A0A061ACF5_CAEEL Loading...

Fibulin-1

AlphaFold DB , UniProt , Accession A0A061ACF5, Species CAEEL (Caenorhabditis elegans), Gene fbl-1, Length 605 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	45.4	Very low	44.8	Very low	191 Å²	191	126.5 Å²	126.5	94%	0.941	63%	0.63	S	S	*	*				0	-52.6	0	-85.5	177.3	69.8	0	0	114	I3 C4 F5	M1-I3 PolarHBondContact O-N 2.87Å; M1-C4 PolarHBondContact O-N 3.37Å; M1-F5 PolarHBondContact O-N 3.48Å; M1-F5 VanDerWaalsContact O-N 3.15Å
2	R	43.1	Very low	45.4	Very low	220 Å²	220	121.8 Å²	121.8	83%	0.83	61%	0.613	S	S	*	*	H	α-helix	trans	-64.4	-32.6	179.3	-78.5	-176.9	174	179.7	-2.4	114.9	F5 L6	R2-F5 PolarHBondContact O-N 3.11Å; R2-L6 PolarHBondContact O-N 3.15Å; R2-L6 VanDerWaalsContact O-N 3.14Å
3	I	46.8	Very low	45.6	Very low	131 Å²	131	117.3 Å²	117.3	67%	0.672	61%	0.607	S	S	*	*	H	α-helix	trans	-70.5	-38.1	175.6	-63.1	169.8	0	0	0	111.4	M1 F5 L6 L7	M1-I3 PolarHBondContact O-N 2.87Å; I3-F5 VanDerWaalsContact C-N 3.34Å; I3-F5 PolarHBondContact O-N 2.91Å; I3-L6 PolarHBondContact O-N 2.82Å; I3-L7 HydrophobicContact CG2-CD1 3.95Å; I3-L7 WeakPolarHBondContact O-CB 3.46Å; I3-L7 PolarHBondContact O-N 3.39Å
4	C	41.9	Very low	45.8	Very low	80 Å²	80	117.3 Å²	117.3	54%	0.541	60%	0.602	S	S	.	*	H	α-helix	trans	-62.5	-38.6	171.3	-78.9	0	0	0	0	112.3	M1 L7 L8	M1-C4 PolarHBondContact O-N 3.37Å; C4-L7 PolarHBondContact O-N 2.91Å; C4-L8 VanDerWaalsContact O-CB 3.29Å; C4-L8 WeakPolarHBondContact O-CB 3.37Å; C4-L8 WeakPolarHBondContact O-CD1 3.3Å; C4-L8 PolarHBondContact O-N 3.13Å
5	F	43	Very low	46.3	Very low	150 Å²	150	114.9 Å²	114.9	66%	0.658	60%	0.596	S	S	*	*	H	α-helix	trans	-69.4	-37.3	-179.9	-103	-86.4	0	0	0	113.1	M1 R2 I3 A9	M1-F5 PolarHBondContact O-N 3.48Å; M1-F5 VanDerWaalsContact O-N 3.15Å; R2-F5 PolarHBondContact O-N 3.11Å; I3-F5 VanDerWaalsContact C-N 3.34Å; I3-F5 PolarHBondContact O-N 2.91Å; F5-A9 WeakPolarHBondContact O-CB 3.12Å; F5-A9 PolarHBondContact O-N 3.21Å
6	L	45.7	Very low	46.7	Very low	115 Å²	115	115.6 Å²	115.6	60%	0.602	59%	0.593	S	S	*	*	H	α-helix	trans	-70.4	-38.7	174	-84.9	155.5	0	0	0	112.1	R2 I3 A9 F10	R2-L6 PolarHBondContact O-N 3.15Å; R2-L6 VanDerWaalsContact O-N 3.14Å; I3-L6 PolarHBondContact O-N 2.82Å; L6-A9 PolarHBondContact O-N 3.23Å; L6-F10 WeakPolarHBondContact O-CB 3.37Å; L6-F10 PolarHBondContact O-N 2.05Å
7	L	45.9	Very low	47.3	Very low	105 Å²	105	112.2 Å²	112.2	55%	0.55	59%	0.586	S	S	.	*	H	α-helix	trans	-65.4	-40.6	172.1	-84.6	157.6	0	0	0	112	I3 C4 F10 L11	I3-L7 HydrophobicContact CG2-CD1 3.95Å; I3-L7 WeakPolarHBondContact O-CB 3.46Å; I3-L7 PolarHBondContact O-N 3.39Å; C4-L7 PolarHBondContact O-N 2.91Å; L7-F10 PolarHBondContact O-N 3.32Å; L7-L11 VanDerWaalsContact O-CB 3.3Å; L7-L11 WeakPolarHBondContact O-CB 3.36Å; L7-L11 WeakPolarHBondContact O-CD1 3.03Å; L7-L11 VanDerWaalsContact O-CG 3.24Å; L7-L11 WeakPolarHBondContact O-CG 3.47Å; L7-L11 PolarHBondContact O-N 3.4Å
8	L	45.4	Very low	48.2	Very low	102 Å²	102	112.3 Å²	112.3	53%	0.534	59%	0.587	S	S	.	*	H	α-helix	trans	-64.7	-40.9	173.4	-95.6	144.6	0	0	0	111.9	C4 L11 V12	C4-L8 VanDerWaalsContact O-CB 3.29Å; C4-L8 WeakPolarHBondContact O-CB 3.37Å; C4-L8 WeakPolarHBondContact O-CD1 3.3Å; C4-L8 PolarHBondContact O-N 3.13Å; L8-L11 PolarHBondContact O-N 2.85Å; L8-V12 VanDerWaalsContact O-CB 3.32Å; L8-V12 WeakPolarHBondContact O-CB 3.09Å; L8-V12 WeakPolarHBondContact O-CG2 3.5Å; L8-V12 PolarHBondContact O-N 2.05Å
9	A	45.5	Very low	49.2	Very low	57 Å²	57	109.6 Å²	109.6	47%	0.471	57%	0.571	S	S	.	*	H	α-helix	trans	-67.5	-38.9	176.9	0	0	0	0	0	112.7	F5 L6 V12 A13	F5-A9 WeakPolarHBondContact O-CB 3.12Å; F5-A9 PolarHBondContact O-N 3.21Å; L6-A9 PolarHBondContact O-N 3.23Å; A9-V12 PolarHBondContact O-N 3.44Å; A9-A13 WeakPolarHBondContact O-CB 3.42Å; A9-A13 PolarHBondContact O-N 3.31Å
10	F	45.3	Very low	50.3	Low	141 Å²	141	108.6 Å²	108.6	62%	0.618	57%	0.566	S	S	*	*	H	α-helix	trans	-66	-44.2	173.2	-105.1	-92.3	0	0	0	112.1	L6 L7 V12 A13 E14	L6-F10 WeakPolarHBondContact O-CB 3.37Å; L6-F10 PolarHBondContact O-N 2.05Å; L7-F10 PolarHBondContact O-N 3.32Å; F10-V12 VanDerWaalsContact C-N 3.34Å; F10-V12 PolarHBondContact O-N 2.82Å; F10-A13 PolarHBondContact O-N 2.88Å; F10-E14 PolarHBondContact O-N 3.06Å
11	L	44.4	Very low	51.7	Low	99 Å²	99	108 Å²	108	52%	0.518	57%	0.568	S	S	.	*	H	α-helix	trans	-64.4	-36.3	175.3	-76.6	160.9	0	0	0	112.1	L7 L8 T15	L7-L11 VanDerWaalsContact O-CB 3.3Å; L7-L11 WeakPolarHBondContact O-CB 3.36Å; L7-L11 WeakPolarHBondContact O-CD1 3.03Å; L7-L11 VanDerWaalsContact O-CG 3.24Å; L7-L11 WeakPolarHBondContact O-CG 3.47Å; L7-L11 PolarHBondContact O-N 3.4Å; L8-L11 PolarHBondContact O-N 2.85Å; L11-T15 WeakPolarHBondContact O-CB 3.48Å; L11-T15 WeakPolarHBondContact O-CG2 3.44Å; L11-T15 PolarHBondContact O-N 3.19Å; L11-T15 PolarHBondContact O-OG1 2.82Å
12	V	52.1	Low	53.3	Low	70 Å²	70	105.4 Å²	105.4	42%	0.424	55%	0.547	S	S	.	.	H	α-helix	trans	-69.9	-38.2	175.3	173.1	0	0	0	0	111.4	L8 A9 F10 T15 F16	L8-V12 VanDerWaalsContact O-CB 3.32Å; L8-V12 WeakPolarHBondContact O-CB 3.09Å; L8-V12 WeakPolarHBondContact O-CG2 3.5Å; L8-V12 PolarHBondContact O-N 2.05Å; A9-V12 PolarHBondContact O-N 3.44Å; F10-V12 VanDerWaalsContact C-N 3.34Å; F10-V12 PolarHBondContact O-N 2.82Å; V12-T15 VanDerWaalsContact CA-OG1 3.25Å; V12-T15 WeakPolarHBondContact CA-OG1 3.09Å; V12-T15 PolarHBondContact O-OG1 3.35Å; V12-F16 HydrophobicContact CG1-CD2 3.93Å; V12-F16 HydrophobicContact CG1-CE2 4.08Å; V12-F16 WeakPolarHBondContact O-CD2 3.4Å; V12-F16 PolarHBondContact O-N 3Å; V12-F16 VanDerWaalsContact O-N 3.12Å
13	A	47.9	Very low	55	Low	64 Å²	64	95 Å²	95	53%	0.529	51%	0.508	S	S	.	.	H	α-helix	trans	-68.3	-41.9	176.5	0	0	0	0	0	112.8	A9 F10 A17	A9-A13 WeakPolarHBondContact O-CB 3.42Å; A9-A13 PolarHBondContact O-N 3.31Å; F10-A13 PolarHBondContact O-N 2.88Å; A13-A17 PolarHBondContact O-N 3.38Å
14	E	48.7	Very low	56.6	Low	117 Å²	117	90.6 Å²	90.6	55%	0.547	49%	0.489	S	S	.	.	H	α-helix	trans	-68.5	-35.4	176.2	-76.3	-176.8	170.1	0	0	112.7	F10 N18	F10-E14 PolarHBondContact O-N 3.06Å; E14-N18 WeakPolarHBondContact O-CB 3.39Å; E14-N18 PolarHBondContact O-N 3.28Å; E14-N18 PolarHBondContact O-ND2 2.99Å
15	T	54	Low	58.5	Low	82 Å²	82	89.2 Å²	89.2	50%	0.503	48%	0.483	S	S	.	.	H	α-helix	trans	-69.8	-38.8	176.9	47	0	0	0	0	112.5	L11 V12 N18 E19	L11-T15 WeakPolarHBondContact O-CB 3.48Å; L11-T15 WeakPolarHBondContact O-CG2 3.44Å; L11-T15 PolarHBondContact O-N 3.19Å; L11-T15 PolarHBondContact O-OG1 2.82Å; V12-T15 VanDerWaalsContact CA-OG1 3.25Å; V12-T15 WeakPolarHBondContact CA-OG1 3.09Å; V12-T15 PolarHBondContact O-OG1 3.35Å; T15-N18 PolarHBondContact O-N 2.99Å; T15-E19 PolarHBondContact O-N 3.44Å
16	F	52.3	Low	60.3	Low	126 Å²	126	82.9 Å²	82.9	55%	0.553	46%	0.46	S	S	*	.	H	α-helix	trans	-67.7	-41	175.6	-97.7	-89.9	0	0	0	113.4	V12 N18 E19 L20	V12-F16 HydrophobicContact CG1-CD2 3.93Å; V12-F16 HydrophobicContact CG1-CE2 4.08Å; V12-F16 WeakPolarHBondContact O-CD2 3.4Å; V12-F16 PolarHBondContact O-N 3Å; V12-F16 VanDerWaalsContact O-N 3.12Å; F16-N18 VanDerWaalsContact C-N 3.32Å; F16-N18 PolarHBondContact O-N 3.02Å; F16-E19 PolarHBondContact O-N 2.82Å; F16-L20 PolarHBondContact O-N 3.41Å
17	A	56.4	Low	62	Low	57 Å²	57	77.4 Å²	77.4	47%	0.471	43%	0.431	S	S	.	.	H	α-helix	trans	-64.5	-37.4	176.1	0	0	0	0	0	112	A13 T21	A13-A17 PolarHBondContact O-N 3.38Å; A17-T21 PolarHBondContact O-N 3.36Å; A17-T21 PolarHBondContact O-OG1 3.02Å
18	N	63.2	Low	63.7	Low	114 Å²	114	74.4 Å²	74.4	61%	0.61	42%	0.417	S	S	*	.	H	α-helix	trans	-69.4	-36.4	175.4	-82.5	-28.4	0	0	0	113	E14 T15 F16 R22	E14-N18 WeakPolarHBondContact O-CB 3.39Å; E14-N18 PolarHBondContact O-N 3.28Å; E14-N18 PolarHBondContact O-ND2 2.99Å; T15-N18 PolarHBondContact O-N 2.99Å; F16-N18 VanDerWaalsContact C-N 3.32Å; F16-N18 PolarHBondContact O-N 3.02Å; N18-R22 WeakPolarHBondContact O-CB 3.39Å; N18-R22 PolarHBondContact O-N 3.18Å; N18-R22 VanDerWaalsContact O-N 3.07Å
19	E	68.3	Low	65.5	Low	61 Å²	61	75.8 Å²	75.8	29%	0.285	42%	0.415	S	S	.	.	H	α-helix	trans	-66	-45.6	177.5	-165.1	-179.6	-179.9	0	0	111.5	T15 F16 T21 R22 C23	T15-E19 PolarHBondContact O-N 3.44Å; F16-E19 PolarHBondContact O-N 2.82Å; E19-T21 VanDerWaalsContact C-N 3.33Å; E19-T21 PolarHBondContact O-N 3.4Å; E19-R22 PolarHBondContact O-N 3.35Å; E19-C23 WeakPolarHBondContact O-CB 3.29Å; E19-C23 PolarHBondContact O-N 2.82Å; E19-C23 PolarHBondContact O-SG 2.81Å
20	L	71.3	Confident	67.2	Low	90 Å²	90	75.7 Å²	75.7	47%	0.471	41%	0.405	S	S	.	.	H	α-helix	trans	-63.1	-40.4	179.8	-146.2	77.8	0	0	0	112.2	F16 C23 C24 A52	F16-L20 PolarHBondContact O-N 3.41Å; L20-C23 PolarHBondContact O-N 2.81Å; L20-C24 WeakPolarHBondContact O-CB 3.46Å; L20-C24 PolarHBondContact O-N 3.43Å; L20-A52 HydrophobicContact CD1-CB 3.82Å; L20-A52 HydrophobicContact CG-CB 3.93Å
21	T	78.5	Confident	68.9	Low	97 Å²	97	69.7 Å²	69.7	60%	0.595	38%	0.379	S	S	*	.	H	α-helix	trans	-63.5	-43.3	176.5	-54.1	0	0	0	0	111.2	A17 E19 C24 A25	A17-T21 PolarHBondContact O-N 3.36Å; A17-T21 PolarHBondContact O-OG1 3.02Å; E19-T21 VanDerWaalsContact C-N 3.33Å; E19-T21 PolarHBondContact O-N 3.4Å; T21-C24 PolarHBondContact O-N 2.8Å; T21-A25 WeakPolarHBondContact O-CB 3.48Å; T21-A25 PolarHBondContact O-N 3.37Å
22	R	79.1	Confident	70.7	Confident	135 Å²	135	72.5 Å²	72.5	51%	0.509	39%	0.387	S	S	.	.	H	α-helix	trans	-62.9	-43	175.1	-165.2	-177.6	83.1	-174.4	5.6	112	N18 E19 A25 G26 E43	N18-R22 WeakPolarHBondContact O-CB 3.39Å; N18-R22 PolarHBondContact O-N 3.18Å; N18-R22 VanDerWaalsContact O-N 3.07Å; E19-R22 PolarHBondContact O-N 3.35Å; R22-A25 PolarHBondContact O-N 2.84Å; R22-G26 PolarHBondContact O-N 3.19Å; R22-E43 PolarHBondContact NH2-O 3.44Å
23	C	79.7	Confident	72.1	Confident	2 Å²	2	75.6 Å²	75.6	1%	0.014	40%	0.401	C	S	.	.	H	α-helix	trans	-67.6	-40.3	179.6	-62.7	0	0	0	0	112.7	E19 L20 G26 G27 C49 A52 A53	E19-C23 WeakPolarHBondContact O-CB 3.29Å; E19-C23 PolarHBondContact O-N 2.82Å; E19-C23 PolarHBondContact O-SG 2.81Å; L20-C23 PolarHBondContact O-N 2.81Å; C23-G26 PolarHBondContact O-N 2.04Å; C23-G27 PolarHBondContact O-N 2.66Å; C23-C49 HydrophobicContact CB-CB 3.87Å; C23-C49 WeakPolarHBondContact CB-SG 3.29Å; C23-C49 WeakPolarHBondContact SG-CB 3.41Å; C23-C49 CovalentContact SG-SG 2.01Å; C23-C49 PolarHBondContact SG-SG 2.95Å; C23-A52 HydrophobicContact CB-CB 4.31Å; C23-A53 WeakPolarHBondContact O-CA 3.38Å; C23-A53 WeakPolarHBondContact O-CB 3.36Å
24	C	80.5	Confident	73.5	Confident	39 Å²	39	74.7 Å²	74.7	26%	0.264	39%	0.391	S	S	.	.	H	α-helix	trans	-60.9	-45.1	172.7	-179.3	0	0	0	0	111.3	L20 T21 G26 G27 T28 C56	L20-C24 WeakPolarHBondContact O-CB 3.46Å; L20-C24 PolarHBondContact O-N 3.43Å; T21-C24 PolarHBondContact O-N 2.8Å; C24-G26 VanDerWaalsContact C-N 3.28Å; C24-G26 PolarHBondContact O-N 2.88Å; C24-G27 WeakPolarHBondContact O-CA 3.34Å; C24-G27 PolarHBondContact O-N 3.03Å; C24-T28 PolarHBondContact O-N 3.5Å; C24-T28 PolarHBondContact O-OG1 3.2Å; C24-C56 HydrophobicContact CB-CB 3.93Å; C24-C56 WeakPolarHBondContact CB-SG 3.05Å; C24-C56 WeakPolarHBondContact O-CB 3.21Å; C24-C56 WeakPolarHBondContact SG-CB 3.42Å; C24-C56 CovalentContact SG-SG 2.03Å; C24-C56 PolarHBondContact SG-SG 2.82Å
25	A	82.3	Confident	74.7	Confident	51 Å²	51	74.3 Å²	74.3	42%	0.421	39%	0.393	S	S	.	.	H	α-helix	trans	-59.9	-37.1	175	0	0	0	0	0	112.6	T21 R22 T28 R29	T21-A25 WeakPolarHBondContact O-CB 3.48Å; T21-A25 PolarHBondContact O-N 3.37Å; R22-A25 PolarHBondContact O-N 2.84Å; A25-T28 PolarHBondContact O-N 3.15Å; A25-R29 WeakPolarHBondContact O-CB 3.36Å; A25-R29 PolarHBondContact O-N 3.37Å
26	G	80.3	Confident	75.9	Confident	16 Å²	16	73.3 Å²	73.3	17%	0.165	39%	0.386	C	S	.	.	H	α-helix	trans	-62.4	-41.4	171.8	0	0	0	0	0	113	R22 C23 C24 R29 H30	R22-G26 PolarHBondContact O-N 3.19Å; C23-G26 PolarHBondContact O-N 2.04Å; C24-G26 VanDerWaalsContact C-N 3.28Å; C24-G26 PolarHBondContact O-N 2.88Å; G26-R29 PolarHBondContact O-N 3.12Å; G26-H30 WeakPolarHBondContact O-CB 3.37Å; G26-H30 PolarHBondContact O-N 3.18Å
27	G	81.6	Confident	77.1	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-61.4	-46.3	173.8	0	0	0	0	0	113.5	C23 C24 H30 F31 A53 C57	C23-G27 PolarHBondContact O-N 2.66Å; C24-G27 WeakPolarHBondContact O-CA 3.34Å; C24-G27 PolarHBondContact O-N 3.03Å; G27-H30 WeakPolarHBondContact O-CB 3.36Å; G27-H30 PolarHBondContact O-N 3.01Å; G27-F31 PolarHBondContact O-N 3.2Å; G27-F31 VanDerWaalsContact O-N 3.14Å; G27-A53 VanDerWaalsContact CA-O 3.26Å; G27-A53 WeakPolarHBondContact CA-O 3.19Å; G27-C57 WeakPolarHBondContact O-CB 3.41Å
28	T	82	Confident	77.9	Confident	42 Å²	42	69.6 Å²	69.6	26%	0.258	37%	0.372	S	S	.	.	H	α-helix	trans	-63.5	-40.2	175.2	-59.1	0	0	0	0	111.9	C24 A25 H30 F31 K32 S60	C24-T28 PolarHBondContact O-N 3.5Å; C24-T28 PolarHBondContact O-OG1 3.2Å; A25-T28 PolarHBondContact O-N 3.15Å; T28-H30 VanDerWaalsContact C-N 3.34Å; T28-F31 PolarHBondContact O-N 2.81Å; T28-K32 WeakPolarHBondContact O-CG 3.05Å; T28-K32 PolarHBondContact O-N 2.85Å; T28-K32 VanDerWaalsContact O-N 3.12Å; T28-S60 PolarHBondContact OG1-OG 3.24Å
29	R	82.4	Confident	78.1	Confident	132 Å²	132	69.3 Å²	69.3	50%	0.498	38%	0.379	S	S	.	.	H	α-helix	trans	-65.2	-39	176.1	-169.8	-173.6	-61.6	150	1.5	111.7	A25 G26 K32 N33 E43	A25-R29 WeakPolarHBondContact O-CB 3.36Å; A25-R29 PolarHBondContact O-N 3.37Å; G26-R29 PolarHBondContact O-N 3.12Å; R29-K32 PolarHBondContact O-N 2.88Å; R29-N33 PolarHBondContact O-N 3.48Å; R29-E43 IonicContact NH1-OE1 3.27Å; R29-E43 PolarHBondContact NH1-OE1 2.03Å
30	H	81.1	Confident	78.1	Confident	55 Å²	55	67.1 Å²	67.1	26%	0.255	37%	0.369	S	S	.	.	H	α-helix	trans	-59.3	-50.1	176	-174.1	87.9	0	0	0	110.9	G26 G27 T28 K32 N33 S34 T36 I40	G26-H30 WeakPolarHBondContact O-CB 3.37Å; G26-H30 PolarHBondContact O-N 3.18Å; G27-H30 WeakPolarHBondContact O-CB 3.36Å; G27-H30 PolarHBondContact O-N 3.01Å; T28-H30 VanDerWaalsContact C-N 3.34Å; H30-K32 VanDerWaalsContact C-N 3.34Å; H30-K32 PolarHBondContact O-N 3.3Å; H30-N33 PolarHBondContact O-N 3.03Å; H30-S34 PolarHBondContact CD2-OG 2.88Å; H30-S34 PolarHBondContact NE2-OG 3.04Å; H30-S34 PolarHBondContact O-N 3.4Å; H30-S34 PolarHBondContact O-OG 3.21Å; H30-T36 PolarHBondContact CD2-O 3.04Å; H30-I40 HydrophobicContact CB-CD1 4.37Å; H30-I40 HydrophobicContact CB-CG1 4.12Å; H30-I40 WeakPolarHBondContact CD2-CG1 3.38Å
31	F	81.5	Confident	77.8	Confident	15 Å²	15	72 Å²	72	7%	0.066	39%	0.387	C	S	.	.	H	α-helix	trans	-54.9	-48.1	176	178.3	-109	0	0	0	112.2	G27 T28 N33 S34 N35 S60 L61 N64	G27-F31 PolarHBondContact O-N 3.2Å; G27-F31 VanDerWaalsContact O-N 3.14Å; T28-F31 PolarHBondContact O-N 2.81Å; F31-N33 PolarHBondContact O-N 2.04Å; F31-N33 VanDerWaalsContact O-N 3.11Å; F31-S34 PolarHBondContact O-N 2.69Å; F31-N35 WeakPolarHBondContact O-CA 3.05Å; F31-N35 PolarHBondContact O-N 3.02Å; F31-S60 VanDerWaalsContact CD1-CB 3.47Å; F31-S60 VanDerWaalsContact CE1-O 3.3Å; F31-S60 WeakPolarHBondContact CE1-O 3.07Å; F31-L61 HydrophobicContact CD2-CB 3.9Å; F31-L61 HydrophobicContact CD2-CD1 4.3Å; F31-L61 HydrophobicContact CD2-CG 4.49Å; F31-L61 HydrophobicContact CE2-CB 3.57Å; F31-L61 HydrophobicContact CE2-CD1 3.87Å; F31-L61 HydrophobicContact CE2-CG 3.85Å; F31-L61 HydrophobicContact CZ-CB 4.12Å; F31-L61 HydrophobicContact CZ-CG 4.5Å; F31-N64 HydrophobicContact CE1-CB 3.76Å; F31-N64 HydrophobicContact CZ-CB 3.69Å
32	K	81.4	Confident	76.9	Confident	157 Å²	157	68.8 Å²	68.8	68%	0.683	37%	0.368	S	S	*	.	H	α-helix	trans	-58.2	-26.5	179.1	-73.5	-174.9	178.7	-170.4	0	113.8	T28 R29 H30	T28-K32 WeakPolarHBondContact O-CG 3.05Å; T28-K32 PolarHBondContact O-N 2.85Å; T28-K32 VanDerWaalsContact O-N 3.12Å; R29-K32 PolarHBondContact O-N 2.88Å; H30-K32 VanDerWaalsContact C-N 3.34Å; H30-K32 PolarHBondContact O-N 3.3Å
33	N	81	Confident	75.9	Confident	135 Å²	135	67.3 Å²	67.3	72%	0.722	37%	0.367	S	S	*	.	H	α-helix	trans	-94.3	-34.2	-178.5	-70.4	-9.5	0	0	0	113.4	R29 H30 F31	R29-N33 PolarHBondContact O-N 3.48Å; H30-N33 PolarHBondContact O-N 3.03Å; F31-N33 PolarHBondContact O-N 2.04Å; F31-N33 VanDerWaalsContact O-N 3.11Å
34	S	77.1	Confident	74.9	Confident	46 Å²	46	67.9 Å²	67.9	32%	0.322	37%	0.373	S	S	.	.	H	α-helix	trans	-110.6	-9.6	-171.4	65.4	0	0	0	0	114.2	H30 F31 T36	H30-S34 PolarHBondContact CD2-OG 2.88Å; H30-S34 PolarHBondContact NE2-OG 3.04Å; H30-S34 PolarHBondContact O-N 3.4Å; H30-S34 PolarHBondContact O-OG 3.21Å; F31-S34 PolarHBondContact O-N 2.69Å; S34-T36 PolarHBondContact O-N 3.28Å; S34-T36 PolarHBondContact O-OG1 3.16Å; S34-T36 PolarHBondContact OG-N 3.36Å; S34-T36 PolarHBondContact OG-O 3.45Å
35	N	75.9	Confident	73.8	Confident	109 Å²	109	73.5 Å²	73.5	58%	0.583	41%	0.406	S	S	*	.	S	Bend	trans	49	19	-170	-78.7	-7.2	0	0	0	114.2	F31	F31-N35 WeakPolarHBondContact O-CA 3.05Å; F31-N35 PolarHBondContact O-N 3.02Å
36	T	77.6	Confident	73.1	Confident	60 Å²	60	73.1 Å²	73.1	37%	0.368	40%	0.401	S	S	.	.	S	Bend	trans	-143.2	156.2	-178.6	61.6	0	0	0	0	109.6	H30 S34 S38	H30-T36 PolarHBondContact CD2-O 3.04Å; S34-T36 PolarHBondContact O-N 3.28Å; S34-T36 PolarHBondContact O-OG1 3.16Å; S34-T36 PolarHBondContact OG-N 3.36Å; S34-T36 PolarHBondContact OG-O 3.45Å; T36-S38 WeakPolarHBondContact CB-OG 3.29Å; T36-S38 PolarHBondContact OG1-OG 3.14Å
37	C	77.3	Confident	72.5	Confident	30 Å²	30	79.2 Å²	79.2	20%	0.203	43%	0.427	C	S	.	.			trans	-106	8.6	175	-62.6	0	0	0	0	113.2	I40 C57 L58	C37-I40 HydrophobicContact CB-CD1 4.5Å; C37-C57 WeakPolarHBondContact CA-SG 3.48Å; C37-C57 HydrophobicContact CB-CB 3.95Å; C37-C57 WeakPolarHBondContact CB-SG 3.48Å; C37-C57 WeakPolarHBondContact SG-CB 3Å; C37-C57 PolarHBondContact SG-O 2.02Å; C37-C57 CovalentContact SG-SG 2.05Å; C37-C57 PolarHBondContact SG-SG 3.47Å; C37-L58 HydrophobicContact CB-CD2 4.19Å; C37-L58 HydrophobicContact CB-CG 4.4Å; C37-L58 PolarHBondContact SG-N 3.38Å; C37-L58 VanDerWaalsContact SG-N 3.45Å
38	S	73.4	Confident	72.2	Confident	76 Å²	76	82.8 Å²	82.8	53%	0.531	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	135.4	173.2	37.8	0	0	0	0	110.8	T36	T36-S38 WeakPolarHBondContact CB-OG 3.29Å; T36-S38 PolarHBondContact OG1-OG 3.14Å
39	S	68.3	Low	71.9	Confident	108 Å²	108	80.8 Å²	80.8	76%	0.755	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.6	32	173.8	-49.9	0	0	0	0	116	K41	S39-K41 PolarHBondContact O-N 2.97Å; S39-K41 VanDerWaalsContact O-N 3.16Å
40	I	69	Low	71.7	Confident	15 Å²	15	79 Å²	79	8%	0.077	43%	0.434	C	S	.	.			trans	-60.9	116.1	170	-83	174.7	0	0	0	110.8	H30 C37 A53 C57	H30-I40 HydrophobicContact CB-CD1 4.37Å; H30-I40 HydrophobicContact CB-CG1 4.12Å; H30-I40 WeakPolarHBondContact CD2-CG1 3.38Å; C37-I40 HydrophobicContact CB-CD1 4.5Å; I40-A53 HydrophobicContact CG2-CB 3.84Å; I40-C57 HydrophobicContact CD1-CB 3.23Å; I40-C57 VanDerWaalsContact CD1-SG 3.52Å
41	K	63.4	Low	71.6	Confident	192 Å²	192	85.1 Å²	85.1	84%	0.835	46%	0.455	S	S	*	.			trans	-101.1	113.7	164.7	-66.7	-174.6	-179.8	-178.4	0	107.4	S39	S39-K41 PolarHBondContact O-N 2.97Å; S39-K41 VanDerWaalsContact O-N 3.16Å
42	S	60.9	Low	71.5	Confident	29 Å²	29	85 Å²	85	20%	0.203	46%	0.456	C	S	.	.			trans	-67.3	146.9	-179.4	47.7	0	0	0	0	111.8	G44	S42-G44 PolarHBondContact O-N 3.38Å; S42-G44 VanDerWaalsContact O-N 3.08Å; S42-G44 PolarHBondContact OG-O 3.37Å
43	E	58.2	Low	71.5	Confident	105 Å²	105	77.6 Å²	77.6	49%	0.491	42%	0.424	S	S	.	.	S	Bend	trans	-68.7	3	172.2	-66.9	-177.2	169.9	0	0	113	R22 R29	R22-E43 PolarHBondContact NH2-O 3.44Å; R29-E43 IonicContact NH1-OE1 3.27Å; R29-E43 PolarHBondContact NH1-OE1 2.03Å
44	G	58	Low	71.4	Confident	14 Å²	14	73.2 Å²	73.2	14%	0.144	40%	0.404	C	S	.	.	S	Bend	trans	-132.4	156.2	178.1	0	0	0	0	0	112.2	S42	S42-G44 PolarHBondContact O-N 3.38Å; S42-G44 VanDerWaalsContact O-N 3.08Å; S42-G44 PolarHBondContact OG-O 3.37Å
45	T	56.3	Low	71.5	Confident	156 Å²	156	76.4 Å²	76.4	96%	0.957	42%	0.417	S	S	*	.	S	Bend	trans	-86.4	-9	-174.5	51.4	0	0	0	0	114.1
46	S	69.5	Low	71.6	Confident	43 Å²	43	72.2 Å²	72.2	30%	0.301	40%	0.396	S	S	.	.	S	Bend	trans	-83.2	139	-179.4	-179.7	0	0	0	0	112.8	T48 C49 Q50	S46-T48 PolarHBondContact O-N 2.94Å; S46-T48 PolarHBondContact OG-N 2.91Å; S46-T48 PolarHBondContact OG-OG1 2.03Å; S46-C49 WeakPolarHBondContact O-CB 3.44Å; S46-C49 PolarHBondContact O-N 2.91Å; S46-C49 VanDerWaalsContact O-N 3.09Å; S46-Q50 PolarHBondContact O-N 3.47Å
47	M	67.6	Low	71.7	Confident	145 Å²	145	69.4 Å²	69.4	71%	0.714	38%	0.378	S	S	*	.	H	α-helix	trans	-57.6	-29.7	172.8	-74	-160.5	-55.8	0	0	113.2	Q50 R51	M47-Q50 PolarHBondContact O-N 3.18Å; M47-R51 WeakPolarHBondContact O-CG 3.48Å; M47-R51 PolarHBondContact O-N 2.72Å; M47-R51 VanDerWaalsContact O-N 3.11Å
48	T	73.9	Confident	71.9	Confident	74 Å²	74	71.7 Å²	71.7	45%	0.454	39%	0.388	S	S	.	.	H	α-helix	trans	-68.9	-38.4	176.7	47.6	0	0	0	0	111.9	S46 R51 A52	S46-T48 PolarHBondContact O-N 2.94Å; S46-T48 PolarHBondContact OG-N 2.91Å; S46-T48 PolarHBondContact OG-OG1 2.03Å; T48-R51 PolarHBondContact O-N 2.72Å; T48-A52 WeakPolarHBondContact O-CB 3.3Å; T48-A52 PolarHBondContact O-N 3.13Å
49	C	76.9	Confident	72.3	Confident	0 Å²	0	76.1 Å²	76.1	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-64.3	-42.1	174.3	176.4	0	0	0	0	111.6	C23 S46 A52 A53	C23-C49 HydrophobicContact CB-CB 3.87Å; C23-C49 WeakPolarHBondContact CB-SG 3.29Å; C23-C49 WeakPolarHBondContact SG-CB 3.41Å; C23-C49 CovalentContact SG-SG 2.01Å; C23-C49 PolarHBondContact SG-SG 2.95Å; S46-C49 WeakPolarHBondContact O-CB 3.44Å; S46-C49 PolarHBondContact O-N 2.91Å; S46-C49 VanDerWaalsContact O-N 3.09Å; C49-A52 PolarHBondContact O-N 2.84Å; C49-A53 WeakPolarHBondContact O-CB 3.47Å; C49-A53 PolarHBondContact O-N 2.86Å
50	Q	77.6	Confident	72.9	Confident	96 Å²	96	72 Å²	72	45%	0.449	36%	0.364	S	S	.	.	H	α-helix	trans	-63.6	-43	177.6	-164.7	173.9	4.1	0	0	112.2	S46 M47 A53 S54	S46-Q50 PolarHBondContact O-N 3.47Å; M47-Q50 PolarHBondContact O-N 3.18Å; Q50-A53 PolarHBondContact O-N 3.36Å; Q50-S54 PolarHBondContact O-N 2.94Å; Q50-S54 PolarHBondContact O-OG 2.04Å
51	R	78.5	Confident	73.4	Confident	183 Å²	183	72.8 Å²	72.8	69%	0.691	37%	0.368	S	S	*	.	H	α-helix	trans	-63.9	-43.8	174.5	-72.6	-176.4	178	-165.2	-0.3	112.4	M47 T48 A53 S54 I55	M47-R51 WeakPolarHBondContact O-CG 3.48Å; M47-R51 PolarHBondContact O-N 2.72Å; M47-R51 VanDerWaalsContact O-N 3.11Å; T48-R51 PolarHBondContact O-N 2.72Å; R51-A53 VanDerWaalsContact C-N 3.34Å; R51-A53 PolarHBondContact O-N 3.34Å; R51-S54 PolarHBondContact O-N 3.36Å; R51-I55 VanDerWaalsContact O-CG1 3.3Å; R51-I55 WeakPolarHBondContact O-CG1 3.47Å; R51-I55 PolarHBondContact O-N 3.08Å
52	A	80.8	Confident	74	Confident	12 Å²	12	67.2 Å²	67.2	10%	0.099	35%	0.348	C	S	.	.	H	α-helix	trans	-60.4	-43.1	177.1	0	0	0	0	0	112.1	L20 C23 T48 C49 I55 C56	L20-A52 HydrophobicContact CD1-CB 3.82Å; L20-A52 HydrophobicContact CG-CB 3.93Å; C23-A52 HydrophobicContact CB-CB 4.31Å; T48-A52 WeakPolarHBondContact O-CB 3.3Å; T48-A52 PolarHBondContact O-N 3.13Å; C49-A52 PolarHBondContact O-N 2.84Å; A52-I55 PolarHBondContact O-N 3.33Å; A52-C56 WeakPolarHBondContact O-CB 3.42Å; A52-C56 PolarHBondContact O-N 3.28Å; A52-C56 PolarHBondContact O-SG 3.09Å; A52-C56 VanDerWaalsContact O-SG 3.35Å
53	A	79.5	Confident	74.9	Confident	2 Å²	2	69 Å²	69	2%	0.017	35%	0.354	C	S	.	.	H	α-helix	trans	-62.9	-43.6	175.8	0	0	0	0	0	112.3	C23 G27 I40 C49 Q50 R51 C57	C23-A53 WeakPolarHBondContact O-CA 3.38Å; C23-A53 WeakPolarHBondContact O-CB 3.36Å; G27-A53 VanDerWaalsContact CA-O 3.26Å; G27-A53 WeakPolarHBondContact CA-O 3.19Å; I40-A53 HydrophobicContact CG2-CB 3.84Å; C49-A53 WeakPolarHBondContact O-CB 3.47Å; C49-A53 PolarHBondContact O-N 2.86Å; Q50-A53 PolarHBondContact O-N 3.36Å; R51-A53 VanDerWaalsContact C-N 3.34Å; R51-A53 PolarHBondContact O-N 3.34Å; A53-C57 WeakPolarHBondContact O-CB 3.36Å; A53-C57 PolarHBondContact O-N 3.34Å
54	S	79.6	Confident	76.1	Confident	43 Å²	43	67.7 Å²	67.7	30%	0.301	35%	0.351	S	S	.	.	H	α-helix	trans	-63.9	-44	177.6	-64.2	0	0	0	0	112.8	Q50 R51 C57 L58	Q50-S54 PolarHBondContact O-N 2.94Å; Q50-S54 PolarHBondContact O-OG 2.04Å; R51-S54 PolarHBondContact O-N 3.36Å; S54-C57 PolarHBondContact O-N 2.94Å; S54-L58 WeakPolarHBondContact O-CG 3.49Å; S54-L58 PolarHBondContact O-N 3.43Å
55	I	78.5	Confident	77.2	Confident	113 Å²	113	67.8 Å²	67.8	58%	0.579	35%	0.35	S	S	*	.	H	α-helix	trans	-62.8	-47	178.6	-68.5	166.3	0	0	0	110.5	R51 A52 C57 L58 R59	R51-I55 VanDerWaalsContact O-CG1 3.3Å; R51-I55 WeakPolarHBondContact O-CG1 3.47Å; R51-I55 PolarHBondContact O-N 3.08Å; A52-I55 PolarHBondContact O-N 3.33Å; I55-C57 VanDerWaalsContact C-N 3.33Å; I55-C57 PolarHBondContact O-N 2.8Å; I55-L58 PolarHBondContact O-N 2.87Å; I55-R59 PolarHBondContact O-N 2.83Å
56	C	79.6	Confident	78.3	Confident	21 Å²	21	60.6 Å²	60.6	14%	0.142	31%	0.307	C	S	.	.	H	α-helix	trans	-68.6	-30.8	-179.6	-66.2	0	0	0	0	113.2	C24 A52 S60	C24-C56 HydrophobicContact CB-CB 3.93Å; C24-C56 WeakPolarHBondContact CB-SG 3.05Å; C24-C56 WeakPolarHBondContact O-CB 3.21Å; C24-C56 WeakPolarHBondContact SG-CB 3.42Å; C24-C56 CovalentContact SG-SG 2.03Å; C24-C56 PolarHBondContact SG-SG 2.82Å; A52-C56 WeakPolarHBondContact O-CB 3.42Å; A52-C56 PolarHBondContact O-N 3.28Å; A52-C56 PolarHBondContact O-SG 3.09Å; A52-C56 VanDerWaalsContact O-SG 3.35Å; C56-S60 PolarHBondContact O-N 3.28Å; C56-S60 VanDerWaalsContact O-N 3.09Å; C56-S60 PolarHBondContact O-OG 2.81Å
57	C	79.7	Confident	79	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-64.3	-49.7	169.7	-175.9	0	0	0	0	111.6	G27 C37 I40 A53 S54 I55 R59 S60 L61	G27-C57 WeakPolarHBondContact O-CB 3.41Å; C37-C57 WeakPolarHBondContact CA-SG 3.48Å; C37-C57 HydrophobicContact CB-CB 3.95Å; C37-C57 WeakPolarHBondContact CB-SG 3.48Å; C37-C57 WeakPolarHBondContact SG-CB 3Å; C37-C57 PolarHBondContact SG-O 2.02Å; C37-C57 CovalentContact SG-SG 2.05Å; C37-C57 PolarHBondContact SG-SG 3.47Å; I40-C57 HydrophobicContact CD1-CB 3.23Å; I40-C57 VanDerWaalsContact CD1-SG 3.52Å; A53-C57 WeakPolarHBondContact O-CB 3.36Å; A53-C57 PolarHBondContact O-N 3.34Å; S54-C57 PolarHBondContact O-N 2.94Å; I55-C57 VanDerWaalsContact C-N 3.33Å; I55-C57 PolarHBondContact O-N 2.8Å; C57-R59 VanDerWaalsContact C-N 3.28Å; C57-R59 PolarHBondContact O-N 3.03Å; C57-S60 WeakPolarHBondContact O-CB 3.46Å; C57-S60 PolarHBondContact O-N 2.78Å; C57-L61 PolarHBondContact O-N 2.78Å
58	L	79.6	Confident	79.8	Confident	78 Å²	78	56 Å²	56	41%	0.408	29%	0.285	S	S	.	.	H	α-helix	trans	-60.4	-39.9	-179.9	-76.2	168	0	0	0	111.8	C37 S54 I55 L61 L62	C37-L58 HydrophobicContact CB-CD2 4.19Å; C37-L58 HydrophobicContact CB-CG 4.4Å; C37-L58 PolarHBondContact SG-N 3.38Å; C37-L58 VanDerWaalsContact SG-N 3.45Å; S54-L58 WeakPolarHBondContact O-CG 3.49Å; S54-L58 PolarHBondContact O-N 3.43Å; I55-L58 PolarHBondContact O-N 2.87Å; L58-L61 WeakPolarHBondContact O-CB 3.43Å; L58-L61 PolarHBondContact O-N 2.81Å; L58-L62 WeakPolarHBondContact O-CG 3.34Å; L58-L62 PolarHBondContact O-N 2.7Å
59	R	82.6	Confident	80.2	Confident	170 Å²	170	52.5 Å²	52.5	64%	0.642	26%	0.263	S	S	*	.	H	α-helix	trans	-59.5	-47.1	172.7	-174.3	173.6	-178.7	164.1	2.7	111.8	I55 C57 L61 L62 D63	I55-R59 PolarHBondContact O-N 2.83Å; C57-R59 VanDerWaalsContact C-N 3.28Å; C57-R59 PolarHBondContact O-N 3.03Å; R59-L61 VanDerWaalsContact C-N 3.26Å; R59-L61 PolarHBondContact O-N 3.16Å; R59-L62 PolarHBondContact O-N 3.31Å; R59-D63 PolarHBondContact O-N 3.4Å
60	S	81.4	Confident	80.5	Confident	21 Å²	21	52.5 Å²	52.5	15%	0.147	26%	0.263	C	S	.	.	H	α-helix	trans	-61.7	-34.8	177.5	-52.2	0	0	0	0	112.2	T28 F31 C56 C57 N64	T28-S60 PolarHBondContact OG1-OG 3.24Å; F31-S60 VanDerWaalsContact CD1-CB 3.47Å; F31-S60 VanDerWaalsContact CE1-O 3.3Å; F31-S60 WeakPolarHBondContact CE1-O 3.07Å; C56-S60 PolarHBondContact O-N 3.28Å; C56-S60 VanDerWaalsContact O-N 3.09Å; C56-S60 PolarHBondContact O-OG 2.81Å; C57-S60 WeakPolarHBondContact O-CB 3.46Å; C57-S60 PolarHBondContact O-N 2.78Å; S60-N64 WeakPolarHBondContact O-CB 3.04Å; S60-N64 PolarHBondContact O-N 2.77Å
61	L	79.4	Confident	80.9	Confident	31 Å²	31	51.2 Å²	51.2	16%	0.162	26%	0.259	C	S	.	.	H	α-helix	trans	-67.6	-41.6	175.7	-177.1	142.7	0	0	0	112.5	F31 C57 L58 R59 A65	F31-L61 HydrophobicContact CD2-CB 3.9Å; F31-L61 HydrophobicContact CD2-CD1 4.3Å; F31-L61 HydrophobicContact CD2-CG 4.49Å; F31-L61 HydrophobicContact CE2-CB 3.57Å; F31-L61 HydrophobicContact CE2-CD1 3.87Å; F31-L61 HydrophobicContact CE2-CG 3.85Å; F31-L61 HydrophobicContact CZ-CB 4.12Å; F31-L61 HydrophobicContact CZ-CG 4.5Å; C57-L61 PolarHBondContact O-N 2.78Å; L58-L61 WeakPolarHBondContact O-CB 3.43Å; L58-L61 PolarHBondContact O-N 2.81Å; R59-L61 VanDerWaalsContact C-N 3.26Å; R59-L61 PolarHBondContact O-N 3.16Å; L61-A65 PolarHBondContact O-N 3.48Å
62	L	75.1	Confident	81	Confident	76 Å²	76	44 Å²	44	40%	0.398	23%	0.234	S	C	.	.	H	α-helix	trans	-69	-42.7	176.2	-69.7	171.6	0	0	0	112.1	L58 R59 N64 A65 C66 L90	L58-L62 WeakPolarHBondContact O-CG 3.34Å; L58-L62 PolarHBondContact O-N 2.7Å; R59-L62 PolarHBondContact O-N 3.31Å; L62-N64 VanDerWaalsContact C-N 3.34Å; L62-N64 PolarHBondContact O-N 3.36Å; L62-A65 PolarHBondContact O-N 3.44Å; L62-C66 PolarHBondContact O-N 3.03Å; L62-L90 HydrophobicContact CB-CD2 3.93Å; L62-L90 HydrophobicContact CD2-CD2 4.12Å; L62-L90 WeakPolarHBondContact O-CD2 3.37Å
63	D	81.5	Confident	81	Confident	65 Å²	65	43.4 Å²	43.4	35%	0.348	23%	0.229	S	C	.	.	H	α-helix	trans	-58.8	-46.4	175.7	-71.3	-24.8	0	0	0	110.3	R59 A65 C66 D67	R59-D63 PolarHBondContact O-N 3.4Å; D63-A65 VanDerWaalsContact C-N 3.34Å; D63-A65 PolarHBondContact O-N 3.05Å; D63-C66 PolarHBondContact O-N 3.15Å; D63-D67 PolarHBondContact O-N 3.02Å
64	N	83.3	Confident	81.1	Confident	78 Å²	78	46.2 Å²	46.2	42%	0.417	24%	0.241	S	C	.	.	H	α-helix	trans	-63.8	-34.8	176.5	-170.8	44.3	0	0	0	113.5	F31 S60 L62 S68	F31-N64 HydrophobicContact CE1-CB 3.76Å; F31-N64 HydrophobicContact CZ-CB 3.69Å; S60-N64 WeakPolarHBondContact O-CB 3.04Å; S60-N64 PolarHBondContact O-N 2.77Å; L62-N64 VanDerWaalsContact C-N 3.34Å; L62-N64 PolarHBondContact O-N 3.36Å; N64-S68 VanDerWaalsContact O-CB 3.25Å; N64-S68 WeakPolarHBondContact O-CB 3.39Å; N64-S68 PolarHBondContact O-N 3.45Å
65	A	79.4	Confident	81	Confident	16 Å²	16	52.4 Å²	52.4	13%	0.132	27%	0.265	C	S	.	.	H	α-helix	trans	-66.2	-40.8	175.5	0	0	0	0	0	111.7	L61 L62 D63 G69 K91	L61-A65 PolarHBondContact O-N 3.48Å; L62-A65 PolarHBondContact O-N 3.44Å; D63-A65 VanDerWaalsContact C-N 3.34Å; D63-A65 PolarHBondContact O-N 3.05Å; A65-G69 PolarHBondContact O-N 2.73Å; A65-K91 HydrophobicContact CB-CB 4.43Å; A65-K91 WeakPolarHBondContact O-CA 3.5Å; A65-K91 WeakPolarHBondContact O-CB 3.37Å; A65-K91 WeakPolarHBondContact O-CG 3Å
66	C	79.6	Confident	80.5	Confident	6 Å²	6	52.1 Å²	52.1	4%	0.041	26%	0.261	C	S	.	.	H	α-helix	trans	-69.5	-43.5	176.5	-177.9	0	0	0	0	112.2	L62 D63 S68 G69 T70 L90 C94	L62-C66 PolarHBondContact O-N 3.03Å; D63-C66 PolarHBondContact O-N 3.15Å; C66-S68 VanDerWaalsContact C-N 3.35Å; C66-S68 PolarHBondContact O-N 3.14Å; C66-G69 PolarHBondContact O-N 3.13Å; C66-T70 PolarHBondContact O-N 3.39Å; C66-T70 PolarHBondContact O-OG1 3.41Å; C66-L90 HydrophobicContact CB-CD2 4.21Å; C66-L90 HydrophobicContact CB-CG 4.14Å; C66-C94 HydrophobicContact CB-CB 3.98Å; C66-C94 WeakPolarHBondContact CB-SG 3.32Å; C66-C94 WeakPolarHBondContact O-CB 3.01Å; C66-C94 WeakPolarHBondContact SG-CB 3.49Å; C66-C94 CovalentContact SG-SG 2.04Å; C66-C94 PolarHBondContact SG-SG 3.31Å
67	D	85.4	Confident	79.8	Confident	53 Å²	53	60.2 Å²	60.2	28%	0.283	30%	0.297	S	S	.	.	H	α-helix	trans	-59.1	-46.4	173.8	-82	-43.9	0	0	0	110.7	D63 G69 T70 D71 K127	D63-D67 PolarHBondContact O-N 3.02Å; D67-G69 VanDerWaalsContact C-N 3.28Å; D67-G69 PolarHBondContact O-N 3.27Å; D67-T70 WeakPolarHBondContact O-CA 3.39Å; D67-T70 VanDerWaalsContact O-CB 3.28Å; D67-T70 WeakPolarHBondContact O-CB 3.03Å; D67-T70 PolarHBondContact O-N 2.92Å; D67-D71 VanDerWaalsContact O-CG 3.3Å; D67-D71 PolarHBondContact O-N 2.95Å; D67-K127 IonicContact OD1-NZ 2.93Å; D67-K127 PolarHBondContact OD1-NZ 2.91Å
68	S	83.6	Confident	79.5	Confident	39 Å²	39	63.9 Å²	63.9	27%	0.273	32%	0.323	S	S	.	.	H	α-helix	trans	-60.6	-34.5	175.8	179.8	0	0	0	0	113.4	N64 C66 I72 K91	N64-S68 VanDerWaalsContact O-CB 3.25Å; N64-S68 WeakPolarHBondContact O-CB 3.39Å; N64-S68 PolarHBondContact O-N 3.45Å; C66-S68 VanDerWaalsContact C-N 3.35Å; C66-S68 PolarHBondContact O-N 3.14Å; S68-I72 WeakPolarHBondContact O-CD1 3.37Å; S68-I72 VanDerWaalsContact O-CG1 3.27Å; S68-I72 WeakPolarHBondContact O-CG1 3.43Å; S68-I72 PolarHBondContact O-N 3.46Å; S68-K91 VanDerWaalsContact OG-CE 3.3Å; S68-K91 WeakPolarHBondContact OG-CE 3.39Å; S68-K91 PolarHBondContact OG-NZ 3.07Å
69	G	82	Confident	79.5	Confident	0 Å²	0	61 Å²	61	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-67.6	-41.7	173	0	0	0	0	0	112.4	A65 C66 D67 D71 I72 A73 K91 C95	A65-G69 PolarHBondContact O-N 2.73Å; C66-G69 PolarHBondContact O-N 3.13Å; D67-G69 VanDerWaalsContact C-N 3.28Å; D67-G69 PolarHBondContact O-N 3.27Å; G69-D71 VanDerWaalsContact C-N 3.33Å; G69-D71 PolarHBondContact O-N 2.82Å; G69-I72 PolarHBondContact O-N 3.28Å; G69-A73 PolarHBondContact O-N 2.65Å; G69-A73 VanDerWaalsContact O-N 3.11Å; G69-K91 WeakPolarHBondContact CA-O 3.41Å; G69-C95 VanDerWaalsContact O-CA 3.29Å; G69-C95 WeakPolarHBondContact O-CA 3.08Å; G69-C95 WeakPolarHBondContact O-CB 3.02Å
70	T	83.9	Confident	78.7	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-61	-42.9	176	-49	0	0	0	0	111.4	C66 D67 A73 K74 C98 S124 K127 C128	C66-T70 PolarHBondContact O-N 3.39Å; C66-T70 PolarHBondContact O-OG1 3.41Å; D67-T70 WeakPolarHBondContact O-CA 3.39Å; D67-T70 VanDerWaalsContact O-CB 3.28Å; D67-T70 WeakPolarHBondContact O-CB 3.03Å; D67-T70 PolarHBondContact O-N 2.92Å; T70-A73 PolarHBondContact O-N 2.92Å; T70-K74 PolarHBondContact O-N 3.48Å; T70-K74 VanDerWaalsContact O-N 3.08Å; T70-C98 HydrophobicContact CG2-CB 4.17Å; T70-S124 WeakPolarHBondContact CB-OG 3.46Å; T70-S124 VanDerWaalsContact CG2-OG 3.25Å; T70-S124 WeakPolarHBondContact CG2-OG 3.04Å; T70-S124 WeakPolarHBondContact OG1-CB 3.07Å; T70-S124 PolarHBondContact OG1-OG 3.33Å; T70-K127 HydrophobicContact CG2-CB 4.39Å; T70-K127 HydrophobicContact CG2-CD 4.07Å; T70-C128 WeakPolarHBondContact CG2-SG 3.3Å
71	D	85	Confident	77.8	Confident	69 Å²	69	59.2 Å²	59.2	37%	0.369	32%	0.321	S	S	.	.	H	α-helix	trans	-68	-38.2	179.5	-63.2	-27	0	0	0	111.7	D67 G69 A73 K74 E75	D67-D71 VanDerWaalsContact O-CG 3.3Å; D67-D71 PolarHBondContact O-N 2.95Å; G69-D71 VanDerWaalsContact C-N 3.33Å; G69-D71 PolarHBondContact O-N 2.82Å; D71-A73 VanDerWaalsContact C-N 3.33Å; D71-A73 PolarHBondContact O-N 3.14Å; D71-K74 WeakPolarHBondContact O-CB 3.07Å; D71-K74 PolarHBondContact O-N 3.12Å; D71-K74 VanDerWaalsContact O-N 3.1Å; D71-E75 PolarHBondContact O-N 2.92Å; D71-E75 VanDerWaalsContact O-N 3.09Å
72	I	81.7	Confident	76.6	Confident	30 Å²	30	64 Å²	64	15%	0.154	35%	0.347	C	S	.	.	H	α-helix	trans	-59.2	-45.1	172.3	-69.2	165	0	0	0	110.6	S68 G69 K74 E75 E76 P80	S68-I72 WeakPolarHBondContact O-CD1 3.37Å; S68-I72 VanDerWaalsContact O-CG1 3.27Å; S68-I72 WeakPolarHBondContact O-CG1 3.43Å; S68-I72 PolarHBondContact O-N 3.46Å; G69-I72 PolarHBondContact O-N 3.28Å; I72-K74 PolarHBondContact O-N 3.27Å; I72-E75 PolarHBondContact O-N 3.33Å; I72-E76 HydrophobicContact CG2-CB 4.2Å; I72-E76 HydrophobicContact CG2-CG 4.34Å; I72-E76 WeakPolarHBondContact O-CA 3.31Å; I72-E76 WeakPolarHBondContact O-CB 3.44Å; I72-E76 PolarHBondContact O-N 3.39Å; I72-P80 HydrophobicContact CD1-CG 4.17Å
73	A	80.9	Confident	75.9	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-65.9	-25.9	177.5	0	0	0	0	0	113.4	G69 T70 D71 C95 C98 L99 K102	G69-A73 PolarHBondContact O-N 2.65Å; G69-A73 VanDerWaalsContact O-N 3.11Å; T70-A73 PolarHBondContact O-N 2.92Å; D71-A73 VanDerWaalsContact C-N 3.33Å; D71-A73 PolarHBondContact O-N 3.14Å; A73-C95 HydrophobicContact CB-CB 4.39Å; A73-C95 VanDerWaalsContact CB-O 3.27Å; A73-C95 WeakPolarHBondContact CB-O 3.32Å; A73-C98 HydrophobicContact CB-CB 3.53Å; A73-C98 WeakPolarHBondContact CB-SG 3.44Å; A73-L99 HydrophobicContact CB-CD2 3.87Å; A73-L99 HydrophobicContact CB-CG 3.81Å; A73-L99 WeakPolarHBondContact O-CD2 3.22Å; A73-K102 VanDerWaalsContact O-CD 3.23Å; A73-K102 WeakPolarHBondContact O-CD 3.48Å; A73-K102 PolarHBondContact O-NZ 2.91Å
74	K	80.3	Confident	74.3	Confident	62 Å²	62	68.6 Å²	68.6	27%	0.27	37%	0.371	S	S	.	.	H	α-helix	trans	-69.9	-43	172.7	-73.6	179.6	176.8	-179.7	0	111.2	T70 D71 I72 K102 D132	T70-K74 PolarHBondContact O-N 3.48Å; T70-K74 VanDerWaalsContact O-N 3.08Å; D71-K74 WeakPolarHBondContact O-CB 3.07Å; D71-K74 PolarHBondContact O-N 3.12Å; D71-K74 VanDerWaalsContact O-N 3.1Å; I72-K74 PolarHBondContact O-N 3.27Å; K74-K102 PolarHBondContact O-NZ 2.84Å; K74-D132 IonicContact NZ-OD1 2.58Å; K74-D132 PolarHBondContact NZ-OD1 3.14Å; K74-D132 IonicContact NZ-OD2 2.78Å; K74-D132 PolarHBondContact NZ-OD2 3.01Å
75	E	77.4	Confident	72.9	Confident	173 Å²	173	71.6 Å²	71.6	81%	0.808	39%	0.386	S	S	*	.	H	α-helix	trans	-91.9	-31.3	-172.9	-64.3	-174.7	172.9	0	0	115	D71 I72	D71-E75 PolarHBondContact O-N 2.92Å; D71-E75 VanDerWaalsContact O-N 3.09Å; I72-E75 PolarHBondContact O-N 3.33Å
76	E	69.3	Low	71.5	Confident	106 Å²	106	77.7 Å²	77.7	50%	0.495	42%	0.415	S	S	.	.			trans	-115.2	156.5	-175.5	-58.7	-173.2	-166.3	0	0	111.8	I72	I72-E76 HydrophobicContact CG2-CB 4.2Å; I72-E76 HydrophobicContact CG2-CG 4.34Å; I72-E76 WeakPolarHBondContact O-CA 3.31Å; I72-E76 WeakPolarHBondContact O-CB 3.44Å; I72-E76 PolarHBondContact O-N 3.39Å
77	E	64.8	Low	70.4	Confident	191 Å²	191	78.2 Å²	78.2	89%	0.893	42%	0.422	S	S	*	.	S	Bend	trans	-87.8	-2.5	178.5	-68.7	-173.4	170.1	0	0	113.6
78	S	73.6	Confident	69.1	Low	78 Å²	78	76.3 Å²	76.3	55%	0.545	42%	0.415	S	S	.	.	S	Bend	trans	-146.2	143.4	-175.9	66.1	0	0	0	0	112.6
79	C	78.2	Confident	68.2	Low	18 Å²	18	76.1 Å²	76.1	12%	0.122	42%	0.419	C	S	.	.			trans	-88.9	150.8	-178.5	-67.7	0	0	0	0	113.6	S81 C95 D96 L99	C79-S81 PolarHBondContact O-N 3.06Å; C79-C95 WeakPolarHBondContact CA-SG 3.08Å; C79-C95 HydrophobicContact CB-CB 3.75Å; C79-C95 WeakPolarHBondContact CB-SG 3.45Å; C79-C95 WeakPolarHBondContact SG-CB 3.27Å; C79-C95 PolarHBondContact SG-O 3.42Å; C79-C95 CovalentContact SG-SG 2.03Å; C79-C95 PolarHBondContact SG-SG 2.76Å; C79-D96 WeakPolarHBondContact CB-OD1 3.42Å; C79-D96 PolarHBondContact SG-N 3.03Å; C79-D96 VanDerWaalsContact SG-N 3.37Å; C79-D96 PolarHBondContact SG-OD1 2.79Å; C79-D96 VanDerWaalsContact SG-OD1 3.36Å; C79-L99 WeakPolarHBondContact SG-CD1 3.4Å
80	P	67.6	Low	67.9	Low	46 Å²	46	78.2 Å²	78.2	30%	0.299	43%	0.43	S	S	.	.			trans	-67.6	132.9	-175	23.8	-31.8	0	0	0	112.6	I72	I72-P80 HydrophobicContact CD1-CG 4.17Å
81	S	61.1	Low	67.6	Low	106 Å²	106	81 Å²	81	74%	0.741	44%	0.442	S	S	*	.			trans	-82.6	-9.1	-177.9	-45	0	0	0	0	114.7	C79	C79-S81 PolarHBondContact O-N 3.06Å
82	N	55	Low	67.3	Low	131 Å²	131	81.2 Å²	81.2	70%	0.701	44%	0.44	S	S	*	.			trans	-98.8	110.5	-167.5	-131.1	-15	0	0	0	111.6
83	I	59.2	Low	67.2	Low	88 Å²	88	83.3 Å²	83.3	45%	0.451	45%	0.449	S	S	.	.			trans	-102.9	2.1	-169.5	-34.8	179.1	0	0	0	112.6	I85	I83-I85 PolarHBondContact O-N 2.77Å
84	N	49.4	Very low	67.3	Low	151 Å²	151	83.3 Å²	83.3	81%	0.807	45%	0.449	S	S	*	.			trans	-78.7	16.5	-166.2	-70.8	-23.9	0	0	0	116.2
85	I	53.7	Low	67.4	Low	141 Å²	141	80.3 Å²	80.3	72%	0.723	44%	0.436	S	S	*	.	S	Bend	trans	-121.6	146.3	177.8	-56.6	175.5	0	0	0	108.9	I83 G87 G88	I83-I85 PolarHBondContact O-N 2.77Å; I85-G87 PolarHBondContact O-N 2.84Å; I85-G87 VanDerWaalsContact O-N 3.08Å; I85-G88 PolarHBondContact O-N 2.87Å
86	L	49.4	Very low	67.6	Low	143 Å²	143	75.6 Å²	75.6	75%	0.749	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	114.7	176.2	-139.9	86.5	0	0	0	110
87	G	55.8	Low	68.1	Low	17 Å²	17	71.1 Å²	71.1	18%	0.175	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	94.5	-3.3	-174.4	0	0	0	0	0	115.7	I85 G89 L90 K91	I85-G87 PolarHBondContact O-N 2.84Å; I85-G87 VanDerWaalsContact O-N 3.08Å; G87-G89 VanDerWaalsContact C-N 3.34Å; G87-G89 PolarHBondContact O-N 2.82Å; G87-L90 PolarHBondContact O-N 3.45Å; G87-K91 PolarHBondContact O-N 3.1Å
88	G	59	Low	69	Low	13 Å²	13	62 Å²	62	13%	0.134	35%	0.354	C	S	.	.	H	α-helix	trans	-64.3	-32.4	-180	0	0	0	0	0	114.5	I85 K91 K92	I85-G88 PolarHBondContact O-N 2.87Å; G88-K91 PolarHBondContact O-N 2.88Å; G88-K92 PolarHBondContact O-N 2.83Å; G88-K92 VanDerWaalsContact O-N 3.11Å
89	G	65.4	Low	69.3	Low	35 Å²	35	60.2 Å²	60.2	36%	0.361	34%	0.338	S	S	.	.	H	α-helix	trans	-64.2	-47.7	174.1	0	0	0	0	0	112.4	G87 K91 K92 E93	G87-G89 VanDerWaalsContact C-N 3.34Å; G87-G89 PolarHBondContact O-N 2.82Å; G89-K91 VanDerWaalsContact C-N 3.32Å; G89-K91 PolarHBondContact O-N 3.39Å; G89-K92 PolarHBondContact O-N 2.04Å; G89-E93 WeakPolarHBondContact O-CB 3.34Å; G89-E93 PolarHBondContact O-N 2.76Å
90	L	74.1	Confident	69.2	Low	44 Å²	44	62.5 Å²	62.5	23%	0.23	35%	0.349	C	S	.	.	H	α-helix	trans	-66.3	-35.5	178	-172.4	66.7	0	0	0	111.8	L62 C66 G87 E93 C94	L62-L90 HydrophobicContact CB-CD2 3.93Å; L62-L90 HydrophobicContact CD2-CD2 4.12Å; L62-L90 WeakPolarHBondContact O-CD2 3.37Å; C66-L90 HydrophobicContact CB-CD2 4.21Å; C66-L90 HydrophobicContact CB-CG 4.14Å; G87-L90 PolarHBondContact O-N 3.45Å; L90-E93 PolarHBondContact O-N 2.88Å; L90-C94 WeakPolarHBondContact O-CB 3.44Å; L90-C94 PolarHBondContact O-N 2.03Å; L90-C94 PolarHBondContact O-SG 2.97Å
91	K	78.3	Confident	69.7	Low	60 Å²	60	60.3 Å²	60.3	26%	0.261	34%	0.335	S	S	.	.	H	α-helix	trans	-61.4	-45.1	174.6	-179.5	165.4	176.4	167.1	0	112.2	A65 S68 G69 G87 G88 G89 C95	A65-K91 HydrophobicContact CB-CB 4.43Å; A65-K91 WeakPolarHBondContact O-CA 3.5Å; A65-K91 WeakPolarHBondContact O-CB 3.37Å; A65-K91 WeakPolarHBondContact O-CG 3Å; S68-K91 VanDerWaalsContact OG-CE 3.3Å; S68-K91 WeakPolarHBondContact OG-CE 3.39Å; S68-K91 PolarHBondContact OG-NZ 3.07Å; G69-K91 WeakPolarHBondContact CA-O 3.41Å; G87-K91 PolarHBondContact O-N 3.1Å; G88-K91 PolarHBondContact O-N 2.88Å; G89-K91 VanDerWaalsContact C-N 3.32Å; G89-K91 PolarHBondContact O-N 3.39Å; K91-C95 WeakPolarHBondContact O-CB 3.23Å; K91-C95 PolarHBondContact O-N 3.24Å; K91-C95 VanDerWaalsContact O-N 3.15Å
92	K	79	Confident	70.4	Confident	72 Å²	72	58.1 Å²	58.1	31%	0.313	31%	0.312	S	S	.	.	H	α-helix	trans	-65.6	-46.7	176	-177	-178.7	175.4	-174.3	0	111.2	G88 G89 C94 C95 D96	G88-K92 PolarHBondContact O-N 2.83Å; G88-K92 VanDerWaalsContact O-N 3.11Å; G89-K92 PolarHBondContact O-N 2.04Å; K92-C94 PolarHBondContact O-N 3.48Å; K92-C95 WeakPolarHBondContact O-CB 3.44Å; K92-C95 PolarHBondContact O-N 3.35Å; K92-C95 VanDerWaalsContact O-N 3.16Å; K92-D96 PolarHBondContact O-N 3.18Å
93	E	79.5	Confident	71.4	Confident	74 Å²	74	54.8 Å²	54.8	35%	0.346	29%	0.294	S	S	.	.	H	α-helix	trans	-57.1	-49	179.4	-172.8	-172.8	167.1	0	0	112	G89 L90 C95 D96 C97 S118 C121	G89-E93 WeakPolarHBondContact O-CB 3.34Å; G89-E93 PolarHBondContact O-N 2.76Å; L90-E93 PolarHBondContact O-N 2.88Å; E93-C95 VanDerWaalsContact C-N 3.34Å; E93-C95 PolarHBondContact O-N 2.87Å; E93-D96 PolarHBondContact O-N 2.79Å; E93-C97 PolarHBondContact O-N 2.79Å; E93-C97 VanDerWaalsContact O-N 3.07Å; E93-C97 PolarHBondContact O-SG 3.15Å; E93-S118 WeakPolarHBondContact OE1-CB 3.37Å; E93-S118 PolarHBondContact OE1-OG 2.85Å; E93-C121 HydrophobicContact CG-CB 4.29Å
94	C	82.9	Confident	71.8	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-64.1	-38.7	177.5	-64.2	0	0	0	0	112	C66 L90 K92 C97 C98 S124	C66-C94 HydrophobicContact CB-CB 3.98Å; C66-C94 WeakPolarHBondContact CB-SG 3.32Å; C66-C94 WeakPolarHBondContact O-CB 3.01Å; C66-C94 WeakPolarHBondContact SG-CB 3.49Å; C66-C94 CovalentContact SG-SG 2.04Å; C66-C94 PolarHBondContact SG-SG 3.31Å; L90-C94 WeakPolarHBondContact O-CB 3.44Å; L90-C94 PolarHBondContact O-N 2.03Å; L90-C94 PolarHBondContact O-SG 2.97Å; K92-C94 PolarHBondContact O-N 3.48Å; C94-C97 PolarHBondContact O-N 2.03Å; C94-C98 PolarHBondContact O-N 3.32Å; C94-S124 PolarHBondContact O-OG 3.38Å
95	C	82.2	Confident	72.9	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-59.5	-50.3	174.3	-176.3	0	0	0	0	112	G69 A73 C79 K91 K92 E93 C97 C98 L99	G69-C95 VanDerWaalsContact O-CA 3.29Å; G69-C95 WeakPolarHBondContact O-CA 3.08Å; G69-C95 WeakPolarHBondContact O-CB 3.02Å; A73-C95 HydrophobicContact CB-CB 4.39Å; A73-C95 VanDerWaalsContact CB-O 3.27Å; A73-C95 WeakPolarHBondContact CB-O 3.32Å; C79-C95 WeakPolarHBondContact CA-SG 3.08Å; C79-C95 HydrophobicContact CB-CB 3.75Å; C79-C95 WeakPolarHBondContact CB-SG 3.45Å; C79-C95 WeakPolarHBondContact SG-CB 3.27Å; C79-C95 PolarHBondContact SG-O 3.42Å; C79-C95 CovalentContact SG-SG 2.03Å; C79-C95 PolarHBondContact SG-SG 2.76Å; K91-C95 WeakPolarHBondContact O-CB 3.23Å; K91-C95 PolarHBondContact O-N 3.24Å; K91-C95 VanDerWaalsContact O-N 3.15Å; K92-C95 WeakPolarHBondContact O-CB 3.44Å; K92-C95 PolarHBondContact O-N 3.35Å; K92-C95 VanDerWaalsContact O-N 3.16Å; E93-C95 VanDerWaalsContact C-N 3.34Å; E93-C95 PolarHBondContact O-N 2.87Å; C95-C97 VanDerWaalsContact C-N 3.3Å; C95-C97 PolarHBondContact O-N 3.43Å; C95-C98 PolarHBondContact O-N 3.23Å; C95-C98 VanDerWaalsContact O-N 3.16Å; C95-L99 PolarHBondContact O-N 2.63Å
96	D	81.1	Confident	73.8	Confident	73 Å²	73	47.7 Å²	47.7	39%	0.39	26%	0.258	S	S	.	.	H	α-helix	trans	-60.8	-40.5	-178.6	-69.1	-27.7	0	0	0	111.1	C79 K92 E93 L99 L100	C79-D96 WeakPolarHBondContact CB-OD1 3.42Å; C79-D96 PolarHBondContact SG-N 3.03Å; C79-D96 VanDerWaalsContact SG-N 3.37Å; C79-D96 PolarHBondContact SG-OD1 2.79Å; C79-D96 VanDerWaalsContact SG-OD1 3.36Å; K92-D96 PolarHBondContact O-N 3.18Å; E93-D96 PolarHBondContact O-N 2.79Å; D96-L99 PolarHBondContact O-N 2.86Å; D96-L100 PolarHBondContact O-N 3.41Å
97	C	81	Confident	74.6	Confident	13 Å²	13	48.2 Å²	48.2	9%	0.088	25%	0.25	C	C	.	.	H	α-helix	trans	-67.5	-36.2	177.5	-60.7	0	0	0	0	113	E93 C94 C95 A101 F117 C121 F125	E93-C97 PolarHBondContact O-N 2.79Å; E93-C97 VanDerWaalsContact O-N 3.07Å; E93-C97 PolarHBondContact O-SG 3.15Å; C94-C97 PolarHBondContact O-N 2.03Å; C95-C97 VanDerWaalsContact C-N 3.3Å; C95-C97 PolarHBondContact O-N 3.43Å; C97-A101 PolarHBondContact O-N 3.43Å; C97-F117 HydrophobicContact CB-CE2 4.39Å; C97-C121 HydrophobicContact CB-CB 4Å; C97-C121 WeakPolarHBondContact CB-SG 3.08Å; C97-C121 WeakPolarHBondContact SG-CB 2.85Å; C97-C121 CovalentContact SG-SG 2.02Å; C97-C121 PolarHBondContact SG-SG 3.2Å; C97-F125 HydrophobicContact CB-CB 4.4Å; C97-F125 WeakPolarHBondContact O-CD2 3.48Å
98	C	82.8	Confident	74.9	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-69.7	-37.4	173.3	171.2	0	0	0	0	112.5	T70 A73 C94 C95 L100 A101 K102 C128	T70-C98 HydrophobicContact CG2-CB 4.17Å; A73-C98 HydrophobicContact CB-CB 3.53Å; A73-C98 WeakPolarHBondContact CB-SG 3.44Å; C94-C98 PolarHBondContact O-N 3.32Å; C95-C98 PolarHBondContact O-N 3.23Å; C95-C98 VanDerWaalsContact O-N 3.16Å; C98-L100 VanDerWaalsContact C-N 3.31Å; C98-L100 PolarHBondContact O-N 3.22Å; C98-A101 WeakPolarHBondContact O-CB 3.19Å; C98-A101 PolarHBondContact O-N 2.88Å; C98-K102 PolarHBondContact O-N 3.42Å; C98-C128 HydrophobicContact CB-CB 3.85Å; C98-C128 WeakPolarHBondContact CB-SG 3.22Å; C98-C128 WeakPolarHBondContact SG-CB 3.5Å; C98-C128 CovalentContact SG-SG 2.01Å; C98-C128 PolarHBondContact SG-SG 3.01Å
99	L	79.8	Confident	74.8	Confident	40 Å²	40	58.8 Å²	58.8	21%	0.209	30%	0.296	C	S	.	.	H	α-helix	trans	-63.3	-38.1	174.2	-74	-174.9	0	0	0	112	A73 C79 C95 D96 K102 D103	A73-L99 HydrophobicContact CB-CD2 3.87Å; A73-L99 HydrophobicContact CB-CG 3.81Å; A73-L99 WeakPolarHBondContact O-CD2 3.22Å; C79-L99 WeakPolarHBondContact SG-CD1 3.4Å; C95-L99 PolarHBondContact O-N 2.63Å; D96-L99 PolarHBondContact O-N 2.86Å; L99-K102 PolarHBondContact O-N 3.09Å; L99-D103 PolarHBondContact O-N 2.04Å
100	L	77.7	Confident	74.3	Confident	66 Å²	66	61.9 Å²	61.9	35%	0.346	31%	0.31	S	S	.	.	H	α-helix	trans	-61.2	-45.1	173.7	-177.6	68.5	0	0	0	111.7	D96 C98 K102 D103 L104 P114 F117 F125	D96-L100 PolarHBondContact O-N 3.41Å; C98-L100 VanDerWaalsContact C-N 3.31Å; C98-L100 PolarHBondContact O-N 3.22Å; L100-K102 VanDerWaalsContact C-N 3.29Å; L100-K102 PolarHBondContact O-N 3.32Å; L100-D103 PolarHBondContact O-N 3.38Å; L100-L104 WeakPolarHBondContact O-CG 3.4Å; L100-L104 PolarHBondContact O-N 2.92Å; L100-P114 HydrophobicContact CD2-CG 4.32Å; L100-F117 HydrophobicContact CD2-CZ 3.8Å; L100-F125 HydrophobicContact CD2-CE2 4.18Å; L100-F125 HydrophobicContact CG-CE2 4.26Å
101	A	76.6	Confident	73.7	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-57.3	-42.5	174.4	0	0	0	0	0	111.9	C97 C98 L104 L105 F125 C128 C129	C97-A101 PolarHBondContact O-N 3.43Å; C98-A101 WeakPolarHBondContact O-CB 3.19Å; C98-A101 PolarHBondContact O-N 2.88Å; A101-L104 PolarHBondContact O-N 2.62Å; A101-L105 WeakPolarHBondContact O-CG 3.31Å; A101-L105 PolarHBondContact O-N 2.04Å; A101-F125 HydrophobicContact CB-CD2 3.69Å; A101-F125 HydrophobicContact CB-CE2 3.86Å; A101-F125 HydrophobicContact CB-CG 4.12Å; A101-F125 HydrophobicContact CB-CZ 4.41Å; A101-C128 HydrophobicContact CB-CB 3.97Å; A101-C129 HydrophobicContact CB-CB 4.3Å; A101-C129 WeakPolarHBondContact CB-SG 3.43Å
102	K	77.4	Confident	73.4	Confident	60 Å²	60	63.7 Å²	63.7	26%	0.261	33%	0.329	S	S	.	.	H	α-helix	trans	-65.1	-39.7	176.2	-75.1	176.8	64.3	178.9	0	112.7	A73 K74 C98 L99 L100 L105 N106	A73-K102 VanDerWaalsContact O-CD 3.23Å; A73-K102 WeakPolarHBondContact O-CD 3.48Å; A73-K102 PolarHBondContact O-NZ 2.91Å; K74-K102 PolarHBondContact O-NZ 2.84Å; C98-K102 PolarHBondContact O-N 3.42Å; L99-K102 PolarHBondContact O-N 3.09Å; L100-K102 VanDerWaalsContact C-N 3.29Å; L100-K102 PolarHBondContact O-N 3.32Å; K102-L105 PolarHBondContact O-N 2.9Å; K102-N106 WeakPolarHBondContact O-CB 3.45Å; K102-N106 VanDerWaalsContact O-CG 3.23Å; K102-N106 PolarHBondContact O-N 3.32Å; K102-N106 PolarHBondContact O-ND2 3.13Å
103	D	75	Confident	72.4	Confident	60 Å²	60	61.7 Å²	61.7	32%	0.321	33%	0.325	S	S	.	.	H	α-helix	trans	-63.1	-42.9	176.3	-175.3	48.6	0	0	0	111.5	L99 L100 N106 R107	L99-D103 PolarHBondContact O-N 2.04Å; L100-D103 PolarHBondContact O-N 3.38Å; D103-N106 PolarHBondContact O-N 2.94Å; D103-R107 VanDerWaalsContact CG-NE 3.32Å; D103-R107 VanDerWaalsContact O-CG 3.29Å; D103-R107 WeakPolarHBondContact O-CG 3.5Å; D103-R107 PolarHBondContact O-N 3.05Å; D103-R107 VanDerWaalsContact O-N 3.07Å; D103-R107 IonicContact OD1-CZ 2.74Å; D103-R107 IonicContact OD1-NE 2.79Å; D103-R107 PolarHBondContact OD1-NE 3.21Å; D103-R107 IonicContact OD1-NH2 2.79Å; D103-R107 PolarHBondContact OD1-NH2 3.05Å; D103-R107 IonicContact OD2-CZ 3.35Å; D103-R107 IonicContact OD2-NE 3.04Å; D103-R107 PolarHBondContact OD2-NE 2.65Å; D103-R107 VanDerWaalsContact OD2-NE 3.1Å; D103-R107 IonicContact OD2-NH2 2.93Å; D103-R107 PolarHBondContact OD2-NH2 3.47Å
104	L	67.8	Low	71.2	Confident	27 Å²	27	61.1 Å²	61.1	14%	0.141	33%	0.328	C	S	.	.	H	α-helix	trans	-62.2	-44.6	175.6	-67.5	174.1	0	0	0	112	L100 A101 N106 R107 N108 E109 F125	L100-L104 WeakPolarHBondContact O-CG 3.4Å; L100-L104 PolarHBondContact O-N 2.92Å; A101-L104 PolarHBondContact O-N 2.62Å; L104-N106 PolarHBondContact O-N 3.06Å; L104-R107 CarbonylContact O-C 3.54Å; L104-R107 PolarHBondContact O-N 3.32Å; L104-R107 VanDerWaalsContact O-N 3.17Å; L104-N108 PolarHBondContact O-N 3.26Å; L104-E109 HydrophobicContact CB-CB 4.48Å; L104-E109 HydrophobicContact CD2-CB 4.23Å; L104-E109 WeakPolarHBondContact CD2-OE2 3.33Å; L104-E109 PolarHBondContact O-N 3.26Å; L104-F125 HydrophobicContact CD1-CE2 3.89Å; L104-F125 HydrophobicContact CD1-CZ 3.75Å
105	L	72.1	Confident	69.7	Low	73 Å²	73	68.6 Å²	68.6	38%	0.382	37%	0.373	S	S	.	.	H	α-helix	trans	-62	-41.4	175.2	-73.4	175.5	0	0	0	112.2	A101 K102 R107 N108 C111	A101-L105 WeakPolarHBondContact O-CG 3.31Å; A101-L105 PolarHBondContact O-N 2.04Å; K102-L105 PolarHBondContact O-N 2.9Å; L105-R107 PolarHBondContact O-N 2.72Å; L105-N108 PolarHBondContact O-N 2.77Å; L105-N108 VanDerWaalsContact O-N 3.08Å; L105-C111 VanDerWaalsContact CD2-SG 3.56Å
106	N	72	Confident	68.2	Low	131 Å²	131	72.2 Å²	72.2	70%	0.701	41%	0.411	S	S	*	.	H	α-helix	trans	-63.7	-26.4	176.7	-75.8	-19.2	0	0	0	112.7	K102 D103 L104	K102-N106 WeakPolarHBondContact O-CB 3.45Å; K102-N106 VanDerWaalsContact O-CG 3.23Å; K102-N106 PolarHBondContact O-N 3.32Å; K102-N106 PolarHBondContact O-ND2 3.13Å; D103-N106 PolarHBondContact O-N 2.94Å; L104-N106 PolarHBondContact O-N 3.06Å
107	R	66.6	Low	67.2	Low	154 Å²	154	71.3 Å²	71.3	58%	0.581	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	3.9	176.7	-65.8	173.5	-168.9	-143.6	9.6	113.6	D103 L104 L105 E109	D103-R107 VanDerWaalsContact CG-NE 3.32Å; D103-R107 VanDerWaalsContact O-CG 3.29Å; D103-R107 WeakPolarHBondContact O-CG 3.5Å; D103-R107 PolarHBondContact O-N 3.05Å; D103-R107 VanDerWaalsContact O-N 3.07Å; D103-R107 IonicContact OD1-CZ 2.74Å; D103-R107 IonicContact OD1-NE 2.79Å; D103-R107 PolarHBondContact OD1-NE 3.21Å; D103-R107 IonicContact OD1-NH2 2.79Å; D103-R107 PolarHBondContact OD1-NH2 3.05Å; D103-R107 IonicContact OD2-CZ 3.35Å; D103-R107 IonicContact OD2-NE 3.04Å; D103-R107 PolarHBondContact OD2-NE 2.65Å; D103-R107 VanDerWaalsContact OD2-NE 3.1Å; D103-R107 IonicContact OD2-NH2 2.93Å; D103-R107 PolarHBondContact OD2-NH2 3.47Å; L104-R107 CarbonylContact O-C 3.54Å; L104-R107 PolarHBondContact O-N 3.32Å; L104-R107 VanDerWaalsContact O-N 3.17Å; L105-R107 PolarHBondContact O-N 2.72Å; R107-E109 HydrophobicContact CB-CG 4.12Å; R107-E109 PolarHBondContact O-N 3.39Å
108	N	63.7	Low	66.6	Low	156 Å²	156	72.8 Å²	72.8	83%	0.834	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	29.4	-172.4	-81.1	20.9	0	0	0	113.7	L104 L105	L104-N108 PolarHBondContact O-N 3.26Å; L105-N108 PolarHBondContact O-N 2.77Å; L105-N108 VanDerWaalsContact O-N 3.08Å
109	E	55.8	Low	65.8	Low	96 Å²	96	76.9 Å²	76.9	45%	0.449	45%	0.448	S	S	.	.			trans	-90.9	150.9	177.6	-72.6	-175.8	-162.3	0	0	111.7	L104 R107 C111	L104-E109 HydrophobicContact CB-CB 4.48Å; L104-E109 HydrophobicContact CD2-CB 4.23Å; L104-E109 WeakPolarHBondContact CD2-OE2 3.33Å; L104-E109 PolarHBondContact O-N 3.26Å; R107-E109 HydrophobicContact CB-CG 4.12Å; R107-E109 PolarHBondContact O-N 3.39Å; E109-C111 PolarHBondContact O-N 3.15Å
110	P	54.6	Low	65.3	Low	100 Å²	100	75.8 Å²	75.8	65%	0.649	45%	0.446	S	S	*	.			trans	-66.6	133.4	179.3	28.7	-34.4	0	0	0	110.5	V112	P110-V112 HydrophobicContact CB-CG2 4.13Å; P110-V112 HydrophobicContact CG-CG2 4.39Å; P110-V112 PolarHBondContact O-N 2.96Å
111	C	62.7	Low	65	Low	39 Å²	39	72.8 Å²	72.8	26%	0.264	43%	0.431	S	S	.	.			trans	-70.6	68.4	-179.5	-100.5	0	0	0	0	112.9	L105 E109 C129	L105-C111 VanDerWaalsContact CD2-SG 3.56Å; E109-C111 PolarHBondContact O-N 3.15Å; C111-C129 HydrophobicContact CB-CB 3.49Å; C111-C129 VanDerWaalsContact CB-CB 3.49Å; C111-C129 WeakPolarHBondContact CB-SG 3.34Å; C111-C129 WeakPolarHBondContact SG-CA 3.44Å; C111-C129 WeakPolarHBondContact SG-CB 3.44Å; C111-C129 CovalentContact SG-SG 2.01Å; C111-C129 PolarHBondContact SG-SG 3.49Å
112	V	70.8	Confident	65	Low	104 Å²	104	76 Å²	76	63%	0.63	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-102.8	116.3	-179.9	-177	0	0	0	0	108.7	P110 P114	P110-V112 HydrophobicContact CB-CG2 4.13Å; P110-V112 HydrophobicContact CG-CG2 4.39Å; P110-V112 PolarHBondContact O-N 2.96Å; V112-P114 WeakPolarHBondContact O-CD 3.43Å
113	A	57.7	Low	65.1	Low	29 Å²	29	80.3 Å²	80.3	24%	0.24	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-67.2	130.7	178.5	0	0	0	0	0	110.7	F117 L122 F125	A113-F117 HydrophobicContact CB-CD2 4.3Å; A113-L122 HydrophobicContact CB-CD1 3.42Å; A113-L122 VanDerWaalsContact CB-CD1 3.42Å; A113-F125 HydrophobicContact CB-CD1 3.75Å; A113-F125 HydrophobicContact CB-CE1 3.73Å; A113-F125 HydrophobicContact CB-CG 4.48Å; A113-F125 HydrophobicContact CB-CZ 4.43Å
114	P	55	Low	65.5	Low	62 Å²	62	77.5 Å²	77.5	40%	0.403	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-57.8	149	171.2	-24.2	32.4	0	0	0	112.7	L100 V112 G116 F117	L100-P114 HydrophobicContact CD2-CG 4.32Å; V112-P114 WeakPolarHBondContact O-CD 3.43Å; P114-G116 PolarHBondContact O-N 3.07Å; P114-F117 HydrophobicContact CB-CD1 4.23Å; P114-F117 HydrophobicContact CB-CE1 3.75Å; P114-F117 HydrophobicContact CB-CZ 4.24Å; P114-F117 VanDerWaalsContact CD-CZ 3.49Å; P114-F117 HydrophobicContact CG-CE1 3.77Å; P114-F117 HydrophobicContact CG-CZ 3.76Å
115	V	50.9	Low	66.1	Low	157 Å²	157	76.2 Å²	76.2	95%	0.952	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	130.7	177.4	-159.8	0	0	0	0	109.3
116	G	50.8	Low	66.4	Low	77 Å²	77	75.3 Å²	75.3	79%	0.794	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	107.3	6.6	178	0	0	0	0	0	115.8	P114	P114-G116 PolarHBondContact O-N 3.07Å
117	F	61.1	Low	66.8	Low	53 Å²	53	72 Å²	72	23%	0.232	42%	0.416	C	S	.	.			trans	-66.7	137.1	174.4	-80.6	17.8	0	0	0	111.8	C97 L100 A113 P114 C121 L122 F125	C97-F117 HydrophobicContact CB-CE2 4.39Å; L100-F117 HydrophobicContact CD2-CZ 3.8Å; A113-F117 HydrophobicContact CB-CD2 4.3Å; P114-F117 HydrophobicContact CB-CD1 4.23Å; P114-F117 HydrophobicContact CB-CE1 3.75Å; P114-F117 HydrophobicContact CB-CZ 4.24Å; P114-F117 VanDerWaalsContact CD-CZ 3.49Å; P114-F117 HydrophobicContact CG-CE1 3.77Å; P114-F117 HydrophobicContact CG-CZ 3.76Å; F117-C121 HydrophobicContact CB-CB 4.37Å; F117-C121 HydrophobicContact CD2-CB 4.46Å; F117-C121 WeakPolarHBondContact CD2-SG 3.44Å; F117-C121 VanDerWaalsContact CE2-SG 3.51Å; F117-C121 WeakPolarHBondContact CG-SG 3.38Å; F117-L122 HydrophobicContact CB-CB 4.04Å; F117-F125 HydrophobicContact CD2-CB 4.26Å; F117-F125 HydrophobicContact CD2-CG 4.43Å; F117-F125 HydrophobicContact CE2-CB 3.99Å; F117-F125 AromaticContact CE2-CD2 3.67Å; F117-F125 HydrophobicContact CE2-CD2 3.67Å; F117-F125 HydrophobicContact CE2-CE2 4.34Å; F117-F125 AromaticContact CE2-CG 3.89Å; F117-F125 HydrophobicContact CE2-CG 3.89Å; F117-F125 HydrophobicContact CZ-CD2 4.43Å
118	S	67.6	Low	67.4	Low	44 Å²	44	65.3 Å²	65.3	31%	0.308	39%	0.392	S	S	.	.			trans	-62.9	158.2	169.6	77	0	0	0	0	110.4	E93 G120 C121 L122	E93-S118 WeakPolarHBondContact OE1-CB 3.37Å; E93-S118 PolarHBondContact OE1-OG 2.85Å; S118-G120 PolarHBondContact O-N 3.29Å; S118-G120 VanDerWaalsContact O-N 3.16Å; S118-C121 PolarHBondContact O-N 3.24Å; S118-C121 VanDerWaalsContact OG-CB 3.32Å; S118-C121 WeakPolarHBondContact OG-CB 3.12Å; S118-C121 PolarHBondContact OG-N 3.11Å; S118-C121 VanDerWaalsContact OG-N 3.13Å; S118-L122 WeakPolarHBondContact O-CB 3.09Å; S118-L122 PolarHBondContact O-N 3.26Å
119	A	67.1	Low	68	Low	86 Å²	86	58.5 Å²	58.5	71%	0.711	36%	0.357	S	S	*	.	H	α-helix	trans	-58.7	-30.2	179.2	0	0	0	0	0	113.1	R123	A119-R123 WeakPolarHBondContact O-CB 3.32Å; A119-R123 PolarHBondContact O-N 3.09Å
120	G	67.7	Low	68.8	Low	17 Å²	17	58.2 Å²	58.2	18%	0.175	36%	0.358	C	S	.	.	H	α-helix	trans	-73.8	-48.2	174.4	0	0	0	0	0	112.5	S118 R123 S124	S118-G120 PolarHBondContact O-N 3.29Å; S118-G120 VanDerWaalsContact O-N 3.16Å; G120-R123 WeakPolarHBondContact O-CB 3.32Å; G120-R123 PolarHBondContact O-N 3.08Å; G120-S124 PolarHBondContact O-N 2.76Å
121	C	72.6	Confident	68.9	Low	4 Å²	4	55.9 Å²	55.9	3%	0.027	35%	0.352	C	S	.	.	H	α-helix	trans	-61.1	-45.1	177	170.6	0	0	0	0	112.1	E93 C97 F117 S118 R123 S124 F125	E93-C121 HydrophobicContact CG-CB 4.29Å; C97-C121 HydrophobicContact CB-CB 4Å; C97-C121 WeakPolarHBondContact CB-SG 3.08Å; C97-C121 WeakPolarHBondContact SG-CB 2.85Å; C97-C121 CovalentContact SG-SG 2.02Å; C97-C121 PolarHBondContact SG-SG 3.2Å; F117-C121 HydrophobicContact CB-CB 4.37Å; F117-C121 HydrophobicContact CD2-CB 4.46Å; F117-C121 WeakPolarHBondContact CD2-SG 3.44Å; F117-C121 VanDerWaalsContact CE2-SG 3.51Å; F117-C121 WeakPolarHBondContact CG-SG 3.38Å; S118-C121 PolarHBondContact O-N 3.24Å; S118-C121 VanDerWaalsContact OG-CB 3.32Å; S118-C121 WeakPolarHBondContact OG-CB 3.12Å; S118-C121 PolarHBondContact OG-N 3.11Å; S118-C121 VanDerWaalsContact OG-N 3.13Å; C121-R123 VanDerWaalsContact C-N 3.33Å; C121-R123 PolarHBondContact O-N 3.37Å; C121-S124 PolarHBondContact O-N 3.24Å; C121-F125 VanDerWaalsContact O-CB 3.3Å; C121-F125 WeakPolarHBondContact O-CB 3.4Å; C121-F125 PolarHBondContact O-N 3.21Å
122	L	76.8	Confident	68.2	Low	67 Å²	67	59 Å²	59	35%	0.351	37%	0.367	S	S	.	.	H	α-helix	trans	-61.6	-41.6	176.9	-176.5	62.8	0	0	0	111.8	A113 F117 S118 N126	A113-L122 HydrophobicContact CB-CD1 3.42Å; A113-L122 VanDerWaalsContact CB-CD1 3.42Å; F117-L122 HydrophobicContact CB-CB 4.04Å; S118-L122 WeakPolarHBondContact O-CB 3.09Å; S118-L122 PolarHBondContact O-N 3.26Å; L122-N126 WeakPolarHBondContact O-CB 3.34Å; L122-N126 PolarHBondContact O-N 3Å; L122-N126 PolarHBondContact O-ND2 3.33Å; L122-N126 VanDerWaalsContact O-ND2 3.13Å
123	R	79.8	Confident	66.5	Low	150 Å²	150	60.2 Å²	60.2	57%	0.566	37%	0.368	S	S	*	.	H	α-helix	trans	-61.9	-47	175.2	-178.6	-171.5	-67	-121.2	-2	111.1	A119 G120 C121 K127	A119-R123 WeakPolarHBondContact O-CB 3.32Å; A119-R123 PolarHBondContact O-N 3.09Å; G120-R123 WeakPolarHBondContact O-CB 3.32Å; G120-R123 PolarHBondContact O-N 3.08Å; C121-R123 VanDerWaalsContact C-N 3.33Å; C121-R123 PolarHBondContact O-N 3.37Å; R123-K127 WeakPolarHBondContact O-CB 3.42Å; R123-K127 PolarHBondContact O-N 3.31Å
124	S	81.7	Confident	65.4	Low	1 Å²	1	67.2 Å²	67.2	1%	0.007	40%	0.396	C	S	.	.	H	α-helix	trans	-65.3	-46.1	-180	-173.2	0	0	0	0	112.7	T70 C94 G120 C121 N126 K127 C128	T70-S124 WeakPolarHBondContact CB-OG 3.46Å; T70-S124 VanDerWaalsContact CG2-OG 3.25Å; T70-S124 WeakPolarHBondContact CG2-OG 3.04Å; T70-S124 WeakPolarHBondContact OG1-CB 3.07Å; T70-S124 PolarHBondContact OG1-OG 3.33Å; C94-S124 PolarHBondContact O-OG 3.38Å; G120-S124 PolarHBondContact O-N 2.76Å; C121-S124 PolarHBondContact O-N 3.24Å; S124-N126 PolarHBondContact O-N 2.92Å; S124-K127 PolarHBondContact O-N 3.28Å; S124-C128 PolarHBondContact O-N 3.28Å
125	F	80.3	Confident	64.3	Low	0 Å²	0	70.5 Å²	70.5	0%	0	41%	0.408	C	S	.	.	H	α-helix	trans	-55	-50.9	174.2	-179.7	-86.9	0	0	0	111.1	C97 L100 A101 L104 A113 F117 C121 K127 C128 C129	C97-F125 HydrophobicContact CB-CB 4.4Å; C97-F125 WeakPolarHBondContact O-CD2 3.48Å; L100-F125 HydrophobicContact CD2-CE2 4.18Å; L100-F125 HydrophobicContact CG-CE2 4.26Å; A101-F125 HydrophobicContact CB-CD2 3.69Å; A101-F125 HydrophobicContact CB-CE2 3.86Å; A101-F125 HydrophobicContact CB-CG 4.12Å; A101-F125 HydrophobicContact CB-CZ 4.41Å; L104-F125 HydrophobicContact CD1-CE2 3.89Å; L104-F125 HydrophobicContact CD1-CZ 3.75Å; A113-F125 HydrophobicContact CB-CD1 3.75Å; A113-F125 HydrophobicContact CB-CE1 3.73Å; A113-F125 HydrophobicContact CB-CG 4.48Å; A113-F125 HydrophobicContact CB-CZ 4.43Å; F117-F125 HydrophobicContact CD2-CB 4.26Å; F117-F125 HydrophobicContact CD2-CG 4.43Å; F117-F125 HydrophobicContact CE2-CB 3.99Å; F117-F125 AromaticContact CE2-CD2 3.67Å; F117-F125 HydrophobicContact CE2-CD2 3.67Å; F117-F125 HydrophobicContact CE2-CE2 4.34Å; F117-F125 AromaticContact CE2-CG 3.89Å; F117-F125 HydrophobicContact CE2-CG 3.89Å; F117-F125 HydrophobicContact CZ-CD2 4.43Å; C121-F125 VanDerWaalsContact O-CB 3.3Å; C121-F125 WeakPolarHBondContact O-CB 3.4Å; C121-F125 PolarHBondContact O-N 3.21Å; F125-K127 VanDerWaalsContact C-N 3.33Å; F125-K127 PolarHBondContact O-N 3.29Å; F125-C128 PolarHBondContact O-N 3.45Å; F125-C129 VanDerWaalsContact CE1-SG 3.58Å; F125-C129 WeakPolarHBondContact O-CB 3.32Å; F125-C129 PolarHBondContact O-N 3.17Å
126	N	78.9	Confident	63.5	Low	55 Å²	55	68.3 Å²	68.3	29%	0.294	40%	0.395	S	S	.	.	H	α-helix	trans	-63.1	-37.9	178.9	-72.3	-24.8	0	0	0	112.5	L122 S124 C128 C129 N130	L122-N126 WeakPolarHBondContact O-CB 3.34Å; L122-N126 PolarHBondContact O-N 3Å; L122-N126 PolarHBondContact O-ND2 3.33Å; L122-N126 VanDerWaalsContact O-ND2 3.13Å; S124-N126 PolarHBondContact O-N 2.92Å; N126-C128 VanDerWaalsContact C-N 3.32Å; N126-C128 PolarHBondContact O-N 2.78Å; N126-C129 PolarHBondContact O-N 3.09Å; N126-N130 WeakPolarHBondContact O-CB 3.45Å; N126-N130 PolarHBondContact O-N 2.71Å
127	K	81.6	Confident	62.4	Low	62 Å²	62	73.2 Å²	73.2	27%	0.27	40%	0.397	S	S	.	.	H	α-helix	trans	-64.3	-36.1	178.1	-161.8	-179.5	-171.4	-171.6	0	111.9	D67 T70 R123 S124 F125 G131 D132	D67-K127 IonicContact OD1-NZ 2.93Å; D67-K127 PolarHBondContact OD1-NZ 2.91Å; T70-K127 HydrophobicContact CG2-CB 4.39Å; T70-K127 HydrophobicContact CG2-CD 4.07Å; R123-K127 WeakPolarHBondContact O-CB 3.42Å; R123-K127 PolarHBondContact O-N 3.31Å; S124-K127 PolarHBondContact O-N 3.28Å; F125-K127 VanDerWaalsContact C-N 3.33Å; F125-K127 PolarHBondContact O-N 3.29Å; K127-G131 PolarHBondContact O-N 2.97Å; K127-D132 WeakPolarHBondContact CE-OD1 3.05Å
128	C	79.3	Confident	61.8	Low	13 Å²	13	75.2 Å²	75.2	9%	0.088	42%	0.424	C	S	.	.	H	α-helix	trans	-84.8	-28.4	178.1	-66.8	0	0	0	0	113.8	T70 C98 A101 S124 F125 N126	T70-C128 WeakPolarHBondContact CG2-SG 3.3Å; C98-C128 HydrophobicContact CB-CB 3.85Å; C98-C128 WeakPolarHBondContact CB-SG 3.22Å; C98-C128 WeakPolarHBondContact SG-CB 3.5Å; C98-C128 CovalentContact SG-SG 2.01Å; C98-C128 PolarHBondContact SG-SG 3.01Å; A101-C128 HydrophobicContact CB-CB 3.97Å; S124-C128 PolarHBondContact O-N 3.28Å; F125-C128 PolarHBondContact O-N 3.45Å; N126-C128 VanDerWaalsContact C-N 3.32Å; N126-C128 PolarHBondContact O-N 2.78Å
129	C	76.4	Confident	60	Low	13 Å²	13	78.5 Å²	78.5	9%	0.088	45%	0.447	C	S	.	.	H	α-helix	trans	-70.8	-40.8	173.6	-97.6	0	0	0	0	113.4	A101 C111 F125 N126	A101-C129 HydrophobicContact CB-CB 4.3Å; A101-C129 WeakPolarHBondContact CB-SG 3.43Å; C111-C129 HydrophobicContact CB-CB 3.49Å; C111-C129 VanDerWaalsContact CB-CB 3.49Å; C111-C129 WeakPolarHBondContact CB-SG 3.34Å; C111-C129 WeakPolarHBondContact SG-CA 3.44Å; C111-C129 WeakPolarHBondContact SG-CB 3.44Å; C111-C129 CovalentContact SG-SG 2.01Å; C111-C129 PolarHBondContact SG-SG 3.49Å; F125-C129 VanDerWaalsContact CE1-SG 3.58Å; F125-C129 WeakPolarHBondContact O-CB 3.32Å; F125-C129 PolarHBondContact O-N 3.17Å; N126-C129 PolarHBondContact O-N 3.09Å
130	N	71.3	Confident	58.6	Low	90 Å²	90	83.3 Å²	83.3	48%	0.481	46%	0.455	S	S	.	.	H	α-helix	trans	-99.5	-7.6	-172.3	-73.4	-20.4	0	0	0	114.7	N126	N126-N130 WeakPolarHBondContact O-CB 3.45Å; N126-N130 PolarHBondContact O-N 2.71Å
131	G	57.3	Low	57	Low	50 Å²	50	89.9 Å²	89.9	52%	0.515	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.6	87.8	-175.5	0	0	0	0	0	112.3	K127 I133	K127-G131 PolarHBondContact O-N 2.97Å; G131-I133 PolarHBondContact O-N 3.28Å; G131-I133 VanDerWaalsContact O-N 3.15Å
132	D	47	Very low	55.3	Low	106 Å²	106	97.7 Å²	97.7	57%	0.567	52%	0.524	S	S	*	.	S	Bend	trans	36.1	59.3	170.5	-64.6	-35.8	0	0	0	116.4	K74 K127	K74-D132 IonicContact NZ-OD1 2.58Å; K74-D132 PolarHBondContact NZ-OD1 3.14Å; K74-D132 IonicContact NZ-OD2 2.78Å; K74-D132 PolarHBondContact NZ-OD2 3.01Å; K127-D132 WeakPolarHBondContact CE-OD1 3.05Å
133	I	36.7	Very low	53.4	Low	129 Å²	129	99.9 Å²	99.9	66%	0.662	54%	0.54	S	S	*	.			trans	-114.2	115.7	158.3	-61.4	175.5	0	0	0	108.2	G131 I135	G131-I133 PolarHBondContact O-N 3.28Å; G131-I133 VanDerWaalsContact O-N 3.15Å; I133-I135 PolarHBondContact O-N 2.92Å
134	E	34.4	Very low	51.4	Low	176 Å²	176	94.3 Å²	94.3	82%	0.822	53%	0.529	S	S	*	.			trans	-64.9	111.7	166.7	-82	-170.6	146.1	0	0	109.6	T136	E134-T136 PolarHBondContact O-N 3.1Å; E134-T136 VanDerWaalsContact O-N 3.08Å
135	I	31.7	Very low	49.7	Very low	130 Å²	130	101.5 Å²	101.5	67%	0.667	56%	0.556	S	S	*	*			trans	-77.7	95.9	170.1	-53	176.3	0	0	0	107.7	I133	I133-I135 PolarHBondContact O-N 2.92Å
136	T	33.9	Very low	47.9	Very low	111 Å²	111	105.7 Å²	105.7	68%	0.681	58%	0.584	S	S	*	*			trans	-92.5	125.1	164.2	44.8	0	0	0	0	108.8	E134	E134-T136 PolarHBondContact O-N 3.1Å; E134-T136 VanDerWaalsContact O-N 3.08Å
137	H	28.2	Very low	46.2	Very low	180 Å²	180	106.3 Å²	106.3	83%	0.833	59%	0.586	S	S	*	*	S	Bend	trans	73.5	102	172	-77.1	-91.6	0	0	0	120.4
138	A	47	Very low	44.5	Very low	95 Å²	95	111.2 Å²	111.2	79%	0.785	62%	0.615	S	S	*	*			trans	14.9	122.6	137	0	0	0	0	0	121.5
139	S	29.8	Very low	42.8	Very low	113 Å²	113	115 Å²	115	79%	0.79	64%	0.635	S	S	*	*				-162.6	128.6	126.3	35.4	0	0	0	0	111.9
140	E	39.2	Very low	40.9	Very low	188 Å²	188	120.2 Å²	120.2	88%	0.879	67%	0.669	S	S	*	*			trans	47.7	94.2	157.6	-64	-179.3	166.7	0	0	119.9
141	I	32.3	Very low	39.4	Very low	155 Å²	155	124 Å²	124	80%	0.795	68%	0.683	S	S	*	*			trans	-133.7	115.4	145.6	-57.8	-179.3	0	0	0	108.1	T143	I141-T143 HydrophobicContact CG2-CG2 4.22Å
142	I	37	Very low	38.5	Very low	167 Å²	167	125.3 Å²	125.3	86%	0.856	68%	0.681	S	S	*	*			trans	-77.5	117.6	174.7	-62.4	167.7	0	0	0	107.5
143	T	38.4	Very low	37.7	Very low	114 Å²	114	128.4 Å²	128.4	70%	0.699	70%	0.697	S	S	*	*			trans	-121.7	126.7	166.9	52.8	0	0	0	0	109.3	I141	I141-T143 HydrophobicContact CG2-CG2 4.22Å
144	G	37.3	Very low	37.9	Very low	32 Å²	32	126.6 Å²	126.6	33%	0.33	69%	0.685	S	S	.	*	P	Polyproline II helix	trans	-62	147.1	173.6	0	0	0	0	0	111.4
145	R	45.6	Very low	37.6	Very low	152 Å²	152	126.6 Å²	126.6	57%	0.574	69%	0.69	S	S	*	*	B	Isolated β-bridge	trans	-94.7	136.5	-171.1	-65.7	-177.3	-171.6	-177.7	1.6	112.2	D157	R145-D157 IonicContact NH1-OD1 3.52Å; R145-D157 IonicContact NH1-OD2 2.94Å; R145-D157 PolarHBondContact NH1-OD2 3.3Å
146	P	41.6	Very low	38.5	Very low	89 Å²	89	123.9 Å²	123.9	58%	0.578	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-73.5	143.7	169.8	-7.6	23.3	0	0	0	111.6
147	L	44.1	Very low	39.4	Very low	67 Å²	67	121.3 Å²	121.3	35%	0.351	68%	0.676	S	S	.	*	S	Bend	trans	-91.7	4.7	-171.7	-92.5	160.7	0	0	0	116.8	C159 C168	L147-C159 WeakPolarHBondContact CD2-O 3.45Å; L147-C168 HydrophobicContact CD1-CB 4.07Å
148	N	45	Very low	40.7	Very low	165 Å²	165	118.6 Å²	118.6	88%	0.882	66%	0.659	S	S	*	*			trans	-132.4	57.4	-178.4	-80.4	-24.6	0	0	0	113.6
149	D	43.9	Very low	41.3	Very low	94 Å²	94	115.1 Å²	115.1	50%	0.503	63%	0.628	S	S	.	*			trans	-112.1	114.1	164.1	-168.6	-26.1	0	0	0	110	H151	D149-H151 PolarHBondContact O-N 2.03Å; D149-H151 VanDerWaalsContact O-N 3.12Å; D149-H151 WeakPolarHBondContact OD1-CB 3.35Å; D149-H151 IonicContact OD1-CD2 3.25Å; D149-H151 IonicContact OD1-CG 2.76Å; D149-H151 PolarHBondContact OD1-N 3.31Å
150	P	37.6	Very low	42.4	Very low	122 Å²	122	113 Å²	113	79%	0.792	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	-0.2	-179.7	-14.4	28.5	0	0	0	115.1
151	H	39.4	Very low	43.2	Very low	168 Å²	168	108.6 Å²	108.6	78%	0.778	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	10.1	-172.9	-67.7	-64.7	0	0	0	115.7	D149	D149-H151 PolarHBondContact O-N 2.03Å; D149-H151 VanDerWaalsContact O-N 3.12Å; D149-H151 WeakPolarHBondContact OD1-CB 3.35Å; D149-H151 IonicContact OD1-CD2 3.25Å; D149-H151 IonicContact OD1-CG 2.76Å; D149-H151 PolarHBondContact OD1-N 3.31Å
152	V	38.5	Very low	44.5	Very low	79 Å²	79	102.1 Å²	102.1	48%	0.479	58%	0.576	S	S	.	*			trans	-116.9	120.5	-177.6	-171.4	0	0	0	0	111.9	H154	V152-H154 VanDerWaalsContact CG1-CE1 3.49Å; V152-H154 WeakPolarHBondContact CG1-CE1 3.47Å; V152-H154 WeakPolarHBondContact CG1-NE2 3.03Å; V152-H154 PolarHBondContact O-CD2 3.24Å; V152-H154 VanDerWaalsContact O-CD2 3.26Å; V152-H154 PolarHBondContact O-N 2.02Å
153	L	30.6	Very low	46.2	Very low	171 Å²	171	101.8 Å²	101.8	90%	0.895	57%	0.571	S	S	*	*			trans	-76.3	114.7	172.2	-135.4	100.6	0	0	0	108.8
154	H	39.3	Very low	47.7	Very low	91 Å²	91	96.7 Å²	96.7	42%	0.421	54%	0.54	S	S	.	.			trans	-104.8	110.6	178.4	-66.8	-80.1	0	0	0	111.5	V152 D157	V152-H154 VanDerWaalsContact CG1-CE1 3.49Å; V152-H154 WeakPolarHBondContact CG1-CE1 3.47Å; V152-H154 WeakPolarHBondContact CG1-NE2 3.03Å; V152-H154 PolarHBondContact O-CD2 3.24Å; V152-H154 VanDerWaalsContact O-CD2 3.26Å; V152-H154 PolarHBondContact O-N 2.02Å; H154-D157 HydrophobicContact CB-CB 4.48Å; H154-D157 IonicContact CE1-OD2 3.63Å; H154-D157 PolarHBondContact CE1-OD2 2.87Å; H154-D157 IonicContact CG-OD2 3.92Å; H154-D157 IonicContact ND1-OD2 2.84Å; H154-D157 PolarHBondContact ND1-OD2 2.79Å
155	L	30	Very low	49.4	Very low	175 Å²	175	100.6 Å²	100.6	92%	0.916	55%	0.549	S	S	*	.	S	Bend	trans	-98	106	158.8	-131.7	84.4	0	0	0	107.4
156	G	48.7	Very low	50.9	Low	74 Å²	74	95.1 Å²	95.1	76%	0.763	53%	0.53	S	S	*	.	S	Bend	trans	91.1	14.8	164.8	0	0	0	0	0	119.1	R158	G156-R158 PolarHBondContact O-N 2.65Å
157	D	53.5	Low	52.3	Low	57 Å²	57	92.7 Å²	92.7	31%	0.305	51%	0.512	S	S	.	.			trans	-80.7	114.2	176.4	-93.1	-24.9	0	0	0	111.6	R145 H154 C159 A160	R145-D157 IonicContact NH1-OD1 3.52Å; R145-D157 IonicContact NH1-OD2 2.94Å; R145-D157 PolarHBondContact NH1-OD2 3.3Å; H154-D157 HydrophobicContact CB-CB 4.48Å; H154-D157 IonicContact CE1-OD2 3.63Å; H154-D157 PolarHBondContact CE1-OD2 2.87Å; H154-D157 IonicContact CG-OD2 3.92Å; H154-D157 IonicContact ND1-OD2 2.84Å; H154-D157 PolarHBondContact ND1-OD2 2.79Å; D157-C159 PolarHBondContact O-N 2.83Å; D157-A160 WeakPolarHBondContact O-CB 3.41Å; D157-A160 PolarHBondContact O-N 2.82Å; D157-A160 VanDerWaalsContact O-N 3.08Å
158	R	56.5	Low	53.5	Low	123 Å²	123	89.8 Å²	89.8	46%	0.464	50%	0.498	S	S	.	.	G	3₁₀ helix	trans	-65.6	-21.5	178.2	-69.8	-177.7	-74.6	-154.3	-6.1	113.5	G156 A160 S161 D170 V176	G156-R158 PolarHBondContact O-N 2.65Å; R158-A160 VanDerWaalsContact C-N 3.28Å; R158-A160 PolarHBondContact O-N 2.75Å; R158-S161 PolarHBondContact O-OG 2.86Å; R158-D170 IonicContact CZ-OD1 3.8Å; R158-D170 IonicContact CZ-OD2 3.51Å; R158-D170 IonicContact NE-OD1 3.3Å; R158-D170 PolarHBondContact NE-OD1 2.72Å; R158-D170 IonicContact NE-OD2 3.82Å; R158-D170 PolarHBondContact NE-OD2 2.73Å; R158-D170 VanDerWaalsContact NH2-CG 3.31Å; R158-D170 IonicContact NH2-OD1 2.83Å; R158-D170 PolarHBondContact NH2-OD1 2.84Å; R158-D170 IonicContact NH2-OD2 3.98Å; R158-D170 PolarHBondContact NH2-OD2 3.32Å; R158-V176 HydrophobicContact CB-CG1 4.06Å
159	C	58.5	Low	54.6	Low	21 Å²	21	84.4 Å²	84.4	14%	0.142	47%	0.467	C	S	.	.	G	3₁₀ helix	trans	-69.1	-20.7	172.2	-75.5	0	0	0	0	113.6	L147 D157 S161 S162 C168	L147-C159 WeakPolarHBondContact CD2-O 3.45Å; D157-C159 PolarHBondContact O-N 2.83Å; C159-S161 PolarHBondContact O-N 3.31Å; C159-S161 VanDerWaalsContact O-N 3.14Å; C159-S162 PolarHBondContact O-N 3.3Å; C159-S162 PolarHBondContact O-OG 3.23Å; C159-C168 WeakPolarHBondContact CA-SG 3.11Å; C159-C168 HydrophobicContact CB-CB 3.72Å; C159-C168 WeakPolarHBondContact CB-SG 3.33Å; C159-C168 WeakPolarHBondContact SG-CB 3.41Å; C159-C168 CovalentContact SG-SG 2.05Å; C159-C168 PolarHBondContact SG-SG 2.78Å
160	A	54.1	Low	55.4	Low	69 Å²	69	82.9 Å²	82.9	57%	0.57	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-67.5	-13	178.5	0	0	0	0	0	113.8	D157 R158	D157-A160 WeakPolarHBondContact O-CB 3.41Å; D157-A160 PolarHBondContact O-N 2.82Å; D157-A160 VanDerWaalsContact O-N 3.08Å; R158-A160 VanDerWaalsContact C-N 3.28Å; R158-A160 PolarHBondContact O-N 2.75Å
161	S	55.5	Low	56.4	Low	95 Å²	95	86.3 Å²	86.3	66%	0.664	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-114.7	1.4	177.7	61.4	0	0	0	0	113.8	R158 C159	R158-S161 PolarHBondContact O-OG 2.86Å; C159-S161 PolarHBondContact O-N 3.31Å; C159-S161 VanDerWaalsContact O-N 3.14Å
162	S	60.1	Low	57	Low	20 Å²	20	81 Å²	81	14%	0.14	45%	0.446	C	S	.	.			trans	-83.5	139.7	177	71.6	0	0	0	0	109.9	C159 C164 C168 V176	C159-S162 PolarHBondContact O-N 3.3Å; C159-S162 PolarHBondContact O-OG 3.23Å; S162-C164 PolarHBondContact O-N 2.93Å; S162-C164 PolarHBondContact OG-SG 2.99Å; S162-C168 PolarHBondContact OG-SG 2.83Å; S162-V176 VanDerWaalsContact CB-CG2 3.44Å
163	H	71.6	Confident	57.9	Low	159 Å²	159	79.3 Å²	79.3	74%	0.736	45%	0.446	S	S	*	.			trans	-87.5	30.3	176.7	-64.8	65.6	0	0	0	111	E165 M191	H163-E165 PolarHBondContact O-N 3.36Å; H163-M191 HydrophobicContact CB-SD 4.06Å
164	C	69.8	Low	59.1	Low	8 Å²	8	81 Å²	81	5%	0.054	45%	0.449	C	S	.	.			trans	-70.1	126	179.9	-58.7	0	0	0	0	109.8	S162 C168 C178	S162-C164 PolarHBondContact O-N 2.93Å; S162-C164 PolarHBondContact OG-SG 2.99Å; C164-C168 HydrophobicContact CB-CB 4.1Å; C164-C178 VanDerWaalsContact CA-SG 3.53Å; C164-C178 HydrophobicContact CB-CB 3.67Å; C164-C178 WeakPolarHBondContact CB-SG 3.3Å; C164-C178 VanDerWaalsContact SG-CA 3.58Å; C164-C178 WeakPolarHBondContact SG-CB 3.12Å; C164-C178 CovalentContact SG-SG 2.03Å; C164-C178 PolarHBondContact SG-SG 3.03Å
165	E	73.3	Confident	60.1	Low	113 Å²	113	85.7 Å²	85.7	53%	0.528	47%	0.468	S	S	.	.	S	Bend	trans	-70.3	-41.8	-174.9	-176.3	167.9	-176	0	0	113.6	H163 M191 A192 C193	H163-E165 PolarHBondContact O-N 3.36Å; E165-M191 PolarHBondContact N-O 2.72Å; E165-A192 WeakPolarHBondContact OE2-CA 3.46Å; E165-C193 HydrophobicContact CB-CB 4.39Å; E165-C193 HydrophobicContact CG-CB 4.48Å; E165-C193 PolarHBondContact OE2-N 3.12Å
166	H	76.4	Confident	61.9	Low	38 Å²	38	79.5 Å²	79.5	18%	0.176	44%	0.437	C	S	.	.	S	Bend	trans	-112.4	-59.8	-173.4	-82.2	159.2	0	0	0	114.9	R181 F184 C193	H166-R181 HydrophobicContact CB-CG 4.14Å; H166-F184 AromaticContact CE1-CD1 3.73Å; H166-F184 AromaticContact CE1-CD2 3.66Å; H166-F184 AromaticContact CE1-CE1 3.96Å; H166-F184 AromaticContact CE1-CE2 3.86Å; H166-F184 AromaticContact CE1-CG 3.6Å; H166-C193 VanDerWaalsContact ND1-CB 3.27Å; H166-C193 WeakPolarHBondContact ND1-CB 3.21Å
167	L	72	Confident	63	Low	38 Å²	38	80.9 Å²	80.9	20%	0.199	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	140.1	-177	-59.8	165.5	0	0	0	109.9	C178 S179 R181	L167-C178 WeakPolarHBondContact O-CA 3.46Å; L167-S179 WeakPolarHBondContact CB-O 3.44Å; L167-S179 PolarHBondContact N-O 2.73Å; L167-S179 PolarHBondContact O-N 2.99Å; L167-R181 HydrophobicContact CD1-CG 4.27Å; L167-R181 HydrophobicContact CG-CG 4.39Å
168	C	69.6	Low	64.1	Low	6 Å²	6	78.9 Å²	78.9	4%	0.041	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	132.6	175.2	174.8	0	0	0	0	110.5	L147 C159 S162 C164	L147-C168 HydrophobicContact CD1-CB 4.07Å; C159-C168 WeakPolarHBondContact CA-SG 3.11Å; C159-C168 HydrophobicContact CB-CB 3.72Å; C159-C168 WeakPolarHBondContact CB-SG 3.33Å; C159-C168 WeakPolarHBondContact SG-CB 3.41Å; C159-C168 CovalentContact SG-SG 2.05Å; C159-C168 PolarHBondContact SG-SG 2.78Å; S162-C168 PolarHBondContact OG-SG 2.83Å; C164-C168 HydrophobicContact CB-CB 4.1Å
169	H	68.1	Low	65	Low	51 Å²	51	74.8 Å²	74.8	24%	0.236	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	122	176	-55.4	-73.4	0	0	0	110.2	E177 S179	H169-E177 HydrophobicContact CB-CB 4.47Å; H169-E177 PolarHBondContact N-O 3.06Å; H169-E177 PolarHBondContact O-N 3.02Å; H169-S179 PolarHBondContact NE2-OG 3.2Å
170	D	61.1	Low	66.1	Low	62 Å²	62	75 Å²	75	33%	0.332	41%	0.406	S	S	.	.			trans	-102.2	97.3	171.3	-175.4	-3.1	0	0	0	109.6	R158 G172	R158-D170 IonicContact CZ-OD1 3.8Å; R158-D170 IonicContact CZ-OD2 3.51Å; R158-D170 IonicContact NE-OD1 3.3Å; R158-D170 PolarHBondContact NE-OD1 2.72Å; R158-D170 IonicContact NE-OD2 3.82Å; R158-D170 PolarHBondContact NE-OD2 2.73Å; R158-D170 VanDerWaalsContact NH2-CG 3.31Å; R158-D170 IonicContact NH2-OD1 2.83Å; R158-D170 PolarHBondContact NH2-OD1 2.84Å; R158-D170 IonicContact NH2-OD2 3.98Å; R158-D170 PolarHBondContact NH2-OD2 3.32Å; D170-G172 PolarHBondContact OD1-N 3.25Å
171	R	57.7	Low	67.1	Low	194 Å²	194	78 Å²	78	73%	0.732	40%	0.402	S	S	*	.			trans	-93.6	12.2	179	-70	179.9	168	166.1	-8.2	113.7	E177	R171-E177 IonicContact CZ-OE2 2.96Å; R171-E177 IonicContact NE-OE2 2.83Å; R171-E177 IonicContact NH1-OE1 3.22Å; R171-E177 IonicContact NH1-OE2 3.1Å; R171-E177 PolarHBondContact NH1-OE2 3.45Å
172	G	52.8	Low	68.1	Low	56 Å²	56	79.1 Å²	79.1	58%	0.577	41%	0.41	S	S	*	.	S	Bend	trans	87.8	12.1	174.5	0	0	0	0	0	116.8	D170	D170-G172 PolarHBondContact OD1-N 3.25Å
173	G	56	Low	68.8	Low	45 Å²	45	79 Å²	79	46%	0.464	41%	0.412	S	S	.	.	S	Bend	trans	-95.4	-170.4	176.7	0	0	0	0	0	115.1	K175	G173-K175 VanDerWaalsContact C-N 3.35Å
174	E	55.9	Low	69.3	Low	207 Å²	207	73.3 Å²	73.3	97%	0.967	39%	0.386	S	S	*	.	S	Bend	trans	-74.5	-17.9	177.8	-74.7	-171.7	164.6	0	0	114.2
175	K	59.8	Low	70.1	Confident	189 Å²	189	77.8 Å²	77.8	82%	0.822	41%	0.409	S	S	*	.	S	Bend	trans	-132.7	145.9	176.9	-66.9	-175.1	180	-177.1	0	110.6	G173	G173-K175 VanDerWaalsContact C-N 3.35Å
176	V	67.8	Low	70.6	Confident	45 Å²	45	76.1 Å²	76.1	27%	0.273	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-79	142.9	171.7	-64.9	0	0	0	0	110.1	R158 S162	R158-V176 HydrophobicContact CB-CG1 4.06Å; S162-V176 VanDerWaalsContact CB-CG2 3.44Å
177	E	71.9	Confident	70.9	Confident	102 Å²	102	75 Å²	75	48%	0.477	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	118.7	-178.2	-172.3	177.6	-169.3	0	0	108.9	H169 R171	H169-E177 HydrophobicContact CB-CB 4.47Å; H169-E177 PolarHBondContact N-O 3.06Å; H169-E177 PolarHBondContact O-N 3.02Å; R171-E177 IonicContact CZ-OE2 2.96Å; R171-E177 IonicContact NE-OE2 2.83Å; R171-E177 IonicContact NH1-OE1 3.22Å; R171-E177 IonicContact NH1-OE2 3.1Å; R171-E177 PolarHBondContact NH1-OE2 3.45Å
178	C	77.8	Confident	71.4	Confident	15 Å²	15	80.2 Å²	80.2	10%	0.101	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	144.1	175.9	-52.7	0	0	0	0	110.1	C164 L167 L186 G190	C164-C178 VanDerWaalsContact CA-SG 3.53Å; C164-C178 HydrophobicContact CB-CB 3.67Å; C164-C178 WeakPolarHBondContact CB-SG 3.3Å; C164-C178 VanDerWaalsContact SG-CA 3.58Å; C164-C178 WeakPolarHBondContact SG-CB 3.12Å; C164-C178 CovalentContact SG-SG 2.03Å; C164-C178 PolarHBondContact SG-SG 3.03Å; L167-C178 WeakPolarHBondContact O-CA 3.46Å; C178-L186 HydrophobicContact CB-CD1 4.19Å; C178-G190 WeakPolarHBondContact CB-O 3.37Å; C178-G190 PolarHBondContact SG-O 2.94Å
179	S	75.2	Confident	71.7	Confident	37 Å²	37	84.3 Å²	84.3	26%	0.259	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	157.4	168.6	79.1	0	0	0	0	110.8	L167 H169	L167-S179 WeakPolarHBondContact CB-O 3.44Å; L167-S179 PolarHBondContact N-O 2.73Å; L167-S179 PolarHBondContact O-N 2.99Å; H169-S179 PolarHBondContact NE2-OG 3.2Å
180	C	80.7	Confident	72.1	Confident	26 Å²	26	83.3 Å²	83.3	18%	0.176	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-95.7	155.9	179.3	-59.6	0	0	0	0	111.7	F184 L186 C193	C180-F184 HydrophobicContact CB-CB 3.88Å; C180-F184 VanDerWaalsContact CB-O 3.25Å; C180-F184 WeakPolarHBondContact CB-O 3.03Å; C180-L186 VanDerWaalsContact SG-CA 3.59Å; C180-C193 WeakPolarHBondContact CA-SG 3.49Å; C180-C193 HydrophobicContact CB-CB 3.83Å; C180-C193 WeakPolarHBondContact CB-SG 3.45Å; C180-C193 WeakPolarHBondContact SG-CA 3.02Å; C180-C193 WeakPolarHBondContact SG-CB 3.38Å; C180-C193 CovalentContact SG-SG 2.03Å; C180-C193 PolarHBondContact SG-SG 3.41Å
181	R	75.8	Confident	72.9	Confident	131 Å²	131	84.3 Å²	84.3	49%	0.494	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-68.5	155.9	166.7	-68.2	174.6	-172.5	-146.8	4	108.6	H166 L167 G183 F184	H166-R181 HydrophobicContact CB-CG 4.14Å; L167-R181 HydrophobicContact CD1-CG 4.27Å; L167-R181 HydrophobicContact CG-CG 4.39Å; R181-G183 PolarHBondContact O-N 3.28Å; R181-F184 PolarHBondContact O-N 3.36Å
182	S	77.6	Confident	74.1	Confident	119 Å²	119	76.4 Å²	76.4	83%	0.832	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	138.2	174.9	-55.7	0	0	0	0	111.1
183	G	74	Confident	75.5	Confident	18 Å²	18	74.1 Å²	74.1	19%	0.186	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.8	3.2	-173.8	0	0	0	0	0	114.9	R181 I196	R181-G183 PolarHBondContact O-N 3.28Å; G183-I196 PolarHBondContact O-N 3.42Å
184	F	82.8	Confident	77	Confident	39 Å²	39	76.2 Å²	76.2	17%	0.171	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	139.7	177.8	-62.8	-98.4	0	0	0	111.1	H166 C180 R181 C193 V194 D195 P216 G217	H166-F184 AromaticContact CE1-CD1 3.73Å; H166-F184 AromaticContact CE1-CD2 3.66Å; H166-F184 AromaticContact CE1-CE1 3.96Å; H166-F184 AromaticContact CE1-CE2 3.86Å; H166-F184 AromaticContact CE1-CG 3.6Å; C180-F184 HydrophobicContact CB-CB 3.88Å; C180-F184 VanDerWaalsContact CB-O 3.25Å; C180-F184 WeakPolarHBondContact CB-O 3.03Å; R181-F184 PolarHBondContact O-N 3.36Å; F184-C193 HydrophobicContact CB-CB 4.1Å; F184-V194 CarbonylContact C-O 3.51Å; F184-V194 VanDerWaalsContact CA-O 3.23Å; F184-V194 WeakPolarHBondContact CA-O 3.5Å; F184-D195 VanDerWaalsContact CD1-CA 3.44Å; F184-D195 HydrophobicContact CD1-CB 4.06Å; F184-D195 HydrophobicContact CE1-CB 3.87Å; F184-P216 HydrophobicContact CZ-CB 4.19Å; F184-G217 VanDerWaalsContact CZ-N 3.26Å
185	D	85.5	Confident	78.5	Confident	103 Å²	103	68.5 Å²	68.5	55%	0.551	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.4	146	174.7	-86	-23.9	0	0	0	111.6	A187 C193 V194 I196	D185-A187 PolarHBondContact O-N 2.93Å; D185-C193 CarbonylContact O-C 3.54Å; D185-C193 WeakPolarHBondContact O-CA 3.48Å; D185-V194 PolarHBondContact N-O 3.06Å; D185-V194 PolarHBondContact O-N 2.81Å; D185-I196 HydrophobicContact CB-CD1 4.42Å; D185-I196 HydrophobicContact CB-CG1 4.12Å
186	L	84.8	Confident	79.7	Confident	77 Å²	77	61.2 Å²	61.2	40%	0.403	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	123.8	177.7	-167.4	71.9	0	0	0	109.8	C178 C180	C178-L186 HydrophobicContact CB-CD1 4.19Å; C180-L186 VanDerWaalsContact SG-CA 3.59Å
187	A	82.8	Confident	80.4	Confident	15 Å²	15	62.2 Å²	62.2	12%	0.124	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-63	159.9	178	0	0	0	0	0	111.6	D185 D189 G190 A192 V194	D185-A187 PolarHBondContact O-N 2.93Å; A187-D189 WeakPolarHBondContact CB-OD1 3.13Å; A187-D189 PolarHBondContact O-N 2.04Å; A187-G190 PolarHBondContact O-N 3.19Å; A187-A192 HydrophobicContact CB-CB 3.94Å; A187-A192 WeakPolarHBondContact CB-O 3.47Å; A187-A192 PolarHBondContact N-O 3.04Å; A187-V194 HydrophobicContact CB-CG2 4.08Å
188	P	80.8	Confident	81.1	Confident	148 Å²	148	58.3 Å²	58.3	96%	0.961	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-18.6	-177.9	-23.8	33.8	0	0	0	115	G190	P188-G190 PolarHBondContact O-N 3.34Å
189	D	77.3	Confident	81.3	Confident	92 Å²	92	59.2 Å²	59.2	49%	0.492	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-9.3	174.2	64.5	11.5	0	0	0	113.3	A187 M191 A192	A187-D189 WeakPolarHBondContact CB-OD1 3.13Å; A187-D189 PolarHBondContact O-N 2.04Å; D189-M191 VanDerWaalsContact C-N 3.26Å; D189-M191 PolarHBondContact O-N 3.15Å; D189-M191 PolarHBondContact OD1-N 2.82Å; D189-A192 PolarHBondContact OD1-N 3.39Å
190	G	76.8	Confident	81.5	Confident	30 Å²	30	61 Å²	61	31%	0.309	37%	0.365	S	S	.	.	S	Bend	trans	72.4	13.5	178.2	0	0	0	0	0	114.3	C178 A187 P188	C178-G190 WeakPolarHBondContact CB-O 3.37Å; C178-G190 PolarHBondContact SG-O 2.94Å; A187-G190 PolarHBondContact O-N 3.19Å; P188-G190 PolarHBondContact O-N 3.34Å
191	M	78.1	Confident	81.3	Confident	82 Å²	82	63.4 Å²	63.4	40%	0.404	38%	0.378	S	S	.	.	S	Bend	trans	-131.4	-38.4	-172.9	-68.4	-177.3	-72.8	0	0	113.7	H163 E165 D189	H163-M191 HydrophobicContact CB-SD 4.06Å; E165-M191 PolarHBondContact N-O 2.72Å; D189-M191 VanDerWaalsContact C-N 3.26Å; D189-M191 PolarHBondContact O-N 3.15Å; D189-M191 PolarHBondContact OD1-N 2.82Å
192	A	81.1	Confident	80.6	Confident	29 Å²	29	64.4 Å²	64.4	24%	0.24	39%	0.393	C	S	.	.			trans	-89	151.6	179.8	0	0	0	0	0	112.1	E165 A187 D189	E165-A192 WeakPolarHBondContact OE2-CA 3.46Å; A187-A192 HydrophobicContact CB-CB 3.94Å; A187-A192 WeakPolarHBondContact CB-O 3.47Å; A187-A192 PolarHBondContact N-O 3.04Å; D189-A192 PolarHBondContact OD1-N 3.39Å
193	C	83.9	Confident	79.9	Confident	8 Å²	8	65.2 Å²	65.2	5%	0.054	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	112.3	179.9	-70.6	0	0	0	0	110.1	E165 H166 C180 F184 D185	E165-C193 HydrophobicContact CB-CB 4.39Å; E165-C193 HydrophobicContact CG-CB 4.48Å; E165-C193 PolarHBondContact OE2-N 3.12Å; H166-C193 VanDerWaalsContact ND1-CB 3.27Å; H166-C193 WeakPolarHBondContact ND1-CB 3.21Å; C180-C193 WeakPolarHBondContact CA-SG 3.49Å; C180-C193 HydrophobicContact CB-CB 3.83Å; C180-C193 WeakPolarHBondContact CB-SG 3.45Å; C180-C193 WeakPolarHBondContact SG-CA 3.02Å; C180-C193 WeakPolarHBondContact SG-CB 3.38Å; C180-C193 CovalentContact SG-SG 2.03Å; C180-C193 PolarHBondContact SG-SG 3.41Å; F184-C193 HydrophobicContact CB-CB 4.1Å; D185-C193 CarbonylContact O-C 3.54Å; D185-C193 WeakPolarHBondContact O-CA 3.48Å
194	V	86.6	Confident	79.4	Confident	88 Å²	88	66.2 Å²	66.2	53%	0.533	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	134	-178.8	-174.6	0	0	0	0	109.2	F184 D185 A187 I196	F184-V194 CarbonylContact C-O 3.51Å; F184-V194 VanDerWaalsContact CA-O 3.23Å; F184-V194 WeakPolarHBondContact CA-O 3.5Å; D185-V194 PolarHBondContact N-O 3.06Å; D185-V194 PolarHBondContact O-N 2.81Å; A187-V194 HydrophobicContact CB-CG2 4.08Å; V194-I196 PolarHBondContact O-N 2.83Å
195	D	86.8	Confident	79	Confident	45 Å²	45	71.6 Å²	71.6	24%	0.241	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	131.1	175.4	-173.6	54.1	0	0	0	111	F184 D197 N214 P216 G217	F184-D195 VanDerWaalsContact CD1-CA 3.44Å; F184-D195 HydrophobicContact CD1-CB 4.06Å; F184-D195 HydrophobicContact CE1-CB 3.87Å; D195-D197 PolarHBondContact O-N 2.75Å; D195-N214 PolarHBondContact OD2-ND2 2.98Å; D195-P216 WeakPolarHBondContact OD1-CA 3.44Å; D195-G217 PolarHBondContact OD1-N 2.94Å
196	I	86.1	Confident	78.4	Confident	37 Å²	37	67.9 Å²	67.9	19%	0.19	40%	0.398	C	S	.	.			trans	-81.5	109.8	175.2	-58.5	175.3	0	0	0	106.8	G183 D185 V194 E198	G183-I196 PolarHBondContact O-N 3.42Å; D185-I196 HydrophobicContact CB-CD1 4.42Å; D185-I196 HydrophobicContact CB-CG1 4.12Å; V194-I196 PolarHBondContact O-N 2.83Å; I196-E198 HydrophobicContact CG2-CG 4.26Å; I196-E198 PolarHBondContact O-N 3.43Å
197	D	82.2	Confident	77.7	Confident	65 Å²	65	68.7 Å²	68.7	35%	0.348	40%	0.403	S	S	.	.			trans	-76.2	91.8	175.2	-170.1	-28.5	0	0	0	110.2	D195 C199 A200 T201 N214	D195-D197 PolarHBondContact O-N 2.75Å; D197-C199 PolarHBondContact O-N 3.44Å; D197-C199 WeakPolarHBondContact OD1-CB 3.32Å; D197-C199 PolarHBondContact OD1-N 3.17Å; D197-C199 VanDerWaalsContact OD1-N 3.15Å; D197-A200 HydrophobicContact CB-CB 3.96Å; D197-A200 VanDerWaalsContact CG-CB 3.5Å; D197-A200 PolarHBondContact O-N 3.01Å; D197-A200 PolarHBondContact OD1-N 2.85Å; D197-T201 WeakPolarHBondContact O-CB 3.49Å; D197-T201 WeakPolarHBondContact O-CG2 3.46Å; D197-T201 PolarHBondContact O-N 2.88Å; D197-T201 PolarHBondContact O-OG1 2.81Å; D197-N214 WeakPolarHBondContact CA-ND2 3.47Å; D197-N214 WeakPolarHBondContact CB-ND2 3.45Å; D197-N214 VanDerWaalsContact CG-ND2 3.34Å; D197-N214 WeakPolarHBondContact OD1-CB 3.5Å
198	E	87.8	Confident	76.6	Confident	20 Å²	20	78.2 Å²	78.2	9%	0.093	45%	0.445	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-25.3	-176.5	-54.8	95.7	156.6	0	0	112.3	I196 T201 L202 M203 D204 N214 S218 F219	I196-E198 HydrophobicContact CG2-CG 4.26Å; I196-E198 PolarHBondContact O-N 3.43Å; E198-T201 WeakPolarHBondContact CA-OG1 3.21Å; E198-T201 PolarHBondContact O-OG1 2.05Å; E198-L202 PolarHBondContact O-N 2.97Å; E198-M203 HydrophobicContact CB-CB 4.42Å; E198-M203 PolarHBondContact O-N 3.07Å; E198-D204 PolarHBondContact O-N 2.79Å; E198-N214 PolarHBondContact OE2-OD1 2.94Å; E198-S218 WeakPolarHBondContact OE1-CA 3.44Å; E198-S218 VanDerWaalsContact OE2-C 3.25Å; E198-F219 HydrophobicContact CB-CB 4.11Å; E198-F219 HydrophobicContact CB-CD1 3.42Å; E198-F219 VanDerWaalsContact CB-CD1 3.42Å; E198-F219 HydrophobicContact CB-CE1 4.04Å; E198-F219 HydrophobicContact CB-CG 3.85Å; E198-F219 HydrophobicContact CG-CD1 3.61Å; E198-F219 HydrophobicContact CG-CE1 4.18Å; E198-F219 HydrophobicContact CG-CG 4.44Å
199	C	81.6	Confident	75.5	Confident	34 Å²	34	73.7 Å²	73.7	23%	0.23	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-30.8	176	-55.3	0	0	0	0	113.2	D197 C212 L213 N214	D197-C199 PolarHBondContact O-N 3.44Å; D197-C199 WeakPolarHBondContact OD1-CB 3.32Å; D197-C199 PolarHBondContact OD1-N 3.17Å; D197-C199 VanDerWaalsContact OD1-N 3.15Å; C199-C212 VanDerWaalsContact CA-SG 3.5Å; C199-C212 HydrophobicContact CB-CB 3.81Å; C199-C212 WeakPolarHBondContact CB-SG 3.17Å; C199-C212 WeakPolarHBondContact SG-CB 3.47Å; C199-C212 CovalentContact SG-SG 2.04Å; C199-C212 PolarHBondContact SG-SG 2.93Å; C199-L213 PolarHBondContact SG-N 2.7Å; C199-N214 HydrophobicContact CB-CB 4.49Å; C199-N214 PolarHBondContact SG-N 2.78Å
200	A	79.8	Confident	75.2	Confident	76 Å²	76	71.3 Å²	71.3	63%	0.628	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-28.3	177.7	0	0	0	0	0	112.7	D197	D197-A200 HydrophobicContact CB-CB 3.96Å; D197-A200 VanDerWaalsContact CG-CB 3.5Å; D197-A200 PolarHBondContact O-N 3.01Å; D197-A200 PolarHBondContact OD1-N 2.85Å
201	T	74.8	Confident	75.1	Confident	75 Å²	75	77.3 Å²	77.3	46%	0.46	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-0.4	-178.7	53.1	0	0	0	0	113.7	D197 E198 M203	D197-T201 WeakPolarHBondContact O-CB 3.49Å; D197-T201 WeakPolarHBondContact O-CG2 3.46Å; D197-T201 PolarHBondContact O-N 2.88Å; D197-T201 PolarHBondContact O-OG1 2.81Å; E198-T201 WeakPolarHBondContact CA-OG1 3.21Å; E198-T201 PolarHBondContact O-OG1 2.05Å; T201-M203 PolarHBondContact O-N 3.03Å
202	L	61.5	Low	75.2	Confident	152 Å²	152	74.8 Å²	74.8	80%	0.796	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	30.9	-175	-63.2	165.7	0	0	0	112.7	E198 D204	E198-L202 PolarHBondContact O-N 2.97Å; L202-D204 VanDerWaalsContact C-N 3.32Å
203	M	62.3	Low	75.2	Confident	136 Å²	136	77.6 Å²	77.6	67%	0.67	42%	0.417	S	S	*	.			trans	-97.3	11.6	173.1	-70	-173.2	155.9	0	0	111.4	E198 T201	E198-M203 HydrophobicContact CB-CB 4.42Å; E198-M203 PolarHBondContact O-N 3.07Å; T201-M203 PolarHBondContact O-N 3.03Å
204	D	64.9	Low	74.9	Confident	39 Å²	39	79.3 Å²	79.3	21%	0.209	43%	0.425	C	S	.	.			trans	-79.6	119.8	175.4	66.5	116.2	0	0	0	112	E198 L202 C206 C212 F219	E198-D204 PolarHBondContact O-N 2.79Å; L202-D204 VanDerWaalsContact C-N 3.32Å; D204-C206 PolarHBondContact O-N 3.31Å; D204-C206 WeakPolarHBondContact OD1-CB 3Å; D204-C212 HydrophobicContact CB-CB 4.05Å; D204-C212 WeakPolarHBondContact CB-SG 3.41Å; D204-C212 WeakPolarHBondContact OD1-CB 3.01Å; D204-F219 VanDerWaalsContact CA-CE2 3.46Å; D204-F219 HydrophobicContact CB-CD2 3.69Å; D204-F219 HydrophobicContact CB-CE2 3.64Å; D204-F219 HydrophobicContact CB-CG 4.38Å; D204-F219 HydrophobicContact CB-CZ 4.3Å
205	D	73.3	Confident	74.7	Confident	152 Å²	152	76.9 Å²	76.9	81%	0.813	41%	0.411	S	S	*	.			trans	-75.6	34.3	173.4	-79.8	-26.5	0	0	0	112.3	F219	D205-F219 HydrophobicContact CB-CZ 4.25Å; D205-F219 VanDerWaalsContact N-CE2 3.34Å; D205-F219 VanDerWaalsContact N-CZ 3.29Å
206	C	72.8	Confident	74.2	Confident	25 Å²	25	80.2 Å²	80.2	17%	0.169	44%	0.435	C	S	.	.			trans	-80.4	136.2	179.7	-61.2	0	0	0	0	111.6	D204 Q210 C221	D204-C206 PolarHBondContact O-N 3.31Å; D204-C206 WeakPolarHBondContact OD1-CB 3Å; C206-Q210 HydrophobicContact CB-CB 4.31Å; C206-C221 WeakPolarHBondContact CA-SG 3.28Å; C206-C221 HydrophobicContact CB-CB 3.72Å; C206-C221 WeakPolarHBondContact CB-SG 3.47Å; C206-C221 WeakPolarHBondContact SG-CA 3.14Å; C206-C221 WeakPolarHBondContact SG-CB 3.28Å; C206-C221 CovalentContact SG-SG 2.03Å; C206-C221 PolarHBondContact SG-SG 3.39Å
207	L	70.1	Confident	73.8	Confident	94 Å²	94	79.4 Å²	79.4	49%	0.492	44%	0.435	S	S	.	.			trans	-65.4	152.7	175	-61.8	170.8	0	0	0	110.4	S209 Q210	L207-S209 PolarHBondContact O-N 2.99Å; L207-Q210 HydrophobicContact CB-CB 4.44Å; L207-Q210 HydrophobicContact CB-CG 4.05Å; L207-Q210 WeakPolarHBondContact O-CA 3.11Å; L207-Q210 WeakPolarHBondContact O-CB 3.12Å; L207-Q210 PolarHBondContact O-N 3.05Å
208	E	59.9	Low	73.9	Confident	216 Å²	216	79.2 Å²	79.2	100%	1.009	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-20.7	175.6	-73.6	-175.6	157.8	0	0	114.1	Q210	E208-Q210 VanDerWaalsContact C-N 3.34Å
209	S	59.1	Low	73.6	Confident	52 Å²	52	80.6 Å²	80.6	36%	0.364	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	7	174.9	60.2	0	0	0	0	113.6	L207 R223 T224	L207-S209 PolarHBondContact O-N 2.99Å; S209-R223 CarbonylContact O-C 3.27Å; S209-T224 PolarHBondContact O-N 2.95Å; S209-T224 PolarHBondContact O-OG1 3.27Å
210	Q	70.2	Confident	73.4	Confident	43 Å²	43	85.3 Å²	85.3	20%	0.201	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	148.2	-177.4	-66.3	170.7	-19.7	0	0	110.2	C206 L207 E208 C221 I222 R223	C206-Q210 HydrophobicContact CB-CB 4.31Å; L207-Q210 HydrophobicContact CB-CB 4.44Å; L207-Q210 HydrophobicContact CB-CG 4.05Å; L207-Q210 WeakPolarHBondContact O-CA 3.11Å; L207-Q210 WeakPolarHBondContact O-CB 3.12Å; L207-Q210 PolarHBondContact O-N 3.05Å; E208-Q210 VanDerWaalsContact C-N 3.34Å; Q210-C221 HydrophobicContact CB-CB 4.23Å; Q210-I222 CarbonylContact C-O 3.57Å; Q210-I222 WeakPolarHBondContact CA-O 3.46Å; Q210-I222 WeakPolarHBondContact CB-O 3.04Å; Q210-R223 HydrophobicContact CG-CB 4.2Å; Q210-R223 HydrophobicContact CG-CG 3.64Å
211	R	75.4	Confident	73.2	Confident	155 Å²	155	83.7 Å²	83.7	59%	0.585	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.2	141.5	167.5	68.5	176.4	-175.7	95.8	-1.3	111	I222	R211-I222 HydrophobicContact CG-CD1 3.58Å; R211-I222 HydrophobicContact CG-CG1 3.5Å; R211-I222 PolarHBondContact N-O 3.41Å; R211-I222 VanDerWaalsContact NE-CD1 3.27Å; R211-I222 WeakPolarHBondContact O-CG1 3.41Å; R211-I222 PolarHBondContact O-N 2.86Å
212	C	80.3	Confident	72.9	Confident	30 Å²	30	83.3 Å²	83.3	20%	0.203	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	145	176.4	-171.7	0	0	0	0	111.7	C199 D204 K220	C199-C212 VanDerWaalsContact CA-SG 3.5Å; C199-C212 HydrophobicContact CB-CB 3.81Å; C199-C212 WeakPolarHBondContact CB-SG 3.17Å; C199-C212 WeakPolarHBondContact SG-CB 3.47Å; C199-C212 CovalentContact SG-SG 2.04Å; C199-C212 PolarHBondContact SG-SG 2.93Å; D204-C212 HydrophobicContact CB-CB 4.05Å; D204-C212 WeakPolarHBondContact CB-SG 3.41Å; D204-C212 WeakPolarHBondContact OD1-CB 3.01Å; C212-K220 CarbonylContact C-O 3.6Å
213	L	79.8	Confident	72.6	Confident	88 Å²	88	85.5 Å²	85.5	46%	0.461	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	117.3	171	178.6	69.4	0	0	0	109.5	C199 F219 K220	C199-L213 PolarHBondContact SG-N 2.7Å; L213-F219 CarbonylContact O-C 3.59Å; L213-F219 WeakPolarHBondContact O-CA 3.41Å; L213-K220 PolarHBondContact N-O 2.63Å; L213-K220 PolarHBondContact O-N 3.24Å
214	N	78.6	Confident	72.2	Confident	44 Å²	44	82.9 Å²	82.9	24%	0.235	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	140.6	179.3	-174.8	30.2	0	0	0	111.1	D195 D197 E198 C199 S218	D195-N214 PolarHBondContact OD2-ND2 2.98Å; D197-N214 WeakPolarHBondContact CA-ND2 3.47Å; D197-N214 WeakPolarHBondContact CB-ND2 3.45Å; D197-N214 VanDerWaalsContact CG-ND2 3.34Å; D197-N214 WeakPolarHBondContact OD1-CB 3.5Å; E198-N214 PolarHBondContact OE2-OD1 2.94Å; C199-N214 HydrophobicContact CB-CB 4.49Å; C199-N214 PolarHBondContact SG-N 2.78Å; N214-S218 PolarHBondContact OD1-O 3.23Å
215	T	80.8	Confident	71.6	Confident	37 Å²	37	89.1 Å²	89.1	23%	0.227	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	152.8	177.2	57.6	0	0	0	0	110.7	G217 S218	T215-G217 PolarHBondContact O-N 3.02Å; T215-S218 CarbonylContact C-O 3.51Å; T215-S218 VanDerWaalsContact C-O 3.27Å; T215-S218 VanDerWaalsContact CA-O 3.26Å; T215-S218 WeakPolarHBondContact CA-O 3.44Å; T215-S218 WeakPolarHBondContact CB-O 3.25Å; T215-S218 PolarHBondContact N-O 3.43Å; T215-S218 CarbonylContact O-C 3.58Å; T215-S218 PolarHBondContact O-N 2.95Å; T215-S218 PolarHBondContact OG1-O 2.92Å
216	P	77.3	Confident	70.7	Confident	115 Å²	115	86.5 Å²	86.5	75%	0.747	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	111.2	-178.9	-26.4	35.4	0	0	0	112.9	F184 D195	F184-P216 HydrophobicContact CZ-CB 4.19Å; D195-P216 WeakPolarHBondContact OD1-CA 3.44Å
217	G	78.6	Confident	70.1	Confident	20 Å²	20	87 Å²	87	21%	0.206	46%	0.459	C	S	.	.	T	Hydrogen-bonded Turn	trans	86	6.1	-178.9	0	0	0	0	0	116.2	F184 D195 T215	F184-G217 VanDerWaalsContact CZ-N 3.26Å; D195-G217 PolarHBondContact OD1-N 2.94Å; T215-G217 PolarHBondContact O-N 3.02Å
218	S	82.6	Confident	69.5	Low	61 Å²	61	84.7 Å²	84.7	43%	0.427	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.1	177.8	-179.9	-158.6	0	0	0	0	113.8	E198 N214 T215	E198-S218 WeakPolarHBondContact OE1-CA 3.44Å; E198-S218 VanDerWaalsContact OE2-C 3.25Å; N214-S218 PolarHBondContact OD1-O 3.23Å; T215-S218 CarbonylContact C-O 3.51Å; T215-S218 VanDerWaalsContact C-O 3.27Å; T215-S218 VanDerWaalsContact CA-O 3.26Å; T215-S218 WeakPolarHBondContact CA-O 3.44Å; T215-S218 WeakPolarHBondContact CB-O 3.25Å; T215-S218 PolarHBondContact N-O 3.43Å; T215-S218 CarbonylContact O-C 3.58Å; T215-S218 PolarHBondContact O-N 2.95Å; T215-S218 PolarHBondContact OG1-O 2.92Å
219	F	83.2	Confident	69.6	Low	49 Å²	49	80.9 Å²	80.9	22%	0.215	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	163.6	171.4	66.4	-75.6	0	0	0	112.7	E198 D204 D205 L213 C221	E198-F219 HydrophobicContact CB-CB 4.11Å; E198-F219 HydrophobicContact CB-CD1 3.42Å; E198-F219 VanDerWaalsContact CB-CD1 3.42Å; E198-F219 HydrophobicContact CB-CE1 4.04Å; E198-F219 HydrophobicContact CB-CG 3.85Å; E198-F219 HydrophobicContact CG-CD1 3.61Å; E198-F219 HydrophobicContact CG-CE1 4.18Å; E198-F219 HydrophobicContact CG-CG 4.44Å; D204-F219 VanDerWaalsContact CA-CE2 3.46Å; D204-F219 HydrophobicContact CB-CD2 3.69Å; D204-F219 HydrophobicContact CB-CE2 3.64Å; D204-F219 HydrophobicContact CB-CG 4.38Å; D204-F219 HydrophobicContact CB-CZ 4.3Å; D205-F219 HydrophobicContact CB-CZ 4.25Å; D205-F219 VanDerWaalsContact N-CE2 3.34Å; D205-F219 VanDerWaalsContact N-CZ 3.29Å; L213-F219 CarbonylContact O-C 3.59Å; L213-F219 WeakPolarHBondContact O-CA 3.41Å; F219-C221 VanDerWaalsContact CE2-SG 3.56Å
220	K	76.1	Confident	69.9	Low	133 Å²	133	79.4 Å²	79.4	58%	0.578	44%	0.442	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.7	133.2	175.4	-69.6	-173.8	179.5	179.6	0	112.4	C212 L213	C212-K220 CarbonylContact C-O 3.6Å; L213-K220 PolarHBondContact N-O 2.63Å; L213-K220 PolarHBondContact O-N 3.24Å
221	C	75.5	Confident	70	Confident	41 Å²	41	80.8 Å²	80.8	28%	0.277	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	127.3	174.8	-53.5	0	0	0	0	111.8	C206 Q210 F219	C206-C221 WeakPolarHBondContact CA-SG 3.28Å; C206-C221 HydrophobicContact CB-CB 3.72Å; C206-C221 WeakPolarHBondContact CB-SG 3.47Å; C206-C221 WeakPolarHBondContact SG-CA 3.14Å; C206-C221 WeakPolarHBondContact SG-CB 3.28Å; C206-C221 CovalentContact SG-SG 2.03Å; C206-C221 PolarHBondContact SG-SG 3.39Å; Q210-C221 HydrophobicContact CB-CB 4.23Å; F219-C221 VanDerWaalsContact CE2-SG 3.56Å
222	I	68.8	Low	69.8	Low	67 Å²	67	75.9 Å²	75.9	34%	0.344	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	125	-176.4	47.8	164.5	0	0	0	111.8	Q210 R211	Q210-I222 CarbonylContact C-O 3.57Å; Q210-I222 WeakPolarHBondContact CA-O 3.46Å; Q210-I222 WeakPolarHBondContact CB-O 3.04Å; R211-I222 HydrophobicContact CG-CD1 3.58Å; R211-I222 HydrophobicContact CG-CG1 3.5Å; R211-I222 PolarHBondContact N-O 3.41Å; R211-I222 VanDerWaalsContact NE-CD1 3.27Å; R211-I222 WeakPolarHBondContact O-CG1 3.41Å; R211-I222 PolarHBondContact O-N 2.86Å
223	R	56.1	Low	69.2	Low	198 Å²	198	79.9 Å²	79.9	75%	0.747	46%	0.455	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.1	148.4	-174.4	-80.2	-171.8	173.7	165.4	-1.3	113.8	S209 Q210	S209-R223 CarbonylContact O-C 3.27Å; Q210-R223 HydrophobicContact CG-CB 4.2Å; Q210-R223 HydrophobicContact CG-CG 3.64Å
224	T	52.5	Low	68.5	Low	82 Å²	82	77.3 Å²	77.3	50%	0.503	44%	0.442	S	S	.	.			trans	-133.5	92	172.3	18	0	0	0	0	110.1	S209	S209-T224 PolarHBondContact O-N 2.95Å; S209-T224 PolarHBondContact O-OG1 3.27Å
225	L	52.3	Low	67.5	Low	169 Å²	169	81.1 Å²	81.1	89%	0.885	47%	0.472	S	S	*	.			trans	-142.8	94.7	148.4	-134.3	105.5	0	0	0	108.4
226	S	55	Low	66.3	Low	97 Å²	97	87.9 Å²	87.9	68%	0.678	50%	0.501	S	S	*	.			trans	-109.1	141.8	177.6	-37.9	0	0	0	0	106.2	G228	S226-G228 PolarHBondContact O-N 3.23Å
227	C	60.3	Low	65.4	Low	37 Å²	37	85.5 Å²	85.5	25%	0.25	49%	0.485	C	S	.	.			trans	-61	14.2	172.4	-86.3	0	0	0	0	113.7	Y231 C240	C227-Y231 WeakPolarHBondContact CB-O 3.48Å; C227-Y231 WeakPolarHBondContact O-CB 3.33Å; C227-C240 VanDerWaalsContact CA-SG 3.56Å; C227-C240 HydrophobicContact CB-CB 3.72Å; C227-C240 WeakPolarHBondContact CB-SG 3.46Å; C227-C240 WeakPolarHBondContact SG-CB 3.44Å; C227-C240 CovalentContact SG-SG 2.05Å; C227-C240 PolarHBondContact SG-SG 3.41Å
228	G	58.2	Low	64.6	Low	45 Å²	45	92.6 Å²	92.6	46%	0.464	51%	0.512	S	S	.	.			trans	71.7	167	-156.4	0	0	0	0	0	110.9	S226	S226-G228 PolarHBondContact O-N 3.23Å
229	T	60.5	Low	63.6	Low	135 Å²	135	98.8 Å²	98.8	83%	0.828	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	136	167.1	45	0	0	0	0	109.6
230	G	65.8	Low	63.1	Low	21 Å²	21	99.3 Å²	99.3	22%	0.216	54%	0.535	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.5	6	177.7	0	0	0	0	0	116.2	V243 G264	G230-V243 PolarHBondContact O-N 3.41Å; G230-G264 WeakPolarHBondContact CA-O 3.44Å
231	Y	72.9	Confident	63.2	Low	73 Å²	73	99.3 Å²	99.3	29%	0.286	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	140.4	171.4	-61.8	-95.1	0	0	0	111	C227 R241 D242 Q263 G264	C227-Y231 WeakPolarHBondContact CB-O 3.48Å; C227-Y231 WeakPolarHBondContact O-CB 3.33Å; Y231-R241 CarbonylContact C-O 3.52Å; Y231-R241 WeakPolarHBondContact CA-O 3.31Å; Y231-R241 WeakPolarHBondContact CB-O 3.4Å; Y231-D242 VanDerWaalsContact CD1-CA 3.48Å; Y231-D242 HydrophobicContact CD1-CB 4.11Å; Y231-D242 HydrophobicContact CE1-CB 3.95Å; Y231-Q263 HydrophobicContact CE1-CG 4.38Å; Y231-Q263 WeakPolarHBondContact OH-CG 3.42Å; Y231-Q263 PolarHBondContact OH-O 2.79Å; Y231-G264 WeakPolarHBondContact OH-CA 3.47Å; Y231-G264 PolarHBondContact OH-N 2.93Å
232	A	70.3	Confident	63.4	Low	51 Å²	51	99.9 Å²	99.9	42%	0.421	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	142.3	176.3	0	0	0	0	0	110.4	D234 C240 R241 V243	A232-D234 PolarHBondContact O-N 3.16Å; A232-C240 WeakPolarHBondContact O-CA 3.11Å; A232-R241 PolarHBondContact N-O 3.22Å; A232-R241 PolarHBondContact O-N 2.95Å; A232-V243 HydrophobicContact CB-CG2 3.41Å; A232-V243 VanDerWaalsContact CB-CG2 3.41Å; A232-V243 VanDerWaalsContact N-CG2 3.33Å
233	M	67.1	Low	64	Low	114 Å²	114	98.3 Å²	98.3	56%	0.562	53%	0.525	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.4	119.2	176.5	-166.5	77.2	95.7	0	0	109.3	S235	M233-S235 PolarHBondContact O-N 3.31Å
234	D	67	Low	65.2	Low	34 Å²	34	91.1 Å²	91.1	18%	0.182	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	119.3	172	-179.1	-72.6	0	0	0	109.4	A232 E236 T237 E238 R239 R241	A232-D234 PolarHBondContact O-N 3.16Å; D234-E236 PolarHBondContact O-N 3.17Å; D234-E236 PolarHBondContact OD1-N 3.13Å; D234-T237 WeakPolarHBondContact CB-OG1 3.5Å; D234-T237 PolarHBondContact O-N 3.14Å; D234-T237 PolarHBondContact OD1-N 3.12Å; D234-T237 PolarHBondContact OD1-OG1 2.95Å; D234-E238 WeakPolarHBondContact O-CA 3.47Å; D234-E238 PolarHBondContact O-N 3.1Å; D234-R239 WeakPolarHBondContact CB-O 3.49Å; D234-R239 PolarHBondContact N-O 2.97Å; D234-R241 HydrophobicContact CB-CG 4.21Å; D234-R241 IonicContact OD1-NH2 3.87Å; D234-R241 IonicContact OD2-CZ 3.58Å; D234-R241 IonicContact OD2-NE 3.18Å; D234-R241 PolarHBondContact OD2-NE 3.48Å; D234-R241 IonicContact OD2-NH1 3.72Å; D234-R241 PolarHBondContact OD2-NH1 3.08Å; D234-R241 IonicContact OD2-NH2 3.97Å; D234-R241 PolarHBondContact OD2-NH2 2.82Å
235	S	57.1	Low	66.7	Low	124 Å²	124	88 Å²	88	87%	0.867	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-12.7	-171.5	49.5	0	0	0	0	114.7	M233	M233-S235 PolarHBondContact O-N 3.31Å
236	E	54.6	Low	68.2	Low	180 Å²	180	81.3 Å²	81.3	84%	0.841	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	-23.6	-178.7	-152	172.7	-161.7	0	0	111.7	D234	D234-E236 PolarHBondContact O-N 3.17Å; D234-E236 PolarHBondContact OD1-N 3.13Å
237	T	58.4	Low	69.5	Low	65 Å²	65	83.3 Å²	83.3	40%	0.399	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120	-2.9	-174.3	55.8	0	0	0	0	114.9	D234 R239 R241	D234-T237 WeakPolarHBondContact CB-OG1 3.5Å; D234-T237 PolarHBondContact O-N 3.14Å; D234-T237 PolarHBondContact OD1-N 3.12Å; D234-T237 PolarHBondContact OD1-OG1 2.95Å; T237-R239 PolarHBondContact O-N 3.45Å; T237-R239 VanDerWaalsContact O-N 3.07Å; T237-R241 PolarHBondContact OG1-NH2 2.94Å
238	E	61.5	Low	70.4	Confident	168 Å²	168	87.4 Å²	87.4	79%	0.785	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	29.2	-177.3	-61.4	-170.9	146.8	0	0	113.6	D234	D234-E238 WeakPolarHBondContact O-CA 3.47Å; D234-E238 PolarHBondContact O-N 3.1Å
239	R	62.5	Low	71	Confident	191 Å²	191	87.8 Å²	87.8	72%	0.721	47%	0.474	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.5	137.7	178.3	-74.6	-179	175.1	177.1	-0.5	110.1	D234 T237 R241	D234-R239 WeakPolarHBondContact CB-O 3.49Å; D234-R239 PolarHBondContact N-O 2.97Å; T237-R239 PolarHBondContact O-N 3.45Å; T237-R239 VanDerWaalsContact O-N 3.07Å; R239-R241 PolarHBondContact O-N 3.11Å
240	C	71.6	Confident	71.6	Confident	60 Å²	60	84.7 Å²	84.7	41%	0.405	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	120.4	173.4	-56.2	0	0	0	0	109.4	C227 A232	C227-C240 VanDerWaalsContact CA-SG 3.56Å; C227-C240 HydrophobicContact CB-CB 3.72Å; C227-C240 WeakPolarHBondContact CB-SG 3.46Å; C227-C240 WeakPolarHBondContact SG-CB 3.44Å; C227-C240 CovalentContact SG-SG 2.05Å; C227-C240 PolarHBondContact SG-SG 3.41Å; A232-C240 WeakPolarHBondContact O-CA 3.11Å
241	R	78.2	Confident	72.1	Confident	134 Å²	134	86.4 Å²	86.4	51%	0.506	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	148	173.1	-70.5	-170.6	-170.5	162.6	14.8	110.1	Y231 A232 D234 T237 R239 V243	Y231-R241 CarbonylContact C-O 3.52Å; Y231-R241 WeakPolarHBondContact CA-O 3.31Å; Y231-R241 WeakPolarHBondContact CB-O 3.4Å; A232-R241 PolarHBondContact N-O 3.22Å; A232-R241 PolarHBondContact O-N 2.95Å; D234-R241 HydrophobicContact CB-CG 4.21Å; D234-R241 IonicContact OD1-NH2 3.87Å; D234-R241 IonicContact OD2-CZ 3.58Å; D234-R241 IonicContact OD2-NE 3.18Å; D234-R241 PolarHBondContact OD2-NE 3.48Å; D234-R241 IonicContact OD2-NH1 3.72Å; D234-R241 PolarHBondContact OD2-NH1 3.08Å; D234-R241 IonicContact OD2-NH2 3.97Å; D234-R241 PolarHBondContact OD2-NH2 2.82Å; T237-R241 PolarHBondContact OG1-NH2 2.94Å; R239-R241 PolarHBondContact O-N 3.11Å; R241-V243 PolarHBondContact O-N 3.2Å
242	D	80	Confident	72.3	Confident	52 Å²	52	89.9 Å²	89.9	28%	0.278	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	133.7	175.8	-177.2	49.5	0	0	0	110.2	Y231 N261 G264	Y231-D242 VanDerWaalsContact CD1-CA 3.48Å; Y231-D242 HydrophobicContact CD1-CB 4.11Å; Y231-D242 HydrophobicContact CE1-CB 3.95Å; D242-N261 PolarHBondContact OD2-ND2 3.35Å; D242-N261 VanDerWaalsContact OD2-ND2 3.15Å; D242-G264 WeakPolarHBondContact OD1-CA 3.38Å; D242-G264 PolarHBondContact OD1-N 2.9Å
243	V	82.1	Confident	72.4	Confident	34 Å²	34	88.2 Å²	88.2	21%	0.206	47%	0.469	C	S	.	.			trans	-91.5	114.2	176.7	-179.9	0	0	0	0	107.2	G230 A232 R241 E245 L248	G230-V243 PolarHBondContact O-N 3.41Å; A232-V243 HydrophobicContact CB-CG2 3.41Å; A232-V243 VanDerWaalsContact CB-CG2 3.41Å; A232-V243 VanDerWaalsContact N-CG2 3.33Å; R241-V243 PolarHBondContact O-N 3.2Å; V243-E245 HydrophobicContact CG1-CG 4.24Å; V243-E245 PolarHBondContact O-N 3.32Å; V243-L248 HydrophobicContact CG1-CD1 3.51Å
244	D	81.3	Confident	72.1	Confident	48 Å²	48	84.3 Å²	84.3	26%	0.257	46%	0.458	S	S	.	.			trans	-77.7	88.8	177.5	-171.8	-28.6	0	0	0	110.8	C246 N247 L248 N261	D244-C246 PolarHBondContact O-N 3.33Å; D244-C246 PolarHBondContact OD1-N 3.37Å; D244-N247 HydrophobicContact CB-CB 4.4Å; D244-N247 PolarHBondContact O-N 3.3Å; D244-N247 PolarHBondContact OD1-N 2.88Å; D244-N247 PolarHBondContact OD2-ND2 3.49Å; D244-L248 WeakPolarHBondContact O-CB 3.12Å; D244-L248 WeakPolarHBondContact O-CD1 3.44Å; D244-L248 PolarHBondContact O-N 3.48Å; D244-L248 VanDerWaalsContact O-N 3.08Å; D244-N261 VanDerWaalsContact CG-ND2 3.32Å; D244-N261 WeakPolarHBondContact OD1-CB 3.41Å
245	E	85	Confident	72	Confident	17 Å²	17	85.8 Å²	85.8	8%	0.079	47%	0.469	C	S	.	.	H	α-helix	trans	-68.4	-21.8	-174.2	-53.9	94.6	160.1	0	0	112.6	V243 G249 S250 H251 N261 S265 Y266	V243-E245 HydrophobicContact CG1-CG 4.24Å; V243-E245 PolarHBondContact O-N 3.32Å; E245-G249 PolarHBondContact O-N 3.11Å; E245-G249 VanDerWaalsContact O-N 3.11Å; E245-S250 WeakPolarHBondContact CB-OG 3.3Å; E245-S250 PolarHBondContact O-N 3.45Å; E245-S250 VanDerWaalsContact O-N 3.09Å; E245-H251 HydrophobicContact CB-CB 4.4Å; E245-H251 PolarHBondContact O-CD2 2.75Å; E245-N261 PolarHBondContact OE2-OD1 3.17Å; E245-S265 VanDerWaalsContact OE2-C 3.3Å; E245-Y266 HydrophobicContact CB-CD1 3.48Å; E245-Y266 VanDerWaalsContact CB-CD1 3.48Å; E245-Y266 HydrophobicContact CB-CE1 3.99Å; E245-Y266 HydrophobicContact CB-CG 4.17Å; E245-Y266 HydrophobicContact CG-CD1 3.77Å; E245-Y266 HydrophobicContact CG-CE1 4.21Å; E245-Y266 WeakPolarHBondContact OE2-CD1 3.4Å; E245-Y266 PolarHBondContact OE2-N 2.03Å
246	C	82.5	Confident	71.9	Confident	28 Å²	28	81.9 Å²	81.9	19%	0.189	44%	0.439	C	S	.	.	H	α-helix	trans	-69.8	-42	176.2	-60.8	0	0	0	0	112.1	D244 C259 R260 N261	D244-C246 PolarHBondContact O-N 3.33Å; D244-C246 PolarHBondContact OD1-N 3.37Å; C246-C259 WeakPolarHBondContact CA-SG 3.23Å; C246-C259 HydrophobicContact CB-CB 3.84Å; C246-C259 WeakPolarHBondContact CB-SG 3.34Å; C246-C259 WeakPolarHBondContact SG-CB 3.46Å; C246-C259 CovalentContact SG-SG 2.04Å; C246-C259 PolarHBondContact SG-SG 2.03Å; C246-R260 PolarHBondContact SG-N 3.32Å; C246-N261 HydrophobicContact CB-CB 4.45Å; C246-N261 PolarHBondContact SG-N 2.89Å
247	N	82.4	Confident	72.7	Confident	138 Å²	138	78.8 Å²	78.8	74%	0.738	42%	0.42	S	S	*	.	H	α-helix	trans	-79.2	-32.1	178.7	-79.1	-37.2	0	0	0	112.8	D244 G249	D244-N247 HydrophobicContact CB-CB 4.4Å; D244-N247 PolarHBondContact O-N 3.3Å; D244-N247 PolarHBondContact OD1-N 2.88Å; D244-N247 PolarHBondContact OD2-ND2 3.49Å; N247-G249 PolarHBondContact O-N 3.2Å
248	L	78.9	Confident	73.7	Confident	124 Å²	124	82.1 Å²	82.1	65%	0.649	43%	0.431	S	S	*	.	H	α-helix	trans	-74.6	-13.2	174.7	-79.3	153.2	0	0	0	112.9	V243 D244 S250	V243-L248 HydrophobicContact CG1-CD1 3.51Å; D244-L248 WeakPolarHBondContact O-CB 3.12Å; D244-L248 WeakPolarHBondContact O-CD1 3.44Å; D244-L248 PolarHBondContact O-N 3.48Å; D244-L248 VanDerWaalsContact O-N 3.08Å; L248-S250 PolarHBondContact O-N 3.03Å
249	G	71.2	Confident	74.7	Confident	53 Å²	53	75.2 Å²	75.2	55%	0.546	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.3	14.2	-176.3	0	0	0	0	0	113.4	E245 N247 H251	E245-G249 PolarHBondContact O-N 3.11Å; E245-G249 VanDerWaalsContact O-N 3.11Å; N247-G249 PolarHBondContact O-N 3.2Å; G249-H251 PolarHBondContact O-N 2.93Å
250	S	73.8	Confident	75.6	Confident	69 Å²	69	72.7 Å²	72.7	48%	0.483	39%	0.392	S	S	.	.			trans	-90.7	29.8	-179.4	63.9	0	0	0	0	112.2	E245 L248	E245-S250 WeakPolarHBondContact CB-OG 3.3Å; E245-S250 PolarHBondContact O-N 3.45Å; E245-S250 VanDerWaalsContact O-N 3.09Å; L248-S250 PolarHBondContact O-N 3.03Å
251	H	75.9	Confident	76	Confident	57 Å²	57	72.1 Å²	72.1	26%	0.264	39%	0.385	S	S	.	.			trans	-108.7	139.9	-178.2	68.8	74.1	0	0	0	110.7	E245 G249 C253 C259 Y266	E245-H251 HydrophobicContact CB-CB 4.4Å; E245-H251 PolarHBondContact O-CD2 2.75Å; G249-H251 PolarHBondContact O-N 2.93Å; H251-C253 VanDerWaalsContact C-N 3.27Å; H251-C253 WeakPolarHBondContact ND1-CB 3.41Å; H251-C253 PolarHBondContact ND1-N 3.46Å; H251-C253 PolarHBondContact O-N 3.42Å; H251-C259 HydrophobicContact CB-CB 4.48Å; H251-C259 VanDerWaalsContact CB-SG 3.58Å; H251-Y266 HydrophobicContact CB-CD1 4.23Å; H251-Y266 HydrophobicContact CB-CD2 3.69Å; H251-Y266 HydrophobicContact CB-CE1 4.04Å; H251-Y266 HydrophobicContact CB-CE2 3.49Å; H251-Y266 VanDerWaalsContact CB-CE2 3.49Å; H251-Y266 HydrophobicContact CB-CG 4.06Å
252	D	76.6	Confident	76.1	Confident	146 Å²	146	68.2 Å²	68.2	78%	0.781	38%	0.375	S	S	*	.			trans	-94.7	22.3	179.5	-63.8	-32.3	0	0	0	112	G254 Y266	D252-G254 PolarHBondContact O-N 2.92Å; D252-Y266 PolarHBondContact N-OH 3.03Å
253	C	71.9	Confident	76	Confident	16 Å²	16	73.8 Å²	73.8	11%	0.108	40%	0.4	C	S	.	.			trans	-58.8	104.4	170.7	-59.7	0	0	0	0	109.2	H251 C259 C268	H251-C253 VanDerWaalsContact C-N 3.27Å; H251-C253 WeakPolarHBondContact ND1-CB 3.41Å; H251-C253 PolarHBondContact ND1-N 3.46Å; H251-C253 PolarHBondContact O-N 3.42Å; C253-C259 HydrophobicContact CB-CB 4.36Å; C253-C268 WeakPolarHBondContact CA-SG 3Å; C253-C268 HydrophobicContact CB-CB 3.75Å; C253-C268 WeakPolarHBondContact CB-SG 3.44Å; C253-C268 VanDerWaalsContact SG-CA 3.58Å; C253-C268 WeakPolarHBondContact SG-CB 3.27Å; C253-C268 CovalentContact SG-SG 2.03Å; C253-C268 PolarHBondContact SG-SG 2.04Å
254	G	62.5	Low	75.6	Confident	32 Å²	32	72.6 Å²	72.6	33%	0.33	40%	0.395	S	S	.	.			trans	-56.6	162.1	178.3	0	0	0	0	0	111.8	D252 L256 Y257	D252-G254 PolarHBondContact O-N 2.92Å; G254-L256 PolarHBondContact O-N 3.46Å; G254-Y257 PolarHBondContact O-N 3.2Å
255	P	63.9	Low	75.5	Confident	65 Å²	65	73 Å²	73	42%	0.422	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-25.5	-170.8	7.6	-21.2	0	0	0	115.6	K271 M282 G284	P255-K271 PolarHBondContact O-NZ 3.01Å; P255-M282 WeakPolarHBondContact CB-O 3.08Å; P255-M282 VanDerWaalsContact CG-C 3.48Å; P255-M282 WeakPolarHBondContact CG-O 3.35Å; P255-G284 WeakPolarHBondContact O-CA 3.46Å
256	L	55.6	Low	75.3	Confident	43 Å²	43	74.9 Å²	74.9	23%	0.225	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-10.7	177.3	-68.7	179.4	0	0	0	115.5	G254 K271 Q279 N280 P281	G254-L256 PolarHBondContact O-N 3.46Å; L256-K271 WeakPolarHBondContact O-CB 3.36Å; L256-K271 PolarHBondContact O-N 3.24Å; L256-Q279 HydrophobicContact CD2-CG 3.72Å; L256-N280 WeakPolarHBondContact CD2-O 3.43Å; L256-P281 VanDerWaalsContact CD1-O 3.31Å; L256-P281 WeakPolarHBondContact CD1-O 3.46Å; L256-P281 WeakPolarHBondContact CG-O 3.36Å
257	Y	70.8	Confident	75.2	Confident	115 Å²	115	79.2 Å²	79.2	45%	0.451	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	149.9	-173	-60	-97.5	0	0	0	110.8	G254 C268 D269 A270	G254-Y257 PolarHBondContact O-N 3.2Å; Y257-C268 HydrophobicContact CD1-CB 4.41Å; Y257-C268 HydrophobicContact CG-CB 4.26Å; Y257-D269 CarbonylContact C-O 3.47Å; Y257-D269 WeakPolarHBondContact CA-O 3.26Å; Y257-A270 HydrophobicContact CD1-CB 3.94Å; Y257-A270 HydrophobicContact CE1-CB 3.8Å
258	Q	80.4	Confident	75.1	Confident	134 Å²	134	75 Å²	75	63%	0.626	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.9	128.8	176.5	-178.4	174.5	4.2	0	0	109.5	C268 D269 K271	Q258-C268 CarbonylContact O-C 3.27Å; Q258-C268 WeakPolarHBondContact O-CA 3.47Å; Q258-D269 PolarHBondContact N-O 2.83Å; Q258-D269 PolarHBondContact O-N 3.05Å; Q258-K271 HydrophobicContact CB-CG 4.22Å
259	C	81	Confident	75.1	Confident	23 Å²	23	71.7 Å²	71.7	16%	0.155	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	135.3	178.2	-168.5	0	0	0	0	111.2	C246 H251 C253	C246-C259 WeakPolarHBondContact CA-SG 3.23Å; C246-C259 HydrophobicContact CB-CB 3.84Å; C246-C259 WeakPolarHBondContact CB-SG 3.34Å; C246-C259 WeakPolarHBondContact SG-CB 3.46Å; C246-C259 CovalentContact SG-SG 2.04Å; C246-C259 PolarHBondContact SG-SG 2.03Å; H251-C259 HydrophobicContact CB-CB 4.48Å; H251-C259 VanDerWaalsContact CB-SG 3.58Å; C253-C259 HydrophobicContact CB-CB 4.36Å
260	R	83	Confident	74.9	Confident	139 Å²	139	72 Å²	72	53%	0.525	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	117	172.3	178.3	178.7	-179.4	157.1	3.9	109.2	C246 R267 D269	C246-R260 PolarHBondContact SG-N 3.32Å; R260-R267 HydrophobicContact CB-CG 4.01Å; R260-R267 HydrophobicContact CG-CG 4.4Å; R260-R267 PolarHBondContact N-O 2.86Å; R260-R267 PolarHBondContact O-N 3.47Å; R260-D269 WeakPolarHBondContact CD-OD2 3.4Å; R260-D269 IonicContact NH1-OD2 2.88Å
261	N	78.2	Confident	74.6	Confident	48 Å²	48	72.6 Å²	72.6	26%	0.257	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	140.5	-178.7	-169.2	34.2	0	0	0	111.1	D242 D244 E245 C246 S265	D242-N261 PolarHBondContact OD2-ND2 3.35Å; D242-N261 VanDerWaalsContact OD2-ND2 3.15Å; D244-N261 VanDerWaalsContact CG-ND2 3.32Å; D244-N261 WeakPolarHBondContact OD1-CB 3.41Å; E245-N261 PolarHBondContact OE2-OD1 3.17Å; C246-N261 HydrophobicContact CB-CB 4.45Å; C246-N261 PolarHBondContact SG-N 2.89Å; N261-S265 PolarHBondContact OD1-O 3.43Å
262	T	81.1	Confident	73.9	Confident	51 Å²	51	79.4 Å²	79.4	31%	0.313	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	164	177.6	52	0	0	0	0	109.8	G264 S265 R267	T262-G264 PolarHBondContact O-N 2.03Å; T262-S265 CarbonylContact C-O 3.56Å; T262-S265 WeakPolarHBondContact CA-O 3.17Å; T262-S265 WeakPolarHBondContact CB-O 3.42Å; T262-S265 PolarHBondContact N-O 2.94Å; T262-S265 PolarHBondContact O-N 3.14Å; T262-S265 PolarHBondContact OG1-O 3.03Å; T262-R267 HydrophobicContact CG2-CG 4.03Å
263	Q	77.7	Confident	73.2	Confident	169 Å²	169	74 Å²	74	79%	0.79	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	113.9	-177.2	-154.7	-173.4	-4.3	0	0	110.2	Y231	Y231-Q263 HydrophobicContact CE1-CG 4.38Å; Y231-Q263 WeakPolarHBondContact OH-CG 3.42Å; Y231-Q263 PolarHBondContact OH-O 2.79Å
264	G	74	Confident	72.5	Confident	10 Å²	10	75.6 Å²	75.6	10%	0.103	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.1	7.8	179.6	0	0	0	0	0	115.6	G230 Y231 D242 T262	G230-G264 WeakPolarHBondContact CA-O 3.44Å; Y231-G264 WeakPolarHBondContact OH-CA 3.47Å; Y231-G264 PolarHBondContact OH-N 2.93Å; D242-G264 WeakPolarHBondContact OD1-CA 3.38Å; D242-G264 PolarHBondContact OD1-N 2.9Å; T262-G264 PolarHBondContact O-N 2.03Å
265	S	78.8	Confident	72.1	Confident	56 Å²	56	82.7 Å²	82.7	39%	0.392	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.6	179.9	-179.4	-156.6	0	0	0	0	111.4	E245 N261 T262	E245-S265 VanDerWaalsContact OE2-C 3.3Å; N261-S265 PolarHBondContact OD1-O 3.43Å; T262-S265 CarbonylContact C-O 3.56Å; T262-S265 WeakPolarHBondContact CA-O 3.17Å; T262-S265 WeakPolarHBondContact CB-O 3.42Å; T262-S265 PolarHBondContact N-O 2.94Å; T262-S265 PolarHBondContact O-N 3.14Å; T262-S265 PolarHBondContact OG1-O 3.03Å
266	Y	81.9	Confident	71.8	Confident	56 Å²	56	83.2 Å²	83.2	22%	0.22	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	158.2	169.2	64.6	-80.6	0	0	0	111.2	E245 H251 D252	E245-Y266 HydrophobicContact CB-CD1 3.48Å; E245-Y266 VanDerWaalsContact CB-CD1 3.48Å; E245-Y266 HydrophobicContact CB-CE1 3.99Å; E245-Y266 HydrophobicContact CB-CG 4.17Å; E245-Y266 HydrophobicContact CG-CD1 3.77Å; E245-Y266 HydrophobicContact CG-CE1 4.21Å; E245-Y266 WeakPolarHBondContact OE2-CD1 3.4Å; E245-Y266 PolarHBondContact OE2-N 2.03Å; H251-Y266 HydrophobicContact CB-CD1 4.23Å; H251-Y266 HydrophobicContact CB-CD2 3.69Å; H251-Y266 HydrophobicContact CB-CE1 4.04Å; H251-Y266 HydrophobicContact CB-CE2 3.49Å; H251-Y266 VanDerWaalsContact CB-CE2 3.49Å; H251-Y266 HydrophobicContact CB-CG 4.06Å; D252-Y266 PolarHBondContact N-OH 3.03Å
267	R	80	Confident	71.9	Confident	120 Å²	120	85.8 Å²	85.8	45%	0.453	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	147	170.2	64.7	-179.4	-110.8	-159.1	-3.1	110.9	R260 T262 D269	R260-R267 HydrophobicContact CB-CG 4.01Å; R260-R267 HydrophobicContact CG-CG 4.4Å; R260-R267 PolarHBondContact N-O 2.86Å; R260-R267 PolarHBondContact O-N 3.47Å; T262-R267 HydrophobicContact CG2-CG 4.03Å; R267-D269 IonicContact CZ-OD1 3.13Å; R267-D269 VanDerWaalsContact CZ-OD1 3.25Å; R267-D269 IonicContact CZ-OD2 2.9Å; R267-D269 IonicContact NE-OD1 3.89Å; R267-D269 PolarHBondContact NE-OD1 2.9Å; R267-D269 IonicContact NE-OD2 3.05Å; R267-D269 IonicContact NH2-OD1 3.89Å; R267-D269 PolarHBondContact NH2-OD1 3.49Å; R267-D269 IonicContact NH2-OD2 3.68Å; R267-D269 PolarHBondContact NH2-OD2 2.85Å
268	C	80	Confident	71.1	Confident	50 Å²	50	82.7 Å²	82.7	34%	0.338	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	106.9	-179.7	-51.9	0	0	0	0	109.5	C253 Y257 Q258	C253-C268 WeakPolarHBondContact CA-SG 3Å; C253-C268 HydrophobicContact CB-CB 3.75Å; C253-C268 WeakPolarHBondContact CB-SG 3.44Å; C253-C268 VanDerWaalsContact SG-CA 3.58Å; C253-C268 WeakPolarHBondContact SG-CB 3.27Å; C253-C268 CovalentContact SG-SG 2.03Å; C253-C268 PolarHBondContact SG-SG 2.04Å; Y257-C268 HydrophobicContact CD1-CB 4.41Å; Y257-C268 HydrophobicContact CG-CB 4.26Å; Q258-C268 CarbonylContact O-C 3.27Å; Q258-C268 WeakPolarHBondContact O-CA 3.47Å
269	D	78.1	Confident	69.8	Low	54 Å²	54	78.9 Å²	78.9	29%	0.289	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	137	177.2	-70.4	-29	0	0	0	109.7	Y257 Q258 R260 R267 K271	Y257-D269 CarbonylContact C-O 3.47Å; Y257-D269 WeakPolarHBondContact CA-O 3.26Å; Q258-D269 PolarHBondContact N-O 2.83Å; Q258-D269 PolarHBondContact O-N 3.05Å; R260-D269 WeakPolarHBondContact CD-OD2 3.4Å; R260-D269 IonicContact NH1-OD2 2.88Å; R267-D269 IonicContact CZ-OD1 3.13Å; R267-D269 VanDerWaalsContact CZ-OD1 3.25Å; R267-D269 IonicContact CZ-OD2 2.9Å; R267-D269 IonicContact NE-OD1 3.89Å; R267-D269 PolarHBondContact NE-OD1 2.9Å; R267-D269 IonicContact NE-OD2 3.05Å; R267-D269 IonicContact NH2-OD1 3.89Å; R267-D269 PolarHBondContact NH2-OD1 3.49Å; R267-D269 IonicContact NH2-OD2 3.68Å; R267-D269 PolarHBondContact NH2-OD2 2.85Å; D269-K271 PolarHBondContact O-N 2.78Å
270	A	68.3	Low	68.6	Low	60 Å²	60	80.4 Å²	80.4	50%	0.496	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	127.6	-177.5	0	0	0	0	0	111.6	Y257 K272	Y257-A270 HydrophobicContact CD1-CB 3.94Å; Y257-A270 HydrophobicContact CE1-CB 3.8Å; A270-K272 PolarHBondContact O-N 3.37Å
271	K	66.7	Low	67	Low	80 Å²	80	78.6 Å²	78.6	35%	0.348	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-69.8	124.9	170.1	-66.6	174.1	-176.2	170.2	0	107.9	P255 L256 Q258 D269 Q279	P255-K271 PolarHBondContact O-NZ 3.01Å; L256-K271 WeakPolarHBondContact O-CB 3.36Å; L256-K271 PolarHBondContact O-N 3.24Å; Q258-K271 HydrophobicContact CB-CG 4.22Å; D269-K271 PolarHBondContact O-N 2.78Å; K271-Q279 PolarHBondContact O-NE2 3.11Å; K271-Q279 PolarHBondContact O-OE1 3.08Å; K271-Q279 VanDerWaalsContact O-OE1 3.05Å
272	K	61.7	Low	65.4	Low	200 Å²	200	83.4 Å²	83.4	87%	0.87	46%	0.464	S	S	*	.			trans	-106.4	126.6	178.1	-66.8	-174.3	178.7	-176.7	0	111	A270	A270-K272 PolarHBondContact O-N 3.37Å
273	C	60.7	Low	64	Low	33 Å²	33	84 Å²	84	22%	0.223	47%	0.468	C	S	.	.	P	Polyproline II helix	trans	-81.9	158	170.7	-62.6	0	0	0	0	111.4	E277 Q279 C286	C273-E277 HydrophobicContact CB-CB 4.34Å; C273-Q279 VanDerWaalsContact SG-CB 3.5Å; C273-C286 HydrophobicContact CB-CB 3.81Å; C273-C286 WeakPolarHBondContact CB-SG 3.14Å; C273-C286 WeakPolarHBondContact SG-CB 3.1Å; C273-C286 CovalentContact SG-SG 2.02Å; C273-C286 PolarHBondContact SG-SG 3.44Å
274	G	59	Low	62.9	Low	49 Å²	49	76.3 Å²	76.3	51%	0.505	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-70	165.6	176.1	0	0	0	0	0	113.2	G276 E277	G274-G276 PolarHBondContact O-N 3.23Å; G274-E277 PolarHBondContact O-N 2.05Å
275	D	53.5	Low	62	Low	181 Å²	181	82.4 Å²	82.4	97%	0.968	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	123.6	-178.6	-78.1	-33.1	0	0	0	112.1
276	G	56.8	Low	61	Low	76 Å²	76	82.1 Å²	82.1	78%	0.784	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.4	3.3	177	0	0	0	0	0	115.9	G274	G274-G276 PolarHBondContact O-N 3.23Å
277	E	58.3	Low	59.8	Low	97 Å²	97	83.3 Å²	83.3	45%	0.453	47%	0.47	S	S	.	.			trans	-111.2	153.3	174.8	-62.8	-175.8	154.8	0	0	112.1	C273 G274 C286	C273-E277 HydrophobicContact CB-CB 4.34Å; G274-E277 PolarHBondContact O-N 2.05Å; E277-C286 HydrophobicContact CB-CB 4.04Å; E277-C286 VanDerWaalsContact OE2-CB 3.27Å; E277-C286 WeakPolarHBondContact OE2-CB 2.97Å
278	L	53.4	Low	58.6	Low	51 Å²	51	82.1 Å²	82.1	27%	0.267	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	120.9	-178.4	-66.3	163.2	0	0	0	110.9	N280 C286 T287 I289	L278-N280 PolarHBondContact O-N 3.26Å; L278-C286 CarbonylContact O-C 3.47Å; L278-T287 WeakPolarHBondContact CA-O 3.34Å; L278-T287 PolarHBondContact N-O 3.01Å; L278-T287 PolarHBondContact O-N 2.54Å; L278-T287 PolarHBondContact O-OG1 3.36Å; L278-I289 HydrophobicContact CB-CD1 4.31Å; L278-I289 HydrophobicContact CB-CG1 4.44Å; L278-I289 HydrophobicContact CD1-CB 3.62Å; L278-I289 HydrophobicContact CD1-CD1 3.17Å; L278-I289 HydrophobicContact CD1-CG1 3.4Å; L278-I289 VanDerWaalsContact CD1-CG1 3.4Å; L278-I289 HydrophobicContact CG-CD1 4.37Å
279	Q	54.4	Low	57.7	Low	54 Å²	54	83.2 Å²	83.2	25%	0.252	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	120.9	178.1	-161.5	169.8	30.2	0	0	109	L256 K271 C273 P281 G284 E285	L256-Q279 HydrophobicContact CD2-CG 3.72Å; K271-Q279 PolarHBondContact O-NE2 3.11Å; K271-Q279 PolarHBondContact O-OE1 3.08Å; K271-Q279 VanDerWaalsContact O-OE1 3.05Å; C273-Q279 VanDerWaalsContact SG-CB 3.5Å; Q279-P281 VanDerWaalsContact O-CD 3.23Å; Q279-P281 WeakPolarHBondContact O-CD 3.49Å; Q279-P281 VanDerWaalsContact O-N 3.09Å; Q279-G284 WeakPolarHBondContact CG-O 3.12Å; Q279-G284 PolarHBondContact NE2-O 2.84Å; Q279-G284 VanDerWaalsContact NE2-O 3.15Å; Q279-E285 WeakPolarHBondContact CA-O 3.45Å
280	N	54.8	Low	56.8	Low	55 Å²	55	87.1 Å²	87.1	29%	0.294	51%	0.508	S	S	.	.			trans	-56.7	115.5	173.4	-179.1	-29.8	0	0	0	108.6	L256 L278 M282 T283 G284 E285	L256-N280 WeakPolarHBondContact CD2-O 3.43Å; L278-N280 PolarHBondContact O-N 3.26Å; N280-M282 PolarHBondContact O-N 2.75Å; N280-M282 PolarHBondContact OD1-N 2.94Å; N280-T283 VanDerWaalsContact CB-OG1 3.32Å; N280-T283 WeakPolarHBondContact CB-OG1 3.25Å; N280-T283 PolarHBondContact ND2-OG1 3.33Å; N280-T283 PolarHBondContact O-N 3.26Å; N280-T283 VanDerWaalsContact O-N 3.14Å; N280-T283 PolarHBondContact OD1-N 3.35Å; N280-G284 PolarHBondContact O-N 3.4Å; N280-E285 WeakPolarHBondContact CB-O 3.4Å; N280-E285 PolarHBondContact N-O 3.45Å
281	P	50	Low	57	Low	101 Å²	101	85.7 Å²	85.7	66%	0.656	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-12.7	-173.9	21.1	-28	0	0	0	113.9	L256 Q279	L256-P281 VanDerWaalsContact CD1-O 3.31Å; L256-P281 WeakPolarHBondContact CD1-O 3.46Å; L256-P281 WeakPolarHBondContact CG-O 3.36Å; Q279-P281 VanDerWaalsContact O-CD 3.23Å; Q279-P281 WeakPolarHBondContact O-CD 3.49Å; Q279-P281 VanDerWaalsContact O-N 3.09Å
282	M	43.5	Very low	57.4	Low	149 Å²	149	85.9 Å²	85.9	73%	0.734	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.9	-11.6	177.6	-66.9	-165.9	-69.2	0	0	114.6	P255 N280	P255-M282 WeakPolarHBondContact CB-O 3.08Å; P255-M282 VanDerWaalsContact CG-C 3.48Å; P255-M282 WeakPolarHBondContact CG-O 3.35Å; N280-M282 PolarHBondContact O-N 2.75Å; N280-M282 PolarHBondContact OD1-N 2.94Å
283	T	52.6	Low	58.2	Low	63 Å²	63	84.1 Å²	84.1	39%	0.387	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.9	-17.5	-177.8	67.5	0	0	0	0	114.8	N280 E285	N280-T283 VanDerWaalsContact CB-OG1 3.32Å; N280-T283 WeakPolarHBondContact CB-OG1 3.25Å; N280-T283 PolarHBondContact ND2-OG1 3.33Å; N280-T283 PolarHBondContact O-N 3.26Å; N280-T283 VanDerWaalsContact O-N 3.14Å; N280-T283 PolarHBondContact OD1-N 3.35Å; T283-E285 VanDerWaalsContact C-N 3.26Å; T283-E285 PolarHBondContact O-N 3.38Å
284	G	53.8	Low	59	Low	8 Å²	8	83.5 Å²	83.5	8%	0.082	50%	0.503	C	S	.	.			trans	80.3	0.2	-178.5	0	0	0	0	0	115.1	P255 Q279 N280	P255-G284 WeakPolarHBondContact O-CA 3.46Å; Q279-G284 WeakPolarHBondContact CG-O 3.12Å; Q279-G284 PolarHBondContact NE2-O 2.84Å; Q279-G284 VanDerWaalsContact NE2-O 3.15Å; N280-G284 PolarHBondContact O-N 3.4Å
285	E	56.2	Low	60.1	Low	137 Å²	137	84.4 Å²	84.4	64%	0.64	49%	0.492	S	S	*	.			trans	-82.6	140.7	176.1	-69.4	-173.9	147.4	0	0	111.9	Q279 N280 T283	Q279-E285 WeakPolarHBondContact CA-O 3.45Å; N280-E285 WeakPolarHBondContact CB-O 3.4Å; N280-E285 PolarHBondContact N-O 3.45Å; T283-E285 VanDerWaalsContact C-N 3.26Å; T283-E285 PolarHBondContact O-N 3.38Å
286	C	56.9	Low	61.4	Low	51 Å²	51	80.6 Å²	80.6	35%	0.345	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	129.4	-176.4	-46.2	0	0	0	0	110.9	C273 E277 L278	C273-C286 HydrophobicContact CB-CB 3.81Å; C273-C286 WeakPolarHBondContact CB-SG 3.14Å; C273-C286 WeakPolarHBondContact SG-CB 3.1Å; C273-C286 CovalentContact SG-SG 2.02Å; C273-C286 PolarHBondContact SG-SG 3.44Å; E277-C286 HydrophobicContact CB-CB 4.04Å; E277-C286 VanDerWaalsContact OE2-CB 3.27Å; E277-C286 WeakPolarHBondContact OE2-CB 2.97Å; L278-C286 CarbonylContact O-C 3.47Å
287	T	57.5	Low	62.2	Low	80 Å²	80	81.3 Å²	81.3	49%	0.491	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	145.1	178.7	47.6	0	0	0	0	111.5	L278	L278-T287 WeakPolarHBondContact CA-O 3.34Å; L278-T287 PolarHBondContact N-O 3.01Å; L278-T287 PolarHBondContact O-N 2.54Å; L278-T287 PolarHBondContact O-OG1 3.36Å
288	S	53.9	Low	63	Low	95 Å²	95	82 Å²	82	66%	0.664	46%	0.457	S	S	*	.			trans	-85	130.7	177.2	56.1	0	0	0	0	111.5
289	I	60.8	Low	63.5	Low	74 Å²	74	87 Å²	87	38%	0.379	48%	0.484	S	S	.	.			trans	-92.3	126.9	-178.9	-76.8	-176	0	0	0	111.8	L278 G300	L278-I289 HydrophobicContact CB-CD1 4.31Å; L278-I289 HydrophobicContact CB-CG1 4.44Å; L278-I289 HydrophobicContact CD1-CB 3.62Å; L278-I289 HydrophobicContact CD1-CD1 3.17Å; L278-I289 HydrophobicContact CD1-CG1 3.4Å; L278-I289 VanDerWaalsContact CD1-CG1 3.4Å; L278-I289 HydrophobicContact CG-CD1 4.37Å; I289-G300 WeakPolarHBondContact CD1-O 3.22Å
290	T	60.9	Low	63.7	Low	136 Å²	136	85.6 Å²	85.6	83%	0.834	48%	0.484	S	S	*	.			trans	-105.4	121.5	164	-53.2	0	0	0	0	108.4
291	C	71.2	Confident	64.1	Low	29 Å²	29	89 Å²	89	20%	0.196	50%	0.5	C	S	.	.	P	Polyproline II helix	trans	-88.1	147.6	-176.4	-70.9	0	0	0	0	113.9	C302	C291-C302 WeakPolarHBondContact CA-SG 3.38Å; C291-C302 HydrophobicContact CB-CB 3.85Å; C291-C302 WeakPolarHBondContact CB-SG 3.48Å; C291-C302 WeakPolarHBondContact SG-CA 3.35Å; C291-C302 WeakPolarHBondContact SG-CB 3.37Å; C291-C302 CovalentContact SG-SG 2.04Å; C291-C302 PolarHBondContact SG-SG 3.13Å
292	P	75.8	Confident	65.5	Low	84 Å²	84	86.2 Å²	86.2	55%	0.545	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-62.5	156.7	169.9	-19.5	32.1	0	0	0	112.8	G294 Y295	P292-G294 PolarHBondContact O-N 3.43Å; P292-Y295 HydrophobicContact CB-CD2 4.4Å; P292-Y295 PolarHBondContact O-N 2.95Å
293	N	78	Confident	67.3	Low	163 Å²	163	81.9 Å²	81.9	87%	0.872	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	138.1	173	-67.9	-31.3	0	0	0	110.7
294	G	78.1	Confident	68.8	Low	21 Å²	21	80.9 Å²	80.9	22%	0.216	45%	0.454	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.1	-2	-173.1	0	0	0	0	0	114.3	P292 I305	P292-G294 PolarHBondContact O-N 3.43Å; G294-I305 WeakPolarHBondContact O-CB 3.5Å; G294-I305 WeakPolarHBondContact O-CG1 3.48Å; G294-I305 PolarHBondContact O-N 3.44Å
295	Y	82.1	Confident	70.4	Confident	68 Å²	68	83.2 Å²	83.2	27%	0.267	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	153.6	177.7	-62.8	-102	0	0	0	111.9	P292 C302 N303 D304 P324 G325	P292-Y295 HydrophobicContact CB-CD2 4.4Å; P292-Y295 PolarHBondContact O-N 2.95Å; Y295-C302 HydrophobicContact CD1-CB 4.17Å; Y295-C302 HydrophobicContact CG-CB 4.21Å; Y295-N303 CarbonylContact C-O 3.53Å; Y295-N303 WeakPolarHBondContact CA-O 3.25Å; Y295-N303 WeakPolarHBondContact CB-O 3.33Å; Y295-D304 HydrophobicContact CD1-CB 4.2Å; Y295-D304 HydrophobicContact CE1-CB 3.97Å; Y295-P324 WeakPolarHBondContact OH-CB 3.23Å; Y295-P324 PolarHBondContact OH-O 3.19Å; Y295-G325 VanDerWaalsContact CZ-CA 3.46Å; Y295-G325 VanDerWaalsContact CZ-N 3.34Å; Y295-G325 WeakPolarHBondContact OH-CA 3.34Å; Y295-G325 PolarHBondContact OH-N 3.43Å
296	Y	81.2	Confident	71.8	Confident	100 Å²	100	79.6 Å²	79.6	39%	0.392	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	142.7	174.6	72.4	-80.4	0	0	0	112.3	K298 N303 I305	Y296-K298 HydrophobicContact CD2-CB 4.12Å; Y296-K298 HydrophobicContact CE2-CB 3.75Å; Y296-K298 HydrophobicContact CE2-CD 3.77Å; Y296-K298 HydrophobicContact CE2-CG 4.43Å; Y296-K298 PolarHBondContact O-N 3.44Å; Y296-N303 HydrophobicContact CD1-CB 4.25Å; Y296-N303 VanDerWaalsContact CD1-O 3.29Å; Y296-N303 WeakPolarHBondContact CD1-O 3.06Å; Y296-N303 HydrophobicContact CE1-CB 3.78Å; Y296-N303 HydrophobicContact CE2-CB 4.45Å; Y296-N303 PolarHBondContact N-O 3.45Å; Y296-N303 PolarHBondContact O-N 2.91Å; Y296-I305 HydrophobicContact CD1-CG1 3.82Å
297	P	72.6	Confident	73.4	Confident	91 Å²	91	78.5 Å²	78.5	59%	0.591	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.9	122.3	-179.2	28.3	-32.4	0	0	0	110.6
298	K	75.9	Confident	74.6	Confident	112 Å²	112	76.4 Å²	76.4	49%	0.487	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	133.4	171.2	173.3	177.8	179	-175.4	0	110	Y296 G300 M301 N303	Y296-K298 HydrophobicContact CD2-CB 4.12Å; Y296-K298 HydrophobicContact CE2-CB 3.75Å; Y296-K298 HydrophobicContact CE2-CD 3.77Å; Y296-K298 HydrophobicContact CE2-CG 4.43Å; Y296-K298 PolarHBondContact O-N 3.44Å; K298-G300 PolarHBondContact O-N 2.98Å; K298-G300 VanDerWaalsContact O-N 3.14Å; K298-M301 PolarHBondContact N-O 3.35Å; K298-M301 PolarHBondContact O-N 3.44Å; K298-M301 VanDerWaalsContact O-N 3.16Å; K298-M301 VanDerWaalsContact O-O 3.09Å; K298-N303 WeakPolarHBondContact CB-ND2 3.37Å; K298-N303 PolarHBondContact O-ND2 3.48Å
299	N	62.8	Low	76	Confident	155 Å²	155	77.5 Å²	77.5	83%	0.829	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	33.3	-177	-63.8	-6.7	0	0	0	114.4	M301	N299-M301 VanDerWaalsContact C-N 3.33Å; N299-M301 PolarHBondContact O-N 3.16Å
300	G	59.4	Low	76.9	Confident	26 Å²	26	78.9 Å²	78.9	27%	0.268	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.7	10.2	176.7	0	0	0	0	0	117.5	I289 K298	I289-G300 WeakPolarHBondContact CD1-O 3.22Å; K298-G300 PolarHBondContact O-N 2.98Å; K298-G300 VanDerWaalsContact O-N 3.14Å
301	M	63.4	Low	77.6	Confident	127 Å²	127	75 Å²	75	63%	0.626	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.7	151.9	175.8	-65.9	177.9	57.4	0	0	109.7	K298 N299 N303	K298-M301 PolarHBondContact N-O 3.35Å; K298-M301 PolarHBondContact O-N 3.44Å; K298-M301 VanDerWaalsContact O-N 3.16Å; K298-M301 VanDerWaalsContact O-O 3.09Å; N299-M301 VanDerWaalsContact C-N 3.33Å; N299-M301 PolarHBondContact O-N 3.16Å; M301-N303 PolarHBondContact O-N 3.3Å; M301-N303 PolarHBondContact O-ND2 3.34Å
302	C	78.1	Confident	77.9	Confident	42 Å²	42	77.3 Å²	77.3	28%	0.284	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	105.4	166.9	-61.2	0	0	0	0	107.1	C291 Y295	C291-C302 WeakPolarHBondContact CA-SG 3.38Å; C291-C302 HydrophobicContact CB-CB 3.85Å; C291-C302 WeakPolarHBondContact CB-SG 3.48Å; C291-C302 WeakPolarHBondContact SG-CA 3.35Å; C291-C302 WeakPolarHBondContact SG-CB 3.37Å; C291-C302 CovalentContact SG-SG 2.04Å; C291-C302 PolarHBondContact SG-SG 3.13Å; Y295-C302 HydrophobicContact CD1-CB 4.17Å; Y295-C302 HydrophobicContact CG-CB 4.21Å
303	N	81.4	Confident	78.2	Confident	57 Å²	57	81 Å²	81	31%	0.305	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	137.5	175.4	-70	-75.9	0	0	0	109.1	Y295 Y296 K298 M301	Y295-N303 CarbonylContact C-O 3.53Å; Y295-N303 WeakPolarHBondContact CA-O 3.25Å; Y295-N303 WeakPolarHBondContact CB-O 3.33Å; Y296-N303 HydrophobicContact CD1-CB 4.25Å; Y296-N303 VanDerWaalsContact CD1-O 3.29Å; Y296-N303 WeakPolarHBondContact CD1-O 3.06Å; Y296-N303 HydrophobicContact CE1-CB 3.78Å; Y296-N303 HydrophobicContact CE2-CB 4.45Å; Y296-N303 PolarHBondContact N-O 3.45Å; Y296-N303 PolarHBondContact O-N 2.91Å; K298-N303 WeakPolarHBondContact CB-ND2 3.37Å; K298-N303 PolarHBondContact O-ND2 3.48Å; M301-N303 PolarHBondContact O-N 3.3Å; M301-N303 PolarHBondContact O-ND2 3.34Å
304	D	85.1	Confident	78.3	Confident	42 Å²	42	74.5 Å²	74.5	23%	0.225	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	139.4	177.9	-176.1	49.6	0	0	0	111.2	Y295 N322 G325	Y295-D304 HydrophobicContact CD1-CB 4.2Å; Y295-D304 HydrophobicContact CE1-CB 3.97Å; D304-N322 PolarHBondContact OD2-ND2 3.26Å; D304-N322 PolarHBondContact OD2-OD1 2.9Å; D304-G325 WeakPolarHBondContact OD1-CA 3Å; D304-G325 PolarHBondContact OD1-N 3.04Å
305	I	87.7	Confident	78.2	Confident	57 Å²	57	75.4 Å²	75.4	29%	0.292	43%	0.428	S	S	.	.			trans	-87.1	112.5	173.9	-63.3	171	0	0	0	107	G294 Y296 E307	G294-I305 WeakPolarHBondContact O-CB 3.5Å; G294-I305 WeakPolarHBondContact O-CG1 3.48Å; G294-I305 PolarHBondContact O-N 3.44Å; Y296-I305 HydrophobicContact CD1-CG1 3.82Å; I305-E307 HydrophobicContact CG2-CG 4.42Å; I305-E307 PolarHBondContact O-N 3.36Å
306	D	85.8	Confident	77.3	Confident	61 Å²	61	77.8 Å²	77.8	33%	0.326	46%	0.461	S	S	.	.			trans	-73.4	97.1	175.1	-170.2	-27	0	0	0	110.5	C308 V309 T310	D306-C308 PolarHBondContact O-N 3.27Å; D306-C308 WeakPolarHBondContact OD1-CA 3.06Å; D306-C308 VanDerWaalsContact OD1-CB 3.29Å; D306-C308 WeakPolarHBondContact OD1-CB 3.1Å; D306-C308 PolarHBondContact OD1-N 2.97Å; D306-V309 HydrophobicContact CB-CB 4.49Å; D306-V309 HydrophobicContact CB-CG2 4.41Å; D306-V309 PolarHBondContact O-N 3.21Å; D306-V309 PolarHBondContact OD1-N 3.07Å; D306-T310 PolarHBondContact O-N 3.35Å; D306-T310 PolarHBondContact O-OG1 3.06Å
307	E	88.8	Confident	76.4	Confident	29 Å²	29	76.1 Å²	76.1	14%	0.136	48%	0.475	C	S	.	.	H	α-helix	trans	-71.2	-18.3	178.9	-56	95.1	162	0	0	112.8	I305 V309 T310 G311 H312 N322 S326 F327	I305-E307 HydrophobicContact CG2-CG 4.42Å; I305-E307 PolarHBondContact O-N 3.36Å; E307-V309 VanDerWaalsContact C-N 3.27Å; E307-V309 PolarHBondContact O-N 2.83Å; E307-T310 WeakPolarHBondContact CA-OG1 3.38Å; E307-G311 CarbonylContact O-C 3.47Å; E307-G311 WeakPolarHBondContact O-CA 3.03Å; E307-G311 PolarHBondContact O-N 3.49Å; E307-H312 PolarHBondContact O-N 3.35Å; E307-N322 PolarHBondContact OE2-OD1 2.05Å; E307-S326 WeakPolarHBondContact OE1-CA 3.18Å; E307-F327 HydrophobicContact CB-CB 4.12Å; E307-F327 HydrophobicContact CB-CD1 3.47Å; E307-F327 VanDerWaalsContact CB-CD1 3.47Å; E307-F327 HydrophobicContact CB-CE1 4.16Å; E307-F327 HydrophobicContact CB-CG 3.96Å; E307-F327 HydrophobicContact CG-CD1 3.88Å; E307-F327 PolarHBondContact OE2-N 3.26Å
308	C	83.7	Confident	76.6	Confident	35 Å²	35	75.9 Å²	75.9	24%	0.236	47%	0.466	C	S	.	.	H	α-helix	trans	-70.6	-27.2	175.1	-59.3	0	0	0	0	112	D306 C320 V321 N322	D306-C308 PolarHBondContact O-N 3.27Å; D306-C308 WeakPolarHBondContact OD1-CA 3.06Å; D306-C308 VanDerWaalsContact OD1-CB 3.29Å; D306-C308 WeakPolarHBondContact OD1-CB 3.1Å; D306-C308 PolarHBondContact OD1-N 2.97Å; C308-C320 WeakPolarHBondContact CA-SG 3.41Å; C308-C320 HydrophobicContact CB-CB 3.81Å; C308-C320 WeakPolarHBondContact CB-SG 3.33Å; C308-C320 WeakPolarHBondContact SG-CB 3.07Å; C308-C320 CovalentContact SG-SG 2.05Å; C308-C320 PolarHBondContact SG-SG 3.02Å; C308-V321 VanDerWaalsContact SG-C 3.6Å; C308-N322 PolarHBondContact SG-N 3Å
309	V	83.9	Confident	76.7	Confident	118 Å²	118	75.5 Å²	75.5	72%	0.715	47%	0.466	S	S	*	.	H	α-helix	trans	-91.6	-37.6	174.5	-179.9	0	0	0	0	111.9	D306 E307	D306-V309 HydrophobicContact CB-CB 4.49Å; D306-V309 HydrophobicContact CB-CG2 4.41Å; D306-V309 PolarHBondContact O-N 3.21Å; D306-V309 PolarHBondContact OD1-N 3.07Å; E307-V309 VanDerWaalsContact C-N 3.27Å; E307-V309 PolarHBondContact O-N 2.83Å
310	T	79.3	Confident	77.8	Confident	104 Å²	104	69.2 Å²	69.2	64%	0.638	43%	0.434	S	S	*	.	H	α-helix	trans	-86.2	-15.3	-174.4	54.5	0	0	0	0	114.1	D306 E307	D306-T310 PolarHBondContact O-N 3.35Å; D306-T310 PolarHBondContact O-OG1 3.06Å; E307-T310 WeakPolarHBondContact CA-OG1 3.38Å
311	G	75.1	Confident	78.9	Confident	54 Å²	54	70 Å²	70	56%	0.557	43%	0.434	S	S	*	.			trans	132.2	125.4	171.3	0	0	0	0	0	112.1	E307	E307-G311 CarbonylContact O-C 3.47Å; E307-G311 WeakPolarHBondContact O-CA 3.03Å; E307-G311 PolarHBondContact O-N 3.49Å
312	H	78.6	Confident	79.7	Confident	78 Å²	78	66.5 Å²	66.5	36%	0.361	42%	0.417	S	S	.	.			trans	-127.4	154.3	-174.6	66.6	86.1	0	0	0	112.6	E307 C314 C320 F327	E307-H312 PolarHBondContact O-N 3.35Å; H312-C314 WeakPolarHBondContact ND1-CB 3.38Å; H312-C314 PolarHBondContact ND1-N 2.98Å; H312-C314 PolarHBondContact ND1-SG 3.46Å; H312-C314 VanDerWaalsContact ND1-SG 3.37Å; H312-C320 HydrophobicContact CB-CB 4.49Å; H312-F327 HydrophobicContact CB-CD2 3.97Å; H312-F327 HydrophobicContact CB-CE2 3.75Å; H312-F327 HydrophobicContact CB-CZ 4.19Å
313	N	82	Confident	79.9	Confident	161 Å²	161	65.8 Å²	65.8	86%	0.861	41%	0.412	S	S	*	.			trans	-103.7	49.1	178.8	-73.3	-20.8	0	0	0	112
314	C	79.6	Confident	79.9	Confident	26 Å²	26	68.4 Å²	68.4	18%	0.176	43%	0.432	C	S	.	.			trans	-82.4	146.7	177.2	-64.3	0	0	0	0	111.8	H312 E318 C329	H312-C314 WeakPolarHBondContact ND1-CB 3.38Å; H312-C314 PolarHBondContact ND1-N 2.98Å; H312-C314 PolarHBondContact ND1-SG 3.46Å; H312-C314 VanDerWaalsContact ND1-SG 3.37Å; C314-E318 HydrophobicContact CB-CB 4.17Å; C314-C329 WeakPolarHBondContact CA-SG 3.06Å; C314-C329 HydrophobicContact CB-CB 3.82Å; C314-C329 WeakPolarHBondContact CB-SG 3.38Å; C314-C329 WeakPolarHBondContact SG-CB 3.46Å; C314-C329 CovalentContact SG-SG 2.05Å; C314-C329 PolarHBondContact SG-SG 2.84Å
315	G	76	Confident	79.7	Confident	40 Å²	40	67.4 Å²	67.4	41%	0.412	43%	0.431	S	S	.	.			trans	-69.7	161.8	179.4	0	0	0	0	0	113.1	G317 E318	G315-G317 PolarHBondContact O-N 3.4Å; G315-G317 VanDerWaalsContact O-N 3.11Å; G315-E318 PolarHBondContact N-OE2 3.29Å; G315-E318 PolarHBondContact O-N 2.98Å; G315-E318 VanDerWaalsContact O-N 3.15Å
316	A	63	Low	79.6	Confident	118 Å²	118	67.4 Å²	67.4	98%	0.975	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	114.5	174.9	0	0	0	0	0	110.4
317	G	63.3	Low	79.7	Confident	66 Å²	66	67.4 Å²	67.4	68%	0.68	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	105.4	2.9	-177.4	0	0	0	0	0	115.3	G315	G315-G317 PolarHBondContact O-N 3.4Å; G315-G317 VanDerWaalsContact O-N 3.11Å
318	E	76.2	Confident	79.4	Confident	85 Å²	85	72.5 Å²	72.5	40%	0.397	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	146.8	175.2	-59.4	179.4	148.2	0	0	111.4	C314 G315 C329 Q330	C314-E318 HydrophobicContact CB-CB 4.17Å; G315-E318 PolarHBondContact N-OE2 3.29Å; G315-E318 PolarHBondContact O-N 2.98Å; G315-E318 VanDerWaalsContact O-N 3.15Å; E318-C329 HydrophobicContact CB-CB 3.97Å; E318-C329 HydrophobicContact CG-CB 4.45Å; E318-C329 VanDerWaalsContact OE2-CB 3.3Å; E318-C329 WeakPolarHBondContact OE2-CB 3.06Å; E318-Q330 WeakPolarHBondContact CA-O 3.34Å
319	E	78.6	Confident	79.3	Confident	105 Å²	105	73 Å²	73	49%	0.491	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	133	172.5	-175.2	166.9	175.9	0	0	109.8	C329 Q330	E319-C329 WeakPolarHBondContact O-CA 3.02Å; E319-Q330 PolarHBondContact N-O 3Å; E319-Q330 PolarHBondContact O-N 3.34Å
320	C	83.9	Confident	78.9	Confident	22 Å²	22	72.3 Å²	72.3	15%	0.149	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	127	177.4	-174.4	0	0	0	0	109.9	C308 H312	C308-C320 WeakPolarHBondContact CA-SG 3.41Å; C308-C320 HydrophobicContact CB-CB 3.81Å; C308-C320 WeakPolarHBondContact CB-SG 3.33Å; C308-C320 WeakPolarHBondContact SG-CB 3.07Å; C308-C320 CovalentContact SG-SG 2.05Å; C308-C320 PolarHBondContact SG-SG 3.02Å; H312-C320 HydrophobicContact CB-CB 4.49Å
321	V	82.7	Confident	78.3	Confident	44 Å²	44	74.5 Å²	74.5	27%	0.267	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	116.6	173.2	-178.7	0	0	0	0	108.2	C308 R328 Q330	C308-V321 VanDerWaalsContact SG-C 3.6Å; V321-R328 HydrophobicContact CB-CG 4.22Å; V321-R328 PolarHBondContact N-O 3.45Å; V321-R328 PolarHBondContact O-N 3.41Å; V321-Q330 HydrophobicContact CG2-CB 4.35Å
322	N	81.6	Confident	77.4	Confident	52 Å²	52	79.9 Å²	79.9	28%	0.278	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	137.7	176.2	-172	34.5	0	0	0	110.2	D304 E307 C308 S326	D304-N322 PolarHBondContact OD2-ND2 3.26Å; D304-N322 PolarHBondContact OD2-OD1 2.9Å; E307-N322 PolarHBondContact OE2-OD1 2.05Å; C308-N322 PolarHBondContact SG-N 3Å; N322-S326 PolarHBondContact OD1-O 2.78Å
323	T	81.7	Confident	76.5	Confident	27 Å²	27	78.3 Å²	78.3	17%	0.166	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	152.8	179.1	55.8	0	0	0	0	110.3	G325 S326 R328	T323-G325 PolarHBondContact O-N 2.01Å; T323-S326 CarbonylContact C-O 3.56Å; T323-S326 VanDerWaalsContact C-O 3.27Å; T323-S326 VanDerWaalsContact CA-O 3.29Å; T323-S326 WeakPolarHBondContact CA-O 3.46Å; T323-S326 WeakPolarHBondContact CB-O 3.41Å; T323-S326 PolarHBondContact N-O 2.96Å; T323-S326 CarbonylContact O-C 3.54Å; T323-S326 PolarHBondContact O-N 3.09Å; T323-S326 PolarHBondContact OG1-O 3.05Å; T323-R328 HydrophobicContact CG2-CG 4.08Å
324	P	81.2	Confident	75.3	Confident	112 Å²	112	77.5 Å²	77.5	73%	0.727	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	110.1	-180	-26	35.5	0	0	0	112.4	Y295	Y295-P324 WeakPolarHBondContact OH-CB 3.23Å; Y295-P324 PolarHBondContact OH-O 3.19Å
325	G	81.9	Confident	74.6	Confident	21 Å²	21	84.3 Å²	84.3	22%	0.216	49%	0.489	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.3	3.9	178	0	0	0	0	0	115.7	Y295 D304 T323	Y295-G325 VanDerWaalsContact CZ-CA 3.46Å; Y295-G325 VanDerWaalsContact CZ-N 3.34Å; Y295-G325 WeakPolarHBondContact OH-CA 3.34Å; Y295-G325 PolarHBondContact OH-N 3.43Å; D304-G325 WeakPolarHBondContact OD1-CA 3Å; D304-G325 PolarHBondContact OD1-N 3.04Å; T323-G325 PolarHBondContact O-N 2.01Å
326	S	85.4	Confident	74.4	Confident	58 Å²	58	84.4 Å²	84.4	41%	0.406	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.5	-173.5	179.7	-156	0	0	0	0	112.4	E307 N322 T323	E307-S326 WeakPolarHBondContact OE1-CA 3.18Å; N322-S326 PolarHBondContact OD1-O 2.78Å; T323-S326 CarbonylContact C-O 3.56Å; T323-S326 VanDerWaalsContact C-O 3.27Å; T323-S326 VanDerWaalsContact CA-O 3.29Å; T323-S326 WeakPolarHBondContact CA-O 3.46Å; T323-S326 WeakPolarHBondContact CB-O 3.41Å; T323-S326 PolarHBondContact N-O 2.96Å; T323-S326 CarbonylContact O-C 3.54Å; T323-S326 PolarHBondContact O-N 3.09Å; T323-S326 PolarHBondContact OG1-O 3.05Å
327	F	86.8	Confident	75.1	Confident	61 Å²	61	82 Å²	82	27%	0.268	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	158.1	169.8	70.1	-75.6	0	0	0	110.9	E307 H312	E307-F327 HydrophobicContact CB-CB 4.12Å; E307-F327 HydrophobicContact CB-CD1 3.47Å; E307-F327 VanDerWaalsContact CB-CD1 3.47Å; E307-F327 HydrophobicContact CB-CE1 4.16Å; E307-F327 HydrophobicContact CB-CG 3.96Å; E307-F327 HydrophobicContact CG-CD1 3.88Å; E307-F327 PolarHBondContact OE2-N 3.26Å; H312-F327 HydrophobicContact CB-CD2 3.97Å; H312-F327 HydrophobicContact CB-CE2 3.75Å; H312-F327 HydrophobicContact CB-CZ 4.19Å
328	R	82.4	Confident	75.9	Confident	136 Å²	136	87.6 Å²	87.6	51%	0.513	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	150.2	167.9	69.7	175.9	-175.7	-101.8	-3.5	110.9	V321 T323	V321-R328 HydrophobicContact CB-CG 4.22Å; V321-R328 PolarHBondContact N-O 3.45Å; V321-R328 PolarHBondContact O-N 3.41Å; T323-R328 HydrophobicContact CG2-CG 4.08Å
329	C	82.6	Confident	76.2	Confident	44 Å²	44	84.2 Å²	84.2	30%	0.297	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	134.4	174	-50.8	0	0	0	0	109.2	C314 E318 E319	C314-C329 WeakPolarHBondContact CA-SG 3.06Å; C314-C329 HydrophobicContact CB-CB 3.82Å; C314-C329 WeakPolarHBondContact CB-SG 3.38Å; C314-C329 WeakPolarHBondContact SG-CB 3.46Å; C314-C329 CovalentContact SG-SG 2.05Å; C314-C329 PolarHBondContact SG-SG 2.84Å; E318-C329 HydrophobicContact CB-CB 3.97Å; E318-C329 HydrophobicContact CG-CB 4.45Å; E318-C329 VanDerWaalsContact OE2-CB 3.3Å; E318-C329 WeakPolarHBondContact OE2-CB 3.06Å; E319-C329 WeakPolarHBondContact O-CA 3.02Å
330	Q	74.6	Confident	76.6	Confident	105 Å²	105	83 Å²	83	49%	0.491	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	144.3	180	-179.6	171.7	-3.4	0	0	111.1	E318 E319 V321	E318-Q330 WeakPolarHBondContact CA-O 3.34Å; E319-Q330 PolarHBondContact N-O 3Å; E319-Q330 PolarHBondContact O-N 3.34Å; V321-Q330 HydrophobicContact CG2-CB 4.35Å
331	Q	67.4	Low	76.7	Confident	150 Å²	150	87.7 Å²	87.7	70%	0.701	47%	0.47	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.6	137.8	173	-76.6	-171.8	-22.8	0	0	111.8	G333	Q331-G333 PolarHBondContact O-N 3.35Å
332	K	56.6	Low	76.6	Confident	167 Å²	167	88.5 Å²	88.5	73%	0.726	48%	0.475	S	S	*	.	S	Bend	trans	-73.1	111.7	-178.3	-145.2	169.7	-171	173.2	0	111.5
333	G	59.4	Low	76.5	Confident	44 Å²	44	88 Å²	88	45%	0.454	47%	0.472	S	S	.	.	S	Bend	trans	87.7	43.5	152.2	0	0	0	0	0	121.6	Q331	Q331-G333 PolarHBondContact O-N 3.35Å
334	N	56	Low	76.2	Confident	145 Å²	145	90.6 Å²	90.6	78%	0.775	51%	0.505	S	S	*	.			trans	-135.6	19.8	-176.6	-100.7	-18.6	0	0	0	119.2
335	L	64.8	Low	75.8	Confident	169 Å²	169	89.9 Å²	89.9	89%	0.885	51%	0.508	S	S	*	.			trans	-140.1	95.4	171	-89.6	101.6	0	0	0	112.6
336	C	72.4	Confident	75.2	Confident	41 Å²	41	92.3 Å²	92.3	28%	0.277	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-102.4	149.2	160.6	-65.9	0	0	0	0	110.4	Y340 V342 C349	C336-Y340 WeakPolarHBondContact CB-O 3.42Å; C336-V342 WeakPolarHBondContact SG-CG2 3.19Å; C336-C349 WeakPolarHBondContact CA-SG 3.41Å; C336-C349 HydrophobicContact CB-CB 3.88Å; C336-C349 WeakPolarHBondContact CB-SG 3.46Å; C336-C349 WeakPolarHBondContact SG-CB 3.48Å; C336-C349 CovalentContact SG-SG 2.04Å; C336-C349 PolarHBondContact SG-SG 2.81Å
337	A	77.3	Confident	74.4	Confident	67 Å²	67	92 Å²	92	55%	0.554	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-65.8	159	173.4	0	0	0	0	0	110.8	G339 Y340	A337-G339 PolarHBondContact O-N 3.39Å; A337-Y340 HydrophobicContact CB-CD2 4.06Å; A337-Y340 WeakPolarHBondContact O-CB 3.34Å; A337-Y340 PolarHBondContact O-N 2.93Å
338	H	80.5	Confident	73.7	Confident	185 Å²	185	96.4 Å²	96.4	86%	0.856	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	133.1	176.3	-167	-72.4	0	0	0	110.3
339	G	82.5	Confident	73.6	Confident	13 Å²	13	92.8 Å²	92.8	13%	0.134	54%	0.539	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.3	4	-173.6	0	0	0	0	0	114.9	A337 V352	A337-G339 PolarHBondContact O-N 3.39Å; G339-V352 WeakPolarHBondContact O-CB 3.32Å; G339-V352 PolarHBondContact O-N 2.89Å
340	Y	87	Confident	73.8	Confident	79 Å²	79	95.1 Å²	95.1	31%	0.31	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	143.4	177.9	-64	-102.6	0	0	0	111.6	C336 A337 E350 D351 P370 G371	C336-Y340 WeakPolarHBondContact CB-O 3.42Å; A337-Y340 HydrophobicContact CB-CD2 4.06Å; A337-Y340 WeakPolarHBondContact O-CB 3.34Å; A337-Y340 PolarHBondContact O-N 2.93Å; Y340-E350 CarbonylContact C-O 3.27Å; Y340-E350 WeakPolarHBondContact CA-O 3.48Å; Y340-E350 WeakPolarHBondContact CB-O 3.36Å; Y340-D351 HydrophobicContact CD1-CB 4.2Å; Y340-D351 HydrophobicContact CE1-CB 3.96Å; Y340-P370 VanDerWaalsContact OH-C 3.3Å; Y340-P370 WeakPolarHBondContact OH-CB 3.49Å; Y340-G371 PolarHBondContact OH-N 3.17Å
341	E	86.2	Confident	74.6	Confident	122 Å²	122	92.5 Å²	92.5	57%	0.57	54%	0.535	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.3	150.6	176.8	69.6	179.6	177.8	0	0	112.2	N343 C349 E350 V352	E341-N343 PolarHBondContact O-N 3.34Å; E341-C349 CarbonylContact O-C 3.05Å; E341-C349 WeakPolarHBondContact O-CA 3.36Å; E341-E350 PolarHBondContact N-O 2.93Å; E341-E350 PolarHBondContact O-N 2.96Å; E341-V352 HydrophobicContact CB-CG2 3.76Å; E341-V352 HydrophobicContact CG-CG2 3.75Å
342	V	79.9	Confident	75.7	Confident	61 Å²	61	86.6 Å²	86.6	37%	0.37	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	120.8	178.1	-179.4	0	0	0	0	109	C336 G344	C336-V342 WeakPolarHBondContact SG-CG2 3.19Å; V342-G344 PolarHBondContact O-N 2.88Å
343	N	79.8	Confident	77.4	Confident	40 Å²	40	81.2 Å²	81.2	21%	0.214	49%	0.488	C	S	.	.			trans	-67.3	115.8	169	-178.6	-51.4	0	0	0	109.4	E341 A345 T346 G347 F348 E350	E341-N343 PolarHBondContact O-N 3.34Å; N343-A345 PolarHBondContact O-N 2.83Å; N343-A345 VanDerWaalsContact O-N 3.13Å; N343-A345 WeakPolarHBondContact OD1-CB 3.38Å; N343-A345 PolarHBondContact OD1-N 2.82Å; N343-T346 WeakPolarHBondContact CB-OG1 3.21Å; N343-T346 PolarHBondContact O-N 2.82Å; N343-T346 PolarHBondContact OD1-N 3.01Å; N343-G347 WeakPolarHBondContact O-CA 3.46Å; N343-G347 PolarHBondContact O-N 3.04Å; N343-F348 PolarHBondContact N-O 2.83Å; N343-E350 HydrophobicContact CB-CG 4.13Å; N343-E350 PolarHBondContact ND2-OE1 3.08Å; N343-E350 PolarHBondContact ND2-OE2 3.16Å
344	G	74.4	Confident	79	Confident	83 Å²	83	80 Å²	80	86%	0.856	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-15.4	-175	0	0	0	0	0	115.5	V342	V342-G344 PolarHBondContact O-N 2.88Å
345	A	73	Confident	80.7	Confident	96 Å²	96	75 Å²	75	79%	0.793	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-35.4	176.9	0	0	0	0	0	112.7	N343	N343-A345 PolarHBondContact O-N 2.83Å; N343-A345 VanDerWaalsContact O-N 3.13Å; N343-A345 WeakPolarHBondContact OD1-CB 3.38Å; N343-A345 PolarHBondContact OD1-N 2.82Å
346	T	69.6	Low	81.8	Confident	73 Å²	73	72.2 Å²	72.2	45%	0.448	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	-20.7	-172.4	70.2	0	0	0	0	113.5	N343 F348	N343-T346 WeakPolarHBondContact CB-OG1 3.21Å; N343-T346 PolarHBondContact O-N 2.82Å; N343-T346 PolarHBondContact OD1-N 3.01Å; T346-F348 WeakPolarHBondContact O-CD2 2.99Å; T346-F348 PolarHBondContact O-N 2.76Å; T346-F348 PolarHBondContact OG1-N 2.83Å
347	G	69	Low	82.5	Confident	52 Å²	52	73.8 Å²	73.8	54%	0.536	45%	0.446	S	S	.	.			trans	75	3.2	-176.4	0	0	0	0	0	114.4	N343	N343-G347 WeakPolarHBondContact O-CA 3.46Å; N343-G347 PolarHBondContact O-N 3.04Å
348	F	72.3	Confident	82.6	Confident	152 Å²	152	73.3 Å²	73.3	67%	0.667	45%	0.447	S	S	*	.	S	Bend	trans	-90.8	155.5	176.4	-64.6	-72.8	0	0	0	111.9	N343 T346	N343-F348 PolarHBondContact N-O 2.83Å; T346-F348 WeakPolarHBondContact O-CD2 2.99Å; T346-F348 PolarHBondContact O-N 2.76Å; T346-F348 PolarHBondContact OG1-N 2.83Å
349	C	81.1	Confident	82.8	Confident	60 Å²	60	69.8 Å²	69.8	41%	0.405	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	124.2	172.4	-60.8	0	0	0	0	110.2	C336 E341	C336-C349 WeakPolarHBondContact CA-SG 3.41Å; C336-C349 HydrophobicContact CB-CB 3.88Å; C336-C349 WeakPolarHBondContact CB-SG 3.46Å; C336-C349 WeakPolarHBondContact SG-CB 3.48Å; C336-C349 CovalentContact SG-SG 2.04Å; C336-C349 PolarHBondContact SG-SG 2.81Å; E341-C349 CarbonylContact O-C 3.05Å; E341-C349 WeakPolarHBondContact O-CA 3.36Å
350	E	86.3	Confident	82.8	Confident	94 Å²	94	69.2 Å²	69.2	44%	0.439	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	150	174.1	-71.9	179.1	178.6	0	0	109.9	Y340 E341 N343	Y340-E350 CarbonylContact C-O 3.27Å; Y340-E350 WeakPolarHBondContact CA-O 3.48Å; Y340-E350 WeakPolarHBondContact CB-O 3.36Å; E341-E350 PolarHBondContact N-O 2.93Å; E341-E350 PolarHBondContact O-N 2.96Å; N343-E350 HydrophobicContact CB-CG 4.13Å; N343-E350 PolarHBondContact ND2-OE1 3.08Å; N343-E350 PolarHBondContact ND2-OE2 3.16Å
351	D	90.6	Very high	82.8	Confident	49 Å²	49	69.1 Å²	69.1	26%	0.262	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	131.9	179.8	179.8	61.7	0	0	0	111.1	Y340 N353 N368 P370 G371	Y340-D351 HydrophobicContact CD1-CB 4.2Å; Y340-D351 HydrophobicContact CE1-CB 3.96Å; D351-N353 PolarHBondContact O-N 2.82Å; D351-N368 PolarHBondContact OD2-ND2 2.83Å; D351-P370 WeakPolarHBondContact OD1-CA 3.42Å; D351-G371 PolarHBondContact OD1-N 2.83Å
352	V	91.7	Very high	83	Confident	26 Å²	26	64.6 Å²	64.6	16%	0.158	43%	0.425	C	S	.	.			trans	-81.6	112.3	176.5	177.1	0	0	0	0	108.2	G339 E341 E354 T357	G339-V352 WeakPolarHBondContact O-CB 3.32Å; G339-V352 PolarHBondContact O-N 2.89Å; E341-V352 HydrophobicContact CB-CG2 3.76Å; E341-V352 HydrophobicContact CG-CG2 3.75Å; V352-E354 HydrophobicContact CG1-CG 4.44Å; V352-E354 PolarHBondContact O-N 3.5Å; V352-T357 HydrophobicContact CG1-CG2 4.33Å
353	N	91.9	Very high	83.6	Confident	54 Å²	54	67.1 Å²	67.1	29%	0.289	43%	0.432	S	S	.	.			trans	-78.7	92.6	178.7	-175.9	-27.5	0	0	0	112	D351 C355 T356 T357 N368	D351-N353 PolarHBondContact O-N 2.82Å; N353-C355 PolarHBondContact O-N 2.86Å; N353-C355 VanDerWaalsContact O-N 3.15Å; N353-C355 WeakPolarHBondContact OD1-CB 3.48Å; N353-C355 PolarHBondContact OD1-N 2.74Å; N353-T356 HydrophobicContact CB-CG2 4.43Å; N353-T356 WeakPolarHBondContact CB-OG1 3.3Å; N353-T356 PolarHBondContact O-N 3.04Å; N353-T356 PolarHBondContact O-OG1 3.34Å; N353-T356 PolarHBondContact OD1-N 3.04Å; N353-T357 WeakPolarHBondContact O-CG2 3.47Å; N353-T357 PolarHBondContact O-N 2.93Å; N353-T357 VanDerWaalsContact O-N 3.12Å; N353-T357 PolarHBondContact O-OG1 2.9Å; N353-N368 WeakPolarHBondContact CA-OD1 3.36Å
354	E	92.6	Very high	84.1	Confident	18 Å²	18	68 Å²	68	8%	0.084	44%	0.435	C	S	.	.	H	α-helix	trans	-66	-19.8	-174.2	-57	92.2	160.6	0	0	114.1	V352 T357 G358 I359 A360 N368 S372 Y373	V352-E354 HydrophobicContact CG1-CG 4.44Å; V352-E354 PolarHBondContact O-N 3.5Å; E354-T357 VanDerWaalsContact CA-OG1 3.3Å; E354-T357 WeakPolarHBondContact CA-OG1 3.44Å; E354-T357 PolarHBondContact O-OG1 2.84Å; E354-G358 PolarHBondContact O-N 2.87Å; E354-I359 HydrophobicContact CB-CB 4.19Å; E354-I359 HydrophobicContact CG-CB 4.44Å; E354-I359 HydrophobicContact CG-CG2 4.44Å; E354-I359 PolarHBondContact O-N 3.42Å; E354-A360 HydrophobicContact CB-CB 4.08Å; E354-A360 WeakPolarHBondContact O-CB 3.45Å; E354-A360 PolarHBondContact O-N 2.8Å; E354-N368 PolarHBondContact OE2-OD1 3.16Å; E354-S372 VanDerWaalsContact OE2-C 3.25Å; E354-Y373 HydrophobicContact CB-CD1 3.53Å; E354-Y373 HydrophobicContact CB-CE1 4.2Å; E354-Y373 HydrophobicContact CB-CG 4.01Å; E354-Y373 HydrophobicContact CG-CD1 3.7Å; E354-Y373 HydrophobicContact CG-CE1 4.28Å
355	C	91.9	Very high	85	Confident	42 Å²	42	69.9 Å²	69.9	28%	0.284	42%	0.42	S	S	.	.	H	α-helix	trans	-70.8	-33.8	173.6	-56.8	0	0	0	0	112.2	N353 C366 V367 N368	N353-C355 PolarHBondContact O-N 2.86Å; N353-C355 VanDerWaalsContact O-N 3.15Å; N353-C355 WeakPolarHBondContact OD1-CB 3.48Å; N353-C355 PolarHBondContact OD1-N 2.74Å; C355-C366 WeakPolarHBondContact CA-SG 3.42Å; C355-C366 HydrophobicContact CB-CB 3.7Å; C355-C366 WeakPolarHBondContact CB-SG 3.3Å; C355-C366 WeakPolarHBondContact SG-CB 3.47Å; C355-C366 CovalentContact SG-SG 2.03Å; C355-C366 PolarHBondContact SG-SG 3.35Å; C355-V367 PolarHBondContact SG-N 2.79Å; C355-V367 VanDerWaalsContact SG-N 3.44Å; C355-N368 PolarHBondContact SG-N 3.07Å; C355-N368 VanDerWaalsContact SG-N 3.37Å
356	T	88.5	Confident	86	Confident	110 Å²	110	67.1 Å²	67.1	68%	0.675	39%	0.394	S	S	*	.	H	α-helix	trans	-86.5	-30.3	178.8	60.4	0	0	0	0	112.7	N353 G358	N353-T356 HydrophobicContact CB-CG2 4.43Å; N353-T356 WeakPolarHBondContact CB-OG1 3.3Å; N353-T356 PolarHBondContact O-N 3.04Å; N353-T356 PolarHBondContact O-OG1 3.34Å; N353-T356 PolarHBondContact OD1-N 3.04Å; T356-G358 VanDerWaalsContact C-N 3.29Å
357	T	85.7	Confident	87.2	Confident	74 Å²	74	66.1 Å²	66.1	45%	0.454	39%	0.388	S	S	.	.	H	α-helix	trans	-79.5	-13.9	177.3	63.1	0	0	0	0	112.6	V352 N353 E354 I359	V352-T357 HydrophobicContact CG1-CG2 4.33Å; N353-T357 WeakPolarHBondContact O-CG2 3.47Å; N353-T357 PolarHBondContact O-N 2.93Å; N353-T357 VanDerWaalsContact O-N 3.12Å; N353-T357 PolarHBondContact O-OG1 2.9Å; E354-T357 VanDerWaalsContact CA-OG1 3.3Å; E354-T357 WeakPolarHBondContact CA-OG1 3.44Å; E354-T357 PolarHBondContact O-OG1 2.84Å; T357-I359 PolarHBondContact O-N 3.18Å; T357-I359 WeakPolarHBondContact OG1-CD1 3.43Å; T357-I359 WeakPolarHBondContact OG1-CG1 3.26Å
358	G	79.5	Confident	88.4	Confident	57 Å²	57	65.9 Å²	65.9	59%	0.588	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.8	5.5	-179.6	0	0	0	0	0	114	E354 T356 A360	E354-G358 PolarHBondContact O-N 2.87Å; T356-G358 VanDerWaalsContact C-N 3.29Å; G358-A360 VanDerWaalsContact C-N 3.3Å
359	I	85.3	Confident	89.3	Confident	110 Å²	110	61.8 Å²	61.8	56%	0.564	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-32.2	177.9	-65.4	172.3	0	0	0	110.9	E354 T357 A361	E354-I359 HydrophobicContact CB-CB 4.19Å; E354-I359 HydrophobicContact CG-CB 4.44Å; E354-I359 HydrophobicContact CG-CG2 4.44Å; E354-I359 PolarHBondContact O-N 3.42Å; T357-I359 PolarHBondContact O-N 3.18Å; T357-I359 WeakPolarHBondContact OG1-CD1 3.43Å; T357-I359 WeakPolarHBondContact OG1-CG1 3.26Å; I359-A361 PolarHBondContact O-N 3.05Å
360	A	83.4	Confident	89.8	Confident	2 Å²	2	64.2 Å²	64.2	2%	0.017	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-24.7	-175.5	0	0	0	0	0	114.9	E354 G358 C362 C366 Y373	E354-A360 HydrophobicContact CB-CB 4.08Å; E354-A360 WeakPolarHBondContact O-CB 3.45Å; E354-A360 PolarHBondContact O-N 2.8Å; G358-A360 VanDerWaalsContact C-N 3.3Å; A360-C362 PolarHBondContact O-N 2.88Å; A360-C366 WeakPolarHBondContact CB-SG 3.32Å; A360-Y373 VanDerWaalsContact CA-CE2 3.45Å; A360-Y373 HydrophobicContact CB-CD1 4.17Å; A360-Y373 HydrophobicContact CB-CD2 3.34Å; A360-Y373 HydrophobicContact CB-CE1 4.35Å; A360-Y373 HydrophobicContact CB-CE2 3.57Å; A360-Y373 HydrophobicContact CB-CG 3.66Å; A360-Y373 VanDerWaalsContact O-CE2 3.31Å; A360-Y373 WeakPolarHBondContact O-CE2 3.41Å
361	A	87.1	Confident	89.8	Confident	76 Å²	76	60.6 Å²	60.6	63%	0.628	36%	0.362	S	S	*	.			trans	46.9	27.9	177.6	0	0	0	0	0	115.7	I359	I359-A361 PolarHBondContact O-N 3.05Å
362	C	90.4	Very high	89.8	Confident	28 Å²	28	60.7 Å²	60.7	19%	0.189	37%	0.367	C	S	.	.			trans	-65.6	133.9	178.8	-58.1	0	0	0	0	111	A360 C366 C375	A360-C362 PolarHBondContact O-N 2.88Å; C362-C366 HydrophobicContact CB-CB 4.06Å; C362-C366 VanDerWaalsContact SG-CB 3.57Å; C362-C375 WeakPolarHBondContact CA-SG 3.11Å; C362-C375 HydrophobicContact CB-CB 3.68Å; C362-C375 WeakPolarHBondContact CB-SG 3.5Å; C362-C375 WeakPolarHBondContact SG-CA 3.02Å; C362-C375 WeakPolarHBondContact SG-CB 3.02Å; C362-C375 CovalentContact SG-SG 2.03Å; C362-C375 PolarHBondContact SG-SG 3.05Å
363	E	90.6	Very high	89.8	Confident	113 Å²	113	63 Å²	63	53%	0.528	37%	0.373	S	S	.	.	S	Bend	trans	-66.3	-38.6	179.1	-177.2	174.5	173.6	0	0	112.7	T388 K389 C390	E363-T388 PolarHBondContact N-O 3.13Å; E363-K389 WeakPolarHBondContact OE2-CA 3.46Å; E363-C390 PolarHBondContact OE2-N 3.28Å
364	Q	91.6	Very high	89.8	Confident	60 Å²	60	65.6 Å²	65.6	28%	0.28	38%	0.383	S	S	.	.	S	Bend	trans	-116.6	-90.3	-175.8	-65.2	177.7	-7.7	0	0	111	C390	Q364-C390 VanDerWaalsContact CD-CB 3.47Å; Q364-C390 HydrophobicContact CG-CB 4.06Å; Q364-C390 PolarHBondContact OE1-SG 2.96Å
365	K	93.4	Very high	89.9	Confident	121 Å²	121	65 Å²	65	53%	0.526	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	135.9	-175.6	-168.9	175.3	-177.9	179.6	0	111.5	C375 I376	K365-C375 CarbonylContact O-C 3.5Å; K365-C375 WeakPolarHBondContact O-CA 2.99Å; K365-I376 HydrophobicContact CB-CB 4.3Å; K365-I376 WeakPolarHBondContact CB-O 3.34Å; K365-I376 PolarHBondContact N-O 2.97Å; K365-I376 VanDerWaalsContact N-O 3.09Å; K365-I376 PolarHBondContact O-N 3.16Å
366	C	94.4	Very high	89.9	Confident	38 Å²	38	66.3 Å²	66.3	26%	0.257	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	137.7	172.4	-174.2	0	0	0	0	110.5	C355 A360 C362	C355-C366 WeakPolarHBondContact CA-SG 3.42Å; C355-C366 HydrophobicContact CB-CB 3.7Å; C355-C366 WeakPolarHBondContact CB-SG 3.3Å; C355-C366 WeakPolarHBondContact SG-CB 3.47Å; C355-C366 CovalentContact SG-SG 2.03Å; C355-C366 PolarHBondContact SG-SG 3.35Å; A360-C366 WeakPolarHBondContact CB-SG 3.32Å; C362-C366 HydrophobicContact CB-CB 4.06Å; C362-C366 VanDerWaalsContact SG-CB 3.57Å
367	V	93.8	Very high	90.2	Very high	52 Å²	52	62.3 Å²	62.3	32%	0.315	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	122.7	172.4	179.8	0	0	0	0	108.9	C355 I369 Y373 Q374 I376	C355-V367 PolarHBondContact SG-N 2.79Å; C355-V367 VanDerWaalsContact SG-N 3.44Å; V367-I369 HydrophobicContact CG1-CG2 4.48Å; V367-Y373 WeakPolarHBondContact O-CA 3.34Å; V367-Q374 PolarHBondContact N-O 3.46Å; V367-Q374 PolarHBondContact O-N 2.83Å; V367-I376 HydrophobicContact CB-CD1 4.33Å; V367-I376 HydrophobicContact CG2-CD1 3.48Å; V367-I376 VanDerWaalsContact CG2-CD1 3.48Å; V367-I376 HydrophobicContact CG2-CG1 4.21Å
368	N	93.4	Very high	90.5	Very high	47 Å²	47	63.3 Å²	63.3	25%	0.251	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	135	175.9	-169.9	52.1	0	0	0	110.3	D351 N353 E354 C355 S372	D351-N368 PolarHBondContact OD2-ND2 2.83Å; N353-N368 WeakPolarHBondContact CA-OD1 3.36Å; E354-N368 PolarHBondContact OE2-OD1 3.16Å; C355-N368 PolarHBondContact SG-N 3.07Å; C355-N368 VanDerWaalsContact SG-N 3.37Å; N368-S372 PolarHBondContact OD1-O 3.16Å
369	I	92.6	Very high	91.1	Very high	66 Å²	66	72.1 Å²	72.1	34%	0.338	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	147.8	176.9	56.5	174.3	0	0	0	109.3	V367 G371 S372	V367-I369 HydrophobicContact CG1-CG2 4.48Å; I369-G371 PolarHBondContact O-N 2.02Å; I369-S372 CarbonylContact C-O 3.46Å; I369-S372 VanDerWaalsContact CG1-C 3.43Å; I369-S372 WeakPolarHBondContact CG1-O 3.32Å; I369-S372 PolarHBondContact N-O 3.43Å; I369-S372 CarbonylContact O-C 3.58Å; I369-S372 PolarHBondContact O-N 3.24Å
370	P	90.2	Very high	91.4	Very high	111 Å²	111	67.6 Å²	67.6	72%	0.721	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	114.1	-177.9	-27.5	35.5	0	0	0	113	Y340 D351	Y340-P370 VanDerWaalsContact OH-C 3.3Å; Y340-P370 WeakPolarHBondContact OH-CB 3.49Å; D351-P370 WeakPolarHBondContact OD1-CA 3.42Å
371	G	86.4	Confident	91.9	Very high	19 Å²	19	69.7 Å²	69.7	20%	0.196	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.4	2.6	-178.8	0	0	0	0	0	116.6	Y340 D351 I369	Y340-G371 PolarHBondContact OH-N 3.17Å; D351-G371 PolarHBondContact OD1-N 2.83Å; I369-G371 PolarHBondContact O-N 2.02Å
372	S	90.8	Very high	92.1	Very high	51 Å²	51	68.3 Å²	68.3	36%	0.357	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-168	-172.6	179.6	-172.3	0	0	0	0	112.4	E354 N368 I369	E354-S372 VanDerWaalsContact OE2-C 3.25Å; N368-S372 PolarHBondContact OD1-O 3.16Å; I369-S372 CarbonylContact C-O 3.46Å; I369-S372 VanDerWaalsContact CG1-C 3.43Å; I369-S372 WeakPolarHBondContact CG1-O 3.32Å; I369-S372 PolarHBondContact N-O 3.43Å; I369-S372 CarbonylContact O-C 3.58Å; I369-S372 PolarHBondContact O-N 3.24Å
373	Y	92.6	Very high	92.3	Very high	74 Å²	74	70.7 Å²	70.7	29%	0.29	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	167.3	168.1	63.3	-82	0	0	0	111.8	E354 A360 V367	E354-Y373 HydrophobicContact CB-CD1 3.53Å; E354-Y373 HydrophobicContact CB-CE1 4.2Å; E354-Y373 HydrophobicContact CB-CG 4.01Å; E354-Y373 HydrophobicContact CG-CD1 3.7Å; E354-Y373 HydrophobicContact CG-CE1 4.28Å; A360-Y373 VanDerWaalsContact CA-CE2 3.45Å; A360-Y373 HydrophobicContact CB-CD1 4.17Å; A360-Y373 HydrophobicContact CB-CD2 3.34Å; A360-Y373 HydrophobicContact CB-CE1 4.35Å; A360-Y373 HydrophobicContact CB-CE2 3.57Å; A360-Y373 HydrophobicContact CB-CG 3.66Å; A360-Y373 VanDerWaalsContact O-CE2 3.31Å; A360-Y373 WeakPolarHBondContact O-CE2 3.41Å; V367-Y373 WeakPolarHBondContact O-CA 3.34Å
374	Q	91.6	Very high	92.2	Very high	109 Å²	109	65.7 Å²	65.7	51%	0.509	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	132.4	169.8	-173.8	175.3	11.6	0	0	110.6	V367	V367-Q374 PolarHBondContact N-O 3.46Å; V367-Q374 PolarHBondContact O-N 2.83Å
375	C	94.3	Very high	91.9	Very high	5 Å²	5	68.7 Å²	68.7	3%	0.034	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	138.2	169.9	-55.6	0	0	0	0	110.6	C362 K365 L383 G387	C362-C375 WeakPolarHBondContact CA-SG 3.11Å; C362-C375 HydrophobicContact CB-CB 3.68Å; C362-C375 WeakPolarHBondContact CB-SG 3.5Å; C362-C375 WeakPolarHBondContact SG-CA 3.02Å; C362-C375 WeakPolarHBondContact SG-CB 3.02Å; C362-C375 CovalentContact SG-SG 2.03Å; C362-C375 PolarHBondContact SG-SG 3.05Å; K365-C375 CarbonylContact O-C 3.5Å; K365-C375 WeakPolarHBondContact O-CA 2.99Å; C375-L383 HydrophobicContact CB-CD1 4.02Å; C375-G387 WeakPolarHBondContact CB-O 3.34Å
376	I	92.9	Very high	91.6	Very high	69 Å²	69	68.2 Å²	68.2	35%	0.354	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	133.8	179.9	-56.2	-178.7	0	0	0	108.4	K365 V367	K365-I376 HydrophobicContact CB-CB 4.3Å; K365-I376 WeakPolarHBondContact CB-O 3.34Å; K365-I376 PolarHBondContact N-O 2.97Å; K365-I376 VanDerWaalsContact N-O 3.09Å; K365-I376 PolarHBondContact O-N 3.16Å; V367-I376 HydrophobicContact CB-CD1 4.33Å; V367-I376 HydrophobicContact CG2-CD1 3.48Å; V367-I376 VanDerWaalsContact CG2-CD1 3.48Å; V367-I376 HydrophobicContact CG2-CG1 4.21Å
377	C	94.3	Very high	91.2	Very high	26 Å²	26	67.9 Å²	67.9	18%	0.176	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-92.8	146.9	174.9	-55.9	0	0	0	0	111.5	F381 C390	C377-F381 HydrophobicContact CB-CB 3.83Å; C377-C390 WeakPolarHBondContact CA-SG 3.45Å; C377-C390 HydrophobicContact CB-CB 3.74Å; C377-C390 WeakPolarHBondContact CB-SG 3.25Å; C377-C390 WeakPolarHBondContact SG-CA 3.35Å; C377-C390 WeakPolarHBondContact SG-CB 3.2Å; C377-C390 CovalentContact SG-SG 2.04Å; C377-C390 PolarHBondContact SG-SG 3.29Å
378	D	92.4	Very high	91	Very high	96 Å²	96	66.9 Å²	66.9	51%	0.513	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-64.3	163.2	170.9	-69.9	-32.7	0	0	0	110.7	G380 F381	D378-G380 PolarHBondContact O-N 3.12Å; D378-F381 HydrophobicContact CB-CD2 4.43Å; D378-F381 PolarHBondContact O-N 3.21Å; D378-F381 VanDerWaalsContact O-N 3.16Å
379	R	91.8	Very high	91	Very high	241 Å²	241	70 Å²	70	91%	0.909	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	137.6	178.5	-74.9	-173.5	176.4	-177.3	-0.7	110.7
380	G	90.9	Very high	91	Very high	15 Å²	15	67.2 Å²	67.2	16%	0.155	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.8	1	-176.5	0	0	0	0	0	114.1	D378 I393	D378-G380 PolarHBondContact O-N 3.12Å; G380-I393 WeakPolarHBondContact O-CB 3.21Å; G380-I393 PolarHBondContact O-N 2.03Å
381	F	94.3	Very high	91.2	Very high	47 Å²	47	67.2 Å²	67.2	21%	0.206	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	146.6	178.3	-61.8	-92.9	0	0	0	111.4	C377 D378 C390 E391 D392 K415	C377-F381 HydrophobicContact CB-CB 3.83Å; D378-F381 HydrophobicContact CB-CD2 4.43Å; D378-F381 PolarHBondContact O-N 3.21Å; D378-F381 VanDerWaalsContact O-N 3.16Å; F381-C390 HydrophobicContact CB-CB 4.1Å; F381-E391 CarbonylContact C-O 3.42Å; F381-E391 WeakPolarHBondContact CA-O 3.38Å; F381-D392 HydrophobicContact CD1-CB 4.26Å; F381-D392 HydrophobicContact CE1-CB 4.09Å; F381-K415 HydrophobicContact CZ-CB 4.42Å
382	A	91.9	Very high	91.6	Very high	47 Å²	47	68.8 Å²	68.8	39%	0.388	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	146.3	175	0	0	0	0	0	110.5	G384 C390 E391 I393	A382-G384 PolarHBondContact O-N 3.45Å; A382-C390 WeakPolarHBondContact O-CA 3.47Å; A382-E391 PolarHBondContact N-O 3.29Å; A382-E391 PolarHBondContact O-N 2.04Å; A382-I393 HydrophobicContact CB-CD1 4.18Å; A382-I393 HydrophobicContact CB-CG1 3.85Å
383	L	93.5	Very high	91.8	Very high	77 Å²	77	68.8 Å²	68.8	40%	0.403	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	121.6	176.9	-164.7	70.2	0	0	0	109.3	C375	C375-L383 HydrophobicContact CB-CD1 4.02Å
384	G	88.5	Confident	91.8	Very high	9 Å²	9	68 Å²	68	9%	0.093	36%	0.359	C	S	.	.			trans	-66.5	170.1	178.4	0	0	0	0	0	112.6	A382 D386 G387 K389	A382-G384 PolarHBondContact O-N 3.45Å; G384-D386 PolarHBondContact O-N 3.07Å; G384-D386 VanDerWaalsContact O-N 3.13Å; G384-G387 PolarHBondContact O-N 3.34Å; G384-K389 PolarHBondContact N-O 2.96Å
385	P	86.8	Confident	91.7	Very high	122 Å²	122	64 Å²	64	79%	0.792	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-24.4	-176.5	23.9	-33.1	0	0	0	113.8	G387	P385-G387 PolarHBondContact O-N 3.06Å
386	D	85.8	Confident	91.5	Very high	111 Å²	111	64.8 Å²	64.8	59%	0.594	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-4.3	176.1	-61.8	-25.6	0	0	0	113.1	G384 T388	G384-D386 PolarHBondContact O-N 3.07Å; G384-D386 VanDerWaalsContact O-N 3.13Å; D386-T388 PolarHBondContact O-N 3.47Å; D386-T388 VanDerWaalsContact O-N 3.08Å; D386-T388 PolarHBondContact O-OG1 3.34Å
387	G	86.7	Confident	91.4	Very high	31 Å²	31	65.3 Å²	65.3	32%	0.32	36%	0.355	S	S	.	.	S	Bend	trans	69	3.9	177.4	0	0	0	0	0	115.6	C375 G384 P385	C375-G387 WeakPolarHBondContact CB-O 3.34Å; G384-G387 PolarHBondContact O-N 3.34Å; P385-G387 PolarHBondContact O-N 3.06Å
388	T	89.2	Confident	91	Very high	31 Å²	31	69 Å²	69	19%	0.19	37%	0.373	C	S	.	.	S	Bend	trans	-128.2	-28.5	-172.1	49.5	0	0	0	0	114.1	E363 D386	E363-T388 PolarHBondContact N-O 3.13Å; D386-T388 PolarHBondContact O-N 3.47Å; D386-T388 VanDerWaalsContact O-N 3.08Å; D386-T388 PolarHBondContact O-OG1 3.34Å
389	K	92.7	Very high	90.6	Very high	113 Å²	113	69.9 Å²	69.9	49%	0.491	37%	0.369	S	S	.	.			trans	-94.9	148.1	179.7	-67.8	-179	-177.2	164	0	112	E363 G384	E363-K389 WeakPolarHBondContact OE2-CA 3.46Å; G384-K389 PolarHBondContact N-O 2.96Å
390	C	93.6	Very high	89.9	Confident	8 Å²	8	61.8 Å²	61.8	5%	0.054	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	107.6	-179.7	-68.8	0	0	0	0	109.8	E363 Q364 C377 F381 A382	E363-C390 PolarHBondContact OE2-N 3.28Å; Q364-C390 VanDerWaalsContact CD-CB 3.47Å; Q364-C390 HydrophobicContact CG-CB 4.06Å; Q364-C390 PolarHBondContact OE1-SG 2.96Å; C377-C390 WeakPolarHBondContact CA-SG 3.45Å; C377-C390 HydrophobicContact CB-CB 3.74Å; C377-C390 WeakPolarHBondContact CB-SG 3.25Å; C377-C390 WeakPolarHBondContact SG-CA 3.35Å; C377-C390 WeakPolarHBondContact SG-CB 3.2Å; C377-C390 CovalentContact SG-SG 2.04Å; C377-C390 PolarHBondContact SG-SG 3.29Å; F381-C390 HydrophobicContact CB-CB 4.1Å; A382-C390 WeakPolarHBondContact O-CA 3.47Å
391	E	93.8	Very high	88.7	Confident	111 Å²	111	64.9 Å²	64.9	52%	0.519	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	139.5	-179.2	-64.2	-177.7	175.9	0	0	110	F381 A382 I393	F381-E391 CarbonylContact C-O 3.42Å; F381-E391 WeakPolarHBondContact CA-O 3.38Å; A382-E391 PolarHBondContact N-O 3.29Å; A382-E391 PolarHBondContact O-N 2.04Å; E391-I393 PolarHBondContact O-N 3.15Å
392	D	95.8	Very high	87.2	Confident	52 Å²	52	64.7 Å²	64.7	28%	0.278	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	133.5	178.5	-174.2	59	0	0	0	111	F381 D394 N413 K415 G416	F381-D392 HydrophobicContact CD1-CB 4.26Å; F381-D392 HydrophobicContact CE1-CB 4.09Å; D392-D394 PolarHBondContact O-N 2.8Å; D392-N413 PolarHBondContact OD2-ND2 3.37Å; D392-K415 WeakPolarHBondContact OD1-CA 3.32Å; D392-G416 PolarHBondContact OD1-N 2.95Å
393	I	93.9	Very high	85.5	Confident	51 Å²	51	66.3 Å²	66.3	26%	0.262	41%	0.412	S	S	.	.			trans	-82.9	108.8	174.9	-61.9	173.7	0	0	0	107.2	G380 A382 E391 E395 I398	G380-I393 WeakPolarHBondContact O-CB 3.21Å; G380-I393 PolarHBondContact O-N 2.03Å; A382-I393 HydrophobicContact CB-CD1 4.18Å; A382-I393 HydrophobicContact CB-CG1 3.85Å; E391-I393 PolarHBondContact O-N 3.15Å; I393-E395 VanDerWaalsContact C-N 3.33Å; I393-E395 HydrophobicContact CG2-CG 4.11Å; I393-E395 PolarHBondContact O-N 3.5Å; I393-I398 HydrophobicContact CG2-CD1 3.43Å; I393-I398 VanDerWaalsContact CG2-CD1 3.43Å
394	D	92.4	Very high	84	Confident	56 Å²	56	68.5 Å²	68.5	30%	0.299	42%	0.424	S	S	.	.			trans	-74.8	87.7	173.3	-174.9	-12.9	0	0	0	110.4	D392 C396 S397 I398 N413	D392-D394 PolarHBondContact O-N 2.8Å; D394-C396 PolarHBondContact O-N 3.43Å; D394-C396 WeakPolarHBondContact OD1-CB 3.36Å; D394-C396 PolarHBondContact OD1-N 3.04Å; D394-C396 VanDerWaalsContact OD1-N 3.14Å; D394-S397 VanDerWaalsContact CG-CB 3.48Å; D394-S397 PolarHBondContact O-N 3.3Å; D394-S397 PolarHBondContact OD1-N 3.22Å; D394-S397 PolarHBondContact OD1-OG 3.19Å; D394-S397 WeakPolarHBondContact OD2-CB 3.33Å; D394-S397 PolarHBondContact OD2-OG 3.46Å; D394-I398 WeakPolarHBondContact O-CG1 3.32Å; D394-I398 PolarHBondContact O-N 3.11Å; D394-I398 VanDerWaalsContact O-N 3.12Å; D394-N413 WeakPolarHBondContact OD1-CB 3.3Å
395	E	91.1	Very high	83.1	Confident	26 Å²	26	73.8 Å²	73.8	12%	0.121	45%	0.45	C	S	.	.	H	α-helix	trans	-64.3	-31.1	-179.7	-55.5	97.9	156	0	0	111.4	I393 S397 I398 W399 L406 N413 Y418	I393-E395 VanDerWaalsContact C-N 3.33Å; I393-E395 HydrophobicContact CG2-CG 4.11Å; I393-E395 PolarHBondContact O-N 3.5Å; E395-S397 VanDerWaalsContact C-N 3.35Å; E395-S397 PolarHBondContact O-N 3.05Å; E395-I398 PolarHBondContact O-N 3.18Å; E395-W399 PolarHBondContact O-N 3.07Å; E395-L406 HydrophobicContact CB-CD2 3.7Å; E395-N413 PolarHBondContact OE2-OD1 3.34Å; E395-Y418 HydrophobicContact CB-CD1 3.83Å; E395-Y418 HydrophobicContact CB-CE1 4.32Å; E395-Y418 HydrophobicContact CB-CG 4.42Å; E395-Y418 HydrophobicContact CG-CD1 3.95Å; E395-Y418 HydrophobicContact CG-CE1 4.32Å; E395-Y418 WeakPolarHBondContact OE2-CD1 3.31Å
396	C	90.1	Very high	82.9	Confident	21 Å²	21	69.2 Å²	69.2	14%	0.142	42%	0.418	C	S	.	.	H	α-helix	trans	-62.5	-43.1	177.4	-60.5	0	0	0	0	111.6	D394 A400 C411 I412 N413	D394-C396 PolarHBondContact O-N 3.43Å; D394-C396 WeakPolarHBondContact OD1-CB 3.36Å; D394-C396 PolarHBondContact OD1-N 3.04Å; D394-C396 VanDerWaalsContact OD1-N 3.14Å; C396-A400 WeakPolarHBondContact O-CB 3.44Å; C396-A400 PolarHBondContact O-N 2.94Å; C396-A400 VanDerWaalsContact O-N 3.1Å; C396-C411 WeakPolarHBondContact CA-SG 3.24Å; C396-C411 HydrophobicContact CB-CB 3.71Å; C396-C411 WeakPolarHBondContact CB-SG 3.06Å; C396-C411 WeakPolarHBondContact SG-CB 3.38Å; C396-C411 CovalentContact SG-SG 2.04Å; C396-C411 PolarHBondContact SG-SG 3.07Å; C396-I412 PolarHBondContact SG-N 3.07Å; C396-I412 VanDerWaalsContact SG-N 3.39Å; C396-N413 HydrophobicContact CB-CB 4.43Å; C396-N413 PolarHBondContact SG-N 3.09Å
397	S	89.2	Confident	82.9	Confident	80 Å²	80	64.3 Å²	64.3	56%	0.559	39%	0.393	S	S	*	.	H	α-helix	trans	-71	-36	177.6	-70.3	0	0	0	0	112.8	D394 E395	D394-S397 VanDerWaalsContact CG-CB 3.48Å; D394-S397 PolarHBondContact O-N 3.3Å; D394-S397 PolarHBondContact OD1-N 3.22Å; D394-S397 PolarHBondContact OD1-OG 3.19Å; D394-S397 WeakPolarHBondContact OD2-CB 3.33Å; D394-S397 PolarHBondContact OD2-OG 3.46Å; E395-S397 VanDerWaalsContact C-N 3.35Å; E395-S397 PolarHBondContact O-N 3.05Å
398	I	86.9	Confident	82.7	Confident	105 Å²	105	69.2 Å²	69.2	54%	0.538	41%	0.409	S	S	.	.	H	α-helix	trans	-66.3	-41.1	179.8	-69.8	166.8	0	0	0	111.6	I393 D394 E395	I393-I398 HydrophobicContact CG2-CD1 3.43Å; I393-I398 VanDerWaalsContact CG2-CD1 3.43Å; D394-I398 WeakPolarHBondContact O-CG1 3.32Å; D394-I398 PolarHBondContact O-N 3.11Å; D394-I398 VanDerWaalsContact O-N 3.12Å; E395-I398 PolarHBondContact O-N 3.18Å
399	W	83	Confident	82.3	Confident	113 Å²	113	69.3 Å²	69.3	43%	0.428	42%	0.416	S	S	.	.	H	α-helix	trans	-93.7	-4.3	-176.5	-63.7	103.5	0	0	0	113.4	E395 G401 S402 L406	E395-W399 PolarHBondContact O-N 3.07Å; W399-G401 PolarHBondContact O-N 2.79Å; W399-G401 VanDerWaalsContact O-N 3.15Å; W399-S402 WeakPolarHBondContact O-CB 3.35Å; W399-S402 PolarHBondContact O-N 3.28Å; W399-L406 HydrophobicContact CB-CB 3.81Å; W399-L406 HydrophobicContact CG-CB 4.11Å; W399-L406 HydrophobicContact CG-CD1 4.47Å; W399-L406 HydrophobicContact CG-CD2 4.49Å
400	A	78.6	Confident	82	Confident	72 Å²	72	65.7 Å²	65.7	60%	0.595	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	116.5	176.6	0	0	0	0	0	111.8	C396 S402	C396-A400 WeakPolarHBondContact O-CB 3.44Å; C396-A400 PolarHBondContact O-N 2.94Å; C396-A400 VanDerWaalsContact O-N 3.1Å; A400-S402 PolarHBondContact O-N 2.9Å
401	G	65.4	Low	81.9	Confident	80 Å²	80	67.5 Å²	67.5	83%	0.825	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.4	3	176.2	0	0	0	0	0	115.1	W399	W399-G401 PolarHBondContact O-N 2.79Å; W399-G401 VanDerWaalsContact O-N 3.15Å
402	S	61.7	Low	81.8	Confident	42 Å²	42	65.8 Å²	65.8	29%	0.294	42%	0.417	S	S	.	.	S	Bend	trans	-69.5	127.1	160	168.5	0	0	0	0	106.9	W399 A400 N404	W399-S402 WeakPolarHBondContact O-CB 3.35Å; W399-S402 PolarHBondContact O-N 3.28Å; A400-S402 PolarHBondContact O-N 2.9Å; S402-N404 CarbonylContact O-C 3.44Å; S402-N404 PolarHBondContact O-N 3.48Å
403	G	57.8	Low	81.7	Confident	82 Å²	82	65.8 Å²	65.8	85%	0.845	42%	0.417	S	S	*	.	S	Bend	trans	-59	4.3	178.3	0	0	0	0	0	115.7
404	N	60.6	Low	81.6	Confident	123 Å²	123	66 Å²	66	66%	0.658	42%	0.421	S	S	*	.	S	Bend	trans	-110.5	84.7	165.7	-68	-25.1	0	0	0	108.7	S402 L406	S402-N404 CarbonylContact O-C 3.44Å; S402-N404 PolarHBondContact O-N 3.48Å; N404-L406 PolarHBondContact O-N 3.35Å
405	D	69.8	Low	81.6	Confident	119 Å²	119	72.5 Å²	72.5	64%	0.636	45%	0.446	S	S	*	.			trans	-64.7	129.1	-179.7	-69.6	-39.9	0	0	0	111.1	C407	D405-C407 VanDerWaalsContact C-N 3.28Å; D405-C407 PolarHBondContact O-N 3.48Å
406	L	83.1	Confident	81.6	Confident	26 Å²	26	72.1 Å²	72.1	14%	0.136	45%	0.45	C	S	.	.	S	Bend	trans	-62.9	-35.6	177.8	-176.4	65.7	0	0	0	112.4	E395 W399 N404 Y418	E395-L406 HydrophobicContact CB-CD2 3.7Å; W399-L406 HydrophobicContact CB-CB 3.81Å; W399-L406 HydrophobicContact CG-CB 4.11Å; W399-L406 HydrophobicContact CG-CD1 4.47Å; W399-L406 HydrophobicContact CG-CD2 4.49Å; N404-L406 PolarHBondContact O-N 3.35Å; L406-Y418 HydrophobicContact CD1-CE1 4.22Å; L406-Y418 HydrophobicContact CD1-CE2 3.98Å; L406-Y418 WeakPolarHBondContact CD1-OH 3.35Å; L406-Y418 HydrophobicContact CD2-CD1 4.07Å; L406-Y418 HydrophobicContact CD2-CD2 3.72Å; L406-Y418 HydrophobicContact CD2-CE1 4.04Å; L406-Y418 HydrophobicContact CD2-CE2 3.69Å; L406-Y418 HydrophobicContact CD2-CG 3.91Å; L406-Y418 HydrophobicContact CG-CD2 4.13Å; L406-Y418 HydrophobicContact CG-CE1 4.46Å; L406-Y418 HydrophobicContact CG-CE2 3.64Å
407	C	84.8	Confident	81.7	Confident	8 Å²	8	73.9 Å²	73.9	5%	0.054	46%	0.462	C	S	.	.	S	Bend	trans	-126.4	139.8	178.7	-62.1	0	0	0	0	108.6	D405 G409 C411 C420	D405-C407 VanDerWaalsContact C-N 3.28Å; D405-C407 PolarHBondContact O-N 3.48Å; C407-G409 PolarHBondContact O-N 3.18Å; C407-C411 HydrophobicContact CB-CB 4.32Å; C407-C420 VanDerWaalsContact CA-SG 3.57Å; C407-C420 HydrophobicContact CB-CB 3.6Å; C407-C420 WeakPolarHBondContact CB-SG 3.35Å; C407-C420 WeakPolarHBondContact SG-CA 3.33Å; C407-C420 WeakPolarHBondContact SG-CB 3.09Å; C407-C420 CovalentContact SG-SG 2.03Å; C407-C420 PolarHBondContact SG-SG 3.35Å
408	M	82.3	Confident	81.8	Confident	134 Å²	134	72.2 Å²	72.2	66%	0.66	44%	0.444	S	S	*	.	S	Bend	trans	-67.3	-23.8	174.8	-167.3	178.9	-142.4	0	0	112.6	R433 C435	M408-R433 WeakPolarHBondContact CB-O 3.3Å; M408-R433 PolarHBondContact N-O 3.03Å; M408-C435 HydrophobicContact CB-CB 4.48Å; M408-C435 HydrophobicContact SD-CB 4.07Å; M408-C435 PolarHBondContact SD-N 3.38Å; M408-C435 VanDerWaalsContact SD-N 3.38Å
409	G	82.3	Confident	82	Confident	33 Å²	33	72.2 Å²	72.2	34%	0.34	44%	0.444	S	S	.	.	S	Bend	trans	-113.8	-132.9	175.8	0	0	0	0	0	112.3	C407 Q421	C407-G409 PolarHBondContact O-N 3.18Å; G409-Q421 CarbonylContact C-O 3.54Å
410	G	86.7	Confident	82.4	Confident	38 Å²	38	67.1 Å²	67.1	39%	0.392	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	151.5	174.2	0	0	0	0	0	112.5	C420 Q421	G410-C420 CarbonylContact O-C 3.6Å; G410-C420 WeakPolarHBondContact O-CA 3.49Å; G410-Q421 PolarHBondContact N-O 3.26Å; G410-Q421 PolarHBondContact O-N 3.19Å
411	C	90.8	Very high	83	Confident	45 Å²	45	69.3 Å²	69.3	30%	0.304	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	135.1	173	-172.3	0	0	0	0	109.5	C396 C407	C396-C411 WeakPolarHBondContact CA-SG 3.24Å; C396-C411 HydrophobicContact CB-CB 3.71Å; C396-C411 WeakPolarHBondContact CB-SG 3.06Å; C396-C411 WeakPolarHBondContact SG-CB 3.38Å; C396-C411 CovalentContact SG-SG 2.04Å; C396-C411 PolarHBondContact SG-SG 3.07Å; C407-C411 HydrophobicContact CB-CB 4.32Å
412	I	91.8	Very high	84.2	Confident	76 Å²	76	66.6 Å²	66.6	39%	0.39	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	115.9	175.7	-57.8	174.6	0	0	0	107.8	C396 Y418 L419 Q421	C396-I412 PolarHBondContact SG-N 3.07Å; C396-I412 VanDerWaalsContact SG-N 3.39Å; I412-Y418 CarbonylContact O-C 3.5Å; I412-Y418 WeakPolarHBondContact O-CA 3.36Å; I412-L419 PolarHBondContact N-O 3.49Å; I412-L419 PolarHBondContact O-N 3.19Å; I412-Q421 HydrophobicContact CD1-CB 4.41Å
413	N	93.3	Very high	85.4	Confident	51 Å²	51	67.3 Å²	67.3	27%	0.273	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	140.2	177.3	-172.9	41.2	0	0	0	110.7	D392 D394 E395 C396 S417	D392-N413 PolarHBondContact OD2-ND2 3.37Å; D394-N413 WeakPolarHBondContact OD1-CB 3.3Å; E395-N413 PolarHBondContact OE2-OD1 3.34Å; C396-N413 HydrophobicContact CB-CB 4.43Å; C396-N413 PolarHBondContact SG-N 3.09Å; N413-S417 PolarHBondContact OD1-O 2.97Å
414	T	93.1	Very high	86.8	Confident	57 Å²	57	69.3 Å²	69.3	35%	0.35	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	159.9	178.6	61.9	0	0	0	0	109.7	G416 S417 Y418	T414-G416 PolarHBondContact O-N 3.3Å; T414-S417 CarbonylContact C-O 3.56Å; T414-S417 VanDerWaalsContact C-O 3.27Å; T414-S417 WeakPolarHBondContact CA-O 3.1Å; T414-S417 PolarHBondContact N-O 3.12Å; T414-S417 CarbonylContact O-C 3.57Å; T414-S417 PolarHBondContact O-N 2.97Å; T414-S417 VanDerWaalsContact O-N 3.13Å; T414-S417 PolarHBondContact OG1-O 2.92Å; T414-Y418 PolarHBondContact OG1-N 3.39Å
415	K	92.2	Very high	88	Confident	191 Å²	191	64.6 Å²	64.6	83%	0.83	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	117.2	180	-73.1	-167.4	173.7	-168.5	0	111.6	F381 D392 S417	F381-K415 HydrophobicContact CZ-CB 4.42Å; D392-K415 WeakPolarHBondContact OD1-CA 3.32Å; K415-S417 VanDerWaalsContact C-N 3.32Å
416	G	89.9	Confident	88.9	Confident	19 Å²	19	62.2 Å²	62.2	20%	0.196	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.2	5.8	179.8	0	0	0	0	0	114.8	D392 T414	D392-G416 PolarHBondContact OD1-N 2.95Å; T414-G416 PolarHBondContact O-N 3.3Å
417	S	92.3	Very high	89.2	Confident	57 Å²	57	66.9 Å²	66.9	40%	0.399	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.4	-169.1	-177.9	-154	0	0	0	0	112.9	N413 T414 K415	N413-S417 PolarHBondContact OD1-O 2.97Å; T414-S417 CarbonylContact C-O 3.56Å; T414-S417 VanDerWaalsContact C-O 3.27Å; T414-S417 WeakPolarHBondContact CA-O 3.1Å; T414-S417 PolarHBondContact N-O 3.12Å; T414-S417 CarbonylContact O-C 3.57Å; T414-S417 PolarHBondContact O-N 2.97Å; T414-S417 VanDerWaalsContact O-N 3.13Å; T414-S417 PolarHBondContact OG1-O 2.92Å; K415-S417 VanDerWaalsContact C-N 3.32Å
418	Y	92.4	Very high	89.5	Confident	45 Å²	45	70 Å²	70	18%	0.176	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	160.7	174.6	60.3	-82.9	0	0	0	111	E395 L406 I412 T414 R433	E395-Y418 HydrophobicContact CB-CD1 3.83Å; E395-Y418 HydrophobicContact CB-CE1 4.32Å; E395-Y418 HydrophobicContact CB-CG 4.42Å; E395-Y418 HydrophobicContact CG-CD1 3.95Å; E395-Y418 HydrophobicContact CG-CE1 4.32Å; E395-Y418 WeakPolarHBondContact OE2-CD1 3.31Å; L406-Y418 HydrophobicContact CD1-CE1 4.22Å; L406-Y418 HydrophobicContact CD1-CE2 3.98Å; L406-Y418 WeakPolarHBondContact CD1-OH 3.35Å; L406-Y418 HydrophobicContact CD2-CD1 4.07Å; L406-Y418 HydrophobicContact CD2-CD2 3.72Å; L406-Y418 HydrophobicContact CD2-CE1 4.04Å; L406-Y418 HydrophobicContact CD2-CE2 3.69Å; L406-Y418 HydrophobicContact CD2-CG 3.91Å; L406-Y418 HydrophobicContact CG-CD2 4.13Å; L406-Y418 HydrophobicContact CG-CE1 4.46Å; L406-Y418 HydrophobicContact CG-CE2 3.64Å; I412-Y418 CarbonylContact O-C 3.5Å; I412-Y418 WeakPolarHBondContact O-CA 3.36Å; T414-Y418 PolarHBondContact OG1-N 3.39Å; Y418-R433 PolarHBondContact OH-NE 3.24Å; Y418-R433 PolarHBondContact OH-NH2 3.47Å
419	L	90.8	Very high	89.8	Confident	105 Å²	105	67.5 Å²	67.5	55%	0.55	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	129.4	173.8	-170.7	75.1	0	0	0	109.9	I412	I412-L419 PolarHBondContact N-O 3.49Å; I412-L419 PolarHBondContact O-N 3.19Å
420	C	91.6	Very high	90.1	Very high	7 Å²	7	72.6 Å²	72.6	5%	0.047	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	141.5	169.5	-58.6	0	0	0	0	110.7	C407 G410 I428 G432	C407-C420 VanDerWaalsContact CA-SG 3.57Å; C407-C420 HydrophobicContact CB-CB 3.6Å; C407-C420 WeakPolarHBondContact CB-SG 3.35Å; C407-C420 WeakPolarHBondContact SG-CA 3.33Å; C407-C420 WeakPolarHBondContact SG-CB 3.09Å; C407-C420 CovalentContact SG-SG 2.03Å; C407-C420 PolarHBondContact SG-SG 3.35Å; G410-C420 CarbonylContact O-C 3.6Å; G410-C420 WeakPolarHBondContact O-CA 3.49Å; C420-I428 HydrophobicContact CB-CD1 4.09Å; C420-I428 VanDerWaalsContact O-CD1 3.22Å; C420-I428 WeakPolarHBondContact O-CD1 3.18Å; C420-G432 VanDerWaalsContact CB-O 3.3Å; C420-G432 WeakPolarHBondContact CB-O 3.27Å; C420-G432 PolarHBondContact SG-O 3.24Å; C420-G432 VanDerWaalsContact SG-O 3.42Å
421	Q	90.2	Very high	89.9	Confident	118 Å²	118	74.9 Å²	74.9	55%	0.551	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.1	129.3	175.9	-172.6	175.7	17	0	0	110.1	G409 G410 I412	G409-Q421 CarbonylContact C-O 3.54Å; G410-Q421 PolarHBondContact N-O 3.26Å; G410-Q421 PolarHBondContact O-N 3.19Å; I412-Q421 HydrophobicContact CD1-CB 4.41Å
422	C	90	Very high	89.7	Confident	22 Å²	22	74.3 Å²	74.3	15%	0.149	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-80.1	147.7	176.3	-66	0	0	0	0	112	I428 C435	C422-I428 VanDerWaalsContact SG-CA 3.59Å; C422-C435 WeakPolarHBondContact CA-SG 3.33Å; C422-C435 HydrophobicContact CB-CB 3.84Å; C422-C435 WeakPolarHBondContact CB-SG 3.25Å; C422-C435 WeakPolarHBondContact SG-CA 3.37Å; C422-C435 WeakPolarHBondContact SG-CB 3.42Å; C422-C435 CovalentContact SG-SG 2.04Å; C422-C435 PolarHBondContact SG-SG 3.41Å
423	P	87.4	Confident	89.5	Confident	58 Å²	58	76.7 Å²	76.7	38%	0.377	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-62.5	161.9	171.2	25.1	-30.9	0	0	0	111.4	Y426	P423-Y426 HydrophobicContact CB-CD2 4.42Å; P423-Y426 HydrophobicContact CG-CD2 3.73Å; P423-Y426 HydrophobicContact CG-CE2 4.27Å; P423-Y426 HydrophobicContact CG-CG 4.19Å; P423-Y426 WeakPolarHBondContact O-CB 3.48Å; P423-Y426 PolarHBondContact O-N 2.91Å; P423-Y426 VanDerWaalsContact O-N 3.13Å
424	P	88.3	Confident	89.1	Confident	123 Å²	123	76.1 Å²	76.1	80%	0.799	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	140.6	175.2	-24.3	34.1	0	0	0	112.1	Y426	P424-Y426 VanDerWaalsContact C-N 3.3Å; P424-Y426 WeakPolarHBondContact O-CD2 3.27Å
425	G	85.4	Confident	88.8	Confident	24 Å²	24	74 Å²	74	25%	0.247	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.6	-1.7	-174.7	0	0	0	0	0	114.4	V438	G425-V438 WeakPolarHBondContact O-CB 3.35Å; G425-V438 PolarHBondContact O-N 2.92Å
426	Y	87.6	Confident	88.5	Confident	70 Å²	70	67.1 Å²	67.1	28%	0.275	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	147.4	178.4	-64.5	-100.4	0	0	0	111.6	P423 P424 C435 V436 D437 L457 G458	P423-Y426 HydrophobicContact CB-CD2 4.42Å; P423-Y426 HydrophobicContact CG-CD2 3.73Å; P423-Y426 HydrophobicContact CG-CE2 4.27Å; P423-Y426 HydrophobicContact CG-CG 4.19Å; P423-Y426 WeakPolarHBondContact O-CB 3.48Å; P423-Y426 PolarHBondContact O-N 2.91Å; P423-Y426 VanDerWaalsContact O-N 3.13Å; P424-Y426 VanDerWaalsContact C-N 3.3Å; P424-Y426 WeakPolarHBondContact O-CD2 3.27Å; Y426-C435 HydrophobicContact CD1-CB 4.32Å; Y426-C435 HydrophobicContact CG-CB 4.49Å; Y426-V436 CarbonylContact C-O 3.55Å; Y426-V436 VanDerWaalsContact CA-O 3.3Å; Y426-V436 WeakPolarHBondContact CA-O 3.08Å; Y426-D437 HydrophobicContact CD1-CB 4.3Å; Y426-D437 HydrophobicContact CE1-CB 4.04Å; Y426-L457 WeakPolarHBondContact OH-CB 2.97Å; Y426-G458 PolarHBondContact OH-N 2.84Å
427	K	90.1	Very high	88.3	Confident	123 Å²	123	67.9 Å²	67.9	54%	0.535	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	148.5	173.3	66.3	-178.3	177.6	-171.1	0	111	V436 V438	K427-V436 HydrophobicContact CD-CG2 4.32Å; K427-V436 HydrophobicContact CG-CG2 3.59Å; K427-V436 PolarHBondContact N-O 3.34Å; K427-V436 PolarHBondContact O-N 2.03Å; K427-V438 HydrophobicContact CB-CG2 3.93Å; K427-V438 HydrophobicContact CD-CG2 4.27Å; K427-V438 HydrophobicContact CG-CG2 4.03Å
428	I	90.9	Very high	88	Confident	75 Å²	75	66.6 Å²	66.6	39%	0.385	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	137.3	178.3	-158.9	162.8	0	0	0	110.6	C420 C422 G432	C420-I428 HydrophobicContact CB-CD1 4.09Å; C420-I428 VanDerWaalsContact O-CD1 3.22Å; C420-I428 WeakPolarHBondContact O-CD1 3.18Å; C422-I428 VanDerWaalsContact SG-CA 3.59Å; I428-G432 WeakPolarHBondContact CD1-O 3.41Å
429	Q	88.6	Confident	87.5	Confident	80 Å²	80	67.6 Å²	67.6	37%	0.374	37%	0.372	S	S	.	.			trans	-77.4	166.3	173.4	-71.5	-157.6	77.6	0	0	111.6	D431 G432 T434 V436	Q429-D431 WeakPolarHBondContact CB-OD1 3.39Å; Q429-D431 PolarHBondContact O-N 3.4Å; Q429-D431 VanDerWaalsContact O-N 3.09Å; Q429-G432 PolarHBondContact O-N 3.35Å; Q429-T434 WeakPolarHBondContact CB-OG1 3.29Å; Q429-T434 WeakPolarHBondContact CG-OG1 3.38Å; Q429-T434 PolarHBondContact N-O 2.75Å; Q429-T434 PolarHBondContact NE2-OG1 3.3Å; Q429-V436 HydrophobicContact CG-CB 4.31Å; Q429-V436 HydrophobicContact CG-CG1 3.55Å; Q429-V436 HydrophobicContact CG-CG2 3.87Å; Q429-V436 VanDerWaalsContact NE2-CG1 3.3Å
430	P	88.4	Confident	87.2	Confident	140 Å²	140	63.7 Å²	63.7	91%	0.909	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-18.9	176.8	-25.3	35.5	0	0	0	114.8	G432	P430-G432 PolarHBondContact O-N 3.05Å
431	D	83.8	Confident	86.5	Confident	87 Å²	87	64.1 Å²	64.1	47%	0.465	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-9.3	173.9	69.4	2.3	0	0	0	113.5	Q429 R433 T434	Q429-D431 WeakPolarHBondContact CB-OD1 3.39Å; Q429-D431 PolarHBondContact O-N 3.4Å; Q429-D431 VanDerWaalsContact O-N 3.09Å; D431-R433 PolarHBondContact O-N 3.44Å; D431-R433 PolarHBondContact OD1-N 2.93Å; D431-T434 PolarHBondContact OD1-N 3.14Å; D431-T434 PolarHBondContact OD1-OG1 2.99Å; D431-T434 VanDerWaalsContact OD1-OG1 3.06Å; D431-T434 WeakPolarHBondContact OD2-CB 3.47Å; D431-T434 WeakPolarHBondContact OD2-CG2 3.48Å; D431-T434 PolarHBondContact OD2-OG1 3.06Å
432	G	86.2	Confident	85.8	Confident	33 Å²	33	62.1 Å²	62.1	34%	0.34	36%	0.357	S	S	.	.	S	Bend	trans	67.8	12.9	178.8	0	0	0	0	0	114.4	C420 I428 Q429 P430	C420-G432 VanDerWaalsContact CB-O 3.3Å; C420-G432 WeakPolarHBondContact CB-O 3.27Å; C420-G432 PolarHBondContact SG-O 3.24Å; C420-G432 VanDerWaalsContact SG-O 3.42Å; I428-G432 WeakPolarHBondContact CD1-O 3.41Å; Q429-G432 PolarHBondContact O-N 3.35Å; P430-G432 PolarHBondContact O-N 3.05Å
433	R	86.4	Confident	85.3	Confident	125 Å²	125	67 Å²	67	47%	0.472	38%	0.379	S	S	.	.	S	Bend	trans	-135.1	-32.9	-174.4	-66	-174	-176	168.4	7.5	114.4	M408 Y418 D431	M408-R433 WeakPolarHBondContact CB-O 3.3Å; M408-R433 PolarHBondContact N-O 3.03Å; Y418-R433 PolarHBondContact OH-NE 3.24Å; Y418-R433 PolarHBondContact OH-NH2 3.47Å; D431-R433 PolarHBondContact O-N 3.44Å; D431-R433 PolarHBondContact OD1-N 2.93Å
434	T	85.4	Confident	84.7	Confident	40 Å²	40	66.7 Å²	66.7	25%	0.245	39%	0.387	C	S	.	.			trans	-97	146.5	-176.4	59.6	0	0	0	0	111.5	Q429 D431	Q429-T434 WeakPolarHBondContact CB-OG1 3.29Å; Q429-T434 WeakPolarHBondContact CG-OG1 3.38Å; Q429-T434 PolarHBondContact N-O 2.75Å; Q429-T434 PolarHBondContact NE2-OG1 3.3Å; D431-T434 PolarHBondContact OD1-N 3.14Å; D431-T434 PolarHBondContact OD1-OG1 2.99Å; D431-T434 VanDerWaalsContact OD1-OG1 3.06Å; D431-T434 WeakPolarHBondContact OD2-CB 3.47Å; D431-T434 WeakPolarHBondContact OD2-CG2 3.48Å; D431-T434 PolarHBondContact OD2-OG1 3.06Å
435	C	87	Confident	84.3	Confident	13 Å²	13	66.2 Å²	66.2	9%	0.088	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	128.3	-179.1	-64.8	0	0	0	0	109.1	M408 C422 Y426	M408-C435 HydrophobicContact CB-CB 4.48Å; M408-C435 HydrophobicContact SD-CB 4.07Å; M408-C435 PolarHBondContact SD-N 3.38Å; M408-C435 VanDerWaalsContact SD-N 3.38Å; C422-C435 WeakPolarHBondContact CA-SG 3.33Å; C422-C435 HydrophobicContact CB-CB 3.84Å; C422-C435 WeakPolarHBondContact CB-SG 3.25Å; C422-C435 WeakPolarHBondContact SG-CA 3.37Å; C422-C435 WeakPolarHBondContact SG-CB 3.42Å; C422-C435 CovalentContact SG-SG 2.04Å; C422-C435 PolarHBondContact SG-SG 3.41Å; Y426-C435 HydrophobicContact CD1-CB 4.32Å; Y426-C435 HydrophobicContact CG-CB 4.49Å
436	V	86.7	Confident	83.8	Confident	46 Å²	46	66.1 Å²	66.1	28%	0.279	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	140.3	173.3	-69	0	0	0	0	109.6	Y426 K427 Q429	Y426-V436 CarbonylContact C-O 3.55Å; Y426-V436 VanDerWaalsContact CA-O 3.3Å; Y426-V436 WeakPolarHBondContact CA-O 3.08Å; K427-V436 HydrophobicContact CD-CG2 4.32Å; K427-V436 HydrophobicContact CG-CG2 3.59Å; K427-V436 PolarHBondContact N-O 3.34Å; K427-V436 PolarHBondContact O-N 2.03Å; Q429-V436 HydrophobicContact CG-CB 4.31Å; Q429-V436 HydrophobicContact CG-CG1 3.55Å; Q429-V436 HydrophobicContact CG-CG2 3.87Å; Q429-V436 VanDerWaalsContact NE2-CG1 3.3Å
437	D	85.4	Confident	82.7	Confident	35 Å²	35	66.5 Å²	66.5	19%	0.187	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.4	137	175.3	-172.8	63.2	0	0	0	110.4	Y426 N455 L457 G458	Y426-D437 HydrophobicContact CD1-CB 4.3Å; Y426-D437 HydrophobicContact CE1-CB 4.04Å; D437-N455 PolarHBondContact OD2-ND2 3.36Å; D437-L457 HydrophobicContact CB-CD2 4.32Å; D437-G458 WeakPolarHBondContact OD1-CA 3.48Å; D437-G458 PolarHBondContact OD1-N 2.91Å
438	V	86.3	Confident	81.4	Confident	30 Å²	30	62.7 Å²	62.7	18%	0.182	38%	0.382	C	S	.	.			trans	-86.3	115.2	173.1	177.3	0	0	0	0	107.1	G425 K427 E440 M443	G425-V438 WeakPolarHBondContact O-CB 3.35Å; G425-V438 PolarHBondContact O-N 2.92Å; K427-V438 HydrophobicContact CB-CG2 3.93Å; K427-V438 HydrophobicContact CD-CG2 4.27Å; K427-V438 HydrophobicContact CG-CG2 4.03Å; V438-E440 HydrophobicContact CG1-CG 4.33Å; V438-E440 PolarHBondContact O-N 3.12Å; V438-M443 HydrophobicContact CG1-SD 3.63Å
439	D	80.1	Confident	80	Confident	66 Å²	66	64.4 Å²	64.4	35%	0.353	40%	0.401	S	S	.	.			trans	-76.6	91.7	175.7	-169.9	-25.6	0	0	0	110.3	C441 A442 M443	D439-C441 PolarHBondContact O-N 3.01Å; D439-C441 WeakPolarHBondContact OD1-CA 3.37Å; D439-C441 VanDerWaalsContact OD1-CB 3.28Å; D439-C441 WeakPolarHBondContact OD1-CB 3.02Å; D439-C441 PolarHBondContact OD1-N 3.22Å; D439-C441 VanDerWaalsContact OD1-N 3.1Å; D439-A442 HydrophobicContact CB-CB 3.98Å; D439-A442 PolarHBondContact O-N 3.37Å; D439-A442 PolarHBondContact OD1-N 3.34Å; D439-M443 PolarHBondContact O-N 3.34Å
440	E	85.8	Confident	78.8	Confident	23 Å²	23	63.9 Å²	63.9	11%	0.107	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-20.4	-179.7	-57.4	97.9	160.3	0	0	112.5	V438 M443 G444 E445 N455 F460	V438-E440 HydrophobicContact CG1-CG 4.33Å; V438-E440 PolarHBondContact O-N 3.12Å; E440-M443 PolarHBondContact O-N 3.43Å; E440-G444 PolarHBondContact O-N 2.96Å; E440-E445 HydrophobicContact CB-CB 4.31Å; E440-E445 HydrophobicContact CB-CG 4.04Å; E440-E445 PolarHBondContact O-N 3.44Å; E440-N455 PolarHBondContact OE2-OD1 3.06Å; E440-F460 HydrophobicContact CB-CB 4.02Å; E440-F460 HydrophobicContact CB-CD1 3.34Å; E440-F460 HydrophobicContact CB-CD2 4.33Å; E440-F460 HydrophobicContact CB-CE1 3.8Å; E440-F460 HydrophobicContact CB-CG 3.64Å; E440-F460 HydrophobicContact CB-CZ 4.46Å; E440-F460 HydrophobicContact CG-CD1 3.49Å; E440-F460 VanDerWaalsContact CG-CD1 3.49Å; E440-F460 HydrophobicContact CG-CE1 3.89Å; E440-F460 HydrophobicContact CG-CG 4.26Å; E440-F460 WeakPolarHBondContact OE2-CB 3.36Å
441	C	75.7	Confident	78	Confident	15 Å²	15	61.3 Å²	61.3	10%	0.101	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-44	173.1	-60.5	0	0	0	0	111.3	D439 M443 G444 C453 V454 N455	D439-C441 PolarHBondContact O-N 3.01Å; D439-C441 WeakPolarHBondContact OD1-CA 3.37Å; D439-C441 VanDerWaalsContact OD1-CB 3.28Å; D439-C441 WeakPolarHBondContact OD1-CB 3.02Å; D439-C441 PolarHBondContact OD1-N 3.22Å; D439-C441 VanDerWaalsContact OD1-N 3.1Å; C441-M443 PolarHBondContact O-N 2.84Å; C441-G444 PolarHBondContact O-N 3.45Å; C441-C453 WeakPolarHBondContact CA-SG 3.06Å; C441-C453 HydrophobicContact CB-CB 3.62Å; C441-C453 WeakPolarHBondContact CB-SG 3.5Å; C441-C453 WeakPolarHBondContact SG-CB 3.25Å; C441-C453 CovalentContact SG-SG 2.02Å; C441-C453 PolarHBondContact SG-SG 2.72Å; C441-V454 VanDerWaalsContact SG-C 3.52Å; C441-N455 HydrophobicContact CB-CB 4.44Å; C441-N455 PolarHBondContact SG-N 3.11Å
442	A	75.8	Confident	77.5	Confident	76 Å²	76	57.6 Å²	57.6	63%	0.628	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-25.8	173.1	0	0	0	0	0	112.6	D439 G444	D439-A442 HydrophobicContact CB-CB 3.98Å; D439-A442 PolarHBondContact O-N 3.37Å; D439-A442 PolarHBondContact OD1-N 3.34Å; A442-G444 VanDerWaalsContact C-N 3.33Å
443	M	79.2	Confident	76.9	Confident	124 Å²	124	56.8 Å²	56.8	61%	0.611	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-9.4	174.4	-65	-178	61	0	0	113.7	V438 D439 E440 C441 E445	V438-M443 HydrophobicContact CG1-SD 3.63Å; D439-M443 PolarHBondContact O-N 3.34Å; E440-M443 PolarHBondContact O-N 3.43Å; C441-M443 PolarHBondContact O-N 2.84Å; M443-E445 HydrophobicContact CB-CG 4.46Å
444	G	75.5	Confident	76.3	Confident	52 Å²	52	51.9 Å²	51.9	54%	0.536	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.5	23.1	174.8	0	0	0	0	0	114.9	E440 C441 A442 C446	E440-G444 PolarHBondContact O-N 2.96Å; C441-G444 PolarHBondContact O-N 3.45Å; A442-G444 VanDerWaalsContact C-N 3.33Å; G444-C446 PolarHBondContact O-N 2.88Å
445	E	79.3	Confident	75.6	Confident	114 Å²	114	52.3 Å²	52.3	53%	0.533	33%	0.329	S	S	.	.			trans	-65.8	-21.4	-175.8	-68.8	-66.5	152.9	0	0	113.6	E440 M443 A447 F460	E440-E445 HydrophobicContact CB-CB 4.31Å; E440-E445 HydrophobicContact CB-CG 4.04Å; E440-E445 PolarHBondContact O-N 3.44Å; M443-E445 HydrophobicContact CB-CG 4.46Å; E445-A447 PolarHBondContact O-N 3.26Å; E445-F460 HydrophobicContact CB-CD2 4.45Å; E445-F460 HydrophobicContact CB-CE1 4.35Å; E445-F460 HydrophobicContact CB-CE2 3.69Å; E445-F460 HydrophobicContact CB-CZ 3.63Å; E445-F460 HydrophobicContact CG-CZ 4.33Å
446	C	74.8	Confident	75.1	Confident	22 Å²	22	53.2 Å²	53.2	15%	0.149	33%	0.334	C	S	.	.	S	Bend	trans	-90.6	87.5	171.9	-64.4	0	0	0	0	112.1	G444 C453 C462	G444-C446 PolarHBondContact O-N 2.88Å; C446-C453 HydrophobicContact CB-CB 3.81Å; C446-C453 WeakPolarHBondContact SG-CB 3.47Å; C446-C453 PolarHBondContact SG-SG 2.83Å; C446-C462 HydrophobicContact CB-CB 4.03Å; C446-C462 WeakPolarHBondContact CB-SG 3.32Å; C446-C462 VanDerWaalsContact SG-CA 3.57Å; C446-C462 WeakPolarHBondContact SG-CB 3.34Å; C446-C462 CovalentContact SG-SG 2.03Å; C446-C462 PolarHBondContact SG-SG 3.13Å
447	A	66	Low	74.6	Confident	77 Å²	77	57.6 Å²	57.6	64%	0.636	36%	0.355	S	S	*	.			trans	-81	125.3	174.5	0	0	0	0	0	113.1	E445 K451	E445-A447 PolarHBondContact O-N 3.26Å; A447-K451 PolarHBondContact O-NZ 2.63Å; A447-K451 VanDerWaalsContact O-NZ 3.14Å
448	G	62.8	Low	74.4	Confident	43 Å²	43	56.9 Å²	56.9	44%	0.443	36%	0.357	S	S	.	.			trans	148.5	143.1	174	0	0	0	0	0	112.9	D450	G448-D450 PolarHBondContact O-N 3.07Å
449	S	60.4	Low	74.4	Confident	112 Å²	112	58.3 Å²	58.3	78%	0.783	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-7.5	178	54.6	0	0	0	0	114
450	D	65.1	Low	74.4	Confident	68 Å²	68	58.1 Å²	58.1	36%	0.364	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.9	9.4	-174.7	62.5	-39.3	0	0	0	112.7	G448 S464 I465	G448-D450 PolarHBondContact O-N 3.07Å; D450-S464 WeakPolarHBondContact O-CA 3.08Å; D450-I465 PolarHBondContact O-N 3.27Å
451	K	70.5	Confident	74.2	Confident	87 Å²	87	61.4 Å²	61.4	38%	0.378	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	141.3	-176.3	-62.6	179.3	-169.8	164.4	0	111.9	A447 H463	A447-K451 PolarHBondContact O-NZ 2.63Å; A447-K451 VanDerWaalsContact O-NZ 3.14Å; K451-H463 CarbonylContact C-O 3.47Å; K451-H463 VanDerWaalsContact CA-O 3.31Å; K451-H463 WeakPolarHBondContact CA-O 3.33Å
452	V	72.3	Confident	74.4	Confident	8 Å²	8	63.5 Å²	63.5	5%	0.048	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	129.4	168.6	175.3	0	0	0	0	109.2	V454 C462 H463 I465 Y485	V452-V454 HydrophobicContact CG1-CG2 4.27Å; V452-C462 CarbonylContact O-C 3.57Å; V452-C462 WeakPolarHBondContact O-CA 3.32Å; V452-H463 PolarHBondContact N-O 3.1Å; V452-H463 PolarHBondContact O-N 3.47Å; V452-I465 HydrophobicContact CB-CD1 4.04Å; V452-I465 HydrophobicContact CG2-CD1 3.36Å; V452-I465 HydrophobicContact CG2-CG1 4.04Å; V452-Y485 HydrophobicContact CG2-CG 4.15Å
453	C	74.5	Confident	74.4	Confident	16 Å²	16	62.8 Å²	62.8	11%	0.108	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	133.5	168.8	-166.2	0	0	0	0	110.2	C441 C446	C441-C453 WeakPolarHBondContact CA-SG 3.06Å; C441-C453 HydrophobicContact CB-CB 3.62Å; C441-C453 WeakPolarHBondContact CB-SG 3.5Å; C441-C453 WeakPolarHBondContact SG-CB 3.25Å; C441-C453 CovalentContact SG-SG 2.02Å; C441-C453 PolarHBondContact SG-SG 2.72Å; C446-C453 HydrophobicContact CB-CB 3.81Å; C446-C453 WeakPolarHBondContact SG-CB 3.47Å; C446-C453 PolarHBondContact SG-SG 2.83Å
454	V	74.9	Confident	74.1	Confident	22 Å²	22	60.8 Å²	60.8	13%	0.133	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	113	170.9	-178.1	0	0	0	0	107.3	C441 V452 T456 F460 K461 A512	C441-V454 VanDerWaalsContact SG-C 3.52Å; V452-V454 HydrophobicContact CG1-CG2 4.27Å; V454-T456 HydrophobicContact CG1-CG2 4.42Å; V454-F460 WeakPolarHBondContact O-CA 3.47Å; V454-K461 PolarHBondContact N-O 2.67Å; V454-K461 PolarHBondContact O-N 2.95Å; V454-A512 HydrophobicContact CG1-CB 4.15Å; V454-A512 HydrophobicContact CG2-CB 4.21Å
455	N	69.9	Low	73.8	Confident	50 Å²	50	59.4 Å²	59.4	27%	0.267	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	136.3	174.9	-172.1	34.1	0	0	0	109.6	D437 E440 C441 S459	D437-N455 PolarHBondContact OD2-ND2 3.36Å; E440-N455 PolarHBondContact OE2-OD1 3.06Å; C441-N455 HydrophobicContact CB-CB 4.44Å; C441-N455 PolarHBondContact SG-N 3.11Å; N455-S459 PolarHBondContact OD1-O 2.94Å
456	T	75.4	Confident	73.6	Confident	32 Å²	32	61.2 Å²	61.2	20%	0.196	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	158.8	179.7	64	0	0	0	0	109.6	V454 G458 S459	V454-T456 HydrophobicContact CG1-CG2 4.42Å; T456-G458 PolarHBondContact O-N 2.94Å; T456-S459 CarbonylContact C-O 3.59Å; T456-S459 VanDerWaalsContact C-O 3.24Å; T456-S459 VanDerWaalsContact CA-O 3.25Å; T456-S459 WeakPolarHBondContact CA-O 3.48Å; T456-S459 WeakPolarHBondContact CB-O 3.49Å; T456-S459 PolarHBondContact N-O 2.85Å; T456-S459 PolarHBondContact O-N 2.83Å; T456-S459 VanDerWaalsContact O-N 3.09Å; T456-S459 PolarHBondContact OG1-O 2.91Å
457	L	77	Confident	73.5	Confident	137 Å²	137	61.6 Å²	61.6	72%	0.717	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	112	179.1	-70.4	177.1	0	0	0	110.9	Y426 D437	Y426-L457 WeakPolarHBondContact OH-CB 2.97Å; D437-L457 HydrophobicContact CB-CD2 4.32Å
458	G	81.6	Confident	74.1	Confident	21 Å²	21	60.2 Å²	60.2	22%	0.216	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.9	6.3	-179.9	0	0	0	0	0	115.3	Y426 D437 T456	Y426-G458 PolarHBondContact OH-N 2.84Å; D437-G458 WeakPolarHBondContact OD1-CA 3.48Å; D437-G458 PolarHBondContact OD1-N 2.91Å; T456-G458 PolarHBondContact O-N 2.94Å
459	S	85.1	Confident	74.9	Confident	60 Å²	60	64.1 Å²	64.1	42%	0.42	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.9	-178.4	-178.5	-156.8	0	0	0	0	113	N455 T456	N455-S459 PolarHBondContact OD1-O 2.94Å; T456-S459 CarbonylContact C-O 3.59Å; T456-S459 VanDerWaalsContact C-O 3.24Å; T456-S459 VanDerWaalsContact CA-O 3.25Å; T456-S459 WeakPolarHBondContact CA-O 3.48Å; T456-S459 WeakPolarHBondContact CB-O 3.49Å; T456-S459 PolarHBondContact N-O 2.85Å; T456-S459 PolarHBondContact O-N 2.83Å; T456-S459 VanDerWaalsContact O-N 3.09Å; T456-S459 PolarHBondContact OG1-O 2.91Å
460	F	81.9	Confident	75.5	Confident	61 Å²	61	65.3 Å²	65.3	27%	0.268	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	159.3	174.2	66.6	-73	0	0	0	111.7	E440 E445 V454	E440-F460 HydrophobicContact CB-CB 4.02Å; E440-F460 HydrophobicContact CB-CD1 3.34Å; E440-F460 HydrophobicContact CB-CD2 4.33Å; E440-F460 HydrophobicContact CB-CE1 3.8Å; E440-F460 HydrophobicContact CB-CG 3.64Å; E440-F460 HydrophobicContact CB-CZ 4.46Å; E440-F460 HydrophobicContact CG-CD1 3.49Å; E440-F460 VanDerWaalsContact CG-CD1 3.49Å; E440-F460 HydrophobicContact CG-CE1 3.89Å; E440-F460 HydrophobicContact CG-CG 4.26Å; E440-F460 WeakPolarHBondContact OE2-CB 3.36Å; E445-F460 HydrophobicContact CB-CD2 4.45Å; E445-F460 HydrophobicContact CB-CE1 4.35Å; E445-F460 HydrophobicContact CB-CE2 3.69Å; E445-F460 HydrophobicContact CB-CZ 3.63Å; E445-F460 HydrophobicContact CG-CZ 4.33Å; V454-F460 WeakPolarHBondContact O-CA 3.47Å
461	K	80.9	Confident	76.2	Confident	93 Å²	93	64.1 Å²	64.1	40%	0.404	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	130.4	173.7	-67.8	178.7	-173.8	161.1	0	110.9	V454 F605	V454-K461 PolarHBondContact N-O 2.67Å; V454-K461 PolarHBondContact O-N 2.95Å; K461-F605 PolarHBondContact NZ-OXT 3.15Å
462	C	79.2	Confident	76.5	Confident	59 Å²	59	65.4 Å²	65.4	40%	0.399	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	123.7	168.4	-48.9	0	0	0	0	109.8	C446 V452	C446-C462 HydrophobicContact CB-CB 4.03Å; C446-C462 WeakPolarHBondContact CB-SG 3.32Å; C446-C462 VanDerWaalsContact SG-CA 3.57Å; C446-C462 WeakPolarHBondContact SG-CB 3.34Å; C446-C462 CovalentContact SG-SG 2.03Å; C446-C462 PolarHBondContact SG-SG 3.13Å; V452-C462 CarbonylContact O-C 3.57Å; V452-C462 WeakPolarHBondContact O-CA 3.32Å
463	H	75.3	Confident	76.5	Confident	61 Å²	61	68.9 Å²	68.9	28%	0.282	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	126.1	175.1	-70.2	-69.4	0	0	0	110.4	K451 V452 F605	K451-H463 CarbonylContact C-O 3.47Å; K451-H463 VanDerWaalsContact CA-O 3.31Å; K451-H463 WeakPolarHBondContact CA-O 3.33Å; V452-H463 PolarHBondContact N-O 3.1Å; V452-H463 PolarHBondContact O-N 3.47Å; H463-F605 AromaticContact CE1-CD1 3.7Å; H463-F605 AromaticContact CE1-CE1 3.89Å; H463-F605 AromaticContact NE2-CD1 3.55Å
464	S	74.2	Confident	76.1	Confident	82 Å²	82	69.7 Å²	69.7	57%	0.573	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.1	133.5	169.6	-66.8	0	0	0	0	109.8	D450	D450-S464 WeakPolarHBondContact O-CA 3.08Å
465	I	69.4	Low	75.3	Confident	22 Å²	22	73.3 Å²	73.3	11%	0.113	41%	0.413	C	S	.	.			trans	-123	124.7	-179.6	-55.3	-168.2	0	0	0	109.3	D450 V452 Y485 F510	D450-I465 PolarHBondContact O-N 3.27Å; V452-I465 HydrophobicContact CB-CD1 4.04Å; V452-I465 HydrophobicContact CG2-CD1 3.36Å; V452-I465 HydrophobicContact CG2-CG1 4.04Å; I465-Y485 HydrophobicContact CB-CD1 4.03Å; I465-Y485 HydrophobicContact CB-CD2 4.3Å; I465-Y485 HydrophobicContact CB-CE1 3.84Å; I465-Y485 HydrophobicContact CB-CE2 4.19Å; I465-Y485 HydrophobicContact CB-CG 4.22Å; I465-Y485 HydrophobicContact CD1-CD1 4.32Å; I465-Y485 HydrophobicContact CD1-CG 4.35Å; I465-Y485 HydrophobicContact CG2-CD1 3.68Å; I465-Y485 HydrophobicContact CG2-CE1 3.32Å; I465-Y485 HydrophobicContact CG2-CG 4.36Å; I465-Y485 VanDerWaalsContact O-CZ 3.3Å; I465-Y485 PolarHBondContact O-OH 2.01Å; I465-F510 HydrophobicContact CD1-CB 3.77Å; I465-F510 HydrophobicContact CD1-CD1 4.14Å; I465-F510 HydrophobicContact CD1-CD2 3.44Å; I465-F510 VanDerWaalsContact CD1-CD2 3.44Å; I465-F510 HydrophobicContact CD1-CE2 3.93Å; I465-F510 HydrophobicContact CD1-CG 3.53Å; I465-F510 HydrophobicContact CD1-CZ 4.49Å; I465-F510 HydrophobicContact CG2-CD2 3.63Å; I465-F510 HydrophobicContact CG2-CE2 3.25Å; I465-F510 HydrophobicContact CG2-CZ 4.09Å
466	D	74.8	Confident	74.5	Confident	152 Å²	152	78.6 Å²	78.6	81%	0.813	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-89.5	134.3	170.7	-62.7	-51.6	0	0	0	110
467	C	73.2	Confident	73.3	Confident	30 Å²	30	81.5 Å²	81.5	20%	0.203	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-63.5	141.8	172.7	-76	0	0	0	0	111	Y485 C487	C467-Y485 PolarHBondContact N-OH 2.64Å; C467-Y485 PolarHBondContact SG-OH 2.98Å; C467-C487 WeakPolarHBondContact CA-SG 3.33Å; C467-C487 HydrophobicContact CB-CB 3.96Å; C467-C487 WeakPolarHBondContact CB-SG 3.42Å; C467-C487 WeakPolarHBondContact SG-CB 3.44Å; C467-C487 CovalentContact SG-SG 2.04Å; C467-C487 PolarHBondContact SG-SG 3.28Å
468	P	78	Confident	71.8	Confident	49 Å²	49	84 Å²	84	32%	0.318	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-55.4	155.6	169	-22.7	32.6	0	0	0	112.1	N470 Y471 Y508	P468-N470 PolarHBondContact O-N 2.96Å; P468-Y471 HydrophobicContact CB-CD2 3.91Å; P468-Y471 HydrophobicContact CB-CE2 4.36Å; P468-Y471 HydrophobicContact CB-CG 4.48Å; P468-Y471 HydrophobicContact CG-CD2 4.5Å; P468-Y471 WeakPolarHBondContact O-CB 3.42Å; P468-Y471 PolarHBondContact O-N 3.1Å; P468-Y508 HydrophobicContact CG-CD2 4.18Å; P468-Y508 HydrophobicContact CG-CE2 4.43Å; P468-Y508 HydrophobicContact CG-CG 4.34Å
469	T	78.6	Confident	69.9	Low	125 Å²	125	89.3 Å²	89.3	77%	0.767	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	131.8	178.8	50.5	0	0	0	0	111.5	Y471	T469-Y471 VanDerWaalsContact C-N 3.33Å
470	N	74.6	Confident	68	Low	136 Å²	136	95.4 Å²	95.4	73%	0.727	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.6	10.2	-176.3	-49.2	-40.8	0	0	0	116.2	P468	P468-N470 PolarHBondContact O-N 2.96Å
471	Y	78.1	Confident	66.5	Low	44 Å²	44	95.8 Å²	95.8	17%	0.173	51%	0.509	C	S	.	.			trans	-103.7	147.2	167.6	-69.8	-112.5	0	0	0	110.2	P468 T469 C487 K489 V506	P468-Y471 HydrophobicContact CB-CD2 3.91Å; P468-Y471 HydrophobicContact CB-CE2 4.36Å; P468-Y471 HydrophobicContact CB-CG 4.48Å; P468-Y471 HydrophobicContact CG-CD2 4.5Å; P468-Y471 WeakPolarHBondContact O-CB 3.42Å; P468-Y471 PolarHBondContact O-N 3.1Å; T469-Y471 VanDerWaalsContact C-N 3.33Å; Y471-C487 HydrophobicContact CD1-CB 4.1Å; Y471-C487 HydrophobicContact CG-CB 4.37Å; Y471-K489 HydrophobicContact CD1-CB 3.6Å; Y471-K489 HydrophobicContact CD2-CB 4.11Å; Y471-K489 HydrophobicContact CD2-CD 4.45Å; Y471-K489 HydrophobicContact CE1-CB 3.49Å; Y471-K489 VanDerWaalsContact CE1-CB 3.49Å; Y471-K489 HydrophobicContact CE2-CB 4.01Å; Y471-K489 HydrophobicContact CE2-CD 3.9Å; Y471-K489 HydrophobicContact CG-CB 3.9Å; Y471-V506 HydrophobicContact CE1-CB 4.28Å; Y471-V506 HydrophobicContact CE1-CG1 4.16Å; Y471-V506 VanDerWaalsContact OH-CG1 3.26Å; Y471-V506 WeakPolarHBondContact OH-CG1 3.47Å
472	I	77	Confident	64.9	Low	113 Å²	113	94.4 Å²	94.4	58%	0.579	52%	0.516	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.1	155.3	173.4	60.7	171.8	0	0	0	110.3	D474 C487 I488	I472-D474 PolarHBondContact O-N 2.91Å; I472-C487 CarbonylContact O-C 3.53Å; I472-C487 WeakPolarHBondContact O-CA 3.29Å; I472-I488 HydrophobicContact CD1-CG2 4.44Å; I472-I488 HydrophobicContact CG1-CG2 3.83Å; I472-I488 WeakPolarHBondContact CG1-O 3.4Å; I472-I488 PolarHBondContact N-O 2.8Å; I472-I488 PolarHBondContact O-N 3.44Å
473	H	71.9	Confident	63.6	Low	81 Å²	81	95.6 Å²	95.6	38%	0.375	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	128.4	174.8	-70	-90.3	0	0	0	110.6	S475 Y485	H473-S475 VanDerWaalsContact C-N 3.32Å; H473-S475 PolarHBondContact O-N 3.39Å; H473-S475 PolarHBondContact O-OG 3.41Å; H473-Y485 AromaticContact CE1-CE2 3.4Å; H473-Y485 VanDerWaalsContact CE1-CE2 3.4Å; H473-Y485 WeakPolarHBondContact CE1-CE2 2.93Å; H473-Y485 AromaticContact CE1-CZ 3.53Å; H473-Y485 PolarHBondContact CE1-OH 3.22Å; H473-Y485 AromaticContact ND1-CE2 3.36Å; H473-Y485 WeakPolarHBondContact ND1-CE2 3.39Å; H473-Y485 AromaticContact ND1-CZ 3.6Å; H473-Y485 PolarHBondContact ND1-OH 3.04Å
474	D	67.9	Low	62.7	Low	33 Å²	33	93.8 Å²	93.8	18%	0.176	52%	0.516	C	S	.	.			trans	-71.7	86.9	174.9	-179.5	10.9	0	0	0	109.9	I472 L476 N477 S486 I488	I472-D474 PolarHBondContact O-N 2.91Å; D474-L476 PolarHBondContact OD1-N 3.27Å; D474-N477 PolarHBondContact OD1-N 2.91Å; D474-N477 PolarHBondContact OD2-ND2 3.13Å; D474-S486 WeakPolarHBondContact CB-O 3.26Å; D474-S486 PolarHBondContact N-O 3.06Å; D474-S486 VanDerWaalsContact N-O 3.14Å; D474-I488 HydrophobicContact CB-CB 4.38Å; D474-I488 HydrophobicContact CB-CG2 4.15Å
475	S	56.9	Low	62.4	Low	98 Å²	98	90.4 Å²	90.4	69%	0.685	49%	0.491	S	S	*	.			trans	-89.5	-1.2	-178	35.3	0	0	0	0	113.3	H473	H473-S475 VanDerWaalsContact C-N 3.32Å; H473-S475 PolarHBondContact O-N 3.39Å; H473-S475 PolarHBondContact O-OG 3.41Å
476	L	52.8	Low	62.5	Low	161 Å²	161	90.1 Å²	90.1	84%	0.843	49%	0.491	S	S	*	.	S	Bend	trans	-96.2	-19.2	-176.5	-73.5	165.1	0	0	0	113.1	D474 K478	D474-L476 PolarHBondContact OD1-N 3.27Å; L476-K478 VanDerWaalsContact C-N 3.28Å; L476-K478 PolarHBondContact O-N 3.01Å
477	N	51.3	Low	62.6	Low	94 Å²	94	82.9 Å²	82.9	50%	0.503	45%	0.452	S	S	.	.			trans	-79.4	74.6	165.4	-94.9	-45.9	0	0	0	111.2	D474 N479	D474-N477 PolarHBondContact OD1-N 2.91Å; D474-N477 PolarHBondContact OD2-ND2 3.13Å; N477-N479 PolarHBondContact O-N 3.4Å; N477-N479 VanDerWaalsContact O-N 3.12Å
478	K	44.4	Very low	62.8	Low	188 Å²	188	82.7 Å²	82.7	82%	0.817	45%	0.448	S	S	*	.			trans	-67.8	3	169.1	-74.1	-174.3	178.1	-179.8	0	114.1	L476 Q480	L476-K478 VanDerWaalsContact C-N 3.28Å; L476-K478 PolarHBondContact O-N 3.01Å; K478-Q480 PolarHBondContact O-N 3.44Å
479	N	42	Very low	63	Low	134 Å²	134	81 Å²	81	72%	0.717	44%	0.436	S	S	*	.	S	Bend	trans	-87.2	99.1	163.9	-76.1	-5.6	0	0	0	107.1	N477 I481	N477-N479 PolarHBondContact O-N 3.4Å; N477-N479 VanDerWaalsContact O-N 3.12Å; N479-I481 PolarHBondContact O-N 2.86Å
480	Q	46.1	Very low	63	Low	188 Å²	188	79.3 Å²	79.3	88%	0.879	43%	0.425	S	S	*	.			trans	-32.7	104.1	166.8	-70.1	167.5	-10.1	0	0	110.8	K478 A482	K478-Q480 PolarHBondContact O-N 3.44Å; Q480-A482 VanDerWaalsContact C-N 3.32Å; Q480-A482 PolarHBondContact O-N 3.24Å
481	I	49.9	Very low	63.2	Low	68 Å²	68	73.9 Å²	73.9	35%	0.349	40%	0.398	S	S	.	.			trans	-79.3	99	157.3	-59.2	162.5	0	0	0	102.9	N479 D483 G484	N479-I481 PolarHBondContact O-N 2.86Å; I481-D483 PolarHBondContact O-N 3.39Å; I481-G484 PolarHBondContact O-N 3.22Å
482	A	46.3	Very low	62.9	Low	65 Å²	65	75 Å²	75	54%	0.537	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-19	-171.3	0	0	0	0	0	113.6	Q480	Q480-A482 VanDerWaalsContact C-N 3.32Å; Q480-A482 PolarHBondContact O-N 3.24Å
483	D	52	Low	62.4	Low	83 Å²	83	75.8 Å²	75.8	44%	0.444	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.8	17.6	-166.8	-26.2	-41.8	0	0	0	113.3	I481	I481-D483 PolarHBondContact O-N 3.39Å
484	G	56.6	Low	62.2	Low	23 Å²	23	79.9 Å²	79.9	24%	0.237	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.4	153.4	-171.2	0	0	0	0	0	118.5	I481 F510	I481-G484 PolarHBondContact O-N 3.22Å; G484-F510 WeakPolarHBondContact CA-O 3.36Å
485	Y	68.9	Low	62.4	Low	12 Å²	12	80.2 Å²	80.2	5%	0.047	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	148	176.4	172.4	-87	0	0	0	110.8	V452 I465 C467 H473 C487 Q509 F510 R511	V452-Y485 HydrophobicContact CG2-CG 4.15Å; I465-Y485 HydrophobicContact CB-CD1 4.03Å; I465-Y485 HydrophobicContact CB-CD2 4.3Å; I465-Y485 HydrophobicContact CB-CE1 3.84Å; I465-Y485 HydrophobicContact CB-CE2 4.19Å; I465-Y485 HydrophobicContact CB-CG 4.22Å; I465-Y485 HydrophobicContact CD1-CD1 4.32Å; I465-Y485 HydrophobicContact CD1-CG 4.35Å; I465-Y485 HydrophobicContact CG2-CD1 3.68Å; I465-Y485 HydrophobicContact CG2-CE1 3.32Å; I465-Y485 HydrophobicContact CG2-CG 4.36Å; I465-Y485 VanDerWaalsContact O-CZ 3.3Å; I465-Y485 PolarHBondContact O-OH 2.01Å; C467-Y485 PolarHBondContact N-OH 2.64Å; C467-Y485 PolarHBondContact SG-OH 2.98Å; H473-Y485 AromaticContact CE1-CE2 3.4Å; H473-Y485 VanDerWaalsContact CE1-CE2 3.4Å; H473-Y485 WeakPolarHBondContact CE1-CE2 2.93Å; H473-Y485 AromaticContact CE1-CZ 3.53Å; H473-Y485 PolarHBondContact CE1-OH 3.22Å; H473-Y485 AromaticContact ND1-CE2 3.36Å; H473-Y485 WeakPolarHBondContact ND1-CE2 3.39Å; H473-Y485 AromaticContact ND1-CZ 3.6Å; H473-Y485 PolarHBondContact ND1-OH 3.04Å; Y485-C487 WeakPolarHBondContact CE1-SG 3.49Å; Y485-C487 PolarHBondContact OH-SG 3.06Å; Y485-Q509 WeakPolarHBondContact O-CA 3.49Å; Y485-F510 AromaticContact CD1-CD2 3.87Å; Y485-F510 HydrophobicContact CD1-CD2 3.87Å; Y485-F510 HydrophobicContact CD1-CE2 4.5Å; Y485-F510 HydrophobicContact CE1-CD2 4.44Å; Y485-F510 PolarHBondContact N-O 3.03Å; Y485-F510 PolarHBondContact O-N 3.26Å; Y485-R511 PolarHBondContact O-NH1 3.01Å
486	S	70.6	Confident	62.9	Low	16 Å²	16	81.5 Å²	81.5	11%	0.112	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	124.3	-174.4	-167.9	0	0	0	0	110.8	D474 L507 Y508	D474-S486 WeakPolarHBondContact CB-O 3.26Å; D474-S486 PolarHBondContact N-O 3.06Å; D474-S486 VanDerWaalsContact N-O 3.14Å; S486-L507 VanDerWaalsContact OG-CD1 3.23Å; S486-L507 WeakPolarHBondContact OG-CD1 3.41Å; S486-Y508 CarbonylContact C-O 3.55Å; S486-Y508 WeakPolarHBondContact CA-O 3.28Å
487	C	76.9	Confident	63.5	Low	0 Å²	0	79.9 Å²	79.9	0%	0	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	139.9	168.6	-60.3	0	0	0	0	109.8	C467 Y471 I472 Y485 Y508	C467-C487 WeakPolarHBondContact CA-SG 3.33Å; C467-C487 HydrophobicContact CB-CB 3.96Å; C467-C487 WeakPolarHBondContact CB-SG 3.42Å; C467-C487 WeakPolarHBondContact SG-CB 3.44Å; C467-C487 CovalentContact SG-SG 2.04Å; C467-C487 PolarHBondContact SG-SG 3.28Å; Y471-C487 HydrophobicContact CD1-CB 4.1Å; Y471-C487 HydrophobicContact CG-CB 4.37Å; I472-C487 CarbonylContact O-C 3.53Å; I472-C487 WeakPolarHBondContact O-CA 3.29Å; Y485-C487 WeakPolarHBondContact CE1-SG 3.49Å; Y485-C487 PolarHBondContact OH-SG 3.06Å; C487-Y508 PolarHBondContact N-O 3.47Å; C487-Y508 PolarHBondContact O-N 2.96Å
488	I	77.5	Confident	64.3	Low	26 Å²	26	75.7 Å²	75.7	13%	0.133	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	134.8	-179.8	-170.4	168.9	0	0	0	110.7	I472 D474 V490 E505 L507	I472-I488 HydrophobicContact CD1-CG2 4.44Å; I472-I488 HydrophobicContact CG1-CG2 3.83Å; I472-I488 WeakPolarHBondContact CG1-O 3.4Å; I472-I488 PolarHBondContact N-O 2.8Å; I472-I488 PolarHBondContact O-N 3.44Å; D474-I488 HydrophobicContact CB-CB 4.38Å; D474-I488 HydrophobicContact CB-CG2 4.15Å; I488-V490 HydrophobicContact CD1-CG2 4.48Å; I488-V490 HydrophobicContact CG1-CG2 4.44Å; I488-E505 HydrophobicContact CD1-CG 4.35Å; I488-L507 HydrophobicContact CB-CD1 4.16Å; I488-L507 HydrophobicContact CG1-CD1 4.4Å
489	K	82.2	Confident	65	Low	12 Å²	12	71.4 Å²	71.4	5%	0.052	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	112.7	165.6	176.1	179.1	173.7	-176.7	0	107.6	Y471 D495 E497 E505 V506	Y471-K489 HydrophobicContact CD1-CB 3.6Å; Y471-K489 HydrophobicContact CD2-CB 4.11Å; Y471-K489 HydrophobicContact CD2-CD 4.45Å; Y471-K489 HydrophobicContact CE1-CB 3.49Å; Y471-K489 VanDerWaalsContact CE1-CB 3.49Å; Y471-K489 HydrophobicContact CE2-CB 4.01Å; Y471-K489 HydrophobicContact CE2-CD 3.9Å; Y471-K489 HydrophobicContact CG-CB 3.9Å; K489-D495 WeakPolarHBondContact CE-OD2 3.4Å; K489-D495 IonicContact NZ-OD1 3.32Å; K489-D495 PolarHBondContact NZ-OD1 3.08Å; K489-D495 IonicContact NZ-OD2 2.88Å; K489-D495 PolarHBondContact NZ-OD2 2.76Å; K489-E497 IonicContact NZ-OE2 3.33Å; K489-E497 PolarHBondContact NZ-OE2 3.32Å; K489-E505 WeakPolarHBondContact O-CA 3.36Å; K489-V506 HydrophobicContact CB-CB 4.38Å; K489-V506 PolarHBondContact N-O 3.18Å; K489-V506 PolarHBondContact O-N 3.1Å
490	V	79.6	Confident	65.8	Low	90 Å²	90	68 Å²	68	55%	0.545	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	116.8	171.6	-177.3	0	0	0	0	107.3	I488	I488-V490 HydrophobicContact CD1-CG2 4.48Å; I488-V490 HydrophobicContact CG1-CG2 4.44Å
491	C	78.2	Confident	66.4	Low	22 Å²	22	64.8 Å²	64.8	15%	0.149	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-72	132.3	-175.8	-64.9	0	0	0	0	110.8	C498 T503 R504	C491-C498 HydrophobicContact CB-CB 3.39Å; C491-C498 WeakPolarHBondContact CB-SG 3.42Å; C491-C498 WeakPolarHBondContact SG-CB 3.43Å; C491-C498 CovalentContact SG-SG 2.04Å; C491-C498 PolarHBondContact SG-SG 3.49Å; C491-T503 VanDerWaalsContact CB-O 3.28Å; C491-T503 WeakPolarHBondContact CB-O 3.44Å; C491-T503 PolarHBondContact SG-O 2.9Å; C491-T503 VanDerWaalsContact SG-O 3.4Å; C491-R504 WeakPolarHBondContact CB-O 3.25Å; C491-R504 PolarHBondContact N-O 3.49Å
492	S	71.9	Confident	67.2	Low	69 Å²	69	70.3 Å²	70.3	48%	0.483	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-93.4	165.7	171.1	73.3	0	0	0	0	111.1	E494 D495	S492-E494 PolarHBondContact O-N 2.93Å; S492-E494 VanDerWaalsContact O-N 3.08Å; S492-D495 PolarHBondContact O-N 2.75Å
493	T	65.8	Low	68.3	Low	129 Å²	129	69.6 Å²	69.6	79%	0.791	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-5	179.1	49.1	0	0	0	0	114.4	L499	T493-L499 WeakPolarHBondContact O-CD1 3.32Å
494	E	67.5	Low	69.2	Low	166 Å²	166	74 Å²	74	78%	0.776	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.7	-3.8	-179.3	-60.9	-175.8	176.7	0	0	112.8	S492 T496	S492-E494 PolarHBondContact O-N 2.93Å; S492-E494 VanDerWaalsContact O-N 3.08Å; E494-T496 PolarHBondContact O-N 2.83Å
495	D	72.1	Confident	70	Confident	41 Å²	41	77.3 Å²	77.3	22%	0.219	42%	0.418	C	S	.	.			trans	-80.5	100.4	-175.5	-136	-39.8	0	0	0	110.3	K489 S492 E497 C498 L499	K489-D495 WeakPolarHBondContact CE-OD2 3.4Å; K489-D495 IonicContact NZ-OD1 3.32Å; K489-D495 PolarHBondContact NZ-OD1 3.08Å; K489-D495 IonicContact NZ-OD2 2.88Å; K489-D495 PolarHBondContact NZ-OD2 2.76Å; S492-D495 PolarHBondContact O-N 2.75Å; D495-E497 PolarHBondContact O-N 2.89Å; D495-E497 VanDerWaalsContact O-N 3.16Å; D495-C498 HydrophobicContact CB-CB 4.31Å; D495-C498 PolarHBondContact O-N 3.22Å; D495-L499 WeakPolarHBondContact O-CB 3.32Å; D495-L499 WeakPolarHBondContact O-CD1 3.07Å; D495-L499 WeakPolarHBondContact O-CG 3.4Å; D495-L499 PolarHBondContact O-N 3.09Å
496	T	67.6	Low	70.4	Confident	125 Å²	125	78.9 Å²	78.9	77%	0.767	43%	0.428	S	S	*	.	H	α-helix	trans	-59.8	-27.8	-173.4	50.3	0	0	0	0	113.5	E494	E494-T496 PolarHBondContact O-N 2.83Å
497	E	66.4	Low	70.6	Confident	127 Å²	127	81.7 Å²	81.7	59%	0.593	44%	0.442	S	S	*	.	H	α-helix	trans	-68	-35.5	175.2	-171.3	179.9	-156.1	0	0	112.5	K489 D495	K489-E497 IonicContact NZ-OE2 3.33Å; K489-E497 PolarHBondContact NZ-OE2 3.32Å; D495-E497 PolarHBondContact O-N 2.89Å; D495-E497 VanDerWaalsContact O-N 3.16Å
498	C	66.9	Low	70.5	Confident	6 Å²	6	86.1 Å²	86.1	4%	0.041	46%	0.459	C	S	.	.	H	α-helix	trans	-91.6	-27.5	-179.4	-56	0	0	0	0	113.1	C491 D495 G500 N501 H502 T503	C491-C498 HydrophobicContact CB-CB 3.39Å; C491-C498 WeakPolarHBondContact CB-SG 3.42Å; C491-C498 WeakPolarHBondContact SG-CB 3.43Å; C491-C498 CovalentContact SG-SG 2.04Å; C491-C498 PolarHBondContact SG-SG 3.49Å; D495-C498 HydrophobicContact CB-CB 4.31Å; D495-C498 PolarHBondContact O-N 3.22Å; C498-G500 VanDerWaalsContact C-N 3.31Å; C498-G500 PolarHBondContact O-N 3.41Å; C498-N501 PolarHBondContact O-N 3.47Å; C498-H502 PolarHBondContact O-N 3.04Å; C498-T503 PolarHBondContact O-N 3.14Å
499	L	60.1	Low	70.3	Confident	97 Å²	97	87.3 Å²	87.3	51%	0.508	46%	0.464	S	S	.	.	H	α-helix	trans	-62.2	-32.2	-177.2	-90.1	155.6	0	0	0	113.6	T493 D495 N501	T493-L499 WeakPolarHBondContact O-CD1 3.32Å; D495-L499 WeakPolarHBondContact O-CB 3.32Å; D495-L499 WeakPolarHBondContact O-CD1 3.07Å; D495-L499 WeakPolarHBondContact O-CG 3.4Å; D495-L499 PolarHBondContact O-N 3.09Å; L499-N501 VanDerWaalsContact C-N 3.31Å; L499-N501 PolarHBondContact O-N 3.36Å
500	G	59	Low	69.7	Low	64 Å²	64	90.2 Å²	90.2	66%	0.66	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-24.3	-180	0	0	0	0	0	114.6	C498	C498-G500 VanDerWaalsContact C-N 3.31Å; C498-G500 PolarHBondContact O-N 3.41Å
501	N	59.2	Low	69.3	Low	120 Å²	120	88.3 Å²	88.3	64%	0.642	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.1	8	-169	-72.3	-16	0	0	0	113.9	C498 L499 T503	C498-N501 PolarHBondContact O-N 3.47Å; L499-N501 VanDerWaalsContact C-N 3.31Å; L499-N501 PolarHBondContact O-N 3.36Å; N501-T503 WeakPolarHBondContact CB-OG1 3.03Å; N501-T503 PolarHBondContact O-N 3.41Å
502	H	65.7	Low	68.6	Low	183 Å²	183	88.8 Å²	88.8	85%	0.847	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	31.5	-173.4	-60.4	-78.2	0	0	0	113.6	C498	C498-H502 PolarHBondContact O-N 3.04Å
503	T	69	Low	68.4	Low	51 Å²	51	89.2 Å²	89.2	31%	0.313	47%	0.465	S	S	.	.			trans	-76.4	125.5	-176.6	-53.6	0	0	0	0	110.2	C491 C498 N501 E505 V506	C491-T503 VanDerWaalsContact CB-O 3.28Å; C491-T503 WeakPolarHBondContact CB-O 3.44Å; C491-T503 PolarHBondContact SG-O 2.9Å; C491-T503 VanDerWaalsContact SG-O 3.4Å; C498-T503 PolarHBondContact O-N 3.14Å; N501-T503 WeakPolarHBondContact CB-OG1 3.03Å; N501-T503 PolarHBondContact O-N 3.41Å; T503-E505 WeakPolarHBondContact CG2-O 3.23Å; T503-V506 HydrophobicContact CG2-CG2 3.87Å
504	R	71.4	Confident	68.2	Low	174 Å²	174	86.3 Å²	86.3	66%	0.657	45%	0.448	S	S	*	.			trans	-86	-39.4	178.4	-167.7	-178.3	176.6	-154.2	-4.2	112.3	C491	C491-R504 WeakPolarHBondContact CB-O 3.25Å; C491-R504 PolarHBondContact N-O 3.49Å
505	E	74.2	Confident	67.7	Low	94 Å²	94	83.5 Å²	83.5	44%	0.439	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	140.7	-173.3	-69.3	167.1	-172	0	0	109.4	I488 K489 T503	I488-E505 HydrophobicContact CD1-CG 4.35Å; K489-E505 WeakPolarHBondContact O-CA 3.36Å; T503-E505 WeakPolarHBondContact CG2-O 3.23Å
506	V	75.8	Confident	67.1	Low	44 Å²	44	85.4 Å²	85.4	27%	0.267	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	128.7	171.3	-174.2	0	0	0	0	108.4	Y471 K489 T503	Y471-V506 HydrophobicContact CE1-CB 4.28Å; Y471-V506 HydrophobicContact CE1-CG1 4.16Å; Y471-V506 VanDerWaalsContact OH-CG1 3.26Å; Y471-V506 WeakPolarHBondContact OH-CG1 3.47Å; K489-V506 HydrophobicContact CB-CB 4.38Å; K489-V506 PolarHBondContact N-O 3.18Å; K489-V506 PolarHBondContact O-N 3.1Å; T503-V506 HydrophobicContact CG2-CG2 3.87Å
507	L	75.2	Confident	66.8	Low	75 Å²	75	89 Å²	89	39%	0.393	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	124.3	-176.1	-162.6	67.5	0	0	0	109.9	S486 I488 Q509	S486-L507 VanDerWaalsContact OG-CD1 3.23Å; S486-L507 WeakPolarHBondContact OG-CD1 3.41Å; I488-L507 HydrophobicContact CB-CD1 4.16Å; I488-L507 HydrophobicContact CG1-CD1 4.4Å; L507-Q509 HydrophobicContact CD2-CG 3.82Å; L507-Q509 HydrophobicContact CG-CG 3.71Å
508	Y	75	Confident	66.6	Low	94 Å²	94	87.4 Å²	87.4	37%	0.369	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	118.5	173.4	-169.4	-71.1	0	0	0	108.7	P468 S486 C487 F510	P468-Y508 HydrophobicContact CG-CD2 4.18Å; P468-Y508 HydrophobicContact CG-CE2 4.43Å; P468-Y508 HydrophobicContact CG-CG 4.34Å; S486-Y508 CarbonylContact C-O 3.55Å; S486-Y508 WeakPolarHBondContact CA-O 3.28Å; C487-Y508 PolarHBondContact N-O 3.47Å; C487-Y508 PolarHBondContact O-N 2.96Å; Y508-F510 AromaticContact CD1-CD2 3.98Å; Y508-F510 HydrophobicContact CD1-CD2 3.98Å; Y508-F510 AromaticContact CD1-CE2 3.77Å; Y508-F510 HydrophobicContact CD1-CE2 3.77Å; Y508-F510 HydrophobicContact CD1-CZ 4.41Å; Y508-F510 HydrophobicContact CE1-CD1 4.36Å; Y508-F510 AromaticContact CE1-CD2 3.51Å; Y508-F510 HydrophobicContact CE1-CD2 3.51Å; Y508-F510 AromaticContact CE1-CE1 3.97Å; Y508-F510 HydrophobicContact CE1-CE1 3.97Å; Y508-F510 AromaticContact CE1-CE2 3.07Å; Y508-F510 HydrophobicContact CE1-CE2 3.07Å; Y508-F510 HydrophobicContact CE1-CG 4.17Å; Y508-F510 AromaticContact CE1-CZ 3.32Å; Y508-F510 HydrophobicContact CE1-CZ 3.32Å; Y508-F510 AromaticContact CZ-CE2 3.94Å; Y508-F510 AromaticContact CZ-CZ 3.75Å; Y508-F510 WeakPolarHBondContact OH-CZ 3.47Å
509	Q	73	Confident	66.9	Low	51 Å²	51	88.7 Å²	88.7	24%	0.238	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	133.4	-175.1	-58.6	-165.9	-54.6	0	0	111.7	Y485 L507 V525	Y485-Q509 WeakPolarHBondContact O-CA 3.49Å; L507-Q509 HydrophobicContact CD2-CG 3.82Å; L507-Q509 HydrophobicContact CG-CG 3.71Å; Q509-V525 PolarHBondContact OE1-O 2.92Å
510	F	71.1	Confident	67.2	Low	73 Å²	73	91 Å²	91	32%	0.32	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	133.6	166.3	-73.3	-83	0	0	0	109.5	I465 G484 Y485 Y508	I465-F510 HydrophobicContact CD1-CB 3.77Å; I465-F510 HydrophobicContact CD1-CD1 4.14Å; I465-F510 HydrophobicContact CD1-CD2 3.44Å; I465-F510 VanDerWaalsContact CD1-CD2 3.44Å; I465-F510 HydrophobicContact CD1-CE2 3.93Å; I465-F510 HydrophobicContact CD1-CG 3.53Å; I465-F510 HydrophobicContact CD1-CZ 4.49Å; I465-F510 HydrophobicContact CG2-CD2 3.63Å; I465-F510 HydrophobicContact CG2-CE2 3.25Å; I465-F510 HydrophobicContact CG2-CZ 4.09Å; G484-F510 WeakPolarHBondContact CA-O 3.36Å; Y485-F510 AromaticContact CD1-CD2 3.87Å; Y485-F510 HydrophobicContact CD1-CD2 3.87Å; Y485-F510 HydrophobicContact CD1-CE2 4.5Å; Y485-F510 HydrophobicContact CE1-CD2 4.44Å; Y485-F510 PolarHBondContact N-O 3.03Å; Y485-F510 PolarHBondContact O-N 3.26Å; Y508-F510 AromaticContact CD1-CD2 3.98Å; Y508-F510 HydrophobicContact CD1-CD2 3.98Å; Y508-F510 AromaticContact CD1-CE2 3.77Å; Y508-F510 HydrophobicContact CD1-CE2 3.77Å; Y508-F510 HydrophobicContact CD1-CZ 4.41Å; Y508-F510 HydrophobicContact CE1-CD1 4.36Å; Y508-F510 AromaticContact CE1-CD2 3.51Å; Y508-F510 HydrophobicContact CE1-CD2 3.51Å; Y508-F510 AromaticContact CE1-CE1 3.97Å; Y508-F510 HydrophobicContact CE1-CE1 3.97Å; Y508-F510 AromaticContact CE1-CE2 3.07Å; Y508-F510 HydrophobicContact CE1-CE2 3.07Å; Y508-F510 HydrophobicContact CE1-CG 4.17Å; Y508-F510 AromaticContact CE1-CZ 3.32Å; Y508-F510 HydrophobicContact CE1-CZ 3.32Å; Y508-F510 AromaticContact CZ-CE2 3.94Å; Y508-F510 AromaticContact CZ-CZ 3.75Å; Y508-F510 WeakPolarHBondContact OH-CZ 3.47Å
511	R	69.4	Low	67.9	Low	50 Å²	50	91.8 Å²	91.8	19%	0.189	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	131.6	176.7	-66.1	-65	-178.3	-87.7	-6.3	109.5	Y485	Y485-R511 PolarHBondContact O-NH1 3.01Å
512	A	65.3	Low	68.9	Low	31 Å²	31	88.8 Å²	88.8	26%	0.256	46%	0.46	S	S	.	.			trans	-69.4	129.6	165.8	0	0	0	0	0	108.8	V454	V454-A512 HydrophobicContact CG1-CB 4.15Å; V454-A512 HydrophobicContact CG2-CB 4.21Å
513	V	66.1	Low	69.5	Low	79 Å²	79	81.4 Å²	81.4	48%	0.479	43%	0.427	S	S	.	.			trans	-119.5	127.9	173.8	-175.8	0	0	0	0	107.4	I523 L563	V513-I523 HydrophobicContact CG1-CD1 4.23Å; V513-L563 HydrophobicContact CG1-CD2 3.69Å
514	P	61.8	Low	70.1	Confident	67 Å²	67	82.2 Å²	82.2	44%	0.435	43%	0.427	S	S	.	.			trans	-62.2	141.2	-179.8	13.1	-15.1	0	0	0	111.1	L516 I523	P514-L516 HydrophobicContact CB-CD1 4.28Å; P514-L516 HydrophobicContact CB-CG 4.35Å; P514-L516 PolarHBondContact O-N 3.46Å; P514-L516 VanDerWaalsContact O-N 3.1Å; P514-I523 HydrophobicContact CG-CD1 3.8Å
515	S	56.6	Low	70.5	Confident	108 Å²	108	75 Å²	75	76%	0.755	40%	0.403	S	S	*	.			trans	-74.3	7.5	-179.8	60.7	0	0	0	0	114.3
516	L	60.6	Low	70.9	Confident	81 Å²	81	71.5 Å²	71.5	42%	0.424	39%	0.388	S	S	.	.			trans	-67.4	145.9	-175.2	-66.5	169.3	0	0	0	111.5	P514 T518 I520	P514-L516 HydrophobicContact CB-CD1 4.28Å; P514-L516 HydrophobicContact CB-CG 4.35Å; P514-L516 PolarHBondContact O-N 3.46Å; P514-L516 VanDerWaalsContact O-N 3.1Å; L516-T518 VanDerWaalsContact CB-O 3.25Å; L516-T518 WeakPolarHBondContact CB-O 3.43Å; L516-T518 PolarHBondContact O-N 3Å; L516-T518 VanDerWaalsContact O-N 3.13Å; L516-I520 HydrophobicContact CD1-CD1 4.04Å; L516-I520 HydrophobicContact CD1-CG1 4.5Å
517	K	61.5	Low	71.2	Confident	200 Å²	200	74.1 Å²	74.1	87%	0.87	39%	0.393	S	S	*	.	S	Bend	trans	-66.3	-8	171.7	-70.5	-175.1	179.9	178.1	0	113.2
518	T	62.3	Low	71.6	Confident	93 Å²	93	71.7 Å²	71.7	57%	0.571	38%	0.38	S	S	*	.	S	Bend	trans	-143.6	140.2	-179.1	49	0	0	0	0	110.2	L516	L516-T518 VanDerWaalsContact CB-O 3.25Å; L516-T518 WeakPolarHBondContact CB-O 3.43Å; L516-T518 PolarHBondContact O-N 3Å; L516-T518 VanDerWaalsContact O-N 3.13Å
519	I	71.8	Confident	71.9	Confident	33 Å²	33	70.2 Å²	70.2	17%	0.169	38%	0.381	C	S	.	.			trans	-91.7	111.3	174.2	-65.5	-172.9	0	0	0	107.6	S521 I523 L563 K565 P566	I519-S521 WeakPolarHBondContact CG2-O 3.47Å; I519-I523 HydrophobicContact CG2-CG1 4.45Å; I519-L563 HydrophobicContact CD1-CB 4.24Å; I519-L563 HydrophobicContact CD1-CD2 3.48Å; I519-L563 VanDerWaalsContact CD1-CD2 3.48Å; I519-L563 HydrophobicContact CD1-CG 3.43Å; I519-L563 VanDerWaalsContact CD1-CG 3.43Å; I519-K565 WeakPolarHBondContact CD1-O 3.44Å; I519-P566 HydrophobicContact CG1-CB 4.46Å
520	I	67.8	Low	72.2	Confident	147 Å²	147	68.8 Å²	68.8	75%	0.754	38%	0.376	S	S	*	.	S	Bend	trans	-77.9	-33.9	-176.2	-53.9	173.6	0	0	0	110.8	L516	L516-I520 HydrophobicContact CD1-CD1 4.04Å; L516-I520 HydrophobicContact CD1-CG1 4.5Å
521	S	73.2	Confident	72.3	Confident	80 Å²	80	72.5 Å²	72.5	56%	0.559	39%	0.394	S	S	*	.	S	Bend	trans	-132.4	136.4	174.8	52.9	0	0	0	0	110.6	I519 I523	I519-S521 WeakPolarHBondContact CG2-O 3.47Å; S521-I523 PolarHBondContact O-N 3.5Å
522	P	80.1	Confident	72.2	Confident	56 Å²	56	74.1 Å²	74.1	36%	0.364	41%	0.405	S	S	.	.			trans	-58.5	129.3	178.8	-25.1	34.6	0	0	0	112.2	Q562 L563 V564	P522-Q562 HydrophobicContact CB-CB 4.03Å; P522-Q562 HydrophobicContact CB-CG 4.46Å; P522-L563 WeakPolarHBondContact CA-O 3.43Å; P522-V564 HydrophobicContact CB-CG1 3.91Å; P522-V564 HydrophobicContact CG-CG1 4.11Å
523	I	77.9	Confident	72.2	Confident	29 Å²	29	76.2 Å²	76.2	15%	0.149	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	122.9	-175.1	-57	170.3	0	0	0	109.2	V513 P514 I519 S521 V525 Q562 L563	V513-I523 HydrophobicContact CG1-CD1 4.23Å; P514-I523 HydrophobicContact CG-CD1 3.8Å; I519-I523 HydrophobicContact CG2-CG1 4.45Å; S521-I523 PolarHBondContact O-N 3.5Å; I523-V525 WeakPolarHBondContact O-CG2 3.39Å; I523-V525 PolarHBondContact O-N 3.47Å; I523-Q562 CarbonylContact O-C 3.37Å; I523-Q562 WeakPolarHBondContact O-CA 3.49Å; I523-L563 HydrophobicContact CB-CB 4.32Å; I523-L563 PolarHBondContact N-O 3.47Å; I523-L563 PolarHBondContact O-N 3.17Å
524	E	82.4	Confident	72.3	Confident	68 Å²	68	78.9 Å²	78.9	32%	0.318	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	114.1	174.2	179	171.2	154.3	0	0	110.8	R527 I560	E524-R527 VanDerWaalsContact CD-NH2 3.26Å; E524-R527 IonicContact OE1-CZ 2.86Å; E524-R527 VanDerWaalsContact OE1-CZ 3.3Å; E524-R527 IonicContact OE1-NE 2.98Å; E524-R527 PolarHBondContact OE1-NE 3.49Å; E524-R527 IonicContact OE1-NH2 2.78Å; E524-R527 PolarHBondContact OE1-NH2 3.15Å; E524-R527 IonicContact OE2-CZ 2.88Å; E524-R527 IonicContact OE2-NH2 3.74Å; E524-R527 PolarHBondContact OE2-NH2 3.3Å; E524-I560 HydrophobicContact CB-CG2 4.3Å; E524-I560 HydrophobicContact CG-CG2 3.65Å; E524-I560 WeakPolarHBondContact OE2-CG2 3.44Å
525	V	79.3	Confident	72.2	Confident	23 Å²	23	77.1 Å²	77.1	14%	0.139	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	-36.5	-178.6	-172.6	0	0	0	0	111.5	Q509 I523 F550 V561 L563 I598	Q509-V525 PolarHBondContact OE1-O 2.92Å; I523-V525 WeakPolarHBondContact O-CG2 3.39Å; I523-V525 PolarHBondContact O-N 3.47Å; V525-F550 HydrophobicContact CB-CE1 4.48Å; V525-F550 HydrophobicContact CG2-CD1 4.35Å; V525-F550 HydrophobicContact CG2-CE1 4Å; V525-V561 PolarHBondContact N-O 3.24Å; V525-L563 HydrophobicContact CG2-CB 3.64Å; V525-I598 HydrophobicContact CG1-CD1 4.05Å; V525-I598 HydrophobicContact CG1-CG1 4.5Å
526	S	82.3	Confident	72.9	Confident	19 Å²	19	78 Å²	78	13%	0.133	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	153.1	179.2	-172.6	0	0	0	0	111.4	V561	S526-V561 PolarHBondContact N-O 2.81Å; S526-V561 PolarHBondContact O-N 3.03Å
527	R	82.3	Confident	73.9	Confident	99 Å²	99	76.2 Å²	76.2	37%	0.374	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	119.3	178.5	-178	177.6	-66.8	-98.2	-1.5	109.4	E524 V529 E555 I558	E524-R527 VanDerWaalsContact CD-NH2 3.26Å; E524-R527 IonicContact OE1-CZ 2.86Å; E524-R527 VanDerWaalsContact OE1-CZ 3.3Å; E524-R527 IonicContact OE1-NE 2.98Å; E524-R527 PolarHBondContact OE1-NE 3.49Å; E524-R527 IonicContact OE1-NH2 2.78Å; E524-R527 PolarHBondContact OE1-NH2 3.15Å; E524-R527 IonicContact OE2-CZ 2.88Å; E524-R527 IonicContact OE2-NH2 3.74Å; E524-R527 PolarHBondContact OE2-NH2 3.3Å; R527-V529 HydrophobicContact CG-CG2 4.39Å; R527-E555 IonicContact NH1-OE2 3.3Å; R527-I558 HydrophobicContact CG-CG2 3.4Å; R527-I558 VanDerWaalsContact CG-CG2 3.4Å
528	I	83.8	Confident	75.1	Confident	24 Å²	24	66.8 Å²	66.8	12%	0.123	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	119	-179.4	-56.6	164.2	0	0	0	108.5	Y540 I558 G559 V561 V577 I579 A594 I596	I528-Y540 HydrophobicContact CB-CE1 4.22Å; I528-Y540 HydrophobicContact CG2-CE1 3.91Å; I528-Y540 PolarHBondContact O-OH 3.36Å; I528-I558 CarbonylContact O-C 3.51Å; I528-I558 VanDerWaalsContact O-CA 3.32Å; I528-I558 WeakPolarHBondContact O-CA 3.47Å; I528-G559 PolarHBondContact N-O 3.28Å; I528-G559 PolarHBondContact O-N 3.08Å; I528-V561 HydrophobicContact CD1-CG2 4.46Å; I528-V577 HydrophobicContact CD1-CB 3.82Å; I528-V577 HydrophobicContact CD1-CG1 3.88Å; I528-V577 HydrophobicContact CD1-CG2 3.73Å; I528-I579 HydrophobicContact CG2-CD1 3.88Å; I528-A594 HydrophobicContact CD1-CB 3.85Å; I528-I596 HydrophobicContact CD1-CD1 4.18Å
529	V	81.6	Confident	76.4	Confident	63 Å²	63	64.3 Å²	64.3	38%	0.382	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	122.6	178.1	-176.3	0	0	0	0	109.4	R527 I558	R527-V529 HydrophobicContact CG-CG2 4.39Å; V529-I558 HydrophobicContact CG1-CG1 4.48Å; V529-I558 HydrophobicContact CG2-CD1 4.46Å; V529-I558 HydrophobicContact CG2-CG1 4.18Å; V529-I558 HydrophobicContact CG2-CG2 4.24Å
530	T	78.6	Confident	77.3	Confident	22 Å²	22	63.1 Å²	63.1	14%	0.135	36%	0.355	C	S	.	.			trans	-93.1	113.8	170.5	-59	0	0	0	0	109.1	M532 V538 Y540 N557	T530-M532 HydrophobicContact CG2-CG 4.25Å; T530-M532 PolarHBondContact O-N 2.85Å; T530-V538 HydrophobicContact CG2-CG2 4.11Å; T530-Y540 WeakPolarHBondContact CB-OH 3.24Å; T530-Y540 PolarHBondContact N-OH 2.96Å; T530-Y540 PolarHBondContact OG1-OH 2.93Å; T530-N557 PolarHBondContact N-O 3.43Å; T530-N557 PolarHBondContact O-ND2 3.32Å
531	H	74.5	Confident	78.4	Confident	151 Å²	151	60 Å²	60	70%	0.699	34%	0.34	S	S	*	.			trans	-76.4	118	173.3	-67.3	-80.4	0	0	0	109.8
532	M	66.1	Low	79.2	Confident	83 Å²	83	56.7 Å²	56.7	41%	0.409	32%	0.316	S	S	.	.			trans	-107.8	127.8	-172.2	-71.4	-167.5	-54.5	0	0	111.7	T530 P535 V538 N557	T530-M532 HydrophobicContact CG2-CG 4.25Å; T530-M532 PolarHBondContact O-N 2.85Å; M532-P535 HydrophobicContact CB-CG 4.26Å; M532-P535 HydrophobicContact CG-CG 3.97Å; M532-P535 HydrophobicContact SD-CG 3.85Å; M532-V538 HydrophobicContact CG-CG2 4.27Å; M532-V538 HydrophobicContact SD-CG2 3.51Å; M532-V538 VanDerWaalsContact SD-CG2 3.51Å; M532-N557 HydrophobicContact CE-CB 3.64Å; M532-N557 HydrophobicContact SD-CB 4.32Å
533	G	65.5	Low	79.7	Confident	76 Å²	76	55.5 Å²	55.5	78%	0.784	31%	0.306	S	S	*	.	S	Bend	trans	-90.7	-59.9	168.2	0	0	0	0	0	112.6
534	V	68.4	Low	80	Confident	135 Å²	135	62.4 Å²	62.4	82%	0.818	33%	0.332	S	S	*	.	S	Bend	trans	-149.4	71	175.3	-152.7	0	0	0	0	115
535	P	60.1	Low	80.1	Confident	29 Å²	29	61.7 Å²	61.7	19%	0.188	33%	0.332	C	S	.	.			trans	-126.8	166.9	150.2	34.6	-23.9	0	0	0	112.5	M532 T581 K582 L589	M532-P535 HydrophobicContact CB-CG 4.26Å; M532-P535 HydrophobicContact CG-CG 3.97Å; M532-P535 HydrophobicContact SD-CG 3.85Å; P535-T581 HydrophobicContact CB-CG2 3.37Å; P535-T581 HydrophobicContact CG-CG2 3.3Å; P535-K582 WeakPolarHBondContact CB-O 3.29Å; P535-L589 HydrophobicContact CB-CD1 4.17Å
536	F	70.6	Confident	80.1	Confident	126 Å²	126	60.6 Å²	60.6	55%	0.553	33%	0.326	S	S	*	.	S	Bend	trans	-99.5	-23.4	-171.5	-68.2	-96.7	0	0	0	113.9	K582 R584	F536-K582 PolarHBondContact N-O 2.87Å; F536-K582 VanDerWaalsContact N-O 3.08Å; F536-R584 HydrophobicContact CB-CB 4.32Å; F536-R584 HydrophobicContact CB-CG 4.48Å; F536-R584 HydrophobicContact CD1-CB 3.93Å; F536-R584 HydrophobicContact CD1-CG 3.63Å; F536-R584 HydrophobicContact CD2-CB 3.42Å; F536-R584 VanDerWaalsContact CD2-CB 3.42Å; F536-R584 HydrophobicContact CD2-CG 4.1Å; F536-R584 HydrophobicContact CE1-CB 4.05Å; F536-R584 HydrophobicContact CE1-CG 3.76Å; F536-R584 HydrophobicContact CE2-CB 3.55Å; F536-R584 HydrophobicContact CE2-CG 4.21Å; F536-R584 HydrophobicContact CG-CB 3.61Å; F536-R584 HydrophobicContact CG-CG 3.8Å; F536-R584 HydrophobicContact CZ-CB 3.86Å; F536-R584 HydrophobicContact CZ-CG 4.03Å
537	S	82.2	Confident	80.4	Confident	45 Å²	45	65.2 Å²	65.2	32%	0.315	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	161.3	173.2	65.1	0	0	0	0	112	K582	S537-K582 PolarHBondContact N-O 2.71Å; S537-K582 PolarHBondContact O-N 3.05Å
538	V	86.9	Confident	80.6	Confident	1 Å²	1	66.9 Å²	66.9	1%	0.006	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	141.2	174	175.1	0	0	0	0	106.8	T530 M532 Y540 Q554 I579 H580 T581	T530-V538 HydrophobicContact CG2-CG2 4.11Å; M532-V538 HydrophobicContact CG-CG2 4.27Å; M532-V538 HydrophobicContact SD-CG2 3.51Å; M532-V538 VanDerWaalsContact SD-CG2 3.51Å; V538-Y540 HydrophobicContact CB-CE2 4.39Å; V538-Y540 HydrophobicContact CG1-CD2 4.26Å; V538-Y540 HydrophobicContact CG1-CE1 4.37Å; V538-Y540 HydrophobicContact CG1-CE2 3.72Å; V538-Q554 VanDerWaalsContact O-CD 3.32Å; V538-Q554 PolarHBondContact O-NE2 2.78Å; V538-Q554 PolarHBondContact O-OE1 2.91Å; V538-I579 HydrophobicContact CG1-CG2 3.5Å; V538-I579 VanDerWaalsContact CG1-CG2 3.5Å; V538-H580 CarbonylContact C-O 3.6Å; V538-H580 VanDerWaalsContact CA-O 3.31Å; V538-H580 WeakPolarHBondContact CA-O 3.3Å; V538-T581 HydrophobicContact CG2-CG2 4.34Å
539	D	88.8	Confident	80.8	Confident	42 Å²	42	67.6 Å²	67.6	23%	0.225	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	140	172.6	-61.8	-34	0	0	0	110.6	I579 H580 K582	D539-I579 WeakPolarHBondContact O-CA 3.33Å; D539-H580 PolarHBondContact N-O 3.04Å; D539-H580 PolarHBondContact O-N 3.07Å; D539-K582 WeakPolarHBondContact OD2-CD 2.97Å; D539-K582 WeakPolarHBondContact OD2-CE 3.48Å; D539-K582 IonicContact OD2-NZ 3.18Å; D539-K582 PolarHBondContact OD2-NZ 2.74Å
540	Y	91.5	Very high	81.2	Confident	8 Å²	8	64.9 Å²	64.9	3%	0.031	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	127.1	178	-61.7	-91.9	0	0	0	111.2	I528 T530 V538 I552 Q554 N557 V577 N578 I579	I528-Y540 HydrophobicContact CB-CE1 4.22Å; I528-Y540 HydrophobicContact CG2-CE1 3.91Å; I528-Y540 PolarHBondContact O-OH 3.36Å; T530-Y540 WeakPolarHBondContact CB-OH 3.24Å; T530-Y540 PolarHBondContact N-OH 2.96Å; T530-Y540 PolarHBondContact OG1-OH 2.93Å; V538-Y540 HydrophobicContact CB-CE2 4.39Å; V538-Y540 HydrophobicContact CG1-CD2 4.26Å; V538-Y540 HydrophobicContact CG1-CE1 4.37Å; V538-Y540 HydrophobicContact CG1-CE2 3.72Å; Y540-I552 VanDerWaalsContact CB-CD1 3.48Å; Y540-I552 HydrophobicContact CD1-CD1 4.43Å; Y540-I552 HydrophobicContact CG-CD1 4.24Å; Y540-Q554 HydrophobicContact CD2-CG 3.93Å; Y540-Q554 HydrophobicContact CE2-CG 4.35Å; Y540-N557 PolarHBondContact OH-O 2.96Å; Y540-V577 HydrophobicContact CD1-CG1 4.03Å; Y540-N578 WeakPolarHBondContact CA-O 3.46Å; Y540-I579 HydrophobicContact CD1-CB 4.45Å; Y540-I579 HydrophobicContact CD1-CD1 4.29Å; Y540-I579 HydrophobicContact CD1-CG1 3.8Å; Y540-I579 HydrophobicContact CD1-CG2 4.16Å; Y540-I579 HydrophobicContact CE1-CB 4.47Å; Y540-I579 HydrophobicContact CE1-CD1 3.98Å; Y540-I579 HydrophobicContact CE1-CG1 3.92Å; Y540-I579 HydrophobicContact CE1-CG2 3.83Å
541	N	90.3	Very high	81.9	Confident	81 Å²	81	69.5 Å²	69.5	43%	0.433	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	127	-179.7	-64.8	-66.8	0	0	0	111.7	V577 N578	N541-V577 CarbonylContact O-C 3.58Å; N541-V577 WeakPolarHBondContact O-CA 2.94Å; N541-N578 HydrophobicContact CB-CB 4.49Å; N541-N578 PolarHBondContact N-O 3.17Å; N541-N578 PolarHBondContact O-N 2.98Å
542	L	91.3	Very high	82.7	Confident	10 Å²	10	64.2 Å²	64.2	5%	0.052	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	145	172.6	-76.1	163.9	0	0	0	111.4	Q547 F550 R551 I552 I575 V577	L542-Q547 HydrophobicContact CB-CG 3.99Å; L542-Q547 PolarHBondContact O-NE2 3.26Å; L542-F550 HydrophobicContact CD1-CB 3.98Å; L542-R551 VanDerWaalsContact CD1-C 3.48Å; L542-I552 HydrophobicContact CD1-CB 3.89Å; L542-I552 HydrophobicContact CD1-CG2 4.17Å; L542-I552 HydrophobicContact CG-CB 4.02Å; L542-I552 HydrophobicContact CG-CG2 4.08Å; L542-I575 HydrophobicContact CD2-CD1 4.05Å; L542-V577 HydrophobicContact CD2-CG2 3.71Å
543	D	89.9	Confident	84	Confident	32 Å²	32	62.4 Å²	62.4	17%	0.171	32%	0.322	C	S	.	.			trans	-69.5	170.7	168.2	77.4	-43.1	0	0	0	112.6	V545 G546 Q547 K576	D543-V545 PolarHBondContact O-N 2.82Å; D543-V545 WeakPolarHBondContact OD2-CB 3.13Å; D543-G546 PolarHBondContact O-N 3.4Å; D543-G546 VanDerWaalsContact O-N 3.15Å; D543-G546 PolarHBondContact OD1-N 2.88Å; D543-Q547 WeakPolarHBondContact O-CG 3.34Å; D543-Q547 PolarHBondContact O-N 2.84Å; D543-K576 HydrophobicContact CB-CB 3.97Å; D543-K576 PolarHBondContact N-O 2.78Å; D543-K576 PolarHBondContact OD1-N 2.88Å
544	Y	84.6	Confident	85.1	Confident	173 Å²	173	62.7 Å²	62.7	68%	0.678	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-30.9	-176.5	-176	-101.9	0	0	0	113.1
545	V	83.1	Confident	86	Confident	54 Å²	54	61.1 Å²	61.1	33%	0.327	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-48.7	175.4	-177.3	0	0	0	0	109.8	D543 Q547 R548	D543-V545 PolarHBondContact O-N 2.82Å; D543-V545 WeakPolarHBondContact OD2-CB 3.13Å; V545-Q547 VanDerWaalsContact C-N 3.27Å; V545-Q547 PolarHBondContact O-N 3.08Å; V545-R548 WeakPolarHBondContact O-CB 3.45Å; V545-R548 WeakPolarHBondContact O-CG 3.39Å; V545-R548 PolarHBondContact O-N 3.4Å; V545-R548 VanDerWaalsContact O-N 3.1Å
546	G	80.6	Confident	87.1	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-57.1	-36.8	176.1	0	0	0	0	0	113.9	D543 R548 F550 I575	D543-G546 PolarHBondContact O-N 3.4Å; D543-G546 VanDerWaalsContact O-N 3.15Å; D543-G546 PolarHBondContact OD1-N 2.88Å; G546-R548 PolarHBondContact O-N 2.87Å; G546-R548 VanDerWaalsContact O-N 3.13Å; G546-F550 WeakPolarHBondContact O-CA 3.31Å; G546-F550 WeakPolarHBondContact O-CB 3.28Å; G546-F550 WeakPolarHBondContact O-CD2 3.05Å; G546-F550 PolarHBondContact O-N 2.89Å; G546-I575 VanDerWaalsContact CA-CG2 3.49Å
547	Q	87.1	Confident	87.7	Confident	116 Å²	116	66.7 Å²	66.7	54%	0.542	30%	0.303	S	S	.	.	H	α-helix	trans	-67.7	-10.7	178.9	-69.1	175.1	16.6	0	0	114.7	L542 D543 V545	L542-Q547 HydrophobicContact CB-CG 3.99Å; L542-Q547 PolarHBondContact O-NE2 3.26Å; D543-Q547 WeakPolarHBondContact O-CG 3.34Å; D543-Q547 PolarHBondContact O-N 2.84Å; V545-Q547 VanDerWaalsContact C-N 3.27Å; V545-Q547 PolarHBondContact O-N 3.08Å
548	R	87.4	Confident	87.9	Confident	133 Å²	133	66.2 Å²	66.2	50%	0.502	30%	0.297	S	S	.	.	H	α-helix	trans	-67.2	-51.5	179.5	-69.3	-178	173.7	-167.4	-2.2	111.8	V545 G546 K565	V545-R548 WeakPolarHBondContact O-CB 3.45Å; V545-R548 WeakPolarHBondContact O-CG 3.39Å; V545-R548 PolarHBondContact O-N 3.4Å; V545-R548 VanDerWaalsContact O-N 3.1Å; G546-R548 PolarHBondContact O-N 2.87Å; G546-R548 VanDerWaalsContact O-N 3.13Å; R548-K565 VanDerWaalsContact O-CD 3.31Å; R548-K565 WeakPolarHBondContact O-CD 3.4Å; R548-K565 PolarHBondContact O-NZ 3.27Å
549	H	87.1	Confident	87.9	Confident	39 Å²	39	66.2 Å²	66.2	18%	0.181	30%	0.297	C	S	.	.	H	α-helix	trans	-114.7	-16.9	-174.3	-55.3	108.4	0	0	0	113.2	L563 V564 K565 P566 I567 E573	H549-L563 HydrophobicContact CB-CD1 3.92Å; H549-V564 VanDerWaalsContact O-CG2 3.32Å; H549-V564 WeakPolarHBondContact O-CG2 3.34Å; H549-V564 PolarHBondContact O-N 3.48Å; H549-K565 PolarHBondContact O-N 3.46Å; H549-K565 VanDerWaalsContact O-N 3.11Å; H549-P566 PolarHBondContact CD2-O 3.02Å; H549-I567 HydrophobicContact CB-CD1 4.16Å; H549-I567 HydrophobicContact CB-CG1 3.86Å; H549-E573 IonicContact CE1-OE1 3.33Å; H549-E573 PolarHBondContact CE1-OE1 2.82Å; H549-E573 IonicContact CE1-OE2 2.9Å; H549-E573 IonicContact CG-OE2 2.94Å; H549-E573 IonicContact ND1-OE1 3.9Å; H549-E573 PolarHBondContact ND1-OE1 2.04Å; H549-E573 VanDerWaalsContact ND1-OE1 3.13Å; H549-E573 IonicContact ND1-OE2 2.75Å; H549-E573 PolarHBondContact ND1-OE2 3.01Å
550	F	90.8	Very high	87.9	Confident	6 Å²	6	64.4 Å²	64.4	3%	0.026	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	155.1	-173.2	-50	-90.9	0	0	0	112.3	V525 L542 G546 V561 Q562 L563 I567 I575 I598	V525-F550 HydrophobicContact CB-CE1 4.48Å; V525-F550 HydrophobicContact CG2-CD1 4.35Å; V525-F550 HydrophobicContact CG2-CE1 4Å; L542-F550 HydrophobicContact CD1-CB 3.98Å; G546-F550 WeakPolarHBondContact O-CA 3.31Å; G546-F550 WeakPolarHBondContact O-CB 3.28Å; G546-F550 WeakPolarHBondContact O-CD2 3.05Å; G546-F550 PolarHBondContact O-N 2.89Å; F550-V561 HydrophobicContact CB-CG1 4Å; F550-V561 HydrophobicContact CD1-CG1 3.96Å; F550-V561 HydrophobicContact CG-CG1 4.2Å; F550-Q562 CarbonylContact C-O 3.24Å; F550-Q562 WeakPolarHBondContact CA-O 3.43Å; F550-L563 HydrophobicContact CD1-CB 4.08Å; F550-L563 HydrophobicContact CD1-CD1 3.75Å; F550-L563 HydrophobicContact CE1-CB 4.02Å; F550-L563 HydrophobicContact CE1-CD1 3.26Å; F550-L563 HydrophobicContact CE1-CG 4.23Å; F550-L563 HydrophobicContact CE2-CD1 4.32Å; F550-L563 HydrophobicContact CG-CD1 4.45Å; F550-L563 HydrophobicContact CZ-CD1 3.58Å; F550-I567 HydrophobicContact CE1-CD1 4.37Å; F550-I567 HydrophobicContact CE2-CD1 3.86Å; F550-I567 HydrophobicContact CZ-CD1 3.41Å; F550-I567 VanDerWaalsContact CZ-CD1 3.41Å; F550-I575 HydrophobicContact CD2-CD1 4.15Å; F550-I575 HydrophobicContact CD2-CG2 4.08Å; F550-I575 HydrophobicContact CE2-CD1 4.43Å; F550-I575 HydrophobicContact CE2-CG2 4.03Å; F550-I575 HydrophobicContact CG-CD1 4.25Å; F550-I598 HydrophobicContact CD1-CD1 4.35Å; F550-I598 HydrophobicContact CE1-CD1 3.41Å; F550-I598 VanDerWaalsContact CE1-CD1 3.41Å; F550-I598 HydrophobicContact CE2-CD1 3.83Å; F550-I598 HydrophobicContact CZ-CD1 3.1Å; F550-I598 HydrophobicContact CZ-CG1 4.39Å; F550-I598 HydrophobicContact CZ-CG2 4.44Å
551	R	92.9	Very high	87.8	Confident	119 Å²	119	64 Å²	64	45%	0.449	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	157.1	162	71.2	176.6	-175.6	176.8	9.4	109	L542 Q562 V564	L542-R551 VanDerWaalsContact CD1-C 3.48Å; R551-Q562 HydrophobicContact CG-CB 4.04Å; R551-Q562 VanDerWaalsContact CZ-OE1 3.28Å; R551-Q562 PolarHBondContact N-O 2.01Å; R551-Q562 PolarHBondContact O-N 3.17Å; R551-V564 HydrophobicContact CB-CG1 4.46Å; R551-V564 HydrophobicContact CB-CG2 4.45Å; R551-V564 HydrophobicContact CG-CG1 3.68Å
552	I	92.2	Very high	87.8	Confident	40 Å²	40	61.6 Å²	61.6	21%	0.205	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	127.3	172.8	-168.7	153.9	0	0	0	109.5	Y540 L542 I560 V561 V577	Y540-I552 VanDerWaalsContact CB-CD1 3.48Å; Y540-I552 HydrophobicContact CD1-CD1 4.43Å; Y540-I552 HydrophobicContact CG-CD1 4.24Å; L542-I552 HydrophobicContact CD1-CB 3.89Å; L542-I552 HydrophobicContact CD1-CG2 4.17Å; L542-I552 HydrophobicContact CG-CB 4.02Å; L542-I552 HydrophobicContact CG-CG2 4.08Å; I552-I560 CarbonylContact C-O 3.14Å; I552-I560 WeakPolarHBondContact CA-O 3.5Å; I552-V561 HydrophobicContact CD1-CG2 4Å; I552-V561 HydrophobicContact CG1-CG2 4.43Å; I552-V577 HydrophobicContact CD1-CG1 3.5Å; I552-V577 VanDerWaalsContact CD1-CG1 3.5Å; I552-V577 HydrophobicContact CD1-CG2 4.23Å
553	V	93	Very high	87.5	Confident	46 Å²	46	61.3 Å²	61.3	28%	0.279	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	130.2	174.9	179.1	0	0	0	0	107.4	I560	V553-I560 HydrophobicContact CB-CB 4.46Å; V553-I560 PolarHBondContact N-O 3.07Å; V553-I560 WeakPolarHBondContact O-CB 3.47Å; V553-I560 PolarHBondContact O-N 3.29Å
554	Q	88.7	Confident	87.4	Confident	82 Å²	82	61.9 Å²	61.9	38%	0.383	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	126.9	-178.4	-177.5	176.8	-39.4	0	0	111.4	V538 Y540 R556 I558	V538-Q554 VanDerWaalsContact O-CD 3.32Å; V538-Q554 PolarHBondContact O-NE2 2.78Å; V538-Q554 PolarHBondContact O-OE1 2.91Å; Y540-Q554 HydrophobicContact CD2-CG 3.93Å; Y540-Q554 HydrophobicContact CE2-CG 4.35Å; Q554-R556 PolarHBondContact NE2-O 2.76Å; Q554-I558 WeakPolarHBondContact CA-O 3.02Å
555	E	86.1	Confident	87.5	Confident	101 Å²	101	59.1 Å²	59.1	47%	0.472	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	98.7	172.7	-69.1	-175.6	-179.9	0	0	109.4	R527 N557 I558 I560	R527-E555 IonicContact NH1-OE2 3.3Å; E555-N557 PolarHBondContact O-N 2.98Å; E555-I558 HydrophobicContact CB-CB 4.49Å; E555-I558 PolarHBondContact N-O 2.9Å; E555-I558 WeakPolarHBondContact O-CB 3.5Å; E555-I558 PolarHBondContact O-N 3.22Å; E555-I560 HydrophobicContact CB-CD1 4.49Å; E555-I560 VanDerWaalsContact CD-CD1 3.45Å; E555-I560 HydrophobicContact CG-CD1 3.92Å
556	R	84.2	Confident	87.4	Confident	230 Å²	230	58.7 Å²	58.7	87%	0.868	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	-107.3	-176	-56.9	177.2	179.8	176.5	0.5	111.7	Q554	Q554-R556 PolarHBondContact NE2-O 2.76Å
557	N	84.1	Confident	87.4	Confident	42 Å²	42	59.8 Å²	59.8	23%	0.225	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	16.5	179	67.9	-48.2	0	0	0	112.6	T530 M532 Y540 E555	T530-N557 PolarHBondContact N-O 3.43Å; T530-N557 PolarHBondContact O-ND2 3.32Å; M532-N557 HydrophobicContact CE-CB 3.64Å; M532-N557 HydrophobicContact SD-CB 4.32Å; Y540-N557 PolarHBondContact OH-O 2.96Å; E555-N557 PolarHBondContact O-N 2.98Å
558	I	85	Confident	86.9	Confident	36 Å²	36	59.1 Å²	59.1	19%	0.185	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	127	-178.4	-51.1	-179.8	0	0	0	109.4	R527 I528 V529 Q554 E555 I560	R527-I558 HydrophobicContact CG-CG2 3.4Å; R527-I558 VanDerWaalsContact CG-CG2 3.4Å; I528-I558 CarbonylContact O-C 3.51Å; I528-I558 VanDerWaalsContact O-CA 3.32Å; I528-I558 WeakPolarHBondContact O-CA 3.47Å; V529-I558 HydrophobicContact CG1-CG1 4.48Å; V529-I558 HydrophobicContact CG2-CD1 4.46Å; V529-I558 HydrophobicContact CG2-CG1 4.18Å; V529-I558 HydrophobicContact CG2-CG2 4.24Å; Q554-I558 WeakPolarHBondContact CA-O 3.02Å; E555-I558 HydrophobicContact CB-CB 4.49Å; E555-I558 PolarHBondContact N-O 2.9Å; E555-I558 WeakPolarHBondContact O-CB 3.5Å; E555-I558 PolarHBondContact O-N 3.22Å; I558-I560 HydrophobicContact CG2-CG1 4.07Å
559	G	87.8	Confident	86	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	116.2	169.6	0	0	0	0	0	110.3	I528	I528-G559 PolarHBondContact N-O 3.28Å; I528-G559 PolarHBondContact O-N 3.08Å
560	I	88.6	Confident	85.6	Confident	4 Å²	4	56.8 Å²	56.8	2%	0.021	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	113.1	-178.8	-54.5	174.7	0	0	0	108.7	E524 I552 V553 E555 I558 Q562	E524-I560 HydrophobicContact CB-CG2 4.3Å; E524-I560 HydrophobicContact CG-CG2 3.65Å; E524-I560 WeakPolarHBondContact OE2-CG2 3.44Å; I552-I560 CarbonylContact C-O 3.14Å; I552-I560 WeakPolarHBondContact CA-O 3.5Å; V553-I560 HydrophobicContact CB-CB 4.46Å; V553-I560 PolarHBondContact N-O 3.07Å; V553-I560 WeakPolarHBondContact O-CB 3.47Å; V553-I560 PolarHBondContact O-N 3.29Å; E555-I560 HydrophobicContact CB-CD1 4.49Å; E555-I560 VanDerWaalsContact CD-CD1 3.45Å; E555-I560 HydrophobicContact CG-CD1 3.92Å; I558-I560 HydrophobicContact CG2-CG1 4.07Å; I560-Q562 HydrophobicContact CG2-CG 4.05Å
561	V	89.4	Confident	85.3	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	119.4	177.6	-176.8	0	0	0	0	109	V525 S526 I528 F550 I552 I575 V577 I596	V525-V561 PolarHBondContact N-O 3.24Å; S526-V561 PolarHBondContact N-O 2.81Å; S526-V561 PolarHBondContact O-N 3.03Å; I528-V561 HydrophobicContact CD1-CG2 4.46Å; F550-V561 HydrophobicContact CB-CG1 4Å; F550-V561 HydrophobicContact CD1-CG1 3.96Å; F550-V561 HydrophobicContact CG-CG1 4.2Å; I552-V561 HydrophobicContact CD1-CG2 4Å; I552-V561 HydrophobicContact CG1-CG2 4.43Å; V561-I575 HydrophobicContact CG1-CD1 3.9Å; V561-V577 HydrophobicContact CG2-CG2 4.12Å; V561-I596 HydrophobicContact CB-CD1 4.47Å; V561-I596 HydrophobicContact CG2-CD1 3.82Å
562	Q	89.2	Confident	84.9	Confident	30 Å²	30	58 Å²	58	14%	0.14	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	129.7	-177.6	-63.7	-177.7	-25.1	0	0	111.4	P522 I523 F550 R551 I560	P522-Q562 HydrophobicContact CB-CB 4.03Å; P522-Q562 HydrophobicContact CB-CG 4.46Å; I523-Q562 CarbonylContact O-C 3.37Å; I523-Q562 WeakPolarHBondContact O-CA 3.49Å; F550-Q562 CarbonylContact C-O 3.24Å; F550-Q562 WeakPolarHBondContact CA-O 3.43Å; R551-Q562 HydrophobicContact CG-CB 4.04Å; R551-Q562 VanDerWaalsContact CZ-OE1 3.28Å; R551-Q562 PolarHBondContact N-O 2.01Å; R551-Q562 PolarHBondContact O-N 3.17Å; I560-Q562 HydrophobicContact CG2-CG 4.05Å
563	L	86.5	Confident	84.5	Confident	4 Å²	4	57.5 Å²	57.5	2%	0.021	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	122.8	169.6	-172.1	75.5	0	0	0	109	V513 I519 P522 I523 V525 H549 F550 K565 I567	V513-L563 HydrophobicContact CG1-CD2 3.69Å; I519-L563 HydrophobicContact CD1-CB 4.24Å; I519-L563 HydrophobicContact CD1-CD2 3.48Å; I519-L563 VanDerWaalsContact CD1-CD2 3.48Å; I519-L563 HydrophobicContact CD1-CG 3.43Å; I519-L563 VanDerWaalsContact CD1-CG 3.43Å; P522-L563 WeakPolarHBondContact CA-O 3.43Å; I523-L563 HydrophobicContact CB-CB 4.32Å; I523-L563 PolarHBondContact N-O 3.47Å; I523-L563 PolarHBondContact O-N 3.17Å; V525-L563 HydrophobicContact CG2-CB 3.64Å; H549-L563 HydrophobicContact CB-CD1 3.92Å; F550-L563 HydrophobicContact CD1-CB 4.08Å; F550-L563 HydrophobicContact CD1-CD1 3.75Å; F550-L563 HydrophobicContact CE1-CB 4.02Å; F550-L563 HydrophobicContact CE1-CD1 3.26Å; F550-L563 HydrophobicContact CE1-CG 4.23Å; F550-L563 HydrophobicContact CE2-CD1 4.32Å; F550-L563 HydrophobicContact CG-CD1 4.45Å; F550-L563 HydrophobicContact CZ-CD1 3.58Å; L563-K565 VanDerWaalsContact CD1-O 3.25Å; L563-K565 WeakPolarHBondContact CD1-O 3.48Å; L563-K565 WeakPolarHBondContact CG-O 3.5Å; L563-I567 HydrophobicContact CD1-CD1 3.68Å; L563-I567 HydrophobicContact CD1-CG1 3.98Å
564	V	87.5	Confident	84.3	Confident	45 Å²	45	58.1 Å²	58.1	27%	0.273	31%	0.313	S	S	.	.			trans	-121.7	-13.9	-177.9	-69.8	0	0	0	0	113.2	P522 H549 R551	P522-V564 HydrophobicContact CB-CG1 3.91Å; P522-V564 HydrophobicContact CG-CG1 4.11Å; H549-V564 VanDerWaalsContact O-CG2 3.32Å; H549-V564 WeakPolarHBondContact O-CG2 3.34Å; H549-V564 PolarHBondContact O-N 3.48Å; R551-V564 HydrophobicContact CB-CG1 4.46Å; R551-V564 HydrophobicContact CB-CG2 4.45Å; R551-V564 HydrophobicContact CG-CG1 3.68Å
565	K	85.9	Confident	84.4	Confident	114 Å²	114	54.2 Å²	54.2	50%	0.496	30%	0.295	S	S	.	.	S	Bend	trans	-129.3	145.1	168.7	-54.1	-173.8	-161.7	142.9	0	110	I519 R548 H549 L563	I519-K565 WeakPolarHBondContact CD1-O 3.44Å; R548-K565 VanDerWaalsContact O-CD 3.31Å; R548-K565 WeakPolarHBondContact O-CD 3.4Å; R548-K565 PolarHBondContact O-NZ 3.27Å; H549-K565 PolarHBondContact O-N 3.46Å; H549-K565 VanDerWaalsContact O-N 3.11Å; L563-K565 VanDerWaalsContact CD1-O 3.25Å; L563-K565 WeakPolarHBondContact CD1-O 3.48Å; L563-K565 WeakPolarHBondContact CG-O 3.5Å
566	P	80.3	Confident	84.6	Confident	45 Å²	45	53.1 Å²	53.1	29%	0.292	29%	0.288	S	S	.	.			trans	-67.4	145.9	-178.1	29.3	-35.3	0	0	0	111	I519 H549	I519-P566 HydrophobicContact CG1-CB 4.46Å; H549-P566 PolarHBondContact CD2-O 3.02Å
567	I	81.3	Confident	84.9	Confident	24 Å²	24	42.1 Å²	42.1	12%	0.123	25%	0.247	C	C	.	.			trans	-103.5	121.6	172.2	-61.1	167.5	0	0	0	107.5	H549 F550 L563 G569 T571 V600	H549-I567 HydrophobicContact CB-CD1 4.16Å; H549-I567 HydrophobicContact CB-CG1 3.86Å; F550-I567 HydrophobicContact CE1-CD1 4.37Å; F550-I567 HydrophobicContact CE2-CD1 3.86Å; F550-I567 HydrophobicContact CZ-CD1 3.41Å; F550-I567 VanDerWaalsContact CZ-CD1 3.41Å; L563-I567 HydrophobicContact CD1-CD1 3.68Å; L563-I567 HydrophobicContact CD1-CG1 3.98Å; I567-G569 PolarHBondContact O-N 3.45Å; I567-T571 WeakPolarHBondContact CG2-OG1 3.46Å; I567-V600 HydrophobicContact CB-CG2 3.94Å; I567-V600 HydrophobicContact CD1-CG2 4.42Å; I567-V600 HydrophobicContact CG2-CB 4.37Å; I567-V600 HydrophobicContact CG2-CG2 3.61Å
568	S	76	Confident	85.3	Confident	102 Å²	102	42.8 Å²	42.8	71%	0.713	25%	0.25	S	S	*	.			trans	-78.2	115.7	175.8	-62.7	0	0	0	0	109.5	T571	S568-T571 WeakPolarHBondContact O-CG2 2.88Å; S568-T571 PolarHBondContact O-OG1 3.36Å
569	G	69	Low	85.5	Confident	40 Å²	40	41.5 Å²	41.5	41%	0.412	24%	0.244	S	C	.	.	S	Bend	trans	-81.6	170.5	176.2	0	0	0	0	0	113.7	I567	I567-G569 PolarHBondContact O-N 3.45Å
570	P	78.9	Confident	85.6	Confident	83 Å²	83	43.7 Å²	43.7	54%	0.539	25%	0.254	S	S	.	.	S	Bend	cis	-82.2	124.2	-7.4	30.1	-30.5	0	0	0	112.1	V600 K602	P570-V600 WeakPolarHBondContact CA-O 3.48Å; P570-K602 HydrophobicContact CB-CB 3.87Å; P570-K602 HydrophobicContact CB-CG 4.39Å; P570-K602 HydrophobicContact CG-CB 4.07Å; P570-K602 HydrophobicContact CG-CD 4.39Å; P570-K602 HydrophobicContact CG-CG 4.03Å
571	T	84.1	Confident	85.5	Confident	57 Å²	57	44.1 Å²	44.1	35%	0.35	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	157.9	-177.5	50.4	0	0	0	0	110.7	I567 S568 V600	I567-T571 WeakPolarHBondContact CG2-OG1 3.46Å; S568-T571 WeakPolarHBondContact O-CG2 2.88Å; S568-T571 PolarHBondContact O-OG1 3.36Å; T571-V600 PolarHBondContact N-O 3.48Å; T571-V600 PolarHBondContact O-N 3.22Å
572	V	85.1	Confident	85.3	Confident	93 Å²	93	46.7 Å²	46.7	56%	0.564	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.1	123.1	169.4	-179.9	0	0	0	0	107.1	I598	V572-I598 CarbonylContact C-O 3.47Å; V572-I598 WeakPolarHBondContact CA-O 3.46Å
573	E	84.1	Confident	85	Confident	30 Å²	30	46.2 Å²	46.2	14%	0.14	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	127.7	173.2	-63.1	-153.9	156.6	0	0	109.8	H549 I598	H549-E573 IonicContact CE1-OE1 3.33Å; H549-E573 PolarHBondContact CE1-OE1 2.82Å; H549-E573 IonicContact CE1-OE2 2.9Å; H549-E573 IonicContact CG-OE2 2.94Å; H549-E573 IonicContact ND1-OE1 3.9Å; H549-E573 PolarHBondContact ND1-OE1 2.04Å; H549-E573 VanDerWaalsContact ND1-OE1 3.13Å; H549-E573 IonicContact ND1-OE2 2.75Å; H549-E573 PolarHBondContact ND1-OE2 3.01Å; E573-I598 PolarHBondContact N-O 3.15Å; E573-I598 PolarHBondContact O-N 3.23Å
574	T	88.8	Confident	84.6	Confident	59 Å²	59	55.6 Å²	55.6	36%	0.362	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	118.7	171.6	-52	0	0	0	0	107.8	I595 I596 E597	T574-I595 HydrophobicContact CG2-CG2 3.63Å; T574-I596 WeakPolarHBondContact CA-O 3.45Å; T574-E597 HydrophobicContact CG2-CG 4.04Å
575	I	90.6	Very high	84.3	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	147.7	178.9	68.3	173.7	0	0	0	109.8	L542 G546 F550 V561 I596 I598	L542-I575 HydrophobicContact CD2-CD1 4.05Å; G546-I575 VanDerWaalsContact CA-CG2 3.49Å; F550-I575 HydrophobicContact CD2-CD1 4.15Å; F550-I575 HydrophobicContact CD2-CG2 4.08Å; F550-I575 HydrophobicContact CE2-CD1 4.43Å; F550-I575 HydrophobicContact CE2-CG2 4.03Å; F550-I575 HydrophobicContact CG-CD1 4.25Å; V561-I575 HydrophobicContact CG1-CD1 3.9Å; I575-I596 HydrophobicContact CD1-CB 4.1Å; I575-I596 HydrophobicContact CD1-CD1 4.08Å; I575-I596 HydrophobicContact CD1-CG2 4.44Å; I575-I596 HydrophobicContact CG1-CB 3.65Å; I575-I596 HydrophobicContact CG1-CD1 4.33Å; I575-I596 HydrophobicContact CG1-CG1 4.42Å; I575-I596 HydrophobicContact CG1-CG2 4.35Å; I575-I596 PolarHBondContact N-O 3.08Å; I575-I596 PolarHBondContact O-N 2.73Å; I575-I598 HydrophobicContact CD1-CD1 3.93Å; I575-I598 HydrophobicContact CG1-CD1 4.43Å
576	K	90.9	Very high	84	Confident	77 Å²	77	55.9 Å²	55.9	34%	0.335	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	127.7	-179.8	-74.3	159.5	165.8	-95.8	0	109.7	D543 E593 A594 I595	D543-K576 HydrophobicContact CB-CB 3.97Å; D543-K576 PolarHBondContact N-O 2.78Å; D543-K576 PolarHBondContact OD1-N 2.88Å; K576-E593 HydrophobicContact CB-CG 4.22Å; K576-E593 WeakPolarHBondContact CD-OE2 3.42Å; K576-E593 HydrophobicContact CG-CG 4.29Å; K576-E593 IonicContact NZ-OE1 2.73Å; K576-E593 PolarHBondContact NZ-OE1 3.29Å; K576-E593 IonicContact NZ-OE2 2.93Å; K576-E593 PolarHBondContact NZ-OE2 3.32Å; K576-A594 WeakPolarHBondContact CA-O 3.36Å; K576-I595 HydrophobicContact CG-CG1 4.41Å
577	V	90.8	Very high	84.2	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	111.6	172.8	-176.1	0	0	0	0	108.2	I528 Y540 N541 L542 I552 V561 I579 E593 A594 I596	I528-V577 HydrophobicContact CD1-CB 3.82Å; I528-V577 HydrophobicContact CD1-CG1 3.88Å; I528-V577 HydrophobicContact CD1-CG2 3.73Å; Y540-V577 HydrophobicContact CD1-CG1 4.03Å; N541-V577 CarbonylContact O-C 3.58Å; N541-V577 WeakPolarHBondContact O-CA 2.94Å; L542-V577 HydrophobicContact CD2-CG2 3.71Å; I552-V577 HydrophobicContact CD1-CG1 3.5Å; I552-V577 VanDerWaalsContact CD1-CG1 3.5Å; I552-V577 HydrophobicContact CD1-CG2 4.23Å; V561-V577 HydrophobicContact CG2-CG2 4.12Å; V577-I579 HydrophobicContact CG1-CG1 4.25Å; V577-E593 WeakPolarHBondContact O-CA 3.49Å; V577-A594 HydrophobicContact CB-CB 4.3Å; V577-A594 PolarHBondContact N-O 2.93Å; V577-A594 PolarHBondContact O-N 3.44Å; V577-I596 HydrophobicContact CG2-CD1 4.07Å
578	N	90.8	Very high	84.3	Confident	55 Å²	55	59.8 Å²	59.8	29%	0.294	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	125.3	173.2	-61.3	-73.6	0	0	0	109.2	Y540 N541	Y540-N578 WeakPolarHBondContact CA-O 3.46Å; N541-N578 HydrophobicContact CB-CB 4.49Å; N541-N578 PolarHBondContact N-O 3.17Å; N541-N578 PolarHBondContact O-N 2.98Å
579	I	90.1	Very high	84.6	Confident	10 Å²	10	59.8 Å²	59.8	5%	0.051	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	110.8	-174.8	-49.9	174.4	0	0	0	108.2	I528 V538 D539 Y540 V577 N592 A594	I528-I579 HydrophobicContact CG2-CD1 3.88Å; V538-I579 HydrophobicContact CG1-CG2 3.5Å; V538-I579 VanDerWaalsContact CG1-CG2 3.5Å; D539-I579 WeakPolarHBondContact O-CA 3.33Å; Y540-I579 HydrophobicContact CD1-CB 4.45Å; Y540-I579 HydrophobicContact CD1-CD1 4.29Å; Y540-I579 HydrophobicContact CD1-CG1 3.8Å; Y540-I579 HydrophobicContact CD1-CG2 4.16Å; Y540-I579 HydrophobicContact CE1-CB 4.47Å; Y540-I579 HydrophobicContact CE1-CD1 3.98Å; Y540-I579 HydrophobicContact CE1-CG1 3.92Å; Y540-I579 HydrophobicContact CE1-CG2 3.83Å; V577-I579 HydrophobicContact CG1-CG1 4.25Å; I579-N592 HydrophobicContact CB-CB 4.2Å; I579-N592 WeakPolarHBondContact CB-O 3.44Å; I579-N592 PolarHBondContact N-O 3.36Å; I579-N592 PolarHBondContact O-N 2.97Å; I579-A594 HydrophobicContact CD1-CB 4.08Å
580	H	89.5	Confident	85.1	Confident	45 Å²	45	59.6 Å²	59.6	21%	0.208	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	114.9	-179.9	-63.9	173.9	0	0	0	109.8	V538 D539 I588 F591	V538-H580 CarbonylContact C-O 3.6Å; V538-H580 VanDerWaalsContact CA-O 3.31Å; V538-H580 WeakPolarHBondContact CA-O 3.3Å; D539-H580 PolarHBondContact N-O 3.04Å; D539-H580 PolarHBondContact O-N 3.07Å; H580-I588 HydrophobicContact CB-CG2 4.22Å; H580-F591 AromaticContact CD2-CD1 3.36Å; H580-F591 WeakPolarHBondContact CD2-CD1 3.44Å; H580-F591 AromaticContact CD2-CE1 3.72Å; H580-F591 AromaticContact CE1-CE1 3.9Å; H580-F591 AromaticContact NE2-CD1 3.42Å; H580-F591 WeakPolarHBondContact NE2-CD1 3.28Å; H580-F591 AromaticContact NE2-CE1 3.57Å
581	T	86.1	Confident	85.4	Confident	14 Å²	14	62.2 Å²	62.2	9%	0.086	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	129.5	175.4	-58.1	0	0	0	0	109.5	P535 V538 I588 L589 A590	P535-T581 HydrophobicContact CB-CG2 3.37Å; P535-T581 HydrophobicContact CG-CG2 3.3Å; V538-T581 HydrophobicContact CG2-CG2 4.34Å; T581-I588 CarbonylContact O-C 3.58Å; T581-I588 WeakPolarHBondContact O-CA 3.42Å; T581-L589 PolarHBondContact O-N 3.08Å; T581-A590 PolarHBondContact N-O 3.16Å; T581-A590 PolarHBondContact O-N 2.85Å
582	K	84.9	Confident	85.4	Confident	53 Å²	53	63.6 Å²	63.6	23%	0.23	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	147.2	-172.8	-69.8	178.1	173.3	176.6	0	113.8	P535 F536 S537 D539 V587 I588	P535-K582 WeakPolarHBondContact CB-O 3.29Å; F536-K582 PolarHBondContact N-O 2.87Å; F536-K582 VanDerWaalsContact N-O 3.08Å; S537-K582 PolarHBondContact N-O 2.71Å; S537-K582 PolarHBondContact O-N 3.05Å; D539-K582 WeakPolarHBondContact OD2-CD 2.97Å; D539-K582 WeakPolarHBondContact OD2-CE 3.48Å; D539-K582 IonicContact OD2-NZ 3.18Å; D539-K582 PolarHBondContact OD2-NZ 2.74Å; K582-V587 CarbonylContact C-O 3.54Å; K582-V587 VanDerWaalsContact CA-O 3.28Å; K582-V587 WeakPolarHBondContact CA-O 3.39Å; K582-I588 HydrophobicContact CG-CG1 4.2Å
583	S	82.9	Confident	85.5	Confident	20 Å²	20	63.4 Å²	63.4	14%	0.14	33%	0.331	C	S	.	.			trans	-74.2	174.1	170.7	79.7	0	0	0	0	111.8	T585 G586 V587	S583-T585 PolarHBondContact O-N 2.95Å; S583-T585 VanDerWaalsContact O-N 3.17Å; S583-T585 PolarHBondContact OG-N 3.19Å; S583-T585 PolarHBondContact OG-OG1 3.27Å; S583-G586 PolarHBondContact O-N 2.58Å; S583-G586 PolarHBondContact OG-N 2.79Å; S583-V587 PolarHBondContact N-O 3.47Å; S583-V587 PolarHBondContact OG-N 2.96Å
584	R	78.6	Confident	85.5	Confident	202 Å²	202	63 Å²	63	76%	0.762	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-26.8	174.9	-152.2	176	-174.5	169.3	-0.6	113	F536 G586	F536-R584 HydrophobicContact CB-CB 4.32Å; F536-R584 HydrophobicContact CB-CG 4.48Å; F536-R584 HydrophobicContact CD1-CB 3.93Å; F536-R584 HydrophobicContact CD1-CG 3.63Å; F536-R584 HydrophobicContact CD2-CB 3.42Å; F536-R584 VanDerWaalsContact CD2-CB 3.42Å; F536-R584 HydrophobicContact CD2-CG 4.1Å; F536-R584 HydrophobicContact CE1-CB 4.05Å; F536-R584 HydrophobicContact CE1-CG 3.76Å; F536-R584 HydrophobicContact CE2-CB 3.55Å; F536-R584 HydrophobicContact CE2-CG 4.21Å; F536-R584 HydrophobicContact CG-CB 3.61Å; F536-R584 HydrophobicContact CG-CG 3.8Å; F536-R584 HydrophobicContact CZ-CB 3.86Å; F536-R584 HydrophobicContact CZ-CG 4.03Å; R584-G586 VanDerWaalsContact C-N 3.32Å
585	T	81.1	Confident	85.3	Confident	122 Å²	122	64.7 Å²	64.7	75%	0.748	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	6.1	179.8	56	0	0	0	0	112.3	S583 V587	S583-T585 PolarHBondContact O-N 2.95Å; S583-T585 VanDerWaalsContact O-N 3.17Å; S583-T585 PolarHBondContact OG-N 3.19Å; S583-T585 PolarHBondContact OG-OG1 3.27Å; T585-V587 VanDerWaalsContact C-N 3.34Å
586	G	79.5	Confident	85.1	Confident	42 Å²	42	65.8 Å²	65.8	43%	0.433	35%	0.345	S	S	.	.	S	Bend	trans	82.7	4.5	176.9	0	0	0	0	0	115.2	S583 R584	S583-G586 PolarHBondContact O-N 2.58Å; S583-G586 PolarHBondContact OG-N 2.79Å; R584-G586 VanDerWaalsContact C-N 3.32Å
587	V	84.7	Confident	84.8	Confident	88 Å²	88	69 Å²	69	53%	0.533	36%	0.361	S	S	.	.			trans	-74.4	132.2	178.9	179.8	0	0	0	0	109.7	K582 S583 T585 L589	K582-V587 CarbonylContact C-O 3.54Å; K582-V587 VanDerWaalsContact CA-O 3.28Å; K582-V587 WeakPolarHBondContact CA-O 3.39Å; S583-V587 PolarHBondContact N-O 3.47Å; S583-V587 PolarHBondContact OG-N 2.96Å; T585-V587 VanDerWaalsContact C-N 3.34Å; V587-L589 PolarHBondContact O-N 3.2Å
588	I	83.6	Confident	84.5	Confident	63 Å²	63	70 Å²	70	32%	0.323	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	119.2	177.2	-54.1	171.6	0	0	0	109.1	H580 T581 K582 F591	H580-I588 HydrophobicContact CB-CG2 4.22Å; T581-I588 CarbonylContact O-C 3.58Å; T581-I588 WeakPolarHBondContact O-CA 3.42Å; K582-I588 HydrophobicContact CG-CG1 4.2Å; I588-F591 HydrophobicContact CB-CE1 4.48Å; I588-F591 HydrophobicContact CB-CE2 4.13Å; I588-F591 HydrophobicContact CB-CZ 3.84Å; I588-F591 HydrophobicContact CD1-CE1 3.8Å; I588-F591 HydrophobicContact CD1-CZ 3.66Å; I588-F591 HydrophobicContact CG1-CZ 4.35Å; I588-F591 HydrophobicContact CG2-CD1 4.17Å; I588-F591 HydrophobicContact CG2-CD2 3.95Å; I588-F591 HydrophobicContact CG2-CE1 3.73Å; I588-F591 HydrophobicContact CG2-CE2 3.49Å; I588-F591 VanDerWaalsContact CG2-CE2 3.49Å; I588-F591 HydrophobicContact CG2-CG 4.28Å; I588-F591 HydrophobicContact CG2-CZ 3.37Å
589	L	81.5	Confident	84	Confident	102 Å²	102	72 Å²	72	53%	0.534	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	-31.1	-178.4	-62.6	177.3	0	0	0	112.4	P535 T581 V587	P535-L589 HydrophobicContact CB-CD1 4.17Å; T581-L589 PolarHBondContact O-N 3.08Å; V587-L589 PolarHBondContact O-N 3.2Å
590	A	81.5	Confident	83.4	Confident	36 Å²	36	73.4 Å²	73.4	30%	0.298	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	147.5	179.2	0	0	0	0	0	111.2	T581	T581-A590 PolarHBondContact N-O 3.16Å; T581-A590 PolarHBondContact O-N 2.85Å
591	F	84.1	Confident	82.5	Confident	138 Å²	138	74 Å²	74	61%	0.605	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.6	120.3	174.1	-66.2	-90.8	0	0	0	108	H580 I588	H580-F591 AromaticContact CD2-CD1 3.36Å; H580-F591 WeakPolarHBondContact CD2-CD1 3.44Å; H580-F591 AromaticContact CD2-CE1 3.72Å; H580-F591 AromaticContact CE1-CE1 3.9Å; H580-F591 AromaticContact NE2-CD1 3.42Å; H580-F591 WeakPolarHBondContact NE2-CD1 3.28Å; H580-F591 AromaticContact NE2-CE1 3.57Å; I588-F591 HydrophobicContact CB-CE1 4.48Å; I588-F591 HydrophobicContact CB-CE2 4.13Å; I588-F591 HydrophobicContact CB-CZ 3.84Å; I588-F591 HydrophobicContact CD1-CE1 3.8Å; I588-F591 HydrophobicContact CD1-CZ 3.66Å; I588-F591 HydrophobicContact CG1-CZ 4.35Å; I588-F591 HydrophobicContact CG2-CD1 4.17Å; I588-F591 HydrophobicContact CG2-CD2 3.95Å; I588-F591 HydrophobicContact CG2-CE1 3.73Å; I588-F591 HydrophobicContact CG2-CE2 3.49Å; I588-F591 VanDerWaalsContact CG2-CE2 3.49Å; I588-F591 HydrophobicContact CG2-CG 4.28Å; I588-F591 HydrophobicContact CG2-CZ 3.37Å
592	N	84.7	Confident	81.3	Confident	87 Å²	87	80.6 Å²	80.6	47%	0.465	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	152.2	172	-58.9	-79.9	0	0	0	109	I579	I579-N592 HydrophobicContact CB-CB 4.2Å; I579-N592 WeakPolarHBondContact CB-O 3.44Å; I579-N592 PolarHBondContact N-O 3.36Å; I579-N592 PolarHBondContact O-N 2.97Å
593	E	86	Confident	79.9	Confident	88 Å²	88	86 Å²	86	41%	0.411	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	129.4	174	-171.1	-177.7	77.9	0	0	108.2	K576 V577	K576-E593 HydrophobicContact CB-CG 4.22Å; K576-E593 WeakPolarHBondContact CD-OE2 3.42Å; K576-E593 HydrophobicContact CG-CG 4.29Å; K576-E593 IonicContact NZ-OE1 2.73Å; K576-E593 PolarHBondContact NZ-OE1 3.29Å; K576-E593 IonicContact NZ-OE2 2.93Å; K576-E593 PolarHBondContact NZ-OE2 3.32Å; V577-E593 WeakPolarHBondContact O-CA 3.49Å
594	A	84.9	Confident	78.5	Confident	22 Å²	22	90.1 Å²	90.1	18%	0.182	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	128	167	0	0	0	0	0	109	I528 K576 V577 I579	I528-A594 HydrophobicContact CD1-CB 3.85Å; K576-A594 WeakPolarHBondContact CA-O 3.36Å; V577-A594 HydrophobicContact CB-CB 4.3Å; V577-A594 PolarHBondContact N-O 2.93Å; V577-A594 PolarHBondContact O-N 3.44Å; I579-A594 HydrophobicContact CD1-CB 4.08Å
595	I	85.4	Confident	77.1	Confident	94 Å²	94	86.6 Å²	86.6	48%	0.482	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	126.9	176.9	-57.7	174.7	0	0	0	107.5	T574 K576 E597	T574-I595 HydrophobicContact CG2-CG2 3.63Å; K576-I595 HydrophobicContact CG-CG1 4.41Å; I595-E597 HydrophobicContact CG2-CG 4.45Å
596	I	85.9	Confident	76.9	Confident	23 Å²	23	84.9 Å²	84.9	12%	0.118	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	121.5	175.6	-53.8	167.5	0	0	0	107.7	I528 V561 T574 I575 V577 I598	I528-I596 HydrophobicContact CD1-CD1 4.18Å; V561-I596 HydrophobicContact CB-CD1 4.47Å; V561-I596 HydrophobicContact CG2-CD1 3.82Å; T574-I596 WeakPolarHBondContact CA-O 3.45Å; I575-I596 HydrophobicContact CD1-CB 4.1Å; I575-I596 HydrophobicContact CD1-CD1 4.08Å; I575-I596 HydrophobicContact CD1-CG2 4.44Å; I575-I596 HydrophobicContact CG1-CB 3.65Å; I575-I596 HydrophobicContact CG1-CD1 4.33Å; I575-I596 HydrophobicContact CG1-CG1 4.42Å; I575-I596 HydrophobicContact CG1-CG2 4.35Å; I575-I596 PolarHBondContact N-O 3.08Å; I575-I596 PolarHBondContact O-N 2.73Å; V577-I596 HydrophobicContact CG2-CD1 4.07Å; I596-I598 HydrophobicContact CG2-CD1 4.12Å; I596-I598 HydrophobicContact CG2-CG1 3.84Å
597	E	84.4	Confident	76.8	Confident	144 Å²	144	87.1 Å²	87.1	67%	0.673	45%	0.454	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.4	124.1	174.1	-64.5	-168.5	118.7	0	0	110	T574 I595	T574-E597 HydrophobicContact CG2-CG 4.04Å; I595-E597 HydrophobicContact CG2-CG 4.45Å
598	I	83.3	Confident	76.3	Confident	23 Å²	23	87.1 Å²	87.1	12%	0.118	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	108.1	-173.9	-58.4	174	0	0	0	107.6	V525 F550 V572 E573 I575 I596 V600	V525-I598 HydrophobicContact CG1-CD1 4.05Å; V525-I598 HydrophobicContact CG1-CG1 4.5Å; F550-I598 HydrophobicContact CD1-CD1 4.35Å; F550-I598 HydrophobicContact CE1-CD1 3.41Å; F550-I598 VanDerWaalsContact CE1-CD1 3.41Å; F550-I598 HydrophobicContact CE2-CD1 3.83Å; F550-I598 HydrophobicContact CZ-CD1 3.1Å; F550-I598 HydrophobicContact CZ-CG1 4.39Å; F550-I598 HydrophobicContact CZ-CG2 4.44Å; V572-I598 CarbonylContact C-O 3.47Å; V572-I598 WeakPolarHBondContact CA-O 3.46Å; E573-I598 PolarHBondContact N-O 3.15Å; E573-I598 PolarHBondContact O-N 3.23Å; I575-I598 HydrophobicContact CD1-CD1 3.93Å; I575-I598 HydrophobicContact CG1-CD1 4.43Å; I596-I598 HydrophobicContact CG2-CD1 4.12Å; I596-I598 HydrophobicContact CG2-CG1 3.84Å; I598-V600 HydrophobicContact CG2-CG2 4.47Å
599	S	81.3	Confident	75.9	Confident	95 Å²	95	88.5 Å²	88.5	66%	0.664	46%	0.457	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.3	120	175.6	-170.8	0	0	0	0	110.2
600	V	78	Confident	75.6	Confident	40 Å²	40	87.6 Å²	87.6	24%	0.242	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	118.6	175.2	-175.3	0	0	0	0	109.1	I567 P570 T571 I598	I567-V600 HydrophobicContact CB-CG2 3.94Å; I567-V600 HydrophobicContact CD1-CG2 4.42Å; I567-V600 HydrophobicContact CG2-CB 4.37Å; I567-V600 HydrophobicContact CG2-CG2 3.61Å; P570-V600 WeakPolarHBondContact CA-O 3.48Å; T571-V600 PolarHBondContact N-O 3.48Å; T571-V600 PolarHBondContact O-N 3.22Å; I598-V600 HydrophobicContact CG2-CG2 4.47Å
601	S	69.6	Low	75.2	Confident	59 Å²	59	91.1 Å²	91.1	41%	0.413	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-61.7	150.7	179.6	137.4	0	0	0	0	112.2	Y603	S601-Y603 VanDerWaalsContact C-N 3.25Å; S601-Y603 PolarHBondContact OG-N 2.89Å; S601-Y603 PolarHBondContact OG-O 3.22Å
602	K	61.5	Low	74.5	Confident	152 Å²	152	87.7 Å²	87.7	66%	0.661	45%	0.453	S	S	*	.	S	Bend	trans	-70.5	-23.5	172.6	-170.1	177.1	176.3	-175.5	0	112.5	P570 P604	P570-K602 HydrophobicContact CB-CB 3.87Å; P570-K602 HydrophobicContact CB-CG 4.39Å; P570-K602 HydrophobicContact CG-CB 4.07Å; P570-K602 HydrophobicContact CG-CD 4.39Å; P570-K602 HydrophobicContact CG-CG 4.03Å; K602-P604 WeakPolarHBondContact O-CD 3.39Å
603	Y	56.1	Low	73.8	Confident	165 Å²	165	87.8 Å²	87.8	65%	0.647	45%	0.452	S	S	*	.	S	Bend	trans	-94	118.8	-174.9	-59.9	-74.3	0	0	0	109.3	S601 F605	S601-Y603 VanDerWaalsContact C-N 3.25Å; S601-Y603 PolarHBondContact OG-N 2.89Å; S601-Y603 PolarHBondContact OG-O 3.22Å; Y603-F605 PolarHBondContact O-N 3.32Å
604	P	52.7	Low	72.7	Confident	108 Å²	108	87.8 Å²	87.8	70%	0.701	46%	0.455	S	S	*	.			trans	-69.5	110.1	160.1	29.3	-27.9	0	0	0	105.9	K602	K602-P604 WeakPolarHBondContact O-CD 3.39Å
605	F	49.7	Very low	71.6	Confident	128 Å²	128	93.7 Å²	93.7	56%	0.561	48%	0.48	S	S	*	.			trans	-75	0	172.5	-75.9	-76.2	0	0	0	110.4	K461 H463 Y603	K461-F605 PolarHBondContact NZ-OXT 3.15Å; H463-F605 AromaticContact CE1-CD1 3.7Å; H463-F605 AromaticContact CE1-CE1 3.89Å; H463-F605 AromaticContact NE2-CD1 3.55Å; Y603-F605 PolarHBondContact O-N 3.32Å

Retrieved 605 of 605 residues in 236.9 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).