 PolarHBondContact O-N 2.89Å; C395-K397 VanDerWaalsContact SG-CG 3.59Å; K397-F399 HydrophobicContact CB-CE2 3.87Å; K397-F399 HydrophobicContact CB-CZ 3.99Å; K397-F399 WeakPolarHBondContact O-CD2 3.44Å; K397-F399 VanDerWaalsContact O-CE2 3.29Å; K397-F399 WeakPolarHBondContact O-CE2 3.44Å
398	A	93	Very high	90.8	Very high	23 Å²	23	82.3 Å²	82.3	19%	0.19	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	137.2	-174.4	0	0	0	0	0	112.4	R388 Y390 K391 G396	R388-A398 HydrophobicContact CB-CB 3.66Å; R388-A398 VanDerWaalsContact CD-O 3.27Å; R388-A398 WeakPolarHBondContact CD-O 3.08Å; R388-A398 PolarHBondContact NE-O 3.21Å; Y390-A398 CarbonylContact O-C 3.48Å; Y390-A398 WeakPolarHBondContact O-CA 3.42Å; K391-A398 HydrophobicContact CG-CB 3.96Å; G396-A398 PolarHBondContact O-N 3.06Å
399	F	90.4	Very high	90.6	Very high	43 Å²	43	81 Å²	81	19%	0.189	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	149.6	-173.8	-58.2	-88.7	0	0	0	111.9	R388 Y390 K397 Q401 L405 H408	R388-F399 CarbonylContact C-O 3.24Å; R388-F399 WeakPolarHBondContact CA-O 3.23Å; Y390-F399 WeakPolarHBondContact CD2-O 3.34Å; Y390-F399 PolarHBondContact N-O 3.14Å; Y390-F399 PolarHBondContact O-N 3.41Å; K397-F399 HydrophobicContact CB-CE2 3.87Å; K397-F399 HydrophobicContact CB-CZ 3.99Å; K397-F399 WeakPolarHBondContact O-CD2 3.44Å; K397-F399 VanDerWaalsContact O-CE2 3.29Å; K397-F399 WeakPolarHBondContact O-CE2 3.44Å; F399-Q401 VanDerWaalsContact C-N 3.32Å; F399-L405 HydrophobicContact CB-CB 4.44Å; F399-L405 HydrophobicContact CD2-CB 3.95Å; F399-L405 HydrophobicContact CD2-CD1 3.87Å; F399-L405 HydrophobicContact CE2-CD1 3.97Å; F399-L405 HydrophobicContact CG-CB 4.37Å; F399-H408 HydrophobicContact CE1-CB 4.03Å; F399-H408 HydrophobicContact CE2-CB 3.92Å; F399-H408 AromaticContact CE2-CD2 3.43Å; F399-H408 VanDerWaalsContact CE2-CD2 3.43Å; F399-H408 WeakPolarHBondContact CE2-CD2 3.49Å; F399-H408 AromaticContact CE2-CG 3.79Å; F399-H408 HydrophobicContact CZ-CB 3.45Å; F399-H408 VanDerWaalsContact CZ-CB 3.45Å; F399-H408 AromaticContact CZ-CD2 3.43Å; F399-H408 VanDerWaalsContact CZ-CD2 3.43Å; F399-H408 WeakPolarHBondContact CZ-CD2 3.45Å; F399-H408 AromaticContact CZ-CG 3.34Å
400	R	87.8	Confident	90.5	Very high	91 Å²	91	81 Å²	81	34%	0.343	40%	0.397	S	S	.	.	S	Bend	trans	-75.1	-19.4	177.3	-61.4	-172.5	167.4	136.9	-6.3	113.4	R382 I383 E387 R388	R382-R400 PolarHBondContact NH1-O 3.45Å; R382-R400 WeakPolarHBondContact O-CD 3.47Å; R382-R400 PolarHBondContact O-NE 2.84Å; I383-R400 PolarHBondContact O-NH2 2.85Å; E387-R400 WeakPolarHBondContact O-CG 3.18Å; R388-R400 HydrophobicContact CG-CG 3.88Å
401	Q	87.4	Confident	90.3	Very high	79 Å²	79	83.5 Å²	83.5	37%	0.369	41%	0.414	S	S	.	.	S	Bend	trans	-139.3	140.5	-171	-57.1	178.2	9.7	0	0	111.5	Q379 F399 A403 S404 L405	Q379-Q401 HydrophobicContact CG-CG 4.23Å; F399-Q401 VanDerWaalsContact C-N 3.32Å; Q401-A403 PolarHBondContact O-N 2.96Å; Q401-S404 WeakPolarHBondContact O-CB 3.44Å; Q401-S404 PolarHBondContact O-N 3.15Å; Q401-S404 VanDerWaalsContact O-N 3.15Å; Q401-L405 PolarHBondContact O-N 3.49Å
402	R	90.9	Very high	90	Very high	173 Å²	173	80 Å²	80	65%	0.653	40%	0.4	S	S	*	.	H	α-helix	trans	-60.3	-40.4	178.7	-174.3	175.7	177.1	146.1	0.3	112.7	Y390 S404 L405 I406	Y390-R402 HydrophobicContact CD1-CB 4.06Å; Y390-R402 HydrophobicContact CE1-CB 3.89Å; Y390-R402 HydrophobicContact CE2-CB 4.47Å; Y390-R402 HydrophobicContact CG-CB 4.44Å; R402-S404 VanDerWaalsContact C-N 3.26Å; R402-S404 PolarHBondContact O-N 3.11Å; R402-L405 WeakPolarHBondContact O-CB 3.49Å; R402-L405 PolarHBondContact O-N 3.31Å; R402-L405 VanDerWaalsContact O-N 3.09Å; R402-I406 HydrophobicContact CG-CD1 3.96Å; R402-I406 HydrophobicContact CG-CG1 4.37Å; R402-I406 WeakPolarHBondContact O-CG1 3.47Å; R402-I406 PolarHBondContact O-N 3.04Å
403	A	89.2	Confident	89.5	Confident	67 Å²	67	82.5 Å²	82.5	55%	0.554	42%	0.415	S	S	*	.	H	α-helix	trans	-60.8	-33.9	177.4	0	0	0	0	0	112.9	Q401 R407	Q401-A403 PolarHBondContact O-N 2.96Å; A403-R407 WeakPolarHBondContact O-CB 2.99Å; A403-R407 PolarHBondContact O-N 3.11Å
404	S	91.1	Very high	88.7	Confident	30 Å²	30	81.1 Å²	81.1	21%	0.21	42%	0.416	C	S	.	.	H	α-helix	trans	-69.9	-37.1	174.4	-64.5	0	0	0	0	112.3	Q401 R402 H408	Q401-S404 WeakPolarHBondContact O-CB 3.44Å; Q401-S404 PolarHBondContact O-N 3.15Å; Q401-S404 VanDerWaalsContact O-N 3.15Å; R402-S404 VanDerWaalsContact C-N 3.26Å; R402-S404 PolarHBondContact O-N 3.11Å; S404-H408 WeakPolarHBondContact O-CB 3.28Å; S404-H408 PolarHBondContact O-N 3.25Å
405	L	91.9	Very high	87.7	Confident	33 Å²	33	80.3 Å²	80.3	17%	0.173	41%	0.412	C	S	.	.	H	α-helix	trans	-65.7	-45.4	172.4	173.9	61.4	0	0	0	111.4	C392 F399 Q401 R402 R407 H408 W409	C392-L405 HydrophobicContact CB-CD1 3.69Å; F399-L405 HydrophobicContact CB-CB 4.44Å; F399-L405 HydrophobicContact CD2-CB 3.95Å; F399-L405 HydrophobicContact CD2-CD1 3.87Å; F399-L405 HydrophobicContact CE2-CD1 3.97Å; F399-L405 HydrophobicContact CG-CB 4.37Å; Q401-L405 PolarHBondContact O-N 3.49Å; R402-L405 WeakPolarHBondContact O-CB 3.49Å; R402-L405 PolarHBondContact O-N 3.31Å; R402-L405 VanDerWaalsContact O-N 3.09Å; L405-R407 PolarHBondContact O-N 3.47Å; L405-H408 CarbonylContact O-C 3.56Å; L405-H408 WeakPolarHBondContact O-CB 3.41Å; L405-H408 PolarHBondContact O-N 2.92Å; L405-H408 VanDerWaalsContact O-N 3.12Å; L405-W409 WeakPolarHBondContact O-CB 3.27Å; L405-W409 PolarHBondContact O-N 3.49Å
406	I	90.4	Very high	86	Confident	88 Å²	88	88.7 Å²	88.7	45%	0.451	44%	0.436	S	S	.	.	H	α-helix	trans	-60	-48	178.5	-67	167.3	0	0	0	110.7	R402 H408 W409 K410	R402-I406 HydrophobicContact CG-CD1 3.96Å; R402-I406 HydrophobicContact CG-CG1 4.37Å; R402-I406 WeakPolarHBondContact O-CG1 3.47Å; R402-I406 PolarHBondContact O-N 3.04Å; I406-H408 VanDerWaalsContact C-N 3.25Å; I406-H408 PolarHBondContact O-N 3.19Å; I406-W409 PolarHBondContact O-N 2.88Å; I406-W409 VanDerWaalsContact O-N 3.13Å; I406-K410 PolarHBondContact O-N 2.96Å; I406-K410 VanDerWaalsContact O-N 3.1Å
407	R	89.4	Confident	84.4	Confident	184 Å²	184	94.6 Å²	94.6	69%	0.694	47%	0.465	S	S	*	.	H	α-helix	trans	-61.5	-33.3	175.5	-177.5	175.5	62.9	-176.5	-1.3	112.7	A403 L405	A403-R407 WeakPolarHBondContact O-CB 2.99Å; A403-R407 PolarHBondContact O-N 3.11Å; L405-R407 PolarHBondContact O-N 3.47Å
408	H	90.9	Very high	84.1	Confident	19 Å²	19	93 Å²	93	9%	0.088	46%	0.461	C	S	.	.	H	α-helix	trans	-71.9	-39.8	173.4	173	51.8	0	0	0	112.2	C395 F399 S404 L405 I406 K410 I411 H412	C395-H408 PolarHBondContact SG-NE2 3.46Å; F399-H408 HydrophobicContact CE1-CB 4.03Å; F399-H408 HydrophobicContact CE2-CB 3.92Å; F399-H408 AromaticContact CE2-CD2 3.43Å; F399-H408 VanDerWaalsContact CE2-CD2 3.43Å; F399-H408 WeakPolarHBondContact CE2-CD2 3.49Å; F399-H408 AromaticContact CE2-CG 3.79Å; F399-H408 HydrophobicContact CZ-CB 3.45Å; F399-H408 VanDerWaalsContact CZ-CB 3.45Å; F399-H408 AromaticContact CZ-CD2 3.43Å; F399-H408 VanDerWaalsContact CZ-CD2 3.43Å; F399-H408 WeakPolarHBondContact CZ-CD2 3.45Å; F399-H408 AromaticContact CZ-CG 3.34Å; S404-H408 WeakPolarHBondContact O-CB 3.28Å; S404-H408 PolarHBondContact O-N 3.25Å; L405-H408 CarbonylContact O-C 3.56Å; L405-H408 WeakPolarHBondContact O-CB 3.41Å; L405-H408 PolarHBondContact O-N 2.92Å; L405-H408 VanDerWaalsContact O-N 3.12Å; I406-H408 VanDerWaalsContact C-N 3.25Å; I406-H408 PolarHBondContact O-N 3.19Å; H408-K410 VanDerWaalsContact C-N 3.3Å; H408-K410 PolarHBondContact O-N 2.81Å; H408-I411 WeakPolarHBondContact O-CB 3.25Å; H408-I411 WeakPolarHBondContact O-CG1 3.43Å; H408-I411 PolarHBondContact O-N 3.25Å; H408-H412 AromaticContact CD2-NE2 3.99Å; H408-H412 AromaticContact CE1-CE1 3.91Å; H408-H412 AromaticContact CE1-NE2 3.52Å; H408-H412 AromaticContact NE2-CE1 3.89Å; H408-H412 AromaticContact NE2-NE2 3.15Å; H408-H412 PolarHBondContact NE2-NE2 3Å; H408-H412 VanDerWaalsContact NE2-NE2 3.15Å
409	W	88.2	Confident	83.6	Confident	118 Å²	118	96.7 Å²	96.7	45%	0.447	48%	0.475	S	S	.	.	H	α-helix	trans	-64.7	-34.1	-179.1	-174.5	72.7	0	0	0	112.3	L405 I406 I411 H412 T413	L405-W409 WeakPolarHBondContact O-CB 3.27Å; L405-W409 PolarHBondContact O-N 3.49Å; I406-W409 PolarHBondContact O-N 2.88Å; I406-W409 VanDerWaalsContact O-N 3.13Å; W409-I411 PolarHBondContact O-N 2.64Å; W409-I411 VanDerWaalsContact O-N 3.07Å; W409-H412 WeakPolarHBondContact O-CB 3.46Å; W409-H412 PolarHBondContact O-N 3.45Å; W409-T413 HydrophobicContact CD2-CG2 4Å; W409-T413 HydrophobicContact CE3-CG2 4.02Å; W409-T413 HydrophobicContact CH2-CG2 3.68Å; W409-T413 HydrophobicContact CZ2-CG2 3.64Å; W409-T413 HydrophobicContact CZ3-CG2 3.87Å; W409-T413 PolarHBondContact O-N 3.42Å
410	K	88.3	Confident	83.2	Confident	67 Å²	67	99.7 Å²	99.7	29%	0.291	49%	0.491	S	S	.	.	H	α-helix	trans	-53	-25.4	168.2	-78	-162.3	165.5	-152.2	0	114.6	I406 H408 H412 T413 G414 E415	I406-K410 PolarHBondContact O-N 2.96Å; I406-K410 VanDerWaalsContact O-N 3.1Å; H408-K410 VanDerWaalsContact C-N 3.3Å; H408-K410 PolarHBondContact O-N 2.81Å; K410-H412 VanDerWaalsContact C-N 3.34Å; K410-T413 WeakPolarHBondContact CA-OG1 3.48Å; K410-T413 PolarHBondContact O-OG1 2.9Å; K410-G414 PolarHBondContact O-N 3.07Å; K410-E415 HydrophobicContact CG-CB 4.47Å; K410-E415 PolarHBondContact O-N 3.31Å
411	I	86.8	Confident	82.9	Confident	126 Å²	126	100.2 Å²	100.2	65%	0.646	50%	0.5	S	S	*	.	H	α-helix	trans	-71.3	-31.8	176.2	-53.7	174.8	0	0	0	110.9	H408 W409	H408-I411 WeakPolarHBondContact O-CB 3.25Å; H408-I411 WeakPolarHBondContact O-CG1 3.43Å; H408-I411 PolarHBondContact O-N 3.25Å; W409-I411 PolarHBondContact O-N 2.64Å; W409-I411 VanDerWaalsContact O-N 3.07Å
412	H	86.7	Confident	82.7	Confident	81 Å²	81	101.5 Å²	101.5	38%	0.375	51%	0.508	S	S	.	.	H	α-helix	trans	-80.5	-34.6	177.4	-58.2	-56.6	0	0	0	112.4	C392 H408 W409 K410 G414	C392-H412 PolarHBondContact SG-NE2 2.97Å; H408-H412 AromaticContact CD2-NE2 3.99Å; H408-H412 AromaticContact CE1-CE1 3.91Å; H408-H412 AromaticContact CE1-NE2 3.52Å; H408-H412 AromaticContact NE2-CE1 3.89Å; H408-H412 AromaticContact NE2-NE2 3.15Å; H408-H412 PolarHBondContact NE2-NE2 3Å; H408-H412 VanDerWaalsContact NE2-NE2 3.15Å; W409-H412 WeakPolarHBondContact O-CB 3.46Å; W409-H412 PolarHBondContact O-N 3.45Å; K410-H412 VanDerWaalsContact C-N 3.34Å; H412-G414 VanDerWaalsContact C-N 3.32Å
413	T	82.1	Confident	82.1	Confident	58 Å²	58	96.7 Å²	96.7	36%	0.356	50%	0.498	S	S	.	.	H	α-helix	trans	-81.7	-9	179.3	60	0	0	0	0	113.9	W409 K410 E415	W409-T413 HydrophobicContact CD2-CG2 4Å; W409-T413 HydrophobicContact CE3-CG2 4.02Å; W409-T413 HydrophobicContact CH2-CG2 3.68Å; W409-T413 HydrophobicContact CZ2-CG2 3.64Å; W409-T413 HydrophobicContact CZ3-CG2 3.87Å; W409-T413 PolarHBondContact O-N 3.42Å; K410-T413 WeakPolarHBondContact CA-OG1 3.48Å; K410-T413 PolarHBondContact O-OG1 2.9Å; T413-E415 PolarHBondContact O-N 3.45Å
414	G	75	Confident	81.6	Confident	65 Å²	65	98.9 Å²	98.9	67%	0.67	49%	0.494	S	S	*	.			trans	73	-0.8	-177.3	0	0	0	0	0	114.6	K410 H412 R416	K410-G414 PolarHBondContact O-N 3.07Å; H412-G414 VanDerWaalsContact C-N 3.32Å; G414-R416 PolarHBondContact O-N 3.5Å
415	E	68.8	Low	80.9	Confident	110 Å²	110	104.2 Å²	104.2	51%	0.514	52%	0.516	S	S	.	.			trans	-67.5	99.4	175.4	-68.3	-177.3	168.9	0	0	110.2	K410 T413	K410-E415 HydrophobicContact CG-CB 4.47Å; K410-E415 PolarHBondContact O-N 3.31Å; T413-E415 PolarHBondContact O-N 3.45Å
416	R	55.3	Low	80	Confident	229 Å²	229	110.1 Å²	110.1	86%	0.864	55%	0.545	S	S	*	.			trans	-60.3	154.7	173	-104.3	-177.9	166.8	173.4	-3.4	111.3	G414	G414-R416 PolarHBondContact O-N 3.5Å
417	P	58	Low	79	Confident	176 Å²	176	112.1 Å²	112.1	100%	1.143	55%	0.554	S	S	*	*			trans	-55.1	0	-172.2	-27.7	36.5	0	0	0	114.9

Retrieved 417 of 417 residues in 194.8 ms (Link to these results)

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