A0A061ADQ1_CAEEL Loading...

Fibulin-1

AlphaFold DB , UniProt , Accession A0A061ADQ1, Species CAEEL (Caenorhabditis elegans), Gene fbl-1, Length 644 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.8	Very low	45.1	Very low	57 Å²	57	97.5 Å²	97.5	28%	0.281	50%	0.495	S	S	.	.				0	-27.6	0	-74	-163.1	36	0	0	117.4	I3 C4 F5 L317 T326 I328	M1-I3 VanDerWaalsContact C-N 3.26Å; M1-I3 PolarHBondContact O-N 2.92Å; M1-C4 CarbonylContact O-C 3.5Å; M1-C4 WeakPolarHBondContact O-CA 3.38Å; M1-C4 WeakPolarHBondContact O-CB 3.21Å; M1-C4 PolarHBondContact O-N 3.28Å; M1-F5 HydrophobicContact CE-CD2 3.53Å; M1-F5 HydrophobicContact CE-CE2 3.56Å; M1-F5 PolarHBondContact O-N 3.29Å; M1-L317 HydrophobicContact CE-CB 4.23Å; M1-L317 HydrophobicContact CE-CD1 3.14Å; M1-L317 HydrophobicContact CE-CG 4.27Å; M1-L317 HydrophobicContact CG-CB 4.12Å; M1-L317 HydrophobicContact SD-CB 3.09Å; M1-L317 WeakPolarHBondContact SD-CB 3.41Å; M1-L317 HydrophobicContact SD-CD1 3.15Å; M1-L317 WeakPolarHBondContact SD-CD1 3.47Å; M1-L317 HydrophobicContact SD-CD2 4.44Å; M1-L317 HydrophobicContact SD-CG 3.66Å; M1-T326 WeakPolarHBondContact CA-OG1 3.43Å; M1-T326 WeakPolarHBondContact CB-OG1 3.41Å; M1-T326 WeakPolarHBondContact CG-OG1 3.36Å; M1-T326 VanDerWaalsContact N-CG2 3.25Å; M1-T326 PolarHBondContact N-OG1 2.9Å; M1-I328 HydrophobicContact CE-CD1 4.41Å
2	R	38.5	Very low	45.6	Very low	146 Å²	146	95.5 Å²	95.5	55%	0.551	49%	0.491	S	S	*	.	H	α-helix	trans	-58.7	-35.2	174.7	-81.9	-178.8	174.3	177.4	-3.9	113.7	C4 L6 T329	R2-C4 VanDerWaalsContact C-N 3.34Å; R2-L6 WeakPolarHBondContact O-CB 3.36Å; R2-L6 WeakPolarHBondContact O-CD1 3.28Å; R2-L6 WeakPolarHBondContact O-CG 3.49Å; R2-L6 PolarHBondContact O-N 3.39Å; R2-T329 PolarHBondContact NH2-OG1 3.41Å
3	I	48.2	Very low	45.6	Very low	133 Å²	133	92.8 Å²	92.8	68%	0.682	49%	0.491	S	S	*	.	H	α-helix	trans	-69.4	-33.1	170.5	-62.9	168.6	0	0	0	110.9	M1 L7	M1-I3 VanDerWaalsContact C-N 3.26Å; M1-I3 PolarHBondContact O-N 2.92Å; I3-L7 HydrophobicContact CG2-CD1 3.73Å; I3-L7 HydrophobicContact CG2-CG 4.34Å; I3-L7 WeakPolarHBondContact O-CA 3.48Å; I3-L7 WeakPolarHBondContact O-CB 3.08Å; I3-L7 VanDerWaalsContact O-CD1 3.24Å; I3-L7 WeakPolarHBondContact O-CD1 3.07Å; I3-L7 WeakPolarHBondContact O-CG 3.3Å; I3-L7 PolarHBondContact O-N 2.81Å
4	C	42.8	Very low	45.5	Very low	69 Å²	69	92.8 Å²	92.8	47%	0.466	49%	0.487	S	S	.	.	H	α-helix	trans	-77.2	-30.4	178.1	-135.5	0	0	0	0	113.1	M1 R2 L7 L8	M1-C4 CarbonylContact O-C 3.5Å; M1-C4 WeakPolarHBondContact O-CA 3.38Å; M1-C4 WeakPolarHBondContact O-CB 3.21Å; M1-C4 PolarHBondContact O-N 3.28Å; R2-C4 VanDerWaalsContact C-N 3.34Å; C4-L7 CarbonylContact O-C 3.44Å; C4-L8 WeakPolarHBondContact O-CA 3.4Å; C4-L8 WeakPolarHBondContact O-CB 3.38Å; C4-L8 PolarHBondContact O-N 3.12Å
5	F	45.6	Very low	45.9	Very low	103 Å²	103	91.9 Å²	91.9	45%	0.452	49%	0.487	S	S	.	.	H	α-helix	trans	-85.4	-31.9	174.7	-114.4	-83.3	0	0	0	111.8	M1 L7 L8 A9	M1-F5 HydrophobicContact CE-CD2 3.53Å; M1-F5 HydrophobicContact CE-CE2 3.56Å; M1-F5 PolarHBondContact O-N 3.29Å; F5-L7 VanDerWaalsContact C-N 3.34Å; F5-L8 PolarHBondContact O-N 2.82Å; F5-A9 WeakPolarHBondContact O-CA 3.47Å; F5-A9 WeakPolarHBondContact O-CB 3.2Å; F5-A9 PolarHBondContact O-N 3.36Å
6	L	48.3	Very low	46.2	Very low	108 Å²	108	94.6 Å²	94.6	57%	0.565	49%	0.494	S	S	*	.	H	α-helix	trans	-68.4	-36.9	162.6	-80.6	160	0	0	0	109.9	R2 F10	R2-L6 WeakPolarHBondContact O-CB 3.36Å; R2-L6 WeakPolarHBondContact O-CD1 3.28Å; R2-L6 WeakPolarHBondContact O-CG 3.49Å; R2-L6 PolarHBondContact O-N 3.39Å; L6-F10 WeakPolarHBondContact O-CA 3.04Å; L6-F10 WeakPolarHBondContact O-CB 3.26Å; L6-F10 VanDerWaalsContact O-CD2 3.31Å; L6-F10 WeakPolarHBondContact O-CD2 3.37Å; L6-F10 PolarHBondContact O-N 3.15Å
7	L	45.9	Very low	46.6	Very low	91 Å²	91	92.1 Å²	92.1	48%	0.476	49%	0.49	S	S	.	.	H	α-helix	trans	-69.1	-35.2	169.9	-81.3	160.2	0	0	0	111.3	I3 C4 F5 F10 L11	I3-L7 HydrophobicContact CG2-CD1 3.73Å; I3-L7 HydrophobicContact CG2-CG 4.34Å; I3-L7 WeakPolarHBondContact O-CA 3.48Å; I3-L7 WeakPolarHBondContact O-CB 3.08Å; I3-L7 VanDerWaalsContact O-CD1 3.24Å; I3-L7 WeakPolarHBondContact O-CD1 3.07Å; I3-L7 WeakPolarHBondContact O-CG 3.3Å; I3-L7 PolarHBondContact O-N 2.81Å; C4-L7 CarbonylContact O-C 3.44Å; F5-L7 VanDerWaalsContact C-N 3.34Å; L7-F10 CarbonylContact O-C 3.58Å; L7-L11 WeakPolarHBondContact O-CA 3.29Å; L7-L11 WeakPolarHBondContact O-CB 3.38Å; L7-L11 WeakPolarHBondContact O-CD1 3.42Å; L7-L11 WeakPolarHBondContact O-CG 3.33Å; L7-L11 PolarHBondContact O-N 2.73Å
8	L	45.8	Very low	47.4	Very low	92 Å²	92	92.5 Å²	92.5	48%	0.482	49%	0.492	S	S	.	.	H	α-helix	trans	-78.2	-35.1	177.4	-107.9	136.7	0	0	0	111.8	C4 F5 L11 V12	C4-L8 WeakPolarHBondContact O-CA 3.4Å; C4-L8 WeakPolarHBondContact O-CB 3.38Å; C4-L8 PolarHBondContact O-N 3.12Å; F5-L8 PolarHBondContact O-N 2.82Å; L8-L11 CarbonylContact O-C 3.53Å; L8-L11 PolarHBondContact O-N 3.01Å; L8-V12 WeakPolarHBondContact O-CA 3.33Å; L8-V12 WeakPolarHBondContact O-CB 3.46Å; L8-V12 WeakPolarHBondContact O-CG2 3.32Å; L8-V12 PolarHBondContact O-N 2.82Å
9	A	46.2	Very low	48.5	Very low	55 Å²	55	91.2 Å²	91.2	46%	0.455	48%	0.483	S	S	.	.	H	α-helix	trans	-74.9	-34.4	171.1	0	0	0	0	0	110.9	F5 A13	F5-A9 WeakPolarHBondContact O-CA 3.47Å; F5-A9 WeakPolarHBondContact O-CB 3.2Å; F5-A9 PolarHBondContact O-N 3.36Å; A9-A13 WeakPolarHBondContact O-CA 3.46Å; A9-A13 WeakPolarHBondContact O-CB 3.21Å; A9-A13 PolarHBondContact O-N 3.29Å
10	F	47.1	Very low	49.7	Very low	128 Å²	128	90.8 Å²	90.8	56%	0.561	48%	0.481	S	S	*	.	H	α-helix	trans	-65.2	-41.8	164.8	-101.1	-103.2	0	0	0	110.3	L6 L7 E14	L6-F10 WeakPolarHBondContact O-CA 3.04Å; L6-F10 WeakPolarHBondContact O-CB 3.26Å; L6-F10 VanDerWaalsContact O-CD2 3.31Å; L6-F10 WeakPolarHBondContact O-CD2 3.37Å; L6-F10 PolarHBondContact O-N 3.15Å; L7-F10 CarbonylContact O-C 3.58Å; F10-E14 WeakPolarHBondContact O-CA 3.45Å; F10-E14 WeakPolarHBondContact O-CB 3.05Å; F10-E14 WeakPolarHBondContact O-CG 3.35Å; F10-E14 PolarHBondContact O-N 2.79Å
11	L	45.2	Very low	51.1	Low	91 Å²	91	90.8 Å²	90.8	48%	0.476	48%	0.484	S	S	.	.	H	α-helix	trans	-71.7	-32	178.8	-77.2	158.6	0	0	0	111	L7 L8 T15	L7-L11 WeakPolarHBondContact O-CA 3.29Å; L7-L11 WeakPolarHBondContact O-CB 3.38Å; L7-L11 WeakPolarHBondContact O-CD1 3.42Å; L7-L11 WeakPolarHBondContact O-CG 3.33Å; L7-L11 PolarHBondContact O-N 2.73Å; L8-L11 CarbonylContact O-C 3.53Å; L8-L11 PolarHBondContact O-N 3.01Å; L11-T15 WeakPolarHBondContact O-CA 3.18Å; L11-T15 WeakPolarHBondContact O-CB 3.31Å; L11-T15 WeakPolarHBondContact O-CG2 3.42Å; L11-T15 PolarHBondContact O-N 3.48Å; L11-T15 PolarHBondContact O-OG1 2.77Å
12	V	51	Low	52.9	Low	73 Å²	73	94.4 Å²	94.4	44%	0.442	50%	0.495	S	S	.	.	H	α-helix	trans	-77.9	-40.8	175.9	173	0	0	0	0	110.5	L8 T15 F16	L8-V12 WeakPolarHBondContact O-CA 3.33Å; L8-V12 WeakPolarHBondContact O-CB 3.46Å; L8-V12 WeakPolarHBondContact O-CG2 3.32Å; L8-V12 PolarHBondContact O-N 2.82Å; V12-T15 WeakPolarHBondContact CA-OG1 3.47Å; V12-T15 PolarHBondContact O-N 3.48Å; V12-T15 PolarHBondContact O-OG1 2.79Å; V12-F16 HydrophobicContact CG1-CD2 4.09Å; V12-F16 HydrophobicContact CG1-CE2 4.41Å; V12-F16 WeakPolarHBondContact O-CB 3.4Å; V12-F16 WeakPolarHBondContact O-CD2 3.42Å; V12-F16 PolarHBondContact O-N 3.25Å
13	A	45.5	Very low	54.9	Low	60 Å²	60	87.6 Å²	87.6	50%	0.496	47%	0.469	S	S	.	.	H	α-helix	trans	-69.6	-38.1	172	0	0	0	0	0	112	A9 A17	A9-A13 WeakPolarHBondContact O-CA 3.46Å; A9-A13 WeakPolarHBondContact O-CB 3.21Å; A9-A13 PolarHBondContact O-N 3.29Å; A13-A17 WeakPolarHBondContact O-CB 3.18Å; A13-A17 PolarHBondContact O-N 3.3Å
14	E	44.4	Very low	56.4	Low	93 Å²	93	83 Å²	83	44%	0.435	45%	0.449	S	S	.	.	H	α-helix	trans	-67.6	-38.9	170.9	-78.2	174.5	175.9	0	0	109.9	F10 N18	F10-E14 WeakPolarHBondContact O-CA 3.45Å; F10-E14 WeakPolarHBondContact O-CB 3.05Å; F10-E14 WeakPolarHBondContact O-CG 3.35Å; F10-E14 PolarHBondContact O-N 2.79Å; E14-N18 WeakPolarHBondContact O-CA 3.48Å; E14-N18 WeakPolarHBondContact O-CB 3.43Å; E14-N18 PolarHBondContact O-N 2.9Å; E14-N18 PolarHBondContact O-ND2 3Å
15	T	50.8	Low	58.3	Low	79 Å²	79	81.9 Å²	81.9	49%	0.485	45%	0.445	S	S	.	.	H	α-helix	trans	-71.3	-38.3	177.4	48.5	0	0	0	0	112.9	L11 V12 N18 E19	L11-T15 WeakPolarHBondContact O-CA 3.18Å; L11-T15 WeakPolarHBondContact O-CB 3.31Å; L11-T15 WeakPolarHBondContact O-CG2 3.42Å; L11-T15 PolarHBondContact O-N 3.48Å; L11-T15 PolarHBondContact O-OG1 2.77Å; V12-T15 WeakPolarHBondContact CA-OG1 3.47Å; V12-T15 PolarHBondContact O-N 3.48Å; V12-T15 PolarHBondContact O-OG1 2.79Å; T15-N18 PolarHBondContact O-N 3.24Å; T15-E19 WeakPolarHBondContact O-CB 3.33Å; T15-E19 PolarHBondContact O-N 3.46Å
16	F	50.4	Low	60.1	Low	135 Å²	135	77.7 Å²	77.7	59%	0.592	43%	0.431	S	S	*	.	H	α-helix	trans	-70.7	-41.9	172.6	-95.2	-86.8	0	0	0	112.7	V12 N18 E19 L20	V12-F16 HydrophobicContact CG1-CD2 4.09Å; V12-F16 HydrophobicContact CG1-CE2 4.41Å; V12-F16 WeakPolarHBondContact O-CB 3.4Å; V12-F16 WeakPolarHBondContact O-CD2 3.42Å; V12-F16 PolarHBondContact O-N 3.25Å; F16-N18 VanDerWaalsContact C-N 3.3Å; F16-E19 PolarHBondContact O-N 3.38Å; F16-L20 PolarHBondContact O-N 3.46Å; F16-L20 VanDerWaalsContact O-N 3.08Å
17	A	53.1	Low	61.6	Low	53 Å²	53	72.6 Å²	72.6	44%	0.438	40%	0.404	S	S	.	.	H	α-helix	trans	-64.4	-36.7	171.7	0	0	0	0	0	111.1	A13 T21	A13-A17 WeakPolarHBondContact O-CB 3.18Å; A13-A17 PolarHBondContact O-N 3.3Å; A17-T21 WeakPolarHBondContact O-CB 3.41Å; A17-T21 PolarHBondContact O-N 2.05Å; A17-T21 PolarHBondContact O-OG1 3.06Å
18	N	62.4	Low	63.4	Low	99 Å²	99	70.1 Å²	70.1	53%	0.529	39%	0.392	S	S	.	.	H	α-helix	trans	-69.4	-35	175.2	-77	-28	0	0	0	111.7	E14 T15 F16 R22	E14-N18 WeakPolarHBondContact O-CA 3.48Å; E14-N18 WeakPolarHBondContact O-CB 3.43Å; E14-N18 PolarHBondContact O-N 2.9Å; E14-N18 PolarHBondContact O-ND2 3Å; T15-N18 PolarHBondContact O-N 3.24Å; F16-N18 VanDerWaalsContact C-N 3.3Å; N18-R22 WeakPolarHBondContact O-CB 3.37Å; N18-R22 PolarHBondContact O-N 3.45Å
19	E	67.9	Low	65.2	Low	67 Å²	67	72 Å²	72	31%	0.313	39%	0.393	S	S	.	.	H	α-helix	trans	-68.2	-49.5	176.2	-165.8	-178.1	176.9	0	0	110.8	T15 F16 T21 R22 C23	T15-E19 WeakPolarHBondContact O-CB 3.33Å; T15-E19 PolarHBondContact O-N 3.46Å; F16-E19 PolarHBondContact O-N 3.38Å; E19-T21 VanDerWaalsContact C-N 3.33Å; E19-T21 PolarHBondContact O-N 3.21Å; E19-R22 PolarHBondContact O-N 3.11Å; E19-C23 WeakPolarHBondContact O-CB 3.43Å; E19-C23 PolarHBondContact O-N 2.85Å; E19-C23 PolarHBondContact O-SG 2.99Å
20	L	71.9	Confident	66.7	Low	83 Å²	83	71.7 Å²	71.7	44%	0.435	38%	0.382	S	S	.	.	H	α-helix	trans	-61.5	-41.6	175.6	-110.8	78.5	0	0	0	112.1	F16 C23 C24 A52	F16-L20 PolarHBondContact O-N 3.46Å; F16-L20 VanDerWaalsContact O-N 3.08Å; L20-C23 PolarHBondContact O-N 3.16Å; L20-C24 WeakPolarHBondContact O-CB 3.21Å; L20-C24 PolarHBondContact O-N 3.49Å; L20-A52 HydrophobicContact CG-CB 4.04Å
21	T	78.3	Confident	68.2	Low	91 Å²	91	66 Å²	66	56%	0.558	36%	0.357	S	S	*	.	H	α-helix	trans	-66.4	-40.6	178	-56.5	0	0	0	0	111.2	A17 E19 A25	A17-T21 WeakPolarHBondContact O-CB 3.41Å; A17-T21 PolarHBondContact O-N 2.05Å; A17-T21 PolarHBondContact O-OG1 3.06Å; E19-T21 VanDerWaalsContact C-N 3.33Å; E19-T21 PolarHBondContact O-N 3.21Å; T21-A25 VanDerWaalsContact O-CB 3.28Å; T21-A25 WeakPolarHBondContact O-CB 3.43Å; T21-A25 PolarHBondContact O-N 3.41Å
22	R	80.8	Confident	70	Confident	134 Å²	134	69 Å²	69	51%	0.506	37%	0.367	S	S	.	.	H	α-helix	trans	-64.8	-43.7	174.4	-168.8	-176.6	89.7	-179.3	6.1	111.5	N18 E19 A25 G26 E43	N18-R22 WeakPolarHBondContact O-CB 3.37Å; N18-R22 PolarHBondContact O-N 3.45Å; E19-R22 PolarHBondContact O-N 3.11Å; R22-A25 PolarHBondContact O-N 2.86Å; R22-G26 PolarHBondContact O-N 2.68Å; R22-E43 PolarHBondContact NH2-O 2.85Å
23	C	80.4	Confident	71.3	Confident	2 Å²	2	72 Å²	72	1%	0.014	38%	0.38	C	S	.	.	H	α-helix	trans	-66.4	-42.2	177.9	-64	0	0	0	0	112	E19 L20 G26 G27 C49 A52 A53	E19-C23 WeakPolarHBondContact O-CB 3.43Å; E19-C23 PolarHBondContact O-N 2.85Å; E19-C23 PolarHBondContact O-SG 2.99Å; L20-C23 PolarHBondContact O-N 3.16Å; C23-G26 PolarHBondContact O-N 3.45Å; C23-G27 PolarHBondContact O-N 3.23Å; C23-C49 HydrophobicContact CB-CB 3.9Å; C23-C49 WeakPolarHBondContact CB-O 3.09Å; C23-C49 WeakPolarHBondContact CB-SG 3.44Å; C23-C49 WeakPolarHBondContact SG-CB 3.41Å; C23-C49 CovalentContact SG-SG 2.02Å; C23-C49 PolarHBondContact SG-SG 3.22Å; C23-A52 HydrophobicContact CB-CB 4.31Å; C23-A53 VanDerWaalsContact O-CA 3.29Å; C23-A53 WeakPolarHBondContact O-CA 3.09Å; C23-A53 VanDerWaalsContact O-CB 3.23Å; C23-A53 WeakPolarHBondContact O-CB 3.04Å
24	C	80.6	Confident	72.8	Confident	37 Å²	37	71.5 Å²	71.5	25%	0.25	37%	0.373	C	S	.	.	H	α-helix	trans	-59.3	-46.9	171.9	177.1	0	0	0	0	111.4	L20 G26 G27 T28 C56	L20-C24 WeakPolarHBondContact O-CB 3.21Å; L20-C24 PolarHBondContact O-N 3.49Å; C24-G26 VanDerWaalsContact C-N 3.29Å; C24-G26 PolarHBondContact O-N 2.84Å; C24-G27 WeakPolarHBondContact O-CA 2.99Å; C24-G27 PolarHBondContact O-N 3.23Å; C24-G27 VanDerWaalsContact O-N 3.11Å; C24-T28 PolarHBondContact O-N 3.09Å; C24-T28 PolarHBondContact O-OG1 3.15Å; C24-C56 VanDerWaalsContact CA-SG 3.59Å; C24-C56 HydrophobicContact CB-CB 3.85Å; C24-C56 WeakPolarHBondContact CB-SG 3.22Å; C24-C56 WeakPolarHBondContact O-CB 3.04Å; C24-C56 WeakPolarHBondContact SG-CB 3.09Å; C24-C56 CovalentContact SG-SG 2.02Å; C24-C56 PolarHBondContact SG-SG 3.48Å
25	A	83.2	Confident	74.2	Confident	46 Å²	46	72.6 Å²	72.6	38%	0.38	38%	0.382	S	S	.	.	H	α-helix	trans	-61.4	-36.9	175.1	0	0	0	0	0	112.3	T21 R22 T28 R29	T21-A25 VanDerWaalsContact O-CB 3.28Å; T21-A25 WeakPolarHBondContact O-CB 3.43Å; T21-A25 PolarHBondContact O-N 3.41Å; R22-A25 PolarHBondContact O-N 2.86Å; A25-T28 PolarHBondContact O-N 3.5Å; A25-R29 VanDerWaalsContact O-CB 3.32Å; A25-R29 WeakPolarHBondContact O-CB 3.34Å; A25-R29 PolarHBondContact O-N 2.81Å
26	G	81.9	Confident	75.3	Confident	15 Å²	15	71.2 Å²	71.2	16%	0.155	37%	0.373	C	S	.	.	H	α-helix	trans	-61.4	-43.7	171.6	0	0	0	0	0	112.4	R22 C23 C24 R29 H30	R22-G26 PolarHBondContact O-N 2.68Å; C23-G26 PolarHBondContact O-N 3.45Å; C24-G26 VanDerWaalsContact C-N 3.29Å; C24-G26 PolarHBondContact O-N 2.84Å; G26-R29 PolarHBondContact O-N 3.09Å; G26-H30 WeakPolarHBondContact O-CB 3.26Å; G26-H30 PolarHBondContact O-N 2.04Å
27	G	81.1	Confident	76.3	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-60.3	-47	173.4	0	0	0	0	0	113.5	C23 C24 R29 H30 F31 A53 C57	C23-G27 PolarHBondContact O-N 3.23Å; C24-G27 WeakPolarHBondContact O-CA 2.99Å; C24-G27 PolarHBondContact O-N 3.23Å; C24-G27 VanDerWaalsContact O-N 3.11Å; G27-R29 PolarHBondContact O-N 3.31Å; G27-H30 WeakPolarHBondContact O-CB 3.06Å; G27-H30 PolarHBondContact O-N 3.01Å; G27-F31 PolarHBondContact O-N 3.11Å; G27-F31 VanDerWaalsContact O-N 3.09Å; G27-A53 VanDerWaalsContact CA-O 3.24Å; G27-A53 WeakPolarHBondContact CA-O 3.26Å; G27-C57 WeakPolarHBondContact O-CB 3.28Å
28	T	82.9	Confident	77.2	Confident	39 Å²	39	67.1 Å²	67.1	24%	0.239	36%	0.358	C	S	.	.	H	α-helix	trans	-63.3	-40	175.4	-63.4	0	0	0	0	112	C24 A25 F31 K32 S60	C24-T28 PolarHBondContact O-N 3.09Å; C24-T28 PolarHBondContact O-OG1 3.15Å; A25-T28 PolarHBondContact O-N 3.5Å; T28-F31 PolarHBondContact O-N 3.06Å; T28-K32 WeakPolarHBondContact O-CG 3.01Å; T28-K32 PolarHBondContact O-N 2.98Å; T28-S60 PolarHBondContact OG1-OG 2.97Å
29	R	84.2	Confident	77.4	Confident	132 Å²	132	67.5 Å²	67.5	50%	0.498	37%	0.368	S	S	.	.	H	α-helix	trans	-66.3	-40	176.1	-170.3	-174	-62	152.6	0.8	111.6	A25 G26 G27 F31 K32 N33 E43	A25-R29 VanDerWaalsContact O-CB 3.32Å; A25-R29 WeakPolarHBondContact O-CB 3.34Å; A25-R29 PolarHBondContact O-N 2.81Å; G26-R29 PolarHBondContact O-N 3.09Å; G27-R29 PolarHBondContact O-N 3.31Å; R29-F31 VanDerWaalsContact C-N 3.34Å; R29-F31 PolarHBondContact O-N 3.03Å; R29-K32 PolarHBondContact O-N 3Å; R29-N33 PolarHBondContact O-N 3.33Å; R29-E43 IonicContact NH1-OE1 2.88Å; R29-E43 PolarHBondContact NH1-OE1 2.97Å; R29-E43 VanDerWaalsContact NH1-OE1 3.15Å
30	H	78.1	Confident	77.3	Confident	49 Å²	49	65.8 Å²	65.8	23%	0.227	36%	0.361	C	S	.	.	H	α-helix	trans	-58.2	-46.9	175.1	-174.8	87.9	0	0	0	111.1	G26 G27 N33 S34 T36 S38	G26-H30 WeakPolarHBondContact O-CB 3.26Å; G26-H30 PolarHBondContact O-N 2.04Å; G27-H30 WeakPolarHBondContact O-CB 3.06Å; G27-H30 PolarHBondContact O-N 3.01Å; H30-N33 PolarHBondContact O-N 2.78Å; H30-S34 PolarHBondContact CD2-OG 3.16Å; H30-S34 PolarHBondContact NE2-OG 3.32Å; H30-S34 WeakPolarHBondContact O-CB 3.46Å; H30-S34 PolarHBondContact O-N 3.5Å; H30-S34 PolarHBondContact O-OG 3.02Å; H30-T36 PolarHBondContact CD2-O 2.97Å; H30-S38 PolarHBondContact NE2-O 3.05Å; H30-S38 VanDerWaalsContact NE2-O 3.11Å
31	F	78.9	Confident	76.8	Confident	9 Å²	9	71.1 Å²	71.1	4%	0.039	38%	0.38	C	S	.	.	H	α-helix	trans	-59.3	-50.4	174.4	179	-107	0	0	0	111.8	G27 T28 R29 N33 S34 N35 S60 L61 N64	G27-F31 PolarHBondContact O-N 3.11Å; G27-F31 VanDerWaalsContact O-N 3.09Å; T28-F31 PolarHBondContact O-N 3.06Å; R29-F31 VanDerWaalsContact C-N 3.34Å; R29-F31 PolarHBondContact O-N 3.03Å; F31-N33 PolarHBondContact O-N 2.79Å; F31-N33 VanDerWaalsContact O-N 3.11Å; F31-S34 PolarHBondContact O-N 3.45Å; F31-N35 WeakPolarHBondContact O-CA 3.24Å; F31-N35 PolarHBondContact O-N 2.9Å; F31-S60 VanDerWaalsContact CD1-CB 3.44Å; F31-S60 VanDerWaalsContact CE1-O 3.29Å; F31-S60 WeakPolarHBondContact CE1-O 3.42Å; F31-L61 HydrophobicContact CD2-CB 3.97Å; F31-L61 HydrophobicContact CD2-CD1 4.28Å; F31-L61 HydrophobicContact CE2-CB 3.7Å; F31-L61 HydrophobicContact CE2-CD1 3.4Å; F31-L61 HydrophobicContact CE2-CG 4.15Å; F31-L61 HydrophobicContact CZ-CB 4.17Å; F31-L61 HydrophobicContact CZ-CD1 3.98Å; F31-N64 HydrophobicContact CE1-CB 3.67Å; F31-N64 HydrophobicContact CZ-CB 3.74Å
32	K	81.6	Confident	75.8	Confident	154 Å²	154	67.9 Å²	67.9	67%	0.67	36%	0.362	S	S	*	.	H	α-helix	trans	-57.1	-29.7	180	-74.6	-177.9	177.6	-173	0	113.9	T28 R29	T28-K32 WeakPolarHBondContact O-CG 3.01Å; T28-K32 PolarHBondContact O-N 2.98Å; R29-K32 PolarHBondContact O-N 3Å
33	N	79.8	Confident	74.7	Confident	136 Å²	136	66.1 Å²	66.1	73%	0.727	36%	0.359	S	S	*	.	H	α-helix	trans	-91.1	-27.7	-178.6	-70.5	-8.4	0	0	0	113.7	R29 H30 F31	R29-N33 PolarHBondContact O-N 3.33Å; H30-N33 PolarHBondContact O-N 2.78Å; F31-N33 PolarHBondContact O-N 2.79Å; F31-N33 VanDerWaalsContact O-N 3.11Å
34	S	75.1	Confident	73.6	Confident	49 Å²	49	66.7 Å²	66.7	34%	0.343	37%	0.365	S	S	.	.	H	α-helix	trans	-118.8	-11.1	-169.8	67.2	0	0	0	0	114.4	H30 F31 T36	H30-S34 PolarHBondContact CD2-OG 3.16Å; H30-S34 PolarHBondContact NE2-OG 3.32Å; H30-S34 WeakPolarHBondContact O-CB 3.46Å; H30-S34 PolarHBondContact O-N 3.5Å; H30-S34 PolarHBondContact O-OG 3.02Å; F31-S34 PolarHBondContact O-N 3.45Å; S34-T36 PolarHBondContact O-N 2.81Å; S34-T36 PolarHBondContact OG-N 2.95Å; S34-T36 PolarHBondContact OG-O 3.13Å
35	N	73.7	Confident	72.5	Confident	116 Å²	116	71.9 Å²	71.9	62%	0.62	40%	0.396	S	S	*	.	S	Bend	trans	50.5	23	-171.4	-69.1	-12.1	0	0	0	113.7	F31	F31-N35 WeakPolarHBondContact O-CA 3.24Å; F31-N35 PolarHBondContact O-N 2.9Å
36	T	74.7	Confident	71.8	Confident	50 Å²	50	71.8 Å²	71.8	31%	0.307	39%	0.392	S	S	.	.			trans	-143.4	157.5	177.1	-178.6	0	0	0	0	110.4	H30 S34 S38	H30-T36 PolarHBondContact CD2-O 2.97Å; S34-T36 PolarHBondContact O-N 2.81Å; S34-T36 PolarHBondContact OG-N 2.95Å; S34-T36 PolarHBondContact OG-O 3.13Å; T36-S38 PolarHBondContact OG1-N 3.38Å; T36-S38 VanDerWaalsContact OG1-N 3.1Å; T36-S38 PolarHBondContact OG1-OG 2.88Å; T36-S38 VanDerWaalsContact OG1-OG 3.13Å
37	C	72.1	Confident	70.9	Confident	27 Å²	27	77.5 Å²	77.5	18%	0.182	42%	0.417	C	S	.	.			trans	-106.5	9.5	171.3	-64.8	0	0	0	0	113	I40 C57 L58	C37-I40 HydrophobicContact CB-CD1 4.2Å; C37-C57 WeakPolarHBondContact CA-SG 3.31Å; C37-C57 HydrophobicContact CB-CB 3.96Å; C37-C57 WeakPolarHBondContact CB-SG 3.47Å; C37-C57 WeakPolarHBondContact SG-CB 3.03Å; C37-C57 PolarHBondContact SG-O 2.86Å; C37-C57 CovalentContact SG-SG 2.05Å; C37-C57 PolarHBondContact SG-SG 3.47Å; C37-L58 HydrophobicContact CB-CD2 4.43Å; C37-L58 PolarHBondContact SG-N 2.71Å
38	S	71.7	Confident	70.4	Confident	75 Å²	75	81.3 Å²	81.3	52%	0.524	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	142.3	170.3	-51.9	0	0	0	0	110.4	H30 T36 I40	H30-S38 PolarHBondContact NE2-O 3.05Å; H30-S38 VanDerWaalsContact NE2-O 3.11Å; T36-S38 PolarHBondContact OG1-N 3.38Å; T36-S38 VanDerWaalsContact OG1-N 3.1Å; T36-S38 PolarHBondContact OG1-OG 2.88Å; T36-S38 VanDerWaalsContact OG1-OG 3.13Å; S38-I40 PolarHBondContact O-N 3.03Å
39	S	66.4	Low	70.1	Confident	106 Å²	106	79.5 Å²	79.5	74%	0.741	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.7	37.5	170	-51.8	0	0	0	0	115.2	K41	S39-K41 PolarHBondContact O-N 2.67Å
40	I	65.8	Low	69.6	Low	32 Å²	32	77.6 Å²	77.6	16%	0.164	43%	0.426	C	S	.	.			trans	-61.6	109.4	173.9	-67.2	167.5	0	0	0	109.3	C37 S38 S42 A53 C57	C37-I40 HydrophobicContact CB-CD1 4.2Å; S38-I40 PolarHBondContact O-N 3.03Å; I40-S42 PolarHBondContact O-N 2.81Å; I40-A53 HydrophobicContact CG2-CB 3.88Å; I40-C57 HydrophobicContact CD1-CB 3.45Å; I40-C57 VanDerWaalsContact CD1-CB 3.45Å
41	K	61.5	Low	69.4	Low	194 Å²	194	83.4 Å²	83.4	84%	0.843	45%	0.446	S	S	*	.			trans	-88.6	98	167.5	-67.1	-175.9	-179.8	-179.1	0	107.2	S39	S39-K41 PolarHBondContact O-N 2.67Å
42	S	58	Low	69.4	Low	24 Å²	24	83.6 Å²	83.6	17%	0.168	45%	0.449	C	S	.	.			trans	-62.1	143.4	179.1	56.1	0	0	0	0	111.3	I40 G44 Q50	I40-S42 PolarHBondContact O-N 2.81Å; S42-G44 PolarHBondContact O-N 3.36Å; S42-G44 PolarHBondContact OG-O 3.39Å; S42-Q50 WeakPolarHBondContact OG-CG 3.45Å
43	E	57.6	Low	69.1	Low	97 Å²	97	76.3 Å²	76.3	45%	0.453	42%	0.418	S	S	.	.	S	Bend	trans	-69.7	10.3	173.1	-66	-178.1	172.3	0	0	113.2	R22 R29	R22-E43 PolarHBondContact NH2-O 2.85Å; R29-E43 IonicContact NH1-OE1 2.88Å; R29-E43 PolarHBondContact NH1-OE1 2.97Å; R29-E43 VanDerWaalsContact NH1-OE1 3.15Å
44	G	57	Low	68.9	Low	13 Å²	13	72.1 Å²	72.1	13%	0.134	40%	0.399	C	S	.	.	S	Bend	trans	-146.7	153.5	179.9	0	0	0	0	0	111.7	S42	S42-G44 PolarHBondContact O-N 3.36Å; S42-G44 PolarHBondContact OG-O 3.39Å
45	T	56.4	Low	68.8	Low	146 Å²	146	75.2 Å²	75.2	90%	0.896	41%	0.41	S	S	*	.	S	Bend	trans	-89.8	-9.1	-173.4	50.7	0	0	0	0	114.1
46	S	68.9	Low	69.1	Low	44 Å²	44	70.5 Å²	70.5	31%	0.308	39%	0.386	S	S	.	.	S	Bend	trans	-76.2	139	180	178.3	0	0	0	0	112.4	T48 C49 Q50	S46-T48 PolarHBondContact O-N 3.42Å; S46-T48 PolarHBondContact OG-N 3.45Å; S46-T48 PolarHBondContact OG-OG1 2.03Å; S46-C49 WeakPolarHBondContact O-CB 3.34Å; S46-C49 PolarHBondContact O-N 2.89Å; S46-Q50 PolarHBondContact O-N 3.35Å; S46-Q50 VanDerWaalsContact O-N 3.12Å
47	M	64.4	Low	69.3	Low	136 Å²	136	68.1 Å²	68.1	67%	0.67	37%	0.372	S	S	*	.	H	α-helix	trans	-57.6	-30.7	172.7	-74.5	-146.9	-57.3	0	0	112.9	R51	M47-R51 WeakPolarHBondContact O-CG 3.49Å; M47-R51 PolarHBondContact O-N 2.7Å; M47-R51 VanDerWaalsContact O-N 3.09Å
48	T	70.6	Confident	69.5	Low	79 Å²	79	71.1 Å²	71.1	49%	0.485	39%	0.385	S	S	.	.	H	α-helix	trans	-69.9	-36.4	175.6	38.6	0	0	0	0	112.3	S46 R51 A52	S46-T48 PolarHBondContact O-N 3.42Å; S46-T48 PolarHBondContact OG-N 3.45Å; S46-T48 PolarHBondContact OG-OG1 2.03Å; T48-R51 PolarHBondContact O-N 2.71Å; T48-A52 WeakPolarHBondContact O-CB 3.2Å; T48-A52 PolarHBondContact O-N 2.93Å
49	C	74.8	Confident	69.9	Low	1 Å²	1	75 Å²	75	1%	0.007	39%	0.389	C	S	.	.	H	α-helix	trans	-66.5	-43	174.4	173.7	0	0	0	0	111.7	C23 S46 R51 A52 A53	C23-C49 HydrophobicContact CB-CB 3.9Å; C23-C49 WeakPolarHBondContact CB-O 3.09Å; C23-C49 WeakPolarHBondContact CB-SG 3.44Å; C23-C49 WeakPolarHBondContact SG-CB 3.41Å; C23-C49 CovalentContact SG-SG 2.02Å; C23-C49 PolarHBondContact SG-SG 3.22Å; S46-C49 WeakPolarHBondContact O-CB 3.34Å; S46-C49 PolarHBondContact O-N 2.89Å; C49-R51 PolarHBondContact O-N 2.91Å; C49-A52 PolarHBondContact O-N 2.9Å; C49-A53 WeakPolarHBondContact O-CB 3.32Å; C49-A53 PolarHBondContact O-N 3.41Å
50	Q	74.1	Confident	70.6	Confident	92 Å²	92	71 Å²	71	43%	0.43	36%	0.36	S	S	.	.	H	α-helix	trans	-61.3	-42.3	175.4	-79.5	-179.4	-10.5	0	0	112.6	S42 S46 S54	S42-Q50 WeakPolarHBondContact OG-CG 3.45Å; S46-Q50 PolarHBondContact O-N 3.35Å; S46-Q50 VanDerWaalsContact O-N 3.12Å; Q50-S54 WeakPolarHBondContact O-CB 3.21Å; Q50-S54 PolarHBondContact O-N 3.22Å; Q50-S54 PolarHBondContact O-OG 3.48Å
51	R	74.6	Confident	71.1	Confident	171 Å²	171	70.8 Å²	70.8	65%	0.645	36%	0.36	S	S	*	.	H	α-helix	trans	-64.5	-45.9	175.1	-73.7	-179.9	179.4	-166.7	0.2	111.7	M47 T48 C49 A53 S54 I55	M47-R51 WeakPolarHBondContact O-CG 3.49Å; M47-R51 PolarHBondContact O-N 2.7Å; M47-R51 VanDerWaalsContact O-N 3.09Å; T48-R51 PolarHBondContact O-N 2.71Å; C49-R51 PolarHBondContact O-N 2.91Å; R51-A53 PolarHBondContact O-N 2.8Å; R51-S54 PolarHBondContact O-N 3.43Å; R51-I55 WeakPolarHBondContact O-CB 3.43Å; R51-I55 VanDerWaalsContact O-CG1 3.26Å; R51-I55 WeakPolarHBondContact O-CG1 3.15Å; R51-I55 PolarHBondContact O-N 2.93Å
52	A	78.2	Confident	71.5	Confident	14 Å²	14	65.9 Å²	65.9	12%	0.116	34%	0.342	C	S	.	.	H	α-helix	trans	-60.8	-43.3	177.5	0	0	0	0	0	112.4	L20 C23 T48 C49 C56	L20-A52 HydrophobicContact CG-CB 4.04Å; C23-A52 HydrophobicContact CB-CB 4.31Å; T48-A52 WeakPolarHBondContact O-CB 3.2Å; T48-A52 PolarHBondContact O-N 2.93Å; C49-A52 PolarHBondContact O-N 2.9Å; A52-C56 WeakPolarHBondContact O-CB 3.5Å; A52-C56 PolarHBondContact O-N 3.36Å; A52-C56 PolarHBondContact O-SG 2.04Å; A52-C56 VanDerWaalsContact O-SG 3.38Å
53	A	76.3	Confident	72.6	Confident	1 Å²	1	66.8 Å²	66.8	1%	0.008	35%	0.345	C	S	.	.	H	α-helix	trans	-62.8	-42.3	175	0	0	0	0	0	112.1	C23 G27 I40 C49 R51 C57	C23-A53 VanDerWaalsContact O-CA 3.29Å; C23-A53 WeakPolarHBondContact O-CA 3.09Å; C23-A53 VanDerWaalsContact O-CB 3.23Å; C23-A53 WeakPolarHBondContact O-CB 3.04Å; G27-A53 VanDerWaalsContact CA-O 3.24Å; G27-A53 WeakPolarHBondContact CA-O 3.26Å; I40-A53 HydrophobicContact CG2-CB 3.88Å; C49-A53 WeakPolarHBondContact O-CB 3.32Å; C49-A53 PolarHBondContact O-N 3.41Å; R51-A53 PolarHBondContact O-N 2.8Å; A53-C57 VanDerWaalsContact O-CB 3.31Å; A53-C57 WeakPolarHBondContact O-CB 2.99Å; A53-C57 PolarHBondContact O-N 3.26Å
54	S	74.4	Confident	73.8	Confident	47 Å²	47	66.1 Å²	66.1	33%	0.329	35%	0.345	S	S	.	.	H	α-helix	trans	-65.8	-45.2	179.2	-57	0	0	0	0	112.4	Q50 R51 C57 L58	Q50-S54 WeakPolarHBondContact O-CB 3.21Å; Q50-S54 PolarHBondContact O-N 3.22Å; Q50-S54 PolarHBondContact O-OG 3.48Å; R51-S54 PolarHBondContact O-N 3.43Å; S54-C57 PolarHBondContact O-N 3.45Å; S54-L58 WeakPolarHBondContact O-CG 3.41Å; S54-L58 PolarHBondContact O-N 2.03Å
55	I	74.6	Confident	74.7	Confident	114 Å²	114	66.1 Å²	66.1	59%	0.585	34%	0.343	S	S	*	.	H	α-helix	trans	-61.5	-46.6	177.7	-68.8	165.1	0	0	0	110.6	R51 L58 R59	R51-I55 WeakPolarHBondContact O-CB 3.43Å; R51-I55 VanDerWaalsContact O-CG1 3.26Å; R51-I55 WeakPolarHBondContact O-CG1 3.15Å; R51-I55 PolarHBondContact O-N 2.93Å; I55-L58 PolarHBondContact O-N 2.65Å; I55-R59 WeakPolarHBondContact O-CB 2.99Å; I55-R59 PolarHBondContact O-N 3.31Å
56	C	79.1	Confident	75.6	Confident	18 Å²	18	59.4 Å²	59.4	12%	0.122	30%	0.302	C	S	.	.	H	α-helix	trans	-71.9	-30	-179.3	-66.7	0	0	0	0	113.4	C24 A52 S60	C24-C56 VanDerWaalsContact CA-SG 3.59Å; C24-C56 HydrophobicContact CB-CB 3.85Å; C24-C56 WeakPolarHBondContact CB-SG 3.22Å; C24-C56 WeakPolarHBondContact O-CB 3.04Å; C24-C56 WeakPolarHBondContact SG-CB 3.09Å; C24-C56 CovalentContact SG-SG 2.02Å; C24-C56 PolarHBondContact SG-SG 3.48Å; A52-C56 WeakPolarHBondContact O-CB 3.5Å; A52-C56 PolarHBondContact O-N 3.36Å; A52-C56 PolarHBondContact O-SG 2.04Å; A52-C56 VanDerWaalsContact O-SG 3.38Å; C56-S60 PolarHBondContact O-N 2.76Å; C56-S60 VanDerWaalsContact O-N 3.09Å; C56-S60 PolarHBondContact O-OG 2.66Å
57	C	78.5	Confident	76.4	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-63.1	-51.6	169.4	-173.1	0	0	0	0	110.9	G27 C37 I40 A53 S54 R59 S60 L61	G27-C57 WeakPolarHBondContact O-CB 3.28Å; C37-C57 WeakPolarHBondContact CA-SG 3.31Å; C37-C57 HydrophobicContact CB-CB 3.96Å; C37-C57 WeakPolarHBondContact CB-SG 3.47Å; C37-C57 WeakPolarHBondContact SG-CB 3.03Å; C37-C57 PolarHBondContact SG-O 2.86Å; C37-C57 CovalentContact SG-SG 2.05Å; C37-C57 PolarHBondContact SG-SG 3.47Å; I40-C57 HydrophobicContact CD1-CB 3.45Å; I40-C57 VanDerWaalsContact CD1-CB 3.45Å; A53-C57 VanDerWaalsContact O-CB 3.31Å; A53-C57 WeakPolarHBondContact O-CB 2.99Å; A53-C57 PolarHBondContact O-N 3.26Å; S54-C57 PolarHBondContact O-N 3.45Å; C57-R59 VanDerWaalsContact C-N 3.31Å; C57-R59 PolarHBondContact O-N 2.04Å; C57-S60 WeakPolarHBondContact O-CA 3.36Å; C57-S60 WeakPolarHBondContact O-CB 3Å; C57-S60 PolarHBondContact O-N 2.9Å; C57-L61 PolarHBondContact O-N 2.92Å
58	L	76.3	Confident	77.3	Confident	89 Å²	89	55.6 Å²	55.6	47%	0.466	28%	0.284	S	S	.	.	H	α-helix	trans	-59.3	-42	179.1	-77.2	165.8	0	0	0	111.8	C37 S54 I55 S60 L61 L62	C37-L58 HydrophobicContact CB-CD2 4.43Å; C37-L58 PolarHBondContact SG-N 2.71Å; S54-L58 WeakPolarHBondContact O-CG 3.41Å; S54-L58 PolarHBondContact O-N 2.03Å; I55-L58 PolarHBondContact O-N 2.65Å; L58-S60 VanDerWaalsContact C-N 3.28Å; L58-S60 PolarHBondContact O-N 3.19Å; L58-L61 HydrophobicContact CD2-CD2 4.45Å; L58-L61 WeakPolarHBondContact O-CB 3.39Å; L58-L61 PolarHBondContact O-N 3.19Å; L58-L62 VanDerWaalsContact O-CG 3.27Å; L58-L62 WeakPolarHBondContact O-CG 3.47Å; L58-L62 PolarHBondContact O-N 2.75Å
59	R	80.8	Confident	77.7	Confident	158 Å²	158	51.8 Å²	51.8	60%	0.596	26%	0.261	S	S	*	.	H	α-helix	trans	-58.6	-40.3	173.1	-175.4	173.6	179.4	157.4	1.5	112.4	I55 C57 L62 D63	I55-R59 WeakPolarHBondContact O-CB 2.99Å; I55-R59 PolarHBondContact O-N 3.31Å; C57-R59 VanDerWaalsContact C-N 3.31Å; C57-R59 PolarHBondContact O-N 2.04Å; R59-L62 PolarHBondContact O-N 3.38Å; R59-D63 WeakPolarHBondContact O-CB 3.5Å; R59-D63 PolarHBondContact O-N 2.78Å
60	S	81.8	Confident	78.2	Confident	20 Å²	20	51.8 Å²	51.8	14%	0.14	26%	0.26	C	S	.	.	H	α-helix	trans	-68.7	-36.4	178.5	-52.4	0	0	0	0	112.1	T28 F31 C56 C57 L58 N64	T28-S60 PolarHBondContact OG1-OG 2.97Å; F31-S60 VanDerWaalsContact CD1-CB 3.44Å; F31-S60 VanDerWaalsContact CE1-O 3.29Å; F31-S60 WeakPolarHBondContact CE1-O 3.42Å; C56-S60 PolarHBondContact O-N 2.76Å; C56-S60 VanDerWaalsContact O-N 3.09Å; C56-S60 PolarHBondContact O-OG 2.66Å; C57-S60 WeakPolarHBondContact O-CA 3.36Å; C57-S60 WeakPolarHBondContact O-CB 3Å; C57-S60 PolarHBondContact O-N 2.9Å; L58-S60 VanDerWaalsContact C-N 3.28Å; L58-S60 PolarHBondContact O-N 3.19Å; S60-N64 VanDerWaalsContact O-CB 3.31Å; S60-N64 WeakPolarHBondContact O-CB 3.4Å; S60-N64 PolarHBondContact O-N 2.81Å
61	L	76.2	Confident	78.7	Confident	29 Å²	29	51 Å²	51	15%	0.152	26%	0.259	C	S	.	.	H	α-helix	trans	-62.7	-47.1	172.4	175.6	72.1	0	0	0	111.7	F31 C57 L58 N64 A65 L86	F31-L61 HydrophobicContact CD2-CB 3.97Å; F31-L61 HydrophobicContact CD2-CD1 4.28Å; F31-L61 HydrophobicContact CE2-CB 3.7Å; F31-L61 HydrophobicContact CE2-CD1 3.4Å; F31-L61 HydrophobicContact CE2-CG 4.15Å; F31-L61 HydrophobicContact CZ-CB 4.17Å; F31-L61 HydrophobicContact CZ-CD1 3.98Å; C57-L61 PolarHBondContact O-N 2.92Å; L58-L61 HydrophobicContact CD2-CD2 4.45Å; L58-L61 WeakPolarHBondContact O-CB 3.39Å; L58-L61 PolarHBondContact O-N 3.19Å; L61-N64 PolarHBondContact O-N 2.86Å; L61-A65 PolarHBondContact O-N 2.66Å; L61-L86 HydrophobicContact CD2-CD2 4.36Å
62	L	69.6	Low	78.9	Confident	91 Å²	91	44.2 Å²	44.2	48%	0.476	24%	0.235	S	C	.	.	H	α-helix	trans	-64.1	-45.7	178.5	-65.4	165.1	0	0	0	111.6	L58 R59 N64 A65 C66 L90	L58-L62 VanDerWaalsContact O-CG 3.27Å; L58-L62 WeakPolarHBondContact O-CG 3.47Å; L58-L62 PolarHBondContact O-N 2.75Å; R59-L62 PolarHBondContact O-N 3.38Å; L62-N64 VanDerWaalsContact C-N 3.34Å; L62-N64 PolarHBondContact O-N 3.48Å; L62-A65 PolarHBondContact O-N 3.01Å; L62-C66 PolarHBondContact O-N 2.87Å; L62-C66 VanDerWaalsContact O-N 3.17Å; L62-L90 HydrophobicContact CB-CD2 3.95Å; L62-L90 HydrophobicContact CD2-CD2 3.32Å; L62-L90 HydrophobicContact CG-CD2 4.23Å
63	D	80.1	Confident	79	Confident	43 Å²	43	43.5 Å²	43.5	23%	0.23	23%	0.23	C	C	.	.	H	α-helix	trans	-61.2	-42.1	177.3	-78.8	-7.2	0	0	0	111	R59 C66 D67 R123	R59-D63 WeakPolarHBondContact O-CB 3.5Å; R59-D63 PolarHBondContact O-N 2.78Å; D63-C66 PolarHBondContact O-N 2.9Å; D63-D67 PolarHBondContact O-N 3.12Å; D63-R123 VanDerWaalsContact CG-NH1 3.26Å; D63-R123 IonicContact OD1-CZ 3.6Å; D63-R123 IonicContact OD1-NH1 2.98Å; D63-R123 PolarHBondContact OD1-NH1 3.29Å; D63-R123 VanDerWaalsContact OD1-NH1 3.12Å; D63-R123 IonicContact OD1-NH2 3.37Å; D63-R123 PolarHBondContact OD1-NH2 3.4Å; D63-R123 IonicContact OD2-CZ 2.81Å; D63-R123 IonicContact OD2-NH1 2.89Å; D63-R123 PolarHBondContact OD2-NH1 3.23Å; D63-R123 IonicContact OD2-NH2 3.64Å
64	N	83.4	Confident	79	Confident	83 Å²	83	47.3 Å²	47.3	44%	0.444	25%	0.246	S	C	.	.	H	α-helix	trans	-65.1	-39.3	177.3	-176.2	-92.7	0	0	0	113.3	F31 S60 L61 L62 C66 D67 S68	F31-N64 HydrophobicContact CE1-CB 3.67Å; F31-N64 HydrophobicContact CZ-CB 3.74Å; S60-N64 VanDerWaalsContact O-CB 3.31Å; S60-N64 WeakPolarHBondContact O-CB 3.4Å; S60-N64 PolarHBondContact O-N 2.81Å; L61-N64 PolarHBondContact O-N 2.86Å; L62-N64 VanDerWaalsContact C-N 3.34Å; L62-N64 PolarHBondContact O-N 3.48Å; N64-C66 VanDerWaalsContact C-N 3.32Å; N64-C66 PolarHBondContact O-N 2.97Å; N64-D67 PolarHBondContact O-N 2.81Å; N64-S68 WeakPolarHBondContact O-CB 3.5Å; N64-S68 PolarHBondContact O-N 2.76Å
65	A	75.6	Confident	79	Confident	12 Å²	12	53.3 Å²	53.3	10%	0.099	27%	0.269	C	S	.	.	H	α-helix	trans	-61.8	-41	175.7	0	0	0	0	0	111.7	L61 L62 G69 L90 K91	L61-A65 PolarHBondContact O-N 2.66Å; L62-A65 PolarHBondContact O-N 3.01Å; A65-G69 PolarHBondContact O-N 3.11Å; A65-L90 HydrophobicContact CB-CD2 4.34Å; A65-K91 HydrophobicContact CB-CB 4.43Å
66	C	76.1	Confident	78.7	Confident	5 Å²	5	52.4 Å²	52.4	3%	0.034	26%	0.262	C	S	.	.	H	α-helix	trans	-74.2	-36.6	177.9	-76.3	0	0	0	0	113.9	L62 D63 N64 S68 G69 T70 C94	L62-C66 PolarHBondContact O-N 2.87Å; L62-C66 VanDerWaalsContact O-N 3.17Å; D63-C66 PolarHBondContact O-N 2.9Å; N64-C66 VanDerWaalsContact C-N 3.32Å; N64-C66 PolarHBondContact O-N 2.97Å; C66-S68 VanDerWaalsContact C-N 3.34Å; C66-G69 PolarHBondContact O-N 3.45Å; C66-T70 WeakPolarHBondContact O-CB 3.4Å; C66-T70 PolarHBondContact O-N 3.35Å; C66-T70 PolarHBondContact O-OG1 2.02Å; C66-C94 HydrophobicContact CB-CB 3.57Å; C66-C94 WeakPolarHBondContact CB-SG 3.01Å; C66-C94 WeakPolarHBondContact SG-CB 3.04Å; C66-C94 CovalentContact SG-SG 2.04Å; C66-C94 PolarHBondContact SG-SG 2.03Å
67	D	85.4	Confident	77.8	Confident	63 Å²	63	60.9 Å²	60.9	34%	0.337	30%	0.3	S	S	.	.	H	α-helix	trans	-60.5	-45.8	171.2	-78.9	-34.7	0	0	0	110.5	D63 N64 G69 T70 D71 K127	D63-D67 PolarHBondContact O-N 3.12Å; N64-D67 PolarHBondContact O-N 2.81Å; D67-G69 VanDerWaalsContact C-N 3.34Å; D67-G69 PolarHBondContact O-N 3.06Å; D67-T70 WeakPolarHBondContact O-CB 3.5Å; D67-T70 PolarHBondContact O-N 3.22Å; D67-D71 VanDerWaalsContact O-CG 3.29Å; D67-D71 PolarHBondContact O-N 3.12Å; D67-K127 IonicContact OD1-NZ 3.59Å; D67-K127 PolarHBondContact OD1-NZ 3.08Å
68	S	82.8	Confident	77.3	Confident	37 Å²	37	64.7 Å²	64.7	26%	0.259	33%	0.326	S	S	.	.	H	α-helix	trans	-63.9	-35.6	176.4	-175.5	0	0	0	0	113.2	N64 C66 I72 K91	N64-S68 WeakPolarHBondContact O-CB 3.5Å; N64-S68 PolarHBondContact O-N 2.76Å; C66-S68 VanDerWaalsContact C-N 3.34Å; S68-I72 WeakPolarHBondContact O-CG1 3.33Å; S68-I72 PolarHBondContact O-N 2.84Å; S68-K91 WeakPolarHBondContact OG-CE 3.48Å; S68-K91 PolarHBondContact OG-NZ 3.28Å
69	G	80.1	Confident	76.9	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-66.3	-41.1	173.1	0	0	0	0	0	112.4	A65 C66 D67 D71 I72 A73 K91 C95	A65-G69 PolarHBondContact O-N 3.11Å; C66-G69 PolarHBondContact O-N 3.45Å; D67-G69 VanDerWaalsContact C-N 3.34Å; D67-G69 PolarHBondContact O-N 3.06Å; G69-D71 VanDerWaalsContact C-N 3.34Å; G69-D71 PolarHBondContact O-N 3.46Å; G69-I72 PolarHBondContact O-N 2.83Å; G69-A73 PolarHBondContact O-N 2.05Å; G69-A73 VanDerWaalsContact O-N 3.08Å; G69-K91 WeakPolarHBondContact CA-O 3.15Å; G69-C95 VanDerWaalsContact O-CA 3.31Å; G69-C95 WeakPolarHBondContact O-CA 3.43Å; G69-C95 VanDerWaalsContact O-CB 3.24Å; G69-C95 WeakPolarHBondContact O-CB 3.32Å
70	T	83.8	Confident	75.9	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-61.1	-42.7	175	-56.9	0	0	0	0	111.3	C66 D67 A73 K74 S124 K127 C128	C66-T70 WeakPolarHBondContact O-CB 3.4Å; C66-T70 PolarHBondContact O-N 3.35Å; C66-T70 PolarHBondContact O-OG1 2.02Å; D67-T70 WeakPolarHBondContact O-CB 3.5Å; D67-T70 PolarHBondContact O-N 3.22Å; T70-A73 PolarHBondContact O-N 3.41Å; T70-K74 WeakPolarHBondContact O-CG 3.36Å; T70-K74 PolarHBondContact O-N 2.81Å; T70-K74 VanDerWaalsContact O-N 3.09Å; T70-S124 WeakPolarHBondContact OG1-CB 3.43Å; T70-S124 PolarHBondContact OG1-OG 3.13Å; T70-K127 HydrophobicContact CG2-CD 3.9Å; T70-K127 HydrophobicContact CG2-CG 4.37Å; T70-C128 WeakPolarHBondContact CG2-SG 3.13Å
71	D	84.6	Confident	74.5	Confident	75 Å²	75	59.9 Å²	59.9	40%	0.401	32%	0.323	S	S	.	.	H	α-helix	trans	-66.4	-39.4	180	-64.7	-25.4	0	0	0	111.8	D67 G69 A73 K74 E75	D67-D71 VanDerWaalsContact O-CG 3.29Å; D67-D71 PolarHBondContact O-N 3.12Å; G69-D71 VanDerWaalsContact C-N 3.34Å; G69-D71 PolarHBondContact O-N 3.46Å; D71-A73 PolarHBondContact O-N 2.68Å; D71-K74 WeakPolarHBondContact O-CB 3.49Å; D71-K74 PolarHBondContact O-N 3.09Å; D71-K74 VanDerWaalsContact O-N 3.1Å; D71-E75 PolarHBondContact O-N 3.4Å
72	I	79	Confident	73.3	Confident	29 Å²	29	65.4 Å²	65.4	15%	0.149	35%	0.353	C	S	.	.	H	α-helix	trans	-60	-46.7	172.6	-68.2	168	0	0	0	110.7	S68 G69 K74 E75 E76	S68-I72 WeakPolarHBondContact O-CG1 3.33Å; S68-I72 PolarHBondContact O-N 2.84Å; G69-I72 PolarHBondContact O-N 2.83Å; I72-K74 PolarHBondContact O-N 2.86Å; I72-E75 PolarHBondContact O-N 3.16Å; I72-E75 VanDerWaalsContact O-N 3.13Å; I72-E76 HydrophobicContact CG2-CB 4.23Å; I72-E76 HydrophobicContact CG2-CG 4.32Å; I72-E76 WeakPolarHBondContact O-CB 3.44Å; I72-E76 PolarHBondContact O-N 3.13Å
73	A	80.3	Confident	72.2	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-64.6	-19.9	178.1	0	0	0	0	0	113.4	G69 T70 D71 C95 C98 L99 K102	G69-A73 PolarHBondContact O-N 2.05Å; G69-A73 VanDerWaalsContact O-N 3.08Å; T70-A73 PolarHBondContact O-N 3.41Å; D71-A73 PolarHBondContact O-N 2.68Å; A73-C95 WeakPolarHBondContact CB-O 3.28Å; A73-C98 HydrophobicContact CB-CB 3.57Å; A73-C98 WeakPolarHBondContact CB-SG 3.34Å; A73-L99 HydrophobicContact CB-CD2 3.84Å; A73-L99 HydrophobicContact CB-CG 3.82Å; A73-K102 WeakPolarHBondContact O-CD 3.25Å; A73-K102 PolarHBondContact O-NZ 2.94Å
74	K	77.4	Confident	70.5	Confident	81 Å²	81	68.7 Å²	68.7	35%	0.352	37%	0.371	S	S	.	.	H	α-helix	trans	-76.1	-41.7	171.9	-72.8	177.8	176.4	-168.9	0	111.9	T70 D71 I72 K102	T70-K74 WeakPolarHBondContact O-CG 3.36Å; T70-K74 PolarHBondContact O-N 2.81Å; T70-K74 VanDerWaalsContact O-N 3.09Å; D71-K74 WeakPolarHBondContact O-CB 3.49Å; D71-K74 PolarHBondContact O-N 3.09Å; D71-K74 VanDerWaalsContact O-N 3.1Å; I72-K74 PolarHBondContact O-N 2.86Å; K74-K102 PolarHBondContact O-NZ 3.01Å
75	E	74.1	Confident	68.6	Low	173 Å²	173	70.7 Å²	70.7	81%	0.808	38%	0.38	S	S	*	.	H	α-helix	trans	-92.4	-28.5	-172.8	-64.5	-177.2	175.3	0	0	114.4	D71 I72	D71-E75 PolarHBondContact O-N 3.4Å; I72-E75 PolarHBondContact O-N 3.16Å; I72-E75 VanDerWaalsContact O-N 3.13Å
76	E	67.1	Low	67	Low	95 Å²	95	77 Å²	77	44%	0.444	41%	0.411	S	S	.	.			trans	-115.8	155.3	-175.1	-60.1	-172.7	-169.6	0	0	112.2	I72	I72-E76 HydrophobicContact CG2-CB 4.23Å; I72-E76 HydrophobicContact CG2-CG 4.32Å; I72-E76 WeakPolarHBondContact O-CB 3.44Å; I72-E76 PolarHBondContact O-N 3.13Å
77	E	61.6	Low	65.7	Low	196 Å²	196	78.3 Å²	78.3	92%	0.916	43%	0.426	S	S	*	.	S	Bend	trans	-86.2	-6.6	177.6	-66.7	-173.4	170.3	0	0	113.4
78	S	67.6	Low	64.2	Low	79 Å²	79	75.8 Å²	75.8	55%	0.552	41%	0.414	S	S	*	.	S	Bend	trans	-151.6	148.3	-176.6	67.6	0	0	0	0	112.1
79	C	68.1	Low	63.1	Low	14 Å²	14	76.9 Å²	76.9	10%	0.095	43%	0.432	C	S	.	.			trans	-92.4	119.5	179.2	-58.2	0	0	0	0	111.5	K92 C95 D96 L99	C79-K92 HydrophobicContact CB-CG 4.45Å; C79-C95 HydrophobicContact CB-CB 3.77Å; C79-C95 WeakPolarHBondContact CB-SG 3.41Å; C79-C95 WeakPolarHBondContact SG-CB 3.02Å; C79-C95 CovalentContact SG-SG 2.02Å; C79-C95 PolarHBondContact SG-SG 3.1Å; C79-D96 VanDerWaalsContact CB-OD1 3.27Å; C79-D96 WeakPolarHBondContact CB-OD1 3.38Å; C79-D96 PolarHBondContact SG-N 3.29Å; C79-D96 PolarHBondContact SG-OD1 3.1Å; C79-D96 VanDerWaalsContact SG-OD1 3.35Å; C79-L99 WeakPolarHBondContact SG-CD1 3.03Å
80	P	58.9	Low	62.4	Low	56 Å²	56	78.6 Å²	78.6	36%	0.364	44%	0.441	S	S	.	.			trans	-68.7	137.2	-174.4	22.7	-30.7	0	0	0	113.6	N82	P80-N82 VanDerWaalsContact C-N 3.34Å; P80-N82 PolarHBondContact O-N 3.34Å
81	S	53.1	Low	61.8	Low	96 Å²	96	80.9 Å²	80.9	67%	0.671	45%	0.45	S	S	*	.	S	Bend	trans	-77.7	-7.7	-174.7	-59.3	0	0	0	0	115.7
82	N	50.4	Low	61.3	Low	145 Å²	145	81 Å²	81	78%	0.775	45%	0.447	S	S	*	.			trans	-114.6	96.1	-174.8	-96.2	-25.5	0	0	0	111.5	P80	P80-N82 VanDerWaalsContact C-N 3.34Å; P80-N82 PolarHBondContact O-N 3.34Å
83	I	47	Very low	61.1	Low	39 Å²	39	82.9 Å²	82.9	20%	0.2	46%	0.456	C	S	.	.			trans	-128.9	88.8	170.1	-48.1	-179.5	0	0	0	108.5	I85 K91	I83-I85 HydrophobicContact CG2-CB 4.04Å; I83-I85 HydrophobicContact CG2-CD1 4.31Å; I83-I85 HydrophobicContact CG2-CG1 4.17Å; I83-I85 PolarHBondContact O-N 3.03Å; I83-K91 HydrophobicContact CD1-CB 4.06Å; I83-K91 HydrophobicContact CD1-CD 3.73Å; I83-K91 HydrophobicContact CD1-CG 3.73Å
84	N	44.4	Very low	61	Low	165 Å²	165	82.9 Å²	82.9	88%	0.882	46%	0.456	S	S	*	.			trans	-71.4	42.5	174.4	-80.5	-25.6	0	0	0	112.9
85	I	43	Very low	61.1	Low	125 Å²	125	79.1 Å²	79.1	64%	0.641	44%	0.44	S	S	*	.	S	Bend	trans	-127.6	144.1	-178.2	-53.9	177	0	0	0	108.4	I83 G87 G88	I83-I85 HydrophobicContact CG2-CB 4.04Å; I83-I85 HydrophobicContact CG2-CD1 4.31Å; I83-I85 HydrophobicContact CG2-CG1 4.17Å; I83-I85 PolarHBondContact O-N 3.03Å; I85-G87 PolarHBondContact O-N 2.93Å; I85-G88 PolarHBondContact O-N 2.03Å
86	L	42.3	Very low	61.2	Low	143 Å²	143	74.2 Å²	74.2	75%	0.749	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49	113.1	170.8	-132.4	85.2	0	0	0	109.3	L61	L61-L86 HydrophobicContact CD2-CD2 4.36Å
87	G	49.1	Very low	61.7	Low	33 Å²	33	70.3 Å²	70.3	34%	0.34	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.2	6.6	-174.2	0	0	0	0	0	116.1	I85 G89 L90 K91	I85-G87 PolarHBondContact O-N 2.93Å; G87-G89 PolarHBondContact O-N 3.42Å; G87-L90 PolarHBondContact O-N 3.01Å; G87-K91 PolarHBondContact O-N 3Å
88	G	53.1	Low	62.8	Low	10 Å²	10	61 Å²	61	10%	0.103	36%	0.358	C	S	.	.	H	α-helix	trans	-59.9	-37.5	-179.7	0	0	0	0	0	115	I85 K91 K92	I85-G88 PolarHBondContact O-N 2.03Å; G88-K91 PolarHBondContact O-N 3.01Å; G88-K92 PolarHBondContact O-N 3.35Å; G88-K92 VanDerWaalsContact O-N 3.12Å
89	G	59.9	Low	63.4	Low	60 Å²	60	59 Å²	59	62%	0.619	34%	0.342	S	S	*	.	H	α-helix	trans	-64.6	-43.2	174.3	0	0	0	0	0	112.7	G87 K92 E93	G87-G89 PolarHBondContact O-N 3.42Å; G89-K92 PolarHBondContact O-N 2.96Å; G89-E93 WeakPolarHBondContact O-CB 3.42Å; G89-E93 PolarHBondContact O-N 3.41Å
90	L	65.9	Low	63.8	Low	37 Å²	37	61.2 Å²	61.2	19%	0.194	35%	0.352	C	S	.	.	H	α-helix	trans	-68.1	-36.7	177.6	-177.3	68.4	0	0	0	112.2	L62 A65 G87 E93 C94	L62-L90 HydrophobicContact CB-CD2 3.95Å; L62-L90 HydrophobicContact CD2-CD2 3.32Å; L62-L90 HydrophobicContact CG-CD2 4.23Å; A65-L90 HydrophobicContact CB-CD2 4.34Å; G87-L90 PolarHBondContact O-N 3.01Å; L90-E93 PolarHBondContact O-N 3.27Å; L90-C94 WeakPolarHBondContact O-CB 3.44Å; L90-C94 PolarHBondContact O-N 3.12Å
91	K	70.6	Confident	64.7	Low	47 Å²	47	58.6 Å²	58.6	20%	0.204	34%	0.335	C	S	.	.	H	α-helix	trans	-63.3	-42.5	175.5	178.1	165.8	165.6	171.6	0	111.7	A65 S68 G69 I83 G87 G88 C95	A65-K91 HydrophobicContact CB-CB 4.43Å; S68-K91 WeakPolarHBondContact OG-CE 3.48Å; S68-K91 PolarHBondContact OG-NZ 3.28Å; G69-K91 WeakPolarHBondContact CA-O 3.15Å; I83-K91 HydrophobicContact CD1-CB 4.06Å; I83-K91 HydrophobicContact CD1-CD 3.73Å; I83-K91 HydrophobicContact CD1-CG 3.73Å; G87-K91 PolarHBondContact O-N 3Å; G88-K91 PolarHBondContact O-N 3.01Å; K91-C95 WeakPolarHBondContact O-CB 3.5Å; K91-C95 PolarHBondContact O-N 3.15Å
92	K	74.1	Confident	66	Low	77 Å²	77	56 Å²	56	34%	0.335	31%	0.311	S	S	.	.	H	α-helix	trans	-63.6	-48.9	173.7	-176.1	-176.8	174.5	-175.9	0	111.2	C79 G88 G89 C94 C95 D96	C79-K92 HydrophobicContact CB-CG 4.45Å; G88-K92 PolarHBondContact O-N 3.35Å; G88-K92 VanDerWaalsContact O-N 3.12Å; G89-K92 PolarHBondContact O-N 2.96Å; K92-C94 PolarHBondContact O-N 2.8Å; K92-C95 WeakPolarHBondContact O-CB 3.44Å; K92-C95 PolarHBondContact O-N 2.96Å; K92-C95 VanDerWaalsContact O-N 3.11Å; K92-D96 PolarHBondContact O-N 3.12Å
93	E	74.3	Confident	67.3	Low	70 Å²	70	51.6 Å²	51.6	33%	0.327	29%	0.288	S	S	.	.	H	α-helix	trans	-55.2	-48.7	177.7	-173.5	-169.3	164.8	0	0	111.9	G89 L90 C95 D96 C97 S118 C121	G89-E93 WeakPolarHBondContact O-CB 3.42Å; G89-E93 PolarHBondContact O-N 3.41Å; L90-E93 PolarHBondContact O-N 3.27Å; E93-C95 VanDerWaalsContact C-N 3.32Å; E93-C95 PolarHBondContact O-N 2.99Å; E93-D96 PolarHBondContact O-N 3.42Å; E93-C97 PolarHBondContact O-N 3.46Å; E93-C97 PolarHBondContact O-SG 2.95Å; E93-S118 WeakPolarHBondContact OE1-CB 3.03Å; E93-S118 PolarHBondContact OE1-OG 2.98Å; E93-C121 HydrophobicContact CG-CB 4.34Å
94	C	78.8	Confident	68.4	Low	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-66.4	-31.6	178.6	-79.8	0	0	0	0	113.4	C66 L90 K92 C98 G120 S124	C66-C94 HydrophobicContact CB-CB 3.57Å; C66-C94 WeakPolarHBondContact CB-SG 3.01Å; C66-C94 WeakPolarHBondContact SG-CB 3.04Å; C66-C94 CovalentContact SG-SG 2.04Å; C66-C94 PolarHBondContact SG-SG 2.03Å; L90-C94 WeakPolarHBondContact O-CB 3.44Å; L90-C94 PolarHBondContact O-N 3.12Å; K92-C94 PolarHBondContact O-N 2.8Å; C94-C98 PolarHBondContact O-N 2.87Å; C94-G120 PolarHBondContact SG-O 2.74Å; C94-S124 VanDerWaalsContact CB-OG 3.27Å; C94-S124 WeakPolarHBondContact CB-OG 3.02Å; C94-S124 VanDerWaalsContact O-CB 3.26Å; C94-S124 WeakPolarHBondContact O-CB 3.45Å; C94-S124 PolarHBondContact SG-OG 2.97Å; C94-S124 VanDerWaalsContact SG-OG 3.33Å
95	C	80.4	Confident	69.9	Low	2 Å²	2	45.5 Å²	45.5	1%	0.014	26%	0.255	C	S	.	.	H	α-helix	trans	-67.2	-50.4	171.4	-179.8	0	0	0	0	111.5	G69 A73 C79 K91 K92 E93 C97 C98 L99	G69-C95 VanDerWaalsContact O-CA 3.31Å; G69-C95 WeakPolarHBondContact O-CA 3.43Å; G69-C95 VanDerWaalsContact O-CB 3.24Å; G69-C95 WeakPolarHBondContact O-CB 3.32Å; A73-C95 WeakPolarHBondContact CB-O 3.28Å; C79-C95 HydrophobicContact CB-CB 3.77Å; C79-C95 WeakPolarHBondContact CB-SG 3.41Å; C79-C95 WeakPolarHBondContact SG-CB 3.02Å; C79-C95 CovalentContact SG-SG 2.02Å; C79-C95 PolarHBondContact SG-SG 3.1Å; K91-C95 WeakPolarHBondContact O-CB 3.5Å; K91-C95 PolarHBondContact O-N 3.15Å; K92-C95 WeakPolarHBondContact O-CB 3.44Å; K92-C95 PolarHBondContact O-N 2.96Å; K92-C95 VanDerWaalsContact O-N 3.11Å; E93-C95 VanDerWaalsContact C-N 3.32Å; E93-C95 PolarHBondContact O-N 2.99Å; C95-C97 VanDerWaalsContact C-N 3.28Å; C95-C97 PolarHBondContact O-N 3.46Å; C95-C98 PolarHBondContact O-N 2.02Å; C95-C98 VanDerWaalsContact O-N 3.07Å; C95-L99 PolarHBondContact O-N 2.83Å
96	D	76.6	Confident	71.3	Confident	70 Å²	70	43.9 Å²	43.9	37%	0.374	25%	0.248	S	C	.	.	H	α-helix	trans	-59.1	-40.1	180	-70.7	-31.5	0	0	0	111	C79 K92 E93 C98 L99 L100	C79-D96 VanDerWaalsContact CB-OD1 3.27Å; C79-D96 WeakPolarHBondContact CB-OD1 3.38Å; C79-D96 PolarHBondContact SG-N 3.29Å; C79-D96 PolarHBondContact SG-OD1 3.1Å; C79-D96 VanDerWaalsContact SG-OD1 3.35Å; K92-D96 PolarHBondContact O-N 3.12Å; E93-D96 PolarHBondContact O-N 3.42Å; D96-C98 PolarHBondContact O-N 2.84Å; D96-L99 PolarHBondContact O-N 3.44Å; D96-L100 PolarHBondContact O-N 3.04Å
97	C	77.3	Confident	72.4	Confident	13 Å²	13	44.4 Å²	44.4	9%	0.088	24%	0.24	C	C	.	.	H	α-helix	trans	-68.4	-33	176.8	-60.7	0	0	0	0	113.6	E93 C95 A101 F117 C121 F125	E93-C97 PolarHBondContact O-N 3.46Å; E93-C97 PolarHBondContact O-SG 2.95Å; C95-C97 VanDerWaalsContact C-N 3.28Å; C95-C97 PolarHBondContact O-N 3.46Å; C97-A101 PolarHBondContact O-N 3.06Å; C97-F117 HydrophobicContact CB-CE2 4.22Å; C97-C121 HydrophobicContact CB-CB 3.94Å; C97-C121 WeakPolarHBondContact CB-SG 3.09Å; C97-C121 WeakPolarHBondContact SG-CB 3.47Å; C97-C121 CovalentContact SG-SG 2.01Å; C97-C121 PolarHBondContact SG-SG 2.93Å; C97-F125 HydrophobicContact CB-CB 4.45Å; C97-F125 WeakPolarHBondContact O-CD2 3.39Å
98	C	83.6	Confident	73.2	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-72.4	-39.3	172.5	172.6	0	0	0	0	111.7	A73 C94 C95 D96 L100 A101 K102 C128	A73-C98 HydrophobicContact CB-CB 3.57Å; A73-C98 WeakPolarHBondContact CB-SG 3.34Å; C94-C98 PolarHBondContact O-N 2.87Å; C95-C98 PolarHBondContact O-N 2.02Å; C95-C98 VanDerWaalsContact O-N 3.07Å; D96-C98 PolarHBondContact O-N 2.84Å; C98-L100 VanDerWaalsContact C-N 3.29Å; C98-L100 PolarHBondContact O-N 2.69Å; C98-A101 WeakPolarHBondContact O-CB 3.07Å; C98-A101 PolarHBondContact O-N 3.29Å; C98-K102 PolarHBondContact O-N 3.39Å; C98-C128 HydrophobicContact CB-CB 4Å; C98-C128 WeakPolarHBondContact CB-SG 3.42Å; C98-C128 WeakPolarHBondContact SG-CB 3.16Å; C98-C128 CovalentContact SG-SG 2.02Å; C98-C128 PolarHBondContact SG-SG 3.42Å
99	L	80.4	Confident	73.5	Confident	38 Å²	38	52.1 Å²	52.1	20%	0.199	27%	0.268	C	S	.	.	H	α-helix	trans	-61.2	-38.4	173.4	-73.3	-175.7	0	0	0	111.7	A73 C79 C95 D96 K102 D103	A73-L99 HydrophobicContact CB-CD2 3.84Å; A73-L99 HydrophobicContact CB-CG 3.82Å; C79-L99 WeakPolarHBondContact SG-CD1 3.03Å; C95-L99 PolarHBondContact O-N 2.83Å; D96-L99 PolarHBondContact O-N 3.44Å; L99-K102 HydrophobicContact CD2-CD 4.4Å; L99-K102 PolarHBondContact O-N 2.68Å; L99-D103 WeakPolarHBondContact O-CB 3.25Å; L99-D103 PolarHBondContact O-N 2.89Å
100	L	77.3	Confident	73.3	Confident	60 Å²	60	54.1 Å²	54.1	31%	0.314	27%	0.27	S	S	.	.	H	α-helix	trans	-61.5	-45.1	172.8	-177.2	69.8	0	0	0	111.9	D96 C98 K102 D103 L104 P114 F117 F125	D96-L100 PolarHBondContact O-N 3.04Å; C98-L100 VanDerWaalsContact C-N 3.29Å; C98-L100 PolarHBondContact O-N 2.69Å; L100-K102 VanDerWaalsContact C-N 3.29Å; L100-K102 PolarHBondContact O-N 3.45Å; L100-D103 PolarHBondContact O-N 3.3Å; L100-L104 HydrophobicContact CG-CD1 4.46Å; L100-L104 WeakPolarHBondContact O-CG 3.35Å; L100-L104 PolarHBondContact O-N 3.03Å; L100-P114 HydrophobicContact CD2-CG 3.96Å; L100-F117 HydrophobicContact CD2-CE2 4.45Å; L100-F117 HydrophobicContact CD2-CZ 3.65Å; L100-F125 HydrophobicContact CD2-CD2 4.41Å; L100-F125 HydrophobicContact CD2-CE2 4.15Å; L100-F125 HydrophobicContact CG-CE2 4.28Å
101	A	78.1	Confident	73.3	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-59.5	-40.9	175.8	0	0	0	0	0	111.7	C97 C98 L104 L105 F125 C128 C129	C97-A101 PolarHBondContact O-N 3.06Å; C98-A101 WeakPolarHBondContact O-CB 3.07Å; C98-A101 PolarHBondContact O-N 3.29Å; A101-L104 PolarHBondContact O-N 2.77Å; A101-L105 VanDerWaalsContact O-CG 3.31Å; A101-L105 WeakPolarHBondContact O-CG 3Å; A101-L105 PolarHBondContact O-N 2.69Å; A101-F125 HydrophobicContact CB-CD2 3.66Å; A101-F125 HydrophobicContact CB-CE2 3.89Å; A101-F125 HydrophobicContact CB-CG 4.03Å; A101-F125 HydrophobicContact CB-CZ 4.42Å; A101-F125 WeakPolarHBondContact CB-O 3.42Å; A101-C128 HydrophobicContact CB-CB 3.92Å; A101-C129 HydrophobicContact CB-CB 4.27Å
102	K	80.5	Confident	73.3	Confident	41 Å²	41	56.5 Å²	56.5	18%	0.178	29%	0.291	C	S	.	.	H	α-helix	trans	-63.9	-41.6	174.3	-70.8	176.8	74.6	-174.1	0	112.1	A73 K74 C98 L99 L100 L105 N106 I133	A73-K102 WeakPolarHBondContact O-CD 3.25Å; A73-K102 PolarHBondContact O-NZ 2.94Å; K74-K102 PolarHBondContact O-NZ 3.01Å; C98-K102 PolarHBondContact O-N 3.39Å; L99-K102 HydrophobicContact CD2-CD 4.4Å; L99-K102 PolarHBondContact O-N 2.68Å; L100-K102 VanDerWaalsContact C-N 3.29Å; L100-K102 PolarHBondContact O-N 3.45Å; K102-L105 PolarHBondContact O-N 2.72Å; K102-N106 WeakPolarHBondContact O-CB 3.16Å; K102-N106 PolarHBondContact O-N 2.76Å; K102-N106 PolarHBondContact O-ND2 3.33Å; K102-I133 HydrophobicContact CD-CD1 4.17Å; K102-I133 HydrophobicContact CG-CD1 4.35Å
103	D	76.4	Confident	72.2	Confident	54 Å²	54	54 Å²	54	29%	0.289	29%	0.285	S	S	.	.	H	α-helix	trans	-63.2	-42.3	176.6	-178.3	58.6	0	0	0	111.6	L99 L100 N106 R107	L99-D103 WeakPolarHBondContact O-CB 3.25Å; L99-D103 PolarHBondContact O-N 2.89Å; L100-D103 PolarHBondContact O-N 3.3Å; D103-N106 PolarHBondContact O-N 2.91Å; D103-R107 VanDerWaalsContact CG-NH2 3.31Å; D103-R107 WeakPolarHBondContact O-CB 3.44Å; D103-R107 WeakPolarHBondContact O-CG 3.19Å; D103-R107 PolarHBondContact O-N 2.77Å; D103-R107 IonicContact OD1-CZ 2.65Å; D103-R107 VanDerWaalsContact OD1-CZ 3.3Å; D103-R107 IonicContact OD1-NE 2.77Å; D103-R107 PolarHBondContact OD1-NE 2.91Å; D103-R107 IonicContact OD1-NH2 2.89Å; D103-R107 PolarHBondContact OD1-NH2 3.47Å; D103-R107 IonicContact OD2-CZ 3.25Å; D103-R107 IonicContact OD2-NE 3.44Å; D103-R107 PolarHBondContact OD2-NE 2.71Å; D103-R107 IonicContact OD2-NH1 3.1Å; D103-R107 IonicContact OD2-NH2 3.95Å; D103-R107 PolarHBondContact OD2-NH2 3.09Å
104	L	71.1	Confident	71.1	Confident	19 Å²	19	53.6 Å²	53.6	10%	0.099	29%	0.288	C	S	.	.	H	α-helix	trans	-63	-44	174.3	-67.6	175.2	0	0	0	112.3	L100 A101 R107 N108 E109 F125	L100-L104 HydrophobicContact CG-CD1 4.46Å; L100-L104 WeakPolarHBondContact O-CG 3.35Å; L100-L104 PolarHBondContact O-N 3.03Å; A101-L104 PolarHBondContact O-N 2.77Å; L104-R107 CarbonylContact O-C 3.56Å; L104-R107 PolarHBondContact O-N 3.13Å; L104-N108 PolarHBondContact O-N 3.39Å; L104-E109 HydrophobicContact CB-CB 4.38Å; L104-E109 HydrophobicContact CD2-CB 4.08Å; L104-E109 VanDerWaalsContact CD2-OE2 3.27Å; L104-E109 WeakPolarHBondContact CD2-OE2 3.48Å; L104-E109 PolarHBondContact O-N 2.98Å; L104-F125 HydrophobicContact CD1-CE2 3.55Å; L104-F125 HydrophobicContact CD1-CZ 3.49Å; L104-F125 VanDerWaalsContact CD1-CZ 3.49Å
105	L	76.4	Confident	69.4	Low	56 Å²	56	59.7 Å²	59.7	29%	0.293	33%	0.325	S	S	.	.	H	α-helix	trans	-62.6	-43.3	175.2	-72	174.8	0	0	0	111.7	A101 K102 R107 N108 C111 C128	A101-L105 VanDerWaalsContact O-CG 3.31Å; A101-L105 WeakPolarHBondContact O-CG 3Å; A101-L105 PolarHBondContact O-N 2.69Å; K102-L105 PolarHBondContact O-N 2.72Å; L105-R107 PolarHBondContact O-N 3.47Å; L105-N108 PolarHBondContact O-N 2.96Å; L105-C111 HydrophobicContact CD2-CB 4.17Å; L105-C128 WeakPolarHBondContact CD1-O 3.49Å
106	N	72.5	Confident	67.8	Low	92 Å²	92	61.2 Å²	61.2	49%	0.492	34%	0.341	S	S	.	.	H	α-helix	trans	-63.1	-26.8	176	-73.6	-17.2	0	0	0	112.7	K102 D103	K102-N106 WeakPolarHBondContact O-CB 3.16Å; K102-N106 PolarHBondContact O-N 2.76Å; K102-N106 PolarHBondContact O-ND2 3.33Å; D103-N106 PolarHBondContact O-N 2.91Å
107	R	65.3	Low	67	Low	153 Å²	153	60.4 Å²	60.4	58%	0.577	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	4	176.5	-67.3	172.4	-168.8	-152.4	9	113.6	D103 L104 L105 E109	D103-R107 VanDerWaalsContact CG-NH2 3.31Å; D103-R107 WeakPolarHBondContact O-CB 3.44Å; D103-R107 WeakPolarHBondContact O-CG 3.19Å; D103-R107 PolarHBondContact O-N 2.77Å; D103-R107 IonicContact OD1-CZ 2.65Å; D103-R107 VanDerWaalsContact OD1-CZ 3.3Å; D103-R107 IonicContact OD1-NE 2.77Å; D103-R107 PolarHBondContact OD1-NE 2.91Å; D103-R107 IonicContact OD1-NH2 2.89Å; D103-R107 PolarHBondContact OD1-NH2 3.47Å; D103-R107 IonicContact OD2-CZ 3.25Å; D103-R107 IonicContact OD2-NE 3.44Å; D103-R107 PolarHBondContact OD2-NE 2.71Å; D103-R107 IonicContact OD2-NH1 3.1Å; D103-R107 IonicContact OD2-NH2 3.95Å; D103-R107 PolarHBondContact OD2-NH2 3.09Å; L104-R107 CarbonylContact O-C 3.56Å; L104-R107 PolarHBondContact O-N 3.13Å; L105-R107 PolarHBondContact O-N 3.47Å; R107-E109 HydrophobicContact CB-CG 4.06Å; R107-E109 PolarHBondContact O-N 2.77Å
108	N	65.7	Low	66.2	Low	108 Å²	108	61.6 Å²	61.6	58%	0.578	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	27.6	-172.3	-83	35.1	0	0	0	113.8	L104 L105	L104-N108 PolarHBondContact O-N 3.39Å; L105-N108 PolarHBondContact O-N 2.96Å
109	E	58	Low	65.1	Low	97 Å²	97	65.5 Å²	65.5	45%	0.453	38%	0.375	S	S	.	.			trans	-84.7	148.1	177.8	-71.9	-171.6	-166.1	0	0	111.4	L104 R107 C111	L104-E109 HydrophobicContact CB-CB 4.38Å; L104-E109 HydrophobicContact CD2-CB 4.08Å; L104-E109 VanDerWaalsContact CD2-OE2 3.27Å; L104-E109 WeakPolarHBondContact CD2-OE2 3.48Å; L104-E109 PolarHBondContact O-N 2.98Å; R107-E109 HydrophobicContact CB-CG 4.06Å; R107-E109 PolarHBondContact O-N 2.77Å; E109-C111 PolarHBondContact O-N 3.37Å
110	P	56.9	Low	64.4	Low	103 Å²	103	64.4 Å²	64.4	67%	0.669	37%	0.373	S	S	*	.			trans	-62.6	129.7	175.2	29.1	-34.5	0	0	0	108	V112	P110-V112 HydrophobicContact CB-CG2 4.03Å; P110-V112 HydrophobicContact CG-CG2 4.43Å; P110-V112 PolarHBondContact O-N 3.12Å
111	C	65.9	Low	64.1	Low	33 Å²	33	61.7 Å²	61.7	22%	0.223	36%	0.359	C	S	.	.			trans	-83.6	71.2	-166	-164.1	0	0	0	0	109.2	L105 E109 C129	L105-C111 HydrophobicContact CD2-CB 4.17Å; E109-C111 PolarHBondContact O-N 3.37Å; C111-C129 HydrophobicContact CB-CB 4.21Å; C111-C129 WeakPolarHBondContact CB-SG 3.45Å; C111-C129 PolarHBondContact O-SG 3.21Å; C111-C129 WeakPolarHBondContact SG-CA 3.46Å; C111-C129 WeakPolarHBondContact SG-CB 3.49Å; C111-C129 CovalentContact SG-SG 1.99Å; C111-C129 PolarHBondContact SG-SG 3Å
112	V	69.4	Low	63.9	Low	101 Å²	101	65 Å²	65	61%	0.612	38%	0.376	S	S	*	.			trans	-108.5	116.1	-171.8	178.6	0	0	0	0	107.4	P110	P110-V112 HydrophobicContact CB-CG2 4.03Å; P110-V112 HydrophobicContact CG-CG2 4.43Å; P110-V112 PolarHBondContact O-N 3.12Å
113	A	50.9	Low	63.6	Low	24 Å²	24	68.2 Å²	68.2	20%	0.198	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-62.7	132	179.9	0	0	0	0	0	110.7	F117 L122 F125	A113-F117 HydrophobicContact CB-CD2 4.06Å; A113-F117 HydrophobicContact CB-CE2 4.42Å; A113-L122 HydrophobicContact CB-CD1 3.36Å; A113-F125 VanDerWaalsContact CA-CE1 3.42Å; A113-F125 HydrophobicContact CB-CD1 3.64Å; A113-F125 HydrophobicContact CB-CE1 3.66Å; A113-F125 HydrophobicContact CB-CG 4.26Å; A113-F125 HydrophobicContact CB-CZ 4.26Å; A113-F125 VanDerWaalsContact N-CE1 3.28Å
114	P	50.8	Low	63.8	Low	61 Å²	61	65.7 Å²	65.7	40%	0.396	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-54.7	145.5	169.9	-24.3	31	0	0	0	112.5	L100 G116 F117	L100-P114 HydrophobicContact CD2-CG 3.96Å; P114-G116 PolarHBondContact O-N 3.01Å; P114-F117 HydrophobicContact CB-CD1 4.07Å; P114-F117 HydrophobicContact CB-CE1 3.61Å; P114-F117 HydrophobicContact CB-CZ 4.21Å; P114-F117 VanDerWaalsContact CD-CZ 3.45Å; P114-F117 HydrophobicContact CG-CD1 4.46Å; P114-F117 HydrophobicContact CG-CE1 3.62Å; P114-F117 HydrophobicContact CG-CZ 3.72Å; P114-F117 WeakPolarHBondContact O-CD1 2.93Å
115	V	44.1	Very low	64.2	Low	128 Å²	128	64.8 Å²	64.8	78%	0.776	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	117.7	-177.2	-157.8	0	0	0	0	109.6	R181	V115-R181 PolarHBondContact O-NH1 3.13Å
116	G	47.4	Very low	64.3	Low	35 Å²	35	65.1 Å²	65.1	36%	0.361	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	121.1	4.5	-178.2	0	0	0	0	0	115	P114 L153	P114-G116 PolarHBondContact O-N 3.01Å; G116-L153 WeakPolarHBondContact O-CD2 3.37Å
117	F	58.3	Low	64.7	Low	53 Å²	53	65 Å²	65	23%	0.232	37%	0.367	C	S	.	.			trans	-62.1	135.9	174.7	-81.2	18.7	0	0	0	111.5	C97 L100 A113 P114 C121 L122 F125	C97-F117 HydrophobicContact CB-CE2 4.22Å; L100-F117 HydrophobicContact CD2-CE2 4.45Å; L100-F117 HydrophobicContact CD2-CZ 3.65Å; A113-F117 HydrophobicContact CB-CD2 4.06Å; A113-F117 HydrophobicContact CB-CE2 4.42Å; P114-F117 HydrophobicContact CB-CD1 4.07Å; P114-F117 HydrophobicContact CB-CE1 3.61Å; P114-F117 HydrophobicContact CB-CZ 4.21Å; P114-F117 VanDerWaalsContact CD-CZ 3.45Å; P114-F117 HydrophobicContact CG-CD1 4.46Å; P114-F117 HydrophobicContact CG-CE1 3.62Å; P114-F117 HydrophobicContact CG-CZ 3.72Å; P114-F117 WeakPolarHBondContact O-CD1 2.93Å; F117-C121 HydrophobicContact CB-CB 4.3Å; F117-C121 HydrophobicContact CD2-CB 4.37Å; F117-C121 WeakPolarHBondContact CD2-SG 3.46Å; F117-C121 WeakPolarHBondContact CE2-SG 3.37Å; F117-C121 HydrophobicContact CG-CB 4.44Å; F117-C121 WeakPolarHBondContact CG-SG 3.48Å; F117-L122 HydrophobicContact CB-CB 3.97Å; F117-F125 HydrophobicContact CD2-CB 4.16Å; F117-F125 HydrophobicContact CD2-CG 4.35Å; F117-F125 HydrophobicContact CE2-CB 3.86Å; F117-F125 AromaticContact CE2-CD2 3.59Å; F117-F125 HydrophobicContact CE2-CD2 3.59Å; F117-F125 HydrophobicContact CE2-CE2 4.31Å; F117-F125 AromaticContact CE2-CG 3.82Å; F117-F125 HydrophobicContact CE2-CG 3.82Å; F117-F125 HydrophobicContact CZ-CD2 4.32Å
118	S	61.1	Low	65.4	Low	37 Å²	37	58.3 Å²	58.3	26%	0.259	34%	0.343	S	S	.	.			trans	-60.6	157.9	168.1	75.8	0	0	0	0	110.3	E93 G120 C121 L122	E93-S118 WeakPolarHBondContact OE1-CB 3.03Å; E93-S118 PolarHBondContact OE1-OG 2.98Å; S118-G120 PolarHBondContact O-N 2.7Å; S118-G120 VanDerWaalsContact O-N 3.13Å; S118-C121 PolarHBondContact O-N 2.04Å; S118-C121 VanDerWaalsContact O-N 3.15Å; S118-C121 VanDerWaalsContact OG-CB 3.27Å; S118-C121 WeakPolarHBondContact OG-CB 3.04Å; S118-C121 PolarHBondContact OG-N 2.85Å; S118-C121 VanDerWaalsContact OG-N 3.12Å; S118-L122 WeakPolarHBondContact O-CB 3.09Å; S118-L122 PolarHBondContact O-N 3.14Å
119	A	61	Low	66	Low	83 Å²	83	53.9 Å²	53.9	69%	0.686	32%	0.32	S	S	*	.	H	α-helix	trans	-58.5	-28.6	179.2	0	0	0	0	0	113.1	R123	A119-R123 WeakPolarHBondContact O-CB 3.17Å; A119-R123 PolarHBondContact O-N 3.26Å
120	G	65.9	Low	66.9	Low	15 Å²	15	55.9 Å²	55.9	16%	0.155	33%	0.334	C	S	.	.	H	α-helix	trans	-75.2	-47.3	174.2	0	0	0	0	0	112.6	C94 S118 R123 S124	C94-G120 PolarHBondContact SG-O 2.74Å; S118-G120 PolarHBondContact O-N 2.7Å; S118-G120 VanDerWaalsContact O-N 3.13Å; G120-R123 PolarHBondContact O-N 3.02Å; G120-S124 PolarHBondContact O-N 2.81Å; G120-S124 PolarHBondContact O-OG 3.43Å
121	C	69.9	Low	66.9	Low	3 Å²	3	52.9 Å²	52.9	2%	0.02	32%	0.322	C	S	.	.	H	α-helix	trans	-61.2	-46.3	177.3	171.1	0	0	0	0	111.9	E93 C97 F117 S118 R123 S124 F125	E93-C121 HydrophobicContact CG-CB 4.34Å; C97-C121 HydrophobicContact CB-CB 3.94Å; C97-C121 WeakPolarHBondContact CB-SG 3.09Å; C97-C121 WeakPolarHBondContact SG-CB 3.47Å; C97-C121 CovalentContact SG-SG 2.01Å; C97-C121 PolarHBondContact SG-SG 2.93Å; F117-C121 HydrophobicContact CB-CB 4.3Å; F117-C121 HydrophobicContact CD2-CB 4.37Å; F117-C121 WeakPolarHBondContact CD2-SG 3.46Å; F117-C121 WeakPolarHBondContact CE2-SG 3.37Å; F117-C121 HydrophobicContact CG-CB 4.44Å; F117-C121 WeakPolarHBondContact CG-SG 3.48Å; S118-C121 PolarHBondContact O-N 2.04Å; S118-C121 VanDerWaalsContact O-N 3.15Å; S118-C121 VanDerWaalsContact OG-CB 3.27Å; S118-C121 WeakPolarHBondContact OG-CB 3.04Å; S118-C121 PolarHBondContact OG-N 2.85Å; S118-C121 VanDerWaalsContact OG-N 3.12Å; C121-R123 VanDerWaalsContact C-N 3.29Å; C121-R123 PolarHBondContact O-N 2.81Å; C121-S124 PolarHBondContact O-N 2.95Å; C121-F125 VanDerWaalsContact O-CB 3.3Å; C121-F125 WeakPolarHBondContact O-CB 3.21Å; C121-F125 PolarHBondContact O-N 3.36Å
122	L	73.4	Confident	65.8	Low	68 Å²	68	58.3 Å²	58.3	36%	0.356	35%	0.349	S	S	.	.	H	α-helix	trans	-60	-39.3	176.5	-176.8	61.7	0	0	0	112.1	A113 F117 S118 N126	A113-L122 HydrophobicContact CB-CD1 3.36Å; F117-L122 HydrophobicContact CB-CB 3.97Å; S118-L122 WeakPolarHBondContact O-CB 3.09Å; S118-L122 PolarHBondContact O-N 3.14Å; L122-N126 VanDerWaalsContact O-CB 3.32Å; L122-N126 WeakPolarHBondContact O-CB 3.04Å; L122-N126 PolarHBondContact O-N 3.21Å; L122-N126 PolarHBondContact O-ND2 3.13Å; L122-N126 VanDerWaalsContact O-ND2 3.08Å
123	R	75.6	Confident	64.4	Low	109 Å²	109	57.2 Å²	57.2	41%	0.411	34%	0.339	S	S	.	.	H	α-helix	trans	-65.3	-46.9	176.6	-168.6	-173.6	-59	-162.6	19.1	111.4	D63 A119 G120 C121 N126 K127	D63-R123 VanDerWaalsContact CG-NH1 3.26Å; D63-R123 IonicContact OD1-CZ 3.6Å; D63-R123 IonicContact OD1-NH1 2.98Å; D63-R123 PolarHBondContact OD1-NH1 3.29Å; D63-R123 VanDerWaalsContact OD1-NH1 3.12Å; D63-R123 IonicContact OD1-NH2 3.37Å; D63-R123 PolarHBondContact OD1-NH2 3.4Å; D63-R123 IonicContact OD2-CZ 2.81Å; D63-R123 IonicContact OD2-NH1 2.89Å; D63-R123 PolarHBondContact OD2-NH1 3.23Å; D63-R123 IonicContact OD2-NH2 3.64Å; A119-R123 WeakPolarHBondContact O-CB 3.17Å; A119-R123 PolarHBondContact O-N 3.26Å; G120-R123 PolarHBondContact O-N 3.02Å; C121-R123 VanDerWaalsContact C-N 3.29Å; C121-R123 PolarHBondContact O-N 2.81Å; R123-N126 PolarHBondContact O-N 3.06Å; R123-K127 WeakPolarHBondContact O-CB 3.43Å; R123-K127 PolarHBondContact O-N 2.83Å
124	S	80.6	Confident	63.6	Low	2 Å²	2	65.2 Å²	65.2	1%	0.014	37%	0.372	C	S	.	.	H	α-helix	trans	-66.9	-42.1	-178.8	-52.7	0	0	0	0	111.7	T70 C94 G120 C121 K127 C128	T70-S124 WeakPolarHBondContact OG1-CB 3.43Å; T70-S124 PolarHBondContact OG1-OG 3.13Å; C94-S124 VanDerWaalsContact CB-OG 3.27Å; C94-S124 WeakPolarHBondContact CB-OG 3.02Å; C94-S124 VanDerWaalsContact O-CB 3.26Å; C94-S124 WeakPolarHBondContact O-CB 3.45Å; C94-S124 PolarHBondContact SG-OG 2.97Å; C94-S124 VanDerWaalsContact SG-OG 3.33Å; G120-S124 PolarHBondContact O-N 2.81Å; G120-S124 PolarHBondContact O-OG 3.43Å; C121-S124 PolarHBondContact O-N 2.95Å; S124-K127 PolarHBondContact O-N 3.24Å; S124-C128 PolarHBondContact O-N 3.12Å; S124-C128 VanDerWaalsContact O-N 3.11Å; S124-C128 PolarHBondContact O-SG 3.32Å; S124-C128 VanDerWaalsContact O-SG 3.4Å
125	F	79.4	Confident	62.6	Low	0 Å²	0	67.8 Å²	67.8	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-56.5	-55.9	172	-179.9	-84.7	0	0	0	111.3	C97 L100 A101 L104 A113 F117 C121 K127 C128 C129	C97-F125 HydrophobicContact CB-CB 4.45Å; C97-F125 WeakPolarHBondContact O-CD2 3.39Å; L100-F125 HydrophobicContact CD2-CD2 4.41Å; L100-F125 HydrophobicContact CD2-CE2 4.15Å; L100-F125 HydrophobicContact CG-CE2 4.28Å; A101-F125 HydrophobicContact CB-CD2 3.66Å; A101-F125 HydrophobicContact CB-CE2 3.89Å; A101-F125 HydrophobicContact CB-CG 4.03Å; A101-F125 HydrophobicContact CB-CZ 4.42Å; A101-F125 WeakPolarHBondContact CB-O 3.42Å; L104-F125 HydrophobicContact CD1-CE2 3.55Å; L104-F125 HydrophobicContact CD1-CZ 3.49Å; L104-F125 VanDerWaalsContact CD1-CZ 3.49Å; A113-F125 VanDerWaalsContact CA-CE1 3.42Å; A113-F125 HydrophobicContact CB-CD1 3.64Å; A113-F125 HydrophobicContact CB-CE1 3.66Å; A113-F125 HydrophobicContact CB-CG 4.26Å; A113-F125 HydrophobicContact CB-CZ 4.26Å; A113-F125 VanDerWaalsContact N-CE1 3.28Å; F117-F125 HydrophobicContact CD2-CB 4.16Å; F117-F125 HydrophobicContact CD2-CG 4.35Å; F117-F125 HydrophobicContact CE2-CB 3.86Å; F117-F125 AromaticContact CE2-CD2 3.59Å; F117-F125 HydrophobicContact CE2-CD2 3.59Å; F117-F125 HydrophobicContact CE2-CE2 4.31Å; F117-F125 AromaticContact CE2-CG 3.82Å; F117-F125 HydrophobicContact CE2-CG 3.82Å; F117-F125 HydrophobicContact CZ-CD2 4.32Å; C121-F125 VanDerWaalsContact O-CB 3.3Å; C121-F125 WeakPolarHBondContact O-CB 3.21Å; C121-F125 PolarHBondContact O-N 3.36Å; F125-K127 PolarHBondContact O-N 3.38Å; F125-C128 PolarHBondContact O-N 3.31Å; F125-C128 VanDerWaalsContact O-N 3.15Å; F125-C129 HydrophobicContact CD1-CB 4.45Å; F125-C129 HydrophobicContact CE1-CB 4.41Å; F125-C129 WeakPolarHBondContact O-CB 3.41Å; F125-C129 PolarHBondContact O-N 3Å
126	N	78.1	Confident	61.8	Low	62 Å²	62	67 Å²	67	33%	0.332	38%	0.377	S	S	.	.	H	α-helix	trans	-61.4	-32.2	-179.1	-73.4	-28.3	0	0	0	112.8	L122 R123 N130	L122-N126 VanDerWaalsContact O-CB 3.32Å; L122-N126 WeakPolarHBondContact O-CB 3.04Å; L122-N126 PolarHBondContact O-N 3.21Å; L122-N126 PolarHBondContact O-ND2 3.13Å; L122-N126 VanDerWaalsContact O-ND2 3.08Å; R123-N126 PolarHBondContact O-N 3.06Å; N126-N130 PolarHBondContact O-N 3.44Å; N126-N130 PolarHBondContact O-ND2 3.45Å
127	K	81.8	Confident	60.8	Low	90 Å²	90	73.8 Å²	73.8	39%	0.391	40%	0.399	S	S	.	.	H	α-helix	trans	-68.2	-39.6	177.4	-167.5	177.9	-176.7	-169.1	0	111.9	D67 T70 R123 S124 F125	D67-K127 IonicContact OD1-NZ 3.59Å; D67-K127 PolarHBondContact OD1-NZ 3.08Å; T70-K127 HydrophobicContact CG2-CD 3.9Å; T70-K127 HydrophobicContact CG2-CG 4.37Å; R123-K127 WeakPolarHBondContact O-CB 3.43Å; R123-K127 PolarHBondContact O-N 2.83Å; S124-K127 PolarHBondContact O-N 3.24Å; F125-K127 PolarHBondContact O-N 3.38Å
128	C	80.1	Confident	59.2	Low	12 Å²	12	74.6 Å²	74.6	8%	0.081	42%	0.415	C	S	.	.	H	α-helix	trans	-80.7	-25.4	177.5	-61.7	0	0	0	0	112.9	T70 C98 A101 L105 S124 F125	T70-C128 WeakPolarHBondContact CG2-SG 3.13Å; C98-C128 HydrophobicContact CB-CB 4Å; C98-C128 WeakPolarHBondContact CB-SG 3.42Å; C98-C128 WeakPolarHBondContact SG-CB 3.16Å; C98-C128 CovalentContact SG-SG 2.02Å; C98-C128 PolarHBondContact SG-SG 3.42Å; A101-C128 HydrophobicContact CB-CB 3.92Å; L105-C128 WeakPolarHBondContact CD1-O 3.49Å; S124-C128 PolarHBondContact O-N 3.12Å; S124-C128 VanDerWaalsContact O-N 3.11Å; S124-C128 PolarHBondContact O-SG 3.32Å; S124-C128 VanDerWaalsContact O-SG 3.4Å; F125-C128 PolarHBondContact O-N 3.31Å; F125-C128 VanDerWaalsContact O-N 3.15Å
129	C	77.9	Confident	57.4	Low	15 Å²	15	78.5 Å²	78.5	10%	0.101	44%	0.443	C	S	.	.	H	α-helix	trans	-72.1	-38	179.8	-175	0	0	0	0	114.7	A101 C111 F125 G131	A101-C129 HydrophobicContact CB-CB 4.27Å; C111-C129 HydrophobicContact CB-CB 4.21Å; C111-C129 WeakPolarHBondContact CB-SG 3.45Å; C111-C129 PolarHBondContact O-SG 3.21Å; C111-C129 WeakPolarHBondContact SG-CA 3.46Å; C111-C129 WeakPolarHBondContact SG-CB 3.49Å; C111-C129 CovalentContact SG-SG 1.99Å; C111-C129 PolarHBondContact SG-SG 3Å; F125-C129 HydrophobicContact CD1-CB 4.45Å; F125-C129 HydrophobicContact CE1-CB 4.41Å; F125-C129 WeakPolarHBondContact O-CB 3.41Å; F125-C129 PolarHBondContact O-N 3Å; C129-G131 PolarHBondContact O-N 3.05Å; C129-G131 VanDerWaalsContact O-N 3.17Å
130	N	76.4	Confident	55.7	Low	139 Å²	139	82.9 Å²	82.9	74%	0.743	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	13.3	-175.8	-76.3	-37.5	0	0	0	114.8	N126	N126-N130 PolarHBondContact O-N 3.44Å; N126-N130 PolarHBondContact O-ND2 3.45Å
131	G	57.5	Low	53.8	Low	41 Å²	41	88.6 Å²	88.6	42%	0.423	48%	0.475	S	S	.	.			trans	78.8	103.5	165.6	0	0	0	0	0	115.1	C129	C129-G131 PolarHBondContact O-N 3.05Å; C129-G131 VanDerWaalsContact O-N 3.17Å
132	D	42.8	Very low	51.7	Low	146 Å²	146	95.4 Å²	95.4	78%	0.781	51%	0.51	S	S	*	.	S	Bend	trans	-126	38.5	137.7	-86.9	-34.9	0	0	0	108.6
133	I	39.4	Very low	49.6	Very low	79 Å²	79	98.4 Å²	98.4	41%	0.405	53%	0.531	S	S	.	.			trans	-145.9	113.4	175.1	-54.1	180	0	0	0	110	K102 I135	K102-I133 HydrophobicContact CD-CD1 4.17Å; K102-I133 HydrophobicContact CG-CD1 4.35Å; I133-I135 HydrophobicContact CG2-CD1 4.39Å; I133-I135 HydrophobicContact CG2-CG1 4.12Å
134	E	33.8	Very low	47.2	Very low	191 Å²	191	96.5 Å²	96.5	89%	0.893	55%	0.545	S	S	*	.			trans	-81.2	116.6	164.8	-75.7	-176.5	147.5	0	0	109.2
135	I	29.3	Very low	44.8	Very low	115 Å²	115	108 Å²	108	59%	0.59	59%	0.588	S	S	*	*			trans	-136.6	130.3	153	-56.7	-178.7	0	0	0	110.2	I133	I133-I135 HydrophobicContact CG2-CD1 4.39Å; I133-I135 HydrophobicContact CG2-CG1 4.12Å
136	T	27.8	Very low	42.7	Very low	112 Å²	112	113 Å²	113	69%	0.687	62%	0.621	S	S	*	*			trans	-91.8	152.3	-173.9	49.4	0	0	0	0	112.8
137	H	26.4	Very low	40.8	Very low	177 Å²	177	118.2 Å²	118.2	82%	0.819	65%	0.648	S	S	*	*			trans	95.7	117	161	-75.8	-81.9	0	0	0	119.2
138	A	24.7	Very low	38.5	Very low	70 Å²	70	121.4 Å²	121.4	58%	0.579	67%	0.669	S	S	*	*			trans	-92.2	153	177.1	0	0	0	0	0	112.9
139	S	24.3	Very low	36.4	Very low	119 Å²	119	126.5 Å²	126.5	83%	0.832	70%	0.695	S	S	*	*			trans	-168.4	103	138.9	34.7	0	0	0	0	113.9
140	E	25.2	Very low	34.4	Very low	176 Å²	176	131 Å²	131	82%	0.822	73%	0.725	S	S	*	*				47.9	110.8	128.4	-73.6	-171.2	164.7	0	0	125.6
141	I	26	Very low	32.6	Very low	135 Å²	135	130.8 Å²	130.8	69%	0.692	72%	0.719	S	S	*	*				68.1	117.5	129.2	-32.5	172.8	0	0	0	121.6
142	I	25.9	Very low	31.8	Very low	146 Å²	146	130.6 Å²	130.6	75%	0.749	71%	0.709	S	S	*	*				174.5	106.6	100.8	-76.4	177.2	0	0	0	111.6
143	T	28.4	Very low	31.6	Very low	131 Å²	131	126.9 Å²	126.9	80%	0.804	69%	0.689	S	S	*	*			trans	32.4	133.8	137.2	74	0	0	0	0	122.4
144	G	25.4	Very low	31.7	Very low	69 Å²	69	128 Å²	128	71%	0.711	69%	0.692	S	S	*	*			trans	154.3	84.7	133.1	0	0	0	0	0	119.3
145	R	29.5	Very low	31.9	Very low	243 Å²	243	123.5 Å²	123.5	92%	0.917	67%	0.674	S	S	*	*			trans	63.3	166.3	145.9	-79.3	-174.3	-175.8	-171.4	1.3	120.3
146	P	34.8	Very low	32.6	Very low	106 Å²	106	119.7 Å²	119.7	69%	0.688	66%	0.663	S	S	*	*			cis	-131.1	168.2	-25.8	30.9	-11.7	0	0	0	114.4	N148	P146-N148 PolarHBondContact O-N 3.27Å
147	L	40.2	Very low	33.8	Very low	170 Å²	170	122.3 Å²	122.3	89%	0.89	67%	0.673	S	S	*	*			trans	-53.5	111.6	154	-78	132.6	0	0	0	109.9
148	N	32.2	Very low	35.1	Very low	158 Å²	158	118.9 Å²	118.9	85%	0.845	65%	0.653	S	S	*	*			trans	-175.7	82.2	154.8	-96.1	-6.7	0	0	0	106.7	P146	P146-N148 PolarHBondContact O-N 3.27Å
149	D	35.8	Very low	36.5	Very low	118 Å²	118	115.6 Å²	115.6	63%	0.631	63%	0.625	S	S	*	*			trans	-101.6	111.3	163.2	-173.2	-13.4	0	0	0	107.5	H151	D149-H151 VanDerWaalsContact C-N 3.27Å; D149-H151 PolarHBondContact O-N 3.48Å; D149-H151 VanDerWaalsContact OD1-CB 3.26Å; D149-H151 WeakPolarHBondContact OD1-CB 3.05Å; D149-H151 IonicContact OD1-CD2 3.84Å; D149-H151 PolarHBondContact OD1-CD2 3.03Å; D149-H151 IonicContact OD1-CG 3.58Å; D149-H151 VanDerWaalsContact OD1-CG 3.23Å; D149-H151 PolarHBondContact OD1-N 3.47Å; D149-H151 IonicContact OD1-NE2 3.15Å; D149-H151 IonicContact OD2-CD2 3.03Å
150	P	36.1	Very low	37.8	Very low	111 Å²	111	114 Å²	114	72%	0.721	62%	0.62	S	S	*	*			trans	-87	15.3	179.3	36.4	-32.7	0	0	0	113	V152	P150-V152 PolarHBondContact O-N 3Å
151	H	38.8	Very low	39.2	Very low	134 Å²	134	110.6 Å²	110.6	62%	0.62	62%	0.615	S	S	*	*			trans	-80.2	113.5	-176.2	-65.5	-52.6	0	0	0	113.1	D149 R181	D149-H151 VanDerWaalsContact C-N 3.27Å; D149-H151 PolarHBondContact O-N 3.48Å; D149-H151 VanDerWaalsContact OD1-CB 3.26Å; D149-H151 WeakPolarHBondContact OD1-CB 3.05Å; D149-H151 IonicContact OD1-CD2 3.84Å; D149-H151 PolarHBondContact OD1-CD2 3.03Å; D149-H151 IonicContact OD1-CG 3.58Å; D149-H151 VanDerWaalsContact OD1-CG 3.23Å; D149-H151 PolarHBondContact OD1-N 3.47Å; D149-H151 IonicContact OD1-NE2 3.15Å; D149-H151 IonicContact OD2-CD2 3.03Å; H151-R181 PolarHBondContact O-NH2 3.46Å; H151-R181 VanDerWaalsContact O-NH2 3.15Å
152	V	41.6	Very low	40.8	Very low	36 Å²	36	105.3 Å²	105.3	22%	0.218	59%	0.59	C	S	.	*			trans	-66.8	127.5	165	179	0	0	0	0	108.3	P150 H154 C164	P150-V152 PolarHBondContact O-N 3Å; V152-H154 PolarHBondContact O-CD2 3.48Å; V152-H154 PolarHBondContact O-N 3.5Å; V152-C164 VanDerWaalsContact CG2-O 3.32Å; V152-C164 WeakPolarHBondContact CG2-O 3.35Å
153	L	38.8	Very low	42.9	Very low	68 Å²	68	106.2 Å²	106.2	36%	0.356	59%	0.591	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.5	111.3	178.3	-150.1	85.7	0	0	0	108.9	G116 L155	G116-L153 WeakPolarHBondContact O-CD2 3.37Å; L153-L155 HydrophobicContact CD2-CD1 4.4Å
154	H	41.7	Very low	44.5	Very low	102 Å²	102	100.2 Å²	100.2	47%	0.472	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.5	112.7	-176.6	-61	-71	0	0	0	111.5	V152 C159	V152-H154 PolarHBondContact O-CD2 3.48Å; V152-H154 PolarHBondContact O-N 3.5Å; H154-C159 HydrophobicContact CB-CB 3.9Å; H154-C159 PolarHBondContact CE1-O 2.86Å; H154-C159 PolarHBondContact ND1-O 3.32Å
155	L	37.8	Very low	46.2	Very low	98 Å²	98	101.6 Å²	101.6	51%	0.513	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	67.1	175.8	-78.5	131.6	0	0	0	110.9	L153 D170	L153-L155 HydrophobicContact CD2-CD1 4.4Å; L155-D170 PolarHBondContact O-N 3.4Å
156	G	44.1	Very low	47.8	Very low	35 Å²	35	91.4 Å²	91.4	36%	0.361	51%	0.505	S	S	.	.	S	Bend	trans	138.2	154	175.6	0	0	0	0	0	113.7	R158 C159	G156-R158 PolarHBondContact O-N 2.69Å; G156-C159 WeakPolarHBondContact O-CB 3.37Å; G156-C159 PolarHBondContact O-N 3.34Å; G156-C159 VanDerWaalsContact O-N 3.09Å
157	D	51.5	Low	49.1	Very low	166 Å²	166	87.9 Å²	87.9	89%	0.888	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-64.3	-22.9	-170.5	-63.9	-30.1	0	0	0	113.9
158	R	54.1	Low	50.2	Low	106 Å²	106	79.8 Å²	79.8	40%	0.4	44%	0.438	S	S	.	.	G	3₁₀ helix	trans	-86.9	-3.5	177.4	-56	-171.9	-58.3	162.1	9.5	114.3	G156 A160 D170 G173 V176	G156-R158 PolarHBondContact O-N 2.69Å; R158-A160 VanDerWaalsContact C-N 3.28Å; R158-A160 PolarHBondContact O-N 3.44Å; R158-D170 VanDerWaalsContact CB-OD2 3.28Å; R158-D170 WeakPolarHBondContact CB-OD2 3.43Å; R158-D170 VanDerWaalsContact CG-OD2 3.25Å; R158-D170 WeakPolarHBondContact CG-OD2 3.42Å; R158-D170 IonicContact CZ-OD1 3.84Å; R158-D170 VanDerWaalsContact CZ-OD1 3.25Å; R158-D170 IonicContact CZ-OD2 2.93Å; R158-D170 VanDerWaalsContact NE-CG 3.32Å; R158-D170 IonicContact NE-OD1 2.86Å; R158-D170 PolarHBondContact NE-OD1 2.82Å; R158-D170 VanDerWaalsContact NE-OD1 3.1Å; R158-D170 IonicContact NE-OD2 3.3Å; R158-D170 PolarHBondContact NE-OD2 3.33Å; R158-D170 IonicContact NH2-OD1 3.02Å; R158-D170 PolarHBondContact NH2-OD1 2.91Å; R158-D170 IonicContact NH2-OD2 3.02Å; R158-G173 VanDerWaalsContact CZ-O 3.3Å; R158-G173 PolarHBondContact NH1-O 3.09Å; R158-G173 PolarHBondContact NH2-O 3.11Å; R158-V176 HydrophobicContact CB-CG1 4.31Å
159	C	55.1	Low	51.9	Low	0 Å²	0	74.6 Å²	74.6	0%	0	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-79.1	-9.6	178.1	-76.3	0	0	0	0	113.6	H154 G156 S161 S162 C168	H154-C159 HydrophobicContact CB-CB 3.9Å; H154-C159 PolarHBondContact CE1-O 2.86Å; H154-C159 PolarHBondContact ND1-O 3.32Å; G156-C159 WeakPolarHBondContact O-CB 3.37Å; G156-C159 PolarHBondContact O-N 3.34Å; G156-C159 VanDerWaalsContact O-N 3.09Å; C159-S161 PolarHBondContact O-N 3.49Å; C159-S162 PolarHBondContact O-N 3.11Å; C159-S162 PolarHBondContact O-OG 3.34Å; C159-S162 VanDerWaalsContact O-OG 3.08Å; C159-C168 WeakPolarHBondContact CA-SG 3.24Å; C159-C168 HydrophobicContact CB-CB 3.72Å; C159-C168 WeakPolarHBondContact CB-SG 3.43Å; C159-C168 WeakPolarHBondContact SG-CB 3.32Å; C159-C168 PolarHBondContact SG-O 3.34Å; C159-C168 VanDerWaalsContact SG-O 3.35Å; C159-C168 CovalentContact SG-SG 2.05Å; C159-C168 PolarHBondContact SG-SG 2.88Å
160	A	51.2	Low	53.1	Low	87 Å²	87	71.1 Å²	71.1	72%	0.719	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-66.3	-18.9	-178.7	0	0	0	0	0	114.3	R158	R158-A160 VanDerWaalsContact C-N 3.28Å; R158-A160 PolarHBondContact O-N 3.44Å
161	S	53.9	Low	54.4	Low	104 Å²	104	74.8 Å²	74.8	73%	0.727	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-114.8	13.8	178.5	61.9	0	0	0	0	113.6	C159	C159-S161 PolarHBondContact O-N 3.49Å
162	S	60.2	Low	54.7	Low	23 Å²	23	71.5 Å²	71.5	16%	0.161	39%	0.392	C	S	.	.			trans	-84	141.5	-178.5	75.6	0	0	0	0	112	C159 C164	C159-S162 PolarHBondContact O-N 3.11Å; C159-S162 PolarHBondContact O-OG 3.34Å; C159-S162 VanDerWaalsContact O-OG 3.08Å; S162-C164 PolarHBondContact O-N 2.93Å
163	H	68.9	Low	55.2	Low	166 Å²	166	71.8 Å²	71.8	77%	0.769	40%	0.401	S	S	*	.			trans	-87	19.3	171.8	-61.8	-66.5	0	0	0	113.3	E165 M191	H163-E165 PolarHBondContact O-N 3.38Å; H163-M191 HydrophobicContact CB-SD 3.95Å
164	C	63.2	Low	55.5	Low	4 Å²	4	74.1 Å²	74.1	3%	0.027	41%	0.411	C	S	.	.			trans	-66.1	129	179.4	-56.9	0	0	0	0	110.7	V152 S162 C168 C178	V152-C164 VanDerWaalsContact CG2-O 3.32Å; V152-C164 WeakPolarHBondContact CG2-O 3.35Å; S162-C164 PolarHBondContact O-N 2.93Å; C164-C168 HydrophobicContact CB-CB 4.15Å; C164-C178 VanDerWaalsContact CA-SG 3.53Å; C164-C178 HydrophobicContact CB-CB 3.66Å; C164-C178 WeakPolarHBondContact CB-SG 3.23Å; C164-C178 VanDerWaalsContact SG-CA 3.55Å; C164-C178 WeakPolarHBondContact SG-CB 3.34Å; C164-C178 CovalentContact SG-SG 2.02Å; C164-C178 PolarHBondContact SG-SG 2.69Å
165	E	61.5	Low	56.3	Low	98 Å²	98	78.1 Å²	78.1	46%	0.458	43%	0.427	S	S	.	.	S	Bend	trans	-71.4	-34.9	-176.1	-176.4	170.9	-178.7	0	0	113.4	H163 M191 A192 C193	H163-E165 PolarHBondContact O-N 3.38Å; E165-M191 PolarHBondContact N-O 2.79Å; E165-A192 VanDerWaalsContact OE2-CA 3.29Å; E165-A192 WeakPolarHBondContact OE2-CA 3.38Å; E165-A192 WeakPolarHBondContact OE2-CB 3.01Å; E165-C193 HydrophobicContact CB-CB 4.37Å; E165-C193 HydrophobicContact CG-CB 4.44Å; E165-C193 PolarHBondContact OE2-N 3.22Å
166	H	61.5	Low	57.6	Low	30 Å²	30	75.5 Å²	75.5	14%	0.139	42%	0.415	C	S	.	.	S	Bend	trans	-120.4	-58.9	-173.8	-81.3	161.6	0	0	0	114.8	R181 F184 C193	H166-R181 HydrophobicContact CB-CG 4.07Å; H166-F184 AromaticContact CE1-CD1 3.69Å; H166-F184 AromaticContact CE1-CD2 3.63Å; H166-F184 AromaticContact CE1-CE1 3.88Å; H166-F184 AromaticContact CE1-CE2 3.81Å; H166-F184 AromaticContact CE1-CG 3.57Å; H166-F184 AromaticContact CE1-CZ 3.93Å; H166-C193 HydrophobicContact CB-CB 4.47Å; H166-C193 WeakPolarHBondContact ND1-CB 3.49Å; H166-C193 PolarHBondContact ND1-SG 2.85Å; H166-C193 VanDerWaalsContact ND1-SG 3.43Å
167	L	63.7	Low	58.9	Low	32 Å²	32	78.4 Å²	78.4	17%	0.168	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	144	179.8	-59.9	119.8	0	0	0	110.9	C178 S179 R181	L167-C178 CarbonylContact O-C 3.57Å; L167-C178 VanDerWaalsContact O-CA 3.29Å; L167-C178 WeakPolarHBondContact O-CA 3.49Å; L167-S179 WeakPolarHBondContact CB-O 3.01Å; L167-S179 WeakPolarHBondContact CB-OG 3.43Å; L167-S179 PolarHBondContact N-O 2.88Å; L167-S179 PolarHBondContact O-N 3.45Å; L167-R181 HydrophobicContact CD1-CB 4.47Å; L167-R181 HydrophobicContact CD1-CG 3.84Å
168	C	62.7	Low	59.9	Low	0 Å²	0	71.2 Å²	71.2	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	131.8	174.3	169.8	0	0	0	0	110.3	C159 C164	C159-C168 WeakPolarHBondContact CA-SG 3.24Å; C159-C168 HydrophobicContact CB-CB 3.72Å; C159-C168 WeakPolarHBondContact CB-SG 3.43Å; C159-C168 WeakPolarHBondContact SG-CB 3.32Å; C159-C168 PolarHBondContact SG-O 3.34Å; C159-C168 VanDerWaalsContact SG-O 3.35Å; C159-C168 CovalentContact SG-SG 2.05Å; C159-C168 PolarHBondContact SG-SG 2.88Å; C164-C168 HydrophobicContact CB-CB 4.15Å
169	H	66.9	Low	60.6	Low	49 Å²	49	67.9 Å²	67.9	23%	0.227	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	122.7	176	-56.2	-70.7	0	0	0	111.1	R171 E177 S179	H169-R171 HydrophobicContact CB-CG 4.44Å; H169-R171 PolarHBondContact O-N 2.93Å; H169-E177 HydrophobicContact CB-CB 4.34Å; H169-E177 WeakPolarHBondContact CB-O 3.47Å; H169-E177 PolarHBondContact CD2-O 2.94Å; H169-E177 PolarHBondContact N-O 3.36Å; H169-E177 PolarHBondContact O-N 2.65Å; H169-S179 PolarHBondContact NE2-OG 2.83Å
170	D	63	Low	61.1	Low	45 Å²	45	69.1 Å²	69.1	24%	0.241	38%	0.382	C	S	.	.			trans	-94.4	92.1	169.3	-170.1	-6.1	0	0	0	110.7	L155 R158 G172	L155-D170 PolarHBondContact O-N 3.4Å; R158-D170 VanDerWaalsContact CB-OD2 3.28Å; R158-D170 WeakPolarHBondContact CB-OD2 3.43Å; R158-D170 VanDerWaalsContact CG-OD2 3.25Å; R158-D170 WeakPolarHBondContact CG-OD2 3.42Å; R158-D170 IonicContact CZ-OD1 3.84Å; R158-D170 VanDerWaalsContact CZ-OD1 3.25Å; R158-D170 IonicContact CZ-OD2 2.93Å; R158-D170 VanDerWaalsContact NE-CG 3.32Å; R158-D170 IonicContact NE-OD1 2.86Å; R158-D170 PolarHBondContact NE-OD1 2.82Å; R158-D170 VanDerWaalsContact NE-OD1 3.1Å; R158-D170 IonicContact NE-OD2 3.3Å; R158-D170 PolarHBondContact NE-OD2 3.33Å; R158-D170 IonicContact NH2-OD1 3.02Å; R158-D170 PolarHBondContact NH2-OD1 2.91Å; R158-D170 IonicContact NH2-OD2 3.02Å; D170-G172 VanDerWaalsContact C-N 3.32Å; D170-G172 PolarHBondContact OD1-N 2.61Å
171	R	62	Low	61.3	Low	188 Å²	188	68.2 Å²	68.2	71%	0.709	36%	0.36	S	S	*	.			trans	-91.2	13.3	176.4	-67.6	-172.2	174.2	161.1	-6.5	113.9	H169 G173 E177	H169-R171 HydrophobicContact CB-CG 4.44Å; H169-R171 PolarHBondContact O-N 2.93Å; R171-G173 PolarHBondContact O-N 2.71Å; R171-E177 WeakPolarHBondContact CD-OE2 3.24Å; R171-E177 IonicContact CZ-OE2 3.27Å; R171-E177 IonicContact NE-OE2 2.89Å; R171-E177 IonicContact NH1-OE1 3.24Å; R171-E177 IonicContact NH1-OE2 3.85Å; R171-E177 PolarHBondContact NH1-OE2 2.72Å
172	G	45.7	Very low	61.4	Low	65 Å²	65	69 Å²	69	67%	0.67	37%	0.366	S	S	*	.	S	Bend	trans	75.3	15.7	178	0	0	0	0	0	115.7	D170	D170-G172 VanDerWaalsContact C-N 3.32Å; D170-G172 PolarHBondContact OD1-N 2.61Å
173	G	52.2	Low	61.1	Low	41 Å²	41	68.6 Å²	68.6	42%	0.423	37%	0.365	S	S	.	.	S	Bend	trans	-92.5	-173.1	171.9	0	0	0	0	0	114	R158 R171	R158-G173 VanDerWaalsContact CZ-O 3.3Å; R158-G173 PolarHBondContact NH1-O 3.09Å; R158-G173 PolarHBondContact NH2-O 3.11Å; R171-G173 PolarHBondContact O-N 2.71Å
174	E	45	Very low	60.9	Low	118 Å²	118	62.4 Å²	62.4	55%	0.551	34%	0.336	S	S	*	.	S	Bend	trans	-72.8	-23.9	-176.6	-68.3	-170.4	164.7	0	0	115.4	Q413	E174-Q413 VanDerWaalsContact CD-NE2 3.28Å; E174-Q413 VanDerWaalsContact OE1-CD 3.22Å; E174-Q413 PolarHBondContact OE1-NE2 3.39Å; E174-Q413 PolarHBondContact OE1-OE1 3.29Å; E174-Q413 PolarHBondContact OE2-NE2 2.65Å; E174-Q413 PolarHBondContact OE2-OE1 3.2Å; E174-Q413 VanDerWaalsContact OE2-OE1 3.13Å
175	K	58	Low	61.4	Low	186 Å²	186	65.2 Å²	65.2	81%	0.809	35%	0.351	S	S	*	.	S	Bend	trans	-125.8	149.3	175.1	-66.4	-177.2	-179.3	179.8	0	109.7
176	V	66.2	Low	62	Low	43 Å²	43	64.3 Å²	64.3	26%	0.261	35%	0.348	S	S	.	.			trans	-71.8	138.5	168.5	-67	0	0	0	0	109.3	R158	R158-V176 HydrophobicContact CB-CG1 4.31Å
177	E	71.3	Confident	62.6	Low	96 Å²	96	63.4 Å²	63.4	45%	0.449	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	113.5	-177.5	-169.2	179.7	-178.1	0	0	108.5	H169 R171	H169-E177 HydrophobicContact CB-CB 4.34Å; H169-E177 WeakPolarHBondContact CB-O 3.47Å; H169-E177 PolarHBondContact CD2-O 2.94Å; H169-E177 PolarHBondContact N-O 3.36Å; H169-E177 PolarHBondContact O-N 2.65Å; R171-E177 WeakPolarHBondContact CD-OE2 3.24Å; R171-E177 IonicContact CZ-OE2 3.27Å; R171-E177 IonicContact NE-OE2 2.89Å; R171-E177 IonicContact NH1-OE1 3.24Å; R171-E177 IonicContact NH1-OE2 3.85Å; R171-E177 PolarHBondContact NH1-OE2 2.72Å
178	C	72.1	Confident	62.9	Low	14 Å²	14	68.8 Å²	68.8	10%	0.095	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	144.8	176.8	-52.7	0	0	0	0	110.7	C164 L167 L186 G190	C164-C178 VanDerWaalsContact CA-SG 3.53Å; C164-C178 HydrophobicContact CB-CB 3.66Å; C164-C178 WeakPolarHBondContact CB-SG 3.23Å; C164-C178 VanDerWaalsContact SG-CA 3.55Å; C164-C178 WeakPolarHBondContact SG-CB 3.34Å; C164-C178 CovalentContact SG-SG 2.02Å; C164-C178 PolarHBondContact SG-SG 2.69Å; L167-C178 CarbonylContact O-C 3.57Å; L167-C178 VanDerWaalsContact O-CA 3.29Å; L167-C178 WeakPolarHBondContact O-CA 3.49Å; C178-L186 HydrophobicContact CB-CD1 4.17Å; C178-G190 VanDerWaalsContact CB-O 3.28Å; C178-G190 WeakPolarHBondContact CB-O 3.29Å; C178-G190 PolarHBondContact SG-O 3.1Å
179	S	68.8	Low	63.3	Low	36 Å²	36	73.1 Å²	73.1	25%	0.252	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	158.3	169.1	74	0	0	0	0	110.8	L167 H169	L167-S179 WeakPolarHBondContact CB-O 3.01Å; L167-S179 WeakPolarHBondContact CB-OG 3.43Å; L167-S179 PolarHBondContact N-O 2.88Å; L167-S179 PolarHBondContact O-N 3.45Å; H169-S179 PolarHBondContact NE2-OG 2.83Å
180	C	64.6	Low	63.6	Low	26 Å²	26	72.1 Å²	72.1	18%	0.176	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-97.1	150	-179.4	-59.2	0	0	0	0	112.6	F184 L186 C193	C180-F184 HydrophobicContact CB-CB 3.78Å; C180-L186 VanDerWaalsContact SG-CA 3.52Å; C180-C193 WeakPolarHBondContact CA-SG 3.09Å; C180-C193 HydrophobicContact CB-CB 3.76Å; C180-C193 WeakPolarHBondContact CB-SG 3.28Å; C180-C193 WeakPolarHBondContact SG-CA 2.93Å; C180-C193 WeakPolarHBondContact SG-CB 3.36Å; C180-C193 CovalentContact SG-SG 2.03Å; C180-C193 PolarHBondContact SG-SG 2.05Å
181	R	55	Low	64.2	Low	69 Å²	69	73.8 Å²	73.8	26%	0.26	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-61	154.1	168.5	-71.5	172.5	-172.5	-128.9	8.5	109.1	V115 H151 H166 L167 G183 F184	V115-R181 PolarHBondContact O-NH1 3.13Å; H151-R181 PolarHBondContact O-NH2 3.46Å; H151-R181 VanDerWaalsContact O-NH2 3.15Å; H166-R181 HydrophobicContact CB-CG 4.07Å; L167-R181 HydrophobicContact CD1-CB 4.47Å; L167-R181 HydrophobicContact CD1-CG 3.84Å; R181-G183 PolarHBondContact O-N 2.98Å; R181-F184 PolarHBondContact O-N 3.26Å
182	S	56.6	Low	64.6	Low	121 Å²	121	66.1 Å²	66.1	85%	0.846	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	137.1	176.7	-59.3	0	0	0	0	111.3
183	G	54.2	Low	65.6	Low	13 Å²	13	63.3 Å²	63.3	13%	0.134	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.5	1.4	-173.1	0	0	0	0	0	114.5	R181 R196	R181-G183 PolarHBondContact O-N 2.98Å; G183-R196 WeakPolarHBondContact O-CB 3.15Å; G183-R196 PolarHBondContact O-N 3.37Å
184	F	64.1	Low	66.7	Low	36 Å²	36	65.1 Å²	65.1	16%	0.158	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	148.6	177.6	-61.8	-98.9	0	0	0	111.1	H166 C180 R181 C193 V194 D195 I216 G217	H166-F184 AromaticContact CE1-CD1 3.69Å; H166-F184 AromaticContact CE1-CD2 3.63Å; H166-F184 AromaticContact CE1-CE1 3.88Å; H166-F184 AromaticContact CE1-CE2 3.81Å; H166-F184 AromaticContact CE1-CG 3.57Å; H166-F184 AromaticContact CE1-CZ 3.93Å; C180-F184 HydrophobicContact CB-CB 3.78Å; R181-F184 PolarHBondContact O-N 3.26Å; F184-C193 HydrophobicContact CB-CB 4.15Å; F184-V194 CarbonylContact C-O 3.57Å; F184-V194 WeakPolarHBondContact CA-O 3.07Å; F184-V194 WeakPolarHBondContact CB-O 2.96Å; F184-D195 HydrophobicContact CD1-CB 4.28Å; F184-D195 HydrophobicContact CE1-CB 4.22Å; F184-I216 HydrophobicContact CE1-CG2 3.89Å; F184-I216 HydrophobicContact CZ-CG2 3.66Å; F184-G217 VanDerWaalsContact CZ-CA 3.48Å
185	D	73.8	Confident	67.8	Low	64 Å²	64	61.8 Å²	61.8	34%	0.342	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	145.2	174.2	-68.8	-36.7	0	0	0	110.6	A187 C193 V194 R196	D185-A187 PolarHBondContact O-N 2.93Å; D185-C193 WeakPolarHBondContact O-CA 3.04Å; D185-V194 HydrophobicContact CB-CG2 4.26Å; D185-V194 PolarHBondContact N-O 3.23Å; D185-V194 WeakPolarHBondContact O-CG2 3.03Å; D185-V194 PolarHBondContact O-N 3.07Å; D185-R196 IonicContact OD1-CZ 3.21Å; D185-R196 IonicContact OD1-NE 2.79Å; D185-R196 PolarHBondContact OD1-NE 3.47Å; D185-R196 IonicContact OD1-NH2 2.78Å; D185-R196 PolarHBondContact OD1-NH2 3.12Å; D185-R196 WeakPolarHBondContact OD2-CG 3.31Å; D185-R196 IonicContact OD2-NE 2.68Å; D185-R196 PolarHBondContact OD2-NE 2.71Å
186	L	74.9	Confident	68.8	Low	78 Å²	78	58.3 Å²	58.3	41%	0.408	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	125	176.9	-166.9	70.3	0	0	0	109.1	C178 C180	C178-L186 HydrophobicContact CB-CD1 4.17Å; C180-L186 VanDerWaalsContact SG-CA 3.52Å
187	A	73.3	Confident	69.1	Low	11 Å²	11	59.2 Å²	59.2	9%	0.091	34%	0.337	C	S	.	.			trans	-65.7	160.7	177.2	0	0	0	0	0	111	D185 D189 G190 A192 V194	D185-A187 PolarHBondContact O-N 2.93Å; A187-D189 WeakPolarHBondContact CB-OD1 3.32Å; A187-D189 PolarHBondContact O-N 3.46Å; A187-G190 PolarHBondContact O-N 3.38Å; A187-A192 HydrophobicContact CB-CB 3.92Å; A187-A192 VanDerWaalsContact CB-O 3.32Å; A187-A192 WeakPolarHBondContact CB-O 3.36Å; A187-A192 PolarHBondContact N-O 2.92Å; A187-V194 HydrophobicContact CB-CG1 4.25Å
188	P	69.9	Low	69.3	Low	146 Å²	146	55.9 Å²	55.9	95%	0.948	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-18.4	-178.1	-23.8	34.2	0	0	0	114.9	G190	P188-G190 PolarHBondContact O-N 3.06Å
189	D	71.4	Confident	69.2	Low	90 Å²	90	56.8 Å²	56.8	48%	0.481	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-9.7	173.9	62.8	14.1	0	0	0	113.3	A187 M191 A192	A187-D189 WeakPolarHBondContact CB-OD1 3.32Å; A187-D189 PolarHBondContact O-N 3.46Å; D189-M191 PolarHBondContact O-N 3.08Å; D189-M191 PolarHBondContact OD1-N 2.85Å; D189-A192 PolarHBondContact OD1-N 2.78Å; D189-A192 WeakPolarHBondContact OD2-CB 3.03Å
190	G	72.8	Confident	69.3	Low	29 Å²	29	61.8 Å²	61.8	30%	0.299	35%	0.351	S	S	.	.	S	Bend	trans	72.3	12	179	0	0	0	0	0	114.5	C178 A187 P188	C178-G190 VanDerWaalsContact CB-O 3.28Å; C178-G190 WeakPolarHBondContact CB-O 3.29Å; C178-G190 PolarHBondContact SG-O 3.1Å; A187-G190 PolarHBondContact O-N 3.38Å; P188-G190 PolarHBondContact O-N 3.06Å
191	M	75.4	Confident	69.4	Low	80 Å²	80	63.8 Å²	63.8	39%	0.394	36%	0.363	S	S	.	.	S	Bend	trans	-132.8	-39.1	-173.7	-66.9	-179	-72.7	0	0	113.5	H163 E165 D189	H163-M191 HydrophobicContact CB-SD 3.95Å; E165-M191 PolarHBondContact N-O 2.79Å; D189-M191 PolarHBondContact O-N 3.08Å; D189-M191 PolarHBondContact OD1-N 2.85Å
192	A	70.4	Confident	69.4	Low	26 Å²	26	73.2 Å²	73.2	22%	0.215	40%	0.398	C	S	.	.			trans	-86.2	154	179.6	0	0	0	0	0	111.8	E165 A187 D189	E165-A192 VanDerWaalsContact OE2-CA 3.29Å; E165-A192 WeakPolarHBondContact OE2-CA 3.38Å; E165-A192 WeakPolarHBondContact OE2-CB 3.01Å; A187-A192 HydrophobicContact CB-CB 3.92Å; A187-A192 VanDerWaalsContact CB-O 3.32Å; A187-A192 WeakPolarHBondContact CB-O 3.36Å; A187-A192 PolarHBondContact N-O 2.92Å; D189-A192 PolarHBondContact OD1-N 2.78Å; D189-A192 WeakPolarHBondContact OD2-CB 3.03Å
193	C	67.8	Low	69.6	Low	7 Å²	7	75.8 Å²	75.8	5%	0.047	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	109	-178.2	-71.3	0	0	0	0	110.3	E165 H166 C180 F184 D185	E165-C193 HydrophobicContact CB-CB 4.37Å; E165-C193 HydrophobicContact CG-CB 4.44Å; E165-C193 PolarHBondContact OE2-N 3.22Å; H166-C193 HydrophobicContact CB-CB 4.47Å; H166-C193 WeakPolarHBondContact ND1-CB 3.49Å; H166-C193 PolarHBondContact ND1-SG 2.85Å; H166-C193 VanDerWaalsContact ND1-SG 3.43Å; C180-C193 WeakPolarHBondContact CA-SG 3.09Å; C180-C193 HydrophobicContact CB-CB 3.76Å; C180-C193 WeakPolarHBondContact CB-SG 3.28Å; C180-C193 WeakPolarHBondContact SG-CA 2.93Å; C180-C193 WeakPolarHBondContact SG-CB 3.36Å; C180-C193 CovalentContact SG-SG 2.03Å; C180-C193 PolarHBondContact SG-SG 2.05Å; F184-C193 HydrophobicContact CB-CB 4.15Å; D185-C193 WeakPolarHBondContact O-CA 3.04Å
194	V	76	Confident	69.8	Low	79 Å²	79	78 Å²	78	48%	0.479	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	140.8	178.8	-67.1	0	0	0	0	110.4	F184 D185 A187 R196	F184-V194 CarbonylContact C-O 3.57Å; F184-V194 WeakPolarHBondContact CA-O 3.07Å; F184-V194 WeakPolarHBondContact CB-O 2.96Å; D185-V194 HydrophobicContact CB-CG2 4.26Å; D185-V194 PolarHBondContact N-O 3.23Å; D185-V194 WeakPolarHBondContact O-CG2 3.03Å; D185-V194 PolarHBondContact O-N 3.07Å; A187-V194 HydrophobicContact CB-CG1 4.25Å; V194-R196 PolarHBondContact O-N 3.48Å
195	D	67.9	Low	69.8	Low	48 Å²	48	78.9 Å²	78.9	26%	0.257	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.4	126.4	176.6	-178.8	59.6	0	0	0	111	F184 N197 N214 I216 G217	F184-D195 HydrophobicContact CD1-CB 4.28Å; F184-D195 HydrophobicContact CE1-CB 4.22Å; D195-N197 PolarHBondContact O-N 2.78Å; D195-N214 PolarHBondContact OD2-ND2 2.87Å; D195-I216 WeakPolarHBondContact OD1-CA 3.41Å; D195-G217 PolarHBondContact OD1-N 3.38Å
196	R	77.6	Confident	69.4	Low	113 Å²	113	76.5 Å²	76.5	43%	0.426	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-79.7	118.1	177.5	175.3	-175.2	-67.2	-169.6	7.4	107.8	G183 D185 V194 E198	G183-R196 WeakPolarHBondContact O-CB 3.15Å; G183-R196 PolarHBondContact O-N 3.37Å; D185-R196 IonicContact OD1-CZ 3.21Å; D185-R196 IonicContact OD1-NE 2.79Å; D185-R196 PolarHBondContact OD1-NE 3.47Å; D185-R196 IonicContact OD1-NH2 2.78Å; D185-R196 PolarHBondContact OD1-NH2 3.12Å; D185-R196 WeakPolarHBondContact OD2-CG 3.31Å; D185-R196 IonicContact OD2-NE 2.68Å; D185-R196 PolarHBondContact OD2-NE 2.71Å; V194-R196 PolarHBondContact O-N 3.48Å; R196-E198 HydrophobicContact CG-CG 4.27Å; R196-E198 PolarHBondContact O-N 3.3Å; R196-E198 VanDerWaalsContact O-N 3.08Å
197	N	72.7	Confident	69	Low	61 Å²	61	76.4 Å²	76.4	33%	0.326	41%	0.411	S	S	.	.			trans	-82.3	91.7	176.8	-168.7	-25.2	0	0	0	112	D195 C199 L200 N214	D195-N197 PolarHBondContact O-N 2.78Å; N197-C199 PolarHBondContact O-N 2.96Å; N197-C199 WeakPolarHBondContact OD1-CB 3.3Å; N197-C199 PolarHBondContact OD1-N 2.79Å; N197-C199 VanDerWaalsContact OD1-N 3.11Å; N197-L200 HydrophobicContact CB-CD1 4.03Å; N197-L200 HydrophobicContact CB-CG 4.29Å; N197-L200 WeakPolarHBondContact ND2-CD1 3.31Å; N197-L200 PolarHBondContact O-N 2.83Å; N197-N214 WeakPolarHBondContact CA-OD1 3.01Å; N197-N214 VanDerWaalsContact CG-CG 3.5Å
198	E	76.1	Confident	68.4	Low	26 Å²	26	85.5 Å²	85.5	12%	0.121	45%	0.451	C	S	.	.	G	3₁₀ helix	trans	-69	-12.6	-179.2	-58.5	88.9	175.8	0	0	113.7	R196 L200 T201 P205 G218 Y219	R196-E198 HydrophobicContact CG-CG 4.27Å; R196-E198 PolarHBondContact O-N 3.3Å; R196-E198 VanDerWaalsContact O-N 3.08Å; E198-L200 VanDerWaalsContact C-N 3.25Å; E198-L200 PolarHBondContact O-N 3.32Å; E198-T201 PolarHBondContact O-OG1 3.11Å; E198-P205 HydrophobicContact CB-CG 4.06Å; E198-P205 WeakPolarHBondContact O-CD 3.45Å; E198-G218 VanDerWaalsContact OE2-C 3.29Å; E198-Y219 HydrophobicContact CB-CD1 3.59Å; E198-Y219 HydrophobicContact CB-CE1 4.23Å; E198-Y219 HydrophobicContact CB-CG 4.12Å; E198-Y219 HydrophobicContact CG-CD1 3.81Å; E198-Y219 HydrophobicContact CG-CE1 4.32Å
199	C	70	Confident	67.7	Low	33 Å²	33	81.9 Å²	81.9	22%	0.223	43%	0.429	C	S	.	.	G	3₁₀ helix	trans	-76.9	-10.8	175.7	-56.5	0	0	0	0	113.5	N197 C212 N214	N197-C199 PolarHBondContact O-N 2.96Å; N197-C199 WeakPolarHBondContact OD1-CB 3.3Å; N197-C199 PolarHBondContact OD1-N 2.79Å; N197-C199 VanDerWaalsContact OD1-N 3.11Å; C199-C212 WeakPolarHBondContact CA-SG 3.04Å; C199-C212 HydrophobicContact CB-CB 3.73Å; C199-C212 WeakPolarHBondContact CB-SG 3.19Å; C199-C212 WeakPolarHBondContact SG-CB 3.09Å; C199-C212 CovalentContact SG-SG 2.04Å; C199-C212 PolarHBondContact SG-SG 2.91Å; C199-N214 PolarHBondContact SG-N 2.78Å
200	L	70.9	Confident	67.5	Low	142 Å²	142	80 Å²	80	74%	0.743	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-100.6	1.7	-179.5	-62.9	177.9	0	0	0	113.7	N197 E198	N197-L200 HydrophobicContact CB-CD1 4.03Å; N197-L200 HydrophobicContact CB-CG 4.29Å; N197-L200 WeakPolarHBondContact ND2-CD1 3.31Å; N197-L200 PolarHBondContact O-N 2.83Å; E198-L200 VanDerWaalsContact C-N 3.25Å; E198-L200 PolarHBondContact O-N 3.32Å
201	T	67.1	Low	67.1	Low	68 Å²	68	82.1 Å²	82.1	42%	0.417	42%	0.422	S	S	.	.	S	Bend	trans	-72.6	147.7	179.9	55.8	0	0	0	0	111.8	E198 Q203 S204	E198-T201 PolarHBondContact O-OG1 3.11Å; T201-Q203 CarbonylContact O-C 3.55Å; T201-Q203 PolarHBondContact O-N 3.3Å; T201-Q203 PolarHBondContact OG1-O 2.79Å; T201-S204 PolarHBondContact O-N 3.3Å
202	R	54.3	Low	66.6	Low	267 Å²	267	79.9 Å²	79.9	100%	1.008	41%	0.414	S	S	*	.	S	Bend	trans	-57.6	-24.4	-178.9	-79.2	-172	178.6	171.8	1.1	114.1
203	Q	61.4	Low	66.5	Low	174 Å²	174	81.7 Å²	81.7	81%	0.813	42%	0.422	S	S	*	.	S	Bend	trans	-116.8	106	163	-79.1	176.5	-11.8	0	0	106.7	T201	T201-Q203 CarbonylContact O-C 3.55Å; T201-Q203 PolarHBondContact O-N 3.3Å; T201-Q203 PolarHBondContact OG1-O 2.79Å
204	S	57.6	Low	65.8	Low	61 Å²	61	83.8 Å²	83.8	43%	0.427	43%	0.433	S	S	.	.			trans	-60.1	138.1	173.2	172.6	0	0	0	0	109.3	T201 C206	T201-S204 PolarHBondContact O-N 3.3Å; S204-C206 PolarHBondContact O-N 3.04Å; S204-C206 PolarHBondContact OG-N 3.23Å
205	P	63.5	Low	65	Low	53 Å²	53	82.4 Å²	82.4	34%	0.344	43%	0.425	S	S	.	.	S	Bend	trans	-75.5	-10.4	-178.3	32.1	-37.9	0	0	0	113.5	E198 Y219	E198-P205 HydrophobicContact CB-CG 4.06Å; E198-P205 WeakPolarHBondContact O-CD 3.45Å; P205-Y219 HydrophobicContact CB-CD2 4.33Å; P205-Y219 HydrophobicContact CB-CE1 3.96Å; P205-Y219 HydrophobicContact CB-CE2 3.57Å; P205-Y219 WeakPolarHBondContact CB-OH 3.49Å; P205-Y219 HydrophobicContact CG-CD1 4.05Å; P205-Y219 HydrophobicContact CG-CD2 3.64Å; P205-Y219 HydrophobicContact CG-CE1 3.85Å; P205-Y219 HydrophobicContact CG-CE2 3.41Å; P205-Y219 VanDerWaalsContact CG-CE2 3.41Å; P205-Y219 HydrophobicContact CG-CG 3.98Å
206	C	65.4	Low	64.4	Low	14 Å²	14	87.3 Å²	87.3	10%	0.095	45%	0.449	C	S	.	.	S	Bend	trans	-90.6	152	176.4	-59.9	0	0	0	0	111.9	S204 E210 C212 C221	S204-C206 PolarHBondContact O-N 3.04Å; S204-C206 PolarHBondContact OG-N 3.23Å; C206-E210 HydrophobicContact CB-CB 4.13Å; C206-C212 HydrophobicContact CB-CB 4.29Å; C206-C212 VanDerWaalsContact SG-CB 3.56Å; C206-C221 WeakPolarHBondContact CA-SG 3.46Å; C206-C221 HydrophobicContact CB-CB 3.81Å; C206-C221 WeakPolarHBondContact CB-SG 3.26Å; C206-C221 WeakPolarHBondContact SG-CA 3.34Å; C206-C221 WeakPolarHBondContact SG-CB 3.13Å; C206-C221 CovalentContact SG-SG 2.03Å; C206-C221 PolarHBondContact SG-SG 3.1Å
207	T	67.3	Low	63.1	Low	76 Å²	76	83.3 Å²	83.3	47%	0.466	44%	0.444	S	S	.	.			trans	-68.3	160.2	176.8	66.9	0	0	0	0	110.9	S209 E210	T207-S209 PolarHBondContact O-N 2.72Å; T207-S209 PolarHBondContact OG1-OG 3.23Å; T207-S209 VanDerWaalsContact OG1-OG 3.11Å; T207-E210 PolarHBondContact N-OE2 3.09Å; T207-E210 PolarHBondContact O-N 2.95Å; T207-E210 PolarHBondContact OG1-OE2 2.99Å
208	Q	60.2	Low	62.5	Low	202 Å²	202	81.1 Å²	81.1	94%	0.944	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-11.7	179.1	-71.3	-179.6	0.1	0	0	114.3
209	S	56.8	Low	62.1	Low	70 Å²	70	84.6 Å²	84.6	49%	0.49	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	2.4	-179.7	50.4	0	0	0	0	114.6	T207 R224	T207-S209 PolarHBondContact O-N 2.72Å; T207-S209 PolarHBondContact OG1-OG 3.23Å; T207-S209 VanDerWaalsContact OG1-OG 3.11Å; S209-R224 PolarHBondContact O-N 3.37Å
210	E	66.4	Low	61.4	Low	51 Å²	51	87.7 Å²	87.7	24%	0.238	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	143	-174.9	-69.2	162.4	157.4	0	0	110.7	C206 T207 C221 Q222 R223	C206-E210 HydrophobicContact CB-CB 4.13Å; T207-E210 PolarHBondContact N-OE2 3.09Å; T207-E210 PolarHBondContact O-N 2.95Å; T207-E210 PolarHBondContact OG1-OE2 2.99Å; E210-C221 HydrophobicContact CB-CB 4.03Å; E210-C221 HydrophobicContact CG-CB 4.4Å; E210-Q222 CarbonylContact C-O 3.58Å; E210-Q222 WeakPolarHBondContact CA-O 3.45Å; E210-R223 HydrophobicContact CG-CG 4.12Å
211	D	64.4	Low	60.9	Low	73 Å²	73	82.9 Å²	82.9	39%	0.39	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	128.7	170.8	-62.8	-36	0	0	0	108.5	Q222 R224	D211-Q222 PolarHBondContact N-O 3.48Å; D211-Q222 PolarHBondContact O-N 3.5Å; D211-R224 IonicContact OD1-CZ 3.14Å; D211-R224 IonicContact OD1-NE 2.79Å; D211-R224 PolarHBondContact OD1-NE 3.02Å; D211-R224 IonicContact OD1-NH2 3.12Å; D211-R224 PolarHBondContact OD1-NH2 2.86Å; D211-R224 WeakPolarHBondContact OD2-CG 3.4Å; D211-R224 IonicContact OD2-NE 2.8Å
212	C	65.1	Low	60.5	Low	34 Å²	34	84.6 Å²	84.6	23%	0.23	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	125.2	178.2	-173.5	0	0	0	0	109.6	C199 C206	C199-C212 WeakPolarHBondContact CA-SG 3.04Å; C199-C212 HydrophobicContact CB-CB 3.73Å; C199-C212 WeakPolarHBondContact CB-SG 3.19Å; C199-C212 WeakPolarHBondContact SG-CB 3.09Å; C199-C212 CovalentContact SG-SG 2.04Å; C199-C212 PolarHBondContact SG-SG 2.91Å; C206-C212 HydrophobicContact CB-CB 4.29Å; C206-C212 VanDerWaalsContact SG-CB 3.56Å
213	V	67.3	Low	60.4	Low	64 Å²	64	80.8 Å²	80.8	39%	0.388	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	117.2	173.9	-177.9	0	0	0	0	108	Y219 I220	V213-Y219 WeakPolarHBondContact O-CA 3.02Å; V213-I220 PolarHBondContact N-O 2.65Å; V213-I220 PolarHBondContact O-N 2.89Å
214	N	54.1	Low	59.8	Low	51 Å²	51	79.7 Å²	79.7	27%	0.273	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	137	177.4	-167.7	53.5	0	0	0	110.7	D195 N197 C199	D195-N214 PolarHBondContact OD2-ND2 2.87Å; N197-N214 WeakPolarHBondContact CA-OD1 3.01Å; N197-N214 VanDerWaalsContact CG-CG 3.5Å; C199-N214 PolarHBondContact SG-N 2.78Å
215	T	59.2	Low	59	Low	50 Å²	50	83.7 Å²	83.7	31%	0.307	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	159.7	180	54.5	0	0	0	0	110	G217 G218 I220	T215-G217 PolarHBondContact O-N 2.93Å; T215-G217 VanDerWaalsContact O-N 3.07Å; T215-G218 CarbonylContact C-O 3.42Å; T215-G218 VanDerWaalsContact C-O 3.31Å; T215-G218 WeakPolarHBondContact CA-O 3.05Å; T215-G218 PolarHBondContact N-O 2.02Å; T215-G218 PolarHBondContact O-N 3.37Å; T215-G218 VanDerWaalsContact O-N 3.13Å; T215-G218 PolarHBondContact OG1-O 3.34Å; T215-I220 HydrophobicContact CG2-CD1 3.77Å; T215-I220 HydrophobicContact CG2-CG1 3.93Å
216	I	54.7	Low	57.9	Low	150 Å²	150	86.2 Å²	86.2	77%	0.769	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	114.3	-179.8	-62.7	171	0	0	0	109.4	F184 D195	F184-I216 HydrophobicContact CE1-CG2 3.89Å; F184-I216 HydrophobicContact CZ-CG2 3.66Å; D195-I216 WeakPolarHBondContact OD1-CA 3.41Å
217	G	51.1	Low	56.2	Low	30 Å²	30	96.9 Å²	96.9	31%	0.309	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.4	13.1	-178.4	0	0	0	0	0	115.6	F184 D195 T215	F184-G217 VanDerWaalsContact CZ-CA 3.48Å; D195-G217 PolarHBondContact OD1-N 3.38Å; T215-G217 PolarHBondContact O-N 2.93Å; T215-G217 VanDerWaalsContact O-N 3.07Å
218	G	59	Low	54.5	Low	14 Å²	14	101.2 Å²	101.2	14%	0.144	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	162.8	-157.5	174	0	0	0	0	0	114.2	E198 T215	E198-G218 VanDerWaalsContact OE2-C 3.29Å; T215-G218 CarbonylContact C-O 3.42Å; T215-G218 VanDerWaalsContact C-O 3.31Å; T215-G218 WeakPolarHBondContact CA-O 3.05Å; T215-G218 PolarHBondContact N-O 2.02Å; T215-G218 PolarHBondContact O-N 3.37Å; T215-G218 VanDerWaalsContact O-N 3.13Å; T215-G218 PolarHBondContact OG1-O 3.34Å
219	Y	68.6	Low	52.9	Low	100 Å²	100	98.3 Å²	98.3	39%	0.392	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	156.2	-175.8	65.8	-80.9	0	0	0	112.9	E198 P205 V213 C221	E198-Y219 HydrophobicContact CB-CD1 3.59Å; E198-Y219 HydrophobicContact CB-CE1 4.23Å; E198-Y219 HydrophobicContact CB-CG 4.12Å; E198-Y219 HydrophobicContact CG-CD1 3.81Å; E198-Y219 HydrophobicContact CG-CE1 4.32Å; P205-Y219 HydrophobicContact CB-CD2 4.33Å; P205-Y219 HydrophobicContact CB-CE1 3.96Å; P205-Y219 HydrophobicContact CB-CE2 3.57Å; P205-Y219 WeakPolarHBondContact CB-OH 3.49Å; P205-Y219 HydrophobicContact CG-CD1 4.05Å; P205-Y219 HydrophobicContact CG-CD2 3.64Å; P205-Y219 HydrophobicContact CG-CE1 3.85Å; P205-Y219 HydrophobicContact CG-CE2 3.41Å; P205-Y219 VanDerWaalsContact CG-CE2 3.41Å; P205-Y219 HydrophobicContact CG-CG 3.98Å; V213-Y219 WeakPolarHBondContact O-CA 3.02Å; Y219-C221 VanDerWaalsContact CE2-SG 3.58Å
220	I	54.3	Low	51.7	Low	97 Å²	97	99.8 Å²	99.8	50%	0.497	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	126.5	174.4	-59	176.6	0	0	0	109	V213 T215	V213-I220 PolarHBondContact N-O 2.65Å; V213-I220 PolarHBondContact O-N 2.89Å; T215-I220 HydrophobicContact CG2-CD1 3.77Å; T215-I220 HydrophobicContact CG2-CG1 3.93Å
221	C	62	Low	49.8	Very low	42 Å²	42	106 Å²	106	28%	0.284	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	107.9	170	-57.5	0	0	0	0	109.4	C206 E210 Y219	C206-C221 WeakPolarHBondContact CA-SG 3.46Å; C206-C221 HydrophobicContact CB-CB 3.81Å; C206-C221 WeakPolarHBondContact CB-SG 3.26Å; C206-C221 WeakPolarHBondContact SG-CA 3.34Å; C206-C221 WeakPolarHBondContact SG-CB 3.13Å; C206-C221 CovalentContact SG-SG 2.03Å; C206-C221 PolarHBondContact SG-SG 3.1Å; E210-C221 HydrophobicContact CB-CB 4.03Å; E210-C221 HydrophobicContact CG-CB 4.4Å; Y219-C221 VanDerWaalsContact CE2-SG 3.58Å
222	Q	58.6	Low	48	Very low	104 Å²	104	112.4 Å²	112.4	49%	0.486	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.2	125.8	177.4	-171.4	171.2	-14	0	0	109.6	E210 D211 R224	E210-Q222 CarbonylContact C-O 3.58Å; E210-Q222 WeakPolarHBondContact CA-O 3.45Å; D211-Q222 PolarHBondContact N-O 3.48Å; D211-Q222 PolarHBondContact O-N 3.5Å; Q222-R224 PolarHBondContact O-N 2.77Å
223	R	51.5	Low	46.1	Very low	186 Å²	186	117.9 Å²	117.9	70%	0.702	58%	0.581	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-58.7	132.8	172.2	-73.7	-179.1	75.4	116.3	-0.6	109.6	E210 I225	E210-R223 HydrophobicContact CG-CG 4.12Å; R223-I225 PolarHBondContact O-N 2.82Å
224	R	49.5	Very low	44.2	Very low	152 Å²	152	126.2 Å²	126.2	57%	0.574	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-53.7	118.3	167.2	-80.1	-179	-175.3	-179.5	7	108.7	S209 D211 Q222 S226	S209-R224 PolarHBondContact O-N 3.37Å; D211-R224 IonicContact OD1-CZ 3.14Å; D211-R224 IonicContact OD1-NE 2.79Å; D211-R224 PolarHBondContact OD1-NE 3.02Å; D211-R224 IonicContact OD1-NH2 3.12Å; D211-R224 PolarHBondContact OD1-NH2 2.86Å; D211-R224 WeakPolarHBondContact OD2-CG 3.4Å; D211-R224 IonicContact OD2-NE 2.8Å; Q222-R224 PolarHBondContact O-N 2.77Å; R224-S226 PolarHBondContact O-N 3.48Å
225	I	40.3	Very low	43	Very low	145 Å²	145	127.5 Å²	127.5	74%	0.744	62%	0.623	S	S	*	*			trans	-72.9	86.5	174.2	-58.9	175.8	0	0	0	106.9	R223 R227	R223-I225 PolarHBondContact O-N 2.82Å; I225-R227 PolarHBondContact O-N 3.37Å
226	S	39.5	Very low	41.6	Very low	105 Å²	105	132 Å²	132	73%	0.734	65%	0.645	S	S	*	*			trans	-63.9	112.8	165.6	-46.9	0	0	0	0	107.6	R224 L228	R224-S226 PolarHBondContact O-N 3.48Å; S226-L228 PolarHBondContact O-N 3.22Å
227	R	30.9	Very low	40.5	Very low	238 Å²	238	135.7 Å²	135.7	90%	0.898	65%	0.65	S	S	*	*			trans	-50.1	131.6	166.5	-76.8	-179.5	174.3	-176.4	-1.6	109.6	I225	I225-R227 PolarHBondContact O-N 3.37Å
228	L	30.2	Very low	39.6	Very low	168 Å²	168	141.9 Å²	141.9	88%	0.88	67%	0.674	S	S	*	*			trans	-41	132.8	173	-72.6	148.7	0	0	0	113.9	S226	S226-L228 PolarHBondContact O-N 3.22Å
229	V	26.3	Very low	38.1	Very low	141 Å²	141	144.1 Å²	144.1	86%	0.855	70%	0.697	S	S	*	*			trans	-159	138.9	131.4	-171	0	0	0	0	110
230	P	33.1	Very low	36.2	Very low	101 Å²	101	147.2 Å²	147.2	66%	0.656	72%	0.721	S	S	*	*			trans	-95.6	152.7	-177.3	36.8	-32.8	0	0	0	114.3
231	H	25.4	Very low	35.1	Very low	182 Å²	182	146.9 Å²	146.9	84%	0.843	73%	0.732	S	S	*	*				165.6	150.9	127.6	-98.4	-75.8	0	0	0	115.2
232	R	26.6	Very low	34.4	Very low	207 Å²	207	150.4 Å²	150.4	78%	0.781	76%	0.755	S	S	*	*			trans	-63.7	151.2	177.2	-63.9	171.3	169	177.4	-3.7	115.1
233	H	26.5	Very low	33	Very low	149 Å²	149	156.9 Å²	156.9	69%	0.69	78%	0.775	S	S	*	*				158.5	135.2	107	-95.7	-68.7	0	0	0	114.8
234	R	27.7	Very low	32	Very low	238 Å²	238	159.8 Å²	159.8	90%	0.898	79%	0.786	S	S	*	*			trans	44.2	155.7	140	-84.4	-174.4	165.4	174.7	-4	121
235	A	28.1	Very low	30.8	Very low	78 Å²	78	160.4 Å²	160.4	65%	0.645	80%	0.797	S	S	*	*			cis	176.9	164.6	-20.2	0	0	0	0	0	108.3
236	N	29.7	Very low	30.3	Very low	145 Å²	145	163.1 Å²	163.1	78%	0.775	80%	0.798	S	S	*	*			trans	96	114.4	162	-71.7	-16.7	0	0	0	118.8
237	R	32.4	Very low	29.8	Very low	228 Å²	228	164.4 Å²	164.4	86%	0.86	80%	0.797	S	S	*	*				87.3	134.2	67.4	-112.6	-174.6	-159.7	-159.5	7.1	110.4
238	I	31.4	Very low	29.7	Very low	160 Å²	160	160.4 Å²	160.4	82%	0.821	79%	0.793	S	S	*	*				-169.8	154.8	52.7	-62.1	-177.6	0	0	0	106.9
239	G	28.4	Very low	30.5	Very low	61 Å²	61	157 Å²	157	63%	0.629	78%	0.781	S	S	*	*			cis	174.2	165.1	1.2	0	0	0	0	0	114.1
240	N	28.5	Very low	30.7	Very low	165 Å²	165	160.3 Å²	160.3	88%	0.882	78%	0.779	S	S	*	*			trans	44.3	146.3	144.5	-62.2	-6.5	0	0	0	122.9
241	A	30	Very low	30.4	Very low	90 Å²	90	161 Å²	161	74%	0.744	79%	0.786	S	S	*	*			cis	-175.9	166.6	-11	0	0	0	0	0	109.5
242	P	47.5	Very low	30.5	Very low	116 Å²	116	163.9 Å²	163.9	75%	0.753	79%	0.79	S	S	*	*			trans	-115.7	-177.1	-172	41.5	-30.1	0	0	0	114.8
243	R	30.6	Very low	30.5	Very low	240 Å²	240	158.5 Å²	158.5	91%	0.906	79%	0.79	S	S	*	*			trans	168.7	162.9	152.7	-97.3	166.5	-171.6	-139.8	3.3	110.8
244	R	28.7	Very low	30.4	Very low	247 Å²	247	155 Å²	155	93%	0.932	79%	0.793	S	S	*	*			cis	-174.9	164.9	-40	-128.4	-170.5	-161.8	-158.2	4.7	105.7
245	M	26	Very low	30.3	Very low	164 Å²	164	153 Å²	153	81%	0.808	79%	0.794	S	S	*	*			trans	-106.5	168.7	-167.1	-152	-179	-179.9	0	0	112.5
246	R	29.9	Very low	30.2	Very low	202 Å²	202	159.5 Å²	159.5	76%	0.762	80%	0.804	S	S	*	*			trans	87.2	147.3	155	-72.2	-171	-177.3	-141.6	4.3	118.9
247	D	27.4	Very low	30.1	Very low	133 Å²	133	162.1 Å²	162.1	71%	0.711	80%	0.803	S	S	*	*			cis	-160.3	170.3	7.4	-94	-28.3	0	0	0	110.3
248	D	29.2	Very low	29.8	Very low	154 Å²	154	158.3 Å²	158.3	82%	0.824	80%	0.795	S	S	*	*			trans	-64.4	-165.4	177	-124.2	-15.7	0	0	0	116.2
249	P	48	Very low	29.8	Very low	96 Å²	96	155 Å²	155	62%	0.623	79%	0.791	S	S	*	*			cis	-148.4	-172.8	-17.4	36.7	-12.9	0	0	0	118.7
250	Y	29	Very low	29.9	Very low	210 Å²	210	157 Å²	157	82%	0.824	80%	0.796	S	S	*	*			trans	87.1	124.9	148.8	-101.1	-86.3	0	0	0	124.2
251	S	27.6	Very low	30.3	Very low	115 Å²	115	158 Å²	158	80%	0.804	80%	0.795	S	S	*	*				168.3	117.2	121.8	-69.9	0	0	0	0	117.2
252	R	28.5	Very low	30.5	Very low	244 Å²	244	158.1 Å²	158.1	92%	0.921	80%	0.796	S	S	*	*			trans	14.3	141.6	141.7	-112.2	176.4	179.8	171.1	-1	125.6
253	A	24.9	Very low	30.2	Very low	94 Å²	94	160 Å²	160	78%	0.777	80%	0.8	S	S	*	*				100.5	134	125.6	0	0	0	0	0	122.4
254	G	25.4	Very low	30.3	Very low	74 Å²	74	154.9 Å²	154.9	76%	0.763	80%	0.795	S	S	*	*			trans	73.7	152.2	153	0	0	0	0	0	116.7
255	E	24.9	Very low	31	Very low	197 Å²	197	150.8 Å²	150.8	92%	0.921	79%	0.787	S	S	*	*			cis	-171.3	172.4	7.3	-117.4	176.6	-179.6	0	0	109.3
256	Y	25.5	Very low	32.3	Very low	215 Å²	215	149.3 Å²	149.3	84%	0.843	78%	0.776	S	S	*	*			trans	-68.5	169.9	-176.3	-98.2	-103.2	0	0	0	116.9
257	R	27.5	Very low	33.4	Very low	200 Å²	200	143.8 Å²	143.8	76%	0.755	78%	0.782	S	S	*	*			trans	75.6	150.7	154.3	-74.8	170.2	-176.8	-126.8	8.3	116.9
258	E	28.1	Very low	34.9	Very low	148 Å²	148	138.7 Å²	138.7	69%	0.692	76%	0.757	S	S	*	*			cis	-163.5	161.8	-3.1	-121	156.9	-172.4	0	0	106.3
259	A	31.2	Very low	36.6	Very low	90 Å²	90	135.3 Å²	135.3	74%	0.744	74%	0.743	S	S	*	*			trans	6	134	156.4	0	0	0	0	0	120.1
260	S	29.9	Very low	37.3	Very low	104 Å²	104	139.6 Å²	139.6	73%	0.727	76%	0.757	S	S	*	*				172.4	125.3	95.7	60	0	0	0	0	112.8
261	Q	36.2	Very low	39.1	Very low	185 Å²	185	130.6 Å²	130.6	86%	0.864	73%	0.728	S	S	*	*			trans	56.3	116.2	134.3	-72.2	177	-20.8	0	0	121.5
262	A	33.8	Very low	41.4	Very low	93 Å²	93	128 Å²	128	77%	0.769	70%	0.701	S	S	*	*				90.6	112.1	117.2	0	0	0	0	0	119.7
263	N	41.1	Very low	43.7	Very low	155 Å²	155	121 Å²	121	83%	0.829	68%	0.681	S	S	*	*				71.5	114.8	128.3	-117.7	10	0	0	0	119.6
264	T	34.2	Very low	45.8	Very low	132 Å²	132	120.3 Å²	120.3	81%	0.81	66%	0.661	S	S	*	*			trans	-148.7	98.9	133.1	40.7	0	0	0	0	111.3	F266	T264-F266 PolarHBondContact O-N 2.03Å
265	E	43.4	Very low	48.2	Very low	162 Å²	162	121.6 Å²	121.6	76%	0.757	65%	0.647	S	S	*	*	S	Bend		66.7	2.9	124.4	-140.2	167.9	-174.5	0	0	123.3
266	F	53.4	Low	50.4	Low	133 Å²	133	120.6 Å²	120.6	58%	0.583	64%	0.642	S	S	*	*			trans	-147.9	75.9	167	-68.4	-79.9	0	0	0	111.9	T264 C268 F274	T264-F266 PolarHBondContact O-N 2.03Å; F266-C268 PolarHBondContact O-N 3.09Å; F266-F274 HydrophobicContact CB-CB 4.32Å; F266-F274 HydrophobicContact CB-CD1 3.77Å; F266-F274 HydrophobicContact CB-CD2 4.27Å; F266-F274 HydrophobicContact CB-CE1 4.06Å; F266-F274 HydrophobicContact CB-CG 3.87Å; F266-F274 HydrophobicContact CB-CZ 4.41Å; F266-F274 AromaticContact CD1-CD1 3.95Å; F266-F274 HydrophobicContact CD1-CD1 3.95Å; F266-F274 HydrophobicContact CD1-CD2 4.49Å; F266-F274 AromaticContact CD1-CE1 3.3Å; F266-F274 HydrophobicContact CD1-CE1 3.3Å; F266-F274 AromaticContact CD1-CE2 3.94Å; F266-F274 HydrophobicContact CD1-CE2 3.94Å; F266-F274 HydrophobicContact CD1-CG 4.49Å; F266-F274 AromaticContact CD1-CZ 3.28Å; F266-F274 HydrophobicContact CD1-CZ 3.28Å; F266-F274 HydrophobicContact CD2-CD1 4.48Å; F266-F274 HydrophobicContact CD2-CE1 4.3Å; F266-F274 AromaticContact CE1-CE1 3.78Å; F266-F274 HydrophobicContact CE1-CE1 3.78Å; F266-F274 AromaticContact CE1-CZ 3.76Å; F266-F274 HydrophobicContact CE1-CZ 3.76Å; F266-F274 AromaticContact CG-CD1 3.79Å; F266-F274 HydrophobicContact CG-CD1 3.79Å; F266-F274 AromaticContact CG-CE1 3.6Å; F266-F274 HydrophobicContact CG-CE1 3.6Å; F266-F274 HydrophobicContact CG-CG 4.34Å; F266-F274 HydrophobicContact CG-CZ 4.01Å; F266-F274 HydrophobicContact CZ-CE1 4.47Å
267	G	51.9	Low	52.4	Low	86 Å²	86	113.2 Å²	113.2	89%	0.887	63%	0.632	S	S	*	*			trans	-77.3	87	-173.1	0	0	0	0	0	113.6
268	C	59.6	Low	54.7	Low	26 Å²	26	108.9 Å²	108.9	18%	0.176	62%	0.62	C	S	.	*	P	Polyproline II helix	trans	-70.9	147.6	161.2	-68.1	0	0	0	0	110.6	F266 W272 F274 C279	F266-C268 PolarHBondContact O-N 3.09Å; C268-W272 HydrophobicContact CB-CB 3.79Å; C268-F274 VanDerWaalsContact SG-CB 3.58Å; C268-C279 WeakPolarHBondContact CA-SG 3.49Å; C268-C279 HydrophobicContact CB-CB 3.86Å; C268-C279 WeakPolarHBondContact CB-SG 3.33Å; C268-C279 WeakPolarHBondContact SG-CA 3.29Å; C268-C279 WeakPolarHBondContact SG-CB 3.44Å; C268-C279 CovalentContact SG-SG 2.03Å; C268-C279 PolarHBondContact SG-SG 3.37Å
269	P	64.1	Low	57.1	Low	82 Å²	82	104.1 Å²	104.1	53%	0.532	60%	0.602	S	S	.	*	P	Polyproline II helix	trans	-56.4	154.9	173.2	-20.9	31.9	0	0	0	111.7	G271 W272	P269-G271 PolarHBondContact O-N 2.67Å; P269-W272 WeakPolarHBondContact O-CB 3.44Å; P269-W272 PolarHBondContact O-N 2.96Å; P269-W272 VanDerWaalsContact O-N 3.1Å
270	M	63.9	Low	59.4	Low	186 Å²	186	102.3 Å²	102.3	92%	0.916	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.8	133.4	172	-76.3	-72.9	-76.6	0	0	110.3
271	G	66.3	Low	61.9	Low	22 Å²	22	99.2 Å²	99.2	23%	0.227	56%	0.557	C	S	.	*	T	Hydrogen-bonded Turn	trans	92.3	5.3	-173.5	0	0	0	0	0	115.1	P269 V282	P269-G271 PolarHBondContact O-N 2.67Å; G271-V282 WeakPolarHBondContact O-CB 3.18Å; G271-V282 WeakPolarHBondContact O-CG2 3.41Å; G271-V282 PolarHBondContact O-N 3.18Å
272	W	76.2	Confident	64	Low	61 Å²	61	91.6 Å²	91.6	23%	0.231	52%	0.523	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	139.9	-178.1	-61.8	77.1	0	0	0	112.3	C268 P269 C279 V280 D281 Q302	C268-W272 HydrophobicContact CB-CB 3.79Å; P269-W272 WeakPolarHBondContact O-CB 3.44Å; P269-W272 PolarHBondContact O-N 2.96Å; P269-W272 VanDerWaalsContact O-N 3.1Å; W272-C279 HydrophobicContact CB-CB 4.2Å; W272-C279 HydrophobicContact CE3-CB 4Å; W272-V280 CarbonylContact C-O 3.42Å; W272-V280 WeakPolarHBondContact CA-O 3.35Å; W272-D281 HydrophobicContact CE3-CB 4.09Å; W272-D281 HydrophobicContact CH2-CB 4.18Å; W272-D281 HydrophobicContact CZ3-CB 3.86Å; W272-Q302 HydrophobicContact CH2-CG 3.27Å; W272-Q302 VanDerWaalsContact CH2-NE2 3.31Å; W272-Q302 HydrophobicContact CZ2-CB 4.45Å; W272-Q302 HydrophobicContact CZ2-CG 3.43Å; W272-Q302 VanDerWaalsContact CZ2-CG 3.43Å; W272-Q302 HydrophobicContact CZ3-CG 4.49Å
273	L	76.1	Confident	66.3	Low	95 Å²	95	89.4 Å²	89.4	50%	0.497	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	133.4	175.4	-79.2	164.4	0	0	0	110.4	Q275 V280 V282	L273-Q275 PolarHBondContact O-N 3.33Å; L273-V280 PolarHBondContact N-O 3.32Å; L273-V280 PolarHBondContact O-N 3.05Å; L273-V282 HydrophobicContact CB-CG2 4.07Å; L273-V282 HydrophobicContact CD1-CG2 3.62Å; L273-V282 HydrophobicContact CG-CG2 3.48Å; L273-V282 VanDerWaalsContact CG-CG2 3.48Å
274	F	69.1	Low	68.5	Low	81 Å²	81	82.9 Å²	82.9	36%	0.355	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	112.2	173.6	-166	-107	0	0	0	109.8	F266 C268 G277	F266-F274 HydrophobicContact CB-CB 4.32Å; F266-F274 HydrophobicContact CB-CD1 3.77Å; F266-F274 HydrophobicContact CB-CD2 4.27Å; F266-F274 HydrophobicContact CB-CE1 4.06Å; F266-F274 HydrophobicContact CB-CG 3.87Å; F266-F274 HydrophobicContact CB-CZ 4.41Å; F266-F274 AromaticContact CD1-CD1 3.95Å; F266-F274 HydrophobicContact CD1-CD1 3.95Å; F266-F274 HydrophobicContact CD1-CD2 4.49Å; F266-F274 AromaticContact CD1-CE1 3.3Å; F266-F274 HydrophobicContact CD1-CE1 3.3Å; F266-F274 AromaticContact CD1-CE2 3.94Å; F266-F274 HydrophobicContact CD1-CE2 3.94Å; F266-F274 HydrophobicContact CD1-CG 4.49Å; F266-F274 AromaticContact CD1-CZ 3.28Å; F266-F274 HydrophobicContact CD1-CZ 3.28Å; F266-F274 HydrophobicContact CD2-CD1 4.48Å; F266-F274 HydrophobicContact CD2-CE1 4.3Å; F266-F274 AromaticContact CE1-CE1 3.78Å; F266-F274 HydrophobicContact CE1-CE1 3.78Å; F266-F274 AromaticContact CE1-CZ 3.76Å; F266-F274 HydrophobicContact CE1-CZ 3.76Å; F266-F274 AromaticContact CG-CD1 3.79Å; F266-F274 HydrophobicContact CG-CD1 3.79Å; F266-F274 AromaticContact CG-CE1 3.6Å; F266-F274 HydrophobicContact CG-CE1 3.6Å; F266-F274 HydrophobicContact CG-CG 4.34Å; F266-F274 HydrophobicContact CG-CZ 4.01Å; F266-F274 HydrophobicContact CZ-CE1 4.47Å; C268-F274 VanDerWaalsContact SG-CB 3.58Å; F274-G277 VanDerWaalsContact CE2-C 3.44Å; F274-G277 VanDerWaalsContact CZ-C 3.42Å; F274-G277 VanDerWaalsContact CZ-CA 3.42Å
275	Q	75.1	Confident	70.8	Confident	100 Å²	100	78 Å²	78	47%	0.467	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	134.1	176.8	-71.3	-172.1	-14.7	0	0	109.4	L273 G277 H278 V280	L273-Q275 PolarHBondContact O-N 3.33Å; Q275-G277 VanDerWaalsContact C-N 3.31Å; Q275-G277 PolarHBondContact O-N 3.46Å; Q275-H278 PolarHBondContact N-O 2.94Å; Q275-H278 PolarHBondContact O-N 3.42Å; Q275-H278 PolarHBondContact O-ND1 3.17Å; Q275-V280 HydrophobicContact CB-CG2 4.16Å
276	H	72.3	Confident	72.7	Confident	176 Å²	176	76.8 Å²	76.8	82%	0.815	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	43.7	176.1	-54.7	97	0	0	0	114.7	H278	H276-H278 PolarHBondContact O-N 3.03Å; H276-H278 PolarHBondContact O-ND1 2.96Å
277	G	67.5	Low	73.9	Confident	61 Å²	61	76.1 Å²	76.1	63%	0.629	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.4	5.5	173.8	0	0	0	0	0	115.8	F274 Q275	F274-G277 VanDerWaalsContact CE2-C 3.44Å; F274-G277 VanDerWaalsContact CZ-C 3.42Å; F274-G277 VanDerWaalsContact CZ-CA 3.42Å; Q275-G277 VanDerWaalsContact C-N 3.31Å; Q275-G277 PolarHBondContact O-N 3.46Å
278	H	75.8	Confident	75	Confident	109 Å²	109	74.6 Å²	74.6	51%	0.505	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	163.1	176.8	59	-74.4	0	0	0	111.8	Q275 H276	Q275-H278 PolarHBondContact N-O 2.94Å; Q275-H278 PolarHBondContact O-N 3.42Å; Q275-H278 PolarHBondContact O-ND1 3.17Å; H276-H278 PolarHBondContact O-N 3.03Å; H276-H278 PolarHBondContact O-ND1 2.96Å
279	C	78.1	Confident	75.8	Confident	47 Å²	47	77 Å²	77	32%	0.318	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	122.6	176.7	-60.8	0	0	0	0	109.9	C268 W272	C268-C279 WeakPolarHBondContact CA-SG 3.49Å; C268-C279 HydrophobicContact CB-CB 3.86Å; C268-C279 WeakPolarHBondContact CB-SG 3.33Å; C268-C279 WeakPolarHBondContact SG-CA 3.29Å; C268-C279 WeakPolarHBondContact SG-CB 3.44Å; C268-C279 CovalentContact SG-SG 2.03Å; C268-C279 PolarHBondContact SG-SG 3.37Å; W272-C279 HydrophobicContact CB-CB 4.2Å; W272-C279 HydrophobicContact CE3-CB 4Å
280	V	80	Confident	76.5	Confident	53 Å²	53	75.9 Å²	75.9	32%	0.321	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	137.6	173.9	-174.3	0	0	0	0	108.4	W272 L273 Q275	W272-V280 CarbonylContact C-O 3.42Å; W272-V280 WeakPolarHBondContact CA-O 3.35Å; L273-V280 PolarHBondContact N-O 3.32Å; L273-V280 PolarHBondContact O-N 3.05Å; Q275-V280 HydrophobicContact CB-CG2 4.16Å
281	D	81.6	Confident	77.2	Confident	39 Å²	39	73.2 Å²	73.2	21%	0.209	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	136.5	178.6	-179.2	50.7	0	0	0	111	W272 N300 G303	W272-D281 HydrophobicContact CE3-CB 4.09Å; W272-D281 HydrophobicContact CH2-CB 4.18Å; W272-D281 HydrophobicContact CZ3-CB 3.86Å; D281-N300 PolarHBondContact OD2-ND2 3.42Å; D281-G303 VanDerWaalsContact OD1-CA 3.24Å; D281-G303 WeakPolarHBondContact OD1-CA 3.4Å; D281-G303 PolarHBondContact OD1-N 2.8Å
282	V	81.1	Confident	77.8	Confident	24 Å²	24	73.1 Å²	73.1	15%	0.145	41%	0.408	C	S	.	.			trans	-85.6	114.1	174.9	-178.9	0	0	0	0	108.1	G271 L273 E284 L287	G271-V282 WeakPolarHBondContact O-CB 3.18Å; G271-V282 WeakPolarHBondContact O-CG2 3.41Å; G271-V282 PolarHBondContact O-N 3.18Å; L273-V282 HydrophobicContact CB-CG2 4.07Å; L273-V282 HydrophobicContact CD1-CG2 3.62Å; L273-V282 HydrophobicContact CG-CG2 3.48Å; L273-V282 VanDerWaalsContact CG-CG2 3.48Å; V282-E284 HydrophobicContact CG1-CG 4.32Å; V282-E284 PolarHBondContact O-N 3.03Å; V282-L287 HydrophobicContact CG1-CD1 3.45Å; V282-L287 VanDerWaalsContact CG1-CD1 3.45Å
283	D	82.4	Confident	77.3	Confident	47 Å²	47	71.8 Å²	71.8	25%	0.251	41%	0.414	S	S	.	.			trans	-76.6	90	175.2	-170.8	-26.1	0	0	0	110.7	C285 N286 L287	D283-C285 PolarHBondContact O-N 2.95Å; D283-C285 WeakPolarHBondContact OD1-CB 3.46Å; D283-C285 PolarHBondContact OD1-N 3.22Å; D283-C285 VanDerWaalsContact OD1-N 3.12Å; D283-N286 HydrophobicContact CB-CB 4.25Å; D283-N286 PolarHBondContact O-N 3.04Å; D283-N286 PolarHBondContact OD1-N 3.39Å; D283-N286 PolarHBondContact OD2-ND2 2.83Å; D283-L287 PolarHBondContact O-N 2.87Å; D283-L287 VanDerWaalsContact O-N 3.12Å
284	E	85.8	Confident	76.9	Confident	18 Å²	18	71.2 Å²	71.2	8%	0.084	42%	0.415	C	S	.	.	H	α-helix	trans	-67.3	-21.7	-178.2	-56.2	94.7	165.3	0	0	112.5	V282 G288 S289 H290 N300 Y305	V282-E284 HydrophobicContact CG1-CG 4.32Å; V282-E284 PolarHBondContact O-N 3.03Å; E284-G288 PolarHBondContact O-N 3.09Å; E284-G288 VanDerWaalsContact O-N 3.08Å; E284-S289 PolarHBondContact O-N 3.17Å; E284-S289 VanDerWaalsContact O-N 3.13Å; E284-H290 HydrophobicContact CB-CB 4.5Å; E284-H290 PolarHBondContact O-CD2 2.82Å; E284-N300 PolarHBondContact OE2-OD1 3.11Å; E284-Y305 HydrophobicContact CB-CD1 3.55Å; E284-Y305 HydrophobicContact CB-CE1 4.11Å; E284-Y305 HydrophobicContact CB-CG 4.26Å; E284-Y305 HydrophobicContact CG-CD1 3.84Å; E284-Y305 HydrophobicContact CG-CE1 4.31Å; E284-Y305 PolarHBondContact OE2-N 3.09Å
285	C	82.7	Confident	76.5	Confident	29 Å²	29	70.4 Å²	70.4	20%	0.196	41%	0.414	C	S	.	.	H	α-helix	trans	-70.3	-43	176.2	-57.8	0	0	0	0	111.9	D283 C298 R299 N300	D283-C285 PolarHBondContact O-N 2.95Å; D283-C285 WeakPolarHBondContact OD1-CB 3.46Å; D283-C285 PolarHBondContact OD1-N 3.22Å; D283-C285 VanDerWaalsContact OD1-N 3.12Å; C285-C298 WeakPolarHBondContact CA-SG 3.25Å; C285-C298 HydrophobicContact CB-CB 3.73Å; C285-C298 WeakPolarHBondContact CB-SG 3.38Å; C285-C298 WeakPolarHBondContact SG-CB 3.28Å; C285-C298 CovalentContact SG-SG 2.03Å; C285-C298 PolarHBondContact SG-SG 2.89Å; C285-R299 PolarHBondContact SG-N 3.25Å; C285-R299 VanDerWaalsContact SG-N 3.4Å; C285-N300 PolarHBondContact SG-N 3.46Å
286	N	83.4	Confident	76.5	Confident	138 Å²	138	71.2 Å²	71.2	74%	0.738	41%	0.414	S	S	*	.	H	α-helix	trans	-75.4	-30.9	177.1	-84.4	-34.9	0	0	0	112.9	D283 G288	D283-N286 HydrophobicContact CB-CB 4.25Å; D283-N286 PolarHBondContact O-N 3.04Å; D283-N286 PolarHBondContact OD1-N 3.39Å; D283-N286 PolarHBondContact OD2-ND2 2.83Å; N286-G288 VanDerWaalsContact C-N 3.32Å
287	L	79.5	Confident	77	Confident	118 Å²	118	67.9 Å²	67.9	62%	0.618	40%	0.399	S	S	*	.	H	α-helix	trans	-79.2	-14.1	176.8	-73.7	161.6	0	0	0	113.3	V282 D283 S289	V282-L287 HydrophobicContact CG1-CD1 3.45Å; V282-L287 VanDerWaalsContact CG1-CD1 3.45Å; D283-L287 PolarHBondContact O-N 2.87Å; D283-L287 VanDerWaalsContact O-N 3.12Å; L287-S289 PolarHBondContact O-N 3.09Å
288	G	73.8	Confident	77.7	Confident	54 Å²	54	66.5 Å²	66.5	56%	0.557	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.2	17	-177.4	0	0	0	0	0	113.7	E284 N286 H290	E284-G288 PolarHBondContact O-N 3.09Å; E284-G288 VanDerWaalsContact O-N 3.08Å; N286-G288 VanDerWaalsContact C-N 3.32Å; G288-H290 VanDerWaalsContact C-N 3.26Å; G288-H290 PolarHBondContact O-N 2.97Å
289	S	77.2	Confident	78.2	Confident	76 Å²	76	67.7 Å²	67.7	53%	0.531	38%	0.379	S	S	.	.			trans	-90.6	19.4	-180	58.7	0	0	0	0	113.2	E284 L287	E284-S289 PolarHBondContact O-N 3.17Å; E284-S289 VanDerWaalsContact O-N 3.13Å; L287-S289 PolarHBondContact O-N 3.09Å
290	H	79.1	Confident	78.3	Confident	59 Å²	59	67.8 Å²	67.8	27%	0.273	38%	0.376	S	S	.	.			trans	-99.8	153.2	178.9	69.4	79.2	0	0	0	111.8	E284 G288 C292 C298 Y305	E284-H290 HydrophobicContact CB-CB 4.5Å; E284-H290 PolarHBondContact O-CD2 2.82Å; G288-H290 VanDerWaalsContact C-N 3.26Å; G288-H290 PolarHBondContact O-N 2.97Å; H290-C292 WeakPolarHBondContact ND1-CB 3.37Å; H290-C292 PolarHBondContact ND1-N 2.77Å; H290-C298 VanDerWaalsContact CD2-SG 3.57Å; H290-Y305 VanDerWaalsContact CA-CZ 3.5Å; H290-Y305 HydrophobicContact CB-CD1 4.12Å; H290-Y305 HydrophobicContact CB-CD2 3.63Å; H290-Y305 HydrophobicContact CB-CE1 3.95Å; H290-Y305 HydrophobicContact CB-CE2 3.46Å; H290-Y305 VanDerWaalsContact CB-CE2 3.46Å; H290-Y305 HydrophobicContact CB-CG 3.95Å
291	D	79	Confident	78.4	Confident	131 Å²	131	67.5 Å²	67.5	70%	0.701	38%	0.375	S	S	*	.			trans	-103.7	14	-179.1	68.9	-2.1	0	0	0	114.2	G293 Y305	D291-G293 PolarHBondContact O-N 3.35Å; D291-Y305 VanDerWaalsContact CG-OH 3.32Å; D291-Y305 PolarHBondContact N-OH 3.24Å; D291-Y305 PolarHBondContact OD1-OH 3.35Å
292	C	77.1	Confident	78.4	Confident	20 Å²	20	73.6 Å²	73.6	14%	0.135	40%	0.402	C	S	.	.			trans	-52	114.4	176.8	-59.8	0	0	0	0	111.9	H290 C307	H290-C292 WeakPolarHBondContact ND1-CB 3.37Å; H290-C292 PolarHBondContact ND1-N 2.77Å; C292-C307 WeakPolarHBondContact CA-SG 3.41Å; C292-C307 HydrophobicContact CB-CB 3.78Å; C292-C307 WeakPolarHBondContact CB-SG 3.34Å; C292-C307 WeakPolarHBondContact SG-CB 3.42Å; C292-C307 CovalentContact SG-SG 2.04Å; C292-C307 PolarHBondContact SG-SG 2.03Å
293	G	66.4	Low	78	Confident	33 Å²	33	73.1 Å²	73.1	34%	0.34	40%	0.402	S	S	.	.			trans	-61	163.5	176.9	0	0	0	0	0	112.9	D291 L295 Y296	D291-G293 PolarHBondContact O-N 3.35Å; G293-L295 PolarHBondContact O-N 2.9Å; G293-Y296 PolarHBondContact O-N 2.92Å
294	P	67	Low	77.9	Confident	82 Å²	82	73.5 Å²	73.5	53%	0.532	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-24.5	-168.6	18.2	-30.7	0	0	0	115.4	Y296 K310 M321	P294-Y296 VanDerWaalsContact C-N 3.33Å; P294-K310 PolarHBondContact O-NZ 2.86Å; P294-M321 WeakPolarHBondContact CG-O 3.01Å
295	L	61.6	Low	77.8	Confident	64 Å²	64	75.2 Å²	75.2	34%	0.335	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-8.4	178.5	-59.7	178.6	0	0	0	114.7	G293 K310 P320	G293-L295 PolarHBondContact O-N 2.9Å; L295-K310 PolarHBondContact O-N 2.93Å; L295-P320 WeakPolarHBondContact CD2-O 3.31Å
296	Y	75.8	Confident	77.7	Confident	117 Å²	117	79.3 Å²	79.3	46%	0.459	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	148.3	-175.3	-59.2	-95.3	0	0	0	110.8	G293 P294 C307 D308 A309 K310	G293-Y296 PolarHBondContact O-N 2.92Å; P294-Y296 VanDerWaalsContact C-N 3.33Å; Y296-C307 HydrophobicContact CD1-CB 4.4Å; Y296-C307 HydrophobicContact CG-CB 4.22Å; Y296-D308 CarbonylContact C-O 3.46Å; Y296-D308 WeakPolarHBondContact CA-O 3.47Å; Y296-D308 WeakPolarHBondContact CB-O 3.01Å; Y296-A309 HydrophobicContact CD1-CB 4.29Å; Y296-A309 HydrophobicContact CE1-CB 4.23Å; Y296-K310 WeakPolarHBondContact O-CE 3.27Å
297	Q	82.1	Confident	77.6	Confident	106 Å²	106	74.9 Å²	74.9	50%	0.495	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	133	172.9	67	-177.7	21.4	0	0	109.4	C307 D308 K310	Q297-C307 WeakPolarHBondContact O-CA 3.38Å; Q297-D308 HydrophobicContact CG-CB 4.05Å; Q297-D308 PolarHBondContact N-O 3.46Å; Q297-D308 PolarHBondContact O-N 2.02Å; Q297-K310 HydrophobicContact CB-CG 4.02Å
298	C	82.8	Confident	77.7	Confident	32 Å²	32	70.8 Å²	70.8	22%	0.216	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	133.1	177.4	-170.5	0	0	0	0	109.9	C285 H290	C285-C298 WeakPolarHBondContact CA-SG 3.25Å; C285-C298 HydrophobicContact CB-CB 3.73Å; C285-C298 WeakPolarHBondContact CB-SG 3.38Å; C285-C298 WeakPolarHBondContact SG-CB 3.28Å; C285-C298 CovalentContact SG-SG 2.03Å; C285-C298 PolarHBondContact SG-SG 2.89Å; H290-C298 VanDerWaalsContact CD2-SG 3.57Å
299	R	85.4	Confident	77.6	Confident	135 Å²	135	71.1 Å²	71.1	51%	0.509	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	116.2	172.1	-180	175.5	-176.6	159.9	4.9	108.3	C285 R306 D308	C285-R299 PolarHBondContact SG-N 3.25Å; C285-R299 VanDerWaalsContact SG-N 3.4Å; R299-R306 HydrophobicContact CB-CG 4.06Å; R299-R306 PolarHBondContact N-O 2.79Å; R299-R306 PolarHBondContact O-N 2.05Å; R299-D308 WeakPolarHBondContact CD-OD2 3.31Å; R299-D308 IonicContact NH1-OD2 3.4Å
300	N	79.8	Confident	77.4	Confident	48 Å²	48	70.7 Å²	70.7	26%	0.257	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	138.9	179.7	-169.1	38.4	0	0	0	110.3	D281 E284 C285 S304	D281-N300 PolarHBondContact OD2-ND2 3.42Å; E284-N300 PolarHBondContact OE2-OD1 3.11Å; C285-N300 PolarHBondContact SG-N 3.46Å; N300-S304 PolarHBondContact OD1-O 3.08Å
301	T	82.8	Confident	76.8	Confident	47 Å²	47	77 Å²	77	29%	0.288	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	163.4	178.4	55.7	0	0	0	0	109.6	G303 S304 R306	T301-G303 PolarHBondContact O-N 2.97Å; T301-S304 CarbonylContact C-O 2.98Å; T301-S304 WeakPolarHBondContact CA-O 3.09Å; T301-S304 WeakPolarHBondContact CB-O 3.08Å; T301-S304 PolarHBondContact N-O 2.87Å; T301-S304 PolarHBondContact O-N 2.05Å; T301-S304 PolarHBondContact OG1-O 3.3Å; T301-R306 HydrophobicContact CG2-CB 4.39Å; T301-R306 HydrophobicContact CG2-CG 3.94Å
302	Q	80.8	Confident	76.2	Confident	167 Å²	167	72.5 Å²	72.5	78%	0.78	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	106.8	-174.3	-160.2	-169.1	-30.2	0	0	110.7	W272	W272-Q302 HydrophobicContact CH2-CG 3.27Å; W272-Q302 VanDerWaalsContact CH2-NE2 3.31Å; W272-Q302 HydrophobicContact CZ2-CB 4.45Å; W272-Q302 HydrophobicContact CZ2-CG 3.43Å; W272-Q302 VanDerWaalsContact CZ2-CG 3.43Å; W272-Q302 HydrophobicContact CZ3-CG 4.49Å
303	G	73.8	Confident	75.7	Confident	14 Å²	14	73.6 Å²	73.6	14%	0.144	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	87	8.3	-177.8	0	0	0	0	0	116	D281 T301	D281-G303 VanDerWaalsContact OD1-CA 3.24Å; D281-G303 WeakPolarHBondContact OD1-CA 3.4Å; D281-G303 PolarHBondContact OD1-N 2.8Å; T301-G303 PolarHBondContact O-N 2.97Å
304	S	80.3	Confident	75.2	Confident	56 Å²	56	80.5 Å²	80.5	39%	0.392	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.1	-173.2	-177.7	-159.6	0	0	0	0	111.5	N300 T301	N300-S304 PolarHBondContact OD1-O 3.08Å; T301-S304 CarbonylContact C-O 2.98Å; T301-S304 WeakPolarHBondContact CA-O 3.09Å; T301-S304 WeakPolarHBondContact CB-O 3.08Å; T301-S304 PolarHBondContact N-O 2.87Å; T301-S304 PolarHBondContact O-N 2.05Å; T301-S304 PolarHBondContact OG1-O 3.3Å
305	Y	83.1	Confident	74.7	Confident	53 Å²	53	78.2 Å²	78.2	21%	0.208	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	160.5	170.4	62	-82.9	0	0	0	111.5	E284 H290 D291	E284-Y305 HydrophobicContact CB-CD1 3.55Å; E284-Y305 HydrophobicContact CB-CE1 4.11Å; E284-Y305 HydrophobicContact CB-CG 4.26Å; E284-Y305 HydrophobicContact CG-CD1 3.84Å; E284-Y305 HydrophobicContact CG-CE1 4.31Å; E284-Y305 PolarHBondContact OE2-N 3.09Å; H290-Y305 VanDerWaalsContact CA-CZ 3.5Å; H290-Y305 HydrophobicContact CB-CD1 4.12Å; H290-Y305 HydrophobicContact CB-CD2 3.63Å; H290-Y305 HydrophobicContact CB-CE1 3.95Å; H290-Y305 HydrophobicContact CB-CE2 3.46Å; H290-Y305 VanDerWaalsContact CB-CE2 3.46Å; H290-Y305 HydrophobicContact CB-CG 3.95Å; D291-Y305 VanDerWaalsContact CG-OH 3.32Å; D291-Y305 PolarHBondContact N-OH 3.24Å; D291-Y305 PolarHBondContact OD1-OH 3.35Å
306	R	80.9	Confident	74.7	Confident	115 Å²	115	79.1 Å²	79.1	43%	0.434	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	152.3	168.4	74.7	179.3	-135.6	-145.2	1.9	111.1	R299 T301 D308	R299-R306 HydrophobicContact CB-CG 4.06Å; R299-R306 PolarHBondContact N-O 2.79Å; R299-R306 PolarHBondContact O-N 2.05Å; T301-R306 HydrophobicContact CG2-CB 4.39Å; T301-R306 HydrophobicContact CG2-CG 3.94Å; R306-D308 IonicContact CZ-OD1 3.99Å; R306-D308 IonicContact CZ-OD2 3.13Å; R306-D308 IonicContact NE-OD1 2.85Å; R306-D308 PolarHBondContact NE-OD1 3.38Å; R306-D308 IonicContact NE-OD2 2.86Å; R306-D308 VanDerWaalsContact NH2-CG 3.28Å; R306-D308 IonicContact NH2-OD1 3.9Å; R306-D308 PolarHBondContact NH2-OD1 2.82Å; R306-D308 IonicContact NH2-OD2 2.66Å; R306-D308 PolarHBondContact NH2-OD2 3.06Å
307	C	81.4	Confident	73.9	Confident	45 Å²	45	76.1 Å²	76.1	30%	0.304	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	109.4	-179.6	-51.4	0	0	0	0	109.9	C292 Y296 Q297	C292-C307 WeakPolarHBondContact CA-SG 3.41Å; C292-C307 HydrophobicContact CB-CB 3.78Å; C292-C307 WeakPolarHBondContact CB-SG 3.34Å; C292-C307 WeakPolarHBondContact SG-CB 3.42Å; C292-C307 CovalentContact SG-SG 2.04Å; C292-C307 PolarHBondContact SG-SG 2.03Å; Y296-C307 HydrophobicContact CD1-CB 4.4Å; Y296-C307 HydrophobicContact CG-CB 4.22Å; Q297-C307 WeakPolarHBondContact O-CA 3.38Å
308	D	81	Confident	72.9	Confident	33 Å²	33	74.6 Å²	74.6	18%	0.176	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	143.8	177.2	-74.7	-23.5	0	0	0	110.3	Y296 Q297 R299 R306 K310	Y296-D308 CarbonylContact C-O 3.46Å; Y296-D308 WeakPolarHBondContact CA-O 3.47Å; Y296-D308 WeakPolarHBondContact CB-O 3.01Å; Q297-D308 HydrophobicContact CG-CB 4.05Å; Q297-D308 PolarHBondContact N-O 3.46Å; Q297-D308 PolarHBondContact O-N 2.02Å; R299-D308 WeakPolarHBondContact CD-OD2 3.31Å; R299-D308 IonicContact NH1-OD2 3.4Å; R306-D308 IonicContact CZ-OD1 3.99Å; R306-D308 IonicContact CZ-OD2 3.13Å; R306-D308 IonicContact NE-OD1 2.85Å; R306-D308 PolarHBondContact NE-OD1 3.38Å; R306-D308 IonicContact NE-OD2 2.86Å; R306-D308 VanDerWaalsContact NH2-CG 3.28Å; R306-D308 IonicContact NH2-OD1 3.9Å; R306-D308 PolarHBondContact NH2-OD1 2.82Å; R306-D308 IonicContact NH2-OD2 2.66Å; R306-D308 PolarHBondContact NH2-OD2 3.06Å; D308-K310 PolarHBondContact O-N 2.92Å
309	A	72.8	Confident	71.8	Confident	60 Å²	60	75.5 Å²	75.5	50%	0.496	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	129.5	177.2	0	0	0	0	0	111	Y296 K311	Y296-A309 HydrophobicContact CD1-CB 4.29Å; Y296-A309 HydrophobicContact CE1-CB 4.23Å; A309-K311 PolarHBondContact O-N 3.28Å
310	K	71.6	Confident	70.5	Confident	67 Å²	67	74.3 Å²	74.3	29%	0.291	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-64.5	132.9	171.1	-68.4	174.3	-178.6	168.9	0	108.9	P294 L295 Y296 Q297 D308 Q318	P294-K310 PolarHBondContact O-NZ 2.86Å; L295-K310 PolarHBondContact O-N 2.93Å; Y296-K310 WeakPolarHBondContact O-CE 3.27Å; Q297-K310 HydrophobicContact CB-CG 4.02Å; D308-K310 PolarHBondContact O-N 2.92Å; K310-Q318 PolarHBondContact O-NE2 2.98Å
311	K	66.7	Low	69.3	Low	192 Å²	192	79.6 Å²	79.6	84%	0.835	44%	0.435	S	S	*	.			trans	-120.2	134.3	173.3	-66.6	-174.8	179.9	-177.2	0	109.5	A309	A309-K311 PolarHBondContact O-N 3.28Å
312	C	67.1	Low	68.3	Low	37 Å²	37	79.9 Å²	79.9	25%	0.25	44%	0.436	C	S	.	.	P	Polyproline II helix	trans	-88.3	157	177.7	-59.1	0	0	0	0	112.4	E316 Q318 C325	C312-E316 HydrophobicContact CB-CB 3.99Å; C312-Q318 WeakPolarHBondContact SG-CB 3.42Å; C312-C325 WeakPolarHBondContact CA-SG 3.29Å; C312-C325 HydrophobicContact CB-CB 3.69Å; C312-C325 WeakPolarHBondContact CB-SG 3.05Å; C312-C325 WeakPolarHBondContact SG-CA 3.42Å; C312-C325 WeakPolarHBondContact SG-CB 3.47Å; C312-C325 CovalentContact SG-SG 2.02Å; C312-C325 PolarHBondContact SG-SG 3.46Å
313	G	65.3	Low	67.4	Low	43 Å²	43	72 Å²	72	44%	0.443	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-74.2	168.9	176.4	0	0	0	0	0	113.4	G315 E316	G313-G315 PolarHBondContact O-N 2.92Å; G313-E316 PolarHBondContact N-OE2 3.43Å; G313-E316 PolarHBondContact O-N 3.38Å; G313-E316 VanDerWaalsContact O-N 3.13Å
314	D	56.2	Low	67.1	Low	178 Å²	178	77.4 Å²	77.4	95%	0.952	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	126.7	179.1	-78.1	-32.5	0	0	0	111.7
315	G	57.8	Low	66.5	Low	34 Å²	34	77 Å²	77	35%	0.351	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.9	2.9	-179.4	0	0	0	0	0	115.2	G313	G313-G315 PolarHBondContact O-N 2.92Å
316	E	61.3	Low	65.6	Low	82 Å²	82	76 Å²	76	38%	0.383	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	145.7	173.7	-60.8	-171.4	146	0	0	112	C312 G313 C325 T326	C312-E316 HydrophobicContact CB-CB 3.99Å; G313-E316 PolarHBondContact N-OE2 3.43Å; G313-E316 PolarHBondContact O-N 3.38Å; G313-E316 VanDerWaalsContact O-N 3.13Å; E316-C325 HydrophobicContact CB-CB 4.22Å; E316-C325 VanDerWaalsContact OE2-CB 3.31Å; E316-C325 WeakPolarHBondContact OE2-CB 3.07Å; E316-T326 WeakPolarHBondContact CA-O 3.03Å
317	L	58.8	Low	64.7	Low	55 Å²	55	73.4 Å²	73.4	29%	0.288	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	128	177.8	-72.5	163.8	0	0	0	111.1	M1 T326 I328	M1-L317 HydrophobicContact CE-CB 4.23Å; M1-L317 HydrophobicContact CE-CD1 3.14Å; M1-L317 HydrophobicContact CE-CG 4.27Å; M1-L317 HydrophobicContact CG-CB 4.12Å; M1-L317 HydrophobicContact SD-CB 3.09Å; M1-L317 WeakPolarHBondContact SD-CB 3.41Å; M1-L317 HydrophobicContact SD-CD1 3.15Å; M1-L317 WeakPolarHBondContact SD-CD1 3.47Å; M1-L317 HydrophobicContact SD-CD2 4.44Å; M1-L317 HydrophobicContact SD-CG 3.66Å; L317-T326 PolarHBondContact N-O 3.07Å; L317-T326 PolarHBondContact O-N 3.22Å; L317-T326 PolarHBondContact O-OG1 2.82Å; L317-T326 VanDerWaalsContact O-OG1 3.11Å; L317-I328 HydrophobicContact CD1-CD1 3.39Å; L317-I328 HydrophobicContact CD1-CG1 4.26Å; L317-I328 HydrophobicContact CG-CD1 4.39Å
318	Q	60.8	Low	64.1	Low	74 Å²	74	72.4 Å²	72.4	35%	0.346	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	127.6	-180	-163.2	169.6	24.6	0	0	110.8	K310 C312 P320 G323 E324	K310-Q318 PolarHBondContact O-NE2 2.98Å; C312-Q318 WeakPolarHBondContact SG-CB 3.42Å; Q318-P320 VanDerWaalsContact O-CD 3.32Å; Q318-P320 WeakPolarHBondContact O-CD 3.15Å; Q318-G323 PolarHBondContact NE2-O 3.48Å; Q318-E324 CarbonylContact C-O 3.57Å; Q318-E324 WeakPolarHBondContact CA-O 3.28Å
319	N	60.1	Low	63.8	Low	51 Å²	51	75.4 Å²	75.4	27%	0.273	43%	0.428	S	S	.	.			trans	-66.3	119.9	171.5	-175.3	-27.4	0	0	0	109.7	M321 T322 G323 E324	N319-M321 PolarHBondContact O-N 2.92Å; N319-M321 VanDerWaalsContact O-N 3.12Å; N319-M321 PolarHBondContact OD1-N 3.12Å; N319-T322 VanDerWaalsContact CB-OG1 3.25Å; N319-T322 WeakPolarHBondContact CB-OG1 3.4Å; N319-T322 PolarHBondContact ND2-OG1 3.47Å; N319-T322 VanDerWaalsContact ND2-OG1 3.1Å; N319-T322 PolarHBondContact O-N 2.79Å; N319-T322 PolarHBondContact OD1-N 3.39Å; N319-G323 WeakPolarHBondContact O-CA 3.49Å; N319-G323 PolarHBondContact O-N 3.01Å; N319-E324 PolarHBondContact N-O 3.32Å
320	P	57.6	Low	64.2	Low	109 Å²	109	73.6 Å²	73.6	71%	0.708	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-14.2	-177.1	-19.8	31.7	0	0	0	115	L295 Q318	L295-P320 WeakPolarHBondContact CD2-O 3.31Å; Q318-P320 VanDerWaalsContact O-CD 3.32Å; Q318-P320 WeakPolarHBondContact O-CD 3.15Å
321	M	55.4	Low	64.5	Low	159 Å²	159	74.4 Å²	74.4	78%	0.783	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.9	-32	179.6	-59.7	-176.2	-166	0	0	112.8	P294 N319	P294-M321 WeakPolarHBondContact CG-O 3.01Å; N319-M321 PolarHBondContact O-N 2.92Å; N319-M321 VanDerWaalsContact O-N 3.12Å; N319-M321 PolarHBondContact OD1-N 3.12Å
322	T	61.3	Low	65.3	Low	53 Å²	53	73 Å²	73	33%	0.325	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.4	-14.3	-173.1	69.6	0	0	0	0	114.4	N319 E324	N319-T322 VanDerWaalsContact CB-OG1 3.25Å; N319-T322 WeakPolarHBondContact CB-OG1 3.4Å; N319-T322 PolarHBondContact ND2-OG1 3.47Å; N319-T322 VanDerWaalsContact ND2-OG1 3.1Å; N319-T322 PolarHBondContact O-N 2.79Å; N319-T322 PolarHBondContact OD1-N 3.39Å; T322-E324 PolarHBondContact O-N 3.38Å; T322-E324 PolarHBondContact OG1-OE2 3.12Å
323	G	61.7	Low	66.1	Low	3 Å²	3	72 Å²	72	3%	0.031	42%	0.422	C	S	.	.			trans	74.6	3.7	-179.1	0	0	0	0	0	114.3	Q318 N319	Q318-G323 PolarHBondContact NE2-O 3.48Å; N319-G323 WeakPolarHBondContact O-CA 3.49Å; N319-G323 PolarHBondContact O-N 3.01Å
324	E	67.6	Low	67.2	Low	127 Å²	127	73.3 Å²	73.3	59%	0.593	41%	0.414	S	S	*	.			trans	-76.7	134	179.8	-71.3	-179.7	144.7	0	0	112.4	Q318 N319 T322	Q318-E324 CarbonylContact C-O 3.57Å; Q318-E324 WeakPolarHBondContact CA-O 3.28Å; N319-E324 PolarHBondContact N-O 3.32Å; T322-E324 PolarHBondContact O-N 3.38Å; T322-E324 PolarHBondContact OG1-OE2 3.12Å
325	C	67.9	Low	68.6	Low	48 Å²	48	69.6 Å²	69.6	32%	0.324	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	138	176.9	-53.3	0	0	0	0	110.6	C312 E316	C312-C325 WeakPolarHBondContact CA-SG 3.29Å; C312-C325 HydrophobicContact CB-CB 3.69Å; C312-C325 WeakPolarHBondContact CB-SG 3.05Å; C312-C325 WeakPolarHBondContact SG-CA 3.42Å; C312-C325 WeakPolarHBondContact SG-CB 3.47Å; C312-C325 CovalentContact SG-SG 2.02Å; C312-C325 PolarHBondContact SG-SG 3.46Å; E316-C325 HydrophobicContact CB-CB 4.22Å; E316-C325 VanDerWaalsContact OE2-CB 3.31Å; E316-C325 WeakPolarHBondContact OE2-CB 3.07Å
326	T	63.2	Low	69.7	Low	32 Å²	32	71 Å²	71	20%	0.196	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	127.7	176.3	39	0	0	0	0	111.9	M1 E316 L317	M1-T326 WeakPolarHBondContact CA-OG1 3.43Å; M1-T326 WeakPolarHBondContact CB-OG1 3.41Å; M1-T326 WeakPolarHBondContact CG-OG1 3.36Å; M1-T326 VanDerWaalsContact N-CG2 3.25Å; M1-T326 PolarHBondContact N-OG1 2.9Å; E316-T326 WeakPolarHBondContact CA-O 3.03Å; L317-T326 PolarHBondContact N-O 3.07Å; L317-T326 PolarHBondContact O-N 3.22Å; L317-T326 PolarHBondContact O-OG1 2.82Å; L317-T326 VanDerWaalsContact O-OG1 3.11Å
327	S	62.3	Low	70.6	Confident	60 Å²	60	72 Å²	72	42%	0.42	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	136.7	175.1	57.3	0	0	0	0	111.4
328	I	69.2	Low	71.1	Confident	23 Å²	23	76.6 Å²	76.6	12%	0.118	42%	0.418	C	S	.	.			trans	-82.9	135.2	171.5	-72.3	158.3	0	0	0	108.9	M1 L317 G339	M1-I328 HydrophobicContact CE-CD1 4.41Å; L317-I328 HydrophobicContact CD1-CD1 3.39Å; L317-I328 HydrophobicContact CD1-CG1 4.26Å; L317-I328 HydrophobicContact CG-CD1 4.39Å; I328-G339 VanDerWaalsContact CD1-C 3.48Å; I328-G339 VanDerWaalsContact CD1-O 3.31Å; I328-G339 WeakPolarHBondContact CD1-O 3.01Å
329	T	74.5	Confident	71.3	Confident	96 Å²	96	73.9 Å²	73.9	59%	0.589	41%	0.41	S	S	*	.			trans	-107.7	117.3	173	-53.3	0	0	0	0	107.8	R2	R2-T329 PolarHBondContact NH2-OG1 3.41Å
330	C	80.8	Confident	72	Confident	22 Å²	22	77.6 Å²	77.6	15%	0.149	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-89.8	152.2	-179.4	-69.4	0	0	0	0	111.8	Y334 C341	C330-Y334 WeakPolarHBondContact CB-O 3.04Å; C330-C341 WeakPolarHBondContact CA-SG 3.28Å; C330-C341 HydrophobicContact CB-CB 3.84Å; C330-C341 WeakPolarHBondContact CB-SG 3.5Å; C330-C341 WeakPolarHBondContact SG-CA 3.07Å; C330-C341 WeakPolarHBondContact SG-CB 3.07Å; C330-C341 CovalentContact SG-SG 2.05Å; C330-C341 PolarHBondContact SG-SG 3.22Å
331	P	79.8	Confident	73.2	Confident	85 Å²	85	74.7 Å²	74.7	55%	0.552	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-56.6	157.1	168.1	-21.4	33.1	0	0	0	111.6	G333 Y334	P331-G333 PolarHBondContact O-N 2.04Å; P331-Y334 HydrophobicContact CB-CD2 4.23Å; P331-Y334 PolarHBondContact O-N 3.33Å; P331-Y334 VanDerWaalsContact O-N 3.12Å
332	N	82.9	Confident	74.7	Confident	162 Å²	162	69.9 Å²	69.9	87%	0.866	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	138.4	172.8	-66.6	-23	0	0	0	110
333	G	84.3	Confident	76.1	Confident	17 Å²	17	69.5 Å²	69.5	18%	0.175	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.7	2.8	-172.8	0	0	0	0	0	114.6	P331 I344	P331-G333 PolarHBondContact O-N 2.04Å; G333-I344 WeakPolarHBondContact O-CB 3.05Å; G333-I344 PolarHBondContact O-N 2.87Å
334	Y	88.4	Confident	77.5	Confident	69 Å²	69	71.6 Å²	71.6	27%	0.271	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	149.4	178.3	-64.4	-100.7	0	0	0	112.1	C330 P331 C341 N342 D343 P363 G364	C330-Y334 WeakPolarHBondContact CB-O 3.04Å; P331-Y334 HydrophobicContact CB-CD2 4.23Å; P331-Y334 PolarHBondContact O-N 3.33Å; P331-Y334 VanDerWaalsContact O-N 3.12Å; Y334-C341 HydrophobicContact CD1-CB 4.3Å; Y334-C341 HydrophobicContact CG-CB 4.41Å; Y334-N342 CarbonylContact C-O 3.45Å; Y334-N342 WeakPolarHBondContact CA-O 3.4Å; Y334-N342 WeakPolarHBondContact CB-O 3.41Å; Y334-D343 HydrophobicContact CD1-CB 4.31Å; Y334-D343 HydrophobicContact CE1-CB 4.09Å; Y334-P363 WeakPolarHBondContact OH-CB 3.37Å; Y334-P363 PolarHBondContact OH-O 3.3Å; Y334-G364 PolarHBondContact OH-N 3.13Å; Y334-G364 VanDerWaalsContact OH-N 3.13Å
335	Y	85.6	Confident	78.6	Confident	100 Å²	100	68.4 Å²	68.4	39%	0.392	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	143.2	175.3	75.1	-82.1	0	0	0	112.3	K337 N342 D343 I344	Y335-K337 HydrophobicContact CD2-CB 4.35Å; Y335-K337 HydrophobicContact CE2-CB 3.95Å; Y335-K337 HydrophobicContact CE2-CD 3.98Å; Y335-N342 HydrophobicContact CD1-CB 4.27Å; Y335-N342 WeakPolarHBondContact CD1-O 3.21Å; Y335-N342 HydrophobicContact CE1-CB 3.8Å; Y335-N342 PolarHBondContact N-O 3.33Å; Y335-N342 PolarHBondContact O-N 3.34Å; Y335-D343 WeakPolarHBondContact CE1-O 3.44Å; Y335-I344 HydrophobicContact CD1-CG1 3.84Å; Y335-I344 HydrophobicContact CG-CG1 4.49Å
336	P	79.7	Confident	79.8	Confident	64 Å²	64	67.2 Å²	67.2	42%	0.416	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	128.6	-178.5	29.2	-32.8	0	0	0	111.1	M340	P336-M340 WeakPolarHBondContact CA-O 3.34Å
337	K	79.7	Confident	81	Confident	102 Å²	102	67.5 Å²	67.5	44%	0.443	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	131.3	172.6	-178.7	178.4	-175.5	176.9	0	109.8	Y335 G339 M340 N342	Y335-K337 HydrophobicContact CD2-CB 4.35Å; Y335-K337 HydrophobicContact CE2-CB 3.95Å; Y335-K337 HydrophobicContact CE2-CD 3.98Å; K337-G339 PolarHBondContact O-N 3.38Å; K337-G339 VanDerWaalsContact O-N 3.16Å; K337-M340 PolarHBondContact N-O 3.05Å; K337-M340 PolarHBondContact O-N 2.54Å; K337-M340 VanDerWaalsContact O-O 3.1Å; K337-N342 WeakPolarHBondContact CB-ND2 3.44Å
338	N	69.4	Low	82.2	Confident	153 Å²	153	70.2 Å²	70.2	82%	0.818	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	35.3	179.2	-62.9	-11.8	0	0	0	114.8	M340	N338-M340 VanDerWaalsContact C-N 3.31Å; N338-M340 PolarHBondContact O-N 3.18Å
339	G	66.4	Low	82.9	Confident	17 Å²	17	74 Å²	74	18%	0.175	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.7	5.4	179.4	0	0	0	0	0	115.6	I328 K337	I328-G339 VanDerWaalsContact CD1-C 3.48Å; I328-G339 VanDerWaalsContact CD1-O 3.31Å; I328-G339 WeakPolarHBondContact CD1-O 3.01Å; K337-G339 PolarHBondContact O-N 3.38Å; K337-G339 VanDerWaalsContact O-N 3.16Å
340	M	73.3	Confident	83.2	Confident	129 Å²	129	71.8 Å²	71.8	64%	0.635	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.8	158.4	177.9	-67	-179.3	59.9	0	0	111.2	P336 K337 N338	P336-M340 WeakPolarHBondContact CA-O 3.34Å; K337-M340 PolarHBondContact N-O 3.05Å; K337-M340 PolarHBondContact O-N 2.54Å; K337-M340 VanDerWaalsContact O-O 3.1Å; N338-M340 VanDerWaalsContact C-N 3.31Å; N338-M340 PolarHBondContact O-N 3.18Å
341	C	83.3	Confident	83.4	Confident	48 Å²	48	74.4 Å²	74.4	32%	0.324	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	112.6	170.9	-66.2	0	0	0	0	108.6	C330 Y334	C330-C341 WeakPolarHBondContact CA-SG 3.28Å; C330-C341 HydrophobicContact CB-CB 3.84Å; C330-C341 WeakPolarHBondContact CB-SG 3.5Å; C330-C341 WeakPolarHBondContact SG-CA 3.07Å; C330-C341 WeakPolarHBondContact SG-CB 3.07Å; C330-C341 CovalentContact SG-SG 2.05Å; C330-C341 PolarHBondContact SG-SG 3.22Å; Y334-C341 HydrophobicContact CD1-CB 4.3Å; Y334-C341 HydrophobicContact CG-CB 4.41Å
342	N	86.8	Confident	83.7	Confident	58 Å²	58	78 Å²	78	31%	0.31	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	142.8	173.4	-70.2	-40.4	0	0	0	109.4	Y334 Y335 K337	Y334-N342 CarbonylContact C-O 3.45Å; Y334-N342 WeakPolarHBondContact CA-O 3.4Å; Y334-N342 WeakPolarHBondContact CB-O 3.41Å; Y335-N342 HydrophobicContact CD1-CB 4.27Å; Y335-N342 WeakPolarHBondContact CD1-O 3.21Å; Y335-N342 HydrophobicContact CE1-CB 3.8Å; Y335-N342 PolarHBondContact N-O 3.33Å; Y335-N342 PolarHBondContact O-N 3.34Å; K337-N342 WeakPolarHBondContact CB-ND2 3.44Å
343	D	91.7	Very high	83.7	Confident	44 Å²	44	71.3 Å²	71.3	24%	0.235	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.4	136.1	174.9	-174.8	53.4	0	0	0	111	Y334 Y335 N361 P363 G364	Y334-D343 HydrophobicContact CD1-CB 4.31Å; Y334-D343 HydrophobicContact CE1-CB 4.09Å; Y335-D343 WeakPolarHBondContact CE1-O 3.44Å; D343-N361 PolarHBondContact OD2-ND2 3.14Å; D343-N361 PolarHBondContact OD2-OD1 3.26Å; D343-P363 WeakPolarHBondContact OD1-CA 3.14Å; D343-G364 PolarHBondContact OD1-N 3.19Å
344	I	91.6	Very high	83.4	Confident	48 Å²	48	72.2 Å²	72.2	25%	0.246	41%	0.407	C	S	.	.			trans	-83.3	114.4	170.8	-64.5	169.7	0	0	0	106.3	G333 Y335 E346 T349	G333-I344 WeakPolarHBondContact O-CB 3.05Å; G333-I344 PolarHBondContact O-N 2.87Å; Y335-I344 HydrophobicContact CD1-CG1 3.84Å; Y335-I344 HydrophobicContact CG-CG1 4.49Å; I344-E346 HydrophobicContact CG2-CG 4.21Å; I344-E346 PolarHBondContact O-N 3.28Å; I344-T349 HydrophobicContact CG2-CG2 4.34Å
345	D	90.8	Very high	82.3	Confident	59 Å²	59	74.7 Å²	74.7	32%	0.316	44%	0.441	S	S	.	.			trans	-76.8	92.3	173.3	-171.4	-25.3	0	0	0	109.8	C347 V348 T349	D345-C347 PolarHBondContact O-N 3.36Å; D345-C347 WeakPolarHBondContact OD1-CA 3.33Å; D345-C347 VanDerWaalsContact OD1-CB 3.28Å; D345-C347 WeakPolarHBondContact OD1-CB 3.2Å; D345-C347 PolarHBondContact OD1-N 2.62Å; D345-V348 HydrophobicContact CB-CB 4.33Å; D345-V348 HydrophobicContact CB-CG2 4.28Å; D345-V348 PolarHBondContact O-N 3.22Å; D345-V348 PolarHBondContact OD1-N 2.97Å; D345-T349 PolarHBondContact O-N 2.96Å; D345-T349 PolarHBondContact O-OG1 3.33Å; D345-T349 VanDerWaalsContact O-OG1 3.11Å
346	E	92.9	Very high	81.3	Confident	24 Å²	24	72.5 Å²	72.5	11%	0.112	45%	0.449	C	S	.	.	H	α-helix	trans	-65.7	-19.1	-179.1	-58.8	93.2	164.3	0	0	112.8	I344 V348 T349 G350 H351 N361 S365 F366	I344-E346 HydrophobicContact CG2-CG 4.21Å; I344-E346 PolarHBondContact O-N 3.28Å; E346-V348 PolarHBondContact O-N 2.91Å; E346-T349 WeakPolarHBondContact CA-OG1 3.43Å; E346-G350 CarbonylContact O-C 3.59Å; E346-G350 WeakPolarHBondContact O-CA 3.47Å; E346-G350 PolarHBondContact O-N 3.35Å; E346-G350 VanDerWaalsContact O-O 3.1Å; E346-H351 PolarHBondContact O-N 3.36Å; E346-N361 PolarHBondContact OE2-OD1 3.36Å; E346-S365 WeakPolarHBondContact OE1-CA 3.35Å; E346-F366 HydrophobicContact CB-CB 4.04Å; E346-F366 HydrophobicContact CB-CD1 3.41Å; E346-F366 VanDerWaalsContact CB-CD1 3.41Å; E346-F366 HydrophobicContact CB-CE1 4.06Å; E346-F366 HydrophobicContact CB-CG 3.81Å; E346-F366 HydrophobicContact CG-CD1 3.62Å; E346-F366 HydrophobicContact CG-CE1 4.2Å; E346-F366 HydrophobicContact CG-CG 4.43Å
347	C	87.6	Confident	81.2	Confident	38 Å²	38	73.1 Å²	73.1	26%	0.257	45%	0.447	S	S	.	.	H	α-helix	trans	-70.8	-21.8	173.5	-55.1	0	0	0	0	112.4	D345 C359 V360 N361	D345-C347 PolarHBondContact O-N 3.36Å; D345-C347 WeakPolarHBondContact OD1-CA 3.33Å; D345-C347 VanDerWaalsContact OD1-CB 3.28Å; D345-C347 WeakPolarHBondContact OD1-CB 3.2Å; D345-C347 PolarHBondContact OD1-N 2.62Å; C347-C359 WeakPolarHBondContact CA-SG 3.43Å; C347-C359 HydrophobicContact CB-CB 3.75Å; C347-C359 WeakPolarHBondContact CB-SG 3.48Å; C347-C359 WeakPolarHBondContact SG-CB 3.15Å; C347-C359 PolarHBondContact SG-O 3.41Å; C347-C359 CovalentContact SG-SG 2.05Å; C347-C359 PolarHBondContact SG-SG 2.96Å; C347-V360 PolarHBondContact SG-N 3.44Å; C347-N361 PolarHBondContact SG-N 3.38Å
348	V	88.4	Confident	81.2	Confident	117 Å²	117	72.3 Å²	72.3	71%	0.709	44%	0.444	S	S	*	.	H	α-helix	trans	-98.1	-40.6	173.9	179.8	0	0	0	0	111.5	D345 E346	D345-V348 HydrophobicContact CB-CB 4.33Å; D345-V348 HydrophobicContact CB-CG2 4.28Å; D345-V348 PolarHBondContact O-N 3.22Å; D345-V348 PolarHBondContact OD1-N 2.97Å; E346-V348 PolarHBondContact O-N 2.91Å
349	T	83.5	Confident	82	Confident	101 Å²	101	66 Å²	66	62%	0.62	41%	0.412	S	S	*	.	H	α-helix	trans	-83.7	-15.7	-175.5	57.2	0	0	0	0	114	I344 D345 E346	I344-T349 HydrophobicContact CG2-CG2 4.34Å; D345-T349 PolarHBondContact O-N 2.96Å; D345-T349 PolarHBondContact O-OG1 3.33Å; D345-T349 VanDerWaalsContact O-OG1 3.11Å; E346-T349 WeakPolarHBondContact CA-OG1 3.43Å
350	G	80.9	Confident	82.8	Confident	51 Å²	51	67.1 Å²	67.1	53%	0.526	42%	0.416	S	S	.	.			trans	127.6	130.8	176.2	0	0	0	0	0	112.3	E346	E346-G350 CarbonylContact O-C 3.59Å; E346-G350 WeakPolarHBondContact O-CA 3.47Å; E346-G350 PolarHBondContact O-N 3.35Å; E346-G350 VanDerWaalsContact O-O 3.1Å
351	H	84.4	Confident	83.4	Confident	76 Å²	76	63.5 Å²	63.5	35%	0.352	40%	0.398	S	S	.	.			trans	-132.3	153.4	-175.3	61.1	88.2	0	0	0	111.5	E346 C353 C359 F366	E346-H351 PolarHBondContact O-N 3.36Å; H351-C353 VanDerWaalsContact C-N 3.35Å; H351-C353 VanDerWaalsContact ND1-CB 3.28Å; H351-C353 WeakPolarHBondContact ND1-CB 3.27Å; H351-C353 PolarHBondContact ND1-N 2.99Å; H351-C353 PolarHBondContact ND1-SG 2.03Å; H351-C353 PolarHBondContact O-N 2.91Å; H351-C359 HydrophobicContact CB-CB 4.38Å; H351-F366 HydrophobicContact CB-CD2 3.87Å; H351-F366 HydrophobicContact CB-CE2 3.61Å; H351-F366 HydrophobicContact CB-CZ 4.1Å
352	N	86.8	Confident	83.5	Confident	160 Å²	160	62.8 Å²	62.8	86%	0.856	39%	0.393	S	S	*	.			trans	-96.9	35.8	178.9	-72.2	-14.2	0	0	0	112.7
353	C	82.9	Confident	83.5	Confident	23 Å²	23	65.3 Å²	65.3	16%	0.155	41%	0.412	C	S	.	.			trans	-72.8	142.9	178.9	-59.4	0	0	0	0	111.5	H351 E357 C368	H351-C353 VanDerWaalsContact C-N 3.35Å; H351-C353 VanDerWaalsContact ND1-CB 3.28Å; H351-C353 WeakPolarHBondContact ND1-CB 3.27Å; H351-C353 PolarHBondContact ND1-N 2.99Å; H351-C353 PolarHBondContact ND1-SG 2.03Å; H351-C353 PolarHBondContact O-N 2.91Å; C353-E357 HydrophobicContact CB-CB 4Å; C353-C368 WeakPolarHBondContact CA-SG 3.44Å; C353-C368 HydrophobicContact CB-CB 3.64Å; C353-C368 WeakPolarHBondContact CB-SG 3.39Å; C353-C368 VanDerWaalsContact SG-CA 3.6Å; C353-C368 WeakPolarHBondContact SG-CB 3.33Å; C353-C368 CovalentContact SG-SG 2.04Å; C353-C368 PolarHBondContact SG-SG 3.48Å
354	G	77.6	Confident	83.2	Confident	36 Å²	36	64.1 Å²	64.1	37%	0.371	41%	0.411	S	S	.	.			trans	-67	160.4	179.5	0	0	0	0	0	112.7	G356 E357	G354-G356 PolarHBondContact O-N 3.14Å; G354-G356 VanDerWaalsContact O-N 3.11Å; G354-E357 PolarHBondContact N-OE2 3.06Å; G354-E357 PolarHBondContact O-N 3.5Å
355	A	65.7	Low	83	Confident	120 Å²	120	64.7 Å²	64.7	99%	0.992	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	114.8	172.7	0	0	0	0	0	109.9
356	G	64.1	Low	83	Confident	55 Å²	55	64.7 Å²	64.7	57%	0.567	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	106.9	0.5	-174.6	0	0	0	0	0	114.8	G354 K371	G354-G356 PolarHBondContact O-N 3.14Å; G354-G356 VanDerWaalsContact O-N 3.11Å; G356-K371 PolarHBondContact O-N 2.71Å
357	E	76.6	Confident	82.6	Confident	77 Å²	77	69.9 Å²	69.9	36%	0.36	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	140.7	175.4	-61.4	178	154.4	0	0	111.5	C353 G354 C368 Q369 Q370	C353-E357 HydrophobicContact CB-CB 4Å; G354-E357 PolarHBondContact N-OE2 3.06Å; G354-E357 PolarHBondContact O-N 3.5Å; E357-C368 HydrophobicContact CB-CB 4Å; E357-C368 HydrophobicContact CG-CB 4.43Å; E357-C368 WeakPolarHBondContact OE2-CB 3.47Å; E357-Q369 CarbonylContact C-O 3.44Å; E357-Q369 VanDerWaalsContact CA-O 3.26Å; E357-Q369 WeakPolarHBondContact CA-O 3.49Å; E357-Q370 HydrophobicContact CG-CG 4.43Å
358	E	80.4	Confident	82.4	Confident	84 Å²	84	70.2 Å²	70.2	39%	0.393	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	132.2	169	-176	151.9	-139.1	0	0	110.1	Q369 K371	E358-Q369 PolarHBondContact N-O 3.18Å; E358-Q369 PolarHBondContact O-N 3.27Å; E358-K371 HydrophobicContact CB-CB 4.22Å; E358-K371 HydrophobicContact CB-CD 4.17Å; E358-K371 HydrophobicContact CB-CG 4.46Å; E358-K371 IonicContact OE1-NZ 2.71Å; E358-K371 PolarHBondContact OE1-NZ 3.33Å; E358-K371 WeakPolarHBondContact OE2-CD 2.99Å; E358-K371 WeakPolarHBondContact OE2-CE 3.38Å; E358-K371 IonicContact OE2-NZ 3.23Å; E358-K371 PolarHBondContact OE2-NZ 3.25Å
359	C	85.6	Confident	81.6	Confident	21 Å²	21	67.3 Å²	67.3	14%	0.142	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	132.9	174.2	-177.7	0	0	0	0	110.2	C347 H351	C347-C359 WeakPolarHBondContact CA-SG 3.43Å; C347-C359 HydrophobicContact CB-CB 3.75Å; C347-C359 WeakPolarHBondContact CB-SG 3.48Å; C347-C359 WeakPolarHBondContact SG-CB 3.15Å; C347-C359 PolarHBondContact SG-O 3.41Å; C347-C359 CovalentContact SG-SG 2.05Å; C347-C359 PolarHBondContact SG-SG 2.96Å; H351-C359 HydrophobicContact CB-CB 4.38Å
360	V	84.6	Confident	81.1	Confident	41 Å²	41	69 Å²	69	25%	0.248	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	117.3	171.5	-178.7	0	0	0	0	109	C347 F366 R367	C347-V360 PolarHBondContact SG-N 3.44Å; V360-F366 WeakPolarHBondContact O-CA 3.32Å; V360-R367 HydrophobicContact CB-CG 4.14Å; V360-R367 PolarHBondContact N-O 2.82Å; V360-R367 PolarHBondContact O-N 2.96Å
361	N	84.6	Confident	80	Confident	52 Å²	52	73.3 Å²	73.3	28%	0.278	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	139.4	177.6	-174.1	32.1	0	0	0	110.7	D343 E346 C347 S365	D343-N361 PolarHBondContact OD2-ND2 3.14Å; D343-N361 PolarHBondContact OD2-OD1 3.26Å; E346-N361 PolarHBondContact OE2-OD1 3.36Å; C347-N361 PolarHBondContact SG-N 3.38Å; N361-S365 PolarHBondContact OD1-O 2.95Å
362	T	85.9	Confident	78.8	Confident	33 Å²	33	72 Å²	72	20%	0.202	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	151.8	177.7	56.1	0	0	0	0	110.5	G364 S365	T362-G364 PolarHBondContact O-N 3.28Å; T362-S365 CarbonylContact C-O 3.54Å; T362-S365 VanDerWaalsContact C-O 3.32Å; T362-S365 WeakPolarHBondContact CA-O 3.35Å; T362-S365 PolarHBondContact N-O 3.33Å; T362-S365 CarbonylContact O-C 3.52Å; T362-S365 PolarHBondContact O-N 3.11Å; T362-S365 PolarHBondContact OG1-O 3.38Å
363	P	86.9	Confident	77.3	Confident	111 Å²	111	71.5 Å²	71.5	72%	0.721	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	107.9	179.4	-26.5	35.6	0	0	0	112.8	Y334 D343	Y334-P363 WeakPolarHBondContact OH-CB 3.37Å; Y334-P363 PolarHBondContact OH-O 3.3Å; D343-P363 WeakPolarHBondContact OD1-CA 3.14Å
364	G	84.4	Confident	76.3	Confident	20 Å²	20	77.3 Å²	77.3	21%	0.206	45%	0.454	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.2	5	179.6	0	0	0	0	0	116	Y334 D343 T362	Y334-G364 PolarHBondContact OH-N 3.13Å; Y334-G364 VanDerWaalsContact OH-N 3.13Å; D343-G364 PolarHBondContact OD1-N 3.19Å; T362-G364 PolarHBondContact O-N 3.28Å
365	S	89.3	Confident	76	Confident	59 Å²	59	77 Å²	77	41%	0.413	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-169	-172.3	178.7	-156.1	0	0	0	0	112.6	E346 N361 T362	E346-S365 WeakPolarHBondContact OE1-CA 3.35Å; N361-S365 PolarHBondContact OD1-O 2.95Å; T362-S365 CarbonylContact C-O 3.54Å; T362-S365 VanDerWaalsContact C-O 3.32Å; T362-S365 WeakPolarHBondContact CA-O 3.35Å; T362-S365 PolarHBondContact N-O 3.33Å; T362-S365 CarbonylContact O-C 3.52Å; T362-S365 PolarHBondContact O-N 3.11Å; T362-S365 PolarHBondContact OG1-O 3.38Å
366	F	89.8	Confident	76.4	Confident	60 Å²	60	74.3 Å²	74.3	26%	0.263	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	161.6	169.4	68.5	-74.5	0	0	0	110.5	E346 H351 V360	E346-F366 HydrophobicContact CB-CB 4.04Å; E346-F366 HydrophobicContact CB-CD1 3.41Å; E346-F366 VanDerWaalsContact CB-CD1 3.41Å; E346-F366 HydrophobicContact CB-CE1 4.06Å; E346-F366 HydrophobicContact CB-CG 3.81Å; E346-F366 HydrophobicContact CG-CD1 3.62Å; E346-F366 HydrophobicContact CG-CE1 4.2Å; E346-F366 HydrophobicContact CG-CG 4.43Å; H351-F366 HydrophobicContact CB-CD2 3.87Å; H351-F366 HydrophobicContact CB-CE2 3.61Å; H351-F366 HydrophobicContact CB-CZ 4.1Å; V360-F366 WeakPolarHBondContact O-CA 3.32Å
367	R	83.9	Confident	77.1	Confident	133 Å²	133	80.3 Å²	80.3	50%	0.502	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	151.2	167	68.5	177.4	-177.7	-82.8	-1.1	110.9	V360	V360-R367 HydrophobicContact CB-CG 4.14Å; V360-R367 PolarHBondContact N-O 2.82Å; V360-R367 PolarHBondContact O-N 2.96Å
368	C	84.1	Confident	77.3	Confident	44 Å²	44	77.2 Å²	77.2	30%	0.297	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	133.6	174.7	-53.7	0	0	0	0	108.9	C353 E357	C353-C368 WeakPolarHBondContact CA-SG 3.44Å; C353-C368 HydrophobicContact CB-CB 3.64Å; C353-C368 WeakPolarHBondContact CB-SG 3.39Å; C353-C368 VanDerWaalsContact SG-CA 3.6Å; C353-C368 WeakPolarHBondContact SG-CB 3.33Å; C353-C368 CovalentContact SG-SG 2.04Å; C353-C368 PolarHBondContact SG-SG 3.48Å; E357-C368 HydrophobicContact CB-CB 4Å; E357-C368 HydrophobicContact CG-CB 4.43Å; E357-C368 WeakPolarHBondContact OE2-CB 3.47Å
369	Q	72.1	Confident	77.6	Confident	57 Å²	57	77 Å²	77	27%	0.266	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	137	-177.4	-178.4	170.3	8.4	0	0	109.9	E357 E358 K371 F387	E357-Q369 CarbonylContact C-O 3.44Å; E357-Q369 VanDerWaalsContact CA-O 3.26Å; E357-Q369 WeakPolarHBondContact CA-O 3.49Å; E358-Q369 PolarHBondContact N-O 3.18Å; E358-Q369 PolarHBondContact O-N 3.27Å; Q369-K371 PolarHBondContact O-N 3.4Å; Q369-F387 VanDerWaalsContact NE2-CD1 3.29Å
370	Q	72.6	Confident	77.7	Confident	135 Å²	135	81.8 Å²	81.8	63%	0.631	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.1	134.8	-179.2	-70.7	-174.2	-32.1	0	0	112.3	E357	E357-Q370 HydrophobicContact CG-CG 4.43Å
371	K	56.5	Low	77.5	Confident	142 Å²	142	82.7 Å²	82.7	62%	0.617	45%	0.447	S	S	*	.			trans	-104.8	103.9	178.9	-160.8	175.5	-169.2	152	0	110.3	G356 E358 Q369	G356-K371 PolarHBondContact O-N 2.71Å; E358-K371 HydrophobicContact CB-CB 4.22Å; E358-K371 HydrophobicContact CB-CD 4.17Å; E358-K371 HydrophobicContact CB-CG 4.46Å; E358-K371 IonicContact OE1-NZ 2.71Å; E358-K371 PolarHBondContact OE1-NZ 3.33Å; E358-K371 WeakPolarHBondContact OE2-CD 2.99Å; E358-K371 WeakPolarHBondContact OE2-CE 3.38Å; E358-K371 IonicContact OE2-NZ 3.23Å; E358-K371 PolarHBondContact OE2-NZ 3.25Å; Q369-K371 PolarHBondContact O-N 3.4Å
372	G	59.8	Low	77.4	Confident	48 Å²	48	82.2 Å²	82.2	50%	0.495	44%	0.444	S	S	.	.	S	Bend	trans	125.3	171.9	171.4	0	0	0	0	0	116.5	L374	G372-L374 PolarHBondContact O-N 2.89Å
373	N	54.8	Low	77	Confident	150 Å²	150	84.6 Å²	84.6	80%	0.802	48%	0.476	S	S	*	.	S	Bend	trans	-55.5	16.8	-165.1	-50.4	-12.1	0	0	0	119.4
374	L	63.5	Low	76.5	Confident	145 Å²	145	83.8 Å²	83.8	76%	0.759	48%	0.479	S	S	*	.			trans	-110.6	83.6	174.4	-87.7	88.1	0	0	0	109.2	G372	G372-L374 PolarHBondContact O-N 2.89Å
375	C	70.4	Confident	76	Confident	31 Å²	31	86 Å²	86	21%	0.209	49%	0.488	C	S	.	.	P	Polyproline II helix	trans	-73.3	149.1	165.8	-64.8	0	0	0	0	110.4	Y379 V381 C388	C375-Y379 WeakPolarHBondContact CB-O 3.48Å; C375-V381 WeakPolarHBondContact SG-CG2 3.32Å; C375-C388 WeakPolarHBondContact CA-SG 3.47Å; C375-C388 HydrophobicContact CB-CB 3.85Å; C375-C388 WeakPolarHBondContact CB-SG 3.31Å; C375-C388 VanDerWaalsContact SG-CA 3.55Å; C375-C388 WeakPolarHBondContact SG-CB 3.35Å; C375-C388 CovalentContact SG-SG 2.04Å; C375-C388 PolarHBondContact SG-SG 3.23Å
376	A	74.6	Confident	75.1	Confident	62 Å²	62	85.7 Å²	85.7	51%	0.512	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-59.5	156.7	170.8	0	0	0	0	0	110.4	G378 Y379	A376-G378 PolarHBondContact O-N 3.08Å; A376-Y379 HydrophobicContact CB-CD2 4.05Å; A376-Y379 WeakPolarHBondContact O-CB 3.35Å; A376-Y379 PolarHBondContact O-N 3.31Å
377	H	78.5	Confident	74.3	Confident	181 Å²	181	87.6 Å²	87.6	84%	0.838	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	133.4	176.2	-169.9	-76.6	0	0	0	110.3
378	G	81.9	Confident	74.1	Confident	13 Å²	13	83.7 Å²	83.7	13%	0.134	50%	0.495	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.4	4.6	-173.8	0	0	0	0	0	114.9	A376 V391	A376-G378 PolarHBondContact O-N 3.08Å; G378-V391 WeakPolarHBondContact O-CB 3.4Å; G378-V391 PolarHBondContact O-N 3.22Å
379	Y	86.4	Confident	74.2	Confident	78 Å²	78	86.1 Å²	86.1	31%	0.306	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	144.7	177.2	-65.1	-103.2	0	0	0	111.2	C375 A376 E389 D390 P409 G410	C375-Y379 WeakPolarHBondContact CB-O 3.48Å; A376-Y379 HydrophobicContact CB-CD2 4.05Å; A376-Y379 WeakPolarHBondContact O-CB 3.35Å; A376-Y379 PolarHBondContact O-N 3.31Å; Y379-E389 CarbonylContact C-O 3.47Å; Y379-E389 WeakPolarHBondContact CA-O 3.24Å; Y379-E389 WeakPolarHBondContact CB-O 3.45Å; Y379-D390 HydrophobicContact CD1-CB 4.14Å; Y379-D390 HydrophobicContact CE1-CB 3.9Å; Y379-P409 VanDerWaalsContact OH-C 3.23Å; Y379-P409 WeakPolarHBondContact OH-CB 3.46Å; Y379-G410 PolarHBondContact OH-N 3.28Å
380	E	86.2	Confident	75.1	Confident	122 Å²	122	85.6 Å²	85.6	57%	0.57	50%	0.501	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.6	150.9	176.4	68.7	179	-175.3	0	0	111.9	N382 C388 E389 V391	E380-N382 PolarHBondContact O-N 2.83Å; E380-C388 CarbonylContact O-C 3.58Å; E380-C388 WeakPolarHBondContact O-CA 3.37Å; E380-E389 PolarHBondContact N-O 3Å; E380-E389 PolarHBondContact O-N 3.31Å; E380-V391 HydrophobicContact CB-CG2 3.73Å; E380-V391 HydrophobicContact CG-CG2 3.72Å
381	V	81.9	Confident	76	Confident	61 Å²	61	80.3 Å²	80.3	37%	0.37	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	117.7	177.3	-179.2	0	0	0	0	108.6	C375 G383	C375-V381 WeakPolarHBondContact SG-CG2 3.32Å; V381-G383 PolarHBondContact O-N 2.02Å; V381-G383 VanDerWaalsContact O-N 3.15Å
382	N	82.5	Confident	77.8	Confident	41 Å²	41	76.2 Å²	76.2	22%	0.219	46%	0.463	C	S	.	.			trans	-65.5	113.7	167.5	-178.9	-47.1	0	0	0	109	E380 A384 T385 G386 F387 E389	E380-N382 PolarHBondContact O-N 2.83Å; N382-A384 PolarHBondContact O-N 2.86Å; N382-A384 VanDerWaalsContact O-N 3.12Å; N382-A384 WeakPolarHBondContact OD1-CB 3.48Å; N382-A384 PolarHBondContact OD1-N 3Å; N382-T385 WeakPolarHBondContact CB-OG1 3.46Å; N382-T385 PolarHBondContact O-N 3.11Å; N382-T385 PolarHBondContact OD1-N 3.47Å; N382-G386 WeakPolarHBondContact O-CA 3.29Å; N382-G386 PolarHBondContact O-N 3.34Å; N382-F387 PolarHBondContact N-O 3.41Å; N382-E389 HydrophobicContact CB-CG 4.1Å; N382-E389 PolarHBondContact ND2-OE1 3.08Å; N382-E389 PolarHBondContact ND2-OE2 2.97Å
383	G	76.6	Confident	79.3	Confident	83 Å²	83	74.7 Å²	74.7	86%	0.856	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-15.7	-174.6	0	0	0	0	0	115.5	V381	V381-G383 PolarHBondContact O-N 2.02Å; V381-G383 VanDerWaalsContact O-N 3.15Å
384	A	77.1	Confident	81.2	Confident	95 Å²	95	69.6 Å²	69.6	79%	0.785	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-35.1	177.6	0	0	0	0	0	112.8	N382	N382-A384 PolarHBondContact O-N 2.86Å; N382-A384 VanDerWaalsContact O-N 3.12Å; N382-A384 WeakPolarHBondContact OD1-CB 3.48Å; N382-A384 PolarHBondContact OD1-N 3Å
385	T	73.3	Confident	82.4	Confident	66 Å²	66	67.9 Å²	67.9	41%	0.405	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	-19.5	-173.8	66.4	0	0	0	0	113.2	N382 F387	N382-T385 WeakPolarHBondContact CB-OG1 3.46Å; N382-T385 PolarHBondContact O-N 3.11Å; N382-T385 PolarHBondContact OD1-N 3.47Å; T385-F387 VanDerWaalsContact CB-CD2 3.49Å; T385-F387 PolarHBondContact O-N 3.38Å; T385-F387 WeakPolarHBondContact OG1-CD2 3.38Å; T385-F387 PolarHBondContact OG1-N 3.33Å
386	G	70.6	Confident	83.2	Confident	53 Å²	53	70 Å²	70	55%	0.546	43%	0.426	S	S	.	.			trans	73.4	6.3	-174.3	0	0	0	0	0	113.9	N382	N382-G386 WeakPolarHBondContact O-CA 3.29Å; N382-G386 PolarHBondContact O-N 3.34Å
387	F	73	Confident	83.5	Confident	99 Å²	99	70 Å²	70	43%	0.434	43%	0.433	S	S	.	.			trans	-92	151.7	178.9	-62.2	-58.2	0	0	0	111.9	Q369 N382 T385 E389	Q369-F387 VanDerWaalsContact NE2-CD1 3.29Å; N382-F387 PolarHBondContact N-O 3.41Å; T385-F387 VanDerWaalsContact CB-CD2 3.49Å; T385-F387 PolarHBondContact O-N 3.38Å; T385-F387 WeakPolarHBondContact OG1-CD2 3.38Å; T385-F387 PolarHBondContact OG1-N 3.33Å; F387-E389 PolarHBondContact O-N 3.07Å
388	C	79.8	Confident	83.8	Confident	52 Å²	52	66.5 Å²	66.5	35%	0.351	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	120.8	170.3	-64	0	0	0	0	110	C375 E380	C375-C388 WeakPolarHBondContact CA-SG 3.47Å; C375-C388 HydrophobicContact CB-CB 3.85Å; C375-C388 WeakPolarHBondContact CB-SG 3.31Å; C375-C388 VanDerWaalsContact SG-CA 3.55Å; C375-C388 WeakPolarHBondContact SG-CB 3.35Å; C375-C388 CovalentContact SG-SG 2.04Å; C375-C388 PolarHBondContact SG-SG 3.23Å; E380-C388 CarbonylContact O-C 3.58Å; E380-C388 WeakPolarHBondContact O-CA 3.37Å
389	E	86.9	Confident	83.8	Confident	94 Å²	94	66.7 Å²	66.7	44%	0.439	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	148.4	173.4	-72.1	179.1	179.9	0	0	109.4	Y379 E380 N382 F387 V391	Y379-E389 CarbonylContact C-O 3.47Å; Y379-E389 WeakPolarHBondContact CA-O 3.24Å; Y379-E389 WeakPolarHBondContact CB-O 3.45Å; E380-E389 PolarHBondContact N-O 3Å; E380-E389 PolarHBondContact O-N 3.31Å; N382-E389 HydrophobicContact CB-CG 4.1Å; N382-E389 PolarHBondContact ND2-OE1 3.08Å; N382-E389 PolarHBondContact ND2-OE2 2.97Å; F387-E389 PolarHBondContact O-N 3.07Å; E389-V391 PolarHBondContact O-N 3.03Å
390	D	90.9	Very high	83.8	Confident	47 Å²	47	66.3 Å²	66.3	25%	0.251	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	131.8	179.2	-179.2	58.3	0	0	0	110.8	Y379 N392 N407 P409 G410	Y379-D390 HydrophobicContact CD1-CB 4.14Å; Y379-D390 HydrophobicContact CE1-CB 3.9Å; D390-N392 PolarHBondContact O-N 2.85Å; D390-N407 PolarHBondContact OD2-ND2 3.43Å; D390-P409 WeakPolarHBondContact OD1-CA 3.32Å; D390-G410 PolarHBondContact OD1-N 2.98Å
391	V	91.5	Very high	84	Confident	23 Å²	23	61.7 Å²	61.7	14%	0.139	41%	0.413	C	S	.	.			trans	-80.7	114.8	175.9	176.4	0	0	0	0	107.8	G378 E380 E389 E393 T396 N407	G378-V391 WeakPolarHBondContact O-CB 3.4Å; G378-V391 PolarHBondContact O-N 3.22Å; E380-V391 HydrophobicContact CB-CG2 3.73Å; E380-V391 HydrophobicContact CG-CG2 3.72Å; E389-V391 PolarHBondContact O-N 3.03Å; V391-E393 HydrophobicContact CG1-CG 4.37Å; V391-E393 PolarHBondContact O-N 2.01Å; V391-T396 HydrophobicContact CG1-CG2 4.25Å; V391-N407 PolarHBondContact O-OD1 2.78Å
392	N	92.8	Very high	84.5	Confident	57 Å²	57	64.2 Å²	64.2	31%	0.305	42%	0.421	S	S	.	.			trans	-79.9	90.8	178.1	-175.4	-28.8	0	0	0	111.8	D390 C394 T395 T396 N407	D390-N392 PolarHBondContact O-N 2.85Å; N392-C394 PolarHBondContact O-N 3.35Å; N392-C394 VanDerWaalsContact O-N 3.15Å; N392-C394 WeakPolarHBondContact OD1-CB 3.37Å; N392-C394 PolarHBondContact OD1-N 3.28Å; N392-T395 HydrophobicContact CB-CG2 4.44Å; N392-T395 WeakPolarHBondContact CB-OG1 3.26Å; N392-T395 PolarHBondContact O-N 3.07Å; N392-T395 PolarHBondContact O-OG1 2.03Å; N392-T395 PolarHBondContact OD1-N 3.15Å; N392-T395 VanDerWaalsContact OD1-N 3.16Å; N392-T396 WeakPolarHBondContact O-CG2 3.04Å; N392-T396 PolarHBondContact O-N 3.12Å; N392-T396 VanDerWaalsContact O-N 3.09Å; N392-T396 PolarHBondContact O-OG1 3.15Å; N392-N407 VanDerWaalsContact CA-OD1 3.32Å; N392-N407 WeakPolarHBondContact CA-OD1 3.32Å
393	E	93.3	Very high	84.9	Confident	16 Å²	16	65.1 Å²	65.1	8%	0.075	42%	0.424	C	S	.	.	H	α-helix	trans	-64.7	-22.1	-174.4	-57.9	92.3	161.2	0	0	113.8	V391 T395 T396 G397 I398 A399 N407 Y412	V391-E393 HydrophobicContact CG1-CG 4.37Å; V391-E393 PolarHBondContact O-N 2.01Å; E393-T395 VanDerWaalsContact C-N 3.34Å; E393-T396 VanDerWaalsContact CA-OG1 3.29Å; E393-T396 WeakPolarHBondContact CA-OG1 3.27Å; E393-T396 PolarHBondContact O-OG1 2.02Å; E393-G397 PolarHBondContact O-N 3.18Å; E393-I398 HydrophobicContact CB-CB 4.11Å; E393-I398 HydrophobicContact CB-CG2 4.41Å; E393-I398 HydrophobicContact CG-CB 4.35Å; E393-I398 HydrophobicContact CG-CG2 4.3Å; E393-I398 PolarHBondContact O-N 3.5Å; E393-A399 HydrophobicContact CB-CB 4.09Å; E393-A399 WeakPolarHBondContact O-CB 2.97Å; E393-A399 PolarHBondContact O-N 2.89Å; E393-A399 VanDerWaalsContact O-N 3.09Å; E393-N407 PolarHBondContact OE2-OD1 2.66Å; E393-Y412 HydrophobicContact CB-CD1 3.46Å; E393-Y412 VanDerWaalsContact CB-CD1 3.46Å; E393-Y412 HydrophobicContact CB-CE1 4.14Å; E393-Y412 HydrophobicContact CB-CG 3.97Å; E393-Y412 HydrophobicContact CG-CD1 3.7Å; E393-Y412 HydrophobicContact CG-CE1 4.29Å; E393-Y412 PolarHBondContact OE2-N 2.71Å
394	C	92.9	Very high	85.7	Confident	43 Å²	43	66.6 Å²	66.6	29%	0.291	41%	0.407	S	S	.	.	H	α-helix	trans	-68.7	-33.1	173.9	-55.5	0	0	0	0	112.4	N392 C405 V406 N407	N392-C394 PolarHBondContact O-N 3.35Å; N392-C394 VanDerWaalsContact O-N 3.15Å; N392-C394 WeakPolarHBondContact OD1-CB 3.37Å; N392-C394 PolarHBondContact OD1-N 3.28Å; C394-C405 WeakPolarHBondContact CA-SG 3.35Å; C394-C405 HydrophobicContact CB-CB 3.7Å; C394-C405 WeakPolarHBondContact CB-SG 3.27Å; C394-C405 WeakPolarHBondContact SG-CB 3.09Å; C394-C405 CovalentContact SG-SG 2.03Å; C394-C405 PolarHBondContact SG-SG 2.85Å; C394-V406 PolarHBondContact SG-N 3.37Å; C394-N407 PolarHBondContact SG-N 3.17Å; C394-N407 VanDerWaalsContact SG-N 3.35Å
395	T	90.1	Very high	86.5	Confident	109 Å²	109	64 Å²	64	67%	0.669	38%	0.382	S	S	*	.	H	α-helix	trans	-88.9	-29.5	179	60.5	0	0	0	0	112.9	N392 E393 G397	N392-T395 HydrophobicContact CB-CG2 4.44Å; N392-T395 WeakPolarHBondContact CB-OG1 3.26Å; N392-T395 PolarHBondContact O-N 3.07Å; N392-T395 PolarHBondContact O-OG1 2.03Å; N392-T395 PolarHBondContact OD1-N 3.15Å; N392-T395 VanDerWaalsContact OD1-N 3.16Å; E393-T395 VanDerWaalsContact C-N 3.34Å; T395-G397 VanDerWaalsContact C-N 3.26Å; T395-G397 PolarHBondContact O-N 3.01Å
396	T	86.7	Confident	87.4	Confident	75 Å²	75	63.7 Å²	63.7	46%	0.46	38%	0.38	S	S	.	.	H	α-helix	trans	-77.9	-13.6	177.1	62.5	0	0	0	0	112.6	V391 N392 E393 I398	V391-T396 HydrophobicContact CG1-CG2 4.25Å; N392-T396 WeakPolarHBondContact O-CG2 3.04Å; N392-T396 PolarHBondContact O-N 3.12Å; N392-T396 VanDerWaalsContact O-N 3.09Å; N392-T396 PolarHBondContact O-OG1 3.15Å; E393-T396 VanDerWaalsContact CA-OG1 3.29Å; E393-T396 WeakPolarHBondContact CA-OG1 3.27Å; E393-T396 PolarHBondContact O-OG1 2.02Å; T396-I398 PolarHBondContact O-N 3.27Å; T396-I398 WeakPolarHBondContact OG1-CD1 3.39Å; T396-I398 WeakPolarHBondContact OG1-CG1 3.3Å
397	G	80.4	Confident	88.4	Confident	63 Å²	63	63.3 Å²	63.3	65%	0.649	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.9	11.6	-177.7	0	0	0	0	0	113.6	E393 T395 A399	E393-G397 PolarHBondContact O-N 3.18Å; T395-G397 VanDerWaalsContact C-N 3.26Å; T395-G397 PolarHBondContact O-N 3.01Å; G397-A399 VanDerWaalsContact C-N 3.34Å
398	I	85.2	Confident	89.3	Confident	107 Å²	107	61.3 Å²	61.3	55%	0.549	36%	0.359	S	S	.	.			trans	-72.6	-33.5	173.8	-65.7	172.1	0	0	0	110.1	E393 T396 A400	E393-I398 HydrophobicContact CB-CB 4.11Å; E393-I398 HydrophobicContact CB-CG2 4.41Å; E393-I398 HydrophobicContact CG-CB 4.35Å; E393-I398 HydrophobicContact CG-CG2 4.3Å; E393-I398 PolarHBondContact O-N 3.5Å; T396-I398 PolarHBondContact O-N 3.27Å; T396-I398 WeakPolarHBondContact OG1-CD1 3.39Å; T396-I398 WeakPolarHBondContact OG1-CG1 3.3Å; I398-A400 PolarHBondContact O-N 3.04Å
399	A	81.6	Confident	89.7	Confident	16 Å²	16	64 Å²	64	13%	0.132	38%	0.376	C	S	.	.			trans	-68.7	102.6	174.9	0	0	0	0	0	110.7	E393 G397 C401 C405 Y412	E393-A399 HydrophobicContact CB-CB 4.09Å; E393-A399 WeakPolarHBondContact O-CB 2.97Å; E393-A399 PolarHBondContact O-N 2.89Å; E393-A399 VanDerWaalsContact O-N 3.09Å; G397-A399 VanDerWaalsContact C-N 3.34Å; A399-C401 PolarHBondContact O-N 2.77Å; A399-C405 HydrophobicContact CB-CB 4.4Å; A399-C405 WeakPolarHBondContact CB-SG 3.06Å; A399-Y412 HydrophobicContact CB-CD1 4.12Å; A399-Y412 HydrophobicContact CB-CD2 3.33Å; A399-Y412 HydrophobicContact CB-CE1 4.3Å; A399-Y412 HydrophobicContact CB-CE2 3.55Å; A399-Y412 HydrophobicContact CB-CG 3.63Å
400	A	86.8	Confident	89.5	Confident	71 Å²	71	60.3 Å²	60.3	59%	0.587	36%	0.363	S	S	*	.			trans	-77.3	37.2	-179.9	0	0	0	0	0	113.1	I398 T427	I398-A400 PolarHBondContact O-N 3.04Å; A400-T427 WeakPolarHBondContact O-CB 3.18Å
401	C	91.2	Very high	89.5	Confident	24 Å²	24	60.5 Å²	60.5	16%	0.162	37%	0.368	C	S	.	.			trans	-69.7	132.6	-178.4	-58.3	0	0	0	0	111.4	A399 C405 C414	A399-C401 PolarHBondContact O-N 2.77Å; C401-C405 HydrophobicContact CB-CB 4.12Å; C401-C414 WeakPolarHBondContact CA-SG 3.38Å; C401-C414 HydrophobicContact CB-CB 3.66Å; C401-C414 WeakPolarHBondContact CB-SG 3.07Å; C401-C414 WeakPolarHBondContact SG-CA 3.38Å; C401-C414 WeakPolarHBondContact SG-CB 2.99Å; C401-C414 CovalentContact SG-SG 2.03Å; C401-C414 PolarHBondContact SG-SG 3.19Å
402	E	91.6	Very high	89.5	Confident	115 Å²	115	62.6 Å²	62.6	54%	0.537	37%	0.374	S	S	.	.	S	Bend	trans	-67.9	-38.2	177.6	-176.8	175.1	172.3	0	0	112.6	T427 K428 C429	E402-T427 PolarHBondContact N-O 2.73Å; E402-K428 WeakPolarHBondContact OE2-CA 3.26Å; E402-K428 WeakPolarHBondContact OE2-CB 3.26Å; E402-C429 PolarHBondContact OE2-N 3.43Å
403	Q	91.1	Very high	89.3	Confident	59 Å²	59	63 Å²	63	28%	0.276	37%	0.373	S	S	.	.	S	Bend	trans	-117.9	-89.8	-173.7	-64.6	179.3	-7.9	0	0	111.8	C429	Q403-C429 VanDerWaalsContact CD-CB 3.43Å; Q403-C429 HydrophobicContact CG-CB 4.01Å; Q403-C429 PolarHBondContact OE1-SG 2.69Å; Q403-C429 VanDerWaalsContact OE1-SG 3.41Å
404	K	92.1	Very high	89.2	Confident	114 Å²	114	62.5 Å²	62.5	50%	0.496	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	142.1	-178.7	-67.2	173.2	177.9	153.5	0	111.2	C414 I415 D417	K404-C414 CarbonylContact O-C 3.43Å; K404-C414 VanDerWaalsContact O-CA 3.32Å; K404-C414 WeakPolarHBondContact O-CA 3.44Å; K404-I415 HydrophobicContact CB-CB 4.27Å; K404-I415 WeakPolarHBondContact CB-O 3.44Å; K404-I415 PolarHBondContact N-O 3.34Å; K404-I415 VanDerWaalsContact N-O 3.09Å; K404-I415 PolarHBondContact O-N 3.32Å; K404-D417 WeakPolarHBondContact CE-OD1 3.4Å; K404-D417 IonicContact NZ-OD1 2.73Å; K404-D417 PolarHBondContact NZ-OD1 3.48Å
405	C	94.1	Very high	89.1	Confident	40 Å²	40	63.5 Å²	63.5	27%	0.27	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	135.3	172.3	-176.7	0	0	0	0	109.8	C394 A399 C401	C394-C405 WeakPolarHBondContact CA-SG 3.35Å; C394-C405 HydrophobicContact CB-CB 3.7Å; C394-C405 WeakPolarHBondContact CB-SG 3.27Å; C394-C405 WeakPolarHBondContact SG-CB 3.09Å; C394-C405 CovalentContact SG-SG 2.03Å; C394-C405 PolarHBondContact SG-SG 2.85Å; A399-C405 HydrophobicContact CB-CB 4.4Å; A399-C405 WeakPolarHBondContact CB-SG 3.06Å; C401-C405 HydrophobicContact CB-CB 4.12Å
406	V	93.2	Very high	89.2	Confident	60 Å²	60	59.5 Å²	59.5	36%	0.364	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	124.7	172.2	178.8	0	0	0	0	108.7	C394 I408 Y412 Q413 I415	C394-V406 PolarHBondContact SG-N 3.37Å; V406-I408 HydrophobicContact CG1-CG2 4.43Å; V406-Y412 CarbonylContact O-C 3.15Å; V406-Y412 WeakPolarHBondContact O-CA 3.41Å; V406-Q413 PolarHBondContact N-O 2.89Å; V406-Q413 PolarHBondContact O-N 2.94Å; V406-I415 HydrophobicContact CB-CD1 4.26Å; V406-I415 HydrophobicContact CG2-CD1 3.41Å; V406-I415 VanDerWaalsContact CG2-CD1 3.41Å; V406-I415 HydrophobicContact CG2-CG1 4.13Å
407	N	92.2	Very high	89.2	Confident	46 Å²	46	59.1 Å²	59.1	25%	0.246	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	132.8	176.5	-171.2	54.1	0	0	0	110.1	D390 V391 N392 E393 C394 S411	D390-N407 PolarHBondContact OD2-ND2 3.43Å; V391-N407 PolarHBondContact O-OD1 2.78Å; N392-N407 VanDerWaalsContact CA-OD1 3.32Å; N392-N407 WeakPolarHBondContact CA-OD1 3.32Å; E393-N407 PolarHBondContact OE2-OD1 2.66Å; C394-N407 PolarHBondContact SG-N 3.17Å; C394-N407 VanDerWaalsContact SG-N 3.35Å; N407-S411 PolarHBondContact OD1-O 2.86Å
408	I	91.1	Very high	89.5	Confident	57 Å²	57	67.7 Å²	67.7	29%	0.292	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	147.1	178.6	56.3	173.6	0	0	0	109.3	V406 G410 S411	V406-I408 HydrophobicContact CG1-CG2 4.43Å; I408-G410 PolarHBondContact O-N 2.64Å; I408-S411 CarbonylContact C-O 3.55Å; I408-S411 VanDerWaalsContact CG1-C 3.48Å; I408-S411 WeakPolarHBondContact CG1-O 3.02Å; I408-S411 PolarHBondContact N-O 3.4Å; I408-S411 CarbonylContact O-C 3.32Å; I408-S411 PolarHBondContact O-N 3.02Å
409	P	87.2	Confident	89.6	Confident	109 Å²	109	63.1 Å²	63.1	71%	0.708	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	111.9	-177.4	-27	35.2	0	0	0	112.9	Y379 D390	Y379-P409 VanDerWaalsContact OH-C 3.23Å; Y379-P409 WeakPolarHBondContact OH-CB 3.46Å; D390-P409 WeakPolarHBondContact OD1-CA 3.32Å
410	G	84.7	Confident	90	Very high	16 Å²	16	64.7 Å²	64.7	17%	0.165	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.5	2.3	-178.9	0	0	0	0	0	116.5	Y379 D390 I408	Y379-G410 PolarHBondContact OH-N 3.28Å; D390-G410 PolarHBondContact OD1-N 2.98Å; I408-G410 PolarHBondContact O-N 2.64Å
411	S	90	Very high	90.1	Very high	50 Å²	50	63.6 Å²	63.6	35%	0.35	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.1	-172.3	179.9	-170.7	0	0	0	0	112.4	N407 I408	N407-S411 PolarHBondContact OD1-O 2.86Å; I408-S411 CarbonylContact C-O 3.55Å; I408-S411 VanDerWaalsContact CG1-C 3.48Å; I408-S411 WeakPolarHBondContact CG1-O 3.02Å; I408-S411 PolarHBondContact N-O 3.4Å; I408-S411 CarbonylContact O-C 3.32Å; I408-S411 PolarHBondContact O-N 3.02Å
412	Y	91.5	Very high	90.1	Very high	67 Å²	67	66.1 Å²	66.1	26%	0.263	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	167.1	166.4	64.9	-81.2	0	0	0	111.7	E393 A399 V406	E393-Y412 HydrophobicContact CB-CD1 3.46Å; E393-Y412 VanDerWaalsContact CB-CD1 3.46Å; E393-Y412 HydrophobicContact CB-CE1 4.14Å; E393-Y412 HydrophobicContact CB-CG 3.97Å; E393-Y412 HydrophobicContact CG-CD1 3.7Å; E393-Y412 HydrophobicContact CG-CE1 4.29Å; E393-Y412 PolarHBondContact OE2-N 2.71Å; A399-Y412 HydrophobicContact CB-CD1 4.12Å; A399-Y412 HydrophobicContact CB-CD2 3.33Å; A399-Y412 HydrophobicContact CB-CE1 4.3Å; A399-Y412 HydrophobicContact CB-CE2 3.55Å; A399-Y412 HydrophobicContact CB-CG 3.63Å; V406-Y412 CarbonylContact O-C 3.15Å; V406-Y412 WeakPolarHBondContact O-CA 3.41Å
413	Q	89.3	Confident	89.8	Confident	65 Å²	65	61 Å²	61	30%	0.304	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	133.6	172.9	-175.4	163.8	-15.3	0	0	110.8	E174 V406	E174-Q413 VanDerWaalsContact CD-NE2 3.28Å; E174-Q413 VanDerWaalsContact OE1-CD 3.22Å; E174-Q413 PolarHBondContact OE1-NE2 3.39Å; E174-Q413 PolarHBondContact OE1-OE1 3.29Å; E174-Q413 PolarHBondContact OE2-NE2 2.65Å; E174-Q413 PolarHBondContact OE2-OE1 3.2Å; E174-Q413 VanDerWaalsContact OE2-OE1 3.13Å; V406-Q413 PolarHBondContact N-O 2.89Å; V406-Q413 PolarHBondContact O-N 2.94Å
414	C	91.3	Very high	89.5	Confident	6 Å²	6	64.5 Å²	64.5	4%	0.041	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	137.6	173.6	-54.5	0	0	0	0	110.3	C401 K404 L422 G426	C401-C414 WeakPolarHBondContact CA-SG 3.38Å; C401-C414 HydrophobicContact CB-CB 3.66Å; C401-C414 WeakPolarHBondContact CB-SG 3.07Å; C401-C414 WeakPolarHBondContact SG-CA 3.38Å; C401-C414 WeakPolarHBondContact SG-CB 2.99Å; C401-C414 CovalentContact SG-SG 2.03Å; C401-C414 PolarHBondContact SG-SG 3.19Å; K404-C414 CarbonylContact O-C 3.43Å; K404-C414 VanDerWaalsContact O-CA 3.32Å; K404-C414 WeakPolarHBondContact O-CA 3.44Å; C414-L422 HydrophobicContact CB-CD1 3.97Å; C414-G426 WeakPolarHBondContact CB-O 3.43Å
415	I	90.6	Very high	89.1	Confident	65 Å²	65	62.7 Å²	62.7	33%	0.333	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	133.2	179.6	-56.4	-176.1	0	0	0	108.7	K404 V406	K404-I415 HydrophobicContact CB-CB 4.27Å; K404-I415 WeakPolarHBondContact CB-O 3.44Å; K404-I415 PolarHBondContact N-O 3.34Å; K404-I415 VanDerWaalsContact N-O 3.09Å; K404-I415 PolarHBondContact O-N 3.32Å; V406-I415 HydrophobicContact CB-CD1 4.26Å; V406-I415 HydrophobicContact CG2-CD1 3.41Å; V406-I415 VanDerWaalsContact CG2-CD1 3.41Å; V406-I415 HydrophobicContact CG2-CG1 4.13Å
416	C	90.3	Very high	88.7	Confident	25 Å²	25	62.3 Å²	62.3	17%	0.169	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-91.1	147.9	175.6	-56.8	0	0	0	0	111.9	F420 C429	C416-F420 HydrophobicContact CB-CB 3.84Å; C416-C429 WeakPolarHBondContact CA-SG 3.26Å; C416-C429 HydrophobicContact CB-CB 3.74Å; C416-C429 WeakPolarHBondContact CB-SG 3.45Å; C416-C429 WeakPolarHBondContact SG-CA 3.15Å; C416-C429 WeakPolarHBondContact SG-CB 3.2Å; C416-C429 CovalentContact SG-SG 2.04Å; C416-C429 PolarHBondContact SG-SG 3.4Å
417	D	86.8	Confident	88.4	Confident	67 Å²	67	60.7 Å²	60.7	36%	0.358	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-65.6	162.2	170.5	-74.3	-35	0	0	0	110.9	K404 G419 F420	K404-D417 WeakPolarHBondContact CE-OD1 3.4Å; K404-D417 IonicContact NZ-OD1 2.73Å; K404-D417 PolarHBondContact NZ-OD1 3.48Å; D417-G419 PolarHBondContact O-N 2.79Å; D417-F420 HydrophobicContact CB-CD2 4.41Å; D417-F420 PolarHBondContact O-N 3.19Å; D417-F420 VanDerWaalsContact O-N 3.12Å
418	R	88.4	Confident	88.4	Confident	242 Å²	242	64 Å²	64	91%	0.913	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	134.9	-179.2	-173.4	179.7	-178.7	171.7	2.5	110.4
419	G	85.9	Confident	88.4	Confident	11 Å²	11	61.6 Å²	61.6	11%	0.113	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	90	2.9	-176.9	0	0	0	0	0	114	D417 I432	D417-G419 PolarHBondContact O-N 2.79Å; G419-I432 WeakPolarHBondContact O-CB 3.5Å; G419-I432 PolarHBondContact O-N 3.24Å
420	F	90.3	Very high	88.7	Confident	50 Å²	50	61.8 Å²	61.8	22%	0.219	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	147.6	176.7	-61.4	-95.1	0	0	0	110.9	C416 D417 C429 E430 D431 K454	C416-F420 HydrophobicContact CB-CB 3.84Å; D417-F420 HydrophobicContact CB-CD2 4.41Å; D417-F420 PolarHBondContact O-N 3.19Å; D417-F420 VanDerWaalsContact O-N 3.12Å; F420-C429 HydrophobicContact CB-CB 4.12Å; F420-E430 CarbonylContact C-O 3.55Å; F420-E430 WeakPolarHBondContact CA-O 3.42Å; F420-E430 WeakPolarHBondContact CB-O 3.32Å; F420-D431 HydrophobicContact CD1-CB 4.23Å; F420-D431 HydrophobicContact CE1-CB 4.07Å; F420-K454 HydrophobicContact CZ-CB 4.28Å
421	A	88.5	Confident	89.1	Confident	47 Å²	47	63.3 Å²	63.3	39%	0.388	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	146.7	174.7	0	0	0	0	0	110.3	G423 E430 I432	A421-G423 PolarHBondContact O-N 3.13Å; A421-E430 PolarHBondContact N-O 3.15Å; A421-E430 PolarHBondContact O-N 3.11Å; A421-I432 HydrophobicContact CB-CD1 4.25Å; A421-I432 HydrophobicContact CB-CG1 3.9Å
422	L	91.3	Very high	89.2	Confident	78 Å²	78	63.6 Å²	63.6	41%	0.408	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	124.6	177.2	-164.4	70.4	0	0	0	109.3	C414	C414-L422 HydrophobicContact CB-CD1 3.97Å
423	G	84.9	Confident	89.1	Confident	7 Å²	7	63 Å²	63	7%	0.072	33%	0.332	C	S	.	.			trans	-65.3	168.9	178.4	0	0	0	0	0	112.6	A421 D425 G426 K428	A421-G423 PolarHBondContact O-N 3.13Å; G423-D425 PolarHBondContact O-N 3.47Å; G423-D425 VanDerWaalsContact O-N 3.14Å; G423-G426 PolarHBondContact O-N 3.1Å; G423-K428 PolarHBondContact N-O 3.09Å
424	P	84.8	Confident	89.1	Confident	133 Å²	133	61.1 Å²	61.1	86%	0.864	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-17.7	-178.4	25.4	-33.6	0	0	0	113.8
425	D	83.8	Confident	89	Confident	76 Å²	76	61.9 Å²	61.9	41%	0.406	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-4.4	173.2	61.9	8	0	0	0	113.3	G423 T427 K428	G423-D425 PolarHBondContact O-N 3.47Å; G423-D425 VanDerWaalsContact O-N 3.14Å; D425-T427 VanDerWaalsContact CG-OG1 3.32Å; D425-T427 PolarHBondContact O-N 2.72Å; D425-T427 VanDerWaalsContact O-N 3.16Å; D425-T427 PolarHBondContact OD1-N 3.3Å; D425-T427 VanDerWaalsContact OD1-N 3.13Å; D425-T427 PolarHBondContact OD1-OG1 3.18Å; D425-K428 PolarHBondContact OD1-N 2.02Å; D425-K428 VanDerWaalsContact OD2-CD 3.25Å; D425-K428 WeakPolarHBondContact OD2-CD 2.99Å; D425-K428 VanDerWaalsContact OD2-CG 3.28Å; D425-K428 WeakPolarHBondContact OD2-CG 3.43Å
426	G	85.8	Confident	88.8	Confident	31 Å²	31	62.7 Å²	62.7	32%	0.32	34%	0.34	S	S	.	.	S	Bend	trans	67.5	9.9	178.7	0	0	0	0	0	114.4	C414 G423	C414-G426 WeakPolarHBondContact CB-O 3.43Å; G423-G426 PolarHBondContact O-N 3.1Å
427	T	88.4	Confident	88.5	Confident	27 Å²	27	66.6 Å²	66.6	17%	0.166	36%	0.358	C	S	.	.	S	Bend	trans	-131.6	-31.8	-171.9	51.4	0	0	0	0	113.6	A400 E402 D425	A400-T427 WeakPolarHBondContact O-CB 3.18Å; E402-T427 PolarHBondContact N-O 2.73Å; D425-T427 VanDerWaalsContact CG-OG1 3.32Å; D425-T427 PolarHBondContact O-N 2.72Å; D425-T427 VanDerWaalsContact O-N 3.16Å; D425-T427 PolarHBondContact OD1-N 3.3Å; D425-T427 VanDerWaalsContact OD1-N 3.13Å; D425-T427 PolarHBondContact OD1-OG1 3.18Å
428	K	91.4	Very high	88.1	Confident	114 Å²	114	68.6 Å²	68.6	50%	0.496	36%	0.361	S	S	.	.			trans	-91.4	151.2	177.2	-68.6	-177.7	-171.3	172.2	0	112.4	E402 G423 D425	E402-K428 WeakPolarHBondContact OE2-CA 3.26Å; E402-K428 WeakPolarHBondContact OE2-CB 3.26Å; G423-K428 PolarHBondContact N-O 3.09Å; D425-K428 PolarHBondContact OD1-N 2.02Å; D425-K428 VanDerWaalsContact OD2-CD 3.25Å; D425-K428 WeakPolarHBondContact OD2-CD 2.99Å; D425-K428 VanDerWaalsContact OD2-CG 3.28Å; D425-K428 WeakPolarHBondContact OD2-CG 3.43Å
429	C	91.9	Very high	87.4	Confident	8 Å²	8	60.7 Å²	60.7	5%	0.054	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	107.3	179.4	-69.2	0	0	0	0	109.7	E402 Q403 C416 F420	E402-C429 PolarHBondContact OE2-N 3.43Å; Q403-C429 VanDerWaalsContact CD-CB 3.43Å; Q403-C429 HydrophobicContact CG-CB 4.01Å; Q403-C429 PolarHBondContact OE1-SG 2.69Å; Q403-C429 VanDerWaalsContact OE1-SG 3.41Å; C416-C429 WeakPolarHBondContact CA-SG 3.26Å; C416-C429 HydrophobicContact CB-CB 3.74Å; C416-C429 WeakPolarHBondContact CB-SG 3.45Å; C416-C429 WeakPolarHBondContact SG-CA 3.15Å; C416-C429 WeakPolarHBondContact SG-CB 3.2Å; C416-C429 CovalentContact SG-SG 2.04Å; C416-C429 PolarHBondContact SG-SG 3.4Å; F420-C429 HydrophobicContact CB-CB 4.12Å
430	E	92.3	Very high	86.2	Confident	112 Å²	112	64 Å²	64	52%	0.523	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	139.4	-179.5	-63.3	-176	172.3	0	0	110	F420 A421	F420-E430 CarbonylContact C-O 3.55Å; F420-E430 WeakPolarHBondContact CA-O 3.42Å; F420-E430 WeakPolarHBondContact CB-O 3.32Å; A421-E430 PolarHBondContact N-O 3.15Å; A421-E430 PolarHBondContact O-N 3.11Å
431	D	94.1	Very high	84.6	Confident	48 Å²	48	64.3 Å²	64.3	26%	0.257	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	134	178.3	-175.8	59.3	0	0	0	111	F420 D433 N452 K454 G455	F420-D431 HydrophobicContact CD1-CB 4.23Å; F420-D431 HydrophobicContact CE1-CB 4.07Å; D431-D433 PolarHBondContact O-N 3.33Å; D431-N452 PolarHBondContact OD2-ND2 3.23Å; D431-K454 WeakPolarHBondContact OD1-CA 3.45Å; D431-G455 PolarHBondContact OD1-N 3.08Å
432	I	91.8	Very high	82.9	Confident	56 Å²	56	65.2 Å²	65.2	29%	0.287	40%	0.403	S	S	.	.			trans	-82.1	105.8	174.8	-61.9	172.7	0	0	0	107.3	G419 A421 E434 I437	G419-I432 WeakPolarHBondContact O-CB 3.5Å; G419-I432 PolarHBondContact O-N 3.24Å; A421-I432 HydrophobicContact CB-CD1 4.25Å; A421-I432 HydrophobicContact CB-CG1 3.9Å; I432-E434 HydrophobicContact CG2-CG 4.28Å; I432-E434 PolarHBondContact O-N 3.21Å; I432-I437 HydrophobicContact CG2-CD1 3.51Å
433	D	89.2	Confident	81.3	Confident	54 Å²	54	67.1 Å²	67.1	29%	0.289	41%	0.414	S	S	.	.			trans	-74.6	91.2	174.9	-175.8	-12.1	0	0	0	110.7	D431 C435 S436 I437 N452	D431-D433 PolarHBondContact O-N 3.33Å; D433-C435 PolarHBondContact O-N 3.31Å; D433-C435 WeakPolarHBondContact OD1-CB 3.37Å; D433-C435 PolarHBondContact OD1-N 2.95Å; D433-C435 VanDerWaalsContact OD1-N 3.09Å; D433-S436 PolarHBondContact O-N 3.35Å; D433-S436 PolarHBondContact OD1-N 2.92Å; D433-S436 WeakPolarHBondContact OD2-CB 3.37Å; D433-S436 PolarHBondContact OD2-OG 3.02Å; D433-I437 WeakPolarHBondContact O-CG1 2.99Å; D433-I437 PolarHBondContact O-N 3.33Å; D433-N452 WeakPolarHBondContact OD1-CB 3.39Å
434	E	89.4	Confident	80.3	Confident	26 Å²	26	73 Å²	73	12%	0.121	44%	0.444	C	S	.	.	H	α-helix	trans	-65.1	-32.6	-179.7	-55.2	96.8	153.9	0	0	111.4	I432 S436 I437 W438 L445 N452 Y457	I432-E434 HydrophobicContact CG2-CG 4.28Å; I432-E434 PolarHBondContact O-N 3.21Å; E434-S436 VanDerWaalsContact C-N 3.31Å; E434-S436 PolarHBondContact O-N 3.5Å; E434-I437 PolarHBondContact O-N 3.07Å; E434-W438 PolarHBondContact O-N 3.31Å; E434-L445 HydrophobicContact CB-CD2 3.79Å; E434-N452 PolarHBondContact OE2-OD1 2.73Å; E434-Y457 HydrophobicContact CB-CD1 3.75Å; E434-Y457 HydrophobicContact CB-CE1 4.26Å; E434-Y457 HydrophobicContact CB-CG 4.28Å; E434-Y457 HydrophobicContact CG-CD1 3.78Å; E434-Y457 HydrophobicContact CG-CE1 4.21Å
435	C	88.3	Confident	80.1	Confident	23 Å²	23	67.8 Å²	67.8	16%	0.155	41%	0.409	C	S	.	.	H	α-helix	trans	-62.5	-40.5	178.7	-59.4	0	0	0	0	111.9	D433 A439 C450 I451 N452	D433-C435 PolarHBondContact O-N 3.31Å; D433-C435 WeakPolarHBondContact OD1-CB 3.37Å; D433-C435 PolarHBondContact OD1-N 2.95Å; D433-C435 VanDerWaalsContact OD1-N 3.09Å; C435-A439 WeakPolarHBondContact O-CB 3.49Å; C435-A439 PolarHBondContact O-N 3.2Å; C435-C450 WeakPolarHBondContact CA-SG 3.2Å; C435-C450 HydrophobicContact CB-CB 3.73Å; C435-C450 WeakPolarHBondContact CB-SG 3.17Å; C435-C450 WeakPolarHBondContact SG-CB 3.49Å; C435-C450 CovalentContact SG-SG 2.03Å; C435-C450 PolarHBondContact SG-SG 3.08Å; C435-I451 PolarHBondContact SG-N 2.85Å; C435-I451 VanDerWaalsContact SG-N 3.37Å; C435-N452 HydrophobicContact CB-CB 4.44Å; C435-N452 PolarHBondContact SG-N 3.07Å
436	S	87.6	Confident	80	Confident	81 Å²	81	64.6 Å²	64.6	57%	0.566	39%	0.392	S	S	*	.	H	α-helix	trans	-71.2	-36.8	177.1	-70.5	0	0	0	0	112.6	D433 E434	D433-S436 PolarHBondContact O-N 3.35Å; D433-S436 PolarHBondContact OD1-N 2.92Å; D433-S436 WeakPolarHBondContact OD2-CB 3.37Å; D433-S436 PolarHBondContact OD2-OG 3.02Å; E434-S436 VanDerWaalsContact C-N 3.31Å; E434-S436 PolarHBondContact O-N 3.5Å
437	I	83.5	Confident	79.6	Confident	107 Å²	107	67.3 Å²	67.3	55%	0.549	40%	0.398	S	S	.	.	H	α-helix	trans	-67.2	-41.5	-179.7	-68.8	166.3	0	0	0	111.5	I432 D433 E434	I432-I437 HydrophobicContact CG2-CD1 3.51Å; D433-I437 WeakPolarHBondContact O-CG1 2.99Å; D433-I437 PolarHBondContact O-N 3.33Å; E434-I437 PolarHBondContact O-N 3.07Å
438	W	79.1	Confident	79.1	Confident	110 Å²	110	67.4 Å²	67.4	42%	0.417	40%	0.403	S	S	.	.	H	α-helix	trans	-90.1	-7	-175.7	-66.6	97.9	0	0	0	113.7	E434 G440 S441 N443 L445	E434-W438 PolarHBondContact O-N 3.31Å; W438-G440 PolarHBondContact O-N 3.21Å; W438-G440 VanDerWaalsContact O-N 3.11Å; W438-S441 PolarHBondContact O-N 3.09Å; W438-S441 PolarHBondContact O-OG 3.44Å; W438-N443 HydrophobicContact CZ3-CB 4.36Å; W438-L445 HydrophobicContact CB-CB 3.75Å; W438-L445 HydrophobicContact CB-CD2 4.3Å; W438-L445 HydrophobicContact CG-CB 3.96Å; W438-L445 HydrophobicContact CG-CD1 4.22Å; W438-L445 HydrophobicContact CG-CD2 4.21Å; W438-L445 HydrophobicContact CG-CG 4.37Å
439	A	74	Confident	78.7	Confident	75 Å²	75	63.7 Å²	63.7	62%	0.62	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	114	177.3	0	0	0	0	0	111.6	C435	C435-A439 WeakPolarHBondContact O-CB 3.49Å; C435-A439 PolarHBondContact O-N 3.2Å
440	G	60	Low	78.6	Confident	80 Å²	80	65.5 Å²	65.5	83%	0.825	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.3	9.1	174.5	0	0	0	0	0	115.7	W438 G442	W438-G440 PolarHBondContact O-N 3.21Å; W438-G440 VanDerWaalsContact O-N 3.11Å; G440-G442 VanDerWaalsContact C-N 3.25Å; G440-G442 PolarHBondContact O-N 3.48Å
441	S	57.4	Low	78.6	Confident	58 Å²	58	64 Å²	64	41%	0.406	41%	0.405	S	S	.	.	S	Bend	trans	-75.7	-7.5	-178.4	79.1	0	0	0	0	114.6	W438 N443	W438-S441 PolarHBondContact O-N 3.09Å; W438-S441 PolarHBondContact O-OG 3.44Å; S441-N443 PolarHBondContact O-N 2.79Å; S441-N443 PolarHBondContact OG-N 2.75Å; S441-N443 PolarHBondContact OG-O 2.84Å; S441-N443 VanDerWaalsContact OG-O 3.14Å
442	G	52.5	Low	78.5	Confident	65 Å²	65	64.1 Å²	64.1	67%	0.67	41%	0.405	S	S	*	.	S	Bend	trans	75.8	-9.8	-174.4	0	0	0	0	0	114.2	G440	G440-G442 VanDerWaalsContact C-N 3.25Å; G440-G442 PolarHBondContact O-N 3.48Å
443	N	56.2	Low	78.5	Confident	119 Å²	119	63.7 Å²	63.7	64%	0.636	41%	0.406	S	S	*	.	S	Bend	trans	-108.9	95.2	167.5	-70.2	-36.5	0	0	0	108	W438 S441 L445	W438-N443 HydrophobicContact CZ3-CB 4.36Å; S441-N443 PolarHBondContact O-N 2.79Å; S441-N443 PolarHBondContact OG-N 2.75Å; S441-N443 PolarHBondContact OG-O 2.84Å; S441-N443 VanDerWaalsContact OG-O 3.14Å; N443-L445 PolarHBondContact O-N 2.83Å
444	D	65.2	Low	78.6	Confident	129 Å²	129	70.1 Å²	70.1	69%	0.69	43%	0.431	S	S	*	.			trans	-70.6	117.8	-174	-70.2	-26.6	0	0	0	110.8	C446	D444-C446 PolarHBondContact O-N 2.86Å
445	L	79.5	Confident	78.5	Confident	25 Å²	25	69.8 Å²	69.8	13%	0.131	44%	0.435	C	S	.	.	S	Bend	trans	-58.1	-35.5	175.3	-177.4	66.7	0	0	0	112	E434 W438 N443 Y457	E434-L445 HydrophobicContact CB-CD2 3.79Å; W438-L445 HydrophobicContact CB-CB 3.75Å; W438-L445 HydrophobicContact CB-CD2 4.3Å; W438-L445 HydrophobicContact CG-CB 3.96Å; W438-L445 HydrophobicContact CG-CD1 4.22Å; W438-L445 HydrophobicContact CG-CD2 4.21Å; W438-L445 HydrophobicContact CG-CG 4.37Å; N443-L445 PolarHBondContact O-N 2.83Å; L445-Y457 HydrophobicContact CD1-CE1 4.18Å; L445-Y457 HydrophobicContact CD1-CE2 3.91Å; L445-Y457 WeakPolarHBondContact CD1-OH 3.42Å; L445-Y457 HydrophobicContact CD2-CD1 4.3Å; L445-Y457 HydrophobicContact CD2-CD2 3.82Å; L445-Y457 HydrophobicContact CD2-CE1 4.26Å; L445-Y457 HydrophobicContact CD2-CE2 3.8Å; L445-Y457 HydrophobicContact CD2-CG 4.08Å; L445-Y457 HydrophobicContact CG-CD2 4.16Å; L445-Y457 HydrophobicContact CG-CE2 3.66Å
446	C	81.9	Confident	78.6	Confident	8 Å²	8	71.4 Å²	71.4	5%	0.054	45%	0.446	C	S	.	.	S	Bend	trans	-130.4	138	178.6	-62.5	0	0	0	0	108.4	D444 G448 C450 C459	D444-C446 PolarHBondContact O-N 2.86Å; C446-G448 PolarHBondContact O-N 2.91Å; C446-C450 HydrophobicContact CB-CB 4.46Å; C446-C459 VanDerWaalsContact CA-SG 3.52Å; C446-C459 HydrophobicContact CB-CB 3.57Å; C446-C459 WeakPolarHBondContact CB-SG 3.37Å; C446-C459 WeakPolarHBondContact SG-CA 3.09Å; C446-C459 WeakPolarHBondContact SG-CB 3.43Å; C446-C459 CovalentContact SG-SG 2.03Å; C446-C459 PolarHBondContact SG-SG 3.1Å
447	M	77.2	Confident	78.8	Confident	89 Å²	89	69.3 Å²	69.3	44%	0.438	43%	0.426	S	S	.	.	S	Bend	trans	-65.5	-23	173.4	-166.3	177.1	-149.8	0	0	112.4	R472 C474 F644	M447-R472 PolarHBondContact N-O 3Å; M447-C474 HydrophobicContact CB-CB 4.43Å; M447-C474 HydrophobicContact CG-CB 4.45Å; M447-C474 HydrophobicContact SD-CB 4.02Å; M447-C474 PolarHBondContact SD-N 2.76Å; M447-C474 VanDerWaalsContact SD-O 3.42Å; M447-F644 HydrophobicContact CE-CD1 3.84Å; M447-F644 HydrophobicContact CE-CE1 3.47Å; M447-F644 VanDerWaalsContact CE-CE1 3.47Å; M447-F644 HydrophobicContact CE-CZ 4.17Å; M447-F644 HydrophobicContact SD-CE1 4.35Å
448	G	78.2	Confident	79.2	Confident	28 Å²	28	69.4 Å²	69.4	29%	0.289	43%	0.427	S	S	.	.	S	Bend	trans	-113.5	-135.6	175.9	0	0	0	0	0	113	C446 Q460	C446-G448 PolarHBondContact O-N 2.91Å; G448-Q460 CarbonylContact C-O 3.58Å; G448-Q460 WeakPolarHBondContact CA-O 3.4Å
449	G	84.2	Confident	79.7	Confident	37 Å²	37	64.8 Å²	64.8	38%	0.381	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	150.1	174.3	0	0	0	0	0	112.3	C459 Q460	G449-C459 CarbonylContact O-C 3.52Å; G449-C459 WeakPolarHBondContact O-CA 3.1Å; G449-Q460 PolarHBondContact N-O 2.71Å; G449-Q460 PolarHBondContact O-N 2.94Å
450	C	89.6	Confident	80.4	Confident	45 Å²	45	66.9 Å²	66.9	30%	0.304	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	135.9	171.1	-173.4	0	0	0	0	109.8	C435 C446	C435-C450 WeakPolarHBondContact CA-SG 3.2Å; C435-C450 HydrophobicContact CB-CB 3.73Å; C435-C450 WeakPolarHBondContact CB-SG 3.17Å; C435-C450 WeakPolarHBondContact SG-CB 3.49Å; C435-C450 CovalentContact SG-SG 2.03Å; C435-C450 PolarHBondContact SG-SG 3.08Å; C446-C450 HydrophobicContact CB-CB 4.46Å
451	I	91.4	Very high	81.8	Confident	81 Å²	81	64.1 Å²	64.1	42%	0.415	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	115.9	175	-53.5	178.4	0	0	0	108.1	C435 Y457 L458 Q460	C435-I451 PolarHBondContact SG-N 2.85Å; C435-I451 VanDerWaalsContact SG-N 3.37Å; I451-Y457 WeakPolarHBondContact O-CA 3.22Å; I451-L458 PolarHBondContact N-O 2.82Å; I451-L458 PolarHBondContact O-N 2.83Å; I451-Q460 HydrophobicContact CD1-CB 4.21Å
452	N	92.7	Very high	83.1	Confident	50 Å²	50	63.2 Å²	63.2	27%	0.267	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	140.3	177.3	-172.9	37.1	0	0	0	110.6	D431 D433 E434 C435 S456	D431-N452 PolarHBondContact OD2-ND2 3.23Å; D433-N452 WeakPolarHBondContact OD1-CB 3.39Å; E434-N452 PolarHBondContact OE2-OD1 2.73Å; C435-N452 HydrophobicContact CB-CB 4.44Å; C435-N452 PolarHBondContact SG-N 3.07Å; N452-S456 PolarHBondContact OD1-O 3.06Å
453	T	92.4	Very high	84.6	Confident	48 Å²	48	64.3 Å²	64.3	29%	0.294	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	158	178.2	62.2	0	0	0	0	109.7	G455 S456 Y457 L458	T453-G455 PolarHBondContact O-N 2.97Å; T453-S456 CarbonylContact C-O 3.58Å; T453-S456 VanDerWaalsContact C-O 3.26Å; T453-S456 WeakPolarHBondContact CA-O 3.46Å; T453-S456 PolarHBondContact N-O 3.49Å; T453-S456 CarbonylContact O-C 3.42Å; T453-S456 PolarHBondContact O-N 3.41Å; T453-S456 VanDerWaalsContact O-N 3.12Å; T453-S456 PolarHBondContact OG1-O 2.92Å; T453-Y457 PolarHBondContact OG1-N 2.89Å; T453-L458 HydrophobicContact CG2-CD1 4.06Å; T453-L458 HydrophobicContact CG2-CG 4.15Å
454	K	91.1	Very high	85.9	Confident	189 Å²	189	59.7 Å²	59.7	82%	0.822	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	116.9	179.9	-73.1	-167.2	174.1	-167.8	0	111.6	F420 D431 S456	F420-K454 HydrophobicContact CZ-CB 4.28Å; D431-K454 WeakPolarHBondContact OD1-CA 3.45Å; K454-S456 VanDerWaalsContact C-N 3.35Å
455	G	87.2	Confident	87	Confident	19 Å²	19	54.4 Å²	54.4	20%	0.196	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.6	3.6	179.7	0	0	0	0	0	114.9	D431 T453	D431-G455 PolarHBondContact OD1-N 3.08Å; T453-G455 PolarHBondContact O-N 2.97Å
456	S	90.9	Very high	87.5	Confident	57 Å²	57	59 Å²	59	40%	0.399	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.5	-168.3	-178.3	-154.2	0	0	0	0	112.9	N452 T453 K454	N452-S456 PolarHBondContact OD1-O 3.06Å; T453-S456 CarbonylContact C-O 3.58Å; T453-S456 VanDerWaalsContact C-O 3.26Å; T453-S456 WeakPolarHBondContact CA-O 3.46Å; T453-S456 PolarHBondContact N-O 3.49Å; T453-S456 CarbonylContact O-C 3.42Å; T453-S456 PolarHBondContact O-N 3.41Å; T453-S456 VanDerWaalsContact O-N 3.12Å; T453-S456 PolarHBondContact OG1-O 2.92Å; K454-S456 VanDerWaalsContact C-N 3.35Å
457	Y	91.6	Very high	87.9	Confident	37 Å²	37	62.4 Å²	62.4	15%	0.145	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	163.3	174.4	62	-81.7	0	0	0	111.1	E434 L445 I451 T453 R472	E434-Y457 HydrophobicContact CB-CD1 3.75Å; E434-Y457 HydrophobicContact CB-CE1 4.26Å; E434-Y457 HydrophobicContact CB-CG 4.28Å; E434-Y457 HydrophobicContact CG-CD1 3.78Å; E434-Y457 HydrophobicContact CG-CE1 4.21Å; L445-Y457 HydrophobicContact CD1-CE1 4.18Å; L445-Y457 HydrophobicContact CD1-CE2 3.91Å; L445-Y457 WeakPolarHBondContact CD1-OH 3.42Å; L445-Y457 HydrophobicContact CD2-CD1 4.3Å; L445-Y457 HydrophobicContact CD2-CD2 3.82Å; L445-Y457 HydrophobicContact CD2-CE1 4.26Å; L445-Y457 HydrophobicContact CD2-CE2 3.8Å; L445-Y457 HydrophobicContact CD2-CG 4.08Å; L445-Y457 HydrophobicContact CG-CD2 4.16Å; L445-Y457 HydrophobicContact CG-CE2 3.66Å; I451-Y457 WeakPolarHBondContact O-CA 3.22Å; T453-Y457 PolarHBondContact OG1-N 2.89Å; Y457-R472 PolarHBondContact OH-NE 3.43Å; Y457-R472 PolarHBondContact OH-NH2 1.99Å
458	L	90.3	Very high	88.3	Confident	109 Å²	109	62.1 Å²	62.1	57%	0.571	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.3	133.1	173	-67.5	173.1	0	0	0	110	I451 T453	I451-L458 PolarHBondContact N-O 2.82Å; I451-L458 PolarHBondContact O-N 2.83Å; T453-L458 HydrophobicContact CG2-CD1 4.06Å; T453-L458 HydrophobicContact CG2-CG 4.15Å
459	C	90.4	Very high	88.7	Confident	13 Å²	13	67.5 Å²	67.5	9%	0.088	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	139.5	168.4	-59.1	0	0	0	0	110.1	C446 G449 I467 G471	C446-C459 VanDerWaalsContact CA-SG 3.52Å; C446-C459 HydrophobicContact CB-CB 3.57Å; C446-C459 WeakPolarHBondContact CB-SG 3.37Å; C446-C459 WeakPolarHBondContact SG-CA 3.09Å; C446-C459 WeakPolarHBondContact SG-CB 3.43Å; C446-C459 CovalentContact SG-SG 2.03Å; C446-C459 PolarHBondContact SG-SG 3.1Å; G449-C459 CarbonylContact O-C 3.52Å; G449-C459 WeakPolarHBondContact O-CA 3.1Å; C459-I467 HydrophobicContact CB-CD1 4.05Å; C459-I467 WeakPolarHBondContact O-CD1 3.49Å; C459-G471 VanDerWaalsContact CB-O 3.31Å; C459-G471 WeakPolarHBondContact CB-O 3.42Å; C459-G471 PolarHBondContact SG-O 2.91Å
460	Q	89.3	Confident	88.6	Confident	119 Å²	119	69.7 Å²	69.7	56%	0.556	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.5	124.2	176	-173.3	176.2	22.8	0	0	110	G448 G449 I451	G448-Q460 CarbonylContact C-O 3.58Å; G448-Q460 WeakPolarHBondContact CA-O 3.4Å; G449-Q460 PolarHBondContact N-O 2.71Å; G449-Q460 PolarHBondContact O-N 2.94Å; I451-Q460 HydrophobicContact CD1-CB 4.21Å
461	C	88.4	Confident	88.4	Confident	21 Å²	21	69.2 Å²	69.2	14%	0.142	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-75.8	147.5	175.6	-67.2	0	0	0	0	112	I467 C474	C461-I467 VanDerWaalsContact SG-CA 3.56Å; C461-C474 WeakPolarHBondContact CA-SG 3.42Å; C461-C474 HydrophobicContact CB-CB 3.91Å; C461-C474 WeakPolarHBondContact CB-SG 3.04Å; C461-C474 WeakPolarHBondContact SG-CA 3.47Å; C461-C474 WeakPolarHBondContact SG-CB 3.05Å; C461-C474 CovalentContact SG-SG 2.05Å; C461-C474 PolarHBondContact SG-SG 3.44Å
462	P	84.3	Confident	88.1	Confident	39 Å²	39	71.5 Å²	71.5	25%	0.253	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-59.2	160.4	170.2	-19.3	31.3	0	0	0	111.8	G464 Y465 Y642	P462-G464 PolarHBondContact O-N 3.22Å; P462-Y465 HydrophobicContact CB-CD2 4.09Å; P462-Y465 HydrophobicContact CG-CD2 4.46Å; P462-Y465 WeakPolarHBondContact O-CB 3.39Å; P462-Y465 PolarHBondContact O-N 3.33Å; P462-Y465 VanDerWaalsContact O-N 3.14Å; P462-Y642 HydrophobicContact CB-CD1 4.04Å; P462-Y642 HydrophobicContact CB-CE1 4.29Å; P462-Y642 HydrophobicContact CB-CG 4.27Å
463	P	85.4	Confident	87.7	Confident	88 Å²	88	71.1 Å²	71.1	57%	0.571	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	140.3	170.8	-23.5	34	0	0	0	111.9	Y465 Y642	P463-Y465 VanDerWaalsContact C-N 3.32Å; P463-Y642 WeakPolarHBondContact O-CE2 3.32Å
464	G	83.7	Confident	87.3	Confident	23 Å²	23	69.1 Å²	69.1	24%	0.237	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.4	-1.6	-174	0	0	0	0	0	114.2	P462 V477	P462-G464 PolarHBondContact O-N 3.22Å; G464-V477 WeakPolarHBondContact O-CB 3.28Å; G464-V477 PolarHBondContact O-N 3.47Å
465	Y	86.9	Confident	87.1	Confident	18 Å²	18	62.5 Å²	62.5	7%	0.071	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	149.9	178.4	-63.3	-92.2	0	0	0	111.5	P462 P463 C474 V475 D476 L496 G497 Y642 F644	P462-Y465 HydrophobicContact CB-CD2 4.09Å; P462-Y465 HydrophobicContact CG-CD2 4.46Å; P462-Y465 WeakPolarHBondContact O-CB 3.39Å; P462-Y465 PolarHBondContact O-N 3.33Å; P462-Y465 VanDerWaalsContact O-N 3.14Å; P463-Y465 VanDerWaalsContact C-N 3.32Å; Y465-C474 HydrophobicContact CD1-CB 4.47Å; Y465-V475 WeakPolarHBondContact CA-O 3.38Å; Y465-D476 VanDerWaalsContact CD1-CA 3.49Å; Y465-D476 HydrophobicContact CD1-CB 4.17Å; Y465-D476 HydrophobicContact CE1-CB 3.86Å; Y465-L496 WeakPolarHBondContact OH-CB 3.41Å; Y465-L496 PolarHBondContact OH-O 3.25Å; Y465-G497 VanDerWaalsContact CZ-N 3.26Å; Y465-G497 WeakPolarHBondContact OH-CA 3.41Å; Y465-G497 PolarHBondContact OH-N 2.97Å; Y465-Y642 HydrophobicContact CE2-CD2 4.12Å; Y465-Y642 HydrophobicContact CE2-CG 4.45Å; Y465-F644 AromaticContact CD1-CE2 3.93Å; Y465-F644 HydrophobicContact CD1-CE2 3.93Å; Y465-F644 AromaticContact CD1-CZ 3.91Å; Y465-F644 HydrophobicContact CD1-CZ 3.91Å; Y465-F644 HydrophobicContact CE1-CD2 4.27Å; Y465-F644 AromaticContact CE1-CE2 3.09Å; Y465-F644 HydrophobicContact CE1-CE2 3.09Å; Y465-F644 AromaticContact CE1-CZ 3.33Å; Y465-F644 HydrophobicContact CE1-CZ 3.33Å; Y465-F644 HydrophobicContact CE2-CE2 4.25Å; Y465-F644 AromaticContact CZ-CE2 3.28Å; Y465-F644 WeakPolarHBondContact OH-CE2 3.21Å
466	K	89.5	Confident	87	Confident	122 Å²	122	62.8 Å²	62.8	53%	0.53	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	148.4	172.6	69.5	-173.7	177	-170.8	0	110.6	V475 V477	K466-V475 HydrophobicContact CG-CG1 3.72Å; K466-V475 PolarHBondContact N-O 3.25Å; K466-V475 VanDerWaalsContact O-CG1 3.32Å; K466-V475 WeakPolarHBondContact O-CG1 3.35Å; K466-V475 PolarHBondContact O-N 3.4Å; K466-V477 HydrophobicContact CB-CG2 4Å; K466-V477 HydrophobicContact CD-CG2 4.34Å; K466-V477 HydrophobicContact CG-CG2 4.18Å
467	I	90.4	Very high	86.8	Confident	78 Å²	78	61.5 Å²	61.5	40%	0.4	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	137.8	178.6	-159.8	155.3	0	0	0	110.6	C459 C461	C459-I467 HydrophobicContact CB-CD1 4.05Å; C459-I467 WeakPolarHBondContact O-CD1 3.49Å; C461-I467 VanDerWaalsContact SG-CA 3.56Å
468	Q	87.3	Confident	86.2	Confident	84 Å²	84	63 Å²	63	39%	0.393	35%	0.347	S	S	.	.			trans	-75.8	165.7	173.6	-70.7	-159.6	60.5	0	0	111.5	D470 G471 T473 V475	Q468-D470 WeakPolarHBondContact CB-OD1 3.25Å; Q468-D470 PolarHBondContact O-N 3.39Å; Q468-D470 VanDerWaalsContact O-N 3.09Å; Q468-G471 PolarHBondContact O-N 3.17Å; Q468-T473 VanDerWaalsContact CB-OG1 3.28Å; Q468-T473 WeakPolarHBondContact CB-OG1 3.39Å; Q468-T473 WeakPolarHBondContact CG-OG1 3.43Å; Q468-T473 PolarHBondContact N-O 2.89Å; Q468-T473 PolarHBondContact NE2-OG1 3.19Å; Q468-V475 HydrophobicContact CG-CB 4.13Å; Q468-V475 HydrophobicContact CG-CG1 3.41Å; Q468-V475 VanDerWaalsContact CG-CG1 3.41Å
469	P	86.5	Confident	86	Confident	140 Å²	140	58.8 Å²	58.8	91%	0.909	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-18.9	176.2	-25.1	35.4	0	0	0	114.6	G471	P469-G471 PolarHBondContact O-N 2.86Å
470	D	81.7	Confident	85.2	Confident	84 Å²	84	59.7 Å²	59.7	45%	0.449	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-10.2	174.2	69.3	3.5	0	0	0	113.5	Q468 R472 T473	Q468-D470 WeakPolarHBondContact CB-OD1 3.25Å; Q468-D470 PolarHBondContact O-N 3.39Å; Q468-D470 VanDerWaalsContact O-N 3.09Å; D470-R472 PolarHBondContact O-N 3.43Å; D470-R472 PolarHBondContact OD1-N 3.18Å; D470-T473 PolarHBondContact OD1-N 3.22Å; D470-T473 PolarHBondContact OD1-OG1 3.26Å; D470-T473 VanDerWaalsContact OD1-OG1 3.11Å; D470-T473 WeakPolarHBondContact OD2-CB 3.34Å; D470-T473 WeakPolarHBondContact OD2-CG2 3.49Å; D470-T473 PolarHBondContact OD2-OG1 2.98Å
471	G	85	Confident	84.6	Confident	34 Å²	34	57.8 Å²	57.8	35%	0.351	34%	0.336	S	S	.	.	S	Bend	trans	68.1	12.7	179.4	0	0	0	0	0	114.5	C459 Q468 P469	C459-G471 VanDerWaalsContact CB-O 3.31Å; C459-G471 WeakPolarHBondContact CB-O 3.42Å; C459-G471 PolarHBondContact SG-O 2.91Å; Q468-G471 PolarHBondContact O-N 3.17Å; P469-G471 PolarHBondContact O-N 2.86Å
472	R	84.6	Confident	84.2	Confident	129 Å²	129	62.6 Å²	62.6	49%	0.487	36%	0.357	S	S	.	.	S	Bend	trans	-134.3	-35.3	-174.3	-66.4	-174.1	-177	168.8	5.2	114.2	M447 Y457 D470	M447-R472 PolarHBondContact N-O 3Å; Y457-R472 PolarHBondContact OH-NE 3.43Å; Y457-R472 PolarHBondContact OH-NH2 1.99Å; D470-R472 PolarHBondContact O-N 3.43Å; D470-R472 PolarHBondContact OD1-N 3.18Å
473	T	84.1	Confident	83.7	Confident	42 Å²	42	63.3 Å²	63.3	26%	0.258	37%	0.372	S	S	.	.			trans	-95.5	149.2	-177.3	60.8	0	0	0	0	111.4	Q468 D470	Q468-T473 VanDerWaalsContact CB-OG1 3.28Å; Q468-T473 WeakPolarHBondContact CB-OG1 3.39Å; Q468-T473 WeakPolarHBondContact CG-OG1 3.43Å; Q468-T473 PolarHBondContact N-O 2.89Å; Q468-T473 PolarHBondContact NE2-OG1 3.19Å; D470-T473 PolarHBondContact OD1-N 3.22Å; D470-T473 PolarHBondContact OD1-OG1 3.26Å; D470-T473 VanDerWaalsContact OD1-OG1 3.11Å; D470-T473 WeakPolarHBondContact OD2-CB 3.34Å; D470-T473 WeakPolarHBondContact OD2-CG2 3.49Å; D470-T473 PolarHBondContact OD2-OG1 2.98Å
474	C	85.4	Confident	83.3	Confident	7 Å²	7	64.3 Å²	64.3	5%	0.047	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	133.4	-179.7	-64.1	0	0	0	0	109.5	M447 C461 Y465	M447-C474 HydrophobicContact CB-CB 4.43Å; M447-C474 HydrophobicContact CG-CB 4.45Å; M447-C474 HydrophobicContact SD-CB 4.02Å; M447-C474 PolarHBondContact SD-N 2.76Å; M447-C474 VanDerWaalsContact SD-O 3.42Å; C461-C474 WeakPolarHBondContact CA-SG 3.42Å; C461-C474 HydrophobicContact CB-CB 3.91Å; C461-C474 WeakPolarHBondContact CB-SG 3.04Å; C461-C474 WeakPolarHBondContact SG-CA 3.47Å; C461-C474 WeakPolarHBondContact SG-CB 3.05Å; C461-C474 CovalentContact SG-SG 2.05Å; C461-C474 PolarHBondContact SG-SG 3.44Å; Y465-C474 HydrophobicContact CD1-CB 4.47Å
475	V	86.1	Confident	82.8	Confident	50 Å²	50	64.4 Å²	64.4	30%	0.303	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	136.2	176.9	39.2	0	0	0	0	108.1	Y465 K466 Q468	Y465-V475 WeakPolarHBondContact CA-O 3.38Å; K466-V475 HydrophobicContact CG-CG1 3.72Å; K466-V475 PolarHBondContact N-O 3.25Å; K466-V475 VanDerWaalsContact O-CG1 3.32Å; K466-V475 WeakPolarHBondContact O-CG1 3.35Å; K466-V475 PolarHBondContact O-N 3.4Å; Q468-V475 HydrophobicContact CG-CB 4.13Å; Q468-V475 HydrophobicContact CG-CG1 3.41Å; Q468-V475 VanDerWaalsContact CG-CG1 3.41Å
476	D	84.5	Confident	81.7	Confident	25 Å²	25	67.4 Å²	67.4	13%	0.134	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	139.9	177.5	-175.4	54.6	0	0	0	111.2	Y465 N494 L496 G497	Y465-D476 VanDerWaalsContact CD1-CA 3.49Å; Y465-D476 HydrophobicContact CD1-CB 4.17Å; Y465-D476 HydrophobicContact CE1-CB 3.86Å; D476-N494 PolarHBondContact OD2-ND2 3Å; D476-L496 HydrophobicContact CB-CD2 3.95Å; D476-G497 WeakPolarHBondContact OD1-CA 3.48Å; D476-G497 PolarHBondContact OD1-N 3.22Å
477	V	87	Confident	80.1	Confident	30 Å²	30	64 Å²	64	18%	0.182	39%	0.394	C	S	.	.			trans	-88.8	113.2	174	178.1	0	0	0	0	107.5	G464 K466 E479 M482	G464-V477 WeakPolarHBondContact O-CB 3.28Å; G464-V477 PolarHBondContact O-N 3.47Å; K466-V477 HydrophobicContact CB-CG2 4Å; K466-V477 HydrophobicContact CD-CG2 4.34Å; K466-V477 HydrophobicContact CG-CG2 4.18Å; V477-E479 HydrophobicContact CG1-CG 4.28Å; V477-E479 PolarHBondContact O-N 3.49Å; V477-M482 HydrophobicContact CG1-SD 3.55Å; V477-M482 VanDerWaalsContact CG1-SD 3.55Å
478	D	79.6	Confident	78.5	Confident	67 Å²	67	65.8 Å²	65.8	36%	0.358	41%	0.413	S	S	.	.			trans	-72.3	90.5	174.8	-174.4	-14.6	0	0	0	110.6	C480 A481 M482	D478-C480 PolarHBondContact O-N 3.36Å; D478-C480 WeakPolarHBondContact OD1-CA 3.36Å; D478-C480 VanDerWaalsContact OD1-CB 3.26Å; D478-C480 WeakPolarHBondContact OD1-CB 3.28Å; D478-C480 PolarHBondContact OD1-N 2.79Å; D478-A481 HydrophobicContact CB-CB 3.98Å; D478-A481 VanDerWaalsContact CG-CB 3.49Å; D478-A481 PolarHBondContact O-N 2.8Å; D478-A481 PolarHBondContact OD1-N 3.13Å; D478-M482 WeakPolarHBondContact O-CG 3.47Å; D478-M482 PolarHBondContact O-N 3.45Å
479	E	84.9	Confident	77.1	Confident	22 Å²	22	67 Å²	67	10%	0.103	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-18.9	-179.4	-57.4	102.8	158.2	0	0	112.2	V477 M482 G483 E484 N494 F499	V477-E479 HydrophobicContact CG1-CG 4.28Å; V477-E479 PolarHBondContact O-N 3.49Å; E479-M482 PolarHBondContact O-N 2.04Å; E479-G483 PolarHBondContact O-N 3.2Å; E479-E484 HydrophobicContact CB-CB 4.38Å; E479-E484 HydrophobicContact CB-CG 4.03Å; E479-E484 PolarHBondContact O-N 3.47Å; E479-N494 PolarHBondContact OE2-OD1 3.37Å; E479-F499 HydrophobicContact CB-CB 3.9Å; E479-F499 HydrophobicContact CB-CD1 3.33Å; E479-F499 HydrophobicContact CB-CD2 4.38Å; E479-F499 HydrophobicContact CB-CE1 3.91Å; E479-F499 HydrophobicContact CB-CG 3.61Å; E479-F499 HydrophobicContact CG-CD1 3.54Å; E479-F499 HydrophobicContact CG-CE1 4.05Å; E479-F499 HydrophobicContact CG-CG 4.28Å; E479-F499 WeakPolarHBondContact OE2-CB 3.48Å; E479-F499 PolarHBondContact OE2-N 2.97Å
480	C	74.7	Confident	75.9	Confident	31 Å²	31	64.8 Å²	64.8	21%	0.209	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-42.2	172.4	-62.1	0	0	0	0	111.8	D478 M482 G483 C492 V493 N494	D478-C480 PolarHBondContact O-N 3.36Å; D478-C480 WeakPolarHBondContact OD1-CA 3.36Å; D478-C480 VanDerWaalsContact OD1-CB 3.26Å; D478-C480 WeakPolarHBondContact OD1-CB 3.28Å; D478-C480 PolarHBondContact OD1-N 2.79Å; C480-M482 PolarHBondContact O-N 3.11Å; C480-G483 PolarHBondContact O-N 2.98Å; C480-C492 WeakPolarHBondContact CA-SG 3.32Å; C480-C492 HydrophobicContact CB-CB 3.63Å; C480-C492 WeakPolarHBondContact CB-SG 3.36Å; C480-C492 WeakPolarHBondContact SG-CB 2.87Å; C480-C492 CovalentContact SG-SG 2.02Å; C480-C492 PolarHBondContact SG-SG 3.33Å; C480-V493 PolarHBondContact SG-N 3.24Å; C480-N494 HydrophobicContact CB-CB 4.44Å; C480-N494 PolarHBondContact SG-N 2.72Å
481	A	75.9	Confident	75.3	Confident	80 Å²	80	62.7 Å²	62.7	66%	0.661	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-26.5	171.9	0	0	0	0	0	112.2	D478 G483	D478-A481 HydrophobicContact CB-CB 3.98Å; D478-A481 VanDerWaalsContact CG-CB 3.49Å; D478-A481 PolarHBondContact O-N 2.8Å; D478-A481 PolarHBondContact OD1-N 3.13Å; A481-G483 VanDerWaalsContact C-N 3.3Å
482	M	80.1	Confident	74.5	Confident	122 Å²	122	62.8 Å²	62.8	60%	0.601	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-9.5	174	-65	-179.3	60	0	0	113.7	V477 D478 E479 C480 E484	V477-M482 HydrophobicContact CG1-SD 3.55Å; V477-M482 VanDerWaalsContact CG1-SD 3.55Å; D478-M482 WeakPolarHBondContact O-CG 3.47Å; D478-M482 PolarHBondContact O-N 3.45Å; E479-M482 PolarHBondContact O-N 2.04Å; C480-M482 PolarHBondContact O-N 3.11Å; M482-E484 HydrophobicContact CB-CG 4.44Å
483	G	74.4	Confident	73.9	Confident	54 Å²	54	56.8 Å²	56.8	56%	0.557	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.1	23.9	174.5	0	0	0	0	0	114.8	E479 C480 A481 C485	E479-G483 PolarHBondContact O-N 3.2Å; C480-G483 PolarHBondContact O-N 2.98Å; A481-G483 VanDerWaalsContact C-N 3.3Å; G483-C485 PolarHBondContact O-N 2.83Å
484	E	77.9	Confident	73	Confident	109 Å²	109	55.7 Å²	55.7	51%	0.509	35%	0.354	S	S	.	.			trans	-66	-16.8	-175.7	-68.6	-66.7	153.7	0	0	114	E479 M482 F499	E479-E484 HydrophobicContact CB-CB 4.38Å; E479-E484 HydrophobicContact CB-CG 4.03Å; E479-E484 PolarHBondContact O-N 3.47Å; M482-E484 HydrophobicContact CB-CG 4.44Å; E484-F499 HydrophobicContact CB-CD2 4.23Å; E484-F499 HydrophobicContact CB-CE1 4.24Å; E484-F499 HydrophobicContact CB-CE2 3.55Å; E484-F499 HydrophobicContact CB-CZ 3.55Å; E484-F499 HydrophobicContact CG-CZ 4.21Å
485	C	72.1	Confident	72.4	Confident	24 Å²	24	55.9 Å²	55.9	16%	0.162	35%	0.354	C	S	.	.			trans	-94.2	102.4	173.4	-63.4	0	0	0	0	112.5	G483 C492 C501	G483-C485 PolarHBondContact O-N 2.83Å; C485-C492 HydrophobicContact CB-CB 3.84Å; C485-C492 WeakPolarHBondContact SG-CB 3.48Å; C485-C492 PolarHBondContact SG-SG 2.89Å; C485-C501 VanDerWaalsContact CA-SG 3.53Å; C485-C501 HydrophobicContact CB-CB 3.95Å; C485-C501 WeakPolarHBondContact CB-SG 3.34Å; C485-C501 WeakPolarHBondContact SG-CA 3.47Å; C485-C501 WeakPolarHBondContact SG-CB 3.47Å; C485-C501 CovalentContact SG-SG 2.03Å; C485-C501 PolarHBondContact SG-SG 2.93Å
486	A	63	Low	71.9	Confident	81 Å²	81	55.9 Å²	55.9	67%	0.669	35%	0.353	S	S	*	.			trans	-90.2	123.4	174.7	0	0	0	0	0	113.2	K490	A486-K490 WeakPolarHBondContact O-CD 2.72Å; A486-K490 PolarHBondContact O-NZ 3.37Å
487	G	57.5	Low	71.5	Confident	51 Å²	51	55.1 Å²	55.1	53%	0.526	35%	0.35	S	S	.	.	S	Bend	trans	145	145.8	171.6	0	0	0	0	0	113.7	D489	G487-D489 VanDerWaalsContact C-N 3.25Å; G487-D489 PolarHBondContact O-N 2.88Å
488	S	56.4	Low	71.2	Confident	115 Å²	115	56.5 Å²	56.5	80%	0.804	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-23.6	179.9	55.3	0	0	0	0	114.1
489	D	57.3	Low	71	Confident	109 Å²	109	56.3 Å²	56.3	58%	0.583	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.5	19.2	-172.2	-49.3	-21	0	0	0	111.1	G487 S503 I504	G487-D489 VanDerWaalsContact C-N 3.25Å; G487-D489 PolarHBondContact O-N 2.88Å; D489-S503 CarbonylContact O-C 3.48Å; D489-S503 WeakPolarHBondContact O-CA 3.43Å; D489-I504 PolarHBondContact O-N 3.49Å
490	K	62.3	Low	70.5	Confident	95 Å²	95	58.3 Å²	58.3	41%	0.413	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	131.9	-179.5	-63.9	-174.4	-170.6	164	0	111.3	A486 H502	A486-K490 WeakPolarHBondContact O-CD 2.72Å; A486-K490 PolarHBondContact O-NZ 3.37Å; K490-H502 CarbonylContact C-O 3.6Å; K490-H502 WeakPolarHBondContact CA-O 3.46Å
491	V	67.8	Low	70.4	Confident	40 Å²	40	59.5 Å²	59.5	24%	0.242	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	124.5	168.5	171.6	0	0	0	0	108.2	V493 H502 I504 Y524	V491-V493 HydrophobicContact CG1-CG2 4.17Å; V491-H502 PolarHBondContact N-O 2.86Å; V491-H502 PolarHBondContact O-N 3.02Å; V491-I504 HydrophobicContact CB-CD1 4.43Å; V491-I504 HydrophobicContact CB-CG1 4.27Å; V491-I504 HydrophobicContact CG2-CD1 3.23Å; V491-I504 HydrophobicContact CG2-CG1 3.54Å; V491-Y524 HydrophobicContact CG1-CD1 4.17Å
492	C	68.8	Low	69.9	Low	35 Å²	35	57 Å²	57	24%	0.236	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	132	168.2	-167.3	0	0	0	0	109.3	C480 C485	C480-C492 WeakPolarHBondContact CA-SG 3.32Å; C480-C492 HydrophobicContact CB-CB 3.63Å; C480-C492 WeakPolarHBondContact CB-SG 3.36Å; C480-C492 WeakPolarHBondContact SG-CB 2.87Å; C480-C492 CovalentContact SG-SG 2.02Å; C480-C492 PolarHBondContact SG-SG 3.33Å; C485-C492 HydrophobicContact CB-CB 3.84Å; C485-C492 WeakPolarHBondContact SG-CB 3.48Å; C485-C492 PolarHBondContact SG-SG 2.89Å
493	V	71.4	Confident	69.1	Low	3 Å²	3	54.6 Å²	54.6	2%	0.018	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	120.8	167.2	-175.4	0	0	0	0	108.1	C480 V491 F499 K500 Y524 F549	C480-V493 PolarHBondContact SG-N 3.24Å; V491-V493 HydrophobicContact CG1-CG2 4.17Å; V493-F499 WeakPolarHBondContact O-CA 3.28Å; V493-K500 PolarHBondContact N-O 2.88Å; V493-K500 PolarHBondContact O-N 2.85Å; V493-Y524 HydrophobicContact CG2-CD1 4.23Å; V493-F549 HydrophobicContact CB-CD1 4.16Å; V493-F549 HydrophobicContact CB-CE1 4.03Å; V493-F549 HydrophobicContact CG1-CD1 3.72Å; V493-F549 HydrophobicContact CG1-CE1 3.65Å; V493-F549 HydrophobicContact CG2-CD1 4.04Å; V493-F549 HydrophobicContact CG2-CE1 4.35Å
494	N	66.4	Low	68	Low	20 Å²	20	54 Å²	54	11%	0.107	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	139.6	175.1	-169.7	45.3	0	0	0	108.7	D476 E479 C480	D476-N494 PolarHBondContact OD2-ND2 3Å; E479-N494 PolarHBondContact OE2-OD1 3.37Å; C480-N494 HydrophobicContact CB-CB 4.44Å; C480-N494 PolarHBondContact SG-N 2.72Å
495	T	71.6	Confident	66.8	Low	10 Å²	10	55.5 Å²	55.5	6%	0.061	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	154.7	177.7	67.7	0	0	0	0	108.9	G497 S498 A551	T495-G497 PolarHBondContact O-N 3.24Å; T495-S498 CarbonylContact C-O 3.52Å; T495-S498 VanDerWaalsContact C-O 3.25Å; T495-S498 VanDerWaalsContact CA-O 3.25Å; T495-S498 WeakPolarHBondContact CA-O 3.41Å; T495-S498 WeakPolarHBondContact CB-O 3.11Å; T495-S498 PolarHBondContact N-O 2.91Å; T495-S498 CarbonylContact O-C 3.55Å; T495-S498 PolarHBondContact O-N 3.2Å; T495-S498 PolarHBondContact OG1-O 3.47Å; T495-A551 HydrophobicContact CG2-CB 3.96Å
496	L	75.6	Confident	65.6	Low	51 Å²	51	56.2 Å²	56.2	27%	0.267	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	110.2	179.3	-68.1	174	0	0	0	110.9	Y465 D476 P553 S640	Y465-L496 WeakPolarHBondContact OH-CB 3.41Å; Y465-L496 PolarHBondContact OH-O 3.25Å; D476-L496 HydrophobicContact CB-CD2 3.95Å; L496-P553 HydrophobicContact CD1-CB 3.54Å; L496-P553 HydrophobicContact CD1-CG 3.91Å; L496-S640 WeakPolarHBondContact O-CB 3.39Å
497	G	77	Confident	65.1	Low	8 Å²	8	55.9 Å²	55.9	8%	0.082	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.2	11.5	179.2	0	0	0	0	0	115.3	Y465 D476 T495	Y465-G497 VanDerWaalsContact CZ-N 3.26Å; Y465-G497 WeakPolarHBondContact OH-CA 3.41Å; Y465-G497 PolarHBondContact OH-N 2.97Å; D476-G497 WeakPolarHBondContact OD1-CA 3.48Å; D476-G497 PolarHBondContact OD1-N 3.22Å; T495-G497 PolarHBondContact O-N 3.24Å
498	S	80.2	Confident	64.8	Low	60 Å²	60	59.2 Å²	59.2	42%	0.42	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.4	-178	178.3	-155.2	0	0	0	0	112.3	T495	T495-S498 CarbonylContact C-O 3.52Å; T495-S498 VanDerWaalsContact C-O 3.25Å; T495-S498 VanDerWaalsContact CA-O 3.25Å; T495-S498 WeakPolarHBondContact CA-O 3.41Å; T495-S498 WeakPolarHBondContact CB-O 3.11Å; T495-S498 PolarHBondContact N-O 2.91Å; T495-S498 CarbonylContact O-C 3.55Å; T495-S498 PolarHBondContact O-N 3.2Å; T495-S498 PolarHBondContact OG1-O 3.47Å
499	F	76.4	Confident	64.3	Low	62 Å²	62	58.9 Å²	58.9	27%	0.272	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	159.7	172.7	64.3	-72.2	0	0	0	111.1	E479 E484 V493	E479-F499 HydrophobicContact CB-CB 3.9Å; E479-F499 HydrophobicContact CB-CD1 3.33Å; E479-F499 HydrophobicContact CB-CD2 4.38Å; E479-F499 HydrophobicContact CB-CE1 3.91Å; E479-F499 HydrophobicContact CB-CG 3.61Å; E479-F499 HydrophobicContact CG-CD1 3.54Å; E479-F499 HydrophobicContact CG-CE1 4.05Å; E479-F499 HydrophobicContact CG-CG 4.28Å; E479-F499 WeakPolarHBondContact OE2-CB 3.48Å; E479-F499 PolarHBondContact OE2-N 2.97Å; E484-F499 HydrophobicContact CB-CD2 4.23Å; E484-F499 HydrophobicContact CB-CE1 4.24Å; E484-F499 HydrophobicContact CB-CE2 3.55Å; E484-F499 HydrophobicContact CB-CZ 3.55Å; E484-F499 HydrophobicContact CG-CZ 4.21Å; V493-F499 WeakPolarHBondContact O-CA 3.28Å
500	K	73.6	Confident	63.8	Low	64 Å²	64	55.8 Å²	55.8	28%	0.278	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	128.6	171.1	-72.4	-173.3	175.4	169.8	0	110.9	V493 F549 S638	V493-K500 PolarHBondContact N-O 2.88Å; V493-K500 PolarHBondContact O-N 2.85Å; K500-F549 HydrophobicContact CD-CZ 4.09Å; K500-S638 PolarHBondContact NZ-OG 2.83Å
501	C	72.1	Confident	63.6	Low	56 Å²	56	57 Å²	57	38%	0.378	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	113.4	167.3	-51.1	0	0	0	0	108.7	C485	C485-C501 VanDerWaalsContact CA-SG 3.53Å; C485-C501 HydrophobicContact CB-CB 3.95Å; C485-C501 WeakPolarHBondContact CB-SG 3.34Å; C485-C501 WeakPolarHBondContact SG-CA 3.47Å; C485-C501 WeakPolarHBondContact SG-CB 3.47Å; C485-C501 CovalentContact SG-SG 2.03Å; C485-C501 PolarHBondContact SG-SG 2.93Å
502	H	65.9	Low	62.9	Low	29 Å²	29	59.8 Å²	59.8	13%	0.134	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	124.9	171	-66.3	-82.5	0	0	0	108.9	K490 V491 I504 Y524 F549	K490-H502 CarbonylContact C-O 3.6Å; K490-H502 WeakPolarHBondContact CA-O 3.46Å; V491-H502 PolarHBondContact N-O 2.86Å; V491-H502 PolarHBondContact O-N 3.02Å; H502-I504 PolarHBondContact O-N 3.44Å; H502-Y524 HydrophobicContact CB-CE1 4.01Å; H502-Y524 AromaticContact CG-CE1 3.92Å; H502-F549 AromaticContact CE1-CD2 3.79Å; H502-F549 AromaticContact CE1-CE2 3.43Å; H502-F549 VanDerWaalsContact CE1-CE2 3.43Å; H502-F549 WeakPolarHBondContact CE1-CE2 3.07Å; H502-F549 AromaticContact CE1-CZ 3.96Å; H502-F549 AromaticContact NE2-CD2 3.74Å; H502-F549 AromaticContact NE2-CE1 3.93Å; H502-F549 AromaticContact NE2-CE2 3.34Å; H502-F549 VanDerWaalsContact NE2-CE2 3.34Å; H502-F549 WeakPolarHBondContact NE2-CE2 3.41Å; H502-F549 AromaticContact NE2-CZ 3.43Å; H502-F549 WeakPolarHBondContact NE2-CZ 3.08Å
503	S	62.5	Low	62.1	Low	71 Å²	71	59.5 Å²	59.5	50%	0.497	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	125.9	161.2	-59.7	0	0	0	0	107.4	D489 D505	D489-S503 CarbonylContact O-C 3.48Å; D489-S503 WeakPolarHBondContact O-CA 3.43Å; S503-D505 PolarHBondContact O-N 2.88Å
504	I	52.9	Low	60.9	Low	40 Å²	40	63.4 Å²	63.4	21%	0.205	36%	0.358	C	S	.	.			trans	-79.6	82.6	173.2	-49.2	167.1	0	0	0	108.2	D489 V491 H502 C506 H512	D489-I504 PolarHBondContact O-N 3.49Å; V491-I504 HydrophobicContact CB-CD1 4.43Å; V491-I504 HydrophobicContact CB-CG1 4.27Å; V491-I504 HydrophobicContact CG2-CD1 3.23Å; V491-I504 HydrophobicContact CG2-CG1 3.54Å; H502-I504 PolarHBondContact O-N 3.44Å; I504-C506 PolarHBondContact O-N 3.13Å; I504-H512 VanDerWaalsContact CD1-CE1 3.48Å; I504-H512 WeakPolarHBondContact CD1-CE1 3.35Å; I504-H512 WeakPolarHBondContact CG2-CE1 3.32Å
505	D	51.8	Low	59.9	Low	141 Å²	141	70 Å²	70	75%	0.754	39%	0.392	S	S	*	.			trans	-92.4	87.2	157.9	-71.3	-43.4	0	0	0	107.1	S503	S503-D505 PolarHBondContact O-N 2.88Å
506	C	48.1	Very low	58.9	Low	39 Å²	39	74.1 Å²	74.1	26%	0.264	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-52.3	127.5	165.4	-81	0	0	0	0	107.5	I504	I504-C506 PolarHBondContact O-N 3.13Å
507	P	52.1	Low	57.2	Low	75 Å²	75	78.7 Å²	78.7	49%	0.487	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-55.5	156.4	174.6	-16	24.8	0	0	0	109.7	N509 Y510	P507-N509 PolarHBondContact O-N 3.11Å; P507-N509 VanDerWaalsContact O-N 3.1Å; P507-Y510 HydrophobicContact CB-CD2 3.57Å; P507-Y510 HydrophobicContact CB-CE2 3.61Å; P507-Y510 HydrophobicContact CB-CG 4.41Å; P507-Y510 HydrophobicContact CG-CD2 3.81Å; P507-Y510 HydrophobicContact CG-CE2 3.82Å; P507-Y510 HydrophobicContact CG-CG 4.23Å; P507-Y510 VanDerWaalsContact O-CD2 3.29Å; P507-Y510 WeakPolarHBondContact O-CD2 3.47Å; P507-Y510 PolarHBondContact O-N 2.7Å
508	T	49.7	Very low	55.4	Low	121 Å²	121	85.4 Å²	85.4	74%	0.742	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.1	123.5	-179.6	-38	0	0	0	0	110
509	N	47.2	Very low	53.5	Low	108 Å²	108	91.5 Å²	91.5	58%	0.578	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.2	15.2	-177.8	-46.5	-31.6	0	0	0	118	P507	P507-N509 PolarHBondContact O-N 3.11Å; P507-N509 VanDerWaalsContact O-N 3.1Å
510	Y	47.5	Very low	51.8	Low	43 Å²	43	92.3 Å²	92.3	17%	0.169	49%	0.494	C	S	.	.			trans	-97	143	170.2	-71.8	-113.6	0	0	0	110.9	P507 K528	P507-Y510 HydrophobicContact CB-CD2 3.57Å; P507-Y510 HydrophobicContact CB-CE2 3.61Å; P507-Y510 HydrophobicContact CB-CG 4.41Å; P507-Y510 HydrophobicContact CG-CD2 3.81Å; P507-Y510 HydrophobicContact CG-CE2 3.82Å; P507-Y510 HydrophobicContact CG-CG 4.23Å; P507-Y510 VanDerWaalsContact O-CD2 3.29Å; P507-Y510 WeakPolarHBondContact O-CD2 3.47Å; P507-Y510 PolarHBondContact O-N 2.7Å; Y510-K528 HydrophobicContact CD1-CB 3.42Å; Y510-K528 VanDerWaalsContact CD1-CB 3.42Å; Y510-K528 HydrophobicContact CD1-CD 4.5Å; Y510-K528 HydrophobicContact CD2-CB 4.16Å; Y510-K528 HydrophobicContact CD2-CD 3.82Å; Y510-K528 HydrophobicContact CD2-CG 4.46Å; Y510-K528 HydrophobicContact CE1-CB 3.29Å; Y510-K528 HydrophobicContact CE1-CD 4.03Å; Y510-K528 HydrophobicContact CE1-CG 4.28Å; Y510-K528 HydrophobicContact CE2-CB 4.1Å; Y510-K528 HydrophobicContact CE2-CD 3.31Å; Y510-K528 HydrophobicContact CE2-CG 4.27Å; Y510-K528 HydrophobicContact CG-CB 3.84Å; Y510-K528 HydrophobicContact CG-CD 4.39Å; Y510-K528 VanDerWaalsContact CZ-CD 3.4Å
511	I	56.8	Low	50.3	Low	120 Å²	120	92.9 Å²	92.9	62%	0.615	51%	0.511	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.1	150	176.1	57.4	169.2	0	0	0	111.2	D513 I527	I511-D513 PolarHBondContact O-N 3.25Å; I511-I527 PolarHBondContact N-O 3.31Å
512	H	53.2	Low	49.2	Very low	99 Å²	99	94.3 Å²	94.3	46%	0.458	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	129.2	172.7	-82.1	-73	0	0	0	111.2	I504 S514	I504-H512 VanDerWaalsContact CD1-CE1 3.48Å; I504-H512 WeakPolarHBondContact CD1-CE1 3.35Å; I504-H512 WeakPolarHBondContact CG2-CE1 3.32Å; H512-S514 PolarHBondContact O-N 3.02Å; H512-S514 VanDerWaalsContact O-N 3.13Å
513	D	52.8	Low	48.7	Very low	30 Å²	30	93.4 Å²	93.4	16%	0.16	51%	0.514	C	S	.	.			trans	-68.4	109.1	169.1	-180	5.6	0	0	0	109.7	I511 L515 N516 I527	I511-D513 PolarHBondContact O-N 3.25Å; D513-L515 VanDerWaalsContact C-N 3.3Å; D513-L515 PolarHBondContact O-N 3.3Å; D513-L515 WeakPolarHBondContact OD1-CB 3.34Å; D513-L515 PolarHBondContact OD1-N 3.18Å; D513-N516 PolarHBondContact OD2-ND2 2.03Å; D513-I527 HydrophobicContact CB-CD1 3.97Å; D513-I527 HydrophobicContact CB-CG1 4.27Å
514	S	46.2	Very low	48.5	Very low	85 Å²	85	92.1 Å²	92.1	59%	0.594	50%	0.498	S	S	*	.	S	Bend	trans	-76.1	-11.4	-179.5	44.9	0	0	0	0	114.6	H512	H512-S514 PolarHBondContact O-N 3.02Å; H512-S514 VanDerWaalsContact O-N 3.13Å
515	L	45.7	Very low	48.7	Very low	157 Å²	157	91.1 Å²	91.1	82%	0.822	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-20.9	-179.7	-73.3	160.3	0	0	0	113.1	D513	D513-L515 VanDerWaalsContact C-N 3.3Å; D513-L515 PolarHBondContact O-N 3.3Å; D513-L515 WeakPolarHBondContact OD1-CB 3.34Å; D513-L515 PolarHBondContact OD1-N 3.18Å
516	N	48.8	Very low	49.1	Very low	97 Å²	97	84.9 Å²	84.9	52%	0.519	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105	31.1	174.7	-76.6	-56	0	0	0	112.4	D513 N518	D513-N516 PolarHBondContact OD2-ND2 2.03Å; N516-N518 PolarHBondContact O-N 3.27Å
517	K	40.9	Very low	49.7	Very low	147 Å²	147	85.4 Å²	85.4	64%	0.639	46%	0.461	S	S	*	.			trans	-73.3	110.9	171.2	-78.3	-176.9	175	-177.1	0	109.4
518	N	39	Very low	49.9	Very low	149 Å²	149	82 Å²	82	80%	0.797	44%	0.439	S	S	*	.	S	Bend	trans	84.7	51.4	158.2	-56.2	-8.3	0	0	0	118.8	N516	N516-N518 PolarHBondContact O-N 3.27Å
519	Q	39.6	Very low	50.3	Low	189 Å²	189	81 Å²	81	88%	0.883	43%	0.432	S	S	*	.			trans	-170.9	83.5	150.6	-111.9	170.5	61.6	0	0	111.8
520	I	41.9	Very low	50.6	Low	78 Å²	78	77.1 Å²	77.1	40%	0.4	41%	0.414	S	S	.	.			trans	-142	110.5	155.4	-44	176.1	0	0	0	106.5	D522 G523	I520-D522 HydrophobicContact CG2-CB 4.43Å; I520-D522 PolarHBondContact O-N 3.04Å; I520-D522 VanDerWaalsContact O-N 3.09Å; I520-G523 WeakPolarHBondContact CB-O 3.09Å
521	A	42	Very low	50.9	Low	76 Å²	76	78 Å²	78	63%	0.628	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-13.4	173.8	0	0	0	0	0	112.5
522	D	49.5	Very low	50.7	Low	86 Å²	86	78.6 Å²	78.6	46%	0.46	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.9	26	-169.8	-52.7	-50.2	0	0	0	115	I520	I520-D522 HydrophobicContact CG2-CB 4.43Å; I520-D522 PolarHBondContact O-N 3.04Å; I520-D522 VanDerWaalsContact O-N 3.09Å
523	G	53.7	Low	50.7	Low	11 Å²	11	81.8 Å²	81.8	11%	0.113	45%	0.451	C	S	.	.			trans	152.1	179.7	166.5	0	0	0	0	0	118.1	I520 F549	I520-G523 WeakPolarHBondContact CB-O 3.09Å; G523-F549 WeakPolarHBondContact CA-O 3.46Å
524	Y	58.9	Low	50.9	Low	43 Å²	43	81.4 Å²	81.4	17%	0.169	45%	0.449	C	S	.	.			trans	-122.8	163.3	173.8	70	-85.9	0	0	0	111.8	V491 V493 H502 Y547 Q548 F549	V491-Y524 HydrophobicContact CG1-CD1 4.17Å; V493-Y524 HydrophobicContact CG2-CD1 4.23Å; H502-Y524 HydrophobicContact CB-CE1 4.01Å; H502-Y524 AromaticContact CG-CE1 3.92Å; Y524-Y547 HydrophobicContact CE2-CD1 4.08Å; Y524-Y547 AromaticContact CE2-CE1 3.97Å; Y524-Y547 HydrophobicContact CE2-CE1 3.97Å; Y524-Y547 AromaticContact CZ-CE1 3.87Å; Y524-Y547 WeakPolarHBondContact OH-CE1 3.34Å; Y524-Q548 WeakPolarHBondContact O-CA 3.31Å; Y524-F549 HydrophobicContact CD1-CB 4.08Å; Y524-F549 HydrophobicContact CE1-CB 3.91Å; Y524-F549 HydrophobicContact CE1-CG 4.45Å; Y524-F549 PolarHBondContact O-N 2.88Å
525	S	57.4	Low	51.3	Low	20 Å²	20	83.3 Å²	83.3	14%	0.14	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	131.4	-178.8	-174.9	0	0	0	0	112.3	L546 Y547	S525-L546 WeakPolarHBondContact OG-CD1 3.44Å; S525-Y547 CarbonylContact C-O 3.58Å; S525-Y547 WeakPolarHBondContact CA-O 3.2Å
526	C	60.1	Low	51.6	Low	9 Å²	9	82.9 Å²	82.9	6%	0.061	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	146.7	175.9	-64.9	0	0	0	0	110.9	Y547	C526-Y547 PolarHBondContact N-O 2.81Å; C526-Y547 PolarHBondContact O-N 2.81Å
527	I	59.8	Low	51.6	Low	50 Å²	50	79 Å²	79	26%	0.256	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	130.1	-178.7	-57.8	174.3	0	0	0	109.9	I511 D513 V545 L546	I511-I527 PolarHBondContact N-O 3.31Å; D513-I527 HydrophobicContact CB-CD1 3.97Å; D513-I527 HydrophobicContact CB-CG1 4.27Å; I527-V545 WeakPolarHBondContact CA-O 3.27Å; I527-L546 HydrophobicContact CG1-CD1 4.06Å
528	K	56.9	Low	51.9	Low	5 Å²	5	77 Å²	77	2%	0.022	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	125.5	164.5	171	168.1	178.9	174.2	0	110.1	Y510 D534 E544 V545	Y510-K528 HydrophobicContact CD1-CB 3.42Å; Y510-K528 VanDerWaalsContact CD1-CB 3.42Å; Y510-K528 HydrophobicContact CD1-CD 4.5Å; Y510-K528 HydrophobicContact CD2-CB 4.16Å; Y510-K528 HydrophobicContact CD2-CD 3.82Å; Y510-K528 HydrophobicContact CD2-CG 4.46Å; Y510-K528 HydrophobicContact CE1-CB 3.29Å; Y510-K528 HydrophobicContact CE1-CD 4.03Å; Y510-K528 HydrophobicContact CE1-CG 4.28Å; Y510-K528 HydrophobicContact CE2-CB 4.1Å; Y510-K528 HydrophobicContact CE2-CD 3.31Å; Y510-K528 HydrophobicContact CE2-CG 4.27Å; Y510-K528 HydrophobicContact CG-CB 3.84Å; Y510-K528 HydrophobicContact CG-CD 4.39Å; Y510-K528 VanDerWaalsContact CZ-CD 3.4Å; K528-D534 IonicContact NZ-OD1 2.94Å; K528-D534 PolarHBondContact NZ-OD1 2.85Å; K528-E544 WeakPolarHBondContact O-CA 3.18Å; K528-V545 PolarHBondContact N-O 2.83Å; K528-V545 PolarHBondContact O-N 3.35Å; K528-V545 VanDerWaalsContact O-N 3.12Å
529	V	58.1	Low	52.3	Low	98 Å²	98	73.1 Å²	73.1	59%	0.594	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.1	111.7	166.8	-176.6	0	0	0	0	106.8
530	C	53.3	Low	52.9	Low	28 Å²	28	69 Å²	69	19%	0.189	41%	0.406	C	S	.	.			trans	-67.5	135	-175	-70.1	0	0	0	0	111.9	C537 T542 R543	C530-C537 HydrophobicContact CB-CB 3.55Å; C530-C537 WeakPolarHBondContact CB-SG 3.03Å; C530-C537 WeakPolarHBondContact SG-CB 3.44Å; C530-C537 CovalentContact SG-SG 2.05Å; C530-C537 PolarHBondContact SG-SG 3.09Å; C530-T542 PolarHBondContact SG-O 2.89Å; C530-R543 PolarHBondContact N-O 2.89Å
531	S	55.1	Low	53.5	Low	62 Å²	62	72 Å²	72	43%	0.434	42%	0.418	S	S	.	.			trans	-89.3	165.6	169.9	76.8	0	0	0	0	111.6	E533 D534	S531-E533 PolarHBondContact O-N 2.84Å; S531-E533 VanDerWaalsContact O-N 3.12Å; S531-E533 PolarHBondContact OG-N 3.1Å; S531-D534 PolarHBondContact N-OD2 2.8Å; S531-D534 PolarHBondContact O-N 2.67Å; S531-D534 PolarHBondContact OG-OD2 3.38Å
532	T	51.6	Low	54.1	Low	131 Å²	131	69.5 Å²	69.5	80%	0.804	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-5.3	175.9	47.9	0	0	0	0	114.2
533	E	54.1	Low	54.6	Low	167 Å²	167	73.2 Å²	73.2	78%	0.78	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.3	-8.3	-176.6	-60.4	-175.4	179.1	0	0	113.1	S531 T535	S531-E533 PolarHBondContact O-N 2.84Å; S531-E533 VanDerWaalsContact O-N 3.12Å; S531-E533 PolarHBondContact OG-N 3.1Å; E533-T535 PolarHBondContact O-N 2.84Å
534	D	56.9	Low	55.2	Low	22 Å²	22	77.1 Å²	77.1	12%	0.118	42%	0.417	C	S	.	.			trans	-75.4	103.5	178.7	-82.2	-76.9	0	0	0	111.5	K528 S531 E536 C537 L538	K528-D534 IonicContact NZ-OD1 2.94Å; K528-D534 PolarHBondContact NZ-OD1 2.85Å; S531-D534 PolarHBondContact N-OD2 2.8Å; S531-D534 PolarHBondContact O-N 2.67Å; S531-D534 PolarHBondContact OG-OD2 3.38Å; D534-E536 PolarHBondContact O-N 3.09Å; D534-C537 HydrophobicContact CB-CB 4.14Å; D534-C537 PolarHBondContact O-N 2.76Å; D534-C537 VanDerWaalsContact O-N 3.08Å; D534-L538 WeakPolarHBondContact O-CD1 3.47Å; D534-L538 WeakPolarHBondContact O-CG 3.17Å; D534-L538 PolarHBondContact O-N 2.88Å
535	T	54.6	Low	55.6	Low	125 Å²	125	75.6 Å²	75.6	77%	0.767	41%	0.413	S	S	*	.	H	α-helix	trans	-60.4	-26	-179.9	50	0	0	0	0	113.9	E533	E533-T535 PolarHBondContact O-N 2.84Å
536	E	50.8	Low	56.3	Low	147 Å²	147	76.3 Å²	76.3	69%	0.687	42%	0.415	S	S	*	.	H	α-helix	trans	-72.3	-35	176.1	-165.9	176.4	-160.1	0	0	112.4	D534	D534-E536 PolarHBondContact O-N 3.09Å
537	C	50	Low	56.8	Low	16 Å²	16	78.2 Å²	78.2	11%	0.108	42%	0.421	C	S	.	.	H	α-helix	trans	-81.6	-27.3	175.7	-56.6	0	0	0	0	112.3	C530 D534 G539 N540 H541	C530-C537 HydrophobicContact CB-CB 3.55Å; C530-C537 WeakPolarHBondContact CB-SG 3.03Å; C530-C537 WeakPolarHBondContact SG-CB 3.44Å; C530-C537 CovalentContact SG-SG 2.05Å; C530-C537 PolarHBondContact SG-SG 3.09Å; D534-C537 HydrophobicContact CB-CB 4.14Å; D534-C537 PolarHBondContact O-N 2.76Å; D534-C537 VanDerWaalsContact O-N 3.08Å; C537-G539 PolarHBondContact O-N 3.28Å; C537-N540 PolarHBondContact O-N 3.25Å; C537-H541 PolarHBondContact O-N 3.45Å
538	L	45.8	Very low	57.4	Low	105 Å²	105	76.4 Å²	76.4	55%	0.55	41%	0.411	S	S	.	.	H	α-helix	trans	-70.1	-26.3	-179.9	-80.7	158.5	0	0	0	113.7	D534	D534-L538 WeakPolarHBondContact O-CD1 3.47Å; D534-L538 WeakPolarHBondContact O-CG 3.17Å; D534-L538 PolarHBondContact O-N 2.88Å
539	G	48.1	Very low	58.1	Low	67 Å²	67	76.1 Å²	76.1	69%	0.691	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-20.9	177.5	0	0	0	0	0	114.6	C537	C537-G539 PolarHBondContact O-N 3.28Å
540	N	51.8	Low	59.1	Low	104 Å²	104	72.9 Å²	72.9	56%	0.556	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133	12.1	-167.3	-134.8	15.4	0	0	0	114.5	C537 T542	C537-N540 PolarHBondContact O-N 3.25Å; N540-T542 PolarHBondContact O-N 3.07Å; N540-T542 PolarHBondContact O-OG1 2.81Å; N540-T542 VanDerWaalsContact O-OG1 3.11Å
541	H	55.7	Low	59.9	Low	141 Å²	141	72.7 Å²	72.7	65%	0.653	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	20.4	179.4	-59.6	-71	0	0	0	115.7	C537 F630	C537-H541 PolarHBondContact O-N 3.45Å; H541-F630 HydrophobicContact CB-CD2 3.48Å; H541-F630 VanDerWaalsContact CB-CD2 3.48Å; H541-F630 HydrophobicContact CB-CE2 3.78Å; H541-F630 HydrophobicContact CB-CG 4.27Å; H541-F630 WeakPolarHBondContact O-CB 3.39Å; H541-F630 WeakPolarHBondContact O-CD2 3.29Å
542	T	53.3	Low	60.9	Low	22 Å²	22	70.1 Å²	70.1	14%	0.135	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	129.7	-172.6	-51.7	0	0	0	0	111.3	C530 N540 V545 F630 E632	C530-T542 PolarHBondContact SG-O 2.89Å; N540-T542 PolarHBondContact O-N 3.07Å; N540-T542 PolarHBondContact O-OG1 2.81Å; N540-T542 VanDerWaalsContact O-OG1 3.11Å; T542-V545 HydrophobicContact CG2-CG2 4.18Å; T542-F630 CarbonylContact C-O 3.58Å; T542-F630 WeakPolarHBondContact CA-O 3.34Å; T542-F630 WeakPolarHBondContact CG2-O 3.48Å; T542-E632 HydrophobicContact CG2-CB 4.24Å
543	R	61.2	Low	61.8	Low	164 Å²	164	65.2 Å²	65.2	62%	0.619	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.7	-40.1	-176.8	-72.1	-169.2	174.5	-158.1	-1.9	113	C530 F630	C530-R543 PolarHBondContact N-O 2.89Å; R543-F630 PolarHBondContact N-O 2.85Å
544	E	65.1	Low	63	Low	93 Å²	93	57.7 Å²	57.7	44%	0.435	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	139.4	-178.4	-60.7	170.5	154.3	0	0	111.2	K528 N631 E632	K528-E544 WeakPolarHBondContact O-CA 3.18Å; E544-N631 PolarHBondContact N-OD1 2.91Å; E544-N631 CarbonylContact O-C 3.46Å; E544-N631 VanDerWaalsContact O-CA 3.3Å; E544-N631 WeakPolarHBondContact O-CA 3.05Å; E544-N631 PolarHBondContact OE2-ND2 3.43Å; E544-E632 PolarHBondContact O-N 3.03Å
545	V	67.6	Low	63.8	Low	12 Å²	12	58 Å²	58	7%	0.073	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	123	172.4	-175.5	0	0	0	0	109.6	I527 K528 T542 E632 I634	I527-V545 WeakPolarHBondContact CA-O 3.27Å; K528-V545 PolarHBondContact N-O 2.83Å; K528-V545 PolarHBondContact O-N 3.35Å; K528-V545 VanDerWaalsContact O-N 3.12Å; T542-V545 HydrophobicContact CG2-CG2 4.18Å; V545-E632 CarbonylContact C-O 3.59Å; V545-E632 VanDerWaalsContact CA-O 3.29Å; V545-E632 WeakPolarHBondContact CA-O 3.35Å; V545-E632 HydrophobicContact CG2-CB 4.43Å; V545-I634 HydrophobicContact CG1-CD1 4.03Å; V545-I634 HydrophobicContact CG1-CG1 4.28Å
546	L	71.3	Confident	64.6	Low	35 Å²	35	60.4 Å²	60.4	18%	0.183	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	121.3	176.2	177	67.9	0	0	0	109.5	S525 I527 Q548 I567 E632 A633 I634	S525-L546 WeakPolarHBondContact OG-CD1 3.44Å; I527-L546 HydrophobicContact CG1-CD1 4.06Å; L546-Q548 HydrophobicContact CD2-CG 4.37Å; L546-Q548 HydrophobicContact CG-CG 4.15Å; L546-I567 HydrophobicContact CD2-CG1 4.49Å; L546-I567 HydrophobicContact CD2-CG2 4.08Å; L546-E632 PolarHBondContact N-O 2.89Å; L546-A633 HydrophobicContact CB-CB 4.02Å; L546-A633 HydrophobicContact CD2-CB 4.15Å; L546-A633 HydrophobicContact CG-CB 4.4Å; L546-A633 CarbonylContact O-C 3.57Å; L546-A633 WeakPolarHBondContact O-CA 3.31Å; L546-I634 PolarHBondContact O-N 2.99Å
547	Y	71.6	Confident	65.8	Low	49 Å²	49	58.2 Å²	58.2	19%	0.192	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	133.3	174.1	-177	-86.9	0	0	0	110.1	Y524 S525 C526 I634 E636	Y524-Y547 HydrophobicContact CE2-CD1 4.08Å; Y524-Y547 AromaticContact CE2-CE1 3.97Å; Y524-Y547 HydrophobicContact CE2-CE1 3.97Å; Y524-Y547 AromaticContact CZ-CE1 3.87Å; Y524-Y547 WeakPolarHBondContact OH-CE1 3.34Å; S525-Y547 CarbonylContact C-O 3.58Å; S525-Y547 WeakPolarHBondContact CA-O 3.2Å; C526-Y547 PolarHBondContact N-O 2.81Å; C526-Y547 PolarHBondContact O-N 2.81Å; Y547-I634 CarbonylContact C-O 3.39Å; Y547-I634 WeakPolarHBondContact CA-O 3.14Å; Y547-I634 HydrophobicContact CD2-CB 3.92Å; Y547-I634 HydrophobicContact CD2-CG2 3.8Å; Y547-I634 HydrophobicContact CE2-CG2 3.95Å; Y547-E636 PolarHBondContact OH-OE2 2.84Å
548	Q	72.8	Confident	67.1	Low	11 Å²	11	59.2 Å²	59.2	5%	0.051	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	144.1	179.7	-66.4	179	-32.7	0	0	111.2	Y524 L546 S565 I634 I635 E636	Y524-Q548 WeakPolarHBondContact O-CA 3.31Å; L546-Q548 HydrophobicContact CD2-CG 4.37Å; L546-Q548 HydrophobicContact CG-CG 4.15Å; Q548-S565 VanDerWaalsContact CD-OG 3.3Å; Q548-S565 PolarHBondContact NE2-OG 2.96Å; Q548-S565 PolarHBondContact OE1-OG 3.2Å; Q548-I634 PolarHBondContact N-O 3.47Å; Q548-I635 HydrophobicContact CB-CG1 4.33Å; Q548-I635 HydrophobicContact CB-CG2 4.29Å; Q548-I635 CarbonylContact O-C 3.56Å; Q548-I635 VanDerWaalsContact O-CA 3.31Å; Q548-I635 WeakPolarHBondContact O-CA 3.33Å; Q548-E636 PolarHBondContact O-N 2.54Å
549	F	72.3	Confident	68.4	Low	0 Å²	0	62.3 Å²	62.3	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	139.6	167.5	-172.9	-85.2	0	0	0	110.2	V493 K500 H502 G523 Y524 E636	V493-F549 HydrophobicContact CB-CD1 4.16Å; V493-F549 HydrophobicContact CB-CE1 4.03Å; V493-F549 HydrophobicContact CG1-CD1 3.72Å; V493-F549 HydrophobicContact CG1-CE1 3.65Å; V493-F549 HydrophobicContact CG2-CD1 4.04Å; V493-F549 HydrophobicContact CG2-CE1 4.35Å; K500-F549 HydrophobicContact CD-CZ 4.09Å; H502-F549 AromaticContact CE1-CD2 3.79Å; H502-F549 AromaticContact CE1-CE2 3.43Å; H502-F549 VanDerWaalsContact CE1-CE2 3.43Å; H502-F549 WeakPolarHBondContact CE1-CE2 3.07Å; H502-F549 AromaticContact CE1-CZ 3.96Å; H502-F549 AromaticContact NE2-CD2 3.74Å; H502-F549 AromaticContact NE2-CE1 3.93Å; H502-F549 AromaticContact NE2-CE2 3.34Å; H502-F549 VanDerWaalsContact NE2-CE2 3.34Å; H502-F549 WeakPolarHBondContact NE2-CE2 3.41Å; H502-F549 AromaticContact NE2-CZ 3.43Å; H502-F549 WeakPolarHBondContact NE2-CZ 3.08Å; G523-F549 WeakPolarHBondContact CA-O 3.46Å; Y524-F549 HydrophobicContact CD1-CB 4.08Å; Y524-F549 HydrophobicContact CE1-CB 3.91Å; Y524-F549 HydrophobicContact CE1-CG 4.45Å; Y524-F549 PolarHBondContact O-N 2.88Å; F549-E636 CarbonylContact C-O 3.52Å; F549-E636 WeakPolarHBondContact CA-O 3.13Å; F549-E636 HydrophobicContact CD2-CB 3.94Å; F549-E636 HydrophobicContact CD2-CG 3.99Å; F549-E636 HydrophobicContact CE2-CG 4.1Å; F549-E636 WeakPolarHBondContact CE2-OE1 3.47Å
550	R	77.1	Confident	69.9	Low	30 Å²	30	63 Å²	63	11%	0.113	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	143.8	-179.4	-65.9	-64.5	-178.4	-98.4	0.2	112	V564 S565 I635 E636 I637 S638	R550-V564 HydrophobicContact CB-CG1 4.05Å; R550-V564 WeakPolarHBondContact CD-O 3.45Å; R550-V564 HydrophobicContact CG-CG1 4.17Å; R550-V564 WeakPolarHBondContact CG-O 3.03Å; R550-V564 PolarHBondContact NE-O 2.86Å; R550-S565 PolarHBondContact NH2-OG 3.46Å; R550-I635 HydrophobicContact CB-CG2 4.44Å; R550-I635 HydrophobicContact CG-CG2 3.92Å; R550-E636 PolarHBondContact N-O 2.81Å; R550-I637 HydrophobicContact CB-CG1 4.46Å; R550-I637 CarbonylContact O-C 3.58Å; R550-I637 WeakPolarHBondContact O-CA 3.45Å; R550-S638 PolarHBondContact O-N 3.44Å
551	A	71.5	Confident	71.5	Confident	23 Å²	23	60.8 Å²	60.8	19%	0.19	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	137	172.2	0	0	0	0	0	110.5	T495 S638	T495-A551 HydrophobicContact CG2-CB 3.96Å; A551-S638 WeakPolarHBondContact CA-O 3.29Å
552	V	76.2	Confident	72.8	Confident	8 Å²	8	56.9 Å²	56.9	5%	0.048	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	146	173.8	-67.6	0	0	0	0	110.9	V564 I637 S638 V639 S640	V552-V564 HydrophobicContact CG1-CG1 4.3Å; V552-V564 HydrophobicContact CG1-CG2 4.11Å; V552-I637 HydrophobicContact CB-CG2 4.48Å; V552-I637 HydrophobicContact CG1-CG2 4.21Å; V552-I637 HydrophobicContact CG2-CG2 3.48Å; V552-I637 VanDerWaalsContact CG2-CG2 3.48Å; V552-S638 PolarHBondContact N-O 3.24Å; V552-V639 HydrophobicContact CG2-CB 4.42Å; V552-V639 HydrophobicContact CG2-CG2 3.84Å; V552-V639 WeakPolarHBondContact O-CA 3.49Å; V552-S640 PolarHBondContact O-N 3.03Å; V552-S640 VanDerWaalsContact O-N 3.1Å
553	P	69.6	Low	74.4	Confident	28 Å²	28	60.2 Å²	60.2	18%	0.182	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	148.3	173.8	22.5	-28.3	0	0	0	111.3	L496 L555 S640 F644	L496-P553 HydrophobicContact CD1-CB 3.54Å; L496-P553 HydrophobicContact CD1-CG 3.91Å; P553-L555 HydrophobicContact CB-CD2 4.07Å; P553-L555 HydrophobicContact CB-CG 4.23Å; P553-L555 HydrophobicContact CG-CD1 4.21Å; P553-L555 HydrophobicContact CG-CD2 3.97Å; P553-L555 HydrophobicContact CG-CG 4.02Å; P553-L555 PolarHBondContact O-N 3.1Å; P553-S640 WeakPolarHBondContact CA-OG 3.27Å; P553-F644 HydrophobicContact CB-CB 3.87Å
554	S	79	Confident	75.4	Confident	10 Å²	10	53 Å²	53	7%	0.07	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	126.4	158.6	-169.9	0	0	0	0	108.4	I606 G608 S640 P643 F644	S554-I606 PolarHBondContact OG-O 2.75Å; S554-G608 PolarHBondContact OG-N 2.84Å; S554-S640 WeakPolarHBondContact CB-O 3Å; S554-S640 PolarHBondContact N-OG 3.09Å; S554-P643 CarbonylContact O-C 3.54Å; S554-P643 WeakPolarHBondContact O-CA 3.43Å; S554-F644 PolarHBondContact O-N 3.08Å
555	L	74.9	Confident	76.4	Confident	27 Å²	27	48.7 Å²	48.7	14%	0.141	26%	0.26	C	S	.	.			trans	-123.3	139.3	-176.1	-65.7	171.8	0	0	0	109.5	P553 I558 I562 P605 F644	P553-L555 HydrophobicContact CB-CD2 4.07Å; P553-L555 HydrophobicContact CB-CG 4.23Å; P553-L555 HydrophobicContact CG-CD1 4.21Å; P553-L555 HydrophobicContact CG-CD2 3.97Å; P553-L555 HydrophobicContact CG-CG 4.02Å; P553-L555 PolarHBondContact O-N 3.1Å; L555-I558 HydrophobicContact CB-CG1 4.49Å; L555-I558 HydrophobicContact CD1-CD1 4.46Å; L555-I558 HydrophobicContact CD1-CG1 4.03Å; L555-I562 HydrophobicContact CD1-CD1 3.31Å; L555-P605 HydrophobicContact CB-CB 4.49Å; L555-P605 WeakPolarHBondContact O-CB 3.45Å; L555-F644 HydrophobicContact CD2-CB 4.43Å; L555-F644 WeakPolarHBondContact CD2-O 3.43Å
556	K	71.4	Confident	77.2	Confident	177 Å²	177	52.9 Å²	52.9	77%	0.77	27%	0.274	S	S	*	.	S	Bend	trans	-74.1	-38.1	170.6	-70.5	179.8	-176.5	168.3	0	111.2
557	T	75.4	Confident	77.8	Confident	101 Å²	101	51.4 Å²	51.4	62%	0.62	27%	0.267	S	S	*	.			trans	-143.2	153.7	-180	55.5	0	0	0	0	110.3
558	I	76.6	Confident	78.2	Confident	37 Å²	37	52.8 Å²	52.8	19%	0.19	28%	0.28	C	S	.	.			trans	-115.7	107.3	174.8	-62.5	-172.3	0	0	0	107.6	L555 S560 L602 P605	L555-I558 HydrophobicContact CB-CG1 4.49Å; L555-I558 HydrophobicContact CD1-CD1 4.46Å; L555-I558 HydrophobicContact CD1-CG1 4.03Å; I558-S560 WeakPolarHBondContact CG2-O 3.45Å; I558-L602 HydrophobicContact CD1-CB 4.47Å; I558-L602 HydrophobicContact CD1-CD2 3.69Å; I558-L602 HydrophobicContact CD1-CG 3.58Å; I558-P605 HydrophobicContact CG1-CB 4.39Å
559	I	74.3	Confident	78.2	Confident	170 Å²	170	52.9 Å²	52.9	87%	0.872	28%	0.281	S	S	*	.	S	Bend	trans	-79.7	-31.5	-178.1	-53.2	171.8	0	0	0	110.5
560	S	79.6	Confident	77.9	Confident	80 Å²	80	61.7 Å²	61.7	56%	0.559	32%	0.322	S	S	*	.	S	Bend	trans	-144.1	149.8	173.9	63.8	0	0	0	0	111.1	I558 I562	I558-S560 WeakPolarHBondContact CG2-O 3.45Å; S560-I562 PolarHBondContact O-N 2.8Å
561	P	85.3	Confident	77	Confident	59 Å²	59	63.6 Å²	63.6	38%	0.383	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-59	129.7	179.8	-23.9	34.4	0	0	0	112.3	Q601 L602 V603	P561-Q601 HydrophobicContact CB-CB 4.1Å; P561-L602 WeakPolarHBondContact CA-O 3.48Å; P561-V603 HydrophobicContact CB-CG1 3.99Å; P561-V603 HydrophobicContact CG-CG1 4.21Å
562	I	82.4	Confident	76.4	Confident	59 Å²	59	64.4 Å²	64.4	30%	0.303	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	126	-178.2	-59.7	170.3	0	0	0	108.9	L555 S560 V564 Q601 L602	L555-I562 HydrophobicContact CD1-CD1 3.31Å; S560-I562 PolarHBondContact O-N 2.8Å; I562-V564 PolarHBondContact O-N 2.8Å; I562-Q601 CarbonylContact O-C 3.26Å; I562-Q601 WeakPolarHBondContact O-CA 3.32Å; I562-L602 HydrophobicContact CB-CB 4.31Å; I562-L602 PolarHBondContact N-O 2.79Å; I562-L602 VanDerWaalsContact N-O 3.1Å; I562-L602 PolarHBondContact O-N 3.03Å
563	E	87.1	Confident	75.4	Confident	91 Å²	91	70.4 Å²	70.4	43%	0.425	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	119.1	173.1	179.1	169.3	156	0	0	110.4	R566 I599	E563-R566 VanDerWaalsContact CD-NH2 3.25Å; E563-R566 IonicContact OE1-CZ 3.64Å; E563-R566 VanDerWaalsContact OE1-CZ 3.27Å; E563-R566 IonicContact OE1-NE 3.76Å; E563-R566 PolarHBondContact OE1-NE 3.43Å; E563-R566 IonicContact OE1-NH2 3.61Å; E563-R566 PolarHBondContact OE1-NH2 3.08Å; E563-R566 IonicContact OE2-CZ 3.5Å; E563-R566 IonicContact OE2-NH2 3.04Å; E563-R566 PolarHBondContact OE2-NH2 3.15Å; E563-I599 HydrophobicContact CB-CG2 4.35Å; E563-I599 HydrophobicContact CG-CG2 3.66Å
564	V	83.1	Confident	74.9	Confident	12 Å²	12	71.5 Å²	71.5	7%	0.073	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	-39.5	-177.5	177.5	0	0	0	0	110.3	R550 V552 I562 F589 V600 L602 I637	R550-V564 HydrophobicContact CB-CG1 4.05Å; R550-V564 WeakPolarHBondContact CD-O 3.45Å; R550-V564 HydrophobicContact CG-CG1 4.17Å; R550-V564 WeakPolarHBondContact CG-O 3.03Å; R550-V564 PolarHBondContact NE-O 2.86Å; V552-V564 HydrophobicContact CG1-CG1 4.3Å; V552-V564 HydrophobicContact CG1-CG2 4.11Å; I562-V564 PolarHBondContact O-N 2.8Å; V564-F589 HydrophobicContact CG1-CE1 4.35Å; V564-F589 HydrophobicContact CG2-CD1 4.08Å; V564-F589 HydrophobicContact CG2-CE1 3.82Å; V564-V600 PolarHBondContact N-O 2.87Å; V564-L602 HydrophobicContact CG2-CB 3.72Å; V564-I637 HydrophobicContact CG1-CD1 3.91Å; V564-I637 HydrophobicContact CG1-CG1 4.26Å
565	S	84.8	Confident	74.6	Confident	3 Å²	3	75 Å²	75	2%	0.021	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	153.5	175.1	-161.9	0	0	0	0	113	Q548 R550 I599 V600	Q548-S565 VanDerWaalsContact CD-OG 3.3Å; Q548-S565 PolarHBondContact NE2-OG 2.96Å; Q548-S565 PolarHBondContact OE1-OG 3.2Å; R550-S565 PolarHBondContact NH2-OG 3.46Å; S565-I599 CarbonylContact O-C 3.45Å; S565-I599 WeakPolarHBondContact O-CA 3.45Å; S565-V600 PolarHBondContact N-O 2.97Å; S565-V600 PolarHBondContact O-N 2.87Å
566	R	84.6	Confident	74.8	Confident	100 Å²	100	76.4 Å²	76.4	38%	0.377	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	116.1	176.7	-175.1	174.8	-67.6	-95.5	-1.8	108.9	E563 V568 I597	E563-R566 VanDerWaalsContact CD-NH2 3.25Å; E563-R566 IonicContact OE1-CZ 3.64Å; E563-R566 VanDerWaalsContact OE1-CZ 3.27Å; E563-R566 IonicContact OE1-NE 3.76Å; E563-R566 PolarHBondContact OE1-NE 3.43Å; E563-R566 IonicContact OE1-NH2 3.61Å; E563-R566 PolarHBondContact OE1-NH2 3.08Å; E563-R566 IonicContact OE2-CZ 3.5Å; E563-R566 IonicContact OE2-NH2 3.04Å; E563-R566 PolarHBondContact OE2-NH2 3.15Å; R566-V568 HydrophobicContact CG-CG2 4.36Å; R566-I597 HydrophobicContact CG-CG2 3.55Å
567	I	84.2	Confident	75.3	Confident	4 Å²	4	68.1 Å²	68.1	2%	0.021	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	116.8	-179.5	-56.9	165.8	0	0	0	107.9	L546 Y579 I597 G598 V600 V616 I618 A633 I635	L546-I567 HydrophobicContact CD2-CG1 4.49Å; L546-I567 HydrophobicContact CD2-CG2 4.08Å; I567-Y579 HydrophobicContact CB-CE1 4.25Å; I567-Y579 HydrophobicContact CG2-CE1 3.97Å; I567-I597 CarbonylContact O-C 3.25Å; I567-I597 WeakPolarHBondContact O-CA 3.41Å; I567-G598 PolarHBondContact N-O 2.88Å; I567-G598 PolarHBondContact O-N 3.33Å; I567-V600 HydrophobicContact CD1-CG2 4.27Å; I567-V616 HydrophobicContact CD1-CB 3.96Å; I567-V616 HydrophobicContact CD1-CG1 3.99Å; I567-V616 HydrophobicContact CD1-CG2 3.86Å; I567-I618 HydrophobicContact CG2-CD1 3.73Å; I567-A633 HydrophobicContact CD1-CB 3.76Å; I567-A633 HydrophobicContact CG1-CB 4.41Å; I567-I635 HydrophobicContact CD1-CD1 4.37Å
568	V	79.3	Confident	75.8	Confident	78 Å²	78	65.4 Å²	65.4	47%	0.473	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	131.9	179.8	-176.2	0	0	0	0	109.3	R566 I597	R566-V568 HydrophobicContact CG-CG2 4.36Å; V568-I597 HydrophobicContact CG2-CG1 4.29Å; V568-I597 HydrophobicContact CG2-CG2 4.39Å
569	T	73.9	Confident	76.4	Confident	13 Å²	13	64.2 Å²	64.2	8%	0.08	35%	0.353	C	S	.	.			trans	-109.1	135	174.3	51	0	0	0	0	110.7	M571 V577 Y579 N596 I618	T569-M571 VanDerWaalsContact C-N 3.3Å; T569-M571 PolarHBondContact O-N 2.87Å; T569-V577 HydrophobicContact CG2-CG1 4.14Å; T569-Y579 HydrophobicContact CG2-CE1 4.28Å; T569-Y579 VanDerWaalsContact CG2-OH 3.28Å; T569-Y579 WeakPolarHBondContact CG2-OH 3.28Å; T569-Y579 PolarHBondContact OG1-OH 2.93Å; T569-Y579 VanDerWaalsContact OG1-OH 3.04Å; T569-N596 PolarHBondContact N-O 3.25Å; T569-N596 VanDerWaalsContact N-O 3.17Å; T569-N596 PolarHBondContact O-ND2 3.4Å; T569-N596 PolarHBondContact OG1-O 2.97Å; T569-I618 HydrophobicContact CG2-CG2 3.83Å
570	H	65.6	Low	77.2	Confident	185 Å²	185	59.9 Å²	59.9	86%	0.856	33%	0.332	S	S	*	.	S	Bend	trans	-79.2	-7.3	-174.5	-69.8	-78	0	0	0	114.2	G572	H570-G572 PolarHBondContact O-N 3.17Å
571	M	59.3	Low	77.8	Confident	70 Å²	70	56.7 Å²	56.7	35%	0.345	31%	0.308	S	S	.	.			trans	-86.4	106.1	176.9	-70.1	-158.4	-93	0	0	111	T569 T620 A629	T569-M571 VanDerWaalsContact C-N 3.3Å; T569-M571 PolarHBondContact O-N 2.87Å; M571-T620 HydrophobicContact CB-CG2 4.27Å; M571-T620 HydrophobicContact CE-CG2 3.6Å; M571-T620 WeakPolarHBondContact CE-OG1 3.29Å; M571-T620 HydrophobicContact SD-CG2 3.95Å; M571-A629 HydrophobicContact CE-CB 3.98Å
572	G	58.6	Low	78	Confident	40 Å²	40	55.4 Å²	55.4	41%	0.412	30%	0.298	S	S	.	.			trans	-91.8	-173.5	176.6	0	0	0	0	0	114.4	H570 F575	H570-G572 PolarHBondContact O-N 3.17Å; G572-F575 VanDerWaalsContact O-CD2 3.29Å; G572-F575 WeakPolarHBondContact O-CD2 3.21Å; G572-F575 PolarHBondContact O-N 2.7Å; G572-F575 VanDerWaalsContact O-N 3.08Å
573	V	54	Low	78.3	Confident	135 Å²	135	60.5 Å²	60.5	82%	0.818	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.8	125.2	175.4	-174.8	0	0	0	0	109.2
574	P	59.3	Low	78.3	Confident	51 Å²	51	58.5 Å²	58.5	33%	0.331	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	cis	-90.1	2.3	28.8	36.6	-39.9	0	0	0	117.5	R623	P574-R623 HydrophobicContact CB-CG 3.84Å; P574-R623 VanDerWaalsContact CB-CZ 3.48Å; P574-R623 WeakPolarHBondContact O-CG 3.34Å
575	F	73.1	Confident	78.5	Confident	83 Å²	83	57.9 Å²	57.9	36%	0.364	31%	0.305	S	S	.	.			trans	-90.8	149.2	-172.3	-51.7	-70.1	0	0	0	112	G572 T620 K621 L628	G572-F575 VanDerWaalsContact O-CD2 3.29Å; G572-F575 WeakPolarHBondContact O-CD2 3.21Å; G572-F575 PolarHBondContact O-N 2.7Å; G572-F575 VanDerWaalsContact O-N 3.08Å; F575-T620 HydrophobicContact CB-CG2 4.01Å; F575-K621 WeakPolarHBondContact CA-O 3.17Å; F575-K621 WeakPolarHBondContact CB-O 3.34Å; F575-L628 HydrophobicContact CD1-CD1 3.4Å; F575-L628 HydrophobicContact CE1-CD1 3.4Å; F575-L628 HydrophobicContact CG-CD1 4.49Å; F575-L628 HydrophobicContact CZ-CD1 4.5Å
576	S	78.3	Confident	78.8	Confident	57 Å²	57	63.3 Å²	63.3	40%	0.399	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	152.7	168.8	69.6	0	0	0	0	109.7	T620 K621	S576-T620 CarbonylContact O-C 3.53Å; S576-K621 PolarHBondContact N-O 2.9Å; S576-K621 PolarHBondContact O-N 3.11Å
577	V	82.5	Confident	79.2	Confident	3 Å²	3	65 Å²	65	2%	0.018	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	135.2	-179.6	-178.5	0	0	0	0	108	T569 Y579 Q593 I618 H619 T620	T569-V577 HydrophobicContact CG2-CG1 4.14Å; V577-Y579 HydrophobicContact CB-CE2 4.26Å; V577-Y579 HydrophobicContact CG1-CD2 4.34Å; V577-Y579 HydrophobicContact CG1-CE1 4.32Å; V577-Y579 HydrophobicContact CG1-CE2 3.7Å; V577-Q593 VanDerWaalsContact O-CD 3.29Å; V577-Q593 PolarHBondContact O-NE2 2.76Å; V577-Q593 PolarHBondContact O-OE1 2.83Å; V577-I618 HydrophobicContact CG1-CG2 3.55Å; V577-H619 CarbonylContact C-O 3.49Å; V577-H619 WeakPolarHBondContact CA-O 3.09Å; V577-T620 HydrophobicContact CG2-CG2 4.34Å
578	D	86.8	Confident	79.5	Confident	44 Å²	44	67 Å²	67	24%	0.235	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	140.4	174.6	-61.6	-26.4	0	0	0	110.2	I618 H619 K621	D578-I618 CarbonylContact O-C 3.54Å; D578-I618 WeakPolarHBondContact O-CA 3.07Å; D578-H619 PolarHBondContact N-O 2.05Å; D578-H619 PolarHBondContact O-N 3.28Å; D578-K621 WeakPolarHBondContact OD2-CD 3.16Å; D578-K621 WeakPolarHBondContact OD2-CE 3.4Å; D578-K621 IonicContact OD2-NZ 2.59Å; D578-K621 PolarHBondContact OD2-NZ 3.04Å
579	Y	89.5	Confident	80.2	Confident	11 Å²	11	63.6 Å²	63.6	4%	0.043	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	127.4	178.8	-60	-94	0	0	0	111	I567 T569 V577 I591 Q593 N596 V616 N617 I618	I567-Y579 HydrophobicContact CB-CE1 4.25Å; I567-Y579 HydrophobicContact CG2-CE1 3.97Å; T569-Y579 HydrophobicContact CG2-CE1 4.28Å; T569-Y579 VanDerWaalsContact CG2-OH 3.28Å; T569-Y579 WeakPolarHBondContact CG2-OH 3.28Å; T569-Y579 PolarHBondContact OG1-OH 2.93Å; T569-Y579 VanDerWaalsContact OG1-OH 3.04Å; V577-Y579 HydrophobicContact CB-CE2 4.26Å; V577-Y579 HydrophobicContact CG1-CD2 4.34Å; V577-Y579 HydrophobicContact CG1-CE1 4.32Å; V577-Y579 HydrophobicContact CG1-CE2 3.7Å; Y579-I591 VanDerWaalsContact CB-CD1 3.42Å; Y579-I591 HydrophobicContact CD1-CD1 4.25Å; Y579-I591 HydrophobicContact CG-CD1 4.07Å; Y579-Q593 HydrophobicContact CD2-CG 3.99Å; Y579-Q593 HydrophobicContact CE2-CG 4.17Å; Y579-N596 VanDerWaalsContact OH-C 3.31Å; Y579-N596 PolarHBondContact OH-O 3.42Å; Y579-V616 HydrophobicContact CD1-CG1 4.12Å; Y579-N617 WeakPolarHBondContact CA-O 3.28Å; Y579-I618 HydrophobicContact CD1-CB 4.47Å; Y579-I618 HydrophobicContact CD1-CD1 4.35Å; Y579-I618 HydrophobicContact CD1-CG1 3.81Å; Y579-I618 HydrophobicContact CD1-CG2 4.18Å; Y579-I618 HydrophobicContact CE1-CD1 4.14Å; Y579-I618 HydrophobicContact CE1-CG1 3.99Å; Y579-I618 HydrophobicContact CE1-CG2 3.85Å
580	N	89.9	Confident	81.1	Confident	80 Å²	80	68.6 Å²	68.6	43%	0.428	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	119.3	-179.1	-64	-68.7	0	0	0	111.4	V616 N617	N580-V616 CarbonylContact O-C 3.54Å; N580-V616 WeakPolarHBondContact O-CA 3.31Å; N580-N617 HydrophobicContact CB-CB 4.47Å; N580-N617 PolarHBondContact N-O 3.42Å; N580-N617 PolarHBondContact O-N 3.12Å
581	L	91.7	Very high	82.4	Confident	12 Å²	12	61.8 Å²	61.8	6%	0.063	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	144.3	171.4	-78.3	162.5	0	0	0	110.9	Q586 F589 I591 I614 K615 V616	L581-Q586 HydrophobicContact CB-CG 3.99Å; L581-Q586 PolarHBondContact O-NE2 3.12Å; L581-F589 HydrophobicContact CD1-CB 4.03Å; L581-I591 HydrophobicContact CD1-CB 4.06Å; L581-I591 HydrophobicContact CD1-CG2 4.39Å; L581-I591 HydrophobicContact CG-CB 4.32Å; L581-I591 HydrophobicContact CG-CG2 4.48Å; L581-I614 HydrophobicContact CD2-CD1 3.96Å; L581-K615 CarbonylContact C-O 3.47Å; L581-K615 WeakPolarHBondContact CA-O 3.46Å; L581-V616 HydrophobicContact CD2-CG2 3.7Å; L581-V616 HydrophobicContact CG-CG2 4.47Å
582	D	90.9	Very high	83.9	Confident	32 Å²	32	60.4 Å²	60.4	17%	0.171	31%	0.307	C	S	.	.			trans	-69.5	172	169.3	78.7	-45	0	0	0	112.3	V584 G585 Q586 K615	D582-V584 PolarHBondContact O-N 2.8Å; D582-V584 WeakPolarHBondContact OD2-CB 3.19Å; D582-V584 PolarHBondContact OD2-N 2.86Å; D582-G585 PolarHBondContact O-N 3.31Å; D582-G585 PolarHBondContact OD1-N 2.94Å; D582-Q586 VanDerWaalsContact O-CG 3.31Å; D582-Q586 WeakPolarHBondContact O-CG 3.3Å; D582-Q586 PolarHBondContact O-N 2.87Å; D582-K615 HydrophobicContact CB-CB 3.97Å; D582-K615 PolarHBondContact N-O 3.2Å; D582-K615 PolarHBondContact OD1-N 3.33Å
583	Y	88.8	Confident	85.2	Confident	166 Å²	166	62.7 Å²	62.7	65%	0.651	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-31.9	-176.1	-178.9	-104	0	0	0	113
584	V	87.2	Confident	86.6	Confident	49 Å²	49	61.1 Å²	61.1	30%	0.297	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-49.4	175.9	-175.9	0	0	0	0	109.7	D582 Q586 R587	D582-V584 PolarHBondContact O-N 2.8Å; D582-V584 WeakPolarHBondContact OD2-CB 3.19Å; D582-V584 PolarHBondContact OD2-N 2.86Å; V584-Q586 VanDerWaalsContact C-N 3.32Å; V584-Q586 PolarHBondContact O-N 2.84Å; V584-R587 WeakPolarHBondContact O-CB 3.39Å; V584-R587 PolarHBondContact O-N 2.96Å; V584-R587 VanDerWaalsContact O-N 3.15Å
585	G	86.7	Confident	87.6	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-57.6	-39.7	177	0	0	0	0	0	113.9	D582 R587 H588 F589	D582-G585 PolarHBondContact O-N 3.31Å; D582-G585 PolarHBondContact OD1-N 2.94Å; G585-R587 PolarHBondContact O-N 2.82Å; G585-R587 VanDerWaalsContact O-N 3.08Å; G585-H588 PolarHBondContact O-N 3.17Å; G585-F589 WeakPolarHBondContact O-CA 3.36Å; G585-F589 VanDerWaalsContact O-CB 3.28Å; G585-F589 WeakPolarHBondContact O-CB 3.29Å; G585-F589 WeakPolarHBondContact O-CD2 3.47Å; G585-F589 PolarHBondContact O-N 2.84Å
586	Q	91.5	Very high	87.8	Confident	117 Å²	117	68.2 Å²	68.2	55%	0.547	31%	0.312	S	S	.	.	H	α-helix	trans	-64.3	-14.5	179.8	-70.7	174.5	19.3	0	0	114.6	L581 D582 V584	L581-Q586 HydrophobicContact CB-CG 3.99Å; L581-Q586 PolarHBondContact O-NE2 3.12Å; D582-Q586 VanDerWaalsContact O-CG 3.31Å; D582-Q586 WeakPolarHBondContact O-CG 3.3Å; D582-Q586 PolarHBondContact O-N 2.87Å; V584-Q586 VanDerWaalsContact C-N 3.32Å; V584-Q586 PolarHBondContact O-N 2.84Å
587	R	91.6	Very high	88.1	Confident	134 Å²	134	67.2 Å²	67.2	51%	0.506	30%	0.302	S	S	.	.	H	α-helix	trans	-67	-47.1	179.3	-68.8	180	174.3	-165.5	-2.9	112	V584 G585 K604	V584-R587 WeakPolarHBondContact O-CB 3.39Å; V584-R587 PolarHBondContact O-N 2.96Å; V584-R587 VanDerWaalsContact O-N 3.15Å; G585-R587 PolarHBondContact O-N 2.82Å; G585-R587 VanDerWaalsContact O-N 3.08Å; R587-K604 VanDerWaalsContact O-CD 3.29Å; R587-K604 WeakPolarHBondContact O-CD 3.37Å; R587-K604 WeakPolarHBondContact O-CE 3.45Å; R587-K604 PolarHBondContact O-NZ 3.05Å
588	H	91	Very high	88.2	Confident	46 Å²	46	67 Å²	67	21%	0.213	30%	0.301	C	S	.	.	H	α-helix	trans	-119.8	-17.2	-171.5	-62	-84.6	0	0	0	113.8	G585 L602 V603 K604 P605 I606	G585-H588 PolarHBondContact O-N 3.17Å; H588-L602 HydrophobicContact CB-CD1 4.03Å; H588-V603 VanDerWaalsContact O-CG2 3.3Å; H588-V603 WeakPolarHBondContact O-CG2 3.37Å; H588-V603 PolarHBondContact O-N 3.03Å; H588-K604 PolarHBondContact O-N 3.03Å; H588-K604 VanDerWaalsContact O-N 3.09Å; H588-P605 PolarHBondContact CE1-O 3.28Å; H588-P605 PolarHBondContact ND1-O 3Å; H588-P605 VanDerWaalsContact ND1-O 3.09Å; H588-I606 HydrophobicContact CB-CD1 3.89Å; H588-I606 HydrophobicContact CB-CG1 3.87Å
589	F	93.4	Very high	88.3	Confident	8 Å²	8	65 Å²	65	4%	0.035	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	153.7	-174.1	-52	-90.3	0	0	0	111.6	V564 L581 G585 V600 Q601 L602 I606 I614 I637	V564-F589 HydrophobicContact CG1-CE1 4.35Å; V564-F589 HydrophobicContact CG2-CD1 4.08Å; V564-F589 HydrophobicContact CG2-CE1 3.82Å; L581-F589 HydrophobicContact CD1-CB 4.03Å; G585-F589 WeakPolarHBondContact O-CA 3.36Å; G585-F589 VanDerWaalsContact O-CB 3.28Å; G585-F589 WeakPolarHBondContact O-CB 3.29Å; G585-F589 WeakPolarHBondContact O-CD2 3.47Å; G585-F589 PolarHBondContact O-N 2.84Å; F589-V600 HydrophobicContact CB-CG1 4.07Å; F589-V600 HydrophobicContact CD1-CG1 4.07Å; F589-V600 HydrophobicContact CG-CG1 4.3Å; F589-Q601 CarbonylContact C-O 3.56Å; F589-Q601 WeakPolarHBondContact CA-O 3.3Å; F589-L602 HydrophobicContact CD1-CB 4.04Å; F589-L602 HydrophobicContact CD1-CD1 3.81Å; F589-L602 HydrophobicContact CE1-CB 3.93Å; F589-L602 HydrophobicContact CE1-CD1 3.29Å; F589-L602 HydrophobicContact CE1-CG 4.19Å; F589-L602 HydrophobicContact CE2-CD1 4.31Å; F589-L602 HydrophobicContact CG-CD1 4.49Å; F589-L602 HydrophobicContact CZ-CD1 3.57Å; F589-I606 HydrophobicContact CE2-CD1 3.86Å; F589-I606 HydrophobicContact CZ-CD1 3.55Å; F589-I614 HydrophobicContact CD2-CD1 4.18Å; F589-I614 HydrophobicContact CD2-CG2 4.07Å; F589-I614 HydrophobicContact CE2-CG2 4Å; F589-I614 HydrophobicContact CG-CD1 4.24Å; F589-I637 HydrophobicContact CD1-CD1 4.33Å; F589-I637 HydrophobicContact CE1-CD1 3.52Å; F589-I637 HydrophobicContact CE2-CD1 3.8Å; F589-I637 HydrophobicContact CZ-CD1 3.22Å; F589-I637 HydrophobicContact CZ-CG1 4.47Å; F589-I637 HydrophobicContact CZ-CG2 4.31Å
590	R	93.6	Very high	88.3	Confident	117 Å²	117	64.5 Å²	64.5	44%	0.442	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	160.1	163.6	72.2	174.8	-177.3	153.3	2.8	109.1	Q601 V603	R590-Q601 HydrophobicContact CG-CB 4.09Å; R590-Q601 PolarHBondContact N-O 3.21Å; R590-Q601 PolarHBondContact O-N 3.38Å; R590-V603 HydrophobicContact CB-CG1 4.39Å; R590-V603 HydrophobicContact CB-CG2 4.33Å; R590-V603 HydrophobicContact CG-CG1 3.62Å; R590-V603 HydrophobicContact CG-CG2 4.43Å
591	I	92.2	Very high	88.4	Confident	42 Å²	42	62.1 Å²	62.1	22%	0.215	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	130.6	171.5	-167.3	149	0	0	0	109.8	Y579 L581 I599 V600 V616	Y579-I591 VanDerWaalsContact CB-CD1 3.42Å; Y579-I591 HydrophobicContact CD1-CD1 4.25Å; Y579-I591 HydrophobicContact CG-CD1 4.07Å; L581-I591 HydrophobicContact CD1-CB 4.06Å; L581-I591 HydrophobicContact CD1-CG2 4.39Å; L581-I591 HydrophobicContact CG-CB 4.32Å; L581-I591 HydrophobicContact CG-CG2 4.48Å; I591-I599 CarbonylContact C-O 3.55Å; I591-I599 WeakPolarHBondContact CA-O 3.29Å; I591-V600 HydrophobicContact CD1-CG2 4.02Å; I591-V616 HydrophobicContact CD1-CG1 3.68Å; I591-V616 HydrophobicContact CD1-CG2 4.42Å
592	V	91.4	Very high	88.3	Confident	41 Å²	41	61.6 Å²	61.6	25%	0.248	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	129.4	173.6	-179.7	0	0	0	0	107.5	I599	V592-I599 PolarHBondContact N-O 2.9Å; V592-I599 PolarHBondContact O-N 3.1Å
593	Q	85.6	Confident	88.3	Confident	89 Å²	89	62.5 Å²	62.5	42%	0.416	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	125.7	-178	-176.6	177	-29.5	0	0	111.2	V577 Y579 R595 I597	V577-Q593 VanDerWaalsContact O-CD 3.29Å; V577-Q593 PolarHBondContact O-NE2 2.76Å; V577-Q593 PolarHBondContact O-OE1 2.83Å; Y579-Q593 HydrophobicContact CD2-CG 3.99Å; Y579-Q593 HydrophobicContact CE2-CG 4.17Å; Q593-R595 PolarHBondContact NE2-O 3.46Å; Q593-R595 VanDerWaalsContact NE2-O 3.1Å; Q593-I597 WeakPolarHBondContact CA-O 3.36Å
594	E	83	Confident	88.4	Confident	102 Å²	102	59.9 Å²	59.9	48%	0.477	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	96.5	173.6	-68.5	-177.9	-176.3	0	0	109.1	N596 I597 I599	E594-N596 PolarHBondContact O-N 2.86Å; E594-I597 PolarHBondContact N-O 3.04Å; E594-I597 WeakPolarHBondContact O-CB 3.33Å; E594-I597 PolarHBondContact O-N 2.83Å; E594-I599 HydrophobicContact CG-CD1 4.09Å
595	R	80.3	Confident	88.4	Confident	230 Å²	230	60 Å²	60	87%	0.868	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	-108.7	-175.2	-56.6	177.5	-179.1	177.4	1.1	111.8	Q593	Q593-R595 PolarHBondContact NE2-O 3.46Å; Q593-R595 VanDerWaalsContact NE2-O 3.1Å
596	N	79	Confident	88.5	Confident	52 Å²	52	60.5 Å²	60.5	28%	0.278	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	15.4	178.9	66	-45.3	0	0	0	112.5	T569 Y579 E594	T569-N596 PolarHBondContact N-O 3.25Å; T569-N596 VanDerWaalsContact N-O 3.17Å; T569-N596 PolarHBondContact O-ND2 3.4Å; T569-N596 PolarHBondContact OG1-O 2.97Å; Y579-N596 VanDerWaalsContact OH-C 3.31Å; Y579-N596 PolarHBondContact OH-O 3.42Å; E594-N596 PolarHBondContact O-N 2.86Å
597	I	82.9	Confident	88.1	Confident	36 Å²	36	59.5 Å²	59.5	19%	0.185	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	128.6	179.7	-53.3	178.3	0	0	0	109.7	R566 I567 V568 Q593 E594 I599	R566-I597 HydrophobicContact CG-CG2 3.55Å; I567-I597 CarbonylContact O-C 3.25Å; I567-I597 WeakPolarHBondContact O-CA 3.41Å; V568-I597 HydrophobicContact CG2-CG1 4.29Å; V568-I597 HydrophobicContact CG2-CG2 4.39Å; Q593-I597 WeakPolarHBondContact CA-O 3.36Å; E594-I597 PolarHBondContact N-O 3.04Å; E594-I597 WeakPolarHBondContact O-CB 3.33Å; E594-I597 PolarHBondContact O-N 2.83Å; I597-I599 HydrophobicContact CG2-CG1 4.06Å
598	G	85.4	Confident	87.5	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	116.7	170.2	0	0	0	0	0	110.5	I567	I567-G598 PolarHBondContact N-O 2.88Å; I567-G598 PolarHBondContact O-N 3.33Å
599	I	88.4	Confident	87	Confident	2 Å²	2	56.2 Å²	56.2	1%	0.01	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	111.7	-179.7	-53.9	176.3	0	0	0	108.9	E563 S565 I591 V592 E594 I597 Q601	E563-I599 HydrophobicContact CB-CG2 4.35Å; E563-I599 HydrophobicContact CG-CG2 3.66Å; S565-I599 CarbonylContact O-C 3.45Å; S565-I599 WeakPolarHBondContact O-CA 3.45Å; I591-I599 CarbonylContact C-O 3.55Å; I591-I599 WeakPolarHBondContact CA-O 3.29Å; V592-I599 PolarHBondContact N-O 2.9Å; V592-I599 PolarHBondContact O-N 3.1Å; E594-I599 HydrophobicContact CG-CD1 4.09Å; I597-I599 HydrophobicContact CG2-CG1 4.06Å; I599-Q601 HydrophobicContact CG2-CG 4Å
600	V	90.3	Very high	86.5	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	122.6	175.2	-177.6	0	0	0	0	108.6	V564 S565 I567 F589 I591 I614 V616 I635	V564-V600 PolarHBondContact N-O 2.87Å; S565-V600 PolarHBondContact N-O 2.97Å; S565-V600 PolarHBondContact O-N 2.87Å; I567-V600 HydrophobicContact CD1-CG2 4.27Å; F589-V600 HydrophobicContact CB-CG1 4.07Å; F589-V600 HydrophobicContact CD1-CG1 4.07Å; F589-V600 HydrophobicContact CG-CG1 4.3Å; I591-V600 HydrophobicContact CD1-CG2 4.02Å; V600-I614 HydrophobicContact CG1-CD1 3.87Å; V600-V616 HydrophobicContact CG2-CG2 4.06Å; V600-I635 HydrophobicContact CG2-CD1 3.9Å
601	Q	91.5	Very high	86	Confident	29 Å²	29	55.7 Å²	55.7	14%	0.136	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	131.9	-178.3	-64.1	-177.1	-23.8	0	0	111.8	P561 I562 F589 R590 I599	P561-Q601 HydrophobicContact CB-CB 4.1Å; I562-Q601 CarbonylContact O-C 3.26Å; I562-Q601 WeakPolarHBondContact O-CA 3.32Å; F589-Q601 CarbonylContact C-O 3.56Å; F589-Q601 WeakPolarHBondContact CA-O 3.3Å; R590-Q601 HydrophobicContact CG-CB 4.09Å; R590-Q601 PolarHBondContact N-O 3.21Å; R590-Q601 PolarHBondContact O-N 3.38Å; I599-Q601 HydrophobicContact CG2-CG 4Å
602	L	89.9	Confident	85.6	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.005	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	122.8	169.7	-174.2	73.1	0	0	0	109.2	I558 P561 I562 V564 H588 F589 K604 I606	I558-L602 HydrophobicContact CD1-CB 4.47Å; I558-L602 HydrophobicContact CD1-CD2 3.69Å; I558-L602 HydrophobicContact CD1-CG 3.58Å; P561-L602 WeakPolarHBondContact CA-O 3.48Å; I562-L602 HydrophobicContact CB-CB 4.31Å; I562-L602 PolarHBondContact N-O 2.79Å; I562-L602 VanDerWaalsContact N-O 3.1Å; I562-L602 PolarHBondContact O-N 3.03Å; V564-L602 HydrophobicContact CG2-CB 3.72Å; H588-L602 HydrophobicContact CB-CD1 4.03Å; F589-L602 HydrophobicContact CD1-CB 4.04Å; F589-L602 HydrophobicContact CD1-CD1 3.81Å; F589-L602 HydrophobicContact CE1-CB 3.93Å; F589-L602 HydrophobicContact CE1-CD1 3.29Å; F589-L602 HydrophobicContact CE1-CG 4.19Å; F589-L602 HydrophobicContact CE2-CD1 4.31Å; F589-L602 HydrophobicContact CG-CD1 4.49Å; F589-L602 HydrophobicContact CZ-CD1 3.57Å; L602-K604 VanDerWaalsContact CD1-O 3.29Å; L602-K604 WeakPolarHBondContact CD1-O 3.43Å; L602-I606 HydrophobicContact CD1-CD1 3.69Å; L602-I606 HydrophobicContact CD1-CG1 4.06Å
603	V	91.7	Very high	85.4	Confident	51 Å²	51	57.6 Å²	57.6	31%	0.309	30%	0.304	S	S	.	.			trans	-123.9	-14.6	-177	-70.1	0	0	0	0	113.8	P561 H588 R590	P561-V603 HydrophobicContact CB-CG1 3.99Å; P561-V603 HydrophobicContact CG-CG1 4.21Å; H588-V603 VanDerWaalsContact O-CG2 3.3Å; H588-V603 WeakPolarHBondContact O-CG2 3.37Å; H588-V603 PolarHBondContact O-N 3.03Å; R590-V603 HydrophobicContact CB-CG1 4.39Å; R590-V603 HydrophobicContact CB-CG2 4.33Å; R590-V603 HydrophobicContact CG-CG1 3.62Å; R590-V603 HydrophobicContact CG-CG2 4.43Å
604	K	89.9	Confident	85.6	Confident	112 Å²	112	53.4 Å²	53.4	49%	0.487	29%	0.285	S	S	.	.	S	Bend	trans	-126.2	141.5	168.1	-55	-171	-163.1	142.5	0	110.2	R587 H588 L602	R587-K604 VanDerWaalsContact O-CD 3.29Å; R587-K604 WeakPolarHBondContact O-CD 3.37Å; R587-K604 WeakPolarHBondContact O-CE 3.45Å; R587-K604 PolarHBondContact O-NZ 3.05Å; H588-K604 PolarHBondContact O-N 3.03Å; H588-K604 VanDerWaalsContact O-N 3.09Å; L602-K604 VanDerWaalsContact CD1-O 3.29Å; L602-K604 WeakPolarHBondContact CD1-O 3.43Å
605	P	87.7	Confident	85.9	Confident	51 Å²	51	52.3 Å²	52.3	33%	0.331	28%	0.278	S	S	.	.			trans	-60.8	150.1	-179.3	24.4	-32.8	0	0	0	111.5	L555 I558 H588	L555-P605 HydrophobicContact CB-CB 4.49Å; L555-P605 WeakPolarHBondContact O-CB 3.45Å; I558-P605 HydrophobicContact CG1-CB 4.39Å; H588-P605 PolarHBondContact CE1-O 3.28Å; H588-P605 PolarHBondContact ND1-O 3Å; H588-P605 VanDerWaalsContact ND1-O 3.09Å
606	I	87.2	Confident	86.3	Confident	11 Å²	11	41.3 Å²	41.3	6%	0.056	24%	0.237	C	C	.	.			trans	-121.1	127	169.8	-54	166.6	0	0	0	106.7	S554 H588 F589 L602 V639	S554-I606 PolarHBondContact OG-O 2.75Å; H588-I606 HydrophobicContact CB-CD1 3.89Å; H588-I606 HydrophobicContact CB-CG1 3.87Å; F589-I606 HydrophobicContact CE2-CD1 3.86Å; F589-I606 HydrophobicContact CZ-CD1 3.55Å; L602-I606 HydrophobicContact CD1-CD1 3.69Å; L602-I606 HydrophobicContact CD1-CG1 4.06Å; I606-V639 HydrophobicContact CB-CG1 4.33Å; I606-V639 HydrophobicContact CB-CG2 4.01Å; I606-V639 HydrophobicContact CD1-CG2 4.34Å; I606-V639 HydrophobicContact CG2-CB 4.46Å; I606-V639 HydrophobicContact CG2-CG1 4.38Å; I606-V639 HydrophobicContact CG2-CG2 3.72Å; I606-V639 WeakPolarHBondContact O-CG1 3.46Å
607	S	83.6	Confident	86.8	Confident	96 Å²	96	41.4 Å²	41.4	67%	0.671	24%	0.237	S	C	*	.			trans	-84	117.8	175.1	-58.7	0	0	0	0	108.8	T610	S607-T610 PolarHBondContact O-OG1 2.68Å
608	G	78.4	Confident	87	Confident	21 Å²	21	39.9 Å²	39.9	22%	0.216	23%	0.23	C	C	.	.	S	Bend	trans	-86.5	-179.9	174	0	0	0	0	0	112.5	S554 S640	S554-G608 PolarHBondContact OG-N 2.84Å; G608-S640 VanDerWaalsContact CA-O 3.28Å; G608-S640 WeakPolarHBondContact CA-O 3.15Å
609	P	80.8	Confident	87.1	Confident	89 Å²	89	42 Å²	42	58%	0.578	24%	0.239	S	C	*	.	S	Bend	cis	-81.4	117.4	-0.3	30.5	-30	0	0	0	111.5	K641	P609-K641 HydrophobicContact CB-CB 3.94Å; P609-K641 HydrophobicContact CB-CG 4.31Å; P609-K641 HydrophobicContact CG-CB 4.23Å; P609-K641 HydrophobicContact CG-CG 4.03Å
610	T	83.8	Confident	86.8	Confident	52 Å²	52	42 Å²	42	32%	0.319	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	161.3	179.4	56.2	0	0	0	0	110.7	S607 V639	S607-T610 PolarHBondContact O-OG1 2.68Å; T610-V639 PolarHBondContact O-N 2.91Å
611	V	82.1	Confident	86.4	Confident	62 Å²	62	44.6 Å²	44.6	38%	0.376	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	123.1	170.5	-178.8	0	0	0	0	107.4	E636 I637	V611-E636 HydrophobicContact CG1-CG 3.4Å; V611-E636 VanDerWaalsContact CG1-CG 3.4Å; V611-I637 CarbonylContact C-O 3.55Å; V611-I637 WeakPolarHBondContact CA-O 3.46Å
612	E	85.1	Confident	85.8	Confident	58 Å²	58	44 Å²	44	27%	0.271	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	128.7	178	-71.6	-70.8	165	0	0	108.8	I637	E612-I637 PolarHBondContact N-O 3.22Å; E612-I637 PolarHBondContact O-N 3.49Å
613	T	86.2	Confident	85.1	Confident	66 Å²	66	53.6 Å²	53.6	41%	0.405	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	122.8	173.6	-51.5	0	0	0	0	108.7	I634 I635	T613-I634 HydrophobicContact CG2-CG2 3.71Å; T613-I635 WeakPolarHBondContact CA-O 3.45Å
614	I	90.5	Very high	84.5	Confident	0 Å²	0	57 Å²	57	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	153.6	178.7	67.2	169.6	0	0	0	110.3	L581 F589 V600 I635 I637	L581-I614 HydrophobicContact CD2-CD1 3.96Å; F589-I614 HydrophobicContact CD2-CD1 4.18Å; F589-I614 HydrophobicContact CD2-CG2 4.07Å; F589-I614 HydrophobicContact CE2-CG2 4Å; F589-I614 HydrophobicContact CG-CD1 4.24Å; V600-I614 HydrophobicContact CG1-CD1 3.87Å; I614-I635 HydrophobicContact CD1-CB 4.26Å; I614-I635 HydrophobicContact CD1-CD1 4.21Å; I614-I635 HydrophobicContact CG1-CB 3.74Å; I614-I635 HydrophobicContact CG1-CD1 4.43Å; I614-I635 HydrophobicContact CG1-CG1 4.42Å; I614-I635 PolarHBondContact N-O 3.46Å; I614-I635 PolarHBondContact O-N 2.59Å; I614-I637 HydrophobicContact CD1-CD1 3.64Å; I614-I637 HydrophobicContact CG1-CD1 3.95Å; I614-I637 HydrophobicContact CG2-CD1 4.43Å
615	K	88.8	Confident	83.9	Confident	79 Å²	79	53.7 Å²	53.7	34%	0.343	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	136.7	178.4	-66.7	177.4	156.4	-127	0	110.8	L581 D582 E632 A633 I634	L581-K615 CarbonylContact C-O 3.47Å; L581-K615 WeakPolarHBondContact CA-O 3.46Å; D582-K615 HydrophobicContact CB-CB 3.97Å; D582-K615 PolarHBondContact N-O 3.2Å; D582-K615 PolarHBondContact OD1-N 3.33Å; K615-E632 WeakPolarHBondContact CD-OE1 3.42Å; K615-E632 IonicContact NZ-OE1 2.83Å; K615-E632 PolarHBondContact NZ-OE1 3.44Å; K615-E632 IonicContact NZ-OE2 3.17Å; K615-E632 PolarHBondContact NZ-OE2 2.74Å; K615-E632 VanDerWaalsContact NZ-OE2 3.17Å; K615-A633 CarbonylContact C-O 3.56Å; K615-A633 WeakPolarHBondContact CA-O 3.34Å; K615-I634 HydrophobicContact CG-CG1 4.37Å
616	V	90.1	Very high	83.5	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	113.9	173.7	-174.6	0	0	0	0	108.4	I567 Y579 N580 L581 I591 V600 I618 E632 A633 I635	I567-V616 HydrophobicContact CD1-CB 3.96Å; I567-V616 HydrophobicContact CD1-CG1 3.99Å; I567-V616 HydrophobicContact CD1-CG2 3.86Å; Y579-V616 HydrophobicContact CD1-CG1 4.12Å; N580-V616 CarbonylContact O-C 3.54Å; N580-V616 WeakPolarHBondContact O-CA 3.31Å; L581-V616 HydrophobicContact CD2-CG2 3.7Å; L581-V616 HydrophobicContact CG-CG2 4.47Å; I591-V616 HydrophobicContact CD1-CG1 3.68Å; I591-V616 HydrophobicContact CD1-CG2 4.42Å; V600-V616 HydrophobicContact CG2-CG2 4.06Å; V616-I618 HydrophobicContact CG1-CG1 4.17Å; V616-E632 CarbonylContact O-C 3.57Å; V616-E632 WeakPolarHBondContact O-CA 3.34Å; V616-A633 HydrophobicContact CB-CB 4.21Å; V616-A633 PolarHBondContact N-O 2.86Å; V616-A633 PolarHBondContact O-N 2.74Å; V616-I635 HydrophobicContact CG2-CD1 4.29Å
617	N	88.6	Confident	83.1	Confident	53 Å²	53	58 Å²	58	28%	0.283	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	128	172.2	-59.5	-73.9	0	0	0	109.3	Y579 N580	Y579-N617 WeakPolarHBondContact CA-O 3.28Å; N580-N617 HydrophobicContact CB-CB 4.47Å; N580-N617 PolarHBondContact N-O 3.42Å; N580-N617 PolarHBondContact O-N 3.12Å
618	I	87.7	Confident	82.5	Confident	5 Å²	5	57 Å²	57	3%	0.026	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	113.3	-172.5	-52.3	170.1	0	0	0	108.3	I567 T569 V577 D578 Y579 V616 F630 N631 A633	I567-I618 HydrophobicContact CG2-CD1 3.73Å; T569-I618 HydrophobicContact CG2-CG2 3.83Å; V577-I618 HydrophobicContact CG1-CG2 3.55Å; D578-I618 CarbonylContact O-C 3.54Å; D578-I618 WeakPolarHBondContact O-CA 3.07Å; Y579-I618 HydrophobicContact CD1-CB 4.47Å; Y579-I618 HydrophobicContact CD1-CD1 4.35Å; Y579-I618 HydrophobicContact CD1-CG1 3.81Å; Y579-I618 HydrophobicContact CD1-CG2 4.18Å; Y579-I618 HydrophobicContact CE1-CD1 4.14Å; Y579-I618 HydrophobicContact CE1-CG1 3.99Å; Y579-I618 HydrophobicContact CE1-CG2 3.85Å; V616-I618 HydrophobicContact CG1-CG1 4.17Å; I618-F630 CarbonylContact O-C 3.57Å; I618-N631 WeakPolarHBondContact CA-O 3.4Å; I618-N631 HydrophobicContact CB-CB 3.94Å; I618-N631 WeakPolarHBondContact CB-O 3.48Å; I618-N631 HydrophobicContact CD1-CB 4.44Å; I618-N631 HydrophobicContact CG2-CB 4.38Å; I618-N631 PolarHBondContact N-O 2.96Å; I618-N631 PolarHBondContact O-N 3.08Å; I618-A633 HydrophobicContact CD1-CB 4.2Å
619	H	86.4	Confident	82.3	Confident	44 Å²	44	56.2 Å²	56.2	20%	0.204	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	118.7	-178.6	-61.9	170.6	0	0	0	110.2	V577 D578 I627 F630	V577-H619 CarbonylContact C-O 3.49Å; V577-H619 WeakPolarHBondContact CA-O 3.09Å; D578-H619 PolarHBondContact N-O 2.05Å; D578-H619 PolarHBondContact O-N 3.28Å; H619-I627 HydrophobicContact CB-CG2 4.38Å; H619-F630 AromaticContact CD2-CD1 3.46Å; H619-F630 VanDerWaalsContact CD2-CD1 3.46Å; H619-F630 WeakPolarHBondContact CD2-CD1 3.49Å; H619-F630 AromaticContact NE2-CD1 3.46Å; H619-F630 WeakPolarHBondContact NE2-CD1 3.45Å; H619-F630 AromaticContact NE2-CE1 3.87Å
620	T	82.4	Confident	82.3	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.006	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	130.1	171.3	-54.7	0	0	0	0	109.7	M571 F575 S576 V577 I627 L628 A629	M571-T620 HydrophobicContact CB-CG2 4.27Å; M571-T620 HydrophobicContact CE-CG2 3.6Å; M571-T620 WeakPolarHBondContact CE-OG1 3.29Å; M571-T620 HydrophobicContact SD-CG2 3.95Å; F575-T620 HydrophobicContact CB-CG2 4.01Å; S576-T620 CarbonylContact O-C 3.53Å; V577-T620 HydrophobicContact CG2-CG2 4.34Å; T620-I627 CarbonylContact O-C 3.47Å; T620-I627 WeakPolarHBondContact O-CA 3.49Å; T620-L628 PolarHBondContact O-N 2.74Å; T620-A629 PolarHBondContact N-O 2.79Å; T620-A629 PolarHBondContact O-N 3.08Å
621	K	82.4	Confident	82.1	Confident	55 Å²	55	53 Å²	53	24%	0.239	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	146.6	-177.9	-65.5	176.4	174.8	174.1	0	111.8	F575 S576 D578 V626 I627	F575-K621 WeakPolarHBondContact CA-O 3.17Å; F575-K621 WeakPolarHBondContact CB-O 3.34Å; S576-K621 PolarHBondContact N-O 2.9Å; S576-K621 PolarHBondContact O-N 3.11Å; D578-K621 WeakPolarHBondContact OD2-CD 3.16Å; D578-K621 WeakPolarHBondContact OD2-CE 3.4Å; D578-K621 IonicContact OD2-NZ 2.59Å; D578-K621 PolarHBondContact OD2-NZ 3.04Å; K621-V626 CarbonylContact C-O 3.31Å; K621-V626 VanDerWaalsContact CA-O 3.27Å; K621-V626 WeakPolarHBondContact CA-O 3.47Å; K621-I627 HydrophobicContact CG-CG1 4.03Å
622	S	79.3	Confident	82.2	Confident	18 Å²	18	51.4 Å²	51.4	13%	0.126	27%	0.268	C	S	.	.			trans	-70.9	169.2	169	64.3	0	0	0	0	112.2	T624 G625 V626	S622-T624 PolarHBondContact O-N 2.79Å; S622-T624 VanDerWaalsContact O-N 3.09Å; S622-T624 PolarHBondContact OG-OG1 2.88Å; S622-T624 VanDerWaalsContact OG-OG1 3.08Å; S622-G625 PolarHBondContact O-N 2.78Å; S622-V626 PolarHBondContact N-O 3.19Å; S622-V626 WeakPolarHBondContact OG-CB 3.46Å; S622-V626 PolarHBondContact OG-N 2.84Å; S622-V626 VanDerWaalsContact OG-N 3.12Å; S622-V626 PolarHBondContact OG-O 3.17Å
623	R	74.8	Confident	82	Confident	201 Å²	201	48.7 Å²	48.7	76%	0.758	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-25.2	172.6	-72.7	-175.2	176.2	167	3.9	114	P574	P574-R623 HydrophobicContact CB-CG 3.84Å; P574-R623 VanDerWaalsContact CB-CZ 3.48Å; P574-R623 WeakPolarHBondContact O-CG 3.34Å
624	T	79	Confident	81.9	Confident	122 Å²	122	47 Å²	47	75%	0.748	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.1	5.5	178.7	55.2	0	0	0	0	112.8	S622	S622-T624 PolarHBondContact O-N 2.79Å; S622-T624 VanDerWaalsContact O-N 3.09Å; S622-T624 PolarHBondContact OG-OG1 2.88Å; S622-T624 VanDerWaalsContact OG-OG1 3.08Å
625	G	76.3	Confident	81.5	Confident	43 Å²	43	47 Å²	47	44%	0.443	24%	0.243	S	C	.	.	S	Bend	trans	86.2	-1.6	176.4	0	0	0	0	0	115.4	S622	S622-G625 PolarHBondContact O-N 2.78Å
626	V	81	Confident	81.2	Confident	88 Å²	88	45.1 Å²	45.1	53%	0.533	24%	0.236	S	C	.	.			trans	-70	129.1	177.5	-178.8	0	0	0	0	110	K621 S622 L628	K621-V626 CarbonylContact C-O 3.31Å; K621-V626 VanDerWaalsContact CA-O 3.27Å; K621-V626 WeakPolarHBondContact CA-O 3.47Å; S622-V626 PolarHBondContact N-O 3.19Å; S622-V626 WeakPolarHBondContact OG-CB 3.46Å; S622-V626 PolarHBondContact OG-N 2.84Å; S622-V626 VanDerWaalsContact OG-N 3.12Å; S622-V626 PolarHBondContact OG-O 3.17Å; V626-L628 PolarHBondContact O-N 3.06Å
627	I	77.6	Confident	80.8	Confident	66 Å²	66	45.1 Å²	45.1	34%	0.338	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	123.8	176	-56.6	172.2	0	0	0	109.2	H619 T620 K621 F630	H619-I627 HydrophobicContact CB-CG2 4.38Å; T620-I627 CarbonylContact O-C 3.47Å; T620-I627 WeakPolarHBondContact O-CA 3.49Å; K621-I627 HydrophobicContact CG-CG1 4.03Å; I627-F630 HydrophobicContact CB-CE2 4.5Å; I627-F630 HydrophobicContact CB-CZ 4.15Å; I627-F630 HydrophobicContact CD1-CE1 3.98Å; I627-F630 HydrophobicContact CD1-CZ 3.98Å; I627-F630 HydrophobicContact CG2-CD1 4.29Å; I627-F630 HydrophobicContact CG2-CD2 4.12Å; I627-F630 HydrophobicContact CG2-CE1 3.85Å; I627-F630 HydrophobicContact CG2-CE2 3.68Å; I627-F630 HydrophobicContact CG2-CG 4.41Å; I627-F630 HydrophobicContact CG2-CZ 3.53Å
628	L	72.3	Confident	80.3	Confident	75 Å²	75	43 Å²	43	39%	0.393	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	-28.4	-177.5	-60.2	178.7	0	0	0	112.7	F575 T620 V626	F575-L628 HydrophobicContact CD1-CD1 3.4Å; F575-L628 HydrophobicContact CE1-CD1 3.4Å; F575-L628 HydrophobicContact CG-CD1 4.49Å; F575-L628 HydrophobicContact CZ-CD1 4.5Å; T620-L628 PolarHBondContact O-N 2.74Å; V626-L628 PolarHBondContact O-N 3.06Å
629	A	73.4	Confident	79.9	Confident	4 Å²	4	42.9 Å²	42.9	3%	0.033	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	144.2	178.8	0	0	0	0	0	110.7	M571 T620	M571-A629 HydrophobicContact CE-CB 3.98Å; T620-A629 PolarHBondContact N-O 2.79Å; T620-A629 PolarHBondContact O-N 3.08Å
630	F	79.8	Confident	79.3	Confident	60 Å²	60	41.1 Å²	41.1	26%	0.263	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	129.7	167.2	-58.1	-97.5	0	0	0	107.1	H541 T542 R543 I618 H619 I627	H541-F630 HydrophobicContact CB-CD2 3.48Å; H541-F630 VanDerWaalsContact CB-CD2 3.48Å; H541-F630 HydrophobicContact CB-CE2 3.78Å; H541-F630 HydrophobicContact CB-CG 4.27Å; H541-F630 WeakPolarHBondContact O-CB 3.39Å; H541-F630 WeakPolarHBondContact O-CD2 3.29Å; T542-F630 CarbonylContact C-O 3.58Å; T542-F630 WeakPolarHBondContact CA-O 3.34Å; T542-F630 WeakPolarHBondContact CG2-O 3.48Å; R543-F630 PolarHBondContact N-O 2.85Å; I618-F630 CarbonylContact O-C 3.57Å; H619-F630 AromaticContact CD2-CD1 3.46Å; H619-F630 VanDerWaalsContact CD2-CD1 3.46Å; H619-F630 WeakPolarHBondContact CD2-CD1 3.49Å; H619-F630 AromaticContact NE2-CD1 3.46Å; H619-F630 WeakPolarHBondContact NE2-CD1 3.45Å; H619-F630 AromaticContact NE2-CE1 3.87Å; I627-F630 HydrophobicContact CB-CE2 4.5Å; I627-F630 HydrophobicContact CB-CZ 4.15Å; I627-F630 HydrophobicContact CD1-CE1 3.98Å; I627-F630 HydrophobicContact CD1-CZ 3.98Å; I627-F630 HydrophobicContact CG2-CD1 4.29Å; I627-F630 HydrophobicContact CG2-CD2 4.12Å; I627-F630 HydrophobicContact CG2-CE1 3.85Å; I627-F630 HydrophobicContact CG2-CE2 3.68Å; I627-F630 HydrophobicContact CG2-CG 4.41Å; I627-F630 HydrophobicContact CG2-CZ 3.53Å
631	N	80.8	Confident	78.7	Confident	14 Å²	14	47.2 Å²	47.2	8%	0.075	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	154.3	174.5	-75.4	-8.6	0	0	0	107.8	E544 I618	E544-N631 PolarHBondContact N-OD1 2.91Å; E544-N631 CarbonylContact O-C 3.46Å; E544-N631 VanDerWaalsContact O-CA 3.3Å; E544-N631 WeakPolarHBondContact O-CA 3.05Å; E544-N631 PolarHBondContact OE2-ND2 3.43Å; I618-N631 WeakPolarHBondContact CA-O 3.4Å; I618-N631 HydrophobicContact CB-CB 3.94Å; I618-N631 WeakPolarHBondContact CB-O 3.48Å; I618-N631 HydrophobicContact CD1-CB 4.44Å; I618-N631 HydrophobicContact CG2-CB 4.38Å; I618-N631 PolarHBondContact N-O 2.96Å; I618-N631 PolarHBondContact O-N 3.08Å
632	E	83.1	Confident	77.9	Confident	28 Å²	28	47.3 Å²	47.3	13%	0.131	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	142.7	176.8	-169.8	179.5	-126.4	0	0	109.7	T542 E544 V545 L546 K615 V616 I634	T542-E632 HydrophobicContact CG2-CB 4.24Å; E544-E632 PolarHBondContact O-N 3.03Å; V545-E632 CarbonylContact C-O 3.59Å; V545-E632 VanDerWaalsContact CA-O 3.29Å; V545-E632 WeakPolarHBondContact CA-O 3.35Å; V545-E632 HydrophobicContact CG2-CB 4.43Å; L546-E632 PolarHBondContact N-O 2.89Å; K615-E632 WeakPolarHBondContact CD-OE1 3.42Å; K615-E632 IonicContact NZ-OE1 2.83Å; K615-E632 PolarHBondContact NZ-OE1 3.44Å; K615-E632 IonicContact NZ-OE2 3.17Å; K615-E632 PolarHBondContact NZ-OE2 2.74Å; K615-E632 VanDerWaalsContact NZ-OE2 3.17Å; V616-E632 CarbonylContact O-C 3.57Å; V616-E632 WeakPolarHBondContact O-CA 3.34Å; E632-I634 HydrophobicContact CG-CG1 4.36Å
633	A	82.5	Confident	77.1	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	125.9	163.4	0	0	0	0	0	110.5	L546 I567 K615 V616 I618	L546-A633 HydrophobicContact CB-CB 4.02Å; L546-A633 HydrophobicContact CD2-CB 4.15Å; L546-A633 HydrophobicContact CG-CB 4.4Å; L546-A633 CarbonylContact O-C 3.57Å; L546-A633 WeakPolarHBondContact O-CA 3.31Å; I567-A633 HydrophobicContact CD1-CB 3.76Å; I567-A633 HydrophobicContact CG1-CB 4.41Å; K615-A633 CarbonylContact C-O 3.56Å; K615-A633 WeakPolarHBondContact CA-O 3.34Å; V616-A633 HydrophobicContact CB-CB 4.21Å; V616-A633 PolarHBondContact N-O 2.86Å; V616-A633 PolarHBondContact O-N 2.74Å; I618-A633 HydrophobicContact CD1-CB 4.2Å
634	I	82.4	Confident	76.3	Confident	30 Å²	30	45.7 Å²	45.7	15%	0.154	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	122.3	175.9	-56.1	176.3	0	0	0	107.2	V545 L546 Y547 Q548 T613 K615 E632	V545-I634 HydrophobicContact CG1-CD1 4.03Å; V545-I634 HydrophobicContact CG1-CG1 4.28Å; L546-I634 PolarHBondContact O-N 2.99Å; Y547-I634 CarbonylContact C-O 3.39Å; Y547-I634 WeakPolarHBondContact CA-O 3.14Å; Y547-I634 HydrophobicContact CD2-CB 3.92Å; Y547-I634 HydrophobicContact CD2-CG2 3.8Å; Y547-I634 HydrophobicContact CE2-CG2 3.95Å; Q548-I634 PolarHBondContact N-O 3.47Å; T613-I634 HydrophobicContact CG2-CG2 3.71Å; K615-I634 HydrophobicContact CG-CG1 4.37Å; E632-I634 HydrophobicContact CG-CG1 4.36Å
635	I	84.1	Confident	76.2	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	116.8	-179.2	-48.4	172.6	0	0	0	108.5	Q548 R550 I567 V600 T613 I614 V616 I637	Q548-I635 HydrophobicContact CB-CG1 4.33Å; Q548-I635 HydrophobicContact CB-CG2 4.29Å; Q548-I635 CarbonylContact O-C 3.56Å; Q548-I635 VanDerWaalsContact O-CA 3.31Å; Q548-I635 WeakPolarHBondContact O-CA 3.33Å; R550-I635 HydrophobicContact CB-CG2 4.44Å; R550-I635 HydrophobicContact CG-CG2 3.92Å; I567-I635 HydrophobicContact CD1-CD1 4.37Å; V600-I635 HydrophobicContact CG2-CD1 3.9Å; T613-I635 WeakPolarHBondContact CA-O 3.45Å; I614-I635 HydrophobicContact CD1-CB 4.26Å; I614-I635 HydrophobicContact CD1-CD1 4.21Å; I614-I635 HydrophobicContact CG1-CB 3.74Å; I614-I635 HydrophobicContact CG1-CD1 4.43Å; I614-I635 HydrophobicContact CG1-CG1 4.42Å; I614-I635 PolarHBondContact N-O 3.46Å; I614-I635 PolarHBondContact O-N 2.59Å; V616-I635 HydrophobicContact CG2-CD1 4.29Å; I635-I637 HydrophobicContact CG2-CD1 4.26Å; I635-I637 HydrophobicContact CG2-CG1 3.82Å
636	E	80.4	Confident	76.2	Confident	41 Å²	41	41.8 Å²	41.8	19%	0.192	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	122.1	171.7	-169.3	175.2	133.3	0	0	109.6	Y547 Q548 F549 R550 V611	Y547-E636 PolarHBondContact OH-OE2 2.84Å; Q548-E636 PolarHBondContact O-N 2.54Å; F549-E636 CarbonylContact C-O 3.52Å; F549-E636 WeakPolarHBondContact CA-O 3.13Å; F549-E636 HydrophobicContact CD2-CB 3.94Å; F549-E636 HydrophobicContact CD2-CG 3.99Å; F549-E636 HydrophobicContact CE2-CG 4.1Å; F549-E636 WeakPolarHBondContact CE2-OE1 3.47Å; R550-E636 PolarHBondContact N-O 2.81Å; V611-E636 HydrophobicContact CG1-CG 3.4Å; V611-E636 VanDerWaalsContact CG1-CG 3.4Å
637	I	82.2	Confident	75.9	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	112.3	-171.2	-57.4	173.3	0	0	0	108.4	R550 V552 V564 F589 V611 E612 I614 I635	R550-I637 HydrophobicContact CB-CG1 4.46Å; R550-I637 CarbonylContact O-C 3.58Å; R550-I637 WeakPolarHBondContact O-CA 3.45Å; V552-I637 HydrophobicContact CB-CG2 4.48Å; V552-I637 HydrophobicContact CG1-CG2 4.21Å; V552-I637 HydrophobicContact CG2-CG2 3.48Å; V552-I637 VanDerWaalsContact CG2-CG2 3.48Å; V564-I637 HydrophobicContact CG1-CD1 3.91Å; V564-I637 HydrophobicContact CG1-CG1 4.26Å; F589-I637 HydrophobicContact CD1-CD1 4.33Å; F589-I637 HydrophobicContact CE1-CD1 3.52Å; F589-I637 HydrophobicContact CE2-CD1 3.8Å; F589-I637 HydrophobicContact CZ-CD1 3.22Å; F589-I637 HydrophobicContact CZ-CG1 4.47Å; F589-I637 HydrophobicContact CZ-CG2 4.31Å; V611-I637 CarbonylContact C-O 3.55Å; V611-I637 WeakPolarHBondContact CA-O 3.46Å; E612-I637 PolarHBondContact N-O 3.22Å; E612-I637 PolarHBondContact O-N 3.49Å; I614-I637 HydrophobicContact CD1-CD1 3.64Å; I614-I637 HydrophobicContact CG1-CD1 3.95Å; I614-I637 HydrophobicContact CG2-CD1 4.43Å; I635-I637 HydrophobicContact CG2-CD1 4.26Å; I635-I637 HydrophobicContact CG2-CG1 3.82Å
638	S	78.8	Confident	75.9	Confident	7 Å²	7	37.7 Å²	37.7	5%	0.049	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	122.6	175.4	-171.3	0	0	0	0	110.1	K500 R550 A551 V552	K500-S638 PolarHBondContact NZ-OG 2.83Å; R550-S638 PolarHBondContact O-N 3.44Å; A551-S638 WeakPolarHBondContact CA-O 3.29Å; V552-S638 PolarHBondContact N-O 3.24Å
639	V	79.9	Confident	76.1	Confident	4 Å²	4	35.4 Å²	35.4	2%	0.024	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	129.8	178.9	-170.5	0	0	0	0	109.6	V552 I606 T610	V552-V639 HydrophobicContact CG2-CB 4.42Å; V552-V639 HydrophobicContact CG2-CG2 3.84Å; V552-V639 WeakPolarHBondContact O-CA 3.49Å; I606-V639 HydrophobicContact CB-CG1 4.33Å; I606-V639 HydrophobicContact CB-CG2 4.01Å; I606-V639 HydrophobicContact CD1-CG2 4.34Å; I606-V639 HydrophobicContact CG2-CB 4.46Å; I606-V639 HydrophobicContact CG2-CG1 4.38Å; I606-V639 HydrophobicContact CG2-CG2 3.72Å; I606-V639 WeakPolarHBondContact O-CG1 3.46Å; T610-V639 PolarHBondContact O-N 2.91Å
640	S	72.1	Confident	76.3	Confident	6 Å²	6	37.5 Å²	37.5	4%	0.042	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	152.3	-179	66.1	0	0	0	0	112.6	L496 V552 P553 S554 G608 Y642	L496-S640 WeakPolarHBondContact O-CB 3.39Å; V552-S640 PolarHBondContact O-N 3.03Å; V552-S640 VanDerWaalsContact O-N 3.1Å; P553-S640 WeakPolarHBondContact CA-OG 3.27Å; S554-S640 WeakPolarHBondContact CB-O 3Å; S554-S640 PolarHBondContact N-OG 3.09Å; G608-S640 VanDerWaalsContact CA-O 3.28Å; G608-S640 WeakPolarHBondContact CA-O 3.15Å; S640-Y642 VanDerWaalsContact C-N 3.32Å; S640-Y642 PolarHBondContact OG-O 3.12Å
641	K	70.3	Confident	76	Confident	130 Å²	130	35.9 Å²	35.9	57%	0.565	17%	0.173	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-69.8	-32.1	172.7	-176.1	176.4	176.3	-174.4	0	112.5	P609	P609-K641 HydrophobicContact CB-CB 3.94Å; P609-K641 HydrophobicContact CB-CG 4.31Å; P609-K641 HydrophobicContact CG-CB 4.23Å; P609-K641 HydrophobicContact CG-CG 4.03Å
642	Y	65.9	Low	75.6	Confident	57 Å²	57	37.5 Å²	37.5	22%	0.224	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	130	-171.6	-59.6	-73	0	0	0	110.3	P462 P463 Y465 S640	P462-Y642 HydrophobicContact CB-CD1 4.04Å; P462-Y642 HydrophobicContact CB-CE1 4.29Å; P462-Y642 HydrophobicContact CB-CG 4.27Å; P463-Y642 WeakPolarHBondContact O-CE2 3.32Å; Y465-Y642 HydrophobicContact CE2-CD2 4.12Å; Y465-Y642 HydrophobicContact CE2-CG 4.45Å; S640-Y642 VanDerWaalsContact C-N 3.32Å; S640-Y642 PolarHBondContact OG-O 3.12Å
643	P	63.2	Low	75	Confident	76 Å²	76	38.3 Å²	38.3	49%	0.494	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	139.3	177.4	28.7	-32.5	0	0	0	110.8	S554	S554-P643 CarbonylContact O-C 3.54Å; S554-P643 WeakPolarHBondContact O-CA 3.43Å
644	F	58.5	Low	74.3	Confident	109 Å²	109	41.8 Å²	41.8	48%	0.478	20%	0.202	S	C	.	.			trans	-106	0	173.4	-112.5	-108.5	0	0	0	111.9	M447 Y465 P553 S554 L555	M447-F644 HydrophobicContact CE-CD1 3.84Å; M447-F644 HydrophobicContact CE-CE1 3.47Å; M447-F644 VanDerWaalsContact CE-CE1 3.47Å; M447-F644 HydrophobicContact CE-CZ 4.17Å; M447-F644 HydrophobicContact SD-CE1 4.35Å; Y465-F644 AromaticContact CD1-CE2 3.93Å; Y465-F644 HydrophobicContact CD1-CE2 3.93Å; Y465-F644 AromaticContact CD1-CZ 3.91Å; Y465-F644 HydrophobicContact CD1-CZ 3.91Å; Y465-F644 HydrophobicContact CE1-CD2 4.27Å; Y465-F644 AromaticContact CE1-CE2 3.09Å; Y465-F644 HydrophobicContact CE1-CE2 3.09Å; Y465-F644 AromaticContact CE1-CZ 3.33Å; Y465-F644 HydrophobicContact CE1-CZ 3.33Å; Y465-F644 HydrophobicContact CE2-CE2 4.25Å; Y465-F644 AromaticContact CZ-CE2 3.28Å; Y465-F644 WeakPolarHBondContact OH-CE2 3.21Å; P553-F644 HydrophobicContact CB-CB 3.87Å; S554-F644 PolarHBondContact O-N 3.08Å; L555-F644 HydrophobicContact CD2-CB 4.43Å; L555-F644 WeakPolarHBondContact CD2-O 3.43Å

Retrieved 644 of 644 residues in 479.2 ms (Link to these results)

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