A0A077ZB88_TRITR Loading...

LIM domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZB88, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 604 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	46.1	Very low	61.2	Low	232 Å²	232	119.1 Å²	119.1	100%	1.143	64%	0.636	S	S	*	*				0	-14.3	0	-80	-178.5	162.4	0	0	114.8	F3	M1-F3 PolarHBondContact O-N 3.02Å
2	S	50.9	Low	60.9	Low	96 Å²	96	115.1 Å²	115.1	67%	0.671	62%	0.619	S	S	*	*	H	α-helix	trans	-75	-20.7	-176.7	53.4	0	0	0	0	116.2
3	F	57.3	Low	60.2	Low	185 Å²	185	110.2 Å²	110.2	81%	0.811	60%	0.604	S	S	*	*	H	α-helix	trans	-76.7	-28	-177.2	-82.9	-85.1	0	0	0	114.5	M1	M1-F3 PolarHBondContact O-N 3.02Å
4	G	59.3	Low	59.1	Low	52 Å²	52	106.4 Å²	106.4	54%	0.536	58%	0.58	S	S	.	*	H	α-helix	trans	-71.7	-34.4	-179.1	0	0	0	0	0	113.6	L8	G4-L8 PolarHBondContact O-N 3.13Å
5	M	63.9	Low	58.5	Low	111 Å²	111	112.6 Å²	112.6	55%	0.547	59%	0.592	S	S	.	*	H	α-helix	trans	-71.1	-33.5	-177.7	-71.2	-68.1	-90.6	0	0	112.4	L8 F9	M5-L8 PolarHBondContact O-N 3.24Å; M5-F9 HydrophobicContact CE-CE2 4.24Å; M5-F9 WeakPolarHBondContact O-CB 3.4Å; M5-F9 WeakPolarHBondContact O-CD2 3.42Å; M5-F9 PolarHBondContact O-N 3.3Å
6	L	66.1	Low	57.5	Low	114 Å²	114	112.1 Å²	112.1	60%	0.597	59%	0.588	S	S	*	*	H	α-helix	trans	-67.4	-38.2	179.5	-167.2	70.4	0	0	0	111.8	I10	L6-I10 HydrophobicContact CG-CD1 4.07Å; L6-I10 WeakPolarHBondContact O-CB 3.46Å; L6-I10 WeakPolarHBondContact O-CD1 3.14Å; L6-I10 WeakPolarHBondContact O-CG1 3.23Å; L6-I10 PolarHBondContact O-N 3.4Å
7	S	66	Low	56.6	Low	73 Å²	73	108.1 Å²	108.1	51%	0.51	57%	0.571	S	S	.	*	H	α-helix	trans	-65.9	-44.4	175.6	-166.3	0	0	0	0	111.2	I10 M11	S7-I10 PolarHBondContact O-N 3.44Å; S7-M11 WeakPolarHBondContact O-CG 3.38Å; S7-M11 PolarHBondContact O-N 3.23Å
8	L	67.2	Low	55.7	Low	106 Å²	106	104 Å²	104	56%	0.555	55%	0.551	S	S	*	*	H	α-helix	trans	-63.2	-44.3	176.6	-161.4	92.2	0	0	0	111.8	G4 M5 I10 M11 V12	G4-L8 PolarHBondContact O-N 3.13Å; M5-L8 PolarHBondContact O-N 3.24Å; L8-I10 PolarHBondContact O-N 3.47Å; L8-M11 PolarHBondContact O-N 3.04Å; L8-V12 HydrophobicContact CG-CG2 4.49Å; L8-V12 WeakPolarHBondContact O-CB 3.23Å; L8-V12 VanDerWaalsContact O-CG2 3.26Å; L8-V12 WeakPolarHBondContact O-CG2 3.5Å; L8-V12 PolarHBondContact O-N 3.35Å
9	F	63.8	Low	54.6	Low	136 Å²	136	101.2 Å²	101.2	60%	0.596	54%	0.541	S	S	*	.	H	α-helix	trans	-64.9	-38.2	177.4	-98.3	-85.7	0	0	0	112.6	M5 A13	M5-F9 HydrophobicContact CE-CE2 4.24Å; M5-F9 WeakPolarHBondContact O-CB 3.4Å; M5-F9 WeakPolarHBondContact O-CD2 3.42Å; M5-F9 PolarHBondContact O-N 3.3Å; F9-A13 WeakPolarHBondContact O-CB 3.41Å; F9-A13 PolarHBondContact O-N 3.34Å
10	I	70.1	Confident	53.9	Low	81 Å²	81	101.3 Å²	101.3	42%	0.415	54%	0.538	S	S	.	.	H	α-helix	trans	-66.1	-44.9	174	-69.2	166.8	0	0	0	109.7	L6 S7 L8 V12 A13 E14	L6-I10 HydrophobicContact CG-CD1 4.07Å; L6-I10 WeakPolarHBondContact O-CB 3.46Å; L6-I10 WeakPolarHBondContact O-CD1 3.14Å; L6-I10 WeakPolarHBondContact O-CG1 3.23Å; L6-I10 PolarHBondContact O-N 3.4Å; S7-I10 PolarHBondContact O-N 3.44Å; L8-I10 PolarHBondContact O-N 3.47Å; I10-V12 PolarHBondContact O-N 3Å; I10-A13 PolarHBondContact O-N 2.9Å; I10-E14 HydrophobicContact CG2-CG 4.11Å; I10-E14 WeakPolarHBondContact O-CB 3.43Å; I10-E14 WeakPolarHBondContact O-CG 3.31Å; I10-E14 PolarHBondContact O-N 2.84Å
11	M	62.5	Low	52.9	Low	124 Å²	124	96.5 Å²	96.5	61%	0.611	51%	0.513	S	S	*	.	H	α-helix	trans	-61.9	-44.2	176.9	-70.1	-153.2	94.5	0	0	112.1	S7 L8 E14 W15	S7-M11 WeakPolarHBondContact O-CG 3.38Å; S7-M11 PolarHBondContact O-N 3.23Å; L8-M11 PolarHBondContact O-N 3.04Å; M11-E14 PolarHBondContact O-N 3.24Å; M11-W15 WeakPolarHBondContact O-CB 3.29Å; M11-W15 PolarHBondContact O-N 2.91Å
12	V	57.6	Low	52.5	Low	71 Å²	71	86.4 Å²	86.4	43%	0.43	47%	0.466	S	S	.	.	H	α-helix	trans	-68	-42.2	178.6	173.7	0	0	0	0	111.3	L8 I10 W15 I16	L8-V12 HydrophobicContact CG-CG2 4.49Å; L8-V12 WeakPolarHBondContact O-CB 3.23Å; L8-V12 VanDerWaalsContact O-CG2 3.26Å; L8-V12 WeakPolarHBondContact O-CG2 3.5Å; L8-V12 PolarHBondContact O-N 3.35Å; I10-V12 PolarHBondContact O-N 3Å; V12-W15 PolarHBondContact O-N 2.87Å; V12-I16 HydrophobicContact CG1-CD1 3.7Å; V12-I16 HydrophobicContact CG1-CG1 4.36Å; V12-I16 WeakPolarHBondContact O-CB 3.47Å; V12-I16 WeakPolarHBondContact O-CD1 3.46Å; V12-I16 WeakPolarHBondContact O-CG1 3.45Å; V12-I16 PolarHBondContact O-N 3.35Å
13	A	51.4	Low	52.2	Low	52 Å²	52	81.9 Å²	81.9	43%	0.43	43%	0.434	S	S	.	.	H	α-helix	trans	-66.2	-37.2	175.7	0	0	0	0	0	112.3	F9 I10 C17	F9-A13 WeakPolarHBondContact O-CB 3.41Å; F9-A13 PolarHBondContact O-N 3.34Å; I10-A13 PolarHBondContact O-N 2.9Å; A13-C17 WeakPolarHBondContact O-CB 3.48Å; A13-C17 PolarHBondContact O-N 3.07Å; A13-C17 PolarHBondContact O-SG 3.41Å
14	E	45	Very low	51.5	Low	57 Å²	57	74.7 Å²	74.7	27%	0.266	41%	0.406	S	S	.	.	H	α-helix	trans	-69.2	-33.5	173.2	-74.4	-180	157.1	0	0	112	I10 M11 T18 R142	I10-E14 HydrophobicContact CG2-CG 4.11Å; I10-E14 WeakPolarHBondContact O-CB 3.43Å; I10-E14 WeakPolarHBondContact O-CG 3.31Å; I10-E14 PolarHBondContact O-N 2.84Å; M11-E14 PolarHBondContact O-N 3.24Å; E14-T18 WeakPolarHBondContact O-CG2 3.46Å; E14-T18 PolarHBondContact O-N 2.97Å; E14-T18 PolarHBondContact O-OG1 2.81Å; E14-R142 VanDerWaalsContact CD-NH1 3.28Å; E14-R142 IonicContact OE1-NH1 3.8Å; E14-R142 IonicContact OE1-NH2 3.78Å; E14-R142 IonicContact OE2-CZ 3.55Å; E14-R142 IonicContact OE2-NH1 2.66Å; E14-R142 PolarHBondContact OE2-NH1 2.96Å; E14-R142 IonicContact OE2-NH2 3.51Å
15	W	49.7	Very low	50.5	Low	199 Å²	199	73.5 Å²	73.5	75%	0.754	39%	0.391	S	S	*	.	H	α-helix	trans	-72	-42.4	175.9	-154.9	72.6	0	0	0	111.7	M11 V12 C17 T18	M11-W15 WeakPolarHBondContact O-CB 3.29Å; M11-W15 PolarHBondContact O-N 2.91Å; V12-W15 PolarHBondContact O-N 2.87Å; W15-C17 VanDerWaalsContact C-N 3.32Å; W15-C17 PolarHBondContact O-N 3.36Å; W15-T18 PolarHBondContact O-N 3.43Å; W15-T18 PolarHBondContact O-OG1 3.4Å; W15-T18 VanDerWaalsContact O-OG1 3.1Å
16	I	43.4	Very low	49.3	Very low	104 Å²	104	76 Å²	76	53%	0.533	39%	0.394	S	S	.	.	H	α-helix	trans	-64.3	-37.9	175.1	-66.8	164.4	0	0	0	110.6	V12 T18 S19	V12-I16 HydrophobicContact CG1-CD1 3.7Å; V12-I16 HydrophobicContact CG1-CG1 4.36Å; V12-I16 WeakPolarHBondContact O-CB 3.47Å; V12-I16 WeakPolarHBondContact O-CD1 3.46Å; V12-I16 WeakPolarHBondContact O-CG1 3.45Å; V12-I16 PolarHBondContact O-N 3.35Å; I16-T18 VanDerWaalsContact C-N 3.3Å; I16-T18 PolarHBondContact O-N 2.91Å; I16-S19 PolarHBondContact O-OG 2.97Å
17	C	41.7	Very low	47.5	Very low	44 Å²	44	80.2 Å²	80.2	30%	0.297	41%	0.408	S	S	.	.	H	α-helix	trans	-66.6	-27.8	177.9	-73.1	0	0	0	0	113.7	A13 W15 N112	A13-C17 WeakPolarHBondContact O-CB 3.48Å; A13-C17 PolarHBondContact O-N 3.07Å; A13-C17 PolarHBondContact O-SG 3.41Å; W15-C17 VanDerWaalsContact C-N 3.32Å; W15-C17 PolarHBondContact O-N 3.36Å; C17-N112 PolarHBondContact SG-ND2 3.31Å; C17-N112 VanDerWaalsContact SG-ND2 3.4Å
18	T	40.3	Very low	45.8	Very low	35 Å²	35	85.4 Å²	85.4	22%	0.215	42%	0.417	C	S	.	.	H	α-helix	trans	-92.9	-5.6	-173.6	46.9	0	0	0	0	114.3	E14 W15 I16 Q20 F146	E14-T18 WeakPolarHBondContact O-CG2 3.46Å; E14-T18 PolarHBondContact O-N 2.97Å; E14-T18 PolarHBondContact O-OG1 2.81Å; W15-T18 PolarHBondContact O-N 3.43Å; W15-T18 PolarHBondContact O-OG1 3.4Å; W15-T18 VanDerWaalsContact O-OG1 3.1Å; I16-T18 VanDerWaalsContact C-N 3.3Å; I16-T18 PolarHBondContact O-N 2.91Å; T18-Q20 PolarHBondContact O-N 3.36Å; T18-F146 WeakPolarHBondContact O-CD2 3.47Å; T18-F146 WeakPolarHBondContact O-CE1 3.3Å; T18-F146 WeakPolarHBondContact O-CE2 3.35Å; T18-F146 WeakPolarHBondContact O-CG 3.47Å; T18-F146 WeakPolarHBondContact O-CZ 3.5Å
19	S	36.2	Very low	43.8	Very low	51 Å²	51	82.8 Å²	82.8	36%	0.357	42%	0.416	S	S	.	.	S	Bend	trans	-83.6	-2.5	-162.6	63.7	0	0	0	0	118.5	I16 F146 R150	I16-S19 PolarHBondContact O-OG 2.97Å; S19-F146 VanDerWaalsContact C-CZ 3.42Å; S19-R150 PolarHBondContact O-NH2 3.37Å
20	Q	39.4	Very low	42.1	Very low	102 Å²	102	81.9 Å²	81.9	48%	0.477	42%	0.424	S	S	.	.			trans	-134.3	37.2	-165.3	-65.4	-169.2	-9.2	0	0	118.3	T18 R46	T18-Q20 PolarHBondContact O-N 3.36Å; Q20-R46 HydrophobicContact CB-CG 4.49Å; Q20-R46 VanDerWaalsContact O-CA 3.22Å; Q20-R46 WeakPolarHBondContact O-CA 3.34Å; Q20-R46 VanDerWaalsContact O-O 3.12Å
21	G	33.7	Very low	40.3	Very low	2 Å²	2	83.5 Å²	83.5	2%	0.021	44%	0.442	C	S	.	.			trans	-117.1	109.6	173	0	0	0	0	0	114.7	A45 F146 R150	G21-A45 WeakPolarHBondContact CA-O 3.49Å; G21-F146 VanDerWaalsContact N-CZ 3.29Å; G21-F146 WeakPolarHBondContact O-CE1 3.37Å; G21-R150 WeakPolarHBondContact O-CD 3.34Å
22	A	36.8	Very low	38.7	Very low	20 Å²	20	86.4 Å²	86.4	17%	0.165	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	138.2	167.4	0	0	0	0	0	110	V24 R150	A22-V24 HydrophobicContact CB-CG2 3.98Å; A22-R150 HydrophobicContact CB-CB 4.42Å
23	I	45.9	Very low	37.3	Very low	0 Å²	0	89.5 Å²	89.5	0%	0	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	114.1	164.6	-72.4	167	0	0	0	106.8	F48 C50 F87 L104 L147 W151	I23-F48 WeakPolarHBondContact CA-O 3.27Å; I23-F48 HydrophobicContact CD1-CD1 4.37Å; I23-F48 HydrophobicContact CD1-CG 4.39Å; I23-F48 HydrophobicContact CG1-CB 3.63Å; I23-F48 HydrophobicContact CG1-CD1 3.81Å; I23-F48 HydrophobicContact CG1-CG 3.77Å; I23-F48 HydrophobicContact CG2-CD1 4.5Å; I23-C50 HydrophobicContact CG2-CB 4.26Å; I23-C50 WeakPolarHBondContact CG2-SG 3.48Å; I23-F87 HydrophobicContact CG2-CZ 4.11Å; I23-L104 HydrophobicContact CD1-CD1 4.32Å; I23-L104 HydrophobicContact CD1-CD2 4.28Å; I23-L147 HydrophobicContact CD1-CB 4.28Å; I23-L147 HydrophobicContact CD1-CD1 4.5Å; I23-L147 HydrophobicContact CD1-CD2 3.97Å; I23-L147 HydrophobicContact CD1-CG 4.48Å; I23-L147 HydrophobicContact CG1-CD2 4.15Å; I23-W151 HydrophobicContact CB-CE3 4.49Å; I23-W151 HydrophobicContact CD1-CD2 4.49Å; I23-W151 HydrophobicContact CD1-CE3 3.35Å; I23-W151 HydrophobicContact CD1-CZ3 3.38Å; I23-W151 HydrophobicContact CG1-CE3 4.48Å; I23-W151 HydrophobicContact CG2-CE3 4.36Å
24	V	42.5	Very low	36.2	Very low	34 Å²	34	90.6 Å²	90.6	21%	0.206	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	126.9	179.8	-176	0	0	0	0	108.9	A22 F48	A22-V24 HydrophobicContact CB-CG2 3.98Å; V24-F48 PolarHBondContact N-O 2.9Å
25	A	38	Very low	35.5	Very low	27 Å²	27	96.6 Å²	96.6	22%	0.223	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	130	171	0	0	0	0	0	110.2	F87 V153	A25-F87 HydrophobicContact CB-CD1 3.87Å; A25-F87 HydrophobicContact CB-CE1 3.64Å; A25-V153 HydrophobicContact CB-CG1 4.44Å
26	R	37.1	Very low	34.4	Very low	164 Å²	164	92.2 Å²	92.2	62%	0.619	51%	0.508	S	S	*	.			trans	-108.1	140.4	160.5	-85.5	-169.9	-174.6	-178.7	3.6	108.7	Y49	R26-Y49 HydrophobicContact CG-CD1 4.48Å
27	K	28.6	Very low	33.8	Very low	202 Å²	202	98.4 Å²	98.4	88%	0.878	53%	0.525	S	S	*	.			trans	-64.3	135.5	159.2	-85.2	-177.8	176.4	177.2	0	108.2	G29	K27-G29 PolarHBondContact O-N 3.26Å
28	Y	31.2	Very low	33.2	Very low	183 Å²	183	101.3 Å²	101.3	72%	0.718	54%	0.541	S	S	*	.			trans	-56.8	107.2	174.4	-146.3	-90.7	0	0	0	109.7	D51	Y28-D51 WeakPolarHBondContact CD2-OD2 3.34Å; Y28-D51 WeakPolarHBondContact CE2-OD2 2.9Å
29	G	25.1	Very low	32.9	Very low	51 Å²	51	107 Å²	107	53%	0.526	57%	0.57	S	S	.	*			trans	-103	139.3	157.6	0	0	0	0	0	107.2	K27 S31	K27-G29 PolarHBondContact O-N 3.26Å; G29-S31 PolarHBondContact O-N 3.41Å
30	P	27.1	Very low	33	Very low	117 Å²	117	111.2 Å²	111.2	76%	0.76	59%	0.589	S	S	*	*			trans	-54.8	126.1	175.7	23.9	-31.9	0	0	0	108.7	E32	P30-E32 PolarHBondContact O-N 2.94Å; P30-E32 VanDerWaalsContact O-N 3.11Å
31	S	33.9	Very low	33.2	Very low	115 Å²	115	111.8 Å²	111.8	80%	0.804	59%	0.591	S	S	*	*			trans	-61.8	115.2	179.9	56.6	0	0	0	0	109.4	G29 E33	G29-S31 PolarHBondContact O-N 3.41Å; S31-E33 PolarHBondContact O-N 2.94Å
32	E	28.8	Very low	33.6	Very low	184 Å²	184	113.3 Å²	113.3	86%	0.86	60%	0.599	S	S	*	*			trans	-64	119.1	163.8	-69.2	-167.2	150.7	0	0	108.7	P30	P30-E32 PolarHBondContact O-N 2.94Å; P30-E32 VanDerWaalsContact O-N 3.11Å
33	E	28.5	Very low	34.2	Very low	137 Å²	137	112.4 Å²	112.4	64%	0.64	59%	0.591	S	S	*	*	S	Bend	trans	58.4	91.6	152	-57.2	-173.3	177.1	0	0	118.7	S31 R453	S31-E33 PolarHBondContact O-N 2.94Å; E33-R453 IonicContact OE1-NH1 3.28Å
34	G	28	Very low	34.5	Very low	75 Å²	75	114.1 Å²	114.1	77%	0.773	60%	0.6	S	S	*	*				62.9	66.5	123.5	0	0	0	0	0	118.8
35	H	29.5	Very low	34.8	Very low	182 Å²	182	113.1 Å²	113.1	84%	0.843	60%	0.596	S	S	*	*			trans	-103.3	122.1	150	-82.2	12.8	0	0	0	109.9	R37	H35-R37 PolarHBondContact O-N 3.38Å; H35-R37 VanDerWaalsContact O-N 3.12Å
36	S	27.5	Very low	35.2	Very low	108 Å²	108	116.5 Å²	116.5	76%	0.755	60%	0.602	S	S	*	*			trans	-48.9	113.9	-179.3	178.3	0	0	0	0	111	T38	S36-T38 PolarHBondContact O-N 3.15Å; S36-T38 VanDerWaalsContact O-N 3.11Å
37	R	30.2	Very low	35.7	Very low	233 Å²	233	113.3 Å²	113.3	88%	0.879	60%	0.598	S	S	*	*			trans	-80.3	81.3	-175.3	-166.9	-178.3	-170.7	179.1	3.4	109.8	H35	H35-R37 PolarHBondContact O-N 3.38Å; H35-R37 VanDerWaalsContact O-N 3.12Å
38	T	29.6	Very low	37	Very low	106 Å²	106	103.8 Å²	103.8	65%	0.65	56%	0.557	S	S	*	*	S	Bend	trans	-140	108.2	168.9	51.6	0	0	0	0	109.3	S36	S36-T38 PolarHBondContact O-N 3.15Å; S36-T38 VanDerWaalsContact O-N 3.11Å
39	D	34	Very low	38.2	Very low	154 Å²	154	100.2 Å²	100.2	82%	0.824	54%	0.543	S	S	*	.	S	Bend	trans	80.4	16.9	166.8	-68.3	-25.3	0	0	0	122.7	H41	D39-H41 PolarHBondContact O-N 3.42Å
40	D	38.6	Very low	39.9	Very low	139 Å²	139	97.9 Å²	97.9	74%	0.743	52%	0.518	S	S	*	.			trans	-95.5	35.7	173	-78.4	-21.7	0	0	0	115.1	L42	D40-L42 PolarHBondContact O-N 2.91Å; D40-L42 VanDerWaalsContact O-N 3.11Å
41	H	42.2	Very low	41.2	Very low	114 Å²	114	94.4 Å²	94.4	53%	0.528	49%	0.493	S	S	.	.			trans	-75.4	19.5	165.3	-75.4	-73.3	0	0	0	113	D39 D64	D39-H41 PolarHBondContact O-N 3.42Å; H41-D64 IonicContact ND1-OD1 3.98Å
42	L	43	Very low	42.2	Very low	34 Å²	34	89.4 Å²	89.4	18%	0.178	46%	0.457	C	S	.	.			trans	-94.8	108.5	179.1	-171.5	64.8	0	0	0	109.6	D40 I44 R63 K108 A110 L114 M172	D40-L42 PolarHBondContact O-N 2.91Å; D40-L42 VanDerWaalsContact O-N 3.11Å; L42-I44 HydrophobicContact CD2-CD1 4.29Å; L42-I44 HydrophobicContact CD2-CG1 3.94Å; L42-I44 HydrophobicContact CG-CG1 4.02Å; L42-I44 PolarHBondContact O-N 3.28Å; L42-R63 PolarHBondContact O-NH2 3.31Å; L42-K108 HydrophobicContact CD1-CB 4.38Å; L42-A110 HydrophobicContact CD1-CB 3.59Å; L42-A110 HydrophobicContact CD2-CB 4.08Å; L42-A110 HydrophobicContact CG-CB 3.82Å; L42-L114 HydrophobicContact CD1-CD1 4.07Å; L42-L114 HydrophobicContact CD2-CB 4.39Å; L42-L114 HydrophobicContact CD2-CD1 3.6Å; L42-L114 HydrophobicContact CD2-CG 3.97Å; L42-L114 HydrophobicContact CG-CD1 4.48Å; L42-M172 HydrophobicContact CD1-CE 3.15Å
43	A	49.4	Very low	43.2	Very low	1 Å²	1	83.5 Å²	83.5	1%	0.008	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	93.7	171	0	0	0	0	0	109.8	F48 K108 L109 A110	A43-F48 HydrophobicContact CB-CD2 4.24Å; A43-F48 HydrophobicContact CB-CE2 3.76Å; A43-K108 VanDerWaalsContact CB-O 3.22Å; A43-K108 WeakPolarHBondContact CB-O 3.11Å; A43-K108 PolarHBondContact N-O 3.43Å; A43-L109 HydrophobicContact CB-CD1 3.97Å; A43-A110 PolarHBondContact O-N 2.89Å
44	I	51.5	Low	44.3	Very low	36 Å²	36	78.8 Å²	78.8	19%	0.185	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	130	171.1	-60.8	154.6	0	0	0	107.2	L42 R46 N47 A110 D113	L42-I44 HydrophobicContact CD2-CD1 4.29Å; L42-I44 HydrophobicContact CD2-CG1 3.94Å; L42-I44 HydrophobicContact CG-CG1 4.02Å; L42-I44 PolarHBondContact O-N 3.28Å; I44-R46 HydrophobicContact CG2-CB 4.35Å; I44-R46 HydrophobicContact CG2-CG 4.45Å; I44-R46 PolarHBondContact O-N 3.29Å; I44-N47 PolarHBondContact O-N 2.69Å; I44-A110 CarbonylContact C-O 3.51Å; I44-A110 WeakPolarHBondContact CA-O 3.32Å; I44-D113 WeakPolarHBondContact CD1-OD1 3.48Å
45	A	49.1	Very low	45.4	Very low	14 Å²	14	75.5 Å²	75.5	12%	0.116	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.3	-25.1	-174.7	0	0	0	0	0	114.1	G21 A110 L111 M143	G21-A45 WeakPolarHBondContact CA-O 3.49Å; A45-A110 PolarHBondContact N-O 3.42Å; A45-L111 VanDerWaalsContact CB-O 3.26Å; A45-L111 WeakPolarHBondContact CB-O 3.41Å; A45-M143 HydrophobicContact CB-SD 4.21Å
46	R	45.8	Very low	46.7	Very low	97 Å²	97	75 Å²	75	37%	0.366	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-32	-173.2	-65.5	178.4	174.3	179.1	-10.7	115.8	Q20 I44 D113	Q20-R46 HydrophobicContact CB-CG 4.49Å; Q20-R46 VanDerWaalsContact O-CA 3.22Å; Q20-R46 WeakPolarHBondContact O-CA 3.34Å; Q20-R46 VanDerWaalsContact O-O 3.12Å; I44-R46 HydrophobicContact CG2-CB 4.35Å; I44-R46 HydrophobicContact CG2-CG 4.45Å; I44-R46 PolarHBondContact O-N 3.29Å; R46-D113 IonicContact CZ-OD2 2.78Å; R46-D113 IonicContact NH1-OD2 2.76Å; R46-D113 PolarHBondContact NH1-OD2 3.23Å
47	N	47.8	Very low	48.3	Very low	97 Å²	97	69.9 Å²	69.9	52%	0.519	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	93	-178.3	-84.4	-12.3	0	0	0	110.2	I44 Y49 R63	I44-N47 PolarHBondContact O-N 2.69Å; N47-Y49 HydrophobicContact CB-CE2 4.29Å; N47-R63 PolarHBondContact O-NH1 2.85Å
48	F	56.1	Low	49.9	Very low	3 Å²	3	61.4 Å²	61.4	1%	0.013	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	106.1	176.8	-151.8	-66.2	0	0	0	109.8	I23 V24 A43 C50 C61 R63 L104 V106	I23-F48 WeakPolarHBondContact CA-O 3.27Å; I23-F48 HydrophobicContact CD1-CD1 4.37Å; I23-F48 HydrophobicContact CD1-CG 4.39Å; I23-F48 HydrophobicContact CG1-CB 3.63Å; I23-F48 HydrophobicContact CG1-CD1 3.81Å; I23-F48 HydrophobicContact CG1-CG 3.77Å; I23-F48 HydrophobicContact CG2-CD1 4.5Å; V24-F48 PolarHBondContact N-O 2.9Å; A43-F48 HydrophobicContact CB-CD2 4.24Å; A43-F48 HydrophobicContact CB-CE2 3.76Å; F48-C50 VanDerWaalsContact CE1-SG 3.59Å; F48-C61 WeakPolarHBondContact CE1-SG 3.48Å; F48-R63 HydrophobicContact CE1-CB 4.02Å; F48-R63 HydrophobicContact CZ-CB 3.72Å; F48-R63 HydrophobicContact CZ-CG 4.26Å; F48-L104 HydrophobicContact CD1-CD1 4.32Å; F48-L104 HydrophobicContact CE1-CD1 3.63Å; F48-L104 HydrophobicContact CE2-CD1 4Å; F48-L104 HydrophobicContact CE2-CD2 4.39Å; F48-L104 HydrophobicContact CZ-CD1 3.42Å; F48-L104 VanDerWaalsContact CZ-CD1 3.42Å; F48-L104 HydrophobicContact CZ-CG 4.39Å; F48-V106 HydrophobicContact CE2-CG1 3.66Å; F48-V106 HydrophobicContact CZ-CG1 3.46Å; F48-V106 VanDerWaalsContact CZ-CG1 3.46Å
49	Y	57	Low	52	Low	108 Å²	108	56.8 Å²	56.8	42%	0.424	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	122.6	170.5	-62.6	-76.6	0	0	0	107.9	R26 N47	R26-Y49 HydrophobicContact CG-CD1 4.48Å; N47-Y49 HydrophobicContact CB-CE2 4.29Å
50	C	61.5	Low	54.2	Low	2 Å²	2	49.5 Å²	49.5	1%	0.014	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	121.6	173.5	-69.3	0	0	0	0	108.7	I23 F48 N52 C61 F87	I23-C50 HydrophobicContact CG2-CB 4.26Å; I23-C50 WeakPolarHBondContact CG2-SG 3.48Å; F48-C50 VanDerWaalsContact CE1-SG 3.59Å; C50-N52 WeakPolarHBondContact CB-OD1 3.43Å; C50-N52 PolarHBondContact O-N 2.85Å; C50-C61 VanDerWaalsContact CA-SG 3.53Å; C50-C61 HydrophobicContact CB-CB 3.8Å; C50-C61 WeakPolarHBondContact CB-SG 3.44Å; C50-C61 WeakPolarHBondContact SG-CB 3.5Å; C50-C61 CovalentContact SG-SG 2Å; C50-C61 PolarHBondContact SG-SG 3.39Å; C50-F87 HydrophobicContact CB-CZ 4.49Å
51	D	53.8	Low	56.1	Low	43 Å²	43	42.9 Å²	42.9	23%	0.23	21%	0.209	C	C	.	.			trans	-90.2	88.2	168	-169.7	2.3	0	0	0	108.6	Y28 A53 Y54	Y28-D51 WeakPolarHBondContact CD2-OD2 3.34Å; Y28-D51 WeakPolarHBondContact CE2-OD2 2.9Å; D51-A53 VanDerWaalsContact C-N 3.27Å; D51-A53 WeakPolarHBondContact OD1-CB 3.43Å; D51-A53 PolarHBondContact OD1-N 3.02Å; D51-Y54 HydrophobicContact CB-CD1 4.43Å; D51-Y54 VanDerWaalsContact O-CD1 3.26Å; D51-Y54 WeakPolarHBondContact O-CD1 3.28Å; D51-Y54 WeakPolarHBondContact O-CE1 3.42Å
52	N	53.6	Low	57.8	Low	11 Å²	11	37.5 Å²	37.5	6%	0.059	18%	0.184	C	C	.	.			trans	-82.2	-10.7	175.2	-66.4	6.9	0	0	0	111.6	C50 Y54 L55 K56 D58 V60 F87	C50-N52 WeakPolarHBondContact CB-OD1 3.43Å; C50-N52 PolarHBondContact O-N 2.85Å; N52-Y54 VanDerWaalsContact C-N 3.34Å; N52-Y54 PolarHBondContact O-N 3.5Å; N52-L55 PolarHBondContact O-N 3.21Å; N52-K56 PolarHBondContact O-N 3.36Å; N52-K56 VanDerWaalsContact O-N 3.14Å; N52-D58 PolarHBondContact ND2-O 3.41Å; N52-D58 VanDerWaalsContact ND2-O 3.14Å; N52-V60 PolarHBondContact OD1-O 2.8Å; N52-F87 WeakPolarHBondContact ND2-CG 3.23Å
53	A	51.4	Low	59.2	Low	59 Å²	59	39.5 Å²	39.5	49%	0.488	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-34.3	-166.1	0	0	0	0	0	112.4	D51	D51-A53 VanDerWaalsContact C-N 3.27Å; D51-A53 WeakPolarHBondContact OD1-CB 3.43Å; D51-A53 PolarHBondContact OD1-N 3.02Å
54	Y	50	Low	60.3	Low	39 Å²	39	40.9 Å²	40.9	15%	0.153	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-36.3	-178.2	81.9	-87.2	0	0	0	112.3	D51 N52 D62 L65 H69	D51-Y54 HydrophobicContact CB-CD1 4.43Å; D51-Y54 VanDerWaalsContact O-CD1 3.26Å; D51-Y54 WeakPolarHBondContact O-CD1 3.28Å; D51-Y54 WeakPolarHBondContact O-CE1 3.42Å; N52-Y54 VanDerWaalsContact C-N 3.34Å; N52-Y54 PolarHBondContact O-N 3.5Å; Y54-D62 WeakPolarHBondContact OH-CB 3.25Å; Y54-D62 PolarHBondContact OH-O 2.74Å; Y54-D62 PolarHBondContact OH-OD2 2.95Å; Y54-L65 HydrophobicContact CD1-CD2 3.98Å; Y54-L65 HydrophobicContact CD2-CD2 4.1Å; Y54-L65 HydrophobicContact CE1-CD2 3.5Å; Y54-L65 HydrophobicContact CE2-CD2 3.62Å; Y54-L65 HydrophobicContact CG-CD2 4.26Å; Y54-H69 AromaticContact CD2-CE1 3.69Å; Y54-H69 PolarHBondContact O-CE1 3.09Å; Y54-H69 PolarHBondContact O-ND1 3.41Å
55	L	53	Low	61.4	Low	6 Å²	6	44.7 Å²	44.7	3%	0.031	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-29.8	179.5	-66.5	169	0	0	0	112.2	N52 L57 D62 I67 A72	N52-L55 PolarHBondContact O-N 3.21Å; L55-L57 HydrophobicContact CB-CB 3.91Å; L55-L57 HydrophobicContact CB-CD1 4.13Å; L55-L57 WeakPolarHBondContact O-CD1 3.37Å; L55-L57 PolarHBondContact O-N 3.19Å; L55-D62 HydrophobicContact CD1-CB 3.87Å; L55-I67 HydrophobicContact CD2-CB 4.28Å; L55-I67 HydrophobicContact CD2-CG2 4.11Å; L55-A72 HydrophobicContact CB-CB 4.11Å; L55-A72 HydrophobicContact CD2-CB 3.22Å; L55-A72 HydrophobicContact CG-CB 4.23Å
56	K	55.3	Low	62.7	Low	170 Å²	170	45.9 Å²	45.9	74%	0.739	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.7	25	-158.9	-58.9	-179.1	177.4	179.1	0	112.2	N52	N52-K56 PolarHBondContact O-N 3.36Å; N52-K56 VanDerWaalsContact O-N 3.14Å
57	L	60.7	Low	64.1	Low	2 Å²	2	41.4 Å²	41.4	1%	0.01	21%	0.205	C	C	.	.			trans	-107.6	99.3	172.5	-86.4	65.4	0	0	0	106.3	L55 F59 V60 A72 L75 N76	L55-L57 HydrophobicContact CB-CB 3.91Å; L55-L57 HydrophobicContact CB-CD1 4.13Å; L55-L57 WeakPolarHBondContact O-CD1 3.37Å; L55-L57 PolarHBondContact O-N 3.19Å; L57-F59 HydrophobicContact CB-CE1 4.07Å; L57-F59 HydrophobicContact CB-CE2 4.39Å; L57-F59 HydrophobicContact CB-CZ 3.99Å; L57-F59 HydrophobicContact CD2-CE1 4.11Å; L57-F59 HydrophobicContact CD2-CE2 3.77Å; L57-F59 HydrophobicContact CD2-CZ 3.32Å; L57-F59 HydrophobicContact CG-CE1 3.77Å; L57-F59 HydrophobicContact CG-CE2 4.25Å; L57-F59 HydrophobicContact CG-CZ 3.51Å; L57-F59 PolarHBondContact O-N 3.44Å; L57-V60 HydrophobicContact CD2-CG2 4.23Å; L57-A72 HydrophobicContact CD1-CB 3.79Å; L57-A72 VanDerWaalsContact CD1-O 3.27Å; L57-A72 WeakPolarHBondContact CD1-O 3.48Å; L57-A72 HydrophobicContact CD2-CB 4.37Å; L57-A72 WeakPolarHBondContact CD2-O 3.41Å; L57-L75 HydrophobicContact CD2-CB 3.7Å; L57-L75 HydrophobicContact CD2-CD2 3.59Å; L57-L75 HydrophobicContact CD2-CG 3.7Å; L57-N76 HydrophobicContact CD1-CB 3.83Å; L57-N76 HydrophobicContact CG-CB 4.07Å
58	D	64.8	Low	65.4	Low	54 Å²	54	39.1 Å²	39.1	29%	0.289	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-23.5	-176.8	-75.4	-15.8	0	0	0	111.4	N52 H85 F87	N52-D58 PolarHBondContact ND2-O 3.41Å; N52-D58 VanDerWaalsContact ND2-O 3.14Å; D58-H85 WeakPolarHBondContact CB-CE1 3.06Å; D58-H85 WeakPolarHBondContact CB-ND1 3.05Å; D58-H85 WeakPolarHBondContact CB-NE2 3.33Å; D58-H85 IonicContact OD2-CE1 3.25Å; D58-H85 PolarHBondContact OD2-CE1 3.01Å; D58-H85 VanDerWaalsContact OD2-CE1 3.32Å; D58-H85 IonicContact OD2-NE2 3.59Å; D58-F87 HydrophobicContact CB-CB 3.67Å; D58-F87 VanDerWaalsContact O-CB 3.29Å; D58-F87 WeakPolarHBondContact O-CB 3.23Å; D58-F87 WeakPolarHBondContact O-CD2 3.39Å; D58-F87 VanDerWaalsContact O-CG 3.3Å; D58-F87 WeakPolarHBondContact O-CG 3.41Å
59	F	74.5	Confident	66.1	Low	10 Å²	10	44.6 Å²	44.6	4%	0.044	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-21.2	-179.9	57.4	-93.7	0	0	0	115.1	L57 L75 L79 H85 I103	L57-F59 HydrophobicContact CB-CE1 4.07Å; L57-F59 HydrophobicContact CB-CE2 4.39Å; L57-F59 HydrophobicContact CB-CZ 3.99Å; L57-F59 HydrophobicContact CD2-CE1 4.11Å; L57-F59 HydrophobicContact CD2-CE2 3.77Å; L57-F59 HydrophobicContact CD2-CZ 3.32Å; L57-F59 HydrophobicContact CG-CE1 3.77Å; L57-F59 HydrophobicContact CG-CE2 4.25Å; L57-F59 HydrophobicContact CG-CZ 3.51Å; L57-F59 PolarHBondContact O-N 3.44Å; F59-L75 HydrophobicContact CE2-CD2 3.99Å; F59-L75 HydrophobicContact CE2-CG 3.92Å; F59-L75 HydrophobicContact CZ-CD2 4.43Å; F59-L75 HydrophobicContact CZ-CG 4Å; F59-L79 HydrophobicContact CD2-CD1 3.52Å; F59-L79 HydrophobicContact CE1-CB 4.04Å; F59-L79 HydrophobicContact CE1-CD1 4.21Å; F59-L79 HydrophobicContact CE2-CB 4.25Å; F59-L79 HydrophobicContact CE2-CD1 2.93Å; F59-L79 HydrophobicContact CE2-CG 4.17Å; F59-L79 HydrophobicContact CG-CD1 4.37Å; F59-L79 HydrophobicContact CZ-CB 3.86Å; F59-L79 HydrophobicContact CZ-CD1 3.33Å; F59-L79 HydrophobicContact CZ-CG 4.22Å; F59-H85 HydrophobicContact CB-CB 4.05Å; F59-I103 PolarHBondContact O-N 3.49Å
60	V	78.3	Confident	66.6	Low	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	125.2	177.8	-168.9	0	0	0	0	110.3	N52 L57 D62 I67 L75 I103 L105	N52-V60 PolarHBondContact OD1-O 2.8Å; L57-V60 HydrophobicContact CD2-CG2 4.23Å; V60-D62 HydrophobicContact CG1-CB 4.37Å; V60-I67 HydrophobicContact CG1-CD1 4.14Å; V60-L75 HydrophobicContact CG2-CD2 3.69Å; V60-I103 CarbonylContact C-O 3.56Å; V60-I103 WeakPolarHBondContact CA-O 3.19Å; V60-I103 HydrophobicContact CG1-CB 4.43Å; V60-I103 HydrophobicContact CG1-CG2 4.41Å; V60-I103 HydrophobicContact CG2-CB 4.36Å; V60-L105 HydrophobicContact CG1-CB 4.47Å
61	C	79.2	Confident	67.2	Low	0 Å²	0	45 Å²	45	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	105.8	164.1	179.5	0	0	0	0	110	F48 C50 I103 L104 L105 W151	F48-C61 WeakPolarHBondContact CE1-SG 3.48Å; C50-C61 VanDerWaalsContact CA-SG 3.53Å; C50-C61 HydrophobicContact CB-CB 3.8Å; C50-C61 WeakPolarHBondContact CB-SG 3.44Å; C50-C61 WeakPolarHBondContact SG-CB 3.5Å; C50-C61 CovalentContact SG-SG 2Å; C50-C61 PolarHBondContact SG-SG 3.39Å; C61-I103 PolarHBondContact N-O 2.98Å; C61-L104 HydrophobicContact CB-CD1 3.81Å; C61-L105 PolarHBondContact O-N 3.03Å; C61-W151 HydrophobicContact CB-CH2 3.57Å; C61-W151 HydrophobicContact CB-CZ2 4.14Å; C61-W151 HydrophobicContact CB-CZ3 4.41Å
62	D	78.4	Confident	68	Low	1 Å²	1	43 Å²	43	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	95.9	174.9	176.3	18	0	0	0	109.5	Y54 L55 V60 D64 L65 L66 I67	Y54-D62 WeakPolarHBondContact OH-CB 3.25Å; Y54-D62 PolarHBondContact OH-O 2.74Å; Y54-D62 PolarHBondContact OH-OD2 2.95Å; L55-D62 HydrophobicContact CD1-CB 3.87Å; V60-D62 HydrophobicContact CG1-CB 4.37Å; D62-D64 PolarHBondContact OD1-N 3.01Å; D62-L65 PolarHBondContact OD1-N 3.28Å; D62-L65 VanDerWaalsContact OD1-N 3.13Å; D62-L65 WeakPolarHBondContact OD2-CA 3.27Å; D62-L66 VanDerWaalsContact CG-N 3.26Å; D62-L66 PolarHBondContact OD1-N 3.11Å; D62-L66 PolarHBondContact OD2-N 2.88Å; D62-I67 PolarHBondContact OD2-N 3.29Å
63	R	72.1	Confident	68.7	Low	76 Å²	76	46.3 Å²	46.3	29%	0.287	24%	0.244	S	C	.	.	S	Bend	trans	-76.8	-30.4	-176.4	175.5	176.4	167.9	164.6	-2.1	112.7	L42 N47 F48 L105 V106	L42-R63 PolarHBondContact O-NH2 3.31Å; N47-R63 PolarHBondContact O-NH1 2.85Å; F48-R63 HydrophobicContact CE1-CB 4.02Å; F48-R63 HydrophobicContact CZ-CB 3.72Å; F48-R63 HydrophobicContact CZ-CG 4.26Å; R63-L105 PolarHBondContact N-O 3.32Å; R63-V106 HydrophobicContact CB-CG1 4.4Å
64	D	72.6	Confident	69.6	Low	30 Å²	30	47.1 Å²	47.1	16%	0.16	24%	0.24	C	C	.	.	S	Bend	trans	-99.9	9.4	-172.5	-71.7	-57.2	0	0	0	112.9	H41 D62 L66 K107	H41-D64 IonicContact ND1-OD1 3.98Å; D62-D64 PolarHBondContact OD1-N 3.01Å; D64-L66 VanDerWaalsContact C-N 3.26Å; D64-L66 HydrophobicContact CB-CD1 4.14Å; D64-L66 HydrophobicContact CB-CG 3.97Å; D64-L66 PolarHBondContact O-N 2.86Å; D64-K107 HydrophobicContact CB-CB 4.05Å; D64-K107 WeakPolarHBondContact OD2-CA 3.36Å; D64-K107 VanDerWaalsContact OD2-CB 3.24Å; D64-K107 WeakPolarHBondContact OD2-CB 3.3Å; D64-K107 PolarHBondContact OD2-N 3.01Å
65	L	75.3	Confident	70.7	Confident	117 Å²	117	45.3 Å²	45.3	61%	0.613	23%	0.232	S	C	*	.			trans	55.8	41.4	-177.4	-54.1	170.2	0	0	0	111.8	Y54 D62 I67	Y54-L65 HydrophobicContact CD1-CD2 3.98Å; Y54-L65 HydrophobicContact CD2-CD2 4.1Å; Y54-L65 HydrophobicContact CE1-CD2 3.5Å; Y54-L65 HydrophobicContact CE2-CD2 3.62Å; Y54-L65 HydrophobicContact CG-CD2 4.26Å; D62-L65 PolarHBondContact OD1-N 3.28Å; D62-L65 VanDerWaalsContact OD1-N 3.13Å; D62-L65 WeakPolarHBondContact OD2-CA 3.27Å; L65-I67 VanDerWaalsContact C-N 3.26Å; L65-I67 PolarHBondContact O-N 3.33Å
66	L	75.6	Confident	71.4	Confident	39 Å²	39	48.1 Å²	48.1	20%	0.204	25%	0.248	C	C	.	.			trans	-74	-16	179.5	-69.9	166.5	0	0	0	112.8	D62 D64 L105 K107 Y169 S229	D62-L66 VanDerWaalsContact CG-N 3.26Å; D62-L66 PolarHBondContact OD1-N 3.11Å; D62-L66 PolarHBondContact OD2-N 2.88Å; D64-L66 VanDerWaalsContact C-N 3.26Å; D64-L66 HydrophobicContact CB-CD1 4.14Å; D64-L66 HydrophobicContact CB-CG 3.97Å; D64-L66 PolarHBondContact O-N 2.86Å; L66-L105 HydrophobicContact CB-CD2 3.64Å; L66-L105 HydrophobicContact CB-CG 4.12Å; L66-L105 HydrophobicContact CD1-CD1 4.1Å; L66-L105 HydrophobicContact CD1-CD2 4.2Å; L66-L105 HydrophobicContact CD1-CG 3.7Å; L66-K107 HydrophobicContact CD1-CB 4.39Å; L66-Y169 HydrophobicContact CD1-CD2 4.11Å; L66-Y169 HydrophobicContact CD1-CE2 3.97Å; L66-Y169 HydrophobicContact CD2-CE2 4.45Å; L66-S229 PolarHBondContact O-OG 3.43Å
67	I	75.9	Confident	72	Confident	3 Å²	3	49.8 Å²	49.8	2%	0.015	25%	0.249	C	C	.	.	S	Bend	trans	-114	130	176.8	-59.1	173	0	0	0	108.9	L55 V60 D62 L65 E71 A72 L75 L105 V233	L55-I67 HydrophobicContact CD2-CB 4.28Å; L55-I67 HydrophobicContact CD2-CG2 4.11Å; V60-I67 HydrophobicContact CG1-CD1 4.14Å; D62-I67 PolarHBondContact OD2-N 3.29Å; L65-I67 VanDerWaalsContact C-N 3.26Å; L65-I67 PolarHBondContact O-N 3.33Å; I67-E71 HydrophobicContact CG2-CB 3.66Å; I67-A72 HydrophobicContact CG2-CB 4.41Å; I67-L75 HydrophobicContact CD1-CD2 4.32Å; I67-L105 HydrophobicContact CD1-CD2 3.65Å; I67-L105 HydrophobicContact CG1-CD2 3.59Å; I67-V233 HydrophobicContact CD1-CG2 4.34Å
68	S	74.3	Confident	72.2	Confident	49 Å²	49	52.3 Å²	52.3	34%	0.343	27%	0.267	S	S	.	.			trans	-75.2	156.8	174	65.7	0	0	0	0	112.3	T70 E71 A72	S68-T70 PolarHBondContact O-N 3.26Å; S68-T70 PolarHBondContact OG-OG1 3.48Å; S68-E71 WeakPolarHBondContact CB-OE2 3.41Å; S68-E71 PolarHBondContact N-OE2 3.21Å; S68-E71 PolarHBondContact O-N 3.41Å; S68-E71 VanDerWaalsContact O-N 3.16Å; S68-E71 WeakPolarHBondContact OG-CG 3.25Å; S68-E71 PolarHBondContact OG-N 2.98Å; S68-E71 PolarHBondContact OG-OE2 3.43Å; S68-A72 PolarHBondContact O-N 3.04Å
69	H	69.9	Low	72.3	Confident	118 Å²	118	49.9 Å²	49.9	55%	0.546	25%	0.254	S	S	.	.	H	α-helix	trans	-55.7	-35.8	177.9	-77	-78.8	0	0	0	113.8	Y54 A72 V73	Y54-H69 AromaticContact CD2-CE1 3.69Å; Y54-H69 PolarHBondContact O-CE1 3.09Å; Y54-H69 PolarHBondContact O-ND1 3.41Å; H69-A72 WeakPolarHBondContact O-CB 2.98Å; H69-A72 PolarHBondContact O-N 3.05Å; H69-V73 WeakPolarHBondContact O-CG2 3.45Å; H69-V73 PolarHBondContact O-N 2.86Å
70	T	69	Low	71.5	Confident	102 Å²	102	51.8 Å²	51.8	63%	0.626	27%	0.271	S	S	*	.	H	α-helix	trans	-69.7	-41.3	179.1	45.4	0	0	0	0	111.7	S68 A72 V73 I74	S68-T70 PolarHBondContact O-N 3.26Å; S68-T70 PolarHBondContact OG-OG1 3.48Å; T70-A72 VanDerWaalsContact C-N 3.33Å; T70-V73 PolarHBondContact O-N 3.35Å; T70-I74 WeakPolarHBondContact O-CG1 2.98Å; T70-I74 PolarHBondContact O-N 3.01Å
71	E	74.3	Confident	70.5	Confident	16 Å²	16	58.2 Å²	58.2	8%	0.075	31%	0.306	C	S	.	.	H	α-helix	trans	-65	-38.5	174.8	-71	169	137.7	0	0	111.7	I67 S68 V73 I74 L75 F226 S227 M230	I67-E71 HydrophobicContact CG2-CB 3.66Å; S68-E71 WeakPolarHBondContact CB-OE2 3.41Å; S68-E71 PolarHBondContact N-OE2 3.21Å; S68-E71 PolarHBondContact O-N 3.41Å; S68-E71 VanDerWaalsContact O-N 3.16Å; S68-E71 WeakPolarHBondContact OG-CG 3.25Å; S68-E71 PolarHBondContact OG-N 2.98Å; S68-E71 PolarHBondContact OG-OE2 3.43Å; E71-V73 PolarHBondContact O-N 3.5Å; E71-I74 WeakPolarHBondContact O-CB 3.25Å; E71-I74 PolarHBondContact O-N 2.93Å; E71-L75 WeakPolarHBondContact O-CB 2.99Å; E71-L75 PolarHBondContact O-N 2.89Å; E71-F226 HydrophobicContact CG-CD1 4.05Å; E71-S227 VanDerWaalsContact CD-OG 3.3Å; E71-S227 VanDerWaalsContact OE1-CB 3.27Å; E71-S227 WeakPolarHBondContact OE1-CB 3.12Å; E71-S227 PolarHBondContact OE1-N 2Å; E71-S227 PolarHBondContact OE1-OG 2.72Å; E71-S227 PolarHBondContact OE2-OG 3.45Å; E71-M230 HydrophobicContact CB-CB 4.36Å; E71-M230 HydrophobicContact CB-CE 4.23Å; E71-M230 HydrophobicContact CB-CG 3.94Å; E71-M230 HydrophobicContact CB-SD 4.06Å; E71-M230 HydrophobicContact CG-CB 4.23Å; E71-M230 HydrophobicContact CG-CG 3.95Å; E71-M230 VanDerWaalsContact O-CE 3.31Å; E71-M230 WeakPolarHBondContact O-CE 3.25Å; E71-M230 WeakPolarHBondContact OE1-CB 3.45Å
72	A	70.8	Confident	69.8	Low	1 Å²	1	64 Å²	64	1%	0.008	33%	0.331	C	S	.	.	H	α-helix	trans	-54.7	-52.5	175.5	0	0	0	0	0	111.6	L55 L57 I67 S68 H69 T70 I74 L75 N76	L55-A72 HydrophobicContact CB-CB 4.11Å; L55-A72 HydrophobicContact CD2-CB 3.22Å; L55-A72 HydrophobicContact CG-CB 4.23Å; L57-A72 HydrophobicContact CD1-CB 3.79Å; L57-A72 VanDerWaalsContact CD1-O 3.27Å; L57-A72 WeakPolarHBondContact CD1-O 3.48Å; L57-A72 HydrophobicContact CD2-CB 4.37Å; L57-A72 WeakPolarHBondContact CD2-O 3.41Å; I67-A72 HydrophobicContact CG2-CB 4.41Å; S68-A72 PolarHBondContact O-N 3.04Å; H69-A72 WeakPolarHBondContact O-CB 2.98Å; H69-A72 PolarHBondContact O-N 3.05Å; T70-A72 VanDerWaalsContact C-N 3.33Å; A72-I74 PolarHBondContact O-N 3.1Å; A72-L75 CarbonylContact O-C 3.55Å; A72-L75 WeakPolarHBondContact O-CA 3.49Å; A72-L75 WeakPolarHBondContact O-CB 3.2Å; A72-L75 PolarHBondContact O-N 2.99Å; A72-N76 PolarHBondContact O-N 2.99Å
73	V	68	Low	69.6	Low	81 Å²	81	64.8 Å²	64.8	49%	0.491	33%	0.334	S	S	.	.	H	α-helix	trans	-58.4	-37.2	-179.6	174.3	0	0	0	0	111.8	H69 T70 E71	H69-V73 WeakPolarHBondContact O-CG2 3.45Å; H69-V73 PolarHBondContact O-N 2.86Å; T70-V73 PolarHBondContact O-N 3.35Å; E71-V73 PolarHBondContact O-N 3.5Å
74	I	69.8	Low	69.5	Low	76 Å²	76	61.3 Å²	61.3	39%	0.39	32%	0.322	S	S	.	.	H	α-helix	trans	-67	-45.1	175.4	-64.5	167.5	0	0	0	110.5	T70 E71 A72 N76 R77 S78 F226 M230	T70-I74 WeakPolarHBondContact O-CG1 2.98Å; T70-I74 PolarHBondContact O-N 3.01Å; E71-I74 WeakPolarHBondContact O-CB 3.25Å; E71-I74 PolarHBondContact O-N 2.93Å; A72-I74 PolarHBondContact O-N 3.1Å; I74-N76 VanDerWaalsContact C-N 3.33Å; I74-N76 PolarHBondContact O-N 3.49Å; I74-R77 PolarHBondContact O-N 2.98Å; I74-S78 PolarHBondContact O-N 3.22Å; I74-F226 HydrophobicContact CD1-CE1 3.76Å; I74-F226 HydrophobicContact CD1-CZ 4.15Å; I74-M230 HydrophobicContact CB-CE 4.24Å; I74-M230 HydrophobicContact CG2-CE 4.12Å
75	L	72.2	Confident	69.5	Low	0 Å²	0	62 Å²	62	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-64.8	-33.9	179.3	-177.4	64.1	0	0	0	112.7	L57 F59 V60 I67 E71 A72 R77 S78 L79 M230 V233 L234 V237	L57-L75 HydrophobicContact CD2-CB 3.7Å; L57-L75 HydrophobicContact CD2-CD2 3.59Å; L57-L75 HydrophobicContact CD2-CG 3.7Å; F59-L75 HydrophobicContact CE2-CD2 3.99Å; F59-L75 HydrophobicContact CE2-CG 3.92Å; F59-L75 HydrophobicContact CZ-CD2 4.43Å; F59-L75 HydrophobicContact CZ-CG 4Å; V60-L75 HydrophobicContact CG2-CD2 3.69Å; I67-L75 HydrophobicContact CD1-CD2 4.32Å; E71-L75 WeakPolarHBondContact O-CB 2.99Å; E71-L75 PolarHBondContact O-N 2.89Å; A72-L75 CarbonylContact O-C 3.55Å; A72-L75 WeakPolarHBondContact O-CA 3.49Å; A72-L75 WeakPolarHBondContact O-CB 3.2Å; A72-L75 PolarHBondContact O-N 2.99Å; L75-R77 VanDerWaalsContact C-N 3.29Å; L75-R77 PolarHBondContact O-N 3.38Å; L75-S78 PolarHBondContact O-N 3.16Å; L75-S78 PolarHBondContact O-OG 3.29Å; L75-L79 HydrophobicContact CD1-CD1 3.71Å; L75-L79 HydrophobicContact CG-CD1 3.99Å; L75-L79 PolarHBondContact O-N 2.75Å; L75-M230 HydrophobicContact CB-CE 3.83Å; L75-M230 HydrophobicContact CB-SD 4.16Å; L75-M230 HydrophobicContact CD2-SD 4.42Å; L75-V233 HydrophobicContact CD1-CG1 3.77Å; L75-V233 HydrophobicContact CD2-CG1 3.63Å; L75-V233 HydrophobicContact CG-CG1 4.38Å; L75-L234 HydrophobicContact CD1-CD2 4.03Å; L75-V237 HydrophobicContact CD1-CG2 4.31Å
76	N	69.5	Low	69	Low	66 Å²	66	56.7 Å²	56.7	35%	0.353	30%	0.297	S	S	.	.	H	α-helix	trans	-61.5	-39.7	174.9	-163.7	18.5	0	0	0	111.7	L57 A72 I74 S78 L79 A80	L57-N76 HydrophobicContact CD1-CB 3.83Å; L57-N76 HydrophobicContact CG-CB 4.07Å; A72-N76 PolarHBondContact O-N 2.99Å; I74-N76 VanDerWaalsContact C-N 3.33Å; I74-N76 PolarHBondContact O-N 3.49Å; N76-S78 VanDerWaalsContact C-N 3.32Å; N76-S78 PolarHBondContact O-N 3.16Å; N76-L79 PolarHBondContact O-N 2.84Å; N76-A80 VanDerWaalsContact O-CB 3.31Å; N76-A80 WeakPolarHBondContact O-CB 3.41Å; N76-A80 PolarHBondContact O-N 3.42Å; N76-A80 VanDerWaalsContact O-N 3.09Å
77	R	66.7	Low	68.4	Low	204 Å²	204	55.3 Å²	55.3	77%	0.77	29%	0.289	S	S	*	.	H	α-helix	trans	-67	-31	178.7	-68.7	-179.8	179.9	175.9	0	113	I74 L75	I74-R77 PolarHBondContact O-N 2.98Å; L75-R77 VanDerWaalsContact C-N 3.29Å; L75-R77 PolarHBondContact O-N 3.38Å
78	S	65.1	Low	67.5	Low	55 Å²	55	57.5 Å²	57.5	39%	0.385	31%	0.305	S	S	.	.	H	α-helix	trans	-80.4	-18	-179.2	63.3	0	0	0	0	113.8	I74 L75 N76	I74-S78 PolarHBondContact O-N 3.22Å; L75-S78 PolarHBondContact O-N 3.16Å; L75-S78 PolarHBondContact O-OG 3.29Å; N76-S78 VanDerWaalsContact C-N 3.32Å; N76-S78 PolarHBondContact O-N 3.16Å
79	L	66.2	Low	66.4	Low	4 Å²	4	60.4 Å²	60.4	2%	0.021	32%	0.32	C	S	.	.	H	α-helix	trans	-111.4	-31	-172.7	-81.6	165.8	0	0	0	115.3	F59 L75 N76 N81 K82 F83 L101 V237	F59-L79 HydrophobicContact CD2-CD1 3.52Å; F59-L79 HydrophobicContact CE1-CB 4.04Å; F59-L79 HydrophobicContact CE1-CD1 4.21Å; F59-L79 HydrophobicContact CE2-CB 4.25Å; F59-L79 HydrophobicContact CE2-CD1 2.93Å; F59-L79 HydrophobicContact CE2-CG 4.17Å; F59-L79 HydrophobicContact CG-CD1 4.37Å; F59-L79 HydrophobicContact CZ-CB 3.86Å; F59-L79 HydrophobicContact CZ-CD1 3.33Å; F59-L79 HydrophobicContact CZ-CG 4.22Å; L75-L79 HydrophobicContact CD1-CD1 3.71Å; L75-L79 HydrophobicContact CG-CD1 3.99Å; L75-L79 PolarHBondContact O-N 2.75Å; N76-L79 PolarHBondContact O-N 2.84Å; L79-N81 PolarHBondContact O-N 3.19Å; L79-K82 PolarHBondContact O-N 2.81Å; L79-F83 HydrophobicContact CD2-CD2 3.4Å; L79-F83 HydrophobicContact CD2-CE2 3.79Å; L79-F83 HydrophobicContact CD2-CG 4.45Å; L79-F83 PolarHBondContact O-N 3.5Å; L79-L101 HydrophobicContact CD2-CD2 4Å; L79-V237 HydrophobicContact CD1-CG1 4.36Å; L79-V237 HydrophobicContact CD1-CG2 3.69Å; L79-V237 HydrophobicContact CD2-CB 4.22Å; L79-V237 HydrophobicContact CD2-CG1 3.4Å; L79-V237 VanDerWaalsContact CD2-CG1 3.4Å; L79-V237 HydrophobicContact CD2-CG2 3.82Å; L79-V237 HydrophobicContact CG-CG1 3.75Å; L79-V237 HydrophobicContact CG-CG2 4.02Å
80	A	57.6	Low	65.4	Low	49 Å²	49	61.1 Å²	61.1	41%	0.405	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-25.2	-170.3	0	0	0	0	0	115	N76	N76-A80 VanDerWaalsContact O-CB 3.31Å; N76-A80 WeakPolarHBondContact O-CB 3.41Å; N76-A80 PolarHBondContact O-N 3.42Å; N76-A80 VanDerWaalsContact O-N 3.09Å
81	N	58.8	Low	64.4	Low	136 Å²	136	65.8 Å²	65.8	73%	0.727	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-22.5	-173.9	-69.6	-2.5	0	0	0	114.2	L79 K98	L79-N81 PolarHBondContact O-N 3.19Å; N81-K98 WeakPolarHBondContact O-CE 3.38Å
82	K	64.6	Low	63	Low	120 Å²	120	71.2 Å²	71.2	52%	0.522	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.2	-27.5	-172.5	-73.8	-174.5	173.4	-170.2	0	115.5	L79 N241	L79-K82 PolarHBondContact O-N 2.81Å; K82-N241 VanDerWaalsContact CD-OD1 3.23Å; K82-N241 WeakPolarHBondContact CD-OD1 3.45Å
83	F	72.7	Confident	61.7	Low	18 Å²	18	81 Å²	81	8%	0.079	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	140.5	-173.9	-58.5	-70.4	0	0	0	112	L79 Y99 L101 L240 N241 M244	L79-F83 HydrophobicContact CD2-CD2 3.4Å; L79-F83 HydrophobicContact CD2-CE2 3.79Å; L79-F83 HydrophobicContact CD2-CG 4.45Å; L79-F83 PolarHBondContact O-N 3.5Å; F83-Y99 WeakPolarHBondContact CA-O 3.37Å; F83-L101 HydrophobicContact CB-CB 3.86Å; F83-L101 HydrophobicContact CB-CD2 4.26Å; F83-L101 HydrophobicContact CD1-CB 4.08Å; F83-L101 HydrophobicContact CD1-CD2 4.19Å; F83-L101 HydrophobicContact CD2-CD2 3.89Å; F83-L101 HydrophobicContact CE2-CD2 4.31Å; F83-L101 HydrophobicContact CG-CB 4.01Å; F83-L101 HydrophobicContact CG-CD2 3.8Å; F83-L240 HydrophobicContact CZ-CB 4.38Å; F83-N241 WeakPolarHBondContact CE2-OD1 3.46Å; F83-M244 HydrophobicContact CD1-CE 4.35Å; F83-M244 HydrophobicContact CE1-CE 3.16Å; F83-M244 HydrophobicContact CE1-SD 3.65Å; F83-M244 HydrophobicContact CZ-CE 3.37Å; F83-M244 HydrophobicContact CZ-SD 4.35Å
84	A	71.5	Confident	60.9	Low	4 Å²	4	81 Å²	81	3%	0.033	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	165.5	166	0	0	0	0	0	109.6	D94 K98 Y99 K100 L101	A84-D94 WeakPolarHBondContact CB-OD2 3.35Å; A84-K98 HydrophobicContact CB-CB 3.74Å; A84-Y99 PolarHBondContact N-O 3.11Å; A84-K100 HydrophobicContact CB-CG 3.78Å; A84-K100 CarbonylContact O-C 3.09Å; A84-K100 VanDerWaalsContact O-CA 3.28Å; A84-K100 WeakPolarHBondContact O-CA 3.23Å; A84-L101 PolarHBondContact O-N 3.29Å
85	H	71.8	Confident	59.9	Low	44 Å²	44	82.9 Å²	82.9	20%	0.204	41%	0.413	C	S	.	.			trans	-143.3	143.4	173.1	58.6	63.7	0	0	0	112.3	D58 F59 F87 S88	D58-H85 WeakPolarHBondContact CB-CE1 3.06Å; D58-H85 WeakPolarHBondContact CB-ND1 3.05Å; D58-H85 WeakPolarHBondContact CB-NE2 3.33Å; D58-H85 IonicContact OD2-CE1 3.25Å; D58-H85 PolarHBondContact OD2-CE1 3.01Å; D58-H85 VanDerWaalsContact OD2-CE1 3.32Å; D58-H85 IonicContact OD2-NE2 3.59Å; F59-H85 HydrophobicContact CB-CB 4.05Å; H85-F87 PolarHBondContact ND1-N 3.47Å; H85-F87 PolarHBondContact O-N 2.99Å; H85-S88 PolarHBondContact ND1-N 3.06Å
86	C	65.4	Low	59.1	Low	5 Å²	5	90.7 Å²	90.7	3%	0.034	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	0	178.6	-77	0	0	0	0	114.8	V153 C159 K160 T161	C86-V153 VanDerWaalsContact O-CG2 3.28Å; C86-V153 WeakPolarHBondContact O-CG2 3.2Å; C86-C159 WeakPolarHBondContact CA-SG 3.26Å; C86-C159 HydrophobicContact CB-CB 3.7Å; C86-C159 WeakPolarHBondContact CB-SG 3.48Å; C86-C159 WeakPolarHBondContact SG-CB 3.19Å; C86-C159 CovalentContact SG-SG 2.04Å; C86-C159 PolarHBondContact SG-SG 3.43Å; C86-K160 VanDerWaalsContact SG-C 3.59Å; C86-T161 HydrophobicContact CB-CG2 4.12Å
87	F	63.4	Low	58.8	Low	10 Å²	10	93.3 Å²	93.3	4%	0.044	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-8.3	-176	-79.4	-72.3	0	0	0	115.9	I23 A25 C50 N52 D58 H85 V89 W151 V153	I23-F87 HydrophobicContact CG2-CZ 4.11Å; A25-F87 HydrophobicContact CB-CD1 3.87Å; A25-F87 HydrophobicContact CB-CE1 3.64Å; C50-F87 HydrophobicContact CB-CZ 4.49Å; N52-F87 WeakPolarHBondContact ND2-CG 3.23Å; D58-F87 HydrophobicContact CB-CB 3.67Å; D58-F87 VanDerWaalsContact O-CB 3.29Å; D58-F87 WeakPolarHBondContact O-CB 3.23Å; D58-F87 WeakPolarHBondContact O-CD2 3.39Å; D58-F87 VanDerWaalsContact O-CG 3.3Å; D58-F87 WeakPolarHBondContact O-CG 3.41Å; H85-F87 PolarHBondContact ND1-N 3.47Å; H85-F87 PolarHBondContact O-N 2.99Å; F87-V89 PolarHBondContact O-N 3.39Å; F87-W151 AromaticContact CD2-NE1 3.49Å; F87-W151 AromaticContact CE2-CD1 3.73Å; F87-W151 HydrophobicContact CE2-CD2 4.27Å; F87-W151 AromaticContact CE2-CE2 3.36Å; F87-W151 HydrophobicContact CE2-CG 4.5Å; F87-W151 AromaticContact CE2-CZ2 3.63Å; F87-W151 HydrophobicContact CE2-CZ2 3.63Å; F87-W151 AromaticContact CE2-NE1 3.03Å; F87-W151 HydrophobicContact CZ-CZ2 4.41Å; F87-W151 AromaticContact CZ-NE1 3.95Å; F87-V153 VanDerWaalsContact C-CG2 3.43Å; F87-V153 HydrophobicContact CB-CG2 4.21Å; F87-V153 HydrophobicContact CD1-CG2 3.84Å; F87-V153 HydrophobicContact CG-CG2 4.37Å; F87-V153 WeakPolarHBondContact O-CG2 3.5Å
88	S	57	Low	59	Low	49 Å²	49	87 Å²	87	34%	0.343	44%	0.443	S	S	.	.			trans	-73.6	129.5	177.4	-169.1	0	0	0	0	110	H85 D90	H85-S88 PolarHBondContact ND1-N 3.06Å; S88-D90 PolarHBondContact OG-N 3.44Å
89	V	50	Low	59.6	Low	110 Å²	110	86 Å²	86	67%	0.667	43%	0.431	S	S	*	.	S	Bend	trans	-74	-21.7	172.4	-177	0	0	0	0	110.7	F87 K91	F87-V89 PolarHBondContact O-N 3.39Å; V89-K91 PolarHBondContact O-N 3.46Å
90	D	49.6	Very low	60.4	Low	134 Å²	134	88.9 Å²	88.9	72%	0.717	44%	0.443	S	S	*	.			trans	-79.7	92.6	-174.5	-65.8	-23.2	0	0	0	110.2	S88 I92	S88-D90 PolarHBondContact OG-N 3.44Å; D90-I92 PolarHBondContact O-N 3.4Å
91	K	46.9	Very low	61.7	Low	199 Å²	199	86.5 Å²	86.5	87%	0.865	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	2	-178.6	-84.4	-170.2	174.3	-171.8	0	116.6	V89	V89-K91 PolarHBondContact O-N 3.46Å
92	I	45.7	Very low	63	Low	131 Å²	131	80 Å²	80	67%	0.672	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.3	-12.3	-152.7	-53.4	-176.8	0	0	0	115.7	D90	D90-I92 PolarHBondContact O-N 3.4Å
93	Y	43.4	Very low	64.1	Low	206 Å²	206	74.3 Å²	74.3	81%	0.808	37%	0.365	S	S	*	.			trans	-146.9	32.8	-176	-75.6	-75.7	0	0	0	116.9	I95	Y93-I95 PolarHBondContact O-N 3.3Å
94	D	51.1	Low	64.9	Low	82 Å²	82	73.5 Å²	73.5	44%	0.439	36%	0.361	S	S	.	.			trans	-89.1	95.6	166.4	-121.1	-17.2	0	0	0	109.1	A84 D96	A84-D94 WeakPolarHBondContact CB-OD2 3.35Å; D94-D96 PolarHBondContact O-N 3.16Å
95	I	49.4	Very low	65.6	Low	114 Å²	114	73.3 Å²	73.3	59%	0.585	36%	0.359	S	S	*	.			trans	-47.3	130.7	171.9	-58.6	160.9	0	0	0	108.1	Y93 E97 K98	Y93-I95 PolarHBondContact O-N 3.3Å; I95-E97 HydrophobicContact CG2-CB 4.14Å; I95-E97 HydrophobicContact CG2-CG 4.11Å; I95-E97 PolarHBondContact O-N 3.4Å; I95-K98 PolarHBondContact O-N 3.03Å
96	D	54.9	Low	66.3	Low	164 Å²	164	71.2 Å²	71.2	88%	0.877	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-5.4	-176.7	-83.3	-42.4	0	0	0	115	D94	D94-D96 PolarHBondContact O-N 3.16Å
97	E	62.2	Low	67.2	Low	122 Å²	122	75.9 Å²	75.9	57%	0.57	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-11.9	-174.7	-65	-169	-157.7	0	0	115.5	I95	I95-E97 HydrophobicContact CG2-CB 4.14Å; I95-E97 HydrophobicContact CG2-CG 4.11Å; I95-E97 PolarHBondContact O-N 3.4Å
98	K	71.8	Confident	68.1	Low	72 Å²	72	79.4 Å²	79.4	31%	0.313	39%	0.385	S	S	.	.	S	Bend	trans	-97.9	132	-177.3	-70.5	-175.1	180	179.7	0	112.7	N81 A84 I95 K100	N81-K98 WeakPolarHBondContact O-CE 3.38Å; A84-K98 HydrophobicContact CB-CB 3.74Å; I95-K98 PolarHBondContact O-N 3.03Å; K98-K100 PolarHBondContact O-N 2.72Å
99	Y	77.5	Confident	69.3	Low	33 Å²	33	77.1 Å²	77.1	13%	0.129	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	132	172.3	-65	-70.2	0	0	0	111.5	F83 A84 L101 D162 L199 M244 M248	F83-Y99 WeakPolarHBondContact CA-O 3.37Å; A84-Y99 PolarHBondContact N-O 3.11Å; Y99-L101 PolarHBondContact O-N 3.23Å; Y99-D162 HydrophobicContact CD1-CB 4.36Å; Y99-L199 HydrophobicContact CD1-CD1 4.03Å; Y99-L199 HydrophobicContact CD1-CD2 4.08Å; Y99-L199 HydrophobicContact CD1-CG 4.28Å; Y99-L199 HydrophobicContact CE1-CD1 4.25Å; Y99-L199 HydrophobicContact CE1-CD2 3.47Å; Y99-L199 VanDerWaalsContact CE1-CD2 3.47Å; Y99-L199 HydrophobicContact CE1-CG 4.02Å; Y99-M244 HydrophobicContact CD2-CG 4.44Å; Y99-M244 HydrophobicContact CD2-SD 3.62Å; Y99-M244 HydrophobicContact CE2-CB 4.46Å; Y99-M244 HydrophobicContact CE2-CG 4.34Å; Y99-M244 HydrophobicContact CE2-SD 4.08Å; Y99-M244 HydrophobicContact CG-SD 4.07Å; Y99-M248 HydrophobicContact CE1-SD 3.7Å; Y99-M248 HydrophobicContact CE2-SD 4.3Å; Y99-M248 PolarHBondContact OH-SD 3.44Å
100	K	82.8	Confident	70.6	Confident	64 Å²	64	71.9 Å²	71.9	28%	0.278	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	109.6	176.8	-70.7	165.6	178.9	176.2	0	111	A84 K98 K160 D162 I163	A84-K100 HydrophobicContact CB-CG 3.78Å; A84-K100 CarbonylContact O-C 3.09Å; A84-K100 VanDerWaalsContact O-CA 3.28Å; A84-K100 WeakPolarHBondContact O-CA 3.23Å; K98-K100 PolarHBondContact O-N 2.72Å; K100-K160 WeakPolarHBondContact CD-O 3.33Å; K100-D162 PolarHBondContact N-OD2 2.78Å; K100-D162 PolarHBondContact O-N 2.87Å; K100-I163 PolarHBondContact O-N 3.32Å
101	L	85.3	Confident	71.7	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	138	-176.8	-179.5	63.1	0	0	0	112.1	L79 F83 A84 Y99 I103 I163 L240	L79-L101 HydrophobicContact CD2-CD2 4Å; F83-L101 HydrophobicContact CB-CB 3.86Å; F83-L101 HydrophobicContact CB-CD2 4.26Å; F83-L101 HydrophobicContact CD1-CB 4.08Å; F83-L101 HydrophobicContact CD1-CD2 4.19Å; F83-L101 HydrophobicContact CD2-CD2 3.89Å; F83-L101 HydrophobicContact CE2-CD2 4.31Å; F83-L101 HydrophobicContact CG-CB 4.01Å; F83-L101 HydrophobicContact CG-CD2 3.8Å; A84-L101 PolarHBondContact O-N 3.29Å; Y99-L101 PolarHBondContact O-N 3.23Å; L101-I103 HydrophobicContact CD1-CG1 4.48Å; L101-I103 HydrophobicContact CD2-CD1 4.36Å; L101-I103 HydrophobicContact CD2-CG1 4.43Å; L101-I103 HydrophobicContact CG-CG1 4.33Å; L101-I163 CarbonylContact C-O 3.58Å; L101-I163 WeakPolarHBondContact CA-O 2.91Å; L101-I163 HydrophobicContact CD1-CB 3.74Å; L101-I163 HydrophobicContact CD1-CG2 3.56Å; L101-L240 HydrophobicContact CD1-CD1 3.65Å; L101-L240 HydrophobicContact CD2-CD1 3.92Å; L101-L240 HydrophobicContact CG-CD1 4.48Å
102	G	86	Confident	72.7	Confident	0 Å²	0	58 Å²	58	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	138.6	164.9	0	0	0	0	0	111.1	I163 L164 V165	G102-I163 PolarHBondContact N-O 3.18Å; G102-L164 WeakPolarHBondContact O-CA 3.47Å; G102-L164 WeakPolarHBondContact O-CD1 2.93Å; G102-V165 PolarHBondContact O-N 2.84Å
103	I	88.4	Confident	73.5	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	119.7	171.9	-57.7	178.3	0	0	0	108.2	F59 V60 C61 L101 W151 V165 L167 V233 V237	F59-I103 PolarHBondContact O-N 3.49Å; V60-I103 CarbonylContact C-O 3.56Å; V60-I103 WeakPolarHBondContact CA-O 3.19Å; V60-I103 HydrophobicContact CG1-CB 4.43Å; V60-I103 HydrophobicContact CG1-CG2 4.41Å; V60-I103 HydrophobicContact CG2-CB 4.36Å; C61-I103 PolarHBondContact N-O 2.98Å; L101-I103 HydrophobicContact CD1-CG1 4.48Å; L101-I103 HydrophobicContact CD2-CD1 4.36Å; L101-I103 HydrophobicContact CD2-CG1 4.43Å; L101-I103 HydrophobicContact CG-CG1 4.33Å; I103-W151 WeakPolarHBondContact O-CH2 3.23Å; I103-V165 CarbonylContact C-O 3.57Å; I103-V165 WeakPolarHBondContact CA-O 3.26Å; I103-L167 HydrophobicContact CG2-CD1 4.38Å; I103-V233 HydrophobicContact CD1-CG1 4.1Å; I103-V237 HydrophobicContact CD1-CG2 3.99Å
104	L	87.9	Confident	74.5	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	114.9	174.9	-173.4	60.2	0	0	0	109.6	I23 F48 C61 V106 L147 W151 L164 V165 I166 L167	I23-L104 HydrophobicContact CD1-CD1 4.32Å; I23-L104 HydrophobicContact CD1-CD2 4.28Å; F48-L104 HydrophobicContact CD1-CD1 4.32Å; F48-L104 HydrophobicContact CE1-CD1 3.63Å; F48-L104 HydrophobicContact CE2-CD1 4Å; F48-L104 HydrophobicContact CE2-CD2 4.39Å; F48-L104 HydrophobicContact CZ-CD1 3.42Å; F48-L104 VanDerWaalsContact CZ-CD1 3.42Å; F48-L104 HydrophobicContact CZ-CG 4.39Å; C61-L104 HydrophobicContact CB-CD1 3.81Å; L104-V106 HydrophobicContact CD1-CG1 4.21Å; L104-V106 HydrophobicContact CG-CG1 4.19Å; L104-L147 HydrophobicContact CD2-CD1 3.9Å; L104-W151 HydrophobicContact CB-CH2 4.09Å; L104-W151 HydrophobicContact CB-CZ3 3.89Å; L104-W151 HydrophobicContact CD1-CH2 4.3Å; L104-W151 HydrophobicContact CD1-CZ3 4.09Å; L104-W151 HydrophobicContact CG-CZ3 4.45Å; L104-L164 HydrophobicContact CB-CD1 4.41Å; L104-V165 PolarHBondContact N-O 3.4Å; L104-I166 HydrophobicContact CB-CB 4.32Å; L104-I166 HydrophobicContact CB-CG1 4.01Å; L104-I166 HydrophobicContact CB-CG2 4.21Å; L104-I166 HydrophobicContact CD2-CD1 4.08Å; L104-I166 HydrophobicContact CD2-CG1 4.08Å; L104-I166 HydrophobicContact CD2-CG2 3.99Å; L104-I166 HydrophobicContact CG-CG2 4.29Å; L104-I166 WeakPolarHBondContact O-CA 2.99Å; L104-L167 PolarHBondContact O-N 2.86Å
105	L	86.5	Confident	75.3	Confident	0 Å²	0	51 Å²	51	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	119.2	177	-176	64.2	0	0	0	110.1	V60 C61 R63 L66 I67 L167 Y169 V233	V60-L105 HydrophobicContact CG1-CB 4.47Å; C61-L105 PolarHBondContact O-N 3.03Å; R63-L105 PolarHBondContact N-O 3.32Å; L66-L105 HydrophobicContact CB-CD2 3.64Å; L66-L105 HydrophobicContact CB-CG 4.12Å; L66-L105 HydrophobicContact CD1-CD1 4.1Å; L66-L105 HydrophobicContact CD1-CD2 4.2Å; L66-L105 HydrophobicContact CD1-CG 3.7Å; I67-L105 HydrophobicContact CD1-CD2 3.65Å; I67-L105 HydrophobicContact CG1-CD2 3.59Å; L105-L167 HydrophobicContact CD1-CB 3.72Å; L105-L167 HydrophobicContact CD1-CD1 4.22Å; L105-Y169 HydrophobicContact CD1-CE2 4.33Å; L105-V233 HydrophobicContact CD2-CG2 4.37Å
106	V	86.3	Confident	76.1	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	143.8	-176.2	-69.1	0	0	0	0	112.1	F48 R63 L104 L109 L167 A168 Y169	F48-V106 HydrophobicContact CE2-CG1 3.66Å; F48-V106 HydrophobicContact CZ-CG1 3.46Å; F48-V106 VanDerWaalsContact CZ-CG1 3.46Å; R63-V106 HydrophobicContact CB-CG1 4.4Å; L104-V106 HydrophobicContact CD1-CG1 4.21Å; L104-V106 HydrophobicContact CG-CG1 4.19Å; V106-L109 HydrophobicContact CG2-CB 3.99Å; V106-L109 HydrophobicContact CG2-CD1 4.44Å; V106-L109 HydrophobicContact CG2-CD2 4.43Å; V106-L167 PolarHBondContact N-O 3.22Å; V106-A168 HydrophobicContact CG2-CB 3.84Å; V106-A168 WeakPolarHBondContact O-CA 3.28Å; V106-Y169 PolarHBondContact O-N 3.44Å; V106-Y169 VanDerWaalsContact O-N 3.1Å
107	K	85.2	Confident	76.9	Confident	104 Å²	104	46.6 Å²	46.6	45%	0.452	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	-49.4	174.3	-170.7	176.9	-178	173.6	0	111.2	D64 L66 Y169 H170	D64-K107 HydrophobicContact CB-CB 4.05Å; D64-K107 WeakPolarHBondContact OD2-CA 3.36Å; D64-K107 VanDerWaalsContact OD2-CB 3.24Å; D64-K107 WeakPolarHBondContact OD2-CB 3.3Å; D64-K107 PolarHBondContact OD2-N 3.01Å; L66-K107 HydrophobicContact CD1-CB 4.39Å; K107-Y169 CarbonylContact O-C 3.6Å; K107-Y169 WeakPolarHBondContact O-CB 3.22Å; K107-H170 PolarHBondContact O-N 2.91Å
108	K	81.6	Confident	77.1	Confident	84 Å²	84	52.5 Å²	52.5	37%	0.365	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	121.7	179.8	-61.9	-179.1	178.9	180	0	110.3	L42 A43 H170 M172	L42-K108 HydrophobicContact CD1-CB 4.38Å; A43-K108 VanDerWaalsContact CB-O 3.22Å; A43-K108 WeakPolarHBondContact CB-O 3.11Å; A43-K108 PolarHBondContact N-O 3.43Å; K108-H170 WeakPolarHBondContact CA-O 3.23Å; K108-H170 HydrophobicContact CG-CB 4.13Å; K108-M172 HydrophobicContact CB-CE 4.42Å; K108-M172 HydrophobicContact CD-CE 4.46Å
109	L	82.3	Confident	76.7	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	126.3	176.6	-170.9	65.5	0	0	0	109.7	A43 V106 F140 M143 I166 A168 H170 F171 M172	A43-L109 HydrophobicContact CB-CD1 3.97Å; V106-L109 HydrophobicContact CG2-CB 3.99Å; V106-L109 HydrophobicContact CG2-CD1 4.44Å; V106-L109 HydrophobicContact CG2-CD2 4.43Å; L109-F140 HydrophobicContact CD2-CD2 4.31Å; L109-F140 HydrophobicContact CD2-CE2 3.73Å; L109-M143 HydrophobicContact CD1-SD 4.48Å; L109-M143 HydrophobicContact CD2-CE 3.33Å; L109-M143 HydrophobicContact CD2-SD 4.04Å; L109-M143 HydrophobicContact CG-CE 3.94Å; L109-M143 HydrophobicContact CG-SD 4.21Å; L109-I166 HydrophobicContact CD2-CG2 4.19Å; L109-A168 HydrophobicContact CB-CB 4.23Å; L109-A168 HydrophobicContact CD2-CB 4.39Å; L109-H170 PolarHBondContact N-O 3Å; L109-F171 HydrophobicContact CB-CD2 4.29Å; L109-F171 HydrophobicContact CD2-CD2 4.28Å; L109-F171 HydrophobicContact CG-CD2 4.28Å; L109-F171 CarbonylContact O-C 3.39Å; L109-F171 VanDerWaalsContact O-CA 3.32Å; L109-F171 WeakPolarHBondContact O-CA 3.06Å; L109-F171 WeakPolarHBondContact O-CD2 3.37Å; L109-M172 PolarHBondContact O-N 3.16Å
110	A	78.5	Confident	76	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	131.5	174.2	0	0	0	0	0	111.3	L42 A43 I44 A45 L114 M172	L42-A110 HydrophobicContact CD1-CB 3.59Å; L42-A110 HydrophobicContact CD2-CB 4.08Å; L42-A110 HydrophobicContact CG-CB 3.82Å; A43-A110 PolarHBondContact O-N 2.89Å; I44-A110 CarbonylContact C-O 3.51Å; I44-A110 WeakPolarHBondContact CA-O 3.32Å; A45-A110 PolarHBondContact N-O 3.42Å; A110-L114 HydrophobicContact CB-CD1 4.26Å; A110-L114 HydrophobicContact CB-CG 4.23Å; A110-M172 CarbonylContact C-O 3.57Å; A110-M172 WeakPolarHBondContact CA-O 3.24Å; A110-M172 HydrophobicContact CB-CB 4.41Å
111	L	71.8	Confident	75	Confident	18 Å²	18	56.1 Å²	56.1	9%	0.094	25%	0.252	C	S	.	.	S	Bend	trans	-65.8	-47.5	177.6	-164.1	94.9	0	0	0	111.3	A45 M143 F171 M172 L173	A45-L111 VanDerWaalsContact CB-O 3.26Å; A45-L111 WeakPolarHBondContact CB-O 3.41Å; L111-M143 HydrophobicContact CD1-CB 3.83Å; L111-M143 HydrophobicContact CD1-CE 4.27Å; L111-M143 HydrophobicContact CD1-CG 4.21Å; L111-M143 HydrophobicContact CD1-SD 3.83Å; L111-F171 HydrophobicContact CB-CE2 4.31Å; L111-F171 HydrophobicContact CB-CZ 4.31Å; L111-F171 HydrophobicContact CD1-CZ 4.25Å; L111-M172 PolarHBondContact N-O 3.02Å; L111-L173 HydrophobicContact CB-CB 4.01Å
112	N	67.2	Low	73.7	Confident	24 Å²	24	64 Å²	64	13%	0.128	29%	0.287	C	S	.	.	S	Bend	trans	-125.9	161.3	-172.7	-70.9	-8	0	0	0	111.1	C17 L114	C17-N112 PolarHBondContact SG-ND2 3.31Å; C17-N112 VanDerWaalsContact SG-ND2 3.4Å; N112-L114 PolarHBondContact O-N 3.36Å
113	D	63.2	Low	72.4	Confident	53 Å²	53	64.5 Å²	64.5	28%	0.283	29%	0.29	S	S	.	.			trans	-56	107.6	169.4	-71.5	-54	0	0	0	110	I44 R46 K115	I44-D113 WeakPolarHBondContact CD1-OD1 3.48Å; R46-D113 IonicContact CZ-OD2 2.78Å; R46-D113 IonicContact NH1-OD2 2.76Å; R46-D113 PolarHBondContact NH1-OD2 3.23Å; D113-K115 PolarHBondContact O-N 2.69Å; D113-K115 VanDerWaalsContact O-N 3.08Å
114	L	64.4	Low	70.7	Confident	26 Å²	26	68.9 Å²	68.9	14%	0.136	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-68	-7.4	-177.8	-62.7	-179.3	0	0	0	113.3	L42 A110 N112 Q116 C117 M172 C174 V179	L42-L114 HydrophobicContact CD1-CD1 4.07Å; L42-L114 HydrophobicContact CD2-CB 4.39Å; L42-L114 HydrophobicContact CD2-CD1 3.6Å; L42-L114 HydrophobicContact CD2-CG 3.97Å; L42-L114 HydrophobicContact CG-CD1 4.48Å; A110-L114 HydrophobicContact CB-CD1 4.26Å; A110-L114 HydrophobicContact CB-CG 4.23Å; N112-L114 PolarHBondContact O-N 3.36Å; L114-Q116 PolarHBondContact O-N 3.32Å; L114-Q116 VanDerWaalsContact O-N 3.16Å; L114-C117 WeakPolarHBondContact O-CB 3.23Å; L114-C117 PolarHBondContact O-N 3.3Å; L114-C117 VanDerWaalsContact O-N 3.09Å; L114-C117 PolarHBondContact O-SG 3.34Å; L114-M172 HydrophobicContact CD1-CB 4.18Å; L114-M172 HydrophobicContact CD1-CE 3.94Å; L114-M172 HydrophobicContact CD1-SD 4.01Å; L114-M172 HydrophobicContact CD2-CB 4.43Å; L114-C174 HydrophobicContact CD2-CB 4.45Å; L114-V179 HydrophobicContact CD1-CG1 4.45Å; L114-V179 HydrophobicContact CD2-CG1 4.06Å; L114-V179 HydrophobicContact CD2-CG2 4.3Å
115	K	67.6	Low	69.1	Low	191 Å²	191	73.5 Å²	73.5	83%	0.83	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-60.6	-25.2	-177.2	-63.7	-175.5	179.5	-178.7	0	113.7	D113 C117	D113-K115 PolarHBondContact O-N 2.69Å; D113-K115 VanDerWaalsContact O-N 3.08Å; K115-C117 VanDerWaalsContact C-N 3.3Å
116	Q	67.8	Low	67.4	Low	172 Å²	172	78 Å²	78	80%	0.804	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-84.1	-2.8	179.8	-74.8	169.2	-9.7	0	0	113.7	L114	L114-Q116 PolarHBondContact O-N 3.32Å; L114-Q116 VanDerWaalsContact O-N 3.16Å
117	C	70.6	Confident	65.4	Low	14 Å²	14	85.1 Å²	85.1	10%	0.095	41%	0.412	C	S	.	.			trans	-111.5	124.9	-169	-36.3	0	0	0	0	108.4	L114 K115 C174 G177 V179	L114-C117 WeakPolarHBondContact O-CB 3.23Å; L114-C117 PolarHBondContact O-N 3.3Å; L114-C117 VanDerWaalsContact O-N 3.09Å; L114-C117 PolarHBondContact O-SG 3.34Å; K115-C117 VanDerWaalsContact C-N 3.3Å; C117-C174 HydrophobicContact CB-CB 4.19Å; C117-C174 WeakPolarHBondContact CB-SG 3.28Å; C117-C174 WeakPolarHBondContact SG-CB 3.46Å; C117-C174 CovalentContact SG-SG 2Å; C117-C174 PolarHBondContact SG-SG 2.89Å; C117-G177 CarbonylContact C-O 3.56Å; C117-G177 WeakPolarHBondContact CA-O 3.3Å; C117-V179 HydrophobicContact CB-CG2 3.5Å; C117-V179 VanDerWaalsContact CB-CG2 3.5Å
118	R	65.8	Low	63.3	Low	247 Å²	247	88 Å²	88	93%	0.932	43%	0.432	S	S	*	.			trans	-98.1	-21.5	-172.2	-68.6	-175	179.8	178.1	0.2	113.5	G177	R118-G177 PolarHBondContact N-O 3.37Å; R118-G177 VanDerWaalsContact N-O 3.13Å
119	E	63.3	Low	61.4	Low	99 Å²	99	90.4 Å²	90.4	46%	0.463	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	127.3	-170.9	-164.2	-177.3	178.5	0	0	110.6	K178 V179	E119-K178 HydrophobicContact CB-CG 4.42Å; E119-K178 CarbonylContact O-C 3.59Å; E119-K178 WeakPolarHBondContact O-CA 3.22Å; E119-K178 IonicContact OE1-NZ 3.96Å; E119-K178 PolarHBondContact OE1-NZ 2.95Å; E119-K178 WeakPolarHBondContact OE2-CE 3.44Å; E119-K178 IonicContact OE2-NZ 3.43Å; E119-K178 PolarHBondContact OE2-NZ 2.9Å; E119-V179 PolarHBondContact O-N 2.92Å
120	H	62.7	Low	59.9	Low	115 Å²	115	99 Å²	99	53%	0.532	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	119.7	178.2	-77.5	-93.8	0	0	0	111.2	F122	H120-F122 HydrophobicContact CB-CE2 4.26Å
121	V	63.7	Low	58.6	Low	30 Å²	30	103.6 Å²	103.6	18%	0.182	51%	0.511	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	105.3	173.7	-177.7	0	0	0	0	108.6	I123 K178 V179 L180 S181	V121-I123 HydrophobicContact CG1-CG1 4.28Å; V121-I123 PolarHBondContact O-N 3.18Å; V121-K178 HydrophobicContact CG2-CB 4.21Å; V121-K178 HydrophobicContact CG2-CD 4.04Å; V121-V179 CarbonylContact C-O 3.59Å; V121-V179 WeakPolarHBondContact CA-O 3.44Å; V121-V179 PolarHBondContact N-O 3.31Å; V121-L180 HydrophobicContact CB-CD2 4.21Å; V121-L180 HydrophobicContact CG1-CD2 4.44Å; V121-S181 PolarHBondContact O-N 3.38Å
122	F	57.7	Low	57.6	Low	165 Å²	165	104 Å²	104	72%	0.724	52%	0.517	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.4	121	172.3	-71	-86.5	0	0	0	109.8	H120 S181	H120-F122 HydrophobicContact CB-CE2 4.26Å; F122-S181 WeakPolarHBondContact CA-OG 3.29Å; F122-S181 WeakPolarHBondContact CD1-OG 3.45Å
123	I	59	Low	57.6	Low	12 Å²	12	104.2 Å²	104.2	6%	0.062	52%	0.518	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	106.4	171.3	-55	175.3	0	0	0	106.9	V121 A132 N133 L180 S181	V121-I123 HydrophobicContact CG1-CG1 4.28Å; V121-I123 PolarHBondContact O-N 3.18Å; I123-A132 HydrophobicContact CD1-CB 4.13Å; I123-N133 WeakPolarHBondContact CG2-OD1 3.43Å; I123-L180 HydrophobicContact CD1-CB 4.37Å; I123-L180 HydrophobicContact CD1-CD2 4.1Å; I123-S181 PolarHBondContact N-O 3.31Å; I123-S181 VanDerWaalsContact O-O 3.1Å
124	S	52.7	Low	58.1	Low	92 Å²	92	104.6 Å²	104.6	64%	0.643	53%	0.525	S	S	*	.			trans	-77.9	144.3	172.6	39.7	0	0	0	0	111.3
125	L	52.9	Low	58.5	Low	97 Å²	97	105.9 Å²	105.9	51%	0.508	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	144.3	163.7	-88.1	122.4	0	0	0	110.5	L182 A183 L190	L125-L182 HydrophobicContact CD1-CD1 3.63Å; L125-L182 HydrophobicContact CD1-CD2 4.46Å; L125-L182 HydrophobicContact CD1-CG 3.97Å; L125-L182 HydrophobicContact CG-CD1 3.9Å; L125-A183 WeakPolarHBondContact CD1-O 3.41Å; L125-L190 HydrophobicContact CD1-CD2 4.02Å
126	P	51.1	Low	59	Low	95 Å²	95	96.9 Å²	96.9	62%	0.617	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	cis	-117.4	110.5	-48.1	32.8	-16	0	0	0	109.5
127	D	43.5	Very low	59.7	Low	149 Å²	149	91.6 Å²	91.6	80%	0.797	48%	0.476	S	S	*	.	S	Bend	trans	-144.8	126.4	158.5	-78.7	-47.9	0	0	0	107.1
128	D	41.4	Very low	60.4	Low	164 Å²	164	95 Å²	95	88%	0.877	49%	0.494	S	S	*	.	S	Bend	trans	76.2	4.6	168.6	-65.8	-19.4	0	0	0	123.5
129	R	42.9	Very low	61.2	Low	135 Å²	135	84.2 Å²	84.2	51%	0.509	46%	0.456	S	S	.	.			trans	-134.3	61.3	172.8	-70.6	-171.8	171.5	175.2	0.2	115.4	S131 A132 N133	R129-S131 VanDerWaalsContact C-N 3.28Å; R129-S131 PolarHBondContact O-N 3Å; R129-A132 HydrophobicContact CB-CB 4.13Å; R129-A132 PolarHBondContact O-N 3.38Å; R129-N133 WeakPolarHBondContact O-CB 3.21Å; R129-N133 VanDerWaalsContact O-CG 3.24Å; R129-N133 PolarHBondContact O-N 3.25Å; R129-N133 VanDerWaalsContact O-N 3.07Å; R129-N133 PolarHBondContact O-ND2 3.22Å
130	Q	51	Low	62.2	Low	182 Å²	182	79.6 Å²	79.6	85%	0.85	43%	0.434	S	S	*	.	H	α-helix	trans	-53.8	-38.4	174.3	-102.8	175.5	-1.8	0	0	113.8	S134	Q130-S134 PolarHBondContact O-N 2.96Å; Q130-S134 VanDerWaalsContact O-N 3.1Å; Q130-S134 PolarHBondContact O-OG 3.4Å
131	S	50.2	Low	63.4	Low	96 Å²	96	75.8 Å²	75.8	67%	0.671	42%	0.417	S	S	*	.	H	α-helix	trans	-76.9	-39.1	-177.6	65.3	0	0	0	0	114.2	R129 S134 A135	R129-S131 VanDerWaalsContact C-N 3.28Å; R129-S131 PolarHBondContact O-N 3Å; S131-S134 PolarHBondContact O-OG 2.68Å; S131-A135 PolarHBondContact O-N 2.88Å; S131-A135 VanDerWaalsContact O-N 3.13Å
132	A	52	Low	64.4	Low	26 Å²	26	79.3 Å²	79.3	22%	0.215	43%	0.427	C	S	.	.	H	α-helix	trans	-70.6	-36.8	176.7	0	0	0	0	0	110.9	I123 R129 A135 L136	I123-A132 HydrophobicContact CD1-CB 4.13Å; R129-A132 HydrophobicContact CB-CB 4.13Å; R129-A132 PolarHBondContact O-N 3.38Å; A132-A135 PolarHBondContact O-N 3.35Å; A132-L136 VanDerWaalsContact O-CB 3.3Å; A132-L136 WeakPolarHBondContact O-CB 3.22Å; A132-L136 PolarHBondContact O-N 3.02Å
133	N	65.8	Low	65.6	Low	29 Å²	29	71.7 Å²	71.7	16%	0.155	39%	0.393	C	S	.	.	H	α-helix	trans	-65.4	-42	175.6	-73	-13.6	0	0	0	111.8	I123 R129 L136 M137	I123-N133 WeakPolarHBondContact CG2-OD1 3.43Å; R129-N133 WeakPolarHBondContact O-CB 3.21Å; R129-N133 VanDerWaalsContact O-CG 3.24Å; R129-N133 PolarHBondContact O-N 3.25Å; R129-N133 VanDerWaalsContact O-N 3.07Å; R129-N133 PolarHBondContact O-ND2 3.22Å; N133-L136 PolarHBondContact O-N 3.13Å; N133-M137 WeakPolarHBondContact O-CB 3.34Å; N133-M137 VanDerWaalsContact O-CG 3.31Å; N133-M137 WeakPolarHBondContact O-CG 3.47Å; N133-M137 PolarHBondContact O-N 3.25Å
134	S	73.2	Confident	66.9	Low	60 Å²	60	71.1 Å²	71.1	42%	0.42	39%	0.391	S	S	.	.	H	α-helix	trans	-66.1	-42.6	177.1	67.5	0	0	0	0	111.9	Q130 S131 L136 M137 N138	Q130-S134 PolarHBondContact O-N 2.96Å; Q130-S134 VanDerWaalsContact O-N 3.1Å; Q130-S134 PolarHBondContact O-OG 3.4Å; S131-S134 PolarHBondContact O-OG 2.68Å; S134-L136 PolarHBondContact O-N 3.46Å; S134-M137 PolarHBondContact O-N 2.81Å; S134-N138 WeakPolarHBondContact O-CB 3.21Å; S134-N138 PolarHBondContact O-N 3.24Å; S134-N138 PolarHBondContact O-ND2 3.36Å; S134-N138 VanDerWaalsContact O-ND2 3.16Å; S134-N138 PolarHBondContact O-OD1 2.97Å
135	A	73	Confident	68.5	Low	53 Å²	53	68.3 Å²	68.3	44%	0.438	37%	0.369	S	S	.	.	H	α-helix	trans	-62.6	-41.3	175.6	0	0	0	0	0	112.7	S131 A132 N138 S139	S131-A135 PolarHBondContact O-N 2.88Å; S131-A135 VanDerWaalsContact O-N 3.13Å; A132-A135 PolarHBondContact O-N 3.35Å; A135-N138 PolarHBondContact O-N 3.5Å; A135-S139 PolarHBondContact O-N 3.42Å; A135-S139 PolarHBondContact O-OG 3.42Å
136	L	79	Confident	69.8	Low	2 Å²	2	65 Å²	65	1%	0.01	35%	0.35	C	S	.	.	H	α-helix	trans	-65.8	-47.9	177.5	-164.3	94.5	0	0	0	111.6	A132 N133 S134 N138 S139 F140 F171 L173 L180 L182	A132-L136 VanDerWaalsContact O-CB 3.3Å; A132-L136 WeakPolarHBondContact O-CB 3.22Å; A132-L136 PolarHBondContact O-N 3.02Å; N133-L136 PolarHBondContact O-N 3.13Å; S134-L136 PolarHBondContact O-N 3.46Å; L136-N138 VanDerWaalsContact C-N 3.33Å; L136-N138 PolarHBondContact O-N 3.14Å; L136-S139 WeakPolarHBondContact O-CB 3.39Å; L136-S139 PolarHBondContact O-N 3.4Å; L136-S139 VanDerWaalsContact O-N 3.13Å; L136-F140 PolarHBondContact O-N 2.92Å; L136-F171 HydrophobicContact CD1-CD1 4.36Å; L136-F171 HydrophobicContact CD1-CE1 4.22Å; L136-F171 HydrophobicContact CD2-CD1 3.87Å; L136-F171 HydrophobicContact CD2-CE1 4.39Å; L136-F171 HydrophobicContact CG-CD1 3.83Å; L136-F171 HydrophobicContact CG-CE1 3.83Å; L136-L173 HydrophobicContact CD1-CD1 4.32Å; L136-L173 HydrophobicContact CD1-CD2 3.31Å; L136-L173 HydrophobicContact CD1-CG 3.46Å; L136-L173 VanDerWaalsContact CD1-CG 3.46Å; L136-L173 HydrophobicContact CG-CD2 4.07Å; L136-L180 HydrophobicContact CD1-CB 3.74Å; L136-L180 HydrophobicContact CD1-CD1 4.37Å; L136-L182 HydrophobicContact CD2-CB 3.23Å; L136-L182 HydrophobicContact CD2-CD2 3.73Å; L136-L182 HydrophobicContact CD2-CG 4.01Å
137	M	83	Confident	71.2	Confident	61 Å²	61	60.6 Å²	60.6	30%	0.3	32%	0.321	S	S	.	.	H	α-helix	trans	-66.8	-33.7	177.4	-69.4	-63	-82.2	0	0	112	N133 S134 S139 F140 Q141 L182	N133-M137 WeakPolarHBondContact O-CB 3.34Å; N133-M137 VanDerWaalsContact O-CG 3.31Å; N133-M137 WeakPolarHBondContact O-CG 3.47Å; N133-M137 PolarHBondContact O-N 3.25Å; S134-M137 PolarHBondContact O-N 2.81Å; M137-S139 VanDerWaalsContact C-N 3.3Å; M137-S139 PolarHBondContact O-N 3.12Å; M137-F140 HydrophobicContact CE-CD1 4.27Å; M137-F140 WeakPolarHBondContact O-CB 3.47Å; M137-F140 PolarHBondContact O-N 3.14Å; M137-F140 HydrophobicContact SD-CD1 4.08Å; M137-Q141 WeakPolarHBondContact O-CB 3.17Å; M137-Q141 PolarHBondContact O-N 3.23Å; M137-L182 HydrophobicContact CG-CD2 4.41Å; M137-L182 HydrophobicContact SD-CD2 3.72Å
138	N	85.2	Confident	73.2	Confident	87 Å²	87	54.4 Å²	54.4	47%	0.465	29%	0.287	S	S	.	.	H	α-helix	trans	-63.6	-37.2	171.4	-72.4	-18.9	0	0	0	111.8	S134 A135 L136 R142	S134-N138 WeakPolarHBondContact O-CB 3.21Å; S134-N138 PolarHBondContact O-N 3.24Å; S134-N138 PolarHBondContact O-ND2 3.36Å; S134-N138 VanDerWaalsContact O-ND2 3.16Å; S134-N138 PolarHBondContact O-OD1 2.97Å; A135-N138 PolarHBondContact O-N 3.5Å; L136-N138 VanDerWaalsContact C-N 3.33Å; L136-N138 PolarHBondContact O-N 3.14Å; N138-R142 WeakPolarHBondContact O-CB 3.41Å; N138-R142 VanDerWaalsContact O-CG 3.32Å; N138-R142 WeakPolarHBondContact O-CG 3.46Å; N138-R142 PolarHBondContact O-N 2.89Å
139	S	81.8	Confident	75.1	Confident	20 Å²	20	52.4 Å²	52.4	14%	0.14	27%	0.272	C	S	.	.	H	α-helix	trans	-68.6	-39.1	174.3	-56	0	0	0	0	111.3	A135 L136 M137 R142 M143	A135-S139 PolarHBondContact O-N 3.42Å; A135-S139 PolarHBondContact O-OG 3.42Å; L136-S139 WeakPolarHBondContact O-CB 3.39Å; L136-S139 PolarHBondContact O-N 3.4Å; L136-S139 VanDerWaalsContact O-N 3.13Å; M137-S139 VanDerWaalsContact C-N 3.3Å; M137-S139 PolarHBondContact O-N 3.12Å; S139-R142 PolarHBondContact O-N 3.2Å; S139-M143 PolarHBondContact O-N 3.22Å
140	F	85.3	Confident	76.5	Confident	1 Å²	1	50.4 Å²	50.4	0%	0.004	27%	0.265	C	S	.	.	H	α-helix	trans	-62	-45.9	174.3	-173.7	-133.7	0	0	0	111.7	L109 L136 M137 R142 M143 A144 I166 A168 F171 L190 T192	L109-F140 HydrophobicContact CD2-CD2 4.31Å; L109-F140 HydrophobicContact CD2-CE2 3.73Å; L136-F140 PolarHBondContact O-N 2.92Å; M137-F140 HydrophobicContact CE-CD1 4.27Å; M137-F140 WeakPolarHBondContact O-CB 3.47Å; M137-F140 PolarHBondContact O-N 3.14Å; M137-F140 HydrophobicContact SD-CD1 4.08Å; F140-R142 PolarHBondContact O-N 3.39Å; F140-M143 HydrophobicContact CD2-CE 3.54Å; F140-M143 HydrophobicContact CE2-CE 4.07Å; F140-M143 WeakPolarHBondContact O-CB 3.46Å; F140-M143 PolarHBondContact O-N 3.15Å; F140-A144 PolarHBondContact O-N 2.82Å; F140-I166 HydrophobicContact CE2-CG2 3.97Å; F140-I166 HydrophobicContact CZ-CB 4.3Å; F140-I166 HydrophobicContact CZ-CG2 3.95Å; F140-A168 HydrophobicContact CE2-CB 4.26Å; F140-A168 HydrophobicContact CZ-CB 4.09Å; F140-F171 HydrophobicContact CB-CD1 4.09Å; F140-F171 HydrophobicContact CB-CE1 3.82Å; F140-F171 HydrophobicContact CB-CZ 4.18Å; F140-F171 HydrophobicContact CD2-CD1 4.34Å; F140-F171 AromaticContact CD2-CD2 3.92Å; F140-F171 HydrophobicContact CD2-CD2 3.92Å; F140-F171 HydrophobicContact CD2-CE1 4.48Å; F140-F171 HydrophobicContact CD2-CE2 4.13Å; F140-F171 HydrophobicContact CD2-CG 4.06Å; F140-F171 HydrophobicContact CD2-CZ 4.38Å; F140-F171 HydrophobicContact CE2-CD2 4.44Å; F140-F171 HydrophobicContact CG-CD1 4.38Å; F140-F171 HydrophobicContact CG-CE1 4.49Å; F140-F171 HydrophobicContact CG-CG 4.49Å; F140-L190 HydrophobicContact CE1-CB 4.03Å; F140-L190 HydrophobicContact CZ-CB 4.29Å; F140-T192 HydrophobicContact CD1-CG2 3.64Å; F140-T192 HydrophobicContact CD2-CG2 4.23Å; F140-T192 HydrophobicContact CE1-CG2 3.23Å; F140-T192 HydrophobicContact CE2-CG2 3.84Å; F140-T192 HydrophobicContact CG-CG2 4.13Å; F140-T192 HydrophobicContact CZ-CG2 3.33Å
141	Q	87.8	Confident	77.6	Confident	35 Å²	35	41.8 Å²	41.8	16%	0.164	22%	0.224	C	C	.	.	H	α-helix	trans	-61.9	-43	175.4	-173	66.6	23.7	0	0	112.3	M137 M143 A144 N145 T192 I193 E205	M137-Q141 WeakPolarHBondContact O-CB 3.17Å; M137-Q141 PolarHBondContact O-N 3.23Å; Q141-M143 VanDerWaalsContact C-N 3.33Å; Q141-M143 PolarHBondContact O-N 3.16Å; Q141-A144 WeakPolarHBondContact O-CB 3.26Å; Q141-A144 PolarHBondContact O-N 3.07Å; Q141-N145 PolarHBondContact O-N 3.26Å; Q141-N145 PolarHBondContact O-ND2 3.18Å; Q141-T192 PolarHBondContact OE1-OG1 2.89Å; Q141-I193 PolarHBondContact NE2-O 2.88Å; Q141-E205 PolarHBondContact NE2-OE2 3.29Å
142	R	83.4	Confident	78.4	Confident	104 Å²	104	38 Å²	38	39%	0.392	20%	0.197	S	C	.	.	H	α-helix	trans	-61.8	-41.4	176.5	-78.6	-174.3	-107.8	171.9	-6.1	112	E14 N138 S139 F140 N145 F146	E14-R142 VanDerWaalsContact CD-NH1 3.28Å; E14-R142 IonicContact OE1-NH1 3.8Å; E14-R142 IonicContact OE1-NH2 3.78Å; E14-R142 IonicContact OE2-CZ 3.55Å; E14-R142 IonicContact OE2-NH1 2.66Å; E14-R142 PolarHBondContact OE2-NH1 2.96Å; E14-R142 IonicContact OE2-NH2 3.51Å; N138-R142 WeakPolarHBondContact O-CB 3.41Å; N138-R142 VanDerWaalsContact O-CG 3.32Å; N138-R142 WeakPolarHBondContact O-CG 3.46Å; N138-R142 PolarHBondContact O-N 2.89Å; S139-R142 PolarHBondContact O-N 3.2Å; F140-R142 PolarHBondContact O-N 3.39Å; R142-N145 PolarHBondContact O-N 3.11Å; R142-F146 PolarHBondContact O-N 3.26Å; R142-F146 VanDerWaalsContact O-N 3.16Å
143	M	83	Confident	78.9	Confident	5 Å²	5	38.6 Å²	38.6	3%	0.025	20%	0.198	C	C	.	.	H	α-helix	trans	-63.9	-39.5	174	179.1	177.4	47.2	0	0	112	A45 L109 L111 S139 F140 Q141 N145 F146 L147 F171	A45-M143 HydrophobicContact CB-SD 4.21Å; L109-M143 HydrophobicContact CD1-SD 4.48Å; L109-M143 HydrophobicContact CD2-CE 3.33Å; L109-M143 HydrophobicContact CD2-SD 4.04Å; L109-M143 HydrophobicContact CG-CE 3.94Å; L109-M143 HydrophobicContact CG-SD 4.21Å; L111-M143 HydrophobicContact CD1-CB 3.83Å; L111-M143 HydrophobicContact CD1-CE 4.27Å; L111-M143 HydrophobicContact CD1-CG 4.21Å; L111-M143 HydrophobicContact CD1-SD 3.83Å; S139-M143 PolarHBondContact O-N 3.22Å; F140-M143 HydrophobicContact CD2-CE 3.54Å; F140-M143 HydrophobicContact CE2-CE 4.07Å; F140-M143 WeakPolarHBondContact O-CB 3.46Å; F140-M143 PolarHBondContact O-N 3.15Å; Q141-M143 VanDerWaalsContact C-N 3.33Å; Q141-M143 PolarHBondContact O-N 3.16Å; M143-N145 VanDerWaalsContact C-N 3.34Å; M143-N145 PolarHBondContact O-N 3.17Å; M143-F146 PolarHBondContact O-N 3.25Å; M143-L147 HydrophobicContact CG-CD1 3.99Å; M143-L147 HydrophobicContact CG-CG 4.3Å; M143-L147 WeakPolarHBondContact O-CG 3.42Å; M143-L147 PolarHBondContact O-N 2.83Å; M143-F171 HydrophobicContact CE-CD2 3.9Å; M143-F171 HydrophobicContact CE-CE2 3.24Å; M143-F171 HydrophobicContact CE-CZ 3.91Å; M143-F171 HydrophobicContact SD-CE2 4.34Å
144	A	87	Confident	78.6	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-59.7	-45.1	175.8	0	0	0	0	0	112.1	F140 Q141 F146 L147 R148 I166 T192	F140-A144 PolarHBondContact O-N 2.82Å; Q141-A144 WeakPolarHBondContact O-CB 3.26Å; Q141-A144 PolarHBondContact O-N 3.07Å; A144-F146 VanDerWaalsContact C-N 3.28Å; A144-F146 PolarHBondContact O-N 2.79Å; A144-L147 PolarHBondContact O-N 2.95Å; A144-R148 PolarHBondContact O-N 2.9Å; A144-I166 HydrophobicContact CB-CD1 3.68Å; A144-I166 HydrophobicContact CB-CG1 4.37Å; A144-T192 HydrophobicContact CB-CG2 3.74Å
145	N	86.3	Confident	77.9	Confident	34 Å²	34	47.9 Å²	47.9	18%	0.182	23%	0.229	C	C	.	.	H	α-helix	trans	-57.9	-40.4	175	-81.5	-45	0	0	0	113.2	Q141 R142 M143 Q149 S194 R200 E205	Q141-N145 PolarHBondContact O-N 3.26Å; Q141-N145 PolarHBondContact O-ND2 3.18Å; R142-N145 PolarHBondContact O-N 3.11Å; M143-N145 VanDerWaalsContact C-N 3.34Å; M143-N145 PolarHBondContact O-N 3.17Å; N145-Q149 WeakPolarHBondContact O-CG 3.37Å; N145-S194 VanDerWaalsContact CA-OG 3.3Å; N145-S194 WeakPolarHBondContact CA-OG 3.42Å; N145-S194 PolarHBondContact OD1-OG 3.26Å; N145-R200 PolarHBondContact OD1-NH2 3.4Å; N145-E205 PolarHBondContact OD1-OE1 3.34Å
146	F	79.9	Confident	77	Confident	28 Å²	28	49.1 Å²	49.1	12%	0.123	24%	0.239	C	C	.	.	H	α-helix	trans	-70	-44.3	178.1	175.8	-92.7	0	0	0	112.8	T18 S19 G21 R142 M143 A144 R148 Q149 R150	T18-F146 WeakPolarHBondContact O-CD2 3.47Å; T18-F146 WeakPolarHBondContact O-CE1 3.3Å; T18-F146 WeakPolarHBondContact O-CE2 3.35Å; T18-F146 WeakPolarHBondContact O-CG 3.47Å; T18-F146 WeakPolarHBondContact O-CZ 3.5Å; S19-F146 VanDerWaalsContact C-CZ 3.42Å; G21-F146 VanDerWaalsContact N-CZ 3.29Å; G21-F146 WeakPolarHBondContact O-CE1 3.37Å; R142-F146 PolarHBondContact O-N 3.26Å; R142-F146 VanDerWaalsContact O-N 3.16Å; M143-F146 PolarHBondContact O-N 3.25Å; A144-F146 VanDerWaalsContact C-N 3.28Å; A144-F146 PolarHBondContact O-N 2.79Å; F146-R148 VanDerWaalsContact C-N 3.34Å; F146-R148 PolarHBondContact O-N 2.77Å; F146-Q149 PolarHBondContact O-N 3.04Å; F146-R150 VanDerWaalsContact CZ-CZ 3.43Å
147	L	81.8	Confident	76.2	Confident	2 Å²	2	50.7 Å²	50.7	1%	0.01	25%	0.25	C	C	.	.	H	α-helix	trans	-65.4	-36.7	178.6	-71.2	175.2	0	0	0	112	I23 L104 M143 A144 Q149 R150 W151 L164 I166	I23-L147 HydrophobicContact CD1-CB 4.28Å; I23-L147 HydrophobicContact CD1-CD1 4.5Å; I23-L147 HydrophobicContact CD1-CD2 3.97Å; I23-L147 HydrophobicContact CD1-CG 4.48Å; I23-L147 HydrophobicContact CG1-CD2 4.15Å; L104-L147 HydrophobicContact CD2-CD1 3.9Å; M143-L147 HydrophobicContact CG-CD1 3.99Å; M143-L147 HydrophobicContact CG-CG 4.3Å; M143-L147 WeakPolarHBondContact O-CG 3.42Å; M143-L147 PolarHBondContact O-N 2.83Å; A144-L147 PolarHBondContact O-N 2.95Å; L147-Q149 VanDerWaalsContact C-N 3.35Å; L147-Q149 PolarHBondContact O-N 2.88Å; L147-R150 CarbonylContact O-C 3.56Å; L147-R150 PolarHBondContact O-N 3.09Å; L147-R150 VanDerWaalsContact O-N 3.12Å; L147-W151 PolarHBondContact O-N 3.44Å; L147-L164 HydrophobicContact CB-CD2 3.68Å; L147-I166 HydrophobicContact CD1-CD1 3.77Å
148	R	85	Confident	75.3	Confident	19 Å²	19	55.6 Å²	55.6	7%	0.072	28%	0.277	C	S	.	.	H	α-helix	trans	-57.6	-48.2	176.7	-172.3	-170.1	61.2	72.9	3.3	111.2	A144 F146 R150 W151 T161 L164 S194 L195	A144-R148 PolarHBondContact O-N 2.9Å; F146-R148 VanDerWaalsContact C-N 3.34Å; F146-R148 PolarHBondContact O-N 2.77Å; R148-R150 PolarHBondContact O-N 3.12Å; R148-R150 VanDerWaalsContact O-N 3.1Å; R148-W151 WeakPolarHBondContact O-CB 3.09Å; R148-W151 PolarHBondContact O-N 2.99Å; R148-T161 WeakPolarHBondContact CG-OG1 3.31Å; R148-T161 PolarHBondContact NH1-O 2.9Å; R148-T161 PolarHBondContact O-OG1 2.87Å; R148-L164 HydrophobicContact CB-CB 3.75Å; R148-L164 HydrophobicContact CB-CD2 3.91Å; R148-L164 HydrophobicContact CB-CG 4.48Å; R148-L164 HydrophobicContact CG-CB 3.78Å; R148-L164 VanDerWaalsContact N-CD2 3.25Å; R148-S194 WeakPolarHBondContact CD-O 3.33Å; R148-S194 WeakPolarHBondContact CD-OG 3.47Å; R148-S194 PolarHBondContact NE-OG 3.07Å; R148-L195 PolarHBondContact NE-O 2.97Å; R148-L195 VanDerWaalsContact NE-O 3.16Å
149	Q	80	Confident	74.6	Confident	121 Å²	121	52.7 Å²	52.7	57%	0.565	26%	0.264	S	S	*	.	H	α-helix	trans	-61.7	-21.6	-179.7	-69	177.9	-4.5	0	0	113.7	N145 F146 L147	N145-Q149 WeakPolarHBondContact O-CG 3.37Å; F146-Q149 PolarHBondContact O-N 3.04Å; L147-Q149 VanDerWaalsContact C-N 3.35Å; L147-Q149 PolarHBondContact O-N 2.88Å
150	R	72.2	Confident	74.3	Confident	94 Å²	94	59.2 Å²	59.2	36%	0.355	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	8	-178.2	-72.8	-179.4	156.8	80.9	-9.5	113.7	S19 G21 A22 F146 L147 R148 T152	S19-R150 PolarHBondContact O-NH2 3.37Å; G21-R150 WeakPolarHBondContact O-CD 3.34Å; A22-R150 HydrophobicContact CB-CB 4.42Å; F146-R150 VanDerWaalsContact CZ-CZ 3.43Å; L147-R150 CarbonylContact O-C 3.56Å; L147-R150 PolarHBondContact O-N 3.09Å; L147-R150 VanDerWaalsContact O-N 3.12Å; R148-R150 PolarHBondContact O-N 3.12Å; R148-R150 VanDerWaalsContact O-N 3.1Å; R150-T152 PolarHBondContact O-N 3.11Å
151	W	74.9	Confident	74.1	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	90.1	-179.6	-170.6	-75.1	0	0	0	110.7	I23 C61 F87 I103 L104 L147 R148 T161 L164	I23-W151 HydrophobicContact CB-CE3 4.49Å; I23-W151 HydrophobicContact CD1-CD2 4.49Å; I23-W151 HydrophobicContact CD1-CE3 3.35Å; I23-W151 HydrophobicContact CD1-CZ3 3.38Å; I23-W151 HydrophobicContact CG1-CE3 4.48Å; I23-W151 HydrophobicContact CG2-CE3 4.36Å; C61-W151 HydrophobicContact CB-CH2 3.57Å; C61-W151 HydrophobicContact CB-CZ2 4.14Å; C61-W151 HydrophobicContact CB-CZ3 4.41Å; F87-W151 AromaticContact CD2-NE1 3.49Å; F87-W151 AromaticContact CE2-CD1 3.73Å; F87-W151 HydrophobicContact CE2-CD2 4.27Å; F87-W151 AromaticContact CE2-CE2 3.36Å; F87-W151 HydrophobicContact CE2-CG 4.5Å; F87-W151 AromaticContact CE2-CZ2 3.63Å; F87-W151 HydrophobicContact CE2-CZ2 3.63Å; F87-W151 AromaticContact CE2-NE1 3.03Å; F87-W151 HydrophobicContact CZ-CZ2 4.41Å; F87-W151 AromaticContact CZ-NE1 3.95Å; I103-W151 WeakPolarHBondContact O-CH2 3.23Å; L104-W151 HydrophobicContact CB-CH2 4.09Å; L104-W151 HydrophobicContact CB-CZ3 3.89Å; L104-W151 HydrophobicContact CD1-CH2 4.3Å; L104-W151 HydrophobicContact CD1-CZ3 4.09Å; L104-W151 HydrophobicContact CG-CZ3 4.45Å; L147-W151 PolarHBondContact O-N 3.44Å; R148-W151 WeakPolarHBondContact O-CB 3.09Å; R148-W151 PolarHBondContact O-N 2.99Å; W151-T161 HydrophobicContact CB-CG2 3.72Å; W151-T161 HydrophobicContact CG-CG2 3.58Å; W151-L164 HydrophobicContact CD2-CD1 4.01Å; W151-L164 HydrophobicContact CE3-CD1 3.4Å; W151-L164 VanDerWaalsContact CE3-CD1 3.4Å; W151-L164 HydrophobicContact CE3-CD2 4.1Å; W151-L164 HydrophobicContact CE3-CG 4.4Å; W151-L164 HydrophobicContact CH2-CD1 3.88Å; W151-L164 HydrophobicContact CZ2-CD1 4.4Å; W151-L164 HydrophobicContact CZ3-CD1 3.34Å
152	T	66.9	Low	74	Confident	17 Å²	17	58.6 Å²	58.6	10%	0.104	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	152.8	-174	68.4	0	0	0	0	111.3	R150 N154 C159	R150-T152 PolarHBondContact O-N 3.11Å; T152-N154 VanDerWaalsContact C-N 3.31Å; T152-N154 PolarHBondContact OG1-O 3.17Å; T152-C159 VanDerWaalsContact CG2-O 3.31Å; T152-C159 WeakPolarHBondContact CG2-O 3.02Å
153	V	62.3	Low	74.3	Confident	38 Å²	38	53.8 Å²	53.8	23%	0.23	27%	0.269	C	S	.	.	S	Bend	trans	-63.5	-43.8	168.2	-176.4	0	0	0	0	110.1	A25 C86 F87	A25-V153 HydrophobicContact CB-CG1 4.44Å; C86-V153 VanDerWaalsContact O-CG2 3.28Å; C86-V153 WeakPolarHBondContact O-CG2 3.2Å; F87-V153 VanDerWaalsContact C-CG2 3.43Å; F87-V153 HydrophobicContact CB-CG2 4.21Å; F87-V153 HydrophobicContact CD1-CG2 3.84Å; F87-V153 HydrophobicContact CG-CG2 4.37Å; F87-V153 WeakPolarHBondContact O-CG2 3.5Å
154	N	60.4	Low	74.6	Confident	91 Å²	91	53.6 Å²	53.6	49%	0.487	27%	0.268	S	S	.	.			trans	-138.6	137.8	-169.1	-170.3	-10.5	0	0	0	109.2	T152 A156 S157	T152-N154 VanDerWaalsContact C-N 3.31Å; T152-N154 PolarHBondContact OG1-O 3.17Å; N154-A156 PolarHBondContact O-N 3.39Å; N154-A156 VanDerWaalsContact O-N 3.08Å; N154-A156 PolarHBondContact OD1-N 3.33Å; N154-A156 VanDerWaalsContact OD1-N 3.13Å; N154-S157 WeakPolarHBondContact O-CB 3.35Å; N154-S157 PolarHBondContact O-N 2.87Å; N154-S157 PolarHBondContact O-OG 3.19Å
155	R	57	Low	74.9	Confident	194 Å²	194	53.6 Å²	53.6	73%	0.732	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-24	172.9	-67.3	-176	-177.6	-178.6	0.8	112.7
156	A	55.1	Low	75.1	Confident	79 Å²	79	52 Å²	52	65%	0.653	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	0.3	176.2	0	0	0	0	0	114.4	N154	N154-A156 PolarHBondContact O-N 3.39Å; N154-A156 VanDerWaalsContact O-N 3.08Å; N154-A156 PolarHBondContact OD1-N 3.33Å; N154-A156 VanDerWaalsContact OD1-N 3.13Å
157	S	62.2	Low	75.6	Confident	34 Å²	34	50.6 Å²	50.6	24%	0.238	25%	0.254	C	S	.	.			trans	-91.1	128.5	175.3	65.1	0	0	0	0	110.6	N154 C159	N154-S157 WeakPolarHBondContact O-CB 3.35Å; N154-S157 PolarHBondContact O-N 2.87Å; N154-S157 PolarHBondContact O-OG 3.19Å; S157-C159 PolarHBondContact O-N 3.38Å
158	D	64.4	Low	76	Confident	164 Å²	164	50.5 Å²	50.5	88%	0.877	25%	0.253	S	S	*	.			trans	-73.7	13	176	-62.4	-45.9	0	0	0	113.4	K160	D158-K160 PolarHBondContact O-N 2.84Å
159	C	70.4	Confident	76.1	Confident	27 Å²	27	50.3 Å²	50.3	18%	0.182	25%	0.253	C	S	.	.			trans	-74.9	117.9	-176.3	-164	0	0	0	0	110.9	C86 T152 S157	C86-C159 WeakPolarHBondContact CA-SG 3.26Å; C86-C159 HydrophobicContact CB-CB 3.7Å; C86-C159 WeakPolarHBondContact CB-SG 3.48Å; C86-C159 WeakPolarHBondContact SG-CB 3.19Å; C86-C159 CovalentContact SG-SG 2.04Å; C86-C159 PolarHBondContact SG-SG 3.43Å; T152-C159 VanDerWaalsContact CG2-O 3.31Å; T152-C159 WeakPolarHBondContact CG2-O 3.02Å; S157-C159 PolarHBondContact O-N 3.38Å
160	K	75.1	Confident	76.3	Confident	156 Å²	156	47.7 Å²	47.7	68%	0.678	24%	0.24	S	C	*	.			trans	-104.5	131.1	174.2	-65.1	174.6	-176.6	172.1	0	109.1	C86 K100 D158	C86-K160 VanDerWaalsContact SG-C 3.59Å; K100-K160 WeakPolarHBondContact CD-O 3.33Å; D158-K160 PolarHBondContact O-N 2.84Å
161	T	81.2	Confident	76.9	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.223	C	C	.	.			trans	-77.6	138.4	172	49.8	0	0	0	0	111.5	C86 R148 W151	C86-T161 HydrophobicContact CB-CG2 4.12Å; R148-T161 WeakPolarHBondContact CG-OG1 3.31Å; R148-T161 PolarHBondContact NH1-O 2.9Å; R148-T161 PolarHBondContact O-OG1 2.87Å; W151-T161 HydrophobicContact CB-CG2 3.72Å; W151-T161 HydrophobicContact CG-CG2 3.58Å
162	D	85	Confident	77.2	Confident	24 Å²	24	44.4 Å²	44.4	13%	0.128	23%	0.229	C	C	.	.	S	Bend	trans	-84	-40	177.8	-67.8	-54.2	0	0	0	111.6	Y99 K100 L195 S196 L199	Y99-D162 HydrophobicContact CD1-CB 4.36Å; K100-D162 PolarHBondContact N-OD2 2.78Å; K100-D162 PolarHBondContact O-N 2.87Å; D162-L195 CarbonylContact O-C 3.46Å; D162-L195 WeakPolarHBondContact O-CA 3.48Å; D162-S196 PolarHBondContact O-N 3.08Å; D162-S196 PolarHBondContact OD1-OG 3.36Å; D162-S196 VanDerWaalsContact OD1-OG 3.1Å; D162-L199 HydrophobicContact CB-CD1 3.9Å
163	I	89.5	Confident	77.8	Confident	3 Å²	3	44.2 Å²	44.2	2%	0.015	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	125.4	-176.2	-55.6	176.6	0	0	0	108.5	K100 L101 G102 V165 I193 L195 L199 L240 M244	K100-I163 PolarHBondContact O-N 3.32Å; L101-I163 CarbonylContact C-O 3.58Å; L101-I163 WeakPolarHBondContact CA-O 2.91Å; L101-I163 HydrophobicContact CD1-CB 3.74Å; L101-I163 HydrophobicContact CD1-CG2 3.56Å; G102-I163 PolarHBondContact N-O 3.18Å; I163-V165 HydrophobicContact CG2-CG2 4.21Å; I163-I193 HydrophobicContact CG2-CD1 3.98Å; I163-I193 HydrophobicContact CG2-CG1 4.27Å; I163-L195 HydrophobicContact CB-CD2 4.48Å; I163-L195 HydrophobicContact CG1-CD2 3.94Å; I163-L195 HydrophobicContact CG2-CD2 4.18Å; I163-L199 HydrophobicContact CD1-CD1 3.68Å; I163-L199 HydrophobicContact CG1-CD1 3.3Å; I163-L240 HydrophobicContact CG2-CD2 4.12Å; I163-M244 HydrophobicContact CD1-CE 3.55Å; I163-M244 HydrophobicContact CD1-SD 3.19Å; I163-M244 WeakPolarHBondContact CD1-SD 3.26Å
164	L	90.8	Very high	78.4	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	121.5	168.1	175.4	62.2	0	0	0	109.3	G102 L104 L147 R148 W151 I166 I193 S194	G102-L164 WeakPolarHBondContact O-CA 3.47Å; G102-L164 WeakPolarHBondContact O-CD1 2.93Å; L104-L164 HydrophobicContact CB-CD1 4.41Å; L147-L164 HydrophobicContact CB-CD2 3.68Å; R148-L164 HydrophobicContact CB-CB 3.75Å; R148-L164 HydrophobicContact CB-CD2 3.91Å; R148-L164 HydrophobicContact CB-CG 4.48Å; R148-L164 HydrophobicContact CG-CB 3.78Å; R148-L164 VanDerWaalsContact N-CD2 3.25Å; W151-L164 HydrophobicContact CD2-CD1 4.01Å; W151-L164 HydrophobicContact CE3-CD1 3.4Å; W151-L164 VanDerWaalsContact CE3-CD1 3.4Å; W151-L164 HydrophobicContact CE3-CD2 4.1Å; W151-L164 HydrophobicContact CE3-CG 4.4Å; W151-L164 HydrophobicContact CH2-CD1 3.88Å; W151-L164 HydrophobicContact CZ2-CD1 4.4Å; W151-L164 HydrophobicContact CZ3-CD1 3.34Å; L164-I166 HydrophobicContact CD2-CD1 4.29Å; L164-I166 HydrophobicContact CD2-CG1 4.26Å; L164-I166 HydrophobicContact CG-CG1 4.13Å; L164-I193 WeakPolarHBondContact O-CA 3.32Å; L164-S194 PolarHBondContact N-O 3.37Å; L164-S194 PolarHBondContact O-N 3.47Å
165	V	92.1	Very high	79.2	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	130.3	170.3	-174.9	0	0	0	0	109.3	G102 I103 L104 I163 L167 T191 T192 I193 L212 V236 L240	G102-V165 PolarHBondContact O-N 2.84Å; I103-V165 CarbonylContact C-O 3.57Å; I103-V165 WeakPolarHBondContact CA-O 3.26Å; L104-V165 PolarHBondContact N-O 3.4Å; I163-V165 HydrophobicContact CG2-CG2 4.21Å; V165-L167 HydrophobicContact CG1-CD2 4.24Å; V165-L167 HydrophobicContact CG1-CG 4.48Å; V165-T191 HydrophobicContact CG1-CG2 4.13Å; V165-T192 WeakPolarHBondContact CA-O 3.19Å; V165-I193 HydrophobicContact CG2-CD1 4.17Å; V165-I193 HydrophobicContact CG2-CG1 4.2Å; V165-L212 HydrophobicContact CG2-CD1 4.39Å; V165-V236 HydrophobicContact CB-CG1 4.22Å; V165-V236 HydrophobicContact CG1-CG1 3.8Å; V165-V236 HydrophobicContact CG2-CG1 4.07Å; V165-L240 HydrophobicContact CG2-CD1 4.09Å; V165-L240 HydrophobicContact CG2-CD2 4.48Å
166	I	91.1	Very high	80	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	127.3	175.1	-52.4	-179.3	0	0	0	109.2	L104 L109 F140 A144 L147 L164 T191 T192	L104-I166 HydrophobicContact CB-CB 4.32Å; L104-I166 HydrophobicContact CB-CG1 4.01Å; L104-I166 HydrophobicContact CB-CG2 4.21Å; L104-I166 HydrophobicContact CD2-CD1 4.08Å; L104-I166 HydrophobicContact CD2-CG1 4.08Å; L104-I166 HydrophobicContact CD2-CG2 3.99Å; L104-I166 HydrophobicContact CG-CG2 4.29Å; L104-I166 WeakPolarHBondContact O-CA 2.99Å; L109-I166 HydrophobicContact CD2-CG2 4.19Å; F140-I166 HydrophobicContact CE2-CG2 3.97Å; F140-I166 HydrophobicContact CZ-CB 4.3Å; F140-I166 HydrophobicContact CZ-CG2 3.95Å; A144-I166 HydrophobicContact CB-CD1 3.68Å; A144-I166 HydrophobicContact CB-CG1 4.37Å; L147-I166 HydrophobicContact CD1-CD1 3.77Å; L164-I166 HydrophobicContact CD2-CD1 4.29Å; L164-I166 HydrophobicContact CD2-CG1 4.26Å; L164-I166 HydrophobicContact CG-CG1 4.13Å; I166-T191 WeakPolarHBondContact O-CA 2.93Å; I166-T192 HydrophobicContact CB-CG2 3.65Å; I166-T192 HydrophobicContact CD1-CG2 4.25Å; I166-T192 HydrophobicContact CG1-CG2 4.16Å; I166-T192 HydrophobicContact CG2-CG2 4.49Å; I166-T192 PolarHBondContact N-O 2.78Å; I166-T192 PolarHBondContact O-N 3.01Å; I166-T192 VanDerWaalsContact O-N 3.15Å
167	L	90.5	Very high	80.7	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	107.5	174	-57.8	177.9	0	0	0	108.4	I103 L104 L105 V106 V165 P189 L190 T191 V233 V236	I103-L167 HydrophobicContact CG2-CD1 4.38Å; L104-L167 PolarHBondContact O-N 2.86Å; L105-L167 HydrophobicContact CD1-CB 3.72Å; L105-L167 HydrophobicContact CD1-CD1 4.22Å; V106-L167 PolarHBondContact N-O 3.22Å; V165-L167 HydrophobicContact CG1-CD2 4.24Å; V165-L167 HydrophobicContact CG1-CG 4.48Å; L167-P189 HydrophobicContact CB-CB 4.3Å; L167-P189 HydrophobicContact CB-CG 4.33Å; L167-P189 HydrophobicContact CD2-CG 4.05Å; L167-L190 WeakPolarHBondContact CA-O 3.27Å; L167-T191 HydrophobicContact CD2-CG2 3.73Å; L167-T191 VanDerWaalsContact CD2-OG1 3.32Å; L167-T191 WeakPolarHBondContact CD2-OG1 3.22Å; L167-V233 HydrophobicContact CD1-CG2 3.69Å; L167-V236 HydrophobicContact CD1-CG2 4.39Å; L167-V236 HydrophobicContact CD2-CG2 4.03Å
168	A	89.4	Confident	81.3	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	127.6	-179.8	0	0	0	0	0	111.3	V106 L109 F140 L190	V106-A168 HydrophobicContact CG2-CB 3.84Å; V106-A168 WeakPolarHBondContact O-CA 3.28Å; L109-A168 HydrophobicContact CB-CB 4.23Å; L109-A168 HydrophobicContact CD2-CB 4.39Å; F140-A168 HydrophobicContact CE2-CB 4.26Å; F140-A168 HydrophobicContact CZ-CB 4.09Å; A168-L190 HydrophobicContact CB-CB 4.45Å; A168-L190 PolarHBondContact N-O 2.71Å; A168-L190 WeakPolarHBondContact O-CA 3.4Å; A168-L190 WeakPolarHBondContact O-CB 3.05Å; A168-L190 WeakPolarHBondContact O-CG 3.35Å; A168-L190 PolarHBondContact O-N 3.44Å
169	Y	86.9	Confident	81.9	Confident	15 Å²	15	36 Å²	36	6%	0.059	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	-30.9	174.4	-72.5	-77.4	0	0	0	112.8	L66 L105 V106 K107 A183 G184 T185 N186 P189 S229	L66-Y169 HydrophobicContact CD1-CD2 4.11Å; L66-Y169 HydrophobicContact CD1-CE2 3.97Å; L66-Y169 HydrophobicContact CD2-CE2 4.45Å; L105-Y169 HydrophobicContact CD1-CE2 4.33Å; V106-Y169 PolarHBondContact O-N 3.44Å; V106-Y169 VanDerWaalsContact O-N 3.1Å; K107-Y169 CarbonylContact O-C 3.6Å; K107-Y169 WeakPolarHBondContact O-CB 3.22Å; Y169-A183 CarbonylContact O-C 3.55Å; Y169-A183 WeakPolarHBondContact O-CA 2.96Å; Y169-G184 PolarHBondContact O-N 3.38Å; Y169-T185 WeakPolarHBondContact CE1-O 3.4Å; Y169-N186 VanDerWaalsContact CE1-O 3.29Å; Y169-N186 WeakPolarHBondContact CE1-O 3.17Å; Y169-N186 PolarHBondContact OH-O 3.41Å; Y169-P189 HydrophobicContact CD1-CB 4.26Å; Y169-P189 HydrophobicContact CE1-CB 4.01Å; Y169-S229 VanDerWaalsContact OH-CA 3.24Å; Y169-S229 WeakPolarHBondContact OH-CA 3.49Å; Y169-S229 PolarHBondContact OH-N 2.9Å
170	H	84.8	Confident	82.2	Confident	66 Å²	66	36.2 Å²	36.2	31%	0.306	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	128.3	173.5	-64.1	-86.2	0	0	0	109.5	K107 K108 L109 L182 A183	K107-H170 PolarHBondContact O-N 2.91Å; K108-H170 WeakPolarHBondContact CA-O 3.23Å; K108-H170 HydrophobicContact CG-CB 4.13Å; L109-H170 PolarHBondContact N-O 3Å; H170-L182 CarbonylContact C-O 3.55Å; H170-L182 WeakPolarHBondContact CA-O 3.31Å; H170-A183 WeakPolarHBondContact ND1-CB 2.94Å
171	F	85.1	Confident	82.4	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	129.5	170.7	179.5	-121.5	0	0	0	109.9	L109 L111 L136 F140 M143 L173 S181 L182 L190	L109-F171 HydrophobicContact CB-CD2 4.29Å; L109-F171 HydrophobicContact CD2-CD2 4.28Å; L109-F171 HydrophobicContact CG-CD2 4.28Å; L109-F171 CarbonylContact O-C 3.39Å; L109-F171 VanDerWaalsContact O-CA 3.32Å; L109-F171 WeakPolarHBondContact O-CA 3.06Å; L109-F171 WeakPolarHBondContact O-CD2 3.37Å; L111-F171 HydrophobicContact CB-CE2 4.31Å; L111-F171 HydrophobicContact CB-CZ 4.31Å; L111-F171 HydrophobicContact CD1-CZ 4.25Å; L136-F171 HydrophobicContact CD1-CD1 4.36Å; L136-F171 HydrophobicContact CD1-CE1 4.22Å; L136-F171 HydrophobicContact CD2-CD1 3.87Å; L136-F171 HydrophobicContact CD2-CE1 4.39Å; L136-F171 HydrophobicContact CG-CD1 3.83Å; L136-F171 HydrophobicContact CG-CE1 3.83Å; F140-F171 HydrophobicContact CB-CD1 4.09Å; F140-F171 HydrophobicContact CB-CE1 3.82Å; F140-F171 HydrophobicContact CB-CZ 4.18Å; F140-F171 HydrophobicContact CD2-CD1 4.34Å; F140-F171 AromaticContact CD2-CD2 3.92Å; F140-F171 HydrophobicContact CD2-CD2 3.92Å; F140-F171 HydrophobicContact CD2-CE1 4.48Å; F140-F171 HydrophobicContact CD2-CE2 4.13Å; F140-F171 HydrophobicContact CD2-CG 4.06Å; F140-F171 HydrophobicContact CD2-CZ 4.38Å; F140-F171 HydrophobicContact CE2-CD2 4.44Å; F140-F171 HydrophobicContact CG-CD1 4.38Å; F140-F171 HydrophobicContact CG-CE1 4.49Å; F140-F171 HydrophobicContact CG-CG 4.49Å; M143-F171 HydrophobicContact CE-CD2 3.9Å; M143-F171 HydrophobicContact CE-CE2 3.24Å; M143-F171 HydrophobicContact CE-CZ 3.91Å; M143-F171 HydrophobicContact SD-CE2 4.34Å; F171-L173 HydrophobicContact CE1-CD2 4.03Å; F171-L173 HydrophobicContact CZ-CB 4.42Å; F171-L173 HydrophobicContact CZ-CD2 4.29Å; F171-S181 CarbonylContact O-C 3.59Å; F171-S181 WeakPolarHBondContact O-CA 3.28Å; F171-L182 PolarHBondContact N-O 3.08Å; F171-L182 PolarHBondContact O-N 3.22Å; F171-L190 HydrophobicContact CB-CD1 3.57Å
172	M	80.9	Confident	82.4	Confident	25 Å²	25	29.3 Å²	29.3	12%	0.123	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	139	-178.7	-61.7	-172.4	-78.8	0	0	110.7	L42 K108 L109 A110 L111 L114 V179 L180	L42-M172 HydrophobicContact CD1-CE 3.15Å; K108-M172 HydrophobicContact CB-CE 4.42Å; K108-M172 HydrophobicContact CD-CE 4.46Å; L109-M172 PolarHBondContact O-N 3.16Å; A110-M172 CarbonylContact C-O 3.57Å; A110-M172 WeakPolarHBondContact CA-O 3.24Å; A110-M172 HydrophobicContact CB-CB 4.41Å; L111-M172 PolarHBondContact N-O 3.02Å; L114-M172 HydrophobicContact CD1-CB 4.18Å; L114-M172 HydrophobicContact CD1-CE 3.94Å; L114-M172 HydrophobicContact CD1-SD 4.01Å; L114-M172 HydrophobicContact CD2-CB 4.43Å; M172-V179 HydrophobicContact CB-CG1 4.36Å; M172-V179 HydrophobicContact SD-CG1 4.45Å; M172-L180 CarbonylContact C-O 3.54Å; M172-L180 VanDerWaalsContact CA-O 3.32Å; M172-L180 WeakPolarHBondContact CA-O 3.5Å
173	L	80.8	Confident	82.2	Confident	13 Å²	13	30.1 Å²	30.1	7%	0.068	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	156	169.1	71.5	77.8	0	0	0	110.6	L111 L136 F171 H175 V179 L180	L111-L173 HydrophobicContact CB-CB 4.01Å; L136-L173 HydrophobicContact CD1-CD1 4.32Å; L136-L173 HydrophobicContact CD1-CD2 3.31Å; L136-L173 HydrophobicContact CD1-CG 3.46Å; L136-L173 VanDerWaalsContact CD1-CG 3.46Å; L136-L173 HydrophobicContact CG-CD2 4.07Å; F171-L173 HydrophobicContact CE1-CD2 4.03Å; F171-L173 HydrophobicContact CZ-CB 4.42Å; F171-L173 HydrophobicContact CZ-CD2 4.29Å; L173-H175 HydrophobicContact CD1-CB 3.61Å; L173-V179 CarbonylContact O-C 3.54Å; L173-V179 WeakPolarHBondContact O-CA 3.3Å; L173-L180 HydrophobicContact CD1-CB 4.12Å; L173-L180 HydrophobicContact CD1-CD1 3.89Å; L173-L180 HydrophobicContact CD1-CG 4.13Å; L173-L180 HydrophobicContact CG-CB 4.27Å; L173-L180 PolarHBondContact N-O 3.2Å; L173-L180 PolarHBondContact O-N 3.27Å
174	C	74.4	Confident	81.7	Confident	28 Å²	28	30.7 Å²	30.7	19%	0.189	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	119.2	172.7	-169.6	0	0	0	0	110	L114 C117 K178	L114-C174 HydrophobicContact CD2-CB 4.45Å; C117-C174 HydrophobicContact CB-CB 4.19Å; C117-C174 WeakPolarHBondContact CB-SG 3.28Å; C117-C174 WeakPolarHBondContact SG-CB 3.46Å; C117-C174 CovalentContact SG-SG 2Å; C117-C174 PolarHBondContact SG-SG 2.89Å; C174-K178 WeakPolarHBondContact CA-O 2.79Å
175	H	76	Confident	81	Confident	94 Å²	94	34.7 Å²	34.7	44%	0.435	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	123.3	174.8	-172.2	75.7	0	0	0	109.4	L173 G177 K178 L180	L173-H175 HydrophobicContact CD1-CB 3.61Å; H175-G177 VanDerWaalsContact C-N 3.26Å; H175-G177 PolarHBondContact O-N 2.9Å; H175-K178 PolarHBondContact N-O 3.44Å; H175-K178 PolarHBondContact O-N 3.39Å; H175-L180 HydrophobicContact CB-CD1 4.06Å; H175-L180 HydrophobicContact CB-CG 4.46Å
176	K	73.4	Confident	80	Confident	183 Å²	183	40.1 Å²	40.1	80%	0.796	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.5	39.3	-178.8	-60.2	176.6	179.5	178.7	0	113.7	K178	K176-K178 PolarHBondContact O-N 3.3Å
177	G	71.8	Confident	79.1	Confident	35 Å²	35	45.1 Å²	45.1	36%	0.361	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	77	-1.4	-180	0	0	0	0	0	115.4	C117 R118 H175	C117-G177 CarbonylContact C-O 3.56Å; C117-G177 WeakPolarHBondContact CA-O 3.3Å; R118-G177 PolarHBondContact N-O 3.37Å; R118-G177 VanDerWaalsContact N-O 3.13Å; H175-G177 VanDerWaalsContact C-N 3.26Å; H175-G177 PolarHBondContact O-N 2.9Å
178	K	73.2	Confident	78.6	Confident	85 Å²	85	51.2 Å²	51.2	37%	0.37	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	136.4	174.5	-55.9	-166	-179.2	-137.4	0	110.3	E119 V121 C174 H175 K176 L180	E119-K178 HydrophobicContact CB-CG 4.42Å; E119-K178 CarbonylContact O-C 3.59Å; E119-K178 WeakPolarHBondContact O-CA 3.22Å; E119-K178 IonicContact OE1-NZ 3.96Å; E119-K178 PolarHBondContact OE1-NZ 2.95Å; E119-K178 WeakPolarHBondContact OE2-CE 3.44Å; E119-K178 IonicContact OE2-NZ 3.43Å; E119-K178 PolarHBondContact OE2-NZ 2.9Å; V121-K178 HydrophobicContact CG2-CB 4.21Å; V121-K178 HydrophobicContact CG2-CD 4.04Å; C174-K178 WeakPolarHBondContact CA-O 2.79Å; H175-K178 PolarHBondContact N-O 3.44Å; H175-K178 PolarHBondContact O-N 3.39Å; K176-K178 PolarHBondContact O-N 3.3Å; K178-L180 PolarHBondContact O-N 3.32Å
179	V	77.7	Confident	78.4	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.006	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	113	171.3	-176.2	0	0	0	0	107.7	L114 C117 E119 V121 M172 L173	L114-V179 HydrophobicContact CD1-CG1 4.45Å; L114-V179 HydrophobicContact CD2-CG1 4.06Å; L114-V179 HydrophobicContact CD2-CG2 4.3Å; C117-V179 HydrophobicContact CB-CG2 3.5Å; C117-V179 VanDerWaalsContact CB-CG2 3.5Å; E119-V179 PolarHBondContact O-N 2.92Å; V121-V179 CarbonylContact C-O 3.59Å; V121-V179 WeakPolarHBondContact CA-O 3.44Å; V121-V179 PolarHBondContact N-O 3.31Å; M172-V179 HydrophobicContact CB-CG1 4.36Å; M172-V179 HydrophobicContact SD-CG1 4.45Å; L173-V179 CarbonylContact O-C 3.54Å; L173-V179 WeakPolarHBondContact O-CA 3.3Å
180	L	77.1	Confident	78.3	Confident	32 Å²	32	51.3 Å²	51.3	17%	0.168	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	118.8	168.1	-54.2	-176.1	0	0	0	107.4	V121 I123 L136 M172 L173 H175 K178	V121-L180 HydrophobicContact CB-CD2 4.21Å; V121-L180 HydrophobicContact CG1-CD2 4.44Å; I123-L180 HydrophobicContact CD1-CB 4.37Å; I123-L180 HydrophobicContact CD1-CD2 4.1Å; L136-L180 HydrophobicContact CD1-CB 3.74Å; L136-L180 HydrophobicContact CD1-CD1 4.37Å; M172-L180 CarbonylContact C-O 3.54Å; M172-L180 VanDerWaalsContact CA-O 3.32Å; M172-L180 WeakPolarHBondContact CA-O 3.5Å; L173-L180 HydrophobicContact CD1-CB 4.12Å; L173-L180 HydrophobicContact CD1-CD1 3.89Å; L173-L180 HydrophobicContact CD1-CG 4.13Å; L173-L180 HydrophobicContact CG-CB 4.27Å; L173-L180 PolarHBondContact N-O 3.2Å; L173-L180 PolarHBondContact O-N 3.27Å; H175-L180 HydrophobicContact CB-CD1 4.06Å; H175-L180 HydrophobicContact CB-CG 4.46Å; K178-L180 PolarHBondContact O-N 3.32Å
181	S	78.1	Confident	78.5	Confident	8 Å²	8	48.4 Å²	48.4	6%	0.056	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	133.6	176.1	65.7	0	0	0	0	111.1	V121 F122 I123 F171	V121-S181 PolarHBondContact O-N 3.38Å; F122-S181 WeakPolarHBondContact CA-OG 3.29Å; F122-S181 WeakPolarHBondContact CD1-OG 3.45Å; I123-S181 PolarHBondContact N-O 3.31Å; I123-S181 VanDerWaalsContact O-O 3.1Å; F171-S181 CarbonylContact O-C 3.59Å; F171-S181 WeakPolarHBondContact O-CA 3.28Å
182	L	81.7	Confident	78.8	Confident	3 Å²	3	48.5 Å²	48.5	2%	0.016	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	135.2	169	-173.5	70.7	0	0	0	108.8	L125 L136 M137 H170 F171 L190	L125-L182 HydrophobicContact CD1-CD1 3.63Å; L125-L182 HydrophobicContact CD1-CD2 4.46Å; L125-L182 HydrophobicContact CD1-CG 3.97Å; L125-L182 HydrophobicContact CG-CD1 3.9Å; L136-L182 HydrophobicContact CD2-CB 3.23Å; L136-L182 HydrophobicContact CD2-CD2 3.73Å; L136-L182 HydrophobicContact CD2-CG 4.01Å; M137-L182 HydrophobicContact CG-CD2 4.41Å; M137-L182 HydrophobicContact SD-CD2 3.72Å; H170-L182 CarbonylContact C-O 3.55Å; H170-L182 WeakPolarHBondContact CA-O 3.31Å; F171-L182 PolarHBondContact N-O 3.08Å; F171-L182 PolarHBondContact O-N 3.22Å; L182-L190 HydrophobicContact CB-CD1 4.11Å; L182-L190 HydrophobicContact CD2-CD1 3.91Å; L182-L190 HydrophobicContact CD2-CD2 3.39Å; L182-L190 HydrophobicContact CD2-CG 4.3Å; L182-L190 HydrophobicContact CG-CD1 3.93Å; L182-L190 HydrophobicContact CG-CD2 3.77Å; L182-L190 HydrophobicContact CG-CG 4.49Å
183	A	81.2	Confident	79.3	Confident	42 Å²	42	47.3 Å²	47.3	35%	0.347	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	126	179.5	0	0	0	0	0	109.7	L125 Y169 H170	L125-A183 WeakPolarHBondContact CD1-O 3.41Å; Y169-A183 CarbonylContact O-C 3.55Å; Y169-A183 WeakPolarHBondContact O-CA 2.96Å; H170-A183 WeakPolarHBondContact ND1-CB 2.94Å
184	G	78.8	Confident	79.8	Confident	15 Å²	15	46.7 Å²	46.7	16%	0.155	25%	0.248	C	C	.	.			trans	-77	172.9	163.1	0	0	0	0	0	111.1	Y169 R188	Y169-G184 PolarHBondContact O-N 3.38Å; G184-R188 CarbonylContact C-O 3.53Å; G184-R188 WeakPolarHBondContact CA-O 3.18Å
185	T	75.5	Confident	80.5	Confident	84 Å²	84	45.6 Å²	45.6	52%	0.515	24%	0.24	S	C	.	.	B	Isolated β-bridge	trans	-97.5	164.4	171	69.9	0	0	0	0	110.1	Y169 N187 R188	Y169-T185 WeakPolarHBondContact CE1-O 3.4Å; T185-N187 PolarHBondContact O-N 3.07Å; T185-N187 VanDerWaalsContact O-N 3.11Å; T185-R188 PolarHBondContact N-O 3.17Å; T185-R188 CarbonylContact O-C 3.6Å; T185-R188 PolarHBondContact O-N 2.73Å; T185-R188 WeakPolarHBondContact OG1-CB 3.45Å; T185-R188 PolarHBondContact OG1-N 3.34Å
186	N	71.6	Confident	81.1	Confident	114 Å²	114	41.5 Å²	41.5	61%	0.61	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-36	179.9	-67.5	-16.6	0	0	0	113	Y169 P228	Y169-N186 VanDerWaalsContact CE1-O 3.29Å; Y169-N186 WeakPolarHBondContact CE1-O 3.17Å; Y169-N186 PolarHBondContact OH-O 3.41Å; N186-P228 HydrophobicContact CB-CB 4.01Å; N186-P228 HydrophobicContact CB-CG 4.22Å; N186-P228 WeakPolarHBondContact O-CB 3.48Å
187	N	72.8	Confident	81.6	Confident	104 Å²	104	37 Å²	37	56%	0.556	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-8.3	179.7	-63.8	-1.6	0	0	0	113.2	T185	T185-N187 PolarHBondContact O-N 3.07Å; T185-N187 VanDerWaalsContact O-N 3.11Å
188	R	79.4	Confident	81.9	Confident	128 Å²	128	44.6 Å²	44.6	48%	0.483	23%	0.231	S	C	.	.	B	Isolated β-bridge	trans	-136.8	76.8	-179.7	-59.8	-174.6	178.1	-177.9	-0.1	109.7	G184 T185 H217	G184-R188 CarbonylContact C-O 3.53Å; G184-R188 WeakPolarHBondContact CA-O 3.18Å; T185-R188 PolarHBondContact N-O 3.17Å; T185-R188 CarbonylContact O-C 3.6Å; T185-R188 PolarHBondContact O-N 2.73Å; T185-R188 WeakPolarHBondContact OG1-CB 3.45Å; T185-R188 PolarHBondContact OG1-N 3.34Å; R188-H217 PolarHBondContact NH1-CD2 2.81Å; R188-H217 VanDerWaalsContact NH1-CD2 3.3Å
189	P	84.6	Confident	82.3	Confident	7 Å²	7	41 Å²	41	5%	0.045	22%	0.216	C	C	.	.			trans	-64.5	153.3	171.8	28.8	-34.7	0	0	0	110.5	L167 Y169 T191 A232	L167-P189 HydrophobicContact CB-CB 4.3Å; L167-P189 HydrophobicContact CB-CG 4.33Å; L167-P189 HydrophobicContact CD2-CG 4.05Å; Y169-P189 HydrophobicContact CD1-CB 4.26Å; Y169-P189 HydrophobicContact CE1-CB 4.01Å; P189-T191 PolarHBondContact O-N 3.09Å; P189-T191 VanDerWaalsContact O-N 3.14Å; P189-T191 PolarHBondContact O-OG1 3.13Å; P189-A232 HydrophobicContact CG-CB 3.89Å
190	L	85.6	Confident	82.6	Confident	11 Å²	11	45.9 Å²	45.9	6%	0.058	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	118.5	167.8	-59.2	169.6	0	0	0	107.8	L125 F140 L167 A168 F171 L182	L125-L190 HydrophobicContact CD1-CD2 4.02Å; F140-L190 HydrophobicContact CE1-CB 4.03Å; F140-L190 HydrophobicContact CZ-CB 4.29Å; L167-L190 WeakPolarHBondContact CA-O 3.27Å; A168-L190 HydrophobicContact CB-CB 4.45Å; A168-L190 PolarHBondContact N-O 2.71Å; A168-L190 WeakPolarHBondContact O-CA 3.4Å; A168-L190 WeakPolarHBondContact O-CB 3.05Å; A168-L190 WeakPolarHBondContact O-CG 3.35Å; A168-L190 PolarHBondContact O-N 3.44Å; F171-L190 HydrophobicContact CB-CD1 3.57Å; L182-L190 HydrophobicContact CB-CD1 4.11Å; L182-L190 HydrophobicContact CD2-CD1 3.91Å; L182-L190 HydrophobicContact CD2-CD2 3.39Å; L182-L190 HydrophobicContact CD2-CG 4.3Å; L182-L190 HydrophobicContact CG-CD1 3.93Å; L182-L190 HydrophobicContact CG-CD2 3.77Å; L182-L190 HydrophobicContact CG-CG 4.49Å
191	T	89.6	Confident	82.8	Confident	4 Å²	4	49 Å²	49	3%	0.025	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	132.5	-174.4	-54.8	0	0	0	0	109.1	V165 I166 L167 P189 L209 L216	V165-T191 HydrophobicContact CG1-CG2 4.13Å; I166-T191 WeakPolarHBondContact O-CA 2.93Å; L167-T191 HydrophobicContact CD2-CG2 3.73Å; L167-T191 VanDerWaalsContact CD2-OG1 3.32Å; L167-T191 WeakPolarHBondContact CD2-OG1 3.22Å; P189-T191 PolarHBondContact O-N 3.09Å; P189-T191 VanDerWaalsContact O-N 3.14Å; P189-T191 PolarHBondContact O-OG1 3.13Å; T191-L209 HydrophobicContact CG2-CD1 4.42Å; T191-L209 WeakPolarHBondContact O-CD1 3.4Å; T191-L216 HydrophobicContact CG2-CD1 3.95Å; T191-L216 VanDerWaalsContact OG1-CD1 3.3Å; T191-L216 WeakPolarHBondContact OG1-CD1 2.9Å
192	T	90	Very high	82.9	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.012	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	148.3	170.2	170.7	0	0	0	0	108	F140 Q141 A144 V165 I166	F140-T192 HydrophobicContact CD1-CG2 3.64Å; F140-T192 HydrophobicContact CD2-CG2 4.23Å; F140-T192 HydrophobicContact CE1-CG2 3.23Å; F140-T192 HydrophobicContact CE2-CG2 3.84Å; F140-T192 HydrophobicContact CG-CG2 4.13Å; F140-T192 HydrophobicContact CZ-CG2 3.33Å; Q141-T192 PolarHBondContact OE1-OG1 2.89Å; A144-T192 HydrophobicContact CB-CG2 3.74Å; V165-T192 WeakPolarHBondContact CA-O 3.19Å; I166-T192 HydrophobicContact CB-CG2 3.65Å; I166-T192 HydrophobicContact CD1-CG2 4.25Å; I166-T192 HydrophobicContact CG1-CG2 4.16Å; I166-T192 HydrophobicContact CG2-CG2 4.49Å; I166-T192 PolarHBondContact N-O 2.78Å; I166-T192 PolarHBondContact O-N 3.01Å; I166-T192 VanDerWaalsContact O-N 3.15Å
193	I	91.4	Very high	83	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.005	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	132.3	176.4	-178.4	163.5	0	0	0	108.8	Q141 I163 L164 V165 L195 A208 L209 L212 L240	Q141-I193 PolarHBondContact NE2-O 2.88Å; I163-I193 HydrophobicContact CG2-CD1 3.98Å; I163-I193 HydrophobicContact CG2-CG1 4.27Å; L164-I193 WeakPolarHBondContact O-CA 3.32Å; V165-I193 HydrophobicContact CG2-CD1 4.17Å; V165-I193 HydrophobicContact CG2-CG1 4.2Å; I193-L195 HydrophobicContact CD1-CD2 3.83Å; I193-L195 HydrophobicContact CG1-CD2 3.92Å; I193-L195 HydrophobicContact CG1-CG 4.31Å; I193-A208 HydrophobicContact CD1-CB 4.2Å; I193-A208 HydrophobicContact CG2-CB 4.2Å; I193-L209 HydrophobicContact CG2-CB 3.88Å; I193-L209 HydrophobicContact CG2-CD1 4.4Å; I193-L212 HydrophobicContact CB-CD1 4.07Å; I193-L212 HydrophobicContact CD1-CD1 3.76Å; I193-L212 HydrophobicContact CG1-CD1 4.48Å; I193-L212 HydrophobicContact CG2-CD1 4.38Å; I193-L240 HydrophobicContact CD1-CD2 3.9Å
194	S	91.1	Very high	83.3	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	132.7	169.6	174.8	0	0	0	0	109.5	N145 R148 L164	N145-S194 VanDerWaalsContact CA-OG 3.3Å; N145-S194 WeakPolarHBondContact CA-OG 3.42Å; N145-S194 PolarHBondContact OD1-OG 3.26Å; R148-S194 WeakPolarHBondContact CD-O 3.33Å; R148-S194 WeakPolarHBondContact CD-OG 3.47Å; R148-S194 PolarHBondContact NE-OG 3.07Å; L164-S194 PolarHBondContact N-O 3.37Å; L164-S194 PolarHBondContact O-N 3.47Å
195	L	90.6	Very high	83.6	Confident	5 Å²	5	51.8 Å²	51.8	3%	0.026	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	151.6	179.8	-60.3	177.1	0	0	0	110.8	R148 D162 I163 I193 L199 R200 I203 E205 A208	R148-L195 PolarHBondContact NE-O 2.97Å; R148-L195 VanDerWaalsContact NE-O 3.16Å; D162-L195 CarbonylContact O-C 3.46Å; D162-L195 WeakPolarHBondContact O-CA 3.48Å; I163-L195 HydrophobicContact CB-CD2 4.48Å; I163-L195 HydrophobicContact CG1-CD2 3.94Å; I163-L195 HydrophobicContact CG2-CD2 4.18Å; I193-L195 HydrophobicContact CD1-CD2 3.83Å; I193-L195 HydrophobicContact CG1-CD2 3.92Å; I193-L195 HydrophobicContact CG1-CG 4.31Å; L195-L199 HydrophobicContact CB-CB 4.06Å; L195-L199 HydrophobicContact CD2-CB 4.46Å; L195-L199 HydrophobicContact CD2-CD1 4.23Å; L195-R200 HydrophobicContact CB-CG 3.96Å; L195-R200 PolarHBondContact O-NE 3.41Å; L195-R200 PolarHBondContact O-NH2 3.3Å; L195-I203 HydrophobicContact CD1-CG2 3.76Å; L195-E205 HydrophobicContact CB-CG 4.24Å; L195-E205 HydrophobicContact CD1-CG 4.1Å; L195-E205 HydrophobicContact CG-CG 4.14Å; L195-E205 PolarHBondContact N-OE1 2.98Å; L195-A208 HydrophobicContact CD1-CB 4.2Å
196	S	87.2	Confident	84	Confident	7 Å²	7	54.8 Å²	54.8	5%	0.049	28%	0.276	C	S	.	.			trans	-69.5	161.8	169.3	67.2	0	0	0	0	111.2	D162 R198 L199 R200	D162-S196 PolarHBondContact O-N 3.08Å; D162-S196 PolarHBondContact OD1-OG 3.36Å; D162-S196 VanDerWaalsContact OD1-OG 3.1Å; S196-R198 PolarHBondContact O-N 3.49Å; S196-L199 PolarHBondContact O-N 3.13Å; S196-L199 VanDerWaalsContact O-N 3.07Å; S196-R200 WeakPolarHBondContact O-CG 3.41Å; S196-R200 PolarHBondContact O-N 3.18Å
197	S	84.2	Confident	84.7	Confident	89 Å²	89	53.7 Å²	53.7	62%	0.622	27%	0.267	S	S	*	.	H	α-helix	trans	-56.6	-32.5	176.8	50.7	0	0	0	0	112.4
198	R	77.9	Confident	85.3	Confident	194 Å²	194	48.8 Å²	48.8	73%	0.732	24%	0.241	S	C	*	.	H	α-helix	trans	-64.6	-38.2	176.5	-64	-178.4	177.6	-170.8	-4	112.7	S196 S201	S196-R198 PolarHBondContact O-N 3.49Å; R198-S201 PolarHBondContact O-OG 3.46Å
199	L	83	Confident	85.7	Confident	11 Å²	11	44.3 Å²	44.3	6%	0.058	23%	0.227	C	C	.	.	H	α-helix	trans	-84.1	-30.4	179.4	-80.2	170.6	0	0	0	112.7	Y99 D162 I163 L195 S196 S201 V202 I203	Y99-L199 HydrophobicContact CD1-CD1 4.03Å; Y99-L199 HydrophobicContact CD1-CD2 4.08Å; Y99-L199 HydrophobicContact CD1-CG 4.28Å; Y99-L199 HydrophobicContact CE1-CD1 4.25Å; Y99-L199 HydrophobicContact CE1-CD2 3.47Å; Y99-L199 VanDerWaalsContact CE1-CD2 3.47Å; Y99-L199 HydrophobicContact CE1-CG 4.02Å; D162-L199 HydrophobicContact CB-CD1 3.9Å; I163-L199 HydrophobicContact CD1-CD1 3.68Å; I163-L199 HydrophobicContact CG1-CD1 3.3Å; L195-L199 HydrophobicContact CB-CB 4.06Å; L195-L199 HydrophobicContact CD2-CB 4.46Å; L195-L199 HydrophobicContact CD2-CD1 4.23Å; S196-L199 PolarHBondContact O-N 3.13Å; S196-L199 VanDerWaalsContact O-N 3.07Å; L199-S201 PolarHBondContact O-N 3.01Å; L199-V202 PolarHBondContact O-N 2.97Å; L199-I203 PolarHBondContact O-N 3.11Å
200	R	83.9	Confident	85.7	Confident	103 Å²	103	45.7 Å²	45.7	39%	0.389	24%	0.242	S	C	.	.	H	α-helix	trans	-64.2	-24.2	177.3	-73.1	-174.5	-158.7	138.5	10.9	113.9	N145 L195 S196 I203 E205	N145-R200 PolarHBondContact OD1-NH2 3.4Å; L195-R200 HydrophobicContact CB-CG 3.96Å; L195-R200 PolarHBondContact O-NE 3.41Å; L195-R200 PolarHBondContact O-NH2 3.3Å; S196-R200 WeakPolarHBondContact O-CG 3.41Å; S196-R200 PolarHBondContact O-N 3.18Å; R200-I203 WeakPolarHBondContact CA-O 3.33Å; R200-E205 HydrophobicContact CG-CG 4.37Å; R200-E205 IonicContact CZ-OE1 3.43Å; R200-E205 IonicContact NE-OE1 2.79Å; R200-E205 PolarHBondContact NE-OE1 2.86Å; R200-E205 IonicContact NH2-OE1 3.31Å; R200-E205 PolarHBondContact NH2-OE1 2.65Å
201	S	80.4	Confident	85.5	Confident	97 Å²	97	45.9 Å²	45.9	68%	0.678	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73	-19.2	173	53.6	0	0	0	0	112.8	R198 L199	R198-S201 PolarHBondContact O-OG 3.46Å; L199-S201 PolarHBondContact O-N 3.01Å
202	V	80.7	Confident	85.4	Confident	55 Å²	55	45.7 Å²	45.7	33%	0.333	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-41	-177.4	-175.4	0	0	0	0	111.5	L199 I251 F258	L199-V202 PolarHBondContact O-N 2.97Å; V202-I251 HydrophobicContact CG2-CG2 3.93Å; V202-F258 WeakPolarHBondContact O-CB 3.46Å
203	I	84.6	Confident	85.2	Confident	10 Å²	10	48.4 Å²	48.4	5%	0.051	26%	0.258	C	S	.	.	S	Bend	trans	-140.5	138	-178.6	-170.1	172.5	0	0	0	111.6	L195 L199 R200 E207 A208 I243 F258	L195-I203 HydrophobicContact CD1-CG2 3.76Å; L199-I203 PolarHBondContact O-N 3.11Å; R200-I203 WeakPolarHBondContact CA-O 3.33Å; I203-E207 HydrophobicContact CD1-CB 4.47Å; I203-E207 HydrophobicContact CG1-CB 4.12Å; I203-A208 HydrophobicContact CD1-CB 4.01Å; I203-A208 HydrophobicContact CG1-CB 4.39Å; I203-I243 HydrophobicContact CD1-CG2 3.49Å; I203-I243 VanDerWaalsContact CD1-CG2 3.49Å; I203-F258 HydrophobicContact CB-CD1 4.49Å; I203-F258 HydrophobicContact CD1-CD1 4.09Å; I203-F258 HydrophobicContact CD1-CE1 3.45Å; I203-F258 VanDerWaalsContact CD1-CE1 3.45Å; I203-F258 HydrophobicContact CD1-CZ 3.97Å; I203-F258 HydrophobicContact CG1-CD1 4.08Å; I203-F258 HydrophobicContact CG1-CE1 3.97Å
204	S	85.7	Confident	84.8	Confident	38 Å²	38	54.6 Å²	54.6	27%	0.266	29%	0.287	S	S	.	.			trans	-72.4	144.9	175.3	74.7	0	0	0	0	111.4	Q206 E207 A208	S204-Q206 PolarHBondContact O-N 3.04Å; S204-E207 PolarHBondContact O-N 3.45Å; S204-E207 VanDerWaalsContact OG-CB 3.3Å; S204-E207 WeakPolarHBondContact OG-CB 3.48Å; S204-E207 WeakPolarHBondContact OG-CG 3.2Å; S204-E207 PolarHBondContact OG-N 3.44Å; S204-E207 VanDerWaalsContact OG-N 3.15Å; S204-E207 PolarHBondContact OG-OE1 3.14Å; S204-A208 PolarHBondContact O-N 3.2Å
205	E	85.7	Confident	84.3	Confident	24 Å²	24	58 Å²	58	11%	0.112	30%	0.3	C	S	.	.	H	α-helix	trans	-60.4	-31.5	177.6	-68.1	-175.2	167.6	0	0	111.3	Q141 N145 L195 R200 L209	Q141-E205 PolarHBondContact NE2-OE2 3.29Å; N145-E205 PolarHBondContact OD1-OE1 3.34Å; L195-E205 HydrophobicContact CB-CG 4.24Å; L195-E205 HydrophobicContact CD1-CG 4.1Å; L195-E205 HydrophobicContact CG-CG 4.14Å; L195-E205 PolarHBondContact N-OE1 2.98Å; R200-E205 HydrophobicContact CG-CG 4.37Å; R200-E205 IonicContact CZ-OE1 3.43Å; R200-E205 IonicContact NE-OE1 2.79Å; R200-E205 PolarHBondContact NE-OE1 2.86Å; R200-E205 IonicContact NH2-OE1 3.31Å; R200-E205 PolarHBondContact NH2-OE1 2.65Å; E205-L209 WeakPolarHBondContact O-CB 3.47Å; E205-L209 PolarHBondContact O-N 3.41Å
206	Q	85.2	Confident	83.9	Confident	147 Å²	147	58.1 Å²	58.1	69%	0.687	30%	0.301	S	S	*	.	H	α-helix	trans	-69	-43.4	176.9	-68.8	83.1	-9.3	0	0	112.5	S204 L209 G210	S204-Q206 PolarHBondContact O-N 3.04Å; Q206-L209 PolarHBondContact O-N 2.93Å; Q206-G210 PolarHBondContact O-N 3.25Å
207	E	84.4	Confident	83.6	Confident	90 Å²	90	61.9 Å²	61.9	42%	0.421	32%	0.317	S	S	.	.	H	α-helix	trans	-65.5	-45.1	175.2	-77.8	157.7	-130.6	0	0	111.3	I203 S204 L209 G210 A211	I203-E207 HydrophobicContact CD1-CB 4.47Å; I203-E207 HydrophobicContact CG1-CB 4.12Å; S204-E207 PolarHBondContact O-N 3.45Å; S204-E207 VanDerWaalsContact OG-CB 3.3Å; S204-E207 WeakPolarHBondContact OG-CB 3.48Å; S204-E207 WeakPolarHBondContact OG-CG 3.2Å; S204-E207 PolarHBondContact OG-N 3.44Å; S204-E207 VanDerWaalsContact OG-N 3.15Å; S204-E207 PolarHBondContact OG-OE1 3.14Å; E207-L209 VanDerWaalsContact C-N 3.34Å; E207-L209 PolarHBondContact O-N 3.49Å; E207-G210 PolarHBondContact O-N 3.17Å; E207-A211 PolarHBondContact O-N 3.4Å
208	A	86.5	Confident	83.5	Confident	1 Å²	1	63.8 Å²	63.8	1%	0.008	31%	0.311	C	S	.	.	H	α-helix	trans	-60.6	-44.4	176.6	0	0	0	0	0	111.3	I193 L195 I203 S204 A211 L212	I193-A208 HydrophobicContact CD1-CB 4.2Å; I193-A208 HydrophobicContact CG2-CB 4.2Å; L195-A208 HydrophobicContact CD1-CB 4.2Å; I203-A208 HydrophobicContact CD1-CB 4.01Å; I203-A208 HydrophobicContact CG1-CB 4.39Å; S204-A208 PolarHBondContact O-N 3.2Å; A208-A211 PolarHBondContact O-N 3.48Å; A208-L212 WeakPolarHBondContact O-CG 2.82Å; A208-L212 PolarHBondContact O-N 2.76Å
209	L	87.3	Confident	83	Confident	35 Å²	35	59.9 Å²	59.9	18%	0.183	31%	0.311	C	S	.	.	H	α-helix	trans	-62.6	-43	175	-177.5	59.8	0	0	0	111.5	T191 I193 E205 Q206 E207 A211 L212 L213	T191-L209 HydrophobicContact CG2-CD1 4.42Å; T191-L209 WeakPolarHBondContact O-CD1 3.4Å; I193-L209 HydrophobicContact CG2-CB 3.88Å; I193-L209 HydrophobicContact CG2-CD1 4.4Å; E205-L209 WeakPolarHBondContact O-CB 3.47Å; E205-L209 PolarHBondContact O-N 3.41Å; Q206-L209 PolarHBondContact O-N 2.93Å; E207-L209 VanDerWaalsContact C-N 3.34Å; E207-L209 PolarHBondContact O-N 3.49Å; L209-A211 PolarHBondContact O-N 3.3Å; L209-L212 PolarHBondContact O-N 2.85Å; L209-L213 HydrophobicContact CD1-CD1 4.16Å; L209-L213 HydrophobicContact CD1-CG 4.1Å; L209-L213 HydrophobicContact CG-CD1 3.93Å; L209-L213 HydrophobicContact CG-CG 4.29Å; L209-L213 WeakPolarHBondContact O-CB 3.46Å; L209-L213 VanDerWaalsContact O-CG 3.26Å; L209-L213 WeakPolarHBondContact O-CG 3.06Å; L209-L213 PolarHBondContact O-N 2.9Å
210	G	84	Confident	82.1	Confident	36 Å²	36	62.9 Å²	62.9	37%	0.371	33%	0.329	S	S	.	.	H	α-helix	trans	-58.7	-45.8	177	0	0	0	0	0	112.4	Q206 E207 L213 Q214	Q206-G210 PolarHBondContact O-N 3.25Å; E207-G210 PolarHBondContact O-N 3.17Å; G210-L213 PolarHBondContact O-N 3.17Å; G210-Q214 WeakPolarHBondContact O-CB 3.11Å; G210-Q214 PolarHBondContact O-N 2.76Å
211	A	82.8	Confident	80.6	Confident	15 Å²	15	61.8 Å²	61.8	12%	0.124	34%	0.342	C	S	.	.	H	α-helix	trans	-63.7	-43.6	177	0	0	0	0	0	112.3	E207 A208 L209 Q214 R215 I243 L260	E207-A211 PolarHBondContact O-N 3.4Å; A208-A211 PolarHBondContact O-N 3.48Å; L209-A211 PolarHBondContact O-N 3.3Å; A211-Q214 PolarHBondContact O-N 3.39Å; A211-R215 PolarHBondContact O-N 2.78Å; A211-R215 VanDerWaalsContact O-N 3.16Å; A211-I243 HydrophobicContact CB-CD1 3.81Å; A211-I243 HydrophobicContact CB-CG1 3.97Å; A211-L260 HydrophobicContact CB-CD2 4.14Å
212	L	86.5	Confident	79	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-62.6	-45.4	175	-71.4	179.4	0	0	0	112.1	V165 I193 A208 L209 Q214 R215 L216 V236 L240 I243	V165-L212 HydrophobicContact CG2-CD1 4.39Å; I193-L212 HydrophobicContact CB-CD1 4.07Å; I193-L212 HydrophobicContact CD1-CD1 3.76Å; I193-L212 HydrophobicContact CG1-CD1 4.48Å; I193-L212 HydrophobicContact CG2-CD1 4.38Å; A208-L212 WeakPolarHBondContact O-CG 2.82Å; A208-L212 PolarHBondContact O-N 2.76Å; L209-L212 PolarHBondContact O-N 2.85Å; L212-Q214 VanDerWaalsContact C-N 3.35Å; L212-Q214 PolarHBondContact O-N 3.41Å; L212-R215 PolarHBondContact O-N 3.03Å; L212-L216 WeakPolarHBondContact O-CB 3.35Å; L212-L216 WeakPolarHBondContact O-CG 3.42Å; L212-L216 PolarHBondContact O-N 2.73Å; L212-V236 HydrophobicContact CD2-CG1 4.2Å; L212-V236 WeakPolarHBondContact CD2-O 3.47Å; L212-L240 HydrophobicContact CD2-CD2 4.27Å; L212-L240 HydrophobicContact CD2-CG 4.09Å; L212-I243 HydrophobicContact CD2-CD1 4.4Å; L212-I243 HydrophobicContact CG-CD1 4.32Å
213	L	86.1	Confident	77.6	Confident	58 Å²	58	68.1 Å²	68.1	30%	0.304	37%	0.371	S	S	.	.	H	α-helix	trans	-63.4	-42.2	177.4	-71.6	176.5	0	0	0	110.6	L209 G210 R215 L216 H217	L209-L213 HydrophobicContact CD1-CD1 4.16Å; L209-L213 HydrophobicContact CD1-CG 4.1Å; L209-L213 HydrophobicContact CG-CD1 3.93Å; L209-L213 HydrophobicContact CG-CG 4.29Å; L209-L213 WeakPolarHBondContact O-CB 3.46Å; L209-L213 VanDerWaalsContact O-CG 3.26Å; L209-L213 WeakPolarHBondContact O-CG 3.06Å; L209-L213 PolarHBondContact O-N 2.9Å; G210-L213 PolarHBondContact O-N 3.17Å; L213-R215 PolarHBondContact O-N 3.09Å; L213-L216 HydrophobicContact CD2-CD1 4.32Å; L213-L216 PolarHBondContact O-N 3.16Å; L213-H217 WeakPolarHBondContact O-CB 3.38Å; L213-H217 PolarHBondContact O-N 3.13Å; L213-H217 PolarHBondContact O-ND1 2.84Å
214	Q	83.1	Confident	76.1	Confident	132 Å²	132	72.9 Å²	72.9	62%	0.617	39%	0.393	S	S	*	.	H	α-helix	trans	-56.7	-39.7	176.7	-170.1	179.4	7.2	0	0	111.7	G210 A211 L212 R218	G210-Q214 WeakPolarHBondContact O-CB 3.11Å; G210-Q214 PolarHBondContact O-N 2.76Å; A211-Q214 PolarHBondContact O-N 3.39Å; L212-Q214 VanDerWaalsContact C-N 3.35Å; L212-Q214 PolarHBondContact O-N 3.41Å; Q214-R218 PolarHBondContact O-N 2.92Å
215	R	81.8	Confident	75.1	Confident	72 Å²	72	76.6 Å²	76.6	27%	0.272	42%	0.419	S	S	.	.	H	α-helix	trans	-71.9	-43.4	176.2	-160.4	70	178.6	145.2	4.4	112.6	A211 L212 L213 H217 R218 K235	A211-R215 PolarHBondContact O-N 2.78Å; A211-R215 VanDerWaalsContact O-N 3.16Å; L212-R215 PolarHBondContact O-N 3.03Å; L213-R215 PolarHBondContact O-N 3.09Å; R215-H217 VanDerWaalsContact C-N 3.31Å; R215-H217 PolarHBondContact O-N 3.08Å; R215-R218 WeakPolarHBondContact O-CB 3.06Å; R215-R218 PolarHBondContact O-N 2.99Å; R215-K235 HydrophobicContact CG-CB 4.35Å; R215-K235 WeakPolarHBondContact CG-O 3.48Å
216	L	81.3	Confident	74.4	Confident	7 Å²	7	78.1 Å²	78.1	4%	0.037	43%	0.426	C	S	.	.	H	α-helix	trans	-60	-40	175.9	-78.9	165.8	0	0	0	112.3	T191 L212 L213 R218 A232 K235 V236	T191-L216 HydrophobicContact CG2-CD1 3.95Å; T191-L216 VanDerWaalsContact OG1-CD1 3.3Å; T191-L216 WeakPolarHBondContact OG1-CD1 2.9Å; L212-L216 WeakPolarHBondContact O-CB 3.35Å; L212-L216 WeakPolarHBondContact O-CG 3.42Å; L212-L216 PolarHBondContact O-N 2.73Å; L213-L216 HydrophobicContact CD2-CD1 4.32Å; L213-L216 PolarHBondContact O-N 3.16Å; L216-R218 VanDerWaalsContact C-N 3.3Å; L216-R218 PolarHBondContact O-N 3.05Å; L216-A232 HydrophobicContact CD2-CB 4.08Å; L216-K235 HydrophobicContact CD2-CB 4.13Å; L216-K235 HydrophobicContact CD2-CD 4.45Å; L216-K235 PolarHBondContact O-NZ 2.63Å; L216-V236 HydrophobicContact CD1-CG2 4.12Å; L216-V236 HydrophobicContact CD2-CG2 4.17Å; L216-V236 HydrophobicContact CG-CG2 4.29Å
217	H	81.4	Confident	74	Confident	85 Å²	85	72.4 Å²	72.4	39%	0.394	40%	0.402	S	S	.	.	H	α-helix	trans	-73.4	-19.5	179.6	-75.1	81.7	0	0	0	113.6	R188 L213 R215	R188-H217 PolarHBondContact NH1-CD2 2.81Å; R188-H217 VanDerWaalsContact NH1-CD2 3.3Å; L213-H217 WeakPolarHBondContact O-CB 3.38Å; L213-H217 PolarHBondContact O-N 3.13Å; L213-H217 PolarHBondContact O-ND1 2.84Å; R215-H217 VanDerWaalsContact C-N 3.31Å; R215-H217 PolarHBondContact O-N 3.08Å
218	R	80.4	Confident	73.7	Confident	130 Å²	130	70.7 Å²	70.7	49%	0.491	40%	0.398	S	S	.	.	S	Bend	trans	-60.6	129.7	178.3	-161.1	171.5	-174.8	157.4	-5.3	109.4	Q214 R215 L216 T220 K235	Q214-R218 PolarHBondContact O-N 2.92Å; R215-R218 WeakPolarHBondContact O-CB 3.06Å; R215-R218 PolarHBondContact O-N 2.99Å; L216-R218 VanDerWaalsContact C-N 3.3Å; L216-R218 PolarHBondContact O-N 3.05Å; R218-T220 PolarHBondContact O-N 3.02Å; R218-K235 PolarHBondContact O-NZ 3.2Å
219	P	69.4	Low	73.5	Confident	112 Å²	112	70.9 Å²	70.9	73%	0.727	40%	0.4	S	S	*	.			trans	-53.6	131.1	172.9	-21.7	31.1	0	0	0	108.9	A221	P219-A221 PolarHBondContact O-N 2.76Å; P219-A221 VanDerWaalsContact O-N 3.07Å
220	T	63.3	Low	73.2	Confident	74 Å²	74	69.2 Å²	69.2	45%	0.454	39%	0.391	S	S	.	.			trans	-64	110.6	166.8	37.8	0	0	0	0	107.1	R218 T222 T231	R218-T220 PolarHBondContact O-N 3.02Å; T220-T222 PolarHBondContact O-N 3.04Å; T220-T231 HydrophobicContact CG2-CG2 3.52Å
221	A	52.4	Low	73.1	Confident	80 Å²	80	68.6 Å²	68.6	66%	0.661	38%	0.38	S	S	*	.			trans	-69.8	120.2	166.9	0	0	0	0	0	106.6	P219	P219-A221 PolarHBondContact O-N 2.76Å; P219-A221 VanDerWaalsContact O-N 3.07Å
222	T	47.4	Very low	73.2	Confident	116 Å²	116	68 Å²	68	71%	0.712	38%	0.375	S	S	*	.	S	Bend	trans	81.7	158.9	166	79	0	0	0	0	118.4	T220 E224	T220-T222 PolarHBondContact O-N 3.04Å; T222-E224 PolarHBondContact O-N 2.89Å
223	N	50.3	Low	73.2	Confident	169 Å²	169	68 Å²	68	90%	0.904	38%	0.375	S	S	*	.			trans	-62	53	-172	-62.4	-30.2	0	0	0	114.8	S225	N223-S225 PolarHBondContact O-N 2.72Å
224	E	53.9	Low	73	Confident	109 Å²	109	66.4 Å²	66.4	51%	0.509	37%	0.367	S	S	.	.			trans	-70.5	115.7	171.2	-69.3	-163.9	164.9	0	0	109.6	T222 F226	T222-E224 PolarHBondContact O-N 2.89Å; E224-F226 HydrophobicContact CB-CD2 3.91Å; E224-F226 HydrophobicContact CB-CE2 4.42Å; E224-F226 HydrophobicContact CG-CD2 4.49Å; E224-F226 PolarHBondContact O-N 3.25Å
225	S	63.6	Low	73.1	Confident	117 Å²	117	61.5 Å²	61.5	82%	0.818	34%	0.343	S	S	*	.			trans	-74.6	24.7	-178.4	71.7	0	0	0	0	113.5	N223	N223-S225 PolarHBondContact O-N 2.72Å
226	F	70.7	Confident	73.3	Confident	56 Å²	56	58.1 Å²	58.1	25%	0.246	33%	0.33	C	S	.	.			trans	-85.6	150.5	-179.6	-64.3	-54.4	0	0	0	110.5	E71 I74 E224 M230 L234	E71-F226 HydrophobicContact CG-CD1 4.05Å; I74-F226 HydrophobicContact CD1-CE1 3.76Å; I74-F226 HydrophobicContact CD1-CZ 4.15Å; E224-F226 HydrophobicContact CB-CD2 3.91Å; E224-F226 HydrophobicContact CB-CE2 4.42Å; E224-F226 HydrophobicContact CG-CD2 4.49Å; E224-F226 PolarHBondContact O-N 3.25Å; F226-M230 HydrophobicContact CB-CB 4.18Å; F226-M230 HydrophobicContact CB-CG 3.99Å; F226-M230 HydrophobicContact CD1-CG 4.16Å; F226-M230 HydrophobicContact CG-CG 4.11Å; F226-L234 HydrophobicContact CD2-CD1 4.2Å; F226-L234 HydrophobicContact CE2-CD1 4.34Å
227	S	76.7	Confident	73.4	Confident	27 Å²	27	58 Å²	58	19%	0.189	33%	0.33	C	S	.	.			trans	-56.3	150.1	170.4	58.4	0	0	0	0	110.5	E71 S229 M230 T231	E71-S227 VanDerWaalsContact CD-OG 3.3Å; E71-S227 VanDerWaalsContact OE1-CB 3.27Å; E71-S227 WeakPolarHBondContact OE1-CB 3.12Å; E71-S227 PolarHBondContact OE1-N 2Å; E71-S227 PolarHBondContact OE1-OG 2.72Å; E71-S227 PolarHBondContact OE2-OG 3.45Å; S227-S229 WeakPolarHBondContact CB-OG 3.44Å; S227-S229 PolarHBondContact O-N 3.49Å; S227-S229 PolarHBondContact OG-OG 2.81Å; S227-M230 PolarHBondContact O-N 3.4Å; S227-M230 VanDerWaalsContact O-N 3.13Å; S227-M230 WeakPolarHBondContact OG-CB 3.26Å; S227-M230 PolarHBondContact OG-N 3.14Å; S227-T231 PolarHBondContact O-N 3.48Å; S227-T231 PolarHBondContact O-OG1 3.23Å
228	P	79.1	Confident	73.4	Confident	53 Å²	53	57.9 Å²	57.9	34%	0.344	33%	0.33	S	S	.	.	H	α-helix	trans	-55.2	-34.5	176.1	-27.1	35.1	0	0	0	113.2	N186 A232	N186-P228 HydrophobicContact CB-CB 4.01Å; N186-P228 HydrophobicContact CB-CG 4.22Å; N186-P228 WeakPolarHBondContact O-CB 3.48Å; P228-A232 WeakPolarHBondContact O-CB 3.22Å; P228-A232 PolarHBondContact O-N 2.83Å
229	S	82.6	Confident	73.5	Confident	6 Å²	6	51.8 Å²	51.8	4%	0.042	31%	0.308	C	S	.	.	H	α-helix	trans	-63.9	-52	173.6	34	0	0	0	0	112.2	L66 Y169 S227 T231 A232 V233	L66-S229 PolarHBondContact O-OG 3.43Å; Y169-S229 VanDerWaalsContact OH-CA 3.24Å; Y169-S229 WeakPolarHBondContact OH-CA 3.49Å; Y169-S229 PolarHBondContact OH-N 2.9Å; S227-S229 WeakPolarHBondContact CB-OG 3.44Å; S227-S229 PolarHBondContact O-N 3.49Å; S227-S229 PolarHBondContact OG-OG 2.81Å; S229-T231 VanDerWaalsContact C-N 3.32Å; S229-T231 PolarHBondContact O-N 3.05Å; S229-A232 WeakPolarHBondContact O-CB 3.32Å; S229-A232 PolarHBondContact O-N 3.13Å; S229-V233 WeakPolarHBondContact O-CG2 3.49Å; S229-V233 PolarHBondContact O-N 3.39Å
230	M	81.4	Confident	74.2	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-61.4	-42.6	177.6	176.2	57.7	172	0	0	111.5	E71 I74 L75 F226 S227 A232 V233 L234	E71-M230 HydrophobicContact CB-CB 4.36Å; E71-M230 HydrophobicContact CB-CE 4.23Å; E71-M230 HydrophobicContact CB-CG 3.94Å; E71-M230 HydrophobicContact CB-SD 4.06Å; E71-M230 HydrophobicContact CG-CB 4.23Å; E71-M230 HydrophobicContact CG-CG 3.95Å; E71-M230 VanDerWaalsContact O-CE 3.31Å; E71-M230 WeakPolarHBondContact O-CE 3.25Å; E71-M230 WeakPolarHBondContact OE1-CB 3.45Å; I74-M230 HydrophobicContact CB-CE 4.24Å; I74-M230 HydrophobicContact CG2-CE 4.12Å; L75-M230 HydrophobicContact CB-CE 3.83Å; L75-M230 HydrophobicContact CB-SD 4.16Å; L75-M230 HydrophobicContact CD2-SD 4.42Å; F226-M230 HydrophobicContact CB-CB 4.18Å; F226-M230 HydrophobicContact CB-CG 3.99Å; F226-M230 HydrophobicContact CD1-CG 4.16Å; F226-M230 HydrophobicContact CG-CG 4.11Å; S227-M230 PolarHBondContact O-N 3.4Å; S227-M230 VanDerWaalsContact O-N 3.13Å; S227-M230 WeakPolarHBondContact OG-CB 3.26Å; S227-M230 PolarHBondContact OG-N 3.14Å; M230-A232 VanDerWaalsContact C-N 3.32Å; M230-A232 PolarHBondContact O-N 3.45Å; M230-V233 PolarHBondContact O-N 2.92Å; M230-L234 HydrophobicContact CE-CD1 3.87Å; M230-L234 HydrophobicContact CE-CD2 3.89Å; M230-L234 HydrophobicContact CE-CG 3.83Å; M230-L234 HydrophobicContact CG-CD1 4.34Å; M230-L234 WeakPolarHBondContact O-CG 3.32Å; M230-L234 PolarHBondContact O-N 2.76Å; M230-L234 HydrophobicContact SD-CD1 4.47Å; M230-L234 HydrophobicContact SD-CG 4.13Å
231	T	81.7	Confident	75	Confident	22 Å²	22	44.7 Å²	44.7	14%	0.135	26%	0.261	C	S	.	.	H	α-helix	trans	-58.9	-43.8	175.5	-56.9	0	0	0	0	111.5	T220 S227 S229 K235	T220-T231 HydrophobicContact CG2-CG2 3.52Å; S227-T231 PolarHBondContact O-N 3.48Å; S227-T231 PolarHBondContact O-OG1 3.23Å; S229-T231 VanDerWaalsContact C-N 3.32Å; S229-T231 PolarHBondContact O-N 3.05Å; T231-K235 WeakPolarHBondContact O-CG 3.37Å; T231-K235 PolarHBondContact O-N 3.48Å; T231-K235 VanDerWaalsContact O-N 3.08Å
232	A	85.1	Confident	76.2	Confident	2 Å²	2	45.9 Å²	45.9	2%	0.017	26%	0.256	C	S	.	.	H	α-helix	trans	-63.5	-43.7	176.8	0	0	0	0	0	111.7	P189 L216 P228 S229 M230 K235 V236	P189-A232 HydrophobicContact CG-CB 3.89Å; L216-A232 HydrophobicContact CD2-CB 4.08Å; P228-A232 WeakPolarHBondContact O-CB 3.22Å; P228-A232 PolarHBondContact O-N 2.83Å; S229-A232 WeakPolarHBondContact O-CB 3.32Å; S229-A232 PolarHBondContact O-N 3.13Å; M230-A232 VanDerWaalsContact C-N 3.32Å; M230-A232 PolarHBondContact O-N 3.45Å; A232-K235 PolarHBondContact O-N 2.91Å; A232-V236 WeakPolarHBondContact O-CG2 3.37Å; A232-V236 PolarHBondContact O-N 3.5Å
233	V	84.9	Confident	77.7	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-63	-47.3	177.6	175.8	0	0	0	0	111	I67 L75 I103 L105 L167 S229 M230 K235 V236 V237	I67-V233 HydrophobicContact CD1-CG2 4.34Å; L75-V233 HydrophobicContact CD1-CG1 3.77Å; L75-V233 HydrophobicContact CD2-CG1 3.63Å; L75-V233 HydrophobicContact CG-CG1 4.38Å; I103-V233 HydrophobicContact CD1-CG1 4.1Å; L105-V233 HydrophobicContact CD2-CG2 4.37Å; L167-V233 HydrophobicContact CD1-CG2 3.69Å; S229-V233 WeakPolarHBondContact O-CG2 3.49Å; S229-V233 PolarHBondContact O-N 3.39Å; M230-V233 PolarHBondContact O-N 2.92Å; V233-K235 VanDerWaalsContact C-N 3.31Å; V233-K235 PolarHBondContact O-N 3.26Å; V233-V236 WeakPolarHBondContact O-CB 3.42Å; V233-V236 PolarHBondContact O-N 3.32Å; V233-V236 VanDerWaalsContact O-N 3.13Å; V233-V237 HydrophobicContact CG1-CG2 4.22Å; V233-V237 VanDerWaalsContact O-CG2 3.23Å; V233-V237 WeakPolarHBondContact O-CG2 3.44Å; V233-V237 PolarHBondContact O-N 3.34Å
234	L	82.8	Confident	78.8	Confident	26 Å²	26	34.7 Å²	34.7	14%	0.136	19%	0.191	C	C	.	.	H	α-helix	trans	-57.9	-42.3	177.2	-74.5	177.2	0	0	0	112.3	L75 F226 M230 V237 Q238	L75-L234 HydrophobicContact CD1-CD2 4.03Å; F226-L234 HydrophobicContact CD2-CD1 4.2Å; F226-L234 HydrophobicContact CE2-CD1 4.34Å; M230-L234 HydrophobicContact CE-CD1 3.87Å; M230-L234 HydrophobicContact CE-CD2 3.89Å; M230-L234 HydrophobicContact CE-CG 3.83Å; M230-L234 HydrophobicContact CG-CD1 4.34Å; M230-L234 WeakPolarHBondContact O-CG 3.32Å; M230-L234 PolarHBondContact O-N 2.76Å; M230-L234 HydrophobicContact SD-CD1 4.47Å; M230-L234 HydrophobicContact SD-CG 4.13Å; L234-V237 PolarHBondContact O-N 3.25Å; L234-Q238 WeakPolarHBondContact O-CB 3.33Å; L234-Q238 VanDerWaalsContact O-CG 3.3Å; L234-Q238 WeakPolarHBondContact O-CG 3.4Å; L234-Q238 PolarHBondContact O-N 3.48Å
235	K	84.5	Confident	79.4	Confident	29 Å²	29	32.9 Å²	32.9	13%	0.126	20%	0.195	C	C	.	.	H	α-helix	trans	-63.7	-40.4	176.2	-73.8	-178.8	-179.3	-170.7	0	112.4	R215 L216 R218 T231 A232 V233 Q238 G239	R215-K235 HydrophobicContact CG-CB 4.35Å; R215-K235 WeakPolarHBondContact CG-O 3.48Å; L216-K235 HydrophobicContact CD2-CB 4.13Å; L216-K235 HydrophobicContact CD2-CD 4.45Å; L216-K235 PolarHBondContact O-NZ 2.63Å; R218-K235 PolarHBondContact O-NZ 3.2Å; T231-K235 WeakPolarHBondContact O-CG 3.37Å; T231-K235 PolarHBondContact O-N 3.48Å; T231-K235 VanDerWaalsContact O-N 3.08Å; A232-K235 PolarHBondContact O-N 2.91Å; V233-K235 VanDerWaalsContact C-N 3.31Å; V233-K235 PolarHBondContact O-N 3.26Å; K235-Q238 PolarHBondContact O-N 2.85Å; K235-G239 PolarHBondContact O-N 2.69Å
236	V	86.7	Confident	78.9	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62.9	-47	175.5	165.9	0	0	0	0	110.6	V165 L167 L212 L216 A232 V233 Q238 G239 L240	V165-V236 HydrophobicContact CB-CG1 4.22Å; V165-V236 HydrophobicContact CG1-CG1 3.8Å; V165-V236 HydrophobicContact CG2-CG1 4.07Å; L167-V236 HydrophobicContact CD1-CG2 4.39Å; L167-V236 HydrophobicContact CD2-CG2 4.03Å; L212-V236 HydrophobicContact CD2-CG1 4.2Å; L212-V236 WeakPolarHBondContact CD2-O 3.47Å; L216-V236 HydrophobicContact CD1-CG2 4.12Å; L216-V236 HydrophobicContact CD2-CG2 4.17Å; L216-V236 HydrophobicContact CG-CG2 4.29Å; A232-V236 WeakPolarHBondContact O-CG2 3.37Å; A232-V236 PolarHBondContact O-N 3.5Å; V233-V236 WeakPolarHBondContact O-CB 3.42Å; V233-V236 PolarHBondContact O-N 3.32Å; V233-V236 VanDerWaalsContact O-N 3.13Å; V236-Q238 VanDerWaalsContact C-N 3.34Å; V236-Q238 PolarHBondContact O-N 2.97Å; V236-G239 PolarHBondContact O-N 2.69Å; V236-L240 HydrophobicContact CG1-CD1 4.15Å; V236-L240 HydrophobicContact CG1-CG 4.4Å; V236-L240 WeakPolarHBondContact O-CB 2.98Å; V236-L240 WeakPolarHBondContact O-CG 3.27Å; V236-L240 PolarHBondContact O-N 2.85Å
237	V	84	Confident	77.9	Confident	4 Å²	4	35.6 Å²	35.6	2%	0.024	20%	0.202	C	C	.	.	H	α-helix	trans	-60.9	-43.6	179.1	170.3	0	0	0	0	111.5	L75 L79 I103 V233 L234 L240 N241	L75-V237 HydrophobicContact CD1-CG2 4.31Å; L79-V237 HydrophobicContact CD1-CG1 4.36Å; L79-V237 HydrophobicContact CD1-CG2 3.69Å; L79-V237 HydrophobicContact CD2-CB 4.22Å; L79-V237 HydrophobicContact CD2-CG1 3.4Å; L79-V237 VanDerWaalsContact CD2-CG1 3.4Å; L79-V237 HydrophobicContact CD2-CG2 3.82Å; L79-V237 HydrophobicContact CG-CG1 3.75Å; L79-V237 HydrophobicContact CG-CG2 4.02Å; I103-V237 HydrophobicContact CD1-CG2 3.99Å; V233-V237 HydrophobicContact CG1-CG2 4.22Å; V233-V237 VanDerWaalsContact O-CG2 3.23Å; V233-V237 WeakPolarHBondContact O-CG2 3.44Å; V233-V237 PolarHBondContact O-N 3.34Å; L234-V237 PolarHBondContact O-N 3.25Å; V237-L240 PolarHBondContact O-N 3.16Å; V237-N241 PolarHBondContact O-N 3.46Å; V237-N241 PolarHBondContact O-ND2 3.08Å
238	Q	80.9	Confident	76.5	Confident	83 Å²	83	37.5 Å²	37.5	39%	0.388	21%	0.209	S	C	.	.	H	α-helix	trans	-62.3	-45.6	174.1	-72.1	175.6	4	0	0	111.7	L234 K235 V236 L240 N241 D242	L234-Q238 WeakPolarHBondContact O-CB 3.33Å; L234-Q238 VanDerWaalsContact O-CG 3.3Å; L234-Q238 WeakPolarHBondContact O-CG 3.4Å; L234-Q238 PolarHBondContact O-N 3.48Å; K235-Q238 PolarHBondContact O-N 2.85Å; V236-Q238 VanDerWaalsContact C-N 3.34Å; V236-Q238 PolarHBondContact O-N 2.97Å; Q238-L240 VanDerWaalsContact C-N 3.33Å; Q238-L240 PolarHBondContact O-N 3.19Å; Q238-N241 WeakPolarHBondContact O-CB 3.08Å; Q238-N241 PolarHBondContact O-N 3.41Å; Q238-N241 VanDerWaalsContact O-N 3.15Å; Q238-D242 PolarHBondContact O-N 3.45Å
239	G	82.3	Confident	74.6	Confident	3 Å²	3	41.5 Å²	41.5	3%	0.031	23%	0.227	C	C	.	.	H	α-helix	trans	-62.5	-38.7	177.2	0	0	0	0	0	112.9	K235 V236 D242 I243	K235-G239 PolarHBondContact O-N 2.69Å; V236-G239 PolarHBondContact O-N 2.69Å; G239-D242 PolarHBondContact O-N 3.21Å; G239-I243 WeakPolarHBondContact O-CD1 3.38Å; G239-I243 WeakPolarHBondContact O-CG1 3.48Å; G239-I243 PolarHBondContact O-N 3.36Å
240	L	84	Confident	72.5	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.01	26%	0.263	C	S	.	.	H	α-helix	trans	-61.8	-42.1	172.6	-77.1	179.5	0	0	0	111.9	F83 L101 I163 V165 I193 L212 V236 V237 Q238 D242 I243 M244	F83-L240 HydrophobicContact CZ-CB 4.38Å; L101-L240 HydrophobicContact CD1-CD1 3.65Å; L101-L240 HydrophobicContact CD2-CD1 3.92Å; L101-L240 HydrophobicContact CG-CD1 4.48Å; I163-L240 HydrophobicContact CG2-CD2 4.12Å; V165-L240 HydrophobicContact CG2-CD1 4.09Å; V165-L240 HydrophobicContact CG2-CD2 4.48Å; I193-L240 HydrophobicContact CD1-CD2 3.9Å; L212-L240 HydrophobicContact CD2-CD2 4.27Å; L212-L240 HydrophobicContact CD2-CG 4.09Å; V236-L240 HydrophobicContact CG1-CD1 4.15Å; V236-L240 HydrophobicContact CG1-CG 4.4Å; V236-L240 WeakPolarHBondContact O-CB 2.98Å; V236-L240 WeakPolarHBondContact O-CG 3.27Å; V236-L240 PolarHBondContact O-N 2.85Å; V237-L240 PolarHBondContact O-N 3.16Å; Q238-L240 VanDerWaalsContact C-N 3.33Å; Q238-L240 PolarHBondContact O-N 3.19Å; L240-D242 VanDerWaalsContact C-N 3.3Å; L240-D242 PolarHBondContact O-N 3.31Å; L240-I243 PolarHBondContact O-N 3.36Å; L240-M244 HydrophobicContact CB-CE 3.51Å; L240-M244 HydrophobicContact CD2-CE 3.87Å; L240-M244 HydrophobicContact CG-CE 4.15Å; L240-M244 WeakPolarHBondContact O-CB 3.4Å; L240-M244 WeakPolarHBondContact O-CE 3.19Å; L240-M244 PolarHBondContact O-N 2.95Å
241	N	80	Confident	70.8	Confident	34 Å²	34	54.6 Å²	54.6	18%	0.182	28%	0.28	C	S	.	.	H	α-helix	trans	-62	-37	176	-79	-27.1	0	0	0	112.8	K82 F83 V237 Q238 A245	K82-N241 VanDerWaalsContact CD-OD1 3.23Å; K82-N241 WeakPolarHBondContact CD-OD1 3.45Å; F83-N241 WeakPolarHBondContact CE2-OD1 3.46Å; V237-N241 PolarHBondContact O-N 3.46Å; V237-N241 PolarHBondContact O-ND2 3.08Å; Q238-N241 WeakPolarHBondContact O-CB 3.08Å; Q238-N241 PolarHBondContact O-N 3.41Å; Q238-N241 VanDerWaalsContact O-N 3.15Å; N241-A245 PolarHBondContact O-N 3.47Å
242	D	78.5	Confident	68.6	Low	105 Å²	105	63 Å²	63	56%	0.561	32%	0.318	S	S	*	.	H	α-helix	trans	-69.7	-39.1	177.6	-63.2	-21.7	0	0	0	111.2	Q238 G239 L240	Q238-D242 PolarHBondContact O-N 3.45Å; G239-D242 PolarHBondContact O-N 3.21Å; L240-D242 VanDerWaalsContact C-N 3.3Å; L240-D242 PolarHBondContact O-N 3.31Å
243	I	78.1	Confident	66.5	Low	19 Å²	19	66.4 Å²	66.4	10%	0.097	35%	0.346	C	S	.	.	H	α-helix	trans	-67.6	-37.9	177.9	-66.5	161.8	0	0	0	111.3	I203 A211 L212 G239 L240	I203-I243 HydrophobicContact CD1-CG2 3.49Å; I203-I243 VanDerWaalsContact CD1-CG2 3.49Å; A211-I243 HydrophobicContact CB-CD1 3.81Å; A211-I243 HydrophobicContact CB-CG1 3.97Å; L212-I243 HydrophobicContact CD2-CD1 4.4Å; L212-I243 HydrophobicContact CG-CD1 4.32Å; G239-I243 WeakPolarHBondContact O-CD1 3.38Å; G239-I243 WeakPolarHBondContact O-CG1 3.48Å; G239-I243 PolarHBondContact O-N 3.36Å; L240-I243 PolarHBondContact O-N 3.36Å
244	M	74	Confident	64	Low	31 Å²	31	71.7 Å²	71.7	15%	0.153	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	24.1	-172.3	-69.4	179.8	-82.6	0	0	114.4	F83 Y99 I163 L240 F246	F83-M244 HydrophobicContact CD1-CE 4.35Å; F83-M244 HydrophobicContact CE1-CE 3.16Å; F83-M244 HydrophobicContact CE1-SD 3.65Å; F83-M244 HydrophobicContact CZ-CE 3.37Å; F83-M244 HydrophobicContact CZ-SD 4.35Å; Y99-M244 HydrophobicContact CD2-CG 4.44Å; Y99-M244 HydrophobicContact CD2-SD 3.62Å; Y99-M244 HydrophobicContact CE2-CB 4.46Å; Y99-M244 HydrophobicContact CE2-CG 4.34Å; Y99-M244 HydrophobicContact CE2-SD 4.08Å; Y99-M244 HydrophobicContact CG-SD 4.07Å; I163-M244 HydrophobicContact CD1-CE 3.55Å; I163-M244 HydrophobicContact CD1-SD 3.19Å; I163-M244 WeakPolarHBondContact CD1-SD 3.26Å; L240-M244 HydrophobicContact CB-CE 3.51Å; L240-M244 HydrophobicContact CD2-CE 3.87Å; L240-M244 HydrophobicContact CG-CE 4.15Å; L240-M244 WeakPolarHBondContact O-CB 3.4Å; L240-M244 WeakPolarHBondContact O-CE 3.19Å; L240-M244 PolarHBondContact O-N 2.95Å; M244-F246 PolarHBondContact O-N 3.27Å
245	A	66.3	Low	61.7	Low	71 Å²	71	74.9 Å²	74.9	59%	0.587	41%	0.413	S	S	*	.			trans	-68.1	10.8	-178.8	0	0	0	0	0	115.4	N241	N241-A245 PolarHBondContact O-N 3.47Å
246	F	52.4	Low	59.3	Low	134 Å²	134	83 Å²	83	59%	0.588	45%	0.445	S	S	*	.	S	Bend	trans	-109.4	127	179	-68.7	-80	0	0	0	112.1	M244 F258	M244-F246 PolarHBondContact O-N 3.27Å; F246-F258 HydrophobicContact CD2-CE2 4.45Å; F246-F258 HydrophobicContact CE2-CE2 4.22Å
247	P	49	Very low	56.6	Low	97 Å²	97	90.5 Å²	90.5	63%	0.63	49%	0.485	S	S	*	.			trans	-69	144.3	175.3	25.7	-30.6	0	0	0	112.5	D249	P247-D249 VanDerWaalsContact C-N 3.29Å; P247-D249 PolarHBondContact O-N 3.06Å
248	M	47.1	Very low	54.4	Low	67 Å²	67	92.6 Å²	92.6	33%	0.33	49%	0.493	S	S	.	.	G	3₁₀ helix	trans	-56.1	-32.6	-172.3	-75.6	-73.8	-74	0	0	114.7	Y99 R250 I251	Y99-M248 HydrophobicContact CE1-SD 3.7Å; Y99-M248 HydrophobicContact CE2-SD 4.3Å; Y99-M248 PolarHBondContact OH-SD 3.44Å; M248-R250 PolarHBondContact O-N 2.89Å; M248-I251 PolarHBondContact O-N 3.01Å; M248-I251 HydrophobicContact SD-CD1 4.11Å
249	D	41	Very low	51.9	Low	137 Å²	137	94.4 Å²	94.4	73%	0.733	51%	0.51	S	S	*	.	G	3₁₀ helix	trans	-63.7	-6.2	-172.7	-81.3	-4.1	0	0	0	116	P247	P247-D249 VanDerWaalsContact C-N 3.29Å; P247-D249 PolarHBondContact O-N 3.06Å
250	R	37.9	Very low	49.4	Very low	209 Å²	209	97.6 Å²	97.6	79%	0.789	53%	0.527	S	S	*	.	G	3₁₀ helix	trans	-105.5	-4.1	173.7	-71.6	-170	-157.8	-157.9	3.9	115	M248	M248-R250 PolarHBondContact O-N 2.89Å
251	I	44.8	Very low	46.9	Very low	72 Å²	72	102 Å²	102	37%	0.369	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78	-22.8	-175.2	-57.9	178.7	0	0	0	111.6	V202 M248	V202-I251 HydrophobicContact CG2-CG2 3.93Å; M248-I251 PolarHBondContact O-N 3.01Å; M248-I251 HydrophobicContact SD-CD1 4.11Å
252	E	36.7	Very low	44.4	Very low	199 Å²	199	109.7 Å²	109.7	93%	0.93	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	-8.5	177.8	-83	-173.2	163.5	0	0	115.4
253	A	39.6	Very low	42.4	Very low	73 Å²	73	109 Å²	109	60%	0.603	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101	-45.2	-174.7	0	0	0	0	0	114.4
254	D	32.8	Very low	40	Very low	110 Å²	110	113 Å²	113	59%	0.588	62%	0.619	S	S	*	*			trans	-140.2	118.4	-169.9	-67	-52	0	0	0	111.6	Y256	D254-Y256 VanDerWaalsContact C-N 3.32Å; D254-Y256 HydrophobicContact CB-CD2 3.85Å; D254-Y256 HydrophobicContact CB-CE2 3.76Å; D254-Y256 PolarHBondContact O-N 3.15Å
255	G	35.4	Very low	38	Very low	93 Å²	93	117.2 Å²	117.2	96%	0.959	65%	0.65	S	S	*	*			trans	-64.2	85.7	174.8	0	0	0	0	0	111.9
256	Y	33.5	Very low	36.3	Very low	201 Å²	201	119.9 Å²	119.9	79%	0.788	65%	0.652	S	S	*	*			trans	-90.2	130.2	171.1	-85.4	-81.5	0	0	0	111.3	D254 F258	D254-Y256 VanDerWaalsContact C-N 3.32Å; D254-Y256 HydrophobicContact CB-CD2 3.85Å; D254-Y256 HydrophobicContact CB-CE2 3.76Å; D254-Y256 PolarHBondContact O-N 3.15Å; Y256-F258 PolarHBondContact O-N 3.38Å
257	N	31.2	Very low	35.2	Very low	157 Å²	157	120.2 Å²	120.2	84%	0.84	66%	0.66	S	S	*	*			trans	-63.9	118.4	168.6	-72.3	-27.9	0	0	0	109.8	T259	N257-T259 PolarHBondContact O-N 2.86Å; N257-T259 VanDerWaalsContact O-N 3.12Å
258	F	36.6	Very low	34	Very low	47 Å²	47	123 Å²	123	21%	0.206	67%	0.669	C	S	.	*			trans	-69.2	104.3	175.7	-176.6	-102.3	0	0	0	110.1	V202 I203 F246 Y256 L260	V202-F258 WeakPolarHBondContact O-CB 3.46Å; I203-F258 HydrophobicContact CB-CD1 4.49Å; I203-F258 HydrophobicContact CD1-CD1 4.09Å; I203-F258 HydrophobicContact CD1-CE1 3.45Å; I203-F258 VanDerWaalsContact CD1-CE1 3.45Å; I203-F258 HydrophobicContact CD1-CZ 3.97Å; I203-F258 HydrophobicContact CG1-CD1 4.08Å; I203-F258 HydrophobicContact CG1-CE1 3.97Å; F246-F258 HydrophobicContact CD2-CE2 4.45Å; F246-F258 HydrophobicContact CE2-CE2 4.22Å; Y256-F258 PolarHBondContact O-N 3.38Å; F258-L260 HydrophobicContact CD1-CD1 4.41Å; F258-L260 HydrophobicContact CE1-CD1 3.6Å; F258-L260 HydrophobicContact CE1-CG 3.95Å; F258-L260 HydrophobicContact CZ-CD1 4.39Å; F258-L260 HydrophobicContact CZ-CG 4.31Å
259	T	29.1	Very low	33.3	Very low	121 Å²	121	127.5 Å²	127.5	74%	0.742	69%	0.69	S	S	*	*			trans	-98.3	115.9	160.1	53.9	0	0	0	0	107.7	N257	N257-T259 PolarHBondContact O-N 2.86Å; N257-T259 VanDerWaalsContact O-N 3.12Å
260	L	29.8	Very low	32.8	Very low	71 Å²	71	126.8 Å²	126.8	37%	0.372	69%	0.69	S	S	.	*			trans	-44.9	126.8	168.6	-107	105.9	0	0	0	108.2	A211 F258 K262	A211-L260 HydrophobicContact CB-CD2 4.14Å; F258-L260 HydrophobicContact CD1-CD1 4.41Å; F258-L260 HydrophobicContact CE1-CD1 3.6Å; F258-L260 HydrophobicContact CE1-CG 3.95Å; F258-L260 HydrophobicContact CZ-CD1 4.39Å; F258-L260 HydrophobicContact CZ-CG 4.31Å; L260-K262 PolarHBondContact O-N 3.4Å
261	P	30.6	Very low	32.4	Very low	93 Å²	93	126 Å²	126	60%	0.604	70%	0.695	S	S	*	*			trans	-56.7	112.2	164.9	21.4	-27.9	0	0	0	106	S263	P261-S263 PolarHBondContact O-N 3.15Å
262	K	27.8	Very low	31.9	Very low	197 Å²	197	127.8 Å²	127.8	86%	0.857	71%	0.714	S	S	*	*			trans	-48.1	117.4	163.4	-85.3	177.1	179.3	172.6	0	104	L260 S264	L260-K262 PolarHBondContact O-N 3.4Å; K262-S264 PolarHBondContact O-N 3.04Å
263	S	35.9	Very low	31.7	Very low	91 Å²	91	125 Å²	125	64%	0.636	71%	0.711	S	S	*	*			trans	-36.2	114.6	177.3	53.7	0	0	0	0	107.2	P261 P265	P261-S263 PolarHBondContact O-N 3.15Å; S263-P265 WeakPolarHBondContact O-CD 3.42Å
264	S	29.3	Very low	31.6	Very low	101 Å²	101	124.2 Å²	124.2	71%	0.706	71%	0.71	S	S	*	*			trans	-46.5	120.9	177.7	46.3	0	0	0	0	106.3	K262 I266	K262-S264 PolarHBondContact O-N 3.04Å; S264-I266 PolarHBondContact O-N 3.24Å
265	P	30.5	Very low	32	Very low	121 Å²	121	127.9 Å²	127.9	79%	0.786	72%	0.723	S	S	*	*			trans	-55.3	125.7	175.6	23.1	-30.2	0	0	0	105.3	S263 L267	S263-P265 WeakPolarHBondContact O-CD 3.42Å; P265-L267 PolarHBondContact O-N 2Å
266	I	30.9	Very low	32.8	Very low	126 Å²	126	129.4 Å²	129.4	65%	0.646	72%	0.716	S	S	*	*			trans	-39.9	119.7	177	-69.4	165.1	0	0	0	106.7	S264 N268	S264-I266 PolarHBondContact O-N 3.24Å; I266-N268 PolarHBondContact O-N 3.47Å
267	L	29.7	Very low	34.5	Very low	142 Å²	142	125 Å²	125	74%	0.743	72%	0.715	S	S	*	*			trans	-45.6	114.1	164.8	-169.4	77.2	0	0	0	104.9	P265 E269	P265-L267 PolarHBondContact O-N 2Å; L267-E269 HydrophobicContact CD2-CG 4.39Å; L267-E269 PolarHBondContact O-N 2.81Å
268	N	24.7	Very low	36.9	Very low	154 Å²	154	122.9 Å²	122.9	82%	0.824	70%	0.703	S	S	*	*			trans	-62.2	76.4	177.9	-77.2	-25.4	0	0	0	108	I266 T270	I266-N268 PolarHBondContact O-N 3.47Å; N268-T270 PolarHBondContact O-N 3.26Å
269	E	32	Very low	39.3	Very low	163 Å²	163	123.5 Å²	123.5	76%	0.762	71%	0.711	S	S	*	*			trans	-74.4	91.7	156.2	-71.2	-151.2	153.8	0	0	105.6	L267 H271	L267-E269 HydrophobicContact CD2-CG 4.39Å; L267-E269 PolarHBondContact O-N 2.81Å; E269-H271 PolarHBondContact O-N 3.33Å
270	T	30.4	Very low	42.1	Very low	122 Å²	122	124 Å²	124	75%	0.748	71%	0.709	S	S	*	*			trans	-9.3	120.2	154.9	47.7	0	0	0	0	113.2	N268 S272	N268-T270 PolarHBondContact O-N 3.26Å; T270-S272 PolarHBondContact O-N 3.1Å
271	H	30.2	Very low	45.1	Very low	193 Å²	193	128.6 Å²	128.6	89%	0.894	72%	0.721	S	S	*	*			trans	-21.4	97	151.3	-86.5	-102.1	0	0	0	112.1	E269	E269-H271 PolarHBondContact O-N 3.33Å
272	S	32.7	Very low	48	Very low	109 Å²	109	125.5 Å²	125.5	76%	0.762	70%	0.704	S	S	*	*			trans	-111.9	109.7	152.1	-165.6	0	0	0	0	105.9	T270 G274	T270-S272 PolarHBondContact O-N 3.1Å; S272-G274 PolarHBondContact O-N 3.47Å
273	T	34.3	Very low	51.1	Low	140 Å²	140	120.9 Å²	120.9	86%	0.859	69%	0.687	S	S	*	*			trans	-60.2	78.5	167.3	46.7	0	0	0	0	108.7
274	G	37.4	Very low	53.9	Low	57 Å²	57	121 Å²	121	59%	0.588	68%	0.68	S	S	*	*			trans	-111.3	90.2	173.8	0	0	0	0	0	108.7	S272	S272-G274 PolarHBondContact O-N 3.47Å
275	Q	41	Very low	57	Low	186 Å²	186	121.4 Å²	121.4	87%	0.869	67%	0.674	S	S	*	*			trans	-52.2	128.8	161.8	-109.2	175.3	-64.6	0	0	108	S277	Q275-S277 PolarHBondContact O-N 2.81Å
276	P	51.3	Low	60.1	Low	125 Å²	125	122.5 Å²	122.5	81%	0.812	67%	0.666	S	S	*	*			trans	-69.7	97.8	177.9	27.8	-32.1	0	0	0	108	I278	P276-I278 PolarHBondContact O-N 2.78Å
277	S	68.7	Low	63.1	Low	109 Å²	109	118.3 Å²	118.3	76%	0.762	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-68.8	119.8	167.7	45.3	0	0	0	0	107.8	Q275	Q275-S277 PolarHBondContact O-N 2.81Å
278	I	82.1	Confident	66.3	Low	113 Å²	113	115.4 Å²	115.4	58%	0.579	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-53.3	127.3	168	-61.9	162.5	0	0	0	106.2	P276 L280 A282 I283	P276-I278 PolarHBondContact O-N 2.78Å; I278-L280 PolarHBondContact O-N 2.99Å; I278-A282 HydrophobicContact CG2-CB 4Å; I278-I283 HydrophobicContact CB-CD1 4.31Å; I278-I283 HydrophobicContact CB-CG1 4.33Å; I278-I283 HydrophobicContact CG2-CD1 4.33Å; I278-I283 HydrophobicContact CG2-CG1 3.81Å
279	P	86.6	Confident	69.6	Low	60 Å²	60	111.5 Å²	111.5	39%	0.39	63%	0.627	S	S	.	*	P	Polyproline II helix	trans	-62.4	136.5	-175.7	27.7	-36.1	0	0	0	109.6	W281 A282	P279-W281 HydrophobicContact CB-CG 4.41Å; P279-W281 HydrophobicContact CB-CZ2 4.4Å; P279-W281 VanDerWaalsContact CB-NE1 3.3Å; P279-W281 HydrophobicContact CG-CD2 4.37Å; P279-W281 HydrophobicContact CG-CZ2 3.67Å; P279-W281 PolarHBondContact O-N 2.9Å; P279-A282 HydrophobicContact CG-CB 4.13Å; P279-A282 WeakPolarHBondContact O-CB 3.47Å; P279-A282 PolarHBondContact O-N 3.12Å
280	L	88.1	Confident	72.6	Confident	132 Å²	132	107.7 Å²	107.7	69%	0.691	61%	0.611	S	S	*	*	H	α-helix	trans	-54.7	-33.4	-169.7	-161.8	115.1	0	0	0	113	I278 A282 I283 I284	I278-L280 PolarHBondContact O-N 2.99Å; L280-A282 VanDerWaalsContact C-N 3.3Å; L280-A282 PolarHBondContact O-N 3.1Å; L280-I283 PolarHBondContact O-N 3.05Å; L280-I284 HydrophobicContact CD2-CD1 3.66Å; L280-I284 HydrophobicContact CG-CD1 4.38Å; L280-I284 VanDerWaalsContact O-CG1 3.32Å; L280-I284 WeakPolarHBondContact O-CG1 3.46Å; L280-I284 PolarHBondContact O-N 3.4Å
281	W	93	Very high	75.6	Confident	166 Å²	166	107.4 Å²	107.4	63%	0.629	60%	0.604	S	S	*	*	H	α-helix	trans	-61.7	-33.7	175.9	63	-103.3	0	0	0	113.3	P279 I284 L285	P279-W281 HydrophobicContact CB-CG 4.41Å; P279-W281 HydrophobicContact CB-CZ2 4.4Å; P279-W281 VanDerWaalsContact CB-NE1 3.3Å; P279-W281 HydrophobicContact CG-CD2 4.37Å; P279-W281 HydrophobicContact CG-CZ2 3.67Å; P279-W281 PolarHBondContact O-N 2.9Å; W281-I284 PolarHBondContact O-N 2.79Å; W281-L285 HydrophobicContact CE3-CD1 3.78Å; W281-L285 HydrophobicContact CZ3-CD1 4.01Å; W281-L285 WeakPolarHBondContact O-CG 3.49Å; W281-L285 PolarHBondContact O-N 3.48Å
282	A	92.4	Very high	78.8	Confident	29 Å²	29	101.9 Å²	101.9	24%	0.24	58%	0.584	C	S	.	*	H	α-helix	trans	-71.5	-38	179.6	0	0	0	0	0	111.3	I278 P279 L280 I284 L285 F286	I278-A282 HydrophobicContact CG2-CB 4Å; P279-A282 HydrophobicContact CG-CB 4.13Å; P279-A282 WeakPolarHBondContact O-CB 3.47Å; P279-A282 PolarHBondContact O-N 3.12Å; L280-A282 VanDerWaalsContact C-N 3.3Å; L280-A282 PolarHBondContact O-N 3.1Å; A282-I284 VanDerWaalsContact C-N 3.33Å; A282-L285 PolarHBondContact O-N 3.43Å; A282-F286 WeakPolarHBondContact O-CB 3.37Å; A282-F286 PolarHBondContact O-N 3.32Å
283	I	92.8	Very high	81.6	Confident	99 Å²	99	100.2 Å²	100.2	51%	0.508	57%	0.569	S	S	.	*	H	α-helix	trans	-64	-42	173.4	-58.9	175.3	0	0	0	109.9	I278 L280 F286 G287	I278-I283 HydrophobicContact CB-CD1 4.31Å; I278-I283 HydrophobicContact CB-CG1 4.33Å; I278-I283 HydrophobicContact CG2-CD1 4.33Å; I278-I283 HydrophobicContact CG2-CG1 3.81Å; L280-I283 PolarHBondContact O-N 3.05Å; I283-F286 PolarHBondContact O-N 2.91Å; I283-G287 PolarHBondContact O-N 3.19Å
284	I	94.8	Very high	84.5	Confident	93 Å²	93	96.8 Å²	96.8	48%	0.477	55%	0.55	S	S	.	*	H	α-helix	trans	-62.7	-48.6	176.4	-66.9	165.7	0	0	0	111.1	L280 W281 A282 F286 G287 V288	L280-I284 HydrophobicContact CD2-CD1 3.66Å; L280-I284 HydrophobicContact CG-CD1 4.38Å; L280-I284 VanDerWaalsContact O-CG1 3.32Å; L280-I284 WeakPolarHBondContact O-CG1 3.46Å; L280-I284 PolarHBondContact O-N 3.4Å; W281-I284 PolarHBondContact O-N 2.79Å; A282-I284 VanDerWaalsContact C-N 3.33Å; I284-F286 VanDerWaalsContact C-N 3.31Å; I284-F286 PolarHBondContact O-N 2.79Å; I284-G287 PolarHBondContact O-N 2.84Å; I284-V288 HydrophobicContact CG2-CG2 4.28Å; I284-V288 WeakPolarHBondContact O-CG2 3.31Å; I284-V288 PolarHBondContact O-N 2.96Å
285	L	94.3	Very high	87.1	Confident	110 Å²	110	97.7 Å²	97.7	58%	0.576	54%	0.544	S	S	*	.	H	α-helix	trans	-60.6	-40.2	178.9	-73.1	177.7	0	0	0	112.3	W281 A282 V288 S289	W281-L285 HydrophobicContact CE3-CD1 3.78Å; W281-L285 HydrophobicContact CZ3-CD1 4.01Å; W281-L285 WeakPolarHBondContact O-CG 3.49Å; W281-L285 PolarHBondContact O-N 3.48Å; A282-L285 PolarHBondContact O-N 3.43Å; L285-V288 PolarHBondContact O-N 3.1Å; L285-S289 WeakPolarHBondContact O-CB 3.19Å; L285-S289 PolarHBondContact O-N 2.04Å
286	F	94.7	Very high	89.6	Confident	145 Å²	145	92.2 Å²	92.2	64%	0.636	53%	0.526	S	S	*	.	H	α-helix	trans	-64.1	-44	175.8	-172.3	-106	0	0	0	111.7	A282 I283 I284 S289 I290	A282-F286 WeakPolarHBondContact O-CB 3.37Å; A282-F286 PolarHBondContact O-N 3.32Å; I283-F286 PolarHBondContact O-N 2.91Å; I284-F286 VanDerWaalsContact C-N 3.31Å; I284-F286 PolarHBondContact O-N 2.79Å; F286-S289 PolarHBondContact O-N 3.28Å; F286-I290 HydrophobicContact CD1-CD1 3.8Å; F286-I290 HydrophobicContact CE1-CD1 3.38Å; F286-I290 HydrophobicContact CE1-CG1 4.46Å; F286-I290 HydrophobicContact CZ-CD1 3.78Å; F286-I290 WeakPolarHBondContact O-CG1 3.48Å; F286-I290 PolarHBondContact O-N 2.81Å; F286-I290 VanDerWaalsContact O-N 3.08Å
287	G	94.7	Very high	91.4	Very high	38 Å²	38	89.4 Å²	89.4	39%	0.392	51%	0.513	S	S	.	.	H	α-helix	trans	-61.5	-44.5	175.1	0	0	0	0	0	113.2	I283 I284 I290 L291	I283-G287 PolarHBondContact O-N 3.19Å; I284-G287 PolarHBondContact O-N 2.84Å; G287-I290 PolarHBondContact O-N 3.46Å; G287-L291 WeakPolarHBondContact O-CB 3.39Å; G287-L291 PolarHBondContact O-N 3.19Å
288	V	95.6	Very high	92.3	Very high	80 Å²	80	89.2 Å²	89.2	49%	0.485	50%	0.503	S	S	.	.	H	α-helix	trans	-63.2	-42.6	176.7	173.9	0	0	0	0	110.9	I284 L285 I290 L291 V292	I284-V288 HydrophobicContact CG2-CG2 4.28Å; I284-V288 WeakPolarHBondContact O-CG2 3.31Å; I284-V288 PolarHBondContact O-N 2.96Å; L285-V288 PolarHBondContact O-N 3.1Å; V288-I290 PolarHBondContact O-N 3.13Å; V288-L291 PolarHBondContact O-N 2.83Å; V288-V292 HydrophobicContact CG1-CG2 4.31Å; V288-V292 WeakPolarHBondContact O-CG2 3.31Å; V288-V292 PolarHBondContact O-N 3.03Å
289	S	94.8	Very high	92.4	Very high	72 Å²	72	87.5 Å²	87.5	50%	0.503	50%	0.497	S	S	.	.	H	α-helix	trans	-60.1	-44.2	176.9	-174.9	0	0	0	0	112	L285 F286 T293	L285-S289 WeakPolarHBondContact O-CB 3.19Å; L285-S289 PolarHBondContact O-N 2.04Å; F286-S289 PolarHBondContact O-N 3.28Å; S289-T293 WeakPolarHBondContact O-CB 3.43Å; S289-T293 PolarHBondContact O-N 2.89Å; S289-T293 PolarHBondContact O-OG1 3.37Å
290	I	94.9	Very high	92.3	Very high	83 Å²	83	86.5 Å²	86.5	43%	0.426	50%	0.498	S	S	.	.	H	α-helix	trans	-63.4	-45.2	177.1	-70	171.2	0	0	0	110.4	F286 G287 V288 V292 T293 C294	F286-I290 HydrophobicContact CD1-CD1 3.8Å; F286-I290 HydrophobicContact CE1-CD1 3.38Å; F286-I290 HydrophobicContact CE1-CG1 4.46Å; F286-I290 HydrophobicContact CZ-CD1 3.78Å; F286-I290 WeakPolarHBondContact O-CG1 3.48Å; F286-I290 PolarHBondContact O-N 2.81Å; F286-I290 VanDerWaalsContact O-N 3.08Å; G287-I290 PolarHBondContact O-N 3.46Å; V288-I290 PolarHBondContact O-N 3.13Å; I290-V292 PolarHBondContact O-N 3.19Å; I290-T293 PolarHBondContact O-N 3.43Å; I290-C294 PolarHBondContact O-N 3.27Å; I290-C294 PolarHBondContact O-SG 2.95Å
291	L	94.4	Very high	92	Very high	116 Å²	116	86.4 Å²	86.4	61%	0.607	49%	0.494	S	S	*	.	H	α-helix	trans	-62.4	-45	-179.1	-170.9	140.2	0	0	0	111.8	G287 V288 T293 C294 V295	G287-L291 WeakPolarHBondContact O-CB 3.39Å; G287-L291 PolarHBondContact O-N 3.19Å; V288-L291 PolarHBondContact O-N 2.83Å; L291-T293 VanDerWaalsContact C-N 3.32Å; L291-T293 PolarHBondContact O-N 2.88Å; L291-C294 PolarHBondContact O-N 3.4Å; L291-V295 HydrophobicContact CD2-CG2 4.23Å; L291-V295 VanDerWaalsContact O-CG2 3.31Å; L291-V295 WeakPolarHBondContact O-CG2 3.27Å; L291-V295 PolarHBondContact O-N 3.01Å
292	V	95.3	Very high	91.3	Very high	77 Å²	77	87.3 Å²	87.3	47%	0.467	50%	0.497	S	S	.	.	H	α-helix	trans	-60.3	-43	174.7	172	0	0	0	0	110.9	V288 I290 C294 V295 C296	V288-V292 HydrophobicContact CG1-CG2 4.31Å; V288-V292 WeakPolarHBondContact O-CG2 3.31Å; V288-V292 PolarHBondContact O-N 3.03Å; I290-V292 PolarHBondContact O-N 3.19Å; V292-C294 PolarHBondContact O-N 3.28Å; V292-V295 PolarHBondContact O-N 3.22Å; V292-C296 WeakPolarHBondContact O-CB 3.26Å; V292-C296 PolarHBondContact O-N 2.91Å; V292-C296 PolarHBondContact O-SG 2.71Å
293	T	93.2	Very high	90.7	Very high	75 Å²	75	91.9 Å²	91.9	46%	0.46	52%	0.516	S	S	.	.	H	α-helix	trans	-63.2	-42.7	178.6	-46.7	0	0	0	0	111.6	S289 I290 L291 C296 A297	S289-T293 WeakPolarHBondContact O-CB 3.43Å; S289-T293 PolarHBondContact O-N 2.89Å; S289-T293 PolarHBondContact O-OG1 3.37Å; I290-T293 PolarHBondContact O-N 3.43Å; L291-T293 VanDerWaalsContact C-N 3.32Å; L291-T293 PolarHBondContact O-N 2.88Å; T293-C296 PolarHBondContact O-N 3.2Å; T293-A297 WeakPolarHBondContact O-CB 3.43Å; T293-A297 PolarHBondContact O-N 2.77Å
294	C	94.1	Very high	89.8	Confident	68 Å²	68	92.7 Å²	92.7	46%	0.459	52%	0.522	S	S	.	.	H	α-helix	trans	-64.3	-42.4	175.4	-74	0	0	0	0	112.4	I290 L291 V292 A297 L298	I290-C294 PolarHBondContact O-N 3.27Å; I290-C294 PolarHBondContact O-SG 2.95Å; L291-C294 PolarHBondContact O-N 3.4Å; V292-C294 PolarHBondContact O-N 3.28Å; C294-A297 PolarHBondContact O-N 3.2Å; C294-L298 WeakPolarHBondContact O-CB 3.21Å; C294-L298 WeakPolarHBondContact O-CG 3.37Å; C294-L298 PolarHBondContact O-N 3.38Å
295	V	93.1	Very high	88.2	Confident	76 Å²	76	90.8 Å²	90.8	46%	0.461	52%	0.519	S	S	.	.	H	α-helix	trans	-63.1	-46.3	176.1	171.6	0	0	0	0	110.4	L291 V292 A297 L298 V299	L291-V295 HydrophobicContact CD2-CG2 4.23Å; L291-V295 VanDerWaalsContact O-CG2 3.31Å; L291-V295 WeakPolarHBondContact O-CG2 3.27Å; L291-V295 PolarHBondContact O-N 3.01Å; V292-V295 PolarHBondContact O-N 3.22Å; V295-A297 VanDerWaalsContact C-N 3.31Å; V295-A297 PolarHBondContact O-N 3.42Å; V295-L298 PolarHBondContact O-N 2.98Å; V295-V299 HydrophobicContact CG1-CG2 4.28Å; V295-V299 WeakPolarHBondContact O-CB 3.39Å; V295-V299 VanDerWaalsContact O-CG2 3.26Å; V295-V299 WeakPolarHBondContact O-CG2 3.39Å; V295-V299 PolarHBondContact O-N 3.19Å
296	C	93.1	Very high	86.1	Confident	71 Å²	71	91.8 Å²	91.8	48%	0.48	53%	0.525	S	S	.	.	H	α-helix	trans	-60.8	-39.1	176	-69.4	0	0	0	0	112.4	V292 T293 G300	V292-C296 WeakPolarHBondContact O-CB 3.26Å; V292-C296 PolarHBondContact O-N 2.91Å; V292-C296 PolarHBondContact O-SG 2.71Å; T293-C296 PolarHBondContact O-N 3.2Å; C296-G300 PolarHBondContact O-N 3.45Å
297	A	88.7	Confident	84.2	Confident	65 Å²	65	89.5 Å²	89.5	54%	0.537	52%	0.523	S	S	.	.	H	α-helix	trans	-67.9	-41.9	176.7	0	0	0	0	0	112.4	T293 C294 V295 G300 H301	T293-A297 WeakPolarHBondContact O-CB 3.43Å; T293-A297 PolarHBondContact O-N 2.77Å; C294-A297 PolarHBondContact O-N 3.2Å; V295-A297 VanDerWaalsContact C-N 3.31Å; V295-A297 PolarHBondContact O-N 3.42Å; A297-G300 PolarHBondContact O-N 3.04Å; A297-H301 WeakPolarHBondContact O-CB 3.14Å; A297-H301 PolarHBondContact O-N 3.38Å
298	L	87.6	Confident	81.6	Confident	106 Å²	106	92.5 Å²	92.5	56%	0.555	54%	0.536	S	S	*	.	H	α-helix	trans	-65.7	-44.5	175.9	-77.7	168.8	0	0	0	111.6	C294 V295 G300 H301 W302	C294-L298 WeakPolarHBondContact O-CB 3.21Å; C294-L298 WeakPolarHBondContact O-CG 3.37Å; C294-L298 PolarHBondContact O-N 3.38Å; V295-L298 PolarHBondContact O-N 2.98Å; L298-G300 VanDerWaalsContact C-N 3.35Å; L298-H301 CarbonylContact O-C 3.5Å; L298-H301 PolarHBondContact O-N 3.46Å; L298-W302 WeakPolarHBondContact O-CB 3.17Å; L298-W302 VanDerWaalsContact O-CD1 3.32Å; L298-W302 PolarHBondContact O-N 3.41Å
299	V	85	Confident	79.2	Confident	76 Å²	76	96.8 Å²	96.8	46%	0.461	56%	0.555	S	S	.	*	H	α-helix	trans	-62.8	-44.1	175.3	172	0	0	0	0	110.4	V295 H301 W302 I303	V295-V299 HydrophobicContact CG1-CG2 4.28Å; V295-V299 WeakPolarHBondContact O-CB 3.39Å; V295-V299 VanDerWaalsContact O-CG2 3.26Å; V295-V299 WeakPolarHBondContact O-CG2 3.39Å; V295-V299 PolarHBondContact O-N 3.19Å; V299-H301 VanDerWaalsContact C-N 3.28Å; V299-H301 PolarHBondContact O-N 2.93Å; V299-W302 PolarHBondContact O-N 2.85Å; V299-I303 HydrophobicContact CG1-CD1 3.64Å; V299-I303 HydrophobicContact CG1-CG1 4.28Å; V299-I303 WeakPolarHBondContact O-CB 3.18Å; V299-I303 VanDerWaalsContact O-CG1 3.23Å; V299-I303 WeakPolarHBondContact O-CG1 3.47Å; V299-I303 PolarHBondContact O-N 3.45Å
300	G	82.9	Confident	76.6	Confident	39 Å²	39	104.5 Å²	104.5	40%	0.402	57%	0.573	S	S	.	*	H	α-helix	trans	-59.4	-38.9	173.6	0	0	0	0	0	112.5	C296 A297 L298 N304	C296-G300 PolarHBondContact O-N 3.45Å; A297-G300 PolarHBondContact O-N 3.04Å; L298-G300 VanDerWaalsContact C-N 3.35Å; G300-N304 VanDerWaalsContact O-CB 3.26Å; G300-N304 WeakPolarHBondContact O-CB 3.42Å; G300-N304 PolarHBondContact O-N 2.83Å
301	H	82.9	Confident	74	Confident	131 Å²	131	111.5 Å²	111.5	61%	0.606	59%	0.594	S	S	*	*	H	α-helix	trans	-70.2	-42.8	175.3	-167.1	-7.4	0	0	0	112	A297 L298 V299 N304 A305	A297-H301 WeakPolarHBondContact O-CB 3.14Å; A297-H301 PolarHBondContact O-N 3.38Å; L298-H301 CarbonylContact O-C 3.5Å; L298-H301 PolarHBondContact O-N 3.46Å; V299-H301 VanDerWaalsContact C-N 3.28Å; V299-H301 PolarHBondContact O-N 2.93Å; H301-N304 CarbonylContact O-C 3.5Å; H301-N304 PolarHBondContact O-N 3.46Å; H301-A305 WeakPolarHBondContact O-CB 3.43Å; H301-A305 PolarHBondContact O-N 3.26Å
302	W	78.2	Confident	71.4	Confident	185 Å²	185	117.3 Å²	117.3	70%	0.701	61%	0.608	S	S	*	*	H	α-helix	trans	-62.4	-48.4	178.5	-95.1	87.3	0	0	0	112	L298 V299 N304 A305 D306	L298-W302 WeakPolarHBondContact O-CB 3.17Å; L298-W302 VanDerWaalsContact O-CD1 3.32Å; L298-W302 PolarHBondContact O-N 3.41Å; V299-W302 PolarHBondContact O-N 2.85Å; W302-N304 PolarHBondContact O-N 3.28Å; W302-A305 PolarHBondContact O-N 2.82Å; W302-D306 PolarHBondContact O-N 3.42Å
303	I	78.9	Confident	68.6	Low	124 Å²	124	121.2 Å²	121.2	64%	0.636	63%	0.626	S	S	*	*	H	α-helix	trans	-56.6	-34.9	175	-66.9	166.2	0	0	0	110.9	V299	V299-I303 HydrophobicContact CG1-CD1 3.64Å; V299-I303 HydrophobicContact CG1-CG1 4.28Å; V299-I303 WeakPolarHBondContact O-CB 3.18Å; V299-I303 VanDerWaalsContact O-CG1 3.23Å; V299-I303 WeakPolarHBondContact O-CG1 3.47Å; V299-I303 PolarHBondContact O-N 3.45Å
304	N	74.4	Confident	65.9	Low	117 Å²	117	123.4 Å²	123.4	63%	0.626	64%	0.639	S	S	*	*	H	α-helix	trans	-90.8	-11.1	-178.4	-148.1	34.5	0	0	0	113.4	G300 H301 W302 V307	G300-N304 VanDerWaalsContact O-CB 3.26Å; G300-N304 WeakPolarHBondContact O-CB 3.42Å; G300-N304 PolarHBondContact O-N 2.83Å; H301-N304 CarbonylContact O-C 3.5Å; H301-N304 PolarHBondContact O-N 3.46Å; W302-N304 PolarHBondContact O-N 3.28Å; N304-V307 WeakPolarHBondContact O-CG2 3.48Å
305	A	62.2	Low	63.1	Low	52 Å²	52	125.9 Å²	125.9	43%	0.43	65%	0.654	S	S	.	*	H	α-helix	trans	-86.4	-20.2	179.4	0	0	0	0	0	112.5	H301 W302 V307	H301-A305 WeakPolarHBondContact O-CB 3.43Å; H301-A305 PolarHBondContact O-N 3.26Å; W302-A305 PolarHBondContact O-N 2.82Å; A305-V307 PolarHBondContact O-N 2.81Å
306	D	49.2	Very low	60.2	Low	131 Å²	131	127.9 Å²	127.9	70%	0.701	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	9.9	167.4	-75.9	-26.3	0	0	0	113.2	W302 P308	W302-D306 PolarHBondContact O-N 3.42Å; D306-P308 WeakPolarHBondContact O-CD 3.36Å
307	V	54.4	Low	57.4	Low	97 Å²	97	129.2 Å²	129.2	59%	0.588	69%	0.688	S	S	*	*	S	Bend	trans	-85.6	95.7	159.3	-170.2	0	0	0	0	107.5	N304 A305 L309	N304-V307 WeakPolarHBondContact O-CG2 3.48Å; A305-V307 PolarHBondContact O-N 2.81Å; V307-L309 PolarHBondContact O-N 2.92Å
308	P	39.9	Very low	54.9	Low	102 Å²	102	132 Å²	132	66%	0.662	70%	0.7	S	S	*	*			trans	-53.8	131.6	178.9	20.7	-32.6	0	0	0	109.9	D306 R310	D306-P308 WeakPolarHBondContact O-CD 3.36Å; P308-R310 PolarHBondContact O-N 3.43Å
309	L	45.3	Very low	52.3	Low	169 Å²	169	138.4 Å²	138.4	89%	0.885	72%	0.717	S	S	*	*	S	Bend	trans	-51.3	9.5	-179.1	-84.1	136.3	0	0	0	116.4	V307 R311	V307-L309 PolarHBondContact O-N 2.92Å; L309-R311 VanDerWaalsContact C-N 3.34Å; L309-R311 PolarHBondContact O-N 2.97Å
310	R	41.9	Very low	49.9	Very low	235 Å²	235	140.5 Å²	140.5	89%	0.887	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	3.7	-173	-124.7	-177.9	-159.6	-91.5	0.8	115.6	P308	P308-R310 PolarHBondContact O-N 3.43Å
311	R	39.5	Very low	47.4	Very low	229 Å²	229	142.6 Å²	142.6	86%	0.864	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	3.2	-178.5	-135.2	177.1	-153.5	175.1	7.1	116	L309 L313	L309-R311 VanDerWaalsContact C-N 3.34Å; L309-R311 PolarHBondContact O-N 2.97Å; R311-L313 PolarHBondContact O-N 2.8Å
312	W	39.4	Very low	44.8	Very low	238 Å²	238	144.2 Å²	144.2	90%	0.902	76%	0.759	S	S	*	*	S	Bend	trans	-83.4	-0.5	178.2	-101.4	84	0	0	0	115.5
313	L	37.3	Very low	42.5	Very low	160 Å²	160	140.7 Å²	140.7	84%	0.838	77%	0.769	S	S	*	*	S	Bend	trans	-127.4	13.1	-170.1	-77.5	168.5	0	0	0	117.5	R311	R311-L313 PolarHBondContact O-N 2.8Å
314	T	35.7	Very low	40.1	Very low	120 Å²	120	137.9 Å²	137.9	74%	0.736	77%	0.771	S	S	*	*			trans	-137.6	112.3	169.8	49.7	0	0	0	0	112.9
315	P	35.5	Very low	38.1	Very low	120 Å²	120	140.1 Å²	140.1	78%	0.779	78%	0.781	S	S	*	*			trans	-72.3	129.1	172	-13	28.1	0	0	0	111.4
316	S	33.1	Very low	36.5	Very low	119 Å²	119	146.2 Å²	146.2	83%	0.832	80%	0.798	S	S	*	*			trans	44.6	103.2	151.8	59.7	0	0	0	0	118.7
317	A	32.5	Very low	35.6	Very low	99 Å²	99	145.6 Å²	145.6	82%	0.818	80%	0.801	S	S	*	*			trans	-132.4	134.1	146.7	0	0	0	0	0	109.2
318	P	37.3	Very low	34.6	Very low	122 Å²	122	146.3 Å²	146.3	79%	0.792	81%	0.808	S	S	*	*			trans	-96.7	135	-173.1	34.8	-29.7	0	0	0	112.2
319	R	33.1	Very low	34.5	Very low	242 Å²	242	147.7 Å²	147.7	91%	0.913	81%	0.814	S	S	*	*			trans	172.3	163.5	158.4	-102.3	167.3	-167.5	-142.1	5.5	111.1
320	P	34.7	Very low	33.9	Very low	119 Å²	119	147 Å²	147	77%	0.773	81%	0.812	S	S	*	*				-123.3	175.4	-54.7	30.5	-11.1	0	0	0	111.6
321	A	30.4	Very low	33.7	Very low	84 Å²	84	140.4 Å²	140.4	69%	0.694	79%	0.794	S	S	*	*			trans	-59.8	158.9	175	0	0	0	0	0	114.1
322	N	28.2	Very low	33.8	Very low	165 Å²	165	135.3 Å²	135.3	88%	0.882	79%	0.791	S	S	*	*			trans	108.1	123.5	179.8	-55.6	-15.7	0	0	0	110.9
323	A	29.3	Very low	34	Very low	110 Å²	110	126 Å²	126	91%	0.909	76%	0.759	S	S	*	*			cis	-156.5	141.4	10.6	0	0	0	0	0	109.1
324	G	28.9	Very low	34.4	Very low	65 Å²	65	124.3 Å²	124.3	67%	0.67	74%	0.741	S	S	*	*			trans	175.1	126.7	172.9	0	0	0	0	0	111.1	F326	G324-F326 PolarHBondContact O-N 3.16Å
325	I	31.7	Very low	34.7	Very low	165 Å²	165	126.7 Å²	126.7	85%	0.846	74%	0.737	S	S	*	*	S	Bend	trans	-76.2	45.4	-164.4	-63.7	158.7	0	0	0	113.2
326	F	30.3	Very low	35	Very low	180 Å²	180	125.8 Å²	125.8	79%	0.789	74%	0.739	S	S	*	*	S	Bend	trans	-138.8	127.9	165.4	-67.3	-77.2	0	0	0	108.7	G324 P328	G324-F326 PolarHBondContact O-N 3.16Å; F326-P328 WeakPolarHBondContact O-CD 3.37Å; F326-P328 VanDerWaalsContact O-N 3.16Å
327	P	29.8	Very low	35.2	Very low	117 Å²	117	121.3 Å²	121.3	76%	0.76	71%	0.712	S	S	*	*			trans	-62.3	121.9	175.1	26.7	-30.8	0	0	0	107.5	T329	P327-T329 PolarHBondContact O-N 3.39Å
328	P	32.8	Very low	35.3	Very low	112 Å²	112	126.6 Å²	126.6	73%	0.727	72%	0.717	S	S	*	*			trans	-69.5	106	177.1	27.5	-30.1	0	0	0	107.3	F326 N330	F326-P328 WeakPolarHBondContact O-CD 3.37Å; F326-P328 VanDerWaalsContact O-N 3.16Å; P328-N330 PolarHBondContact O-N 3.04Å
329	T	37.5	Very low	35.5	Very low	131 Å²	131	124.6 Å²	124.6	80%	0.804	72%	0.718	S	S	*	*			trans	-63.4	105.7	157.8	53.3	0	0	0	0	106.1	P327 N331	P327-T329 PolarHBondContact O-N 3.39Å; T329-N331 VanDerWaalsContact C-N 3.26Å; T329-N331 PolarHBondContact O-N 3.29Å
330	N	33.8	Very low	35.8	Very low	155 Å²	155	117 Å²	117	83%	0.829	72%	0.716	S	S	*	*	S	Bend	trans	-55.4	76.8	-180	-85.9	-19.8	0	0	0	113	P328	P328-N330 PolarHBondContact O-N 3.04Å
331	N	36.6	Very low	36.1	Very low	96 Å²	96	113.3 Å²	113.3	51%	0.513	70%	0.699	S	S	.	*			trans	-151	78	162.5	-146.9	5.4	0	0	0	111.6	T329 D333	T329-N331 VanDerWaalsContact C-N 3.26Å; T329-N331 PolarHBondContact O-N 3.29Å; N331-D333 PolarHBondContact O-N 3.46Å
332	P	42.9	Very low	36.7	Very low	123 Å²	123	115.6 Å²	115.6	80%	0.799	70%	0.697	S	S	*	*			trans	-82	63.6	-178.6	36.3	-34.7	0	0	0	110.6
333	D	42.9	Very low	37.5	Very low	43 Å²	43	113.9 Å²	113.9	23%	0.23	68%	0.679	C	S	.	*			trans	-141.8	15.7	179	-93	-29.9	0	0	0	115.4	N331 A345	N331-D333 PolarHBondContact O-N 3.46Å; D333-A345 PolarHBondContact O-N 2.98Å
334	W	46.1	Very low	37.9	Very low	123 Å²	123	112.2 Å²	112.2	47%	0.466	65%	0.653	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.7	115.4	174.6	-60	95.5	0	0	0	110.5	M342 H344	W334-M342 HydrophobicContact CB-CE 3.47Å; W334-M342 VanDerWaalsContact CB-CE 3.47Å; W334-M342 HydrophobicContact CD2-CE 3.95Å; W334-M342 HydrophobicContact CE3-CB 3.77Å; W334-M342 HydrophobicContact CE3-CE 4.16Å; W334-M342 HydrophobicContact CG-CE 3.67Å; W334-M342 HydrophobicContact CZ3-CB 4.3Å; W334-H344 HydrophobicContact CH2-CB 4.18Å; W334-H344 AromaticContact CZ2-CD2 3.93Å; W334-H344 HydrophobicContact CZ3-CB 4.07Å
335	R	42.3	Very low	38.8	Very low	171 Å²	171	111.8 Å²	111.8	65%	0.645	64%	0.642	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-104.1	138.6	171.1	-69.7	-177.7	178.8	-97.8	-0.3	109.8	G337 Y343	R335-G337 PolarHBondContact O-N 3.41Å; R335-Y343 HydrophobicContact CB-CE1 4.17Å
336	A	40.4	Very low	39.3	Very low	100 Å²	100	110.6 Å²	110.6	83%	0.826	63%	0.633	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-71.5	116.6	172.7	0	0	0	0	0	109.2
337	G	37.6	Very low	39.8	Very low	26 Å²	26	106.8 Å²	106.8	27%	0.268	63%	0.625	S	S	.	*	P	Polyproline II helix	trans	-92.8	154.3	169.1	0	0	0	0	0	111.6	R335 G339 G341	R335-G337 PolarHBondContact O-N 3.41Å; G337-G339 PolarHBondContact O-N 2.81Å; G337-G341 PolarHBondContact N-O 3.21Å; G337-G341 VanDerWaalsContact N-O 3.07Å
338	F	34	Very low	40.3	Very low	209 Å²	209	111 Å²	111	92%	0.917	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	124.9	174.3	-146.7	-98.1	0	0	0	109.4
339	G	42.8	Very low	40.3	Very low	80 Å²	80	115.7 Å²	115.7	83%	0.825	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	102.6	16.6	-178.3	0	0	0	0	0	116.4	G337 G341	G337-G339 PolarHBondContact O-N 2.81Å; G339-G341 VanDerWaalsContact C-N 3.31Å; G339-G341 PolarHBondContact O-N 2.96Å
340	G	39.7	Very low	40.5	Very low	83 Å²	83	117 Å²	117	86%	0.856	64%	0.638	S	S	*	*	S	Bend	trans	78	11.7	171.2	0	0	0	0	0	115
341	G	40.9	Very low	40.5	Very low	42 Å²	42	116 Å²	116	43%	0.433	63%	0.633	S	S	.	*			trans	-93.3	123.5	171.8	0	0	0	0	0	111.7	G337 G339	G337-G341 PolarHBondContact N-O 3.21Å; G337-G341 VanDerWaalsContact N-O 3.07Å; G339-G341 VanDerWaalsContact C-N 3.31Å; G339-G341 PolarHBondContact O-N 2.96Å
342	M	42.6	Very low	40.5	Very low	131 Å²	131	122.9 Å²	122.9	65%	0.645	65%	0.651	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-85.4	128.4	161.6	-62.4	170.8	67.9	0	0	107.9	W334	W334-M342 HydrophobicContact CB-CE 3.47Å; W334-M342 VanDerWaalsContact CB-CE 3.47Å; W334-M342 HydrophobicContact CD2-CE 3.95Å; W334-M342 HydrophobicContact CE3-CB 3.77Å; W334-M342 HydrophobicContact CE3-CE 4.16Å; W334-M342 HydrophobicContact CG-CE 3.67Å; W334-M342 HydrophobicContact CZ3-CB 4.3Å
343	Y	45.2	Very low	40	Very low	129 Å²	129	123.4 Å²	123.4	51%	0.506	65%	0.652	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-114.6	144.9	173	63.8	-84.7	0	0	0	110.8	R335	R335-Y343 HydrophobicContact CB-CE1 4.17Å
344	H	37.3	Very low	39.6	Very low	76 Å²	76	125.5 Å²	125.5	35%	0.352	67%	0.67	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-85.9	125.5	-179.4	-172.2	-91.6	0	0	0	109.7	W334 Q346	W334-H344 HydrophobicContact CH2-CB 4.18Å; W334-H344 AromaticContact CZ2-CD2 3.93Å; W334-H344 HydrophobicContact CZ3-CB 4.07Å; H344-Q346 PolarHBondContact CE1-O 3.24Å; H344-Q346 PolarHBondContact ND1-N 3.5Å; H344-Q346 PolarHBondContact ND1-O 3.16Å; H344-Q346 PolarHBondContact O-N 3.35Å
345	A	47.8	Very low	39.1	Very low	55 Å²	55	124 Å²	124	46%	0.455	68%	0.676	S	S	.	*	S	Bend	trans	-72.7	-22.9	-171.1	0	0	0	0	0	114.9	D333	D333-A345 PolarHBondContact O-N 2.98Å
346	Q	41.9	Very low	38.7	Very low	141 Å²	141	124.2 Å²	124.2	66%	0.659	68%	0.682	S	S	*	*	S	Bend	trans	-117.3	73.6	-176.5	-75.3	-178.8	-8	0	0	112.4	H344	H344-Q346 PolarHBondContact CE1-O 3.24Å; H344-Q346 PolarHBondContact ND1-N 3.5Å; H344-Q346 PolarHBondContact ND1-O 3.16Å; H344-Q346 PolarHBondContact O-N 3.35Å
347	T	41.2	Very low	38.2	Very low	99 Å²	99	128.4 Å²	128.4	61%	0.607	68%	0.682	S	S	*	*			trans	-163.7	112.7	149.8	38.5	0	0	0	0	108.3	R349	T347-R349 PolarHBondContact O-N 3.21Å
348	E	40.1	Very low	38	Very low	207 Å²	207	134.4 Å²	134.4	97%	0.967	71%	0.707	S	S	*	*			trans	-68.2	35	169.3	-67.3	179.8	154.7	0	0	112.9
349	R	33.6	Very low	37.8	Very low	210 Å²	210	135.5 Å²	135.5	79%	0.792	71%	0.705	S	S	*	*			trans	-121.9	102	170.4	-98.4	-165.9	-85	-168.3	-6.1	108.9	T347 D351	T347-R349 PolarHBondContact O-N 3.21Å; R349-D351 PolarHBondContact O-N 3.46Å; R349-D351 VanDerWaalsContact O-N 3.15Å
350	I	40.1	Very low	37.2	Very low	157 Å²	157	142.8 Å²	142.8	81%	0.805	71%	0.708	S	S	*	*			trans	-69.2	-3.3	-176.2	-66.9	173.9	0	0	0	112.8	R352	I350-R352 PolarHBondContact O-N 3.06Å
351	D	34.1	Very low	36.7	Very low	134 Å²	134	144.4 Å²	144.4	72%	0.717	70%	0.703	S	S	*	*			trans	-95.9	83.5	-176.4	-57.4	-33.6	0	0	0	111.5	R349	R349-D351 PolarHBondContact O-N 3.46Å; R349-D351 VanDerWaalsContact O-N 3.15Å
352	R	36.1	Very low	36.1	Very low	241 Å²	241	147.5 Å²	147.5	91%	0.909	73%	0.725	S	S	*	*			trans	171.3	72.1	147.7	-89.8	153.8	-162.6	-159.2	6.4	110.3	I350	I350-R352 PolarHBondContact O-N 3.06Å
353	V	33	Very low	35.5	Very low	134 Å²	134	145.8 Å²	145.8	81%	0.812	73%	0.726	S	S	*	*			trans	-87.9	98.8	153.8	-174.7	0	0	0	0	106	P355	V353-P355 VanDerWaalsContact O-CD 3.3Å; V353-P355 WeakPolarHBondContact O-CD 3.12Å
354	S	34.4	Very low	34.7	Very low	88 Å²	88	145.3 Å²	145.3	62%	0.615	74%	0.741	S	S	*	*			trans	-88.9	106.7	165.2	56.2	0	0	0	0	107.8
355	P	35.2	Very low	34.4	Very low	91 Å²	91	147.6 Å²	147.6	59%	0.591	76%	0.763	S	S	*	*			trans	-79.5	142.3	171.7	36.4	-32.3	0	0	0	107.7	V353	V353-P355 VanDerWaalsContact O-CD 3.3Å; V353-P355 WeakPolarHBondContact O-CD 3.12Å
356	F	34.8	Very low	33.4	Very low	176 Å²	176	149.4 Å²	149.4	77%	0.772	78%	0.778	S	S	*	*			trans	78.8	55.5	169.4	-51.8	-78.7	0	0	0	118.7	L358	F356-L358 VanDerWaalsContact C-N 3.34Å; F356-L358 HydrophobicContact CD1-CD1 4.41Å; F356-L358 HydrophobicContact CD1-CG 4.37Å
357	F	28.7	Very low	33	Very low	188 Å²	188	149.8 Å²	149.8	83%	0.825	78%	0.784	S	S	*	*			trans	-87.5	86	132.5	-76.4	-77	0	0	0	108.2	R359	F357-R359 PolarHBondContact O-N 3.2Å
358	L	33.4	Very low	32.5	Very low	152 Å²	152	151.4 Å²	151.4	80%	0.796	80%	0.799	S	S	*	*			trans	-63.8	83.3	155	-74.2	166.1	0	0	0	106.8	F356 R360	F356-L358 VanDerWaalsContact C-N 3.34Å; F356-L358 HydrophobicContact CD1-CD1 4.41Å; F356-L358 HydrophobicContact CD1-CG 4.37Å; L358-R360 PolarHBondContact O-N 2.99Å; L358-R360 VanDerWaalsContact O-N 3.16Å
359	R	30.2	Very low	31.9	Very low	232 Å²	232	144.8 Å²	144.8	88%	0.875	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-56.9	119.3	160.4	-90.3	-177.5	175.1	165.3	-1	106	F357	F357-R359 PolarHBondContact O-N 3.2Å
360	R	30.8	Very low	31.8	Very low	233 Å²	233	142.3 Å²	142.3	88%	0.879	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-46.1	137.1	169.7	-79.4	178.2	178.2	168.5	-1.6	109.2	L358 A362	L358-R360 PolarHBondContact O-N 2.99Å; L358-R360 VanDerWaalsContact O-N 3.16Å; R360-A362 PolarHBondContact O-N 2.82Å
361	P	29.4	Very low	31.3	Very low	116 Å²	116	140.7 Å²	140.7	75%	0.753	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-58.1	125.6	-179.5	21.7	-30.9	0	0	0	110.2	S363	P361-S363 PolarHBondContact O-N 2.76Å; P361-S363 VanDerWaalsContact O-N 3.14Å
362	A	27.9	Very low	31.1	Very low	108 Å²	108	143 Å²	143	89%	0.893	79%	0.787	S	S	*	*			trans	-75.5	91.5	170.2	0	0	0	0	0	108.5	R360	R360-A362 PolarHBondContact O-N 2.82Å
363	S	29.5	Very low	30.8	Very low	94 Å²	94	138.6 Å²	138.6	66%	0.657	78%	0.777	S	S	*	*			trans	-165.6	79.8	161.6	41.8	0	0	0	0	111.2	P361	P361-S363 PolarHBondContact O-N 2.76Å; P361-S363 VanDerWaalsContact O-N 3.14Å
364	S	29.3	Very low	30.7	Very low	119 Å²	119	138.1 Å²	138.1	83%	0.832	78%	0.777	S	S	*	*			trans	-164.7	98.7	143.6	5.4	0	0	0	0	108.8
365	P	30.3	Very low	30.5	Very low	124 Å²	124	145.4 Å²	145.4	81%	0.805	79%	0.791	S	S	*	*			trans	-74.7	160.3	160.1	32	-27.1	0	0	0	109.2
366	A	28.3	Very low	30.1	Very low	94 Å²	94	146.3 Å²	146.3	78%	0.777	80%	0.796	S	S	*	*			trans	85.7	76.8	177.9	0	0	0	0	0	117.2
367	L	32.3	Very low	29.8	Very low	148 Å²	148	145.9 Å²	145.9	78%	0.775	80%	0.802	S	S	*	*				-154.9	56.9	129.9	-138.6	81.2	0	0	0	110.8	G369	L367-G369 PolarHBondContact O-N 2.83Å
368	S	30.4	Very low	29.9	Very low	134 Å²	134	141.7 Å²	141.7	94%	0.937	79%	0.792	S	S	*	*			trans	-76.6	97.9	157.6	-70.5	0	0	0	0	106.7
369	G	28.9	Very low	29.8	Very low	68 Å²	68	139.9 Å²	139.9	70%	0.701	79%	0.792	S	S	*	*			trans	179.3	1.6	-178.7	0	0	0	0	0	118.3	L367	L367-G369 PolarHBondContact O-N 2.83Å
370	M	30.7	Very low	29.9	Very low	158 Å²	158	138.9 Å²	138.9	78%	0.778	79%	0.788	S	S	*	*			trans	-110.3	96.1	175	-70.1	-175.4	173.7	0	0	111.1	M372	M370-M372 PolarHBondContact O-N 2.93Å; M370-M372 VanDerWaalsContact O-N 3.16Å
371	N	30.4	Very low	29.8	Very low	122 Å²	122	134.7 Å²	134.7	65%	0.652	78%	0.783	S	S	*	*			trans	-40.5	105.3	164.6	-179.3	17.5	0	0	0	111.7	Q373	N371-Q373 PolarHBondContact ND2-NE2 3.15Å; N371-Q373 PolarHBondContact O-N 2.79Å
372	M	29.2	Very low	29.8	Very low	182 Å²	182	138 Å²	138	90%	0.897	79%	0.791	S	S	*	*			trans	-84.4	86.4	169.1	-69.4	-150.4	170.1	0	0	108.9	M370	M370-M372 PolarHBondContact O-N 2.93Å; M370-M372 VanDerWaalsContact O-N 3.16Å
373	Q	29.3	Very low	29.9	Very low	150 Å²	150	137.9 Å²	137.9	70%	0.701	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-69.3	131.7	163	-84.5	158.6	-15.6	0	0	109.1	N371 R375	N371-Q373 PolarHBondContact ND2-NE2 3.15Å; N371-Q373 PolarHBondContact O-N 2.79Å; Q373-R375 PolarHBondContact O-N 2.93Å
374	P	30.8	Very low	29.8	Very low	123 Å²	123	136.5 Å²	136.5	80%	0.799	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-68.1	118.9	-175	25.5	-31.4	0	0	0	109.8
375	R	30.7	Very low	30.2	Very low	242 Å²	242	136.9 Å²	136.9	91%	0.913	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-66.5	134.2	167.9	-101.8	-173.9	-178.6	-155.8	1.1	108.9	Q373	Q373-R375 PolarHBondContact O-N 2.93Å
376	P	27.8	Very low	30.1	Very low	109 Å²	109	140.5 Å²	140.5	71%	0.708	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-74.1	150.7	-171.2	-3.2	17.7	0	0	0	112.4	V378	P376-V378 PolarHBondContact O-N 2.9Å
377	N	27.7	Very low	30.4	Very low	167 Å²	167	145.4 Å²	145.4	89%	0.893	80%	0.801	S	S	*	*			trans	-50	106.2	167.2	-86	-19.3	0	0	0	110.7	S379	N377-S379 VanDerWaalsContact C-N 3.34Å; N377-S379 PolarHBondContact O-N 2.78Å; N377-S379 VanDerWaalsContact O-N 3.13Å
378	V	29.8	Very low	30.2	Very low	101 Å²	101	142.9 Å²	142.9	61%	0.612	79%	0.793	S	S	*	*			trans	-83.1	89.7	166.7	-179.3	0	0	0	0	107.4	P376 R380	P376-V378 PolarHBondContact O-N 2.9Å; V378-R380 HydrophobicContact CG1-CB 3.9Å; V378-R380 VanDerWaalsContact CG1-CD 3.42Å; V378-R380 HydrophobicContact CG1-CG 3.48Å; V378-R380 VanDerWaalsContact CG1-CG 3.48Å; V378-R380 PolarHBondContact O-N 2.79Å
379	S	31.6	Very low	30	Very low	113 Å²	113	145.4 Å²	145.4	79%	0.79	79%	0.788	S	S	*	*			trans	-68.8	110.9	151.8	-172.9	0	0	0	0	107.6	N377	N377-S379 VanDerWaalsContact C-N 3.34Å; N377-S379 PolarHBondContact O-N 2.78Å; N377-S379 VanDerWaalsContact O-N 3.13Å
380	R	33.6	Very low	30.3	Very low	212 Å²	212	150 Å²	150	80%	0.8	80%	0.796	S	S	*	*			trans	-146.4	109.4	171.2	-85.6	-178.4	-177	157.2	-3.5	104.7	V378	V378-R380 HydrophobicContact CG1-CB 3.9Å; V378-R380 VanDerWaalsContact CG1-CD 3.42Å; V378-R380 HydrophobicContact CG1-CG 3.48Å; V378-R380 VanDerWaalsContact CG1-CG 3.48Å; V378-R380 PolarHBondContact O-N 2.79Å
381	N	28.4	Very low	30.7	Very low	145 Å²	145	150.1 Å²	150.1	78%	0.775	80%	0.799	S	S	*	*			cis	42.1	125.9	49	-85.1	6.6	0	0	0	114.1
382	M	29	Very low	31.7	Very low	184 Å²	184	151.3 Å²	151.3	91%	0.906	80%	0.8	S	S	*	*			trans	94.2	107.1	178.7	-53.2	-170	175	0	0	114.1
383	A	29.1	Very low	33.5	Very low	106 Å²	106	146.6 Å²	146.6	88%	0.876	78%	0.776	S	S	*	*				62.2	98.4	61.1	0	0	0	0	0	112
384	G	28.2	Very low	35.8	Very low	66 Å²	66	141.8 Å²	141.8	68%	0.68	76%	0.757	S	S	*	*			trans	-158.8	136.9	169.2	0	0	0	0	0	109
385	P	37.4	Very low	38	Very low	127 Å²	127	136 Å²	136	83%	0.825	72%	0.719	S	S	*	*			trans	-91.6	113.3	-163.9	34.1	-29.3	0	0	0	111.1
386	F	28.2	Very low	40.3	Very low	200 Å²	200	127.4 Å²	127.4	88%	0.877	69%	0.689	S	S	*	*			trans	-116.6	104.7	151.6	-81.6	-83.6	0	0	0	106.6
387	Q	35.5	Very low	42.6	Very low	196 Å²	196	125.2 Å²	125.2	92%	0.916	67%	0.673	S	S	*	*			trans	-86.4	116	158.8	-75.1	-179.2	-10.2	0	0	106.9
388	P	27.7	Very low	45	Very low	96 Å²	96	119.3 Å²	119.3	62%	0.623	64%	0.644	S	S	*	*			trans	-138.1	127.6	130.2	21.3	-0.8	0	0	0	111.9
389	F	25.8	Very low	47	Very low	186 Å²	186	120.4 Å²	120.4	82%	0.816	64%	0.639	S	S	*	*			trans	63.6	106.8	162	-65	-80.5	0	0	0	117.6	L391	F389-L391 VanDerWaalsContact C-N 3.27Å; F389-L391 PolarHBondContact O-N 2.95Å
390	D	36.3	Very low	49	Very low	165 Å²	165	120.3 Å²	120.3	88%	0.882	63%	0.626	S	S	*	*			trans	-52.6	83.7	169.1	-63.5	-56.4	0	0	0	111.4	H392	D390-H392 PolarHBondContact O-N 3.03Å
391	L	39.3	Very low	50.8	Low	160 Å²	160	113.9 Å²	113.9	84%	0.838	61%	0.613	S	S	*	*			trans	-75	80.1	172.1	-110.4	127.4	0	0	0	108.6	F389	F389-L391 VanDerWaalsContact C-N 3.27Å; F389-L391 PolarHBondContact O-N 2.95Å
392	H	50.2	Low	52.3	Low	147 Å²	147	110.5 Å²	110.5	68%	0.681	60%	0.598	S	S	*	*			trans	52.2	112.8	157.9	-71.1	64.1	0	0	0	115.9	D390 V394	D390-H392 PolarHBondContact O-N 3.03Å; H392-V394 HydrophobicContact CB-CG1 4.17Å; H392-V394 HydrophobicContact CB-CG2 4.37Å; H392-V394 WeakPolarHBondContact O-CG2 3.46Å; H392-V394 PolarHBondContact O-N 2.84Å
393	E	66.9	Low	54	Low	83 Å²	83	105.6 Å²	105.6	39%	0.388	58%	0.575	S	S	.	*			trans	-64	65.2	168.9	-65.7	171.7	152.6	0	0	111.7	S401 K404 M407 L414	E393-S401 VanDerWaalsContact O-CB 3.26Å; E393-S401 WeakPolarHBondContact O-CB 3.44Å; E393-S401 PolarHBondContact O-OG 3.11Å; E393-K404 IonicContact OE1-NZ 2.89Å; E393-K404 PolarHBondContact OE1-NZ 2.79Å; E393-K404 WeakPolarHBondContact OE2-CE 3.16Å; E393-K404 IonicContact OE2-NZ 3.82Å; E393-K404 PolarHBondContact OE2-NZ 2.9Å; E393-M407 HydrophobicContact CB-CE 4.14Å; E393-L414 HydrophobicContact CB-CD1 4.14Å; E393-L414 HydrophobicContact CG-CD1 4.18Å
394	V	78	Confident	55.7	Low	50 Å²	50	107.2 Å²	107.2	30%	0.303	56%	0.562	S	S	.	*			trans	-112.7	141.6	179	-67.7	0	0	0	0	110.3	H392 F396	H392-V394 HydrophobicContact CB-CG1 4.17Å; H392-V394 HydrophobicContact CB-CG2 4.37Å; H392-V394 WeakPolarHBondContact O-CG2 3.46Å; H392-V394 PolarHBondContact O-N 2.84Å; V394-F396 PolarHBondContact O-N 3.5Å
395	C	76.7	Confident	57.7	Low	0 Å²	0	111.4 Å²	111.4	0%	0	57%	0.569	C	S	.	*	B	Isolated β-bridge	trans	-66.2	128.2	175.6	168	0	0	0	0	111.6	V397 C398 Y399 Q400 L414 H416	C395-V397 PolarHBondContact O-N 3.35Å; C395-V397 VanDerWaalsContact O-N 3.13Å; C395-V397 PolarHBondContact SG-N 2.93Å; C395-C398 VanDerWaalsContact CB-SG 3.59Å; C395-C398 PolarHBondContact SG-N 3Å; C395-C398 VanDerWaalsContact SG-N 3.44Å; C395-C398 VanDerWaalsContact SG-SG 3.63Å; C395-Y399 WeakPolarHBondContact O-CA 3.49Å; C395-Y399 PolarHBondContact O-N 2.82Å; C395-Q400 PolarHBondContact N-O 2.94Å; C395-L414 CarbonylContact C-O 3.45Å; C395-L414 VanDerWaalsContact CA-O 3.23Å; C395-L414 WeakPolarHBondContact CA-O 3.45Å; C395-H416 HydrophobicContact CB-CB 4.41Å; C395-H416 WeakPolarHBondContact CB-CE1 3.18Å; C395-H416 WeakPolarHBondContact CB-ND1 3.45Å; C395-H416 PolarHBondContact SG-N 3.45Å
396	F	78.6	Confident	59.6	Low	63 Å²	63	108.7 Å²	108.7	28%	0.276	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-21.1	178.5	178.2	-88.1	0	0	0	114.2	V394 Y399 A413 L414 I415 F436	V394-F396 PolarHBondContact O-N 3.5Å; F396-Y399 WeakPolarHBondContact O-CE2 3.3Å; F396-Y399 PolarHBondContact O-OH 2.86Å; F396-Y399 VanDerWaalsContact O-OH 3.09Å; F396-A413 HydrophobicContact CB-CB 4.01Å; F396-A413 HydrophobicContact CD2-CB 4.14Å; F396-A413 HydrophobicContact CG-CB 4.17Å; F396-L414 PolarHBondContact N-O 3.41Å; F396-I415 HydrophobicContact CB-CG1 3.82Å; F396-F436 HydrophobicContact CD1-CE2 4.42Å; F396-F436 HydrophobicContact CE1-CD2 4.49Å; F396-F436 HydrophobicContact CE1-CE1 4.45Å; F396-F436 AromaticContact CE1-CE2 3.42Å; F396-F436 HydrophobicContact CE1-CE2 3.42Å; F396-F436 VanDerWaalsContact CE1-CE2 3.42Å; F396-F436 AromaticContact CE1-CZ 3.37Å; F396-F436 HydrophobicContact CE1-CZ 3.37Å; F396-F436 HydrophobicContact CZ-CE1 4.24Å; F396-F436 AromaticContact CZ-CE2 4Å; F396-F436 HydrophobicContact CZ-CE2 4Å; F396-F436 AromaticContact CZ-CZ 3.42Å; F396-F436 HydrophobicContact CZ-CZ 3.42Å; F396-F436 VanDerWaalsContact CZ-CZ 3.42Å
397	V	76.2	Confident	62.1	Low	62 Å²	62	100.6 Å²	100.6	38%	0.376	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-46.5	-176.4	177.7	0	0	0	0	111.9	C395 I415 C419 L441	C395-V397 PolarHBondContact O-N 3.35Å; C395-V397 VanDerWaalsContact O-N 3.13Å; C395-V397 PolarHBondContact SG-N 2.93Å; V397-I415 HydrophobicContact CB-CG2 4.43Å; V397-I415 HydrophobicContact CG2-CG1 4.27Å; V397-I415 HydrophobicContact CG2-CG2 3.71Å; V397-C419 HydrophobicContact CB-CB 3.73Å; V397-C419 HydrophobicContact CG1-CB 3.9Å; V397-C419 HydrophobicContact CG2-CB 4.28Å; V397-L441 HydrophobicContact CG2-CD1 3.58Å
398	C	79.1	Confident	64.5	Low	43 Å²	43	93.5 Å²	93.5	29%	0.291	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-10.1	-179.9	73.1	0	0	0	0	114.5	C395 Q400 H416 C419	C395-C398 VanDerWaalsContact CB-SG 3.59Å; C395-C398 PolarHBondContact SG-N 3Å; C395-C398 VanDerWaalsContact SG-N 3.44Å; C395-C398 VanDerWaalsContact SG-SG 3.63Å; C398-Q400 PolarHBondContact O-N 3.16Å; C398-Q400 VanDerWaalsContact O-N 3.17Å; C398-H416 PolarHBondContact SG-CE1 3.09Å; C398-H416 PolarHBondContact SG-ND1 3.23Å; C398-C419 VanDerWaalsContact SG-SG 3.64Å
399	Y	72.3	Confident	66.9	Low	125 Å²	125	95.6 Å²	95.6	49%	0.49	48%	0.48	S	S	.	.			trans	59.2	22.1	178	-56	-88.6	0	0	0	114.8	C395 F396	C395-Y399 WeakPolarHBondContact O-CA 3.49Å; C395-Y399 PolarHBondContact O-N 2.82Å; F396-Y399 WeakPolarHBondContact O-CE2 3.3Å; F396-Y399 PolarHBondContact O-OH 2.86Å; F396-Y399 VanDerWaalsContact O-OH 3.09Å
400	Q	72.2	Confident	69.3	Low	111 Å²	111	87.8 Å²	87.8	52%	0.519	45%	0.448	S	S	.	.			trans	-100.2	146.3	172.5	-66.3	175.4	-19	0	0	110	C395 C398 T402 H416	C395-Q400 PolarHBondContact N-O 2.94Å; C398-Q400 PolarHBondContact O-N 3.16Å; C398-Q400 VanDerWaalsContact O-N 3.17Å; Q400-T402 HydrophobicContact CB-CG2 4.26Å; Q400-H416 PolarHBondContact O-CE1 2.97Å
401	S	72	Confident	71.1	Confident	76 Å²	76	83.2 Å²	83.2	53%	0.531	44%	0.439	S	S	.	.			trans	-105.5	95.5	168.7	-173.9	0	0	0	0	106.3	E393	E393-S401 VanDerWaalsContact O-CB 3.26Å; E393-S401 WeakPolarHBondContact O-CB 3.44Å; E393-S401 PolarHBondContact O-OG 3.11Å
402	T	60.7	Low	72.5	Confident	74 Å²	74	82.7 Å²	82.7	45%	0.454	44%	0.443	S	S	.	.			trans	-118.2	-33.9	-176.8	41.9	0	0	0	0	113.7	Q400 H416 Y418	Q400-T402 HydrophobicContact CB-CG2 4.26Å; T402-H416 PolarHBondContact OG1-CE1 3.31Å; T402-H416 PolarHBondContact OG1-NE2 3.39Å; T402-Y418 PolarHBondContact OG1-OH 2.98Å
403	D	63.7	Low	73.7	Confident	81 Å²	81	76.9 Å²	76.9	43%	0.433	42%	0.421	S	S	.	.			trans	-154.5	124.7	179.3	-75.6	-46.9	0	0	0	112.5	D405 N406 M407	D403-D405 PolarHBondContact O-N 2.9Å; D403-N406 HydrophobicContact CB-CB 4.11Å; D403-M407 WeakPolarHBondContact O-CE 3.17Å; D403-M407 WeakPolarHBondContact O-CG 3.4Å
404	K	64.1	Low	74.5	Confident	140 Å²	140	75.5 Å²	75.5	61%	0.609	42%	0.415	S	S	*	.	S	Bend	trans	-60.6	-34.8	172	-66.1	-174.5	-171.7	-130.7	0	112.3	E393 M407	E393-K404 IonicContact OE1-NZ 2.89Å; E393-K404 PolarHBondContact OE1-NZ 2.79Å; E393-K404 WeakPolarHBondContact OE2-CE 3.16Å; E393-K404 IonicContact OE2-NZ 3.82Å; E393-K404 PolarHBondContact OE2-NZ 2.9Å; K404-M407 HydrophobicContact CG-CE 4.48Å
405	D	71.8	Confident	74.8	Confident	154 Å²	154	73.3 Å²	73.3	82%	0.824	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-26.9	-173.7	-62.5	-22.3	0	0	0	113.5	D403	D403-D405 PolarHBondContact O-N 2.9Å
406	N	77.4	Confident	75.2	Confident	71 Å²	71	73.3 Å²	73.3	38%	0.38	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	23.8	-179.2	-70.4	-43.2	0	0	0	112.7	D403 H416 T417	D403-N406 HydrophobicContact CB-CB 4.11Å; N406-H416 CarbonylContact O-C 3.41Å; N406-H416 WeakPolarHBondContact O-CA 3.48Å; N406-T417 PolarHBondContact O-N 3.13Å; N406-T417 PolarHBondContact O-OG1 3.34Å
407	M	80.7	Confident	75.6	Confident	30 Å²	30	73 Å²	73	15%	0.148	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	131.5	178.3	-75.4	-169.7	-68.3	0	0	112.2	E393 D403 K404 L414 I415	E393-M407 HydrophobicContact CB-CE 4.14Å; D403-M407 WeakPolarHBondContact O-CE 3.17Å; D403-M407 WeakPolarHBondContact O-CG 3.4Å; K404-M407 HydrophobicContact CG-CE 4.48Å; M407-L414 HydrophobicContact SD-CB 4.11Å; M407-I415 CarbonylContact C-O 3.6Å; M407-I415 WeakPolarHBondContact CA-O 3.37Å
408	I	84.4	Confident	76	Confident	47 Å²	47	73.9 Å²	73.9	24%	0.241	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	137.7	169.4	52.9	163.7	0	0	0	109.8	V410 I415 T417 F420	I408-V410 HydrophobicContact CD1-CG2 4.04Å; I408-V410 HydrophobicContact CG1-CG2 4.41Å; I408-I415 HydrophobicContact CG1-CB 4.24Å; I408-I415 WeakPolarHBondContact CG1-O 3.36Å; I408-I415 PolarHBondContact N-O 3.44Å; I408-I415 PolarHBondContact O-N 3.01Å; I408-T417 HydrophobicContact CG2-CG2 3.95Å; I408-F420 HydrophobicContact CD1-CB 3.55Å; I408-F420 HydrophobicContact CD1-CD1 3.36Å; I408-F420 HydrophobicContact CD1-CD2 3.75Å; I408-F420 HydrophobicContact CD1-CE1 3.87Å; I408-F420 HydrophobicContact CD1-CE2 4.25Å; I408-F420 HydrophobicContact CD1-CG 3.28Å; I408-F420 HydrophobicContact CD1-CZ 4.3Å; I408-F420 HydrophobicContact CG1-CB 4.46Å
409	K	78	Confident	76.4	Confident	139 Å²	139	72.1 Å²	72.1	60%	0.604	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	118.8	172.7	-171.1	175.2	-178.5	175.1	0	110	G411 L414	K409-G411 WeakPolarHBondContact CE-O 3.47Å; K409-L414 HydrophobicContact CB-CD2 4.07Å; K409-L414 HydrophobicContact CG-CD2 4.27Å
410	V	77.7	Confident	77.2	Confident	23 Å²	23	66.5 Å²	66.5	14%	0.139	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	105.9	177.7	-179.4	0	0	0	0	108	I408 T412 A413 I415 F420 F434	I408-V410 HydrophobicContact CD1-CG2 4.04Å; I408-V410 HydrophobicContact CG1-CG2 4.41Å; V410-T412 PolarHBondContact O-N 2.97Å; V410-T412 VanDerWaalsContact O-N 3.16Å; V410-A413 PolarHBondContact N-O 3.2Å; V410-A413 PolarHBondContact O-N 3.22Å; V410-I415 HydrophobicContact CB-CD1 4.17Å; V410-I415 HydrophobicContact CG2-CD1 4.11Å; V410-F420 HydrophobicContact CG2-CE2 4.17Å; V410-F434 HydrophobicContact CG1-CE1 3.8Å; V410-F434 HydrophobicContact CG1-CE2 3.93Å; V410-F434 HydrophobicContact CG1-CZ 3.17Å
411	G	72.6	Confident	78	Confident	68 Å²	68	66.1 Å²	66.1	70%	0.701	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	-116.7	-172.1	0	0	0	0	0	111.7	K409	K409-G411 WeakPolarHBondContact CE-O 3.47Å
412	T	69.1	Low	78.9	Confident	150 Å²	150	62.5 Å²	62.5	92%	0.92	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-4	176.7	55.1	0	0	0	0	113.9	V410	V410-T412 PolarHBondContact O-N 2.97Å; V410-T412 VanDerWaalsContact O-N 3.16Å
413	A	76.6	Confident	80	Confident	25 Å²	25	66.8 Å²	66.8	21%	0.207	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	143.7	-176	0	0	0	0	0	112.1	F396 V410	F396-A413 HydrophobicContact CB-CB 4.01Å; F396-A413 HydrophobicContact CD2-CB 4.14Å; F396-A413 HydrophobicContact CG-CB 4.17Å; V410-A413 PolarHBondContact N-O 3.2Å; V410-A413 PolarHBondContact O-N 3.22Å
414	L	81.8	Confident	80.9	Confident	53 Å²	53	67.8 Å²	67.8	28%	0.277	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	134.4	170	-67	168.6	0	0	0	108.7	E393 C395 F396 M407 K409	E393-L414 HydrophobicContact CB-CD1 4.14Å; E393-L414 HydrophobicContact CG-CD1 4.18Å; C395-L414 CarbonylContact C-O 3.45Å; C395-L414 VanDerWaalsContact CA-O 3.23Å; C395-L414 WeakPolarHBondContact CA-O 3.45Å; F396-L414 PolarHBondContact N-O 3.41Å; M407-L414 HydrophobicContact SD-CB 4.11Å; K409-L414 HydrophobicContact CB-CD2 4.07Å; K409-L414 HydrophobicContact CG-CD2 4.27Å
415	I	84.5	Confident	82.1	Confident	5 Å²	5	63.4 Å²	63.4	3%	0.026	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	136.7	180	-62.7	161.6	0	0	0	108.5	F396 V397 M407 I408 V410 C419 F420 L441	F396-I415 HydrophobicContact CB-CG1 3.82Å; V397-I415 HydrophobicContact CB-CG2 4.43Å; V397-I415 HydrophobicContact CG2-CG1 4.27Å; V397-I415 HydrophobicContact CG2-CG2 3.71Å; M407-I415 CarbonylContact C-O 3.6Å; M407-I415 WeakPolarHBondContact CA-O 3.37Å; I408-I415 HydrophobicContact CG1-CB 4.24Å; I408-I415 WeakPolarHBondContact CG1-O 3.36Å; I408-I415 PolarHBondContact N-O 3.44Å; I408-I415 PolarHBondContact O-N 3.01Å; V410-I415 HydrophobicContact CB-CD1 4.17Å; V410-I415 HydrophobicContact CG2-CD1 4.11Å; I415-C419 HydrophobicContact CG2-CB 3.98Å; I415-F420 HydrophobicContact CD1-CD2 4.28Å; I415-F420 HydrophobicContact CG2-CB 4.03Å; I415-F420 HydrophobicContact CG2-CD2 4.39Å; I415-L441 HydrophobicContact CD1-CD1 4.34Å
416	H	86.7	Confident	82.9	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	141.5	171.4	-63.4	124.6	0	0	0	111.1	C395 C398 Q400 T402 N406 Y418 C419 F420	C395-H416 HydrophobicContact CB-CB 4.41Å; C395-H416 WeakPolarHBondContact CB-CE1 3.18Å; C395-H416 WeakPolarHBondContact CB-ND1 3.45Å; C395-H416 PolarHBondContact SG-N 3.45Å; C398-H416 PolarHBondContact SG-CE1 3.09Å; C398-H416 PolarHBondContact SG-ND1 3.23Å; Q400-H416 PolarHBondContact O-CE1 2.97Å; T402-H416 PolarHBondContact OG1-CE1 3.31Å; T402-H416 PolarHBondContact OG1-NE2 3.39Å; N406-H416 CarbonylContact O-C 3.41Å; N406-H416 WeakPolarHBondContact O-CA 3.48Å; H416-Y418 HydrophobicContact CB-CD1 3.72Å; H416-Y418 HydrophobicContact CB-CD2 4.18Å; H416-Y418 HydrophobicContact CB-CE1 3.45Å; H416-Y418 VanDerWaalsContact CB-CE1 3.45Å; H416-Y418 HydrophobicContact CB-CE2 3.94Å; H416-Y418 HydrophobicContact CB-CG 4.09Å; H416-Y418 AromaticContact CD2-CE1 3.91Å; H416-Y418 AromaticContact CD2-CZ 3.99Å; H416-Y418 AromaticContact CE1-CZ 3.99Å; H416-Y418 PolarHBondContact CE1-OH 3.23Å; H416-Y418 AromaticContact CG-CE1 3.56Å; H416-Y418 AromaticContact CG-CZ 3.42Å; H416-Y418 VanDerWaalsContact CG-CZ 3.42Å; H416-Y418 AromaticContact ND1-CE2 3.9Å; H416-Y418 AromaticContact ND1-CZ 3.42Å; H416-Y418 PolarHBondContact ND1-OH 2.95Å; H416-Y418 VanDerWaalsContact ND1-OH 3.08Å; H416-Y418 PolarHBondContact O-N 2.92Å; H416-C419 HydrophobicContact CB-CB 3.94Å; H416-C419 CarbonylContact O-C 3.45Å; H416-C419 WeakPolarHBondContact O-CA 3.49Å; H416-C419 WeakPolarHBondContact O-CB 3.49Å; H416-C419 PolarHBondContact O-N 2.8Å; H416-F420 PolarHBondContact O-N 3.37Å
417	T	85.7	Confident	83.3	Confident	57 Å²	57	62.1 Å²	62.1	35%	0.35	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-49.3	-43.1	173	50.1	0	0	0	0	111.5	N406 I408 C419 F420	N406-T417 PolarHBondContact O-N 3.13Å; N406-T417 PolarHBondContact O-OG1 3.34Å; I408-T417 HydrophobicContact CG2-CG2 3.95Å; T417-C419 VanDerWaalsContact C-N 3.34Å; T417-C419 PolarHBondContact O-N 3.4Å; T417-F420 PolarHBondContact O-N 2.88Å
418	Y	85.8	Confident	83.7	Confident	79 Å²	79	68.7 Å²	68.7	31%	0.31	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-74.3	-20.1	177.1	62	-95.8	0	0	0	115	T402 H416 R421	T402-Y418 PolarHBondContact OG1-OH 2.98Å; H416-Y418 HydrophobicContact CB-CD1 3.72Å; H416-Y418 HydrophobicContact CB-CD2 4.18Å; H416-Y418 HydrophobicContact CB-CE1 3.45Å; H416-Y418 VanDerWaalsContact CB-CE1 3.45Å; H416-Y418 HydrophobicContact CB-CE2 3.94Å; H416-Y418 HydrophobicContact CB-CG 4.09Å; H416-Y418 AromaticContact CD2-CE1 3.91Å; H416-Y418 AromaticContact CD2-CZ 3.99Å; H416-Y418 AromaticContact CE1-CZ 3.99Å; H416-Y418 PolarHBondContact CE1-OH 3.23Å; H416-Y418 AromaticContact CG-CE1 3.56Å; H416-Y418 AromaticContact CG-CZ 3.42Å; H416-Y418 VanDerWaalsContact CG-CZ 3.42Å; H416-Y418 AromaticContact ND1-CE2 3.9Å; H416-Y418 AromaticContact ND1-CZ 3.42Å; H416-Y418 PolarHBondContact ND1-OH 2.95Å; H416-Y418 VanDerWaalsContact ND1-OH 3.08Å; H416-Y418 PolarHBondContact O-N 2.92Å; Y418-R421 PolarHBondContact O-NH1 3.31Å
419	C	86.6	Confident	83.8	Confident	6 Å²	6	67.2 Å²	67.2	4%	0.041	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-87.7	-15.6	174.7	-70.9	0	0	0	0	113	V397 C398 I415 H416 T417 R421	V397-C419 HydrophobicContact CB-CB 3.73Å; V397-C419 HydrophobicContact CG1-CB 3.9Å; V397-C419 HydrophobicContact CG2-CB 4.28Å; C398-C419 VanDerWaalsContact SG-SG 3.64Å; I415-C419 HydrophobicContact CG2-CB 3.98Å; H416-C419 HydrophobicContact CB-CB 3.94Å; H416-C419 CarbonylContact O-C 3.45Å; H416-C419 WeakPolarHBondContact O-CA 3.49Å; H416-C419 WeakPolarHBondContact O-CB 3.49Å; H416-C419 PolarHBondContact O-N 2.8Å; T417-C419 VanDerWaalsContact C-N 3.34Å; T417-C419 PolarHBondContact O-N 3.4Å; C419-R421 PolarHBondContact O-N 2.87Å
420	F	89.6	Confident	84	Confident	7 Å²	7	67 Å²	67	3%	0.031	35%	0.345	C	S	.	.			trans	-80.9	71.1	178.9	-167.4	-120.8	0	0	0	111.2	I408 V410 I415 H416 T417 L429 F434 L441	I408-F420 HydrophobicContact CD1-CB 3.55Å; I408-F420 HydrophobicContact CD1-CD1 3.36Å; I408-F420 HydrophobicContact CD1-CD2 3.75Å; I408-F420 HydrophobicContact CD1-CE1 3.87Å; I408-F420 HydrophobicContact CD1-CE2 4.25Å; I408-F420 HydrophobicContact CD1-CG 3.28Å; I408-F420 HydrophobicContact CD1-CZ 4.3Å; I408-F420 HydrophobicContact CG1-CB 4.46Å; V410-F420 HydrophobicContact CG2-CE2 4.17Å; I415-F420 HydrophobicContact CD1-CD2 4.28Å; I415-F420 HydrophobicContact CG2-CB 4.03Å; I415-F420 HydrophobicContact CG2-CD2 4.39Å; H416-F420 PolarHBondContact O-N 3.37Å; T417-F420 PolarHBondContact O-N 2.88Å; F420-L429 HydrophobicContact CD1-CB 3.64Å; F420-L429 WeakPolarHBondContact CD1-O 3.29Å; F420-L429 HydrophobicContact CD2-CB 4.4Å; F420-L429 HydrophobicContact CD2-CD1 4.45Å; F420-L429 HydrophobicContact CE1-CB 3.43Å; F420-L429 VanDerWaalsContact CE1-CB 3.43Å; F420-L429 WeakPolarHBondContact CE1-O 3.11Å; F420-L429 HydrophobicContact CE2-CB 4.21Å; F420-L429 HydrophobicContact CE2-CD1 4.38Å; F420-L429 HydrophobicContact CG-CB 4.13Å; F420-L429 HydrophobicContact CZ-CB 3.73Å; F420-L429 PolarHBondContact O-N 3.28Å; F420-F434 HydrophobicContact CE2-CB 4.46Å; F420-F434 HydrophobicContact CE2-CD1 4Å; F420-F434 HydrophobicContact CE2-CD2 4.2Å; F420-F434 HydrophobicContact CE2-CE1 4.33Å; F420-F434 AromaticContact CE2-CG 3.94Å; F420-F434 HydrophobicContact CE2-CG 3.94Å; F420-F434 HydrophobicContact CZ-CB 4.17Å; F420-F434 AromaticContact CZ-CD1 3.49Å; F420-F434 HydrophobicContact CZ-CD1 3.49Å; F420-F434 VanDerWaalsContact CZ-CD1 3.49Å; F420-F434 HydrophobicContact CZ-CD2 4.46Å; F420-F434 HydrophobicContact CZ-CE1 4Å; F420-F434 AromaticContact CZ-CG 3.77Å; F420-F434 HydrophobicContact CZ-CG 3.77Å; F420-L441 HydrophobicContact CD2-CD1 3.98Å; F420-L441 HydrophobicContact CE2-CD1 4.47Å; F420-L441 HydrophobicContact CE2-CD2 4.42Å
421	R	89.5	Confident	83.8	Confident	103 Å²	103	72 Å²	72	39%	0.389	37%	0.365	S	S	.	.	B	Isolated β-bridge	trans	-135	151.3	-178.9	56.1	177.3	171.2	-125.4	0.3	112	Y418 C419 D427	Y418-R421 PolarHBondContact O-NH1 3.31Å; C419-R421 PolarHBondContact O-N 2.87Å; R421-D427 CarbonylContact C-O 3.59Å; R421-D427 WeakPolarHBondContact CA-O 3.28Å; R421-D427 VanDerWaalsContact CB-O 3.28Å; R421-D427 WeakPolarHBondContact CB-O 3.44Å
422	C	89.9	Confident	83.8	Confident	0 Å²	0	75.2 Å²	75.2	0%	0	36%	0.361	C	S	.	.			trans	-64.1	136.3	175.7	179.5	0	0	0	0	110.3	E424 C425 N426 D427 L429 C443	C422-E424 VanDerWaalsContact C-N 3.33Å; C422-E424 PolarHBondContact O-N 3.05Å; C422-C425 WeakPolarHBondContact CB-SG 3.33Å; C422-N426 WeakPolarHBondContact O-CA 3.44Å; C422-N426 PolarHBondContact O-N 3.06Å; C422-D427 PolarHBondContact N-O 2.88Å; C422-L429 HydrophobicContact CB-CD2 3.99Å; C422-L429 HydrophobicContact CB-CG 4.48Å; C422-C443 HydrophobicContact CB-CB 4.08Å; C422-C443 PolarHBondContact SG-N 2.98Å; C422-C443 VanDerWaalsContact SG-SG 3.67Å
423	R	84.7	Confident	84	Confident	164 Å²	164	72.7 Å²	72.7	62%	0.619	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-34.7	178.7	-178.9	58.2	179.8	-163.4	2	113.8	L441 F442	R423-L441 PolarHBondContact N-O 3.5Å; R423-F442 HydrophobicContact CB-CD1 4.28Å; R423-F442 HydrophobicContact CB-CE1 4Å
424	E	82.8	Confident	84.3	Confident	103 Å²	103	73.4 Å²	73.4	48%	0.481	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-50	-174	-66.4	-56	139.3	0	0	112.2	C422 F442 C446 L450	C422-E424 VanDerWaalsContact C-N 3.33Å; C422-E424 PolarHBondContact O-N 3.05Å; E424-F442 HydrophobicContact CG-CD1 4.02Å; E424-F442 HydrophobicContact CG-CE1 3.97Å; E424-C446 HydrophobicContact CB-CB 3.91Å; E424-C446 HydrophobicContact CG-CB 4.17Å; E424-L450 HydrophobicContact CG-CD1 3.54Å; E424-L450 HydrophobicContact CG-CG 4.28Å
425	C	88.8	Confident	84.3	Confident	47 Å²	47	76.9 Å²	76.9	32%	0.318	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-13.3	-179.8	63.5	0	0	0	0	114.2	C422 D427	C422-C425 WeakPolarHBondContact CB-SG 3.33Å; C425-D427 WeakPolarHBondContact CB-OD2 3.32Å; C425-D427 PolarHBondContact O-N 3.37Å; C425-D427 PolarHBondContact SG-OD2 3.39Å
426	N	87.3	Confident	84	Confident	96 Å²	96	80.8 Å²	80.8	51%	0.513	37%	0.367	S	S	.	.			trans	60	11.6	-171.3	-70.7	-58.2	0	0	0	115.7	C422	C422-N426 WeakPolarHBondContact O-CA 3.44Å; C422-N426 PolarHBondContact O-N 3.06Å
427	D	87.4	Confident	83.2	Confident	102 Å²	102	85 Å²	85	55%	0.545	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-72.1	146.3	174.1	-64.1	-43.1	0	0	0	111.9	R421 C422 C425 L429	R421-D427 CarbonylContact C-O 3.59Å; R421-D427 WeakPolarHBondContact CA-O 3.28Å; R421-D427 VanDerWaalsContact CB-O 3.28Å; R421-D427 WeakPolarHBondContact CB-O 3.44Å; C422-D427 PolarHBondContact N-O 2.88Å; C425-D427 WeakPolarHBondContact CB-OD2 3.32Å; C425-D427 PolarHBondContact O-N 3.37Å; C425-D427 PolarHBondContact SG-OD2 3.39Å; D427-L429 PolarHBondContact O-N 2.89Å
428	Y	88	Confident	82.2	Confident	168 Å²	168	88.4 Å²	88.4	66%	0.659	40%	0.399	S	S	*	.	B	Isolated β-bridge	trans	-62.3	129.9	173.5	-64.6	-84.1	0	0	0	110.3
429	L	87.5	Confident	81.3	Confident	16 Å²	16	87 Å²	87	8%	0.084	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-84.4	149.5	179.2	-64.2	167.4	0	0	0	109.6	F420 C422 D427 F434 L441 C443	F420-L429 HydrophobicContact CD1-CB 3.64Å; F420-L429 WeakPolarHBondContact CD1-O 3.29Å; F420-L429 HydrophobicContact CD2-CB 4.4Å; F420-L429 HydrophobicContact CD2-CD1 4.45Å; F420-L429 HydrophobicContact CE1-CB 3.43Å; F420-L429 VanDerWaalsContact CE1-CB 3.43Å; F420-L429 WeakPolarHBondContact CE1-O 3.11Å; F420-L429 HydrophobicContact CE2-CB 4.21Å; F420-L429 HydrophobicContact CE2-CD1 4.38Å; F420-L429 HydrophobicContact CG-CB 4.13Å; F420-L429 HydrophobicContact CZ-CB 3.73Å; F420-L429 PolarHBondContact O-N 3.28Å; C422-L429 HydrophobicContact CB-CD2 3.99Å; C422-L429 HydrophobicContact CB-CG 4.48Å; D427-L429 PolarHBondContact O-N 2.89Å; L429-F434 HydrophobicContact CB-CB 4.18Å; L429-F434 HydrophobicContact CD1-CB 3.96Å; L429-F434 HydrophobicContact CD2-CB 4.24Å; L429-F434 HydrophobicContact CG-CB 4.35Å; L429-L441 HydrophobicContact CD1-CB 3.72Å; L429-C443 VanDerWaalsContact CD2-CA 3.42Å; L429-C443 HydrophobicContact CD2-CB 3.54Å
430	Q	81.3	Confident	80.9	Confident	134 Å²	134	92.6 Å²	92.6	63%	0.626	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-93.6	153.3	168.3	-62.2	-170.9	7.5	0	0	109.5	E432 D433	Q430-E432 PolarHBondContact O-N 3.49Å; Q430-E432 VanDerWaalsContact O-N 3.14Å; Q430-D433 PolarHBondContact O-N 3.35Å
431	K	72.7	Confident	80.6	Confident	130 Å²	130	92.9 Å²	92.9	57%	0.565	43%	0.431	S	S	*	.	S	Bend	trans	-64.1	-21.8	-170.8	-170.6	178.5	179.9	-177	0	112.2	F434	K431-F434 VanDerWaalsContact O-CE1 3.23Å; K431-F434 WeakPolarHBondContact O-CE1 3.38Å
432	E	72.6	Confident	80.4	Confident	135 Å²	135	88.1 Å²	88.1	63%	0.631	41%	0.413	S	S	*	.	S	Bend	trans	-91.5	-34.4	-177.8	-61.4	71.2	-151.9	0	0	112.7	Q430	Q430-E432 PolarHBondContact O-N 3.49Å; Q430-E432 VanDerWaalsContact O-N 3.14Å
433	D	74.1	Confident	80.3	Confident	96 Å²	96	89 Å²	89	51%	0.513	42%	0.419	S	S	.	.	S	Bend	trans	-115.7	43	-163	-73.6	-23.6	0	0	0	114.6	Q430	Q430-D433 PolarHBondContact O-N 3.35Å
434	F	82.7	Confident	80.2	Confident	41 Å²	41	83.8 Å²	83.8	18%	0.18	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	161	172.3	75.4	-80	0	0	0	112.5	V410 F420 L429 K431 F436 L441	V410-F434 HydrophobicContact CG1-CE1 3.8Å; V410-F434 HydrophobicContact CG1-CE2 3.93Å; V410-F434 HydrophobicContact CG1-CZ 3.17Å; F420-F434 HydrophobicContact CE2-CB 4.46Å; F420-F434 HydrophobicContact CE2-CD1 4Å; F420-F434 HydrophobicContact CE2-CD2 4.2Å; F420-F434 HydrophobicContact CE2-CE1 4.33Å; F420-F434 AromaticContact CE2-CG 3.94Å; F420-F434 HydrophobicContact CE2-CG 3.94Å; F420-F434 HydrophobicContact CZ-CB 4.17Å; F420-F434 AromaticContact CZ-CD1 3.49Å; F420-F434 HydrophobicContact CZ-CD1 3.49Å; F420-F434 VanDerWaalsContact CZ-CD1 3.49Å; F420-F434 HydrophobicContact CZ-CD2 4.46Å; F420-F434 HydrophobicContact CZ-CE1 4Å; F420-F434 AromaticContact CZ-CG 3.77Å; F420-F434 HydrophobicContact CZ-CG 3.77Å; L429-F434 HydrophobicContact CB-CB 4.18Å; L429-F434 HydrophobicContact CD1-CB 3.96Å; L429-F434 HydrophobicContact CD2-CB 4.24Å; L429-F434 HydrophobicContact CG-CB 4.35Å; K431-F434 VanDerWaalsContact O-CE1 3.23Å; K431-F434 WeakPolarHBondContact O-CE1 3.38Å; F434-F436 HydrophobicContact CE2-CB 4.45Å; F434-L441 HydrophobicContact CD2-CD2 3.65Å; F434-L441 HydrophobicContact CE2-CD2 4.04Å
435	R	81.4	Confident	80	Confident	125 Å²	125	85.7 Å²	85.7	47%	0.472	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	137.3	171.9	-67.2	-71.1	-176.3	-88.3	-0.2	108.9	F442 H447	R435-F442 PolarHBondContact N-O 3.5Å; R435-F442 PolarHBondContact O-N 3.03Å; R435-H447 HydrophobicContact CB-CB 3.87Å; R435-H447 VanDerWaalsContact CB-CD2 3.41Å; R435-H447 WeakPolarHBondContact CB-CD2 3.24Å; R435-H447 VanDerWaalsContact CB-CG 3.49Å; R435-H447 HydrophobicContact CG-CB 3.98Å
436	F	78.9	Confident	79.7	Confident	88 Å²	88	84.4 Å²	84.4	39%	0.386	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	107.6	178.2	-177.1	-104.3	0	0	0	109.3	F396 F434 R440 L441	F396-F436 HydrophobicContact CD1-CE2 4.42Å; F396-F436 HydrophobicContact CE1-CD2 4.49Å; F396-F436 HydrophobicContact CE1-CE1 4.45Å; F396-F436 AromaticContact CE1-CE2 3.42Å; F396-F436 HydrophobicContact CE1-CE2 3.42Å; F396-F436 VanDerWaalsContact CE1-CE2 3.42Å; F396-F436 AromaticContact CE1-CZ 3.37Å; F396-F436 HydrophobicContact CE1-CZ 3.37Å; F396-F436 HydrophobicContact CZ-CE1 4.24Å; F396-F436 AromaticContact CZ-CE2 4Å; F396-F436 HydrophobicContact CZ-CE2 4Å; F396-F436 AromaticContact CZ-CZ 3.42Å; F396-F436 HydrophobicContact CZ-CZ 3.42Å; F396-F436 VanDerWaalsContact CZ-CZ 3.42Å; F434-F436 HydrophobicContact CE2-CB 4.45Å; F436-R440 WeakPolarHBondContact CA-O 3.46Å; F436-R440 WeakPolarHBondContact CD2-O 3.36Å; F436-L441 HydrophobicContact CB-CD2 4.31Å; F436-L441 HydrophobicContact CD2-CD2 3.74Å; F436-L441 HydrophobicContact CD2-CG 4.14Å; F436-L441 HydrophobicContact CG-CD2 4.48Å
437	E	70.6	Confident	79.4	Confident	88 Å²	88	81.4 Å²	81.4	41%	0.411	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	136.9	-174	-157.6	62.8	-121.1	0	0	108.8	G439 R440 F442 H447 Y451	E437-G439 PolarHBondContact O-N 2.96Å; E437-G439 VanDerWaalsContact O-N 3.09Å; E437-R440 PolarHBondContact N-O 2.87Å; E437-R440 PolarHBondContact O-N 2.66Å; E437-F442 HydrophobicContact CB-CD2 4.49Å; E437-F442 HydrophobicContact CB-CE2 4.43Å; E437-H447 IonicContact OE2-NE2 3.6Å; E437-Y451 HydrophobicContact CB-CE2 3.85Å; E437-Y451 WeakPolarHBondContact CB-OH 3.48Å; E437-Y451 HydrophobicContact CG-CD1 4.48Å; E437-Y451 HydrophobicContact CG-CE1 3.69Å; E437-Y451 HydrophobicContact CG-CE2 3.77Å; E437-Y451 VanDerWaalsContact CG-OH 3.23Å; E437-Y451 WeakPolarHBondContact CG-OH 3.23Å
438	E	63.5	Low	78.8	Confident	128 Å²	128	77.8 Å²	77.8	60%	0.598	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	32.3	-175.8	-58.4	-165.8	153.1	0	0	116.5	R440	E438-R440 VanDerWaalsContact C-N 3.34Å
439	G	67.5	Low	78.2	Confident	51 Å²	51	73.5 Å²	73.5	53%	0.526	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.6	8.1	-179.7	0	0	0	0	0	114.6	E437	E437-G439 PolarHBondContact O-N 2.96Å; E437-G439 VanDerWaalsContact O-N 3.09Å
440	R	78.1	Confident	77.5	Confident	122 Å²	122	76.7 Å²	76.7	46%	0.46	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	148.9	-175.7	-59.5	176.1	-168.5	164.5	8.3	111.1	F436 E437 E438 F442	F436-R440 WeakPolarHBondContact CA-O 3.46Å; F436-R440 WeakPolarHBondContact CD2-O 3.36Å; E437-R440 PolarHBondContact N-O 2.87Å; E437-R440 PolarHBondContact O-N 2.66Å; E438-R440 VanDerWaalsContact C-N 3.34Å; R440-F442 HydrophobicContact CB-CD2 4.41Å; R440-F442 HydrophobicContact CB-CE2 3.65Å; R440-F442 HydrophobicContact CB-CZ 3.76Å
441	L	83.6	Confident	77	Confident	13 Å²	13	75 Å²	75	7%	0.068	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	129.1	176.6	-67.5	166.7	0	0	0	109.9	V397 I415 F420 R423 L429 F434 F436	V397-L441 HydrophobicContact CG2-CD1 3.58Å; I415-L441 HydrophobicContact CD1-CD1 4.34Å; F420-L441 HydrophobicContact CD2-CD1 3.98Å; F420-L441 HydrophobicContact CE2-CD1 4.47Å; F420-L441 HydrophobicContact CE2-CD2 4.42Å; R423-L441 PolarHBondContact N-O 3.5Å; L429-L441 HydrophobicContact CD1-CB 3.72Å; F434-L441 HydrophobicContact CD2-CD2 3.65Å; F434-L441 HydrophobicContact CE2-CD2 4.04Å; F436-L441 HydrophobicContact CB-CD2 4.31Å; F436-L441 HydrophobicContact CD2-CD2 3.74Å; F436-L441 HydrophobicContact CD2-CG 4.14Å; F436-L441 HydrophobicContact CG-CD2 4.48Å
442	F	84.9	Confident	77	Confident	3 Å²	3	69.9 Å²	69.9	1%	0.013	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	146.9	177.3	-59.1	-78.7	0	0	0	109.8	R423 E424 R435 E437 R440 H447 L450 Y451	R423-F442 HydrophobicContact CB-CD1 4.28Å; R423-F442 HydrophobicContact CB-CE1 4Å; E424-F442 HydrophobicContact CG-CD1 4.02Å; E424-F442 HydrophobicContact CG-CE1 3.97Å; R435-F442 PolarHBondContact N-O 3.5Å; R435-F442 PolarHBondContact O-N 3.03Å; E437-F442 HydrophobicContact CB-CD2 4.49Å; E437-F442 HydrophobicContact CB-CE2 4.43Å; R440-F442 HydrophobicContact CB-CD2 4.41Å; R440-F442 HydrophobicContact CB-CE2 3.65Å; R440-F442 HydrophobicContact CB-CZ 3.76Å; F442-H447 HydrophobicContact CB-CB 3.82Å; F442-L450 HydrophobicContact CD1-CD1 3.68Å; F442-L450 HydrophobicContact CE1-CD1 3.3Å; F442-L450 HydrophobicContact CZ-CD1 3.91Å; F442-Y451 HydrophobicContact CD2-CE2 4.42Å; F442-Y451 HydrophobicContact CE2-CE2 4.18Å
443	C	88.1	Confident	77	Confident	20 Å²	20	69.8 Å²	69.8	14%	0.135	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	160.6	166.1	66.4	0	0	0	0	109.8	C422 L429 E445 C446 H447	C422-C443 HydrophobicContact CB-CB 4.08Å; C422-C443 PolarHBondContact SG-N 2.98Å; C422-C443 VanDerWaalsContact SG-SG 3.67Å; L429-C443 VanDerWaalsContact CD2-CA 3.42Å; L429-C443 HydrophobicContact CD2-CB 3.54Å; C443-E445 PolarHBondContact O-N 3.23Å; C443-C446 PolarHBondContact O-N 2.84Å; C443-C446 VanDerWaalsContact SG-CB 3.55Å; C443-C446 PolarHBondContact SG-N 3.47Å; C443-C446 PolarHBondContact SG-SG 2.83Å; C443-H447 VanDerWaalsContact O-CB 3.23Å; C443-H447 WeakPolarHBondContact O-CB 3.49Å; C443-H447 PolarHBondContact O-N 3.02Å
444	S	82.3	Confident	77.2	Confident	54 Å²	54	69.6 Å²	69.6	38%	0.378	35%	0.345	S	S	.	.	H	α-helix	trans	-50	-42.2	177.9	52.8	0	0	0	0	112.7	A448	S444-A448 VanDerWaalsContact O-CB 3.25Å; S444-A448 WeakPolarHBondContact O-CB 3.41Å; S444-A448 PolarHBondContact O-N 3.5Å
445	E	79.3	Confident	77.2	Confident	142 Å²	142	67.7 Å²	67.7	66%	0.664	34%	0.336	S	S	*	.	H	α-helix	trans	-68.2	-55	179.4	-65	179.8	-176.1	0	0	112.6	C443 H447 A448 I449	C443-E445 PolarHBondContact O-N 3.23Å; E445-H447 VanDerWaalsContact C-N 3.29Å; E445-H447 PolarHBondContact O-N 2.91Å; E445-A448 PolarHBondContact O-N 3.45Å; E445-I449 VanDerWaalsContact O-CG1 3.25Å; E445-I449 WeakPolarHBondContact O-CG1 3.43Å; E445-I449 PolarHBondContact O-N 3.13Å
446	C	81.1	Confident	77.1	Confident	21 Å²	21	64.6 Å²	64.6	14%	0.142	34%	0.338	C	S	.	.	H	α-helix	trans	-63.8	-36.9	-179.6	-67.6	0	0	0	0	111.9	E424 C443 I449 L450	E424-C446 HydrophobicContact CB-CB 3.91Å; E424-C446 HydrophobicContact CG-CB 4.17Å; C443-C446 PolarHBondContact O-N 2.84Å; C443-C446 VanDerWaalsContact SG-CB 3.55Å; C443-C446 PolarHBondContact SG-N 3.47Å; C443-C446 PolarHBondContact SG-SG 2.83Å; C446-I449 PolarHBondContact O-N 3.31Å; C446-L450 WeakPolarHBondContact O-CB 3.44Å; C446-L450 WeakPolarHBondContact O-CG 3.4Å; C446-L450 PolarHBondContact O-N 3.2Å
447	H	81.3	Confident	77.2	Confident	32 Å²	32	63.7 Å²	63.7	15%	0.148	33%	0.332	C	S	.	.	H	α-helix	trans	-63.2	-47	174.3	-174	-90.6	0	0	0	111.2	R435 E437 F442 C443 E445 I449 L450 Y451	R435-H447 HydrophobicContact CB-CB 3.87Å; R435-H447 VanDerWaalsContact CB-CD2 3.41Å; R435-H447 WeakPolarHBondContact CB-CD2 3.24Å; R435-H447 VanDerWaalsContact CB-CG 3.49Å; R435-H447 HydrophobicContact CG-CB 3.98Å; E437-H447 IonicContact OE2-NE2 3.6Å; F442-H447 HydrophobicContact CB-CB 3.82Å; C443-H447 VanDerWaalsContact O-CB 3.23Å; C443-H447 WeakPolarHBondContact O-CB 3.49Å; C443-H447 PolarHBondContact O-N 3.02Å; E445-H447 VanDerWaalsContact C-N 3.29Å; E445-H447 PolarHBondContact O-N 2.91Å; H447-I449 VanDerWaalsContact C-N 3.27Å; H447-I449 PolarHBondContact O-N 2.79Å; H447-L450 PolarHBondContact O-N 3.45Å; H447-Y451 AromaticContact CD2-CD2 3.39Å; H447-Y451 WeakPolarHBondContact CD2-CD2 3.47Å; H447-Y451 AromaticContact CD2-CE2 3.54Å; H447-Y451 AromaticContact CE1-CD2 3.81Å; H447-Y451 AromaticContact CG-CD2 3.9Å; H447-Y451 AromaticContact NE2-CD2 3.37Å; H447-Y451 WeakPolarHBondContact NE2-CD2 3.2Å; H447-Y451 AromaticContact NE2-CE2 3.64Å; H447-Y451 WeakPolarHBondContact O-CB 3.32Å; H447-Y451 WeakPolarHBondContact O-CD2 3.33Å; H447-Y451 PolarHBondContact O-N 2.9Å
448	A	76.3	Confident	77.8	Confident	26 Å²	26	62.2 Å²	62.2	22%	0.215	33%	0.33	C	S	.	.	H	α-helix	trans	-60.3	-38.8	176.6	0	0	0	0	0	111.5	S444 E445 S452 L463	S444-A448 VanDerWaalsContact O-CB 3.25Å; S444-A448 WeakPolarHBondContact O-CB 3.41Å; S444-A448 PolarHBondContact O-N 3.5Å; E445-A448 PolarHBondContact O-N 3.45Å; A448-S452 WeakPolarHBondContact O-CA 3.44Å; A448-S452 WeakPolarHBondContact O-CB 3.3Å; A448-S452 PolarHBondContact O-N 3.46Å; A448-S452 PolarHBondContact O-OG 3.42Å; A448-L463 HydrophobicContact CB-CD2 4.02Å
449	I	73.7	Confident	78.6	Confident	79 Å²	79	58.7 Å²	58.7	41%	0.405	33%	0.329	S	S	.	.	H	α-helix	trans	-68.9	-48	178	-66.4	165.5	0	0	0	111.3	E445 C446 H447 S452 S461	E445-I449 VanDerWaalsContact O-CG1 3.25Å; E445-I449 WeakPolarHBondContact O-CG1 3.43Å; E445-I449 PolarHBondContact O-N 3.13Å; C446-I449 PolarHBondContact O-N 3.31Å; H447-I449 VanDerWaalsContact C-N 3.27Å; H447-I449 PolarHBondContact O-N 2.79Å; I449-S452 PolarHBondContact O-N 3.21Å; I449-S452 PolarHBondContact O-OG 2.77Å; I449-S461 WeakPolarHBondContact CG2-OG 3.47Å; I449-S461 WeakPolarHBondContact O-CB 3.32Å
450	L	73.2	Confident	79.1	Confident	83 Å²	83	63.3 Å²	63.3	44%	0.435	33%	0.334	S	S	.	.	H	α-helix	trans	-69.4	-41.4	-176.3	-75.2	174.9	0	0	0	113.4	E424 F442 C446 H447 S452	E424-L450 HydrophobicContact CG-CD1 3.54Å; E424-L450 HydrophobicContact CG-CG 4.28Å; F442-L450 HydrophobicContact CD1-CD1 3.68Å; F442-L450 HydrophobicContact CE1-CD1 3.3Å; F442-L450 HydrophobicContact CZ-CD1 3.91Å; C446-L450 WeakPolarHBondContact O-CB 3.44Å; C446-L450 WeakPolarHBondContact O-CG 3.4Å; C446-L450 PolarHBondContact O-N 3.2Å; H447-L450 PolarHBondContact O-N 3.45Å; L450-S452 VanDerWaalsContact C-N 3.34Å
451	Y	71.7	Confident	78.9	Confident	99 Å²	99	60 Å²	60	39%	0.388	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	9.2	180	-65.3	-83.2	0	0	0	112.7	E437 F442 H447	E437-Y451 HydrophobicContact CB-CE2 3.85Å; E437-Y451 WeakPolarHBondContact CB-OH 3.48Å; E437-Y451 HydrophobicContact CG-CD1 4.48Å; E437-Y451 HydrophobicContact CG-CE1 3.69Å; E437-Y451 HydrophobicContact CG-CE2 3.77Å; E437-Y451 VanDerWaalsContact CG-OH 3.23Å; E437-Y451 WeakPolarHBondContact CG-OH 3.23Å; F442-Y451 HydrophobicContact CD2-CE2 4.42Å; F442-Y451 HydrophobicContact CE2-CE2 4.18Å; H447-Y451 AromaticContact CD2-CD2 3.39Å; H447-Y451 WeakPolarHBondContact CD2-CD2 3.47Å; H447-Y451 AromaticContact CD2-CE2 3.54Å; H447-Y451 AromaticContact CE1-CD2 3.81Å; H447-Y451 AromaticContact CG-CD2 3.9Å; H447-Y451 AromaticContact NE2-CD2 3.37Å; H447-Y451 WeakPolarHBondContact NE2-CD2 3.2Å; H447-Y451 AromaticContact NE2-CE2 3.64Å; H447-Y451 WeakPolarHBondContact O-CB 3.32Å; H447-Y451 WeakPolarHBondContact O-CD2 3.33Å; H447-Y451 PolarHBondContact O-N 2.9Å
452	S	71.6	Confident	78.4	Confident	22 Å²	22	59.5 Å²	59.5	15%	0.154	33%	0.327	C	S	.	.	S	Bend	trans	-74.8	150.4	170.3	56.7	0	0	0	0	112.2	A448 I449 L450 S461 M462	A448-S452 WeakPolarHBondContact O-CA 3.44Å; A448-S452 WeakPolarHBondContact O-CB 3.3Å; A448-S452 PolarHBondContact O-N 3.46Å; A448-S452 PolarHBondContact O-OG 3.42Å; I449-S452 PolarHBondContact O-N 3.21Å; I449-S452 PolarHBondContact O-OG 2.77Å; L450-S452 VanDerWaalsContact C-N 3.34Å; S452-S461 WeakPolarHBondContact OG-CA 3.35Å; S452-S461 WeakPolarHBondContact OG-CB 3.44Å; S452-M462 WeakPolarHBondContact CB-O 3.45Å; S452-M462 PolarHBondContact OG-N 3.1Å; S452-M462 VanDerWaalsContact OG-N 3.16Å
453	R	73.7	Confident	77.9	Confident	133 Å²	133	62.9 Å²	62.9	50%	0.502	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-60.1	146.7	167.4	-64.5	-179.8	-176.2	-102	0.2	109.9	E33 M462	E33-R453 IonicContact OE1-NH1 3.28Å; R453-M462 HydrophobicContact CB-CE 3.73Å; R453-M462 WeakPolarHBondContact O-CB 3.17Å; R453-M462 WeakPolarHBondContact O-CE 3.49Å; R453-M462 PolarHBondContact O-N 2.98Å
454	T	78.7	Confident	76.9	Confident	91 Å²	91	66.4 Å²	66.4	56%	0.558	37%	0.368	S	S	*	.	B	Isolated β-bridge	trans	-85.4	140	174.2	54.4	0	0	0	0	111	A456 M462	T454-A456 PolarHBondContact O-N 2.86Å; T454-M462 VanDerWaalsContact C-CE 3.42Å; T454-M462 VanDerWaalsContact O-CE 3.25Å; T454-M462 WeakPolarHBondContact O-CE 3.42Å
455	C	82.3	Confident	76.3	Confident	1 Å²	1	71.9 Å²	71.9	1%	0.007	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-72.9	122.5	177.6	171.8	0	0	0	0	110.6	R457 C458 G459 K460 M462 H476	C455-R457 PolarHBondContact O-N 2.65Å; C455-R457 VanDerWaalsContact O-N 3.09Å; C455-R457 PolarHBondContact SG-N 3.43Å; C455-R457 VanDerWaalsContact SG-N 3.41Å; C455-C458 PolarHBondContact O-N 2.75Å; C455-G459 VanDerWaalsContact O-CA 3.27Å; C455-G459 WeakPolarHBondContact O-CA 3.41Å; C455-G459 PolarHBondContact O-N 2.75Å; C455-K460 WeakPolarHBondContact CB-O 3.21Å; C455-K460 PolarHBondContact N-O 3.19Å; C455-M462 HydrophobicContact CB-CE 4.34Å; C455-M462 HydrophobicContact CB-CG 3.73Å; C455-M462 HydrophobicContact CB-SD 3.62Å; C455-H476 WeakPolarHBondContact CB-CE1 3.43Å; C455-H476 VanDerWaalsContact CB-ND1 3.27Å; C455-H476 WeakPolarHBondContact CB-ND1 3.3Å; C455-H476 PolarHBondContact SG-ND1 3.36Å
456	A	79.4	Confident	76	Confident	61 Å²	61	69.1 Å²	69.1	50%	0.504	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-21.2	179.5	0	0	0	0	0	114.6	T454 K473 S474 I475	T454-A456 PolarHBondContact O-N 2.86Å; A456-K473 HydrophobicContact CB-CB 4.02Å; A456-K473 HydrophobicContact CB-CD 3.98Å; A456-K473 HydrophobicContact CB-CG 4.35Å; A456-S474 PolarHBondContact N-O 3.18Å; A456-I475 HydrophobicContact CB-CG1 4.16Å
457	R	79.9	Confident	75.7	Confident	69 Å²	69	71 Å²	71	26%	0.26	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-54.8	177.6	-174.2	84.3	177.2	-135.5	-1.1	113.3	C455 I475 C479 T481	C455-R457 PolarHBondContact O-N 2.65Å; C455-R457 VanDerWaalsContact O-N 3.09Å; C455-R457 PolarHBondContact SG-N 3.43Å; C455-R457 VanDerWaalsContact SG-N 3.41Å; R457-I475 HydrophobicContact CB-CG2 4.03Å; R457-C479 HydrophobicContact CB-CB 3.97Å; R457-C479 HydrophobicContact CG-CB 4.08Å; R457-T481 PolarHBondContact NH1-O 3.13Å; R457-T481 PolarHBondContact NH2-OG1 3.38Å; R457-T481 VanDerWaalsContact NH2-OG1 3.15Å
458	C	83.1	Confident	75.5	Confident	56 Å²	56	70.1 Å²	70.1	38%	0.378	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.2	-6.2	-171.6	70.9	0	0	0	0	114.4	C455 K460 H476	C455-C458 PolarHBondContact O-N 2.75Å; C458-K460 PolarHBondContact O-N 2.57Å; C458-H476 PolarHBondContact SG-CE1 3.49Å; C458-H476 PolarHBondContact SG-ND1 2.77Å
459	G	80.3	Confident	75.4	Confident	55 Å²	55	75.7 Å²	75.7	57%	0.567	41%	0.405	S	S	*	.			trans	71.6	1.3	-179.4	0	0	0	0	0	115.6	C455	C455-G459 VanDerWaalsContact O-CA 3.27Å; C455-G459 WeakPolarHBondContact O-CA 3.41Å; C455-G459 PolarHBondContact O-N 2.75Å
460	K	78.7	Confident	75.3	Confident	147 Å²	147	71.9 Å²	71.9	64%	0.639	39%	0.386	S	S	*	.			trans	-84.1	151.9	179.5	-58	-178.4	179.9	-176.8	0	111.3	C455 C458	C455-K460 WeakPolarHBondContact CB-O 3.21Å; C455-K460 PolarHBondContact N-O 3.19Å; C458-K460 PolarHBondContact O-N 2.57Å
461	S	73.5	Confident	75.2	Confident	54 Å²	54	72 Å²	72	38%	0.378	39%	0.386	S	S	.	.	B	Isolated β-bridge	trans	-60	137.2	172.4	22.9	0	0	0	0	111.6	I449 S452 H476	I449-S461 WeakPolarHBondContact CG2-OG 3.47Å; I449-S461 WeakPolarHBondContact O-CB 3.32Å; S452-S461 WeakPolarHBondContact OG-CA 3.35Å; S452-S461 WeakPolarHBondContact OG-CB 3.44Å; S461-H476 PolarHBondContact O-NE2 2.94Å
462	M	72.9	Confident	75.2	Confident	1 Å²	1	73.5 Å²	73.5	1%	0.005	41%	0.406	C	S	.	.			trans	-111.9	120.6	-175.3	-66.9	-179.5	-66.3	0	0	112.6	S452 R453 T454 C455 I467 S474 H476	S452-M462 WeakPolarHBondContact CB-O 3.45Å; S452-M462 PolarHBondContact OG-N 3.1Å; S452-M462 VanDerWaalsContact OG-N 3.16Å; R453-M462 HydrophobicContact CB-CE 3.73Å; R453-M462 WeakPolarHBondContact O-CB 3.17Å; R453-M462 WeakPolarHBondContact O-CE 3.49Å; R453-M462 PolarHBondContact O-N 2.98Å; T454-M462 VanDerWaalsContact C-CE 3.42Å; T454-M462 VanDerWaalsContact O-CE 3.25Å; T454-M462 WeakPolarHBondContact O-CE 3.42Å; C455-M462 HydrophobicContact CB-CE 4.34Å; C455-M462 HydrophobicContact CB-CG 3.73Å; C455-M462 HydrophobicContact CB-SD 3.62Å; M462-I467 HydrophobicContact CB-CD1 4.27Å; M462-I467 HydrophobicContact CB-CG1 3.64Å; M462-I467 HydrophobicContact CE-CG1 4.28Å; M462-I467 HydrophobicContact SD-CG1 4.27Å; M462-S474 VanDerWaalsContact CE-OG 3.3Å; M462-S474 WeakPolarHBondContact CE-OG 3.19Å; M462-H476 WeakPolarHBondContact CG-NE2 3.49Å; M462-H476 PolarHBondContact SD-N 2.93Å
463	L	74.2	Confident	75.6	Confident	75 Å²	75	76.9 Å²	76.9	39%	0.393	42%	0.418	S	S	.	.			trans	-62	144.7	170.5	-69.4	161.6	0	0	0	110.7	A448 L465 E466 I467	A448-L463 HydrophobicContact CB-CD2 4.02Å; L463-L465 PolarHBondContact O-N 3.07Å; L463-E466 HydrophobicContact CB-CG 4.46Å; L463-E466 PolarHBondContact O-N 2.78Å; L463-I467 WeakPolarHBondContact O-CG1 3.34Å
464	P	67.6	Low	75.9	Confident	94 Å²	94	71.5 Å²	71.5	61%	0.61	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-31.8	-177.6	-29.3	35	0	0	0	115.2	E466	P464-E466 VanDerWaalsContact C-N 3.34Å
465	L	69.7	Low	76.2	Confident	169 Å²	169	67.4 Å²	67.4	89%	0.885	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-19	178.6	-79.9	78.8	0	0	0	113.9	L463	L463-L465 PolarHBondContact O-N 3.07Å
466	E	73.9	Confident	76.2	Confident	83 Å²	83	68 Å²	68	39%	0.388	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-8.9	-175.7	-61.8	-170.7	171.2	0	0	113.6	L463 P464 I468 H476 R477	L463-E466 HydrophobicContact CB-CG 4.46Å; L463-E466 PolarHBondContact O-N 2.78Å; P464-E466 VanDerWaalsContact C-N 3.34Å; E466-I468 PolarHBondContact O-N 3.03Å; E466-H476 CarbonylContact O-C 3.58Å; E466-H476 WeakPolarHBondContact O-CA 3.46Å; E466-H476 IonicContact OE2-CD2 3.72Å; E466-H476 PolarHBondContact OE2-CD2 3.14Å; E466-H476 VanDerWaalsContact OE2-CD2 3.28Å; E466-R477 PolarHBondContact O-N 3.08Å
467	I	74.1	Confident	76.2	Confident	60 Å²	60	73.8 Å²	73.8	31%	0.308	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	123.7	-174.3	-60.8	171.6	0	0	0	110.1	M462 L463	M462-I467 HydrophobicContact CB-CD1 4.27Å; M462-I467 HydrophobicContact CB-CG1 3.64Å; M462-I467 HydrophobicContact CE-CG1 4.28Å; M462-I467 HydrophobicContact SD-CG1 4.27Å; L463-I467 WeakPolarHBondContact O-CG1 3.34Å
468	I	78	Confident	76.3	Confident	14 Å²	14	74.9 Å²	74.9	7%	0.072	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	132.1	165.7	-59.4	-168.2	0	0	0	108.7	E466 V470 I475 R477 L491	E466-I468 PolarHBondContact O-N 3.03Å; I468-V470 HydrophobicContact CG2-CG2 4.41Å; I468-I475 PolarHBondContact N-O 3.24Å; I468-I475 PolarHBondContact O-N 3.02Å; I468-R477 HydrophobicContact CD1-CB 3.61Å; I468-R477 HydrophobicContact CD1-CG 3.65Å; I468-R477 HydrophobicContact CG1-CB 4.05Å; I468-L491 HydrophobicContact CG2-CD1 3.35Å; I468-L491 HydrophobicContact CG2-CD2 4Å; I468-L491 HydrophobicContact CG2-CG 4.25Å
469	Q	73.4	Confident	76.4	Confident	143 Å²	143	73.2 Å²	73.2	67%	0.668	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.1	116.9	178	-167.4	166.2	-14.6	0	0	110.8	N471	Q469-N471 PolarHBondContact NE2-O 3.36Å
470	V	70.7	Confident	76.6	Confident	0 Å²	0	71 Å²	71	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	104.7	173.8	-175.2	0	0	0	0	108.1	I468 T472 K473 I475 L480 K496	I468-V470 HydrophobicContact CG2-CG2 4.41Å; V470-T472 PolarHBondContact O-N 3.44Å; V470-K473 PolarHBondContact N-O 3.19Å; V470-K473 PolarHBondContact O-N 2.83Å; V470-I475 HydrophobicContact CB-CD1 4.39Å; V470-I475 HydrophobicContact CG2-CD1 4.31Å; V470-L480 HydrophobicContact CG2-CD1 4.25Å; V470-K496 HydrophobicContact CG1-CD 3.9Å; V470-K496 HydrophobicContact CG1-CG 4.01Å
471	N	70.7	Confident	76.9	Confident	84 Å²	84	65.4 Å²	65.4	45%	0.449	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.1	-104.9	-170.5	-62.7	-6.5	0	0	0	111.3	Q469 K496	Q469-N471 PolarHBondContact NE2-O 3.36Å; N471-K496 VanDerWaalsContact OD1-CD 3.29Å; N471-K496 WeakPolarHBondContact OD1-CD 3.34Å
472	T	73.6	Confident	77.5	Confident	131 Å²	131	62.8 Å²	62.8	80%	0.804	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.3	1.6	-179.4	56.2	0	0	0	0	113.4	V470	V470-T472 PolarHBondContact O-N 3.44Å
473	K	78.6	Confident	77.9	Confident	93 Å²	93	66.6 Å²	66.6	40%	0.404	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	138.1	-176.3	-65.7	-177.9	178.4	-179.2	0	111.4	A456 V470	A456-K473 HydrophobicContact CB-CB 4.02Å; A456-K473 HydrophobicContact CB-CD 3.98Å; A456-K473 HydrophobicContact CB-CG 4.35Å; V470-K473 PolarHBondContact N-O 3.19Å; V470-K473 PolarHBondContact O-N 2.83Å
474	S	81.1	Confident	78.2	Confident	20 Å²	20	67 Å²	67	14%	0.14	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	128.7	173.9	46.2	0	0	0	0	110.8	A456 M462	A456-S474 PolarHBondContact N-O 3.18Å; M462-S474 VanDerWaalsContact CE-OG 3.3Å; M462-S474 WeakPolarHBondContact CE-OG 3.19Å
475	I	83.6	Confident	79	Confident	5 Å²	5	65.4 Å²	65.4	3%	0.026	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	145.7	-176.1	-57.5	174.7	0	0	0	108.9	A456 R457 I468 V470 C479	A456-I475 HydrophobicContact CB-CG1 4.16Å; R457-I475 HydrophobicContact CB-CG2 4.03Å; I468-I475 PolarHBondContact N-O 3.24Å; I468-I475 PolarHBondContact O-N 3.02Å; V470-I475 HydrophobicContact CB-CD1 4.39Å; V470-I475 HydrophobicContact CG2-CD1 4.31Å; I475-C479 HydrophobicContact CG2-CB 3.47Å; I475-C479 VanDerWaalsContact CG2-CB 3.47Å
476	H	83.1	Confident	79.6	Confident	14 Å²	14	62.6 Å²	62.6	7%	0.065	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	146.9	172.7	-58.9	98.8	0	0	0	111.3	C455 C458 S461 M462 E466 S478 C479 L480	C455-H476 WeakPolarHBondContact CB-CE1 3.43Å; C455-H476 VanDerWaalsContact CB-ND1 3.27Å; C455-H476 WeakPolarHBondContact CB-ND1 3.3Å; C455-H476 PolarHBondContact SG-ND1 3.36Å; C458-H476 PolarHBondContact SG-CE1 3.49Å; C458-H476 PolarHBondContact SG-ND1 2.77Å; S461-H476 PolarHBondContact O-NE2 2.94Å; M462-H476 WeakPolarHBondContact CG-NE2 3.49Å; M462-H476 PolarHBondContact SD-N 2.93Å; E466-H476 CarbonylContact O-C 3.58Å; E466-H476 WeakPolarHBondContact O-CA 3.46Å; E466-H476 IonicContact OE2-CD2 3.72Å; E466-H476 PolarHBondContact OE2-CD2 3.14Å; E466-H476 VanDerWaalsContact OE2-CD2 3.28Å; H476-S478 WeakPolarHBondContact CB-OG 3.14Å; H476-S478 PolarHBondContact O-N 3.35Å; H476-C479 HydrophobicContact CB-CB 3.79Å; H476-C479 PolarHBondContact ND1-SG 3.27Å; H476-C479 VanDerWaalsContact ND1-SG 3.41Å; H476-C479 CarbonylContact O-C 3.59Å; H476-C479 WeakPolarHBondContact O-CA 3.37Å; H476-C479 WeakPolarHBondContact O-CB 3.38Å; H476-C479 PolarHBondContact O-N 3.5Å; H476-L480 PolarHBondContact O-N 3.5Å
477	R	79.8	Confident	80	Confident	183 Å²	183	65.6 Å²	65.6	69%	0.691	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-52.7	-40.2	167.4	-174.9	165.6	-163.8	102.9	-2.5	113.3	E466 I468 C479 L480	E466-R477 PolarHBondContact O-N 3.08Å; I468-R477 HydrophobicContact CD1-CB 3.61Å; I468-R477 HydrophobicContact CD1-CG 3.65Å; I468-R477 HydrophobicContact CG1-CB 4.05Å; R477-C479 VanDerWaalsContact C-N 3.32Å; R477-L480 WeakPolarHBondContact O-CB 3.37Å; R477-L480 PolarHBondContact O-N 3.33Å
478	S	81	Confident	80.4	Confident	92 Å²	92	67.4 Å²	67.4	64%	0.643	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-70.7	-25.9	175.7	57	0	0	0	0	113.4	H476 L480	H476-S478 WeakPolarHBondContact CB-OG 3.14Å; H476-S478 PolarHBondContact O-N 3.35Å; S478-L480 VanDerWaalsContact C-N 3.29Å
479	C	85.8	Confident	80.5	Confident	21 Å²	21	67.5 Å²	67.5	14%	0.142	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-85.2	-0.4	178.1	-71.9	0	0	0	0	113.2	R457 I475 H476 R477 T481	R457-C479 HydrophobicContact CB-CB 3.97Å; R457-C479 HydrophobicContact CG-CB 4.08Å; I475-C479 HydrophobicContact CG2-CB 3.47Å; I475-C479 VanDerWaalsContact CG2-CB 3.47Å; H476-C479 HydrophobicContact CB-CB 3.79Å; H476-C479 PolarHBondContact ND1-SG 3.27Å; H476-C479 VanDerWaalsContact ND1-SG 3.41Å; H476-C479 CarbonylContact O-C 3.59Å; H476-C479 WeakPolarHBondContact O-CA 3.37Å; H476-C479 WeakPolarHBondContact O-CB 3.38Å; H476-C479 PolarHBondContact O-N 3.5Å; R477-C479 VanDerWaalsContact C-N 3.32Å; C479-T481 PolarHBondContact O-N 3.28Å
480	L	84.9	Confident	80.8	Confident	7 Å²	7	68.3 Å²	68.3	4%	0.037	35%	0.353	C	S	.	.			trans	-77.1	68.8	174.8	-169.5	63.6	0	0	0	110.4	V470 H476 R477 S478 I489 L491 P501	V470-L480 HydrophobicContact CG2-CD1 4.25Å; H476-L480 PolarHBondContact O-N 3.5Å; R477-L480 WeakPolarHBondContact O-CB 3.37Å; R477-L480 PolarHBondContact O-N 3.33Å; S478-L480 VanDerWaalsContact C-N 3.29Å; L480-I489 VanDerWaalsContact CD2-O 3.23Å; L480-I489 WeakPolarHBondContact CD2-O 3.22Å; L480-I489 HydrophobicContact CG-CB 4.37Å; L480-I489 WeakPolarHBondContact CG-O 3.34Å; L480-I489 PolarHBondContact O-N 2.89Å; L480-L491 HydrophobicContact CD2-CB 4.4Å; L480-L491 HydrophobicContact CD2-CD1 4.34Å; L480-P501 HydrophobicContact CD1-CB 3.76Å; L480-P501 HydrophobicContact CD1-CG 4.31Å
481	T	85.2	Confident	80.8	Confident	30 Å²	30	72 Å²	72	18%	0.184	37%	0.373	C	S	.	.	B	Isolated β-bridge	trans	-117.6	152.8	176	56.2	0	0	0	0	110.2	R457 C479 Q483 K487	R457-T481 PolarHBondContact NH1-O 3.13Å; R457-T481 PolarHBondContact NH2-OG1 3.38Å; R457-T481 VanDerWaalsContact NH2-OG1 3.15Å; C479-T481 PolarHBondContact O-N 3.28Å; T481-Q483 PolarHBondContact O-N 3.27Å; T481-K487 CarbonylContact C-O 3.48Å; T481-K487 VanDerWaalsContact CA-O 3.23Å; T481-K487 WeakPolarHBondContact CA-O 3.3Å
482	C	86.1	Confident	80.8	Confident	0 Å²	0	77 Å²	77	0%	0	39%	0.393	C	S	.	.			trans	-64.8	133.5	174.5	-179.4	0	0	0	0	110.2	F484 C485 N486 K487 I489 P501 C503	C482-F484 PolarHBondContact O-N 2.97Å; C482-F484 PolarHBondContact SG-N 3.45Å; C482-F484 VanDerWaalsContact SG-N 3.4Å; C482-C485 WeakPolarHBondContact CB-SG 3.46Å; C482-C485 VanDerWaalsContact SG-SG 3.61Å; C482-N486 WeakPolarHBondContact O-CA 3.23Å; C482-N486 PolarHBondContact O-N 3.16Å; C482-N486 PolarHBondContact O-OD1 3.1Å; C482-K487 PolarHBondContact N-O 3.38Å; C482-I489 HydrophobicContact CB-CD1 3.96Å; C482-I489 HydrophobicContact CB-CG1 4.39Å; C482-P501 WeakPolarHBondContact CA-O 3.46Å; C482-C503 HydrophobicContact CB-CB 3.97Å
483	Q	81.8	Confident	80.6	Confident	81 Å²	81	74.7 Å²	74.7	38%	0.379	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-29.5	176	-174.9	61.6	30.7	0	0	113.1	T481 I500 P501 F502	T481-Q483 PolarHBondContact O-N 3.27Å; Q483-I500 HydrophobicContact CB-CG2 3.74Å; Q483-I500 HydrophobicContact CG-CG2 4.26Å; Q483-P501 PolarHBondContact N-O 3.44Å; Q483-F502 HydrophobicContact CB-CE1 4.3Å
484	F	79.4	Confident	80.2	Confident	84 Å²	84	70.9 Å²	70.9	37%	0.368	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-49.5	-175.9	-171	-92.7	0	0	0	112.5	C482 C507 N510 Q511 L514	C482-F484 PolarHBondContact O-N 2.97Å; C482-F484 PolarHBondContact SG-N 3.45Å; C482-F484 VanDerWaalsContact SG-N 3.4Å; F484-C507 HydrophobicContact CB-CB 4.06Å; F484-C507 HydrophobicContact CD1-CB 4.37Å; F484-C507 HydrophobicContact CG-CB 4.44Å; F484-N510 HydrophobicContact CD2-CB 4.16Å; F484-N510 HydrophobicContact CE1-CB 4.26Å; F484-N510 HydrophobicContact CE2-CB 3.59Å; F484-N510 HydrophobicContact CZ-CB 3.66Å; F484-Q511 HydrophobicContact CD2-CB 4.48Å; F484-L514 HydrophobicContact CD2-CD1 4.4Å; F484-L514 HydrophobicContact CE2-CD1 3.65Å
485	C	84.1	Confident	79.6	Confident	59 Å²	59	75 Å²	75	40%	0.399	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108	-0.7	-174.8	69.8	0	0	0	0	114.6	C482 K487 C503	C482-C485 WeakPolarHBondContact CB-SG 3.46Å; C482-C485 VanDerWaalsContact SG-SG 3.61Å; C485-K487 PolarHBondContact O-N 3.07Å; C485-K487 VanDerWaalsContact SG-CB 3.58Å; C485-C503 PolarHBondContact SG-SG 2.86Å
486	N	82.6	Confident	78.9	Confident	111 Å²	111	79.2 Å²	79.2	59%	0.594	40%	0.398	S	S	*	.			trans	56	11.4	-177	-68.9	-33.2	0	0	0	116.1	C482	C482-N486 WeakPolarHBondContact O-CA 3.23Å; C482-N486 PolarHBondContact O-N 3.16Å; C482-N486 PolarHBondContact O-OD1 3.1Å
487	K	83.5	Confident	78.1	Confident	145 Å²	145	85 Å²	85	63%	0.63	42%	0.423	S	S	*	.			trans	-68.2	135.3	175.6	-158.1	174.7	-165.7	-177.7	0	110.4	T481 C482 C485 I489	T481-K487 CarbonylContact C-O 3.48Å; T481-K487 VanDerWaalsContact CA-O 3.23Å; T481-K487 WeakPolarHBondContact CA-O 3.3Å; C482-K487 PolarHBondContact N-O 3.38Å; C485-K487 PolarHBondContact O-N 3.07Å; C485-K487 VanDerWaalsContact SG-CB 3.58Å; K487-I489 WeakPolarHBondContact O-CG1 3.49Å
488	S	81.1	Confident	77.4	Confident	99 Å²	99	80.4 Å²	80.4	69%	0.692	42%	0.424	S	S	*	.	B	Isolated β-bridge	trans	-65.6	129.5	172.5	55.2	0	0	0	0	110.5
489	I	81.1	Confident	76.8	Confident	16 Å²	16	76.5 Å²	76.5	8%	0.082	40%	0.399	C	S	.	.			trans	-111.2	142.8	-175.1	-44.5	158.3	0	0	0	108.7	L480 C482 K487 C494 P501 F502 C503	L480-I489 VanDerWaalsContact CD2-O 3.23Å; L480-I489 WeakPolarHBondContact CD2-O 3.22Å; L480-I489 HydrophobicContact CG-CB 4.37Å; L480-I489 WeakPolarHBondContact CG-O 3.34Å; L480-I489 PolarHBondContact O-N 2.89Å; C482-I489 HydrophobicContact CB-CD1 3.96Å; C482-I489 HydrophobicContact CB-CG1 4.39Å; K487-I489 WeakPolarHBondContact O-CG1 3.49Å; I489-C494 HydrophobicContact CG2-CB 3.97Å; I489-P501 HydrophobicContact CD1-CB 4.24Å; I489-F502 WeakPolarHBondContact CD1-O 3.31Å; I489-C503 HydrophobicContact CD1-CB 4.35Å; I489-C503 HydrophobicContact CG1-CB 4.02Å
490	K	78.7	Confident	76.3	Confident	159 Å²	159	78.5 Å²	78.5	69%	0.691	41%	0.408	S	S	*	.			trans	-80.4	147.5	169.1	-67.3	-177.5	179.8	-179.5	0	109.3	E492 T493 C494	K490-E492 PolarHBondContact O-N 3.28Å; K490-E492 VanDerWaalsContact O-N 3.13Å; K490-T493 PolarHBondContact O-N 2.99Å; K490-T493 PolarHBondContact O-OG1 2.96Å; K490-C494 PolarHBondContact O-N 3.23Å
491	L	71.5	Confident	76.1	Confident	78 Å²	78	78.3 Å²	78.3	41%	0.408	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-54.3	-37.1	-177	-172.2	59	0	0	0	113	I468 L480	I468-L491 HydrophobicContact CG2-CD1 3.35Å; I468-L491 HydrophobicContact CG2-CD2 4Å; I468-L491 HydrophobicContact CG2-CG 4.25Å; L480-L491 HydrophobicContact CD2-CB 4.4Å; L480-L491 HydrophobicContact CD2-CD1 4.34Å
492	E	70.8	Confident	76	Confident	188 Å²	188	77.1 Å²	77.1	88%	0.879	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-68.9	-31.9	179.9	-65.2	167.8	-166.4	0	0	113.2	K490	K490-E492 PolarHBondContact O-N 3.28Å; K490-E492 VanDerWaalsContact O-N 3.13Å
493	T	69.8	Low	75.8	Confident	84 Å²	84	78 Å²	78	52%	0.515	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-103.2	11.6	-175.7	65.8	0	0	0	0	112.7	K490 F495	K490-T493 PolarHBondContact O-N 2.99Å; K490-T493 PolarHBondContact O-OG1 2.96Å; T493-F495 PolarHBondContact O-N 2.89Å
494	C	68.3	Low	75.9	Confident	13 Å²	13	78.8 Å²	78.8	9%	0.088	41%	0.412	C	S	.	.			trans	-81.3	113.3	-178	-177.5	0	0	0	0	111.1	I489 K490 P501	I489-C494 HydrophobicContact CG2-CB 3.97Å; K490-C494 PolarHBondContact O-N 3.23Å; C494-P501 WeakPolarHBondContact SG-CB 3.38Å
495	F	69.8	Low	76	Confident	106 Å²	106	80.3 Å²	80.3	47%	0.465	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	130.7	168.1	-115.2	-97.5	0	0	0	109.8	T493 F502 E505	T493-F495 PolarHBondContact O-N 2.89Å; F495-F502 HydrophobicContact CB-CB 4.34Å; F495-F502 PolarHBondContact N-O 3.49Å; F495-F502 PolarHBondContact O-N 3.46Å; F495-E505 HydrophobicContact CD1-CB 4.29Å; F495-E505 HydrophobicContact CE1-CB 4.04Å; F495-E505 HydrophobicContact CE1-CG 4.1Å; F495-E505 HydrophobicContact CZ-CB 4.24Å
496	K	68.6	Low	75.9	Confident	93 Å²	93	85.3 Å²	85.3	40%	0.404	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	111.3	-170.8	-57.4	175.9	-169.8	171.5	0	109.8	V470 N471	V470-K496 HydrophobicContact CG1-CD 3.9Å; V470-K496 HydrophobicContact CG1-CG 4.01Å; N471-K496 VanDerWaalsContact OD1-CD 3.29Å; N471-K496 WeakPolarHBondContact OD1-CD 3.34Å
497	F	66.7	Low	75.8	Confident	136 Å²	136	80.8 Å²	80.8	60%	0.596	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.5	123.4	172.4	-164.1	-96.2	0	0	0	109.7	G499 I500 F502 A508	F497-G499 PolarHBondContact O-N 3.35Å; F497-I500 PolarHBondContact N-O 3.49Å; F497-I500 PolarHBondContact O-N 3.04Å; F497-F502 HydrophobicContact CB-CD2 4.25Å; F497-F502 HydrophobicContact CB-CE2 3.95Å; F497-A508 HydrophobicContact CB-CB 4.46Å
498	A	65.2	Low	75.6	Confident	86 Å²	86	74.6 Å²	74.6	71%	0.711	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.5	30.1	-178.6	0	0	0	0	0	115.9
499	G	67.9	Low	75.5	Confident	11 Å²	11	74.4 Å²	74.4	11%	0.113	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.7	16.5	-179.5	0	0	0	0	0	115.1	F497	F497-G499 PolarHBondContact O-N 3.35Å
500	I	75.9	Confident	75.1	Confident	63 Å²	63	77.1 Å²	77.1	32%	0.323	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	133.7	173.8	-57.1	171.9	0	0	0	108.8	Q483 F497 F502	Q483-I500 HydrophobicContact CB-CG2 3.74Å; Q483-I500 HydrophobicContact CG-CG2 4.26Å; F497-I500 PolarHBondContact N-O 3.49Å; F497-I500 PolarHBondContact O-N 3.04Å; I500-F502 HydrophobicContact CB-CE2 3.85Å; I500-F502 HydrophobicContact CB-CZ 4.26Å; I500-F502 HydrophobicContact CG2-CE2 3.83Å; I500-F502 HydrophobicContact CG2-CZ 3.88Å; I500-F502 VanDerWaalsContact O-CD2 3.31Å; I500-F502 WeakPolarHBondContact O-CD2 3.44Å; I500-F502 WeakPolarHBondContact O-CE2 3.48Å
501	P	79.8	Confident	74.5	Confident	3 Å²	3	72.4 Å²	72.4	2%	0.019	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	132.8	179.6	30.8	-33.6	0	0	0	113.1	L480 C482 Q483 I489 C494	L480-P501 HydrophobicContact CD1-CB 3.76Å; L480-P501 HydrophobicContact CD1-CG 4.31Å; C482-P501 WeakPolarHBondContact CA-O 3.46Å; Q483-P501 PolarHBondContact N-O 3.44Å; I489-P501 HydrophobicContact CD1-CB 4.24Å; C494-P501 WeakPolarHBondContact SG-CB 3.38Å
502	F	82.6	Confident	74.1	Confident	4 Å²	4	70.9 Å²	70.9	2%	0.018	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	149	175.3	-62.7	-88.1	0	0	0	112	Q483 I489 F495 F497 I500 C507 A508 Q511	Q483-F502 HydrophobicContact CB-CE1 4.3Å; I489-F502 WeakPolarHBondContact CD1-O 3.31Å; F495-F502 HydrophobicContact CB-CB 4.34Å; F495-F502 PolarHBondContact N-O 3.49Å; F495-F502 PolarHBondContact O-N 3.46Å; F497-F502 HydrophobicContact CB-CD2 4.25Å; F497-F502 HydrophobicContact CB-CE2 3.95Å; I500-F502 HydrophobicContact CB-CE2 3.85Å; I500-F502 HydrophobicContact CB-CZ 4.26Å; I500-F502 HydrophobicContact CG2-CE2 3.83Å; I500-F502 HydrophobicContact CG2-CZ 3.88Å; I500-F502 VanDerWaalsContact O-CD2 3.31Å; I500-F502 WeakPolarHBondContact O-CD2 3.44Å; I500-F502 WeakPolarHBondContact O-CE2 3.48Å; F502-C507 HydrophobicContact CD1-CB 4.24Å; F502-A508 HydrophobicContact CB-CB 4.18Å; F502-A508 HydrophobicContact CD1-CB 4.17Å; F502-A508 HydrophobicContact CD2-CB 3.87Å; F502-A508 HydrophobicContact CE2-CB 4.27Å; F502-A508 HydrophobicContact CG-CB 3.81Å; F502-Q511 HydrophobicContact CE1-CB 4.09Å; F502-Q511 HydrophobicContact CZ-CB 4.38Å
503	C	82.8	Confident	73.7	Confident	19 Å²	19	65 Å²	65	13%	0.128	35%	0.346	C	S	.	.	S	Bend	trans	-73.8	-35.8	179.9	65.3	0	0	0	0	112.5	C482 C485 I489 C507	C482-C503 HydrophobicContact CB-CB 3.97Å; C485-C503 PolarHBondContact SG-SG 2.86Å; I489-C503 HydrophobicContact CD1-CB 4.35Å; I489-C503 HydrophobicContact CG1-CB 4.02Å; C503-C507 PolarHBondContact SG-SG 3.42Å
504	D	84.6	Confident	73.3	Confident	97 Å²	97	65.8 Å²	65.8	52%	0.519	35%	0.347	S	S	.	.	S	Bend	trans	-149.4	159.8	-177.8	-62.2	-59.7	0	0	0	110	K506 C507 A508	D504-K506 PolarHBondContact O-N 3.5Å; D504-C507 PolarHBondContact O-N 2.85Å; D504-A508 PolarHBondContact O-N 3.36Å
505	E	80.1	Confident	72.9	Confident	116 Å²	116	68 Å²	68	54%	0.542	36%	0.362	S	S	.	.	H	α-helix	trans	-55.3	-37.1	175.6	-166.7	-178.7	178.8	0	0	112.6	F495 C507 A508 L509	F495-E505 HydrophobicContact CD1-CB 4.29Å; F495-E505 HydrophobicContact CE1-CB 4.04Å; F495-E505 HydrophobicContact CE1-CG 4.1Å; F495-E505 HydrophobicContact CZ-CB 4.24Å; E505-C507 VanDerWaalsContact C-N 3.31Å; E505-C507 PolarHBondContact O-N 2.7Å; E505-A508 WeakPolarHBondContact O-CB 3.17Å; E505-A508 PolarHBondContact O-N 3.38Å; E505-A508 VanDerWaalsContact O-N 3.07Å; E505-L509 HydrophobicContact CG-CD1 3.89Å; E505-L509 PolarHBondContact O-N 3.19Å
506	K	81.6	Confident	72.4	Confident	165 Å²	165	68.2 Å²	68.2	72%	0.717	37%	0.365	S	S	*	.	H	α-helix	trans	-59.3	-40.1	176.1	-60.8	179.7	-176.3	177.1	0	112.4	D504 A508 N510	D504-K506 PolarHBondContact O-N 3.5Å; K506-A508 VanDerWaalsContact C-N 3.34Å; K506-N510 WeakPolarHBondContact O-CB 3.26Å; K506-N510 PolarHBondContact O-N 3.26Å; K506-N510 PolarHBondContact O-ND2 2.84Å
507	C	81.9	Confident	72.1	Confident	16 Å²	16	69.4 Å²	69.4	11%	0.108	37%	0.372	C	S	.	.	H	α-helix	trans	-71.5	-31.2	176.9	-76.4	0	0	0	0	112	F484 F502 C503 D504 E505	F484-C507 HydrophobicContact CB-CB 4.06Å; F484-C507 HydrophobicContact CD1-CB 4.37Å; F484-C507 HydrophobicContact CG-CB 4.44Å; F502-C507 HydrophobicContact CD1-CB 4.24Å; C503-C507 PolarHBondContact SG-SG 3.42Å; D504-C507 PolarHBondContact O-N 2.85Å; E505-C507 VanDerWaalsContact C-N 3.31Å; E505-C507 PolarHBondContact O-N 2.7Å
508	A	78.7	Confident	71.9	Confident	14 Å²	14	65.3 Å²	65.3	12%	0.116	36%	0.363	C	S	.	.	H	α-helix	trans	-68.9	-44.6	174.2	0	0	0	0	0	111.7	F497 F502 D504 E505 K506 Q511	F497-A508 HydrophobicContact CB-CB 4.46Å; F502-A508 HydrophobicContact CB-CB 4.18Å; F502-A508 HydrophobicContact CD1-CB 4.17Å; F502-A508 HydrophobicContact CD2-CB 3.87Å; F502-A508 HydrophobicContact CE2-CB 4.27Å; F502-A508 HydrophobicContact CG-CB 3.81Å; D504-A508 PolarHBondContact O-N 3.36Å; E505-A508 WeakPolarHBondContact O-CB 3.17Å; E505-A508 PolarHBondContact O-N 3.38Å; E505-A508 VanDerWaalsContact O-N 3.07Å; K506-A508 VanDerWaalsContact C-N 3.34Å; A508-Q511 PolarHBondContact O-N 3.22Å
509	L	78.4	Confident	71.5	Confident	96 Å²	96	68.7 Å²	68.7	50%	0.503	36%	0.361	S	S	.	.	H	α-helix	trans	-66.3	-36.4	176.6	-78.7	153.1	0	0	0	112.9	E505 Q511 S512 T513	E505-L509 HydrophobicContact CG-CD1 3.89Å; E505-L509 PolarHBondContact O-N 3.19Å; L509-Q511 VanDerWaalsContact C-N 3.28Å; L509-Q511 PolarHBondContact O-N 3.23Å; L509-S512 PolarHBondContact O-N 2.91Å; L509-S512 PolarHBondContact O-OG 2.91Å; L509-T513 PolarHBondContact O-N 2.99Å
510	N	72.9	Confident	71.4	Confident	72 Å²	72	76.3 Å²	76.3	39%	0.385	39%	0.387	S	S	.	.	H	α-helix	trans	-70.2	-22.6	179.2	-73.7	-16.1	0	0	0	113.6	F484 K506 T513 L514	F484-N510 HydrophobicContact CD2-CB 4.16Å; F484-N510 HydrophobicContact CE1-CB 4.26Å; F484-N510 HydrophobicContact CE2-CB 3.59Å; F484-N510 HydrophobicContact CZ-CB 3.66Å; K506-N510 WeakPolarHBondContact O-CB 3.26Å; K506-N510 PolarHBondContact O-N 3.26Å; K506-N510 PolarHBondContact O-ND2 2.84Å; N510-T513 PolarHBondContact O-OG1 3.25Å; N510-L514 PolarHBondContact O-N 3.3Å
511	Q	67	Low	71.1	Confident	60 Å²	60	79.8 Å²	79.8	28%	0.28	40%	0.402	S	S	.	.	H	α-helix	trans	-78.5	-32.7	175.8	-165.5	168.9	18.4	0	0	112.3	F484 F502 A508 L509 S515	F484-Q511 HydrophobicContact CD2-CB 4.48Å; F502-Q511 HydrophobicContact CE1-CB 4.09Å; F502-Q511 HydrophobicContact CZ-CB 4.38Å; A508-Q511 PolarHBondContact O-N 3.22Å; L509-Q511 VanDerWaalsContact C-N 3.28Å; L509-Q511 PolarHBondContact O-N 3.23Å; Q511-S515 WeakPolarHBondContact O-CB 3.37Å; Q511-S515 PolarHBondContact O-N 3.04Å
512	S	62.3	Low	70.5	Confident	46 Å²	46	87.6 Å²	87.6	32%	0.322	44%	0.435	S	S	.	.	H	α-helix	trans	-64.5	-42.7	175.2	59.9	0	0	0	0	110.8	L509 S515 E516	L509-S512 PolarHBondContact O-N 2.91Å; L509-S512 PolarHBondContact O-OG 2.91Å; S512-S515 PolarHBondContact O-N 3.15Å; S512-S515 PolarHBondContact O-OG 3.43Å; S512-E516 WeakPolarHBondContact O-CG 3.36Å; S512-E516 PolarHBondContact O-N 2.95Å; S512-E516 VanDerWaalsContact O-N 3.11Å
513	T	62.8	Low	69.9	Low	64 Å²	64	92.8 Å²	92.8	39%	0.393	46%	0.463	S	S	.	.	H	α-helix	trans	-65.4	-40.7	178.1	60.2	0	0	0	0	112.8	L509 N510 S515 E516 H517	L509-T513 PolarHBondContact O-N 2.99Å; N510-T513 PolarHBondContact O-OG1 3.25Å; T513-S515 PolarHBondContact O-N 2.99Å; T513-E516 PolarHBondContact O-N 3.42Å; T513-H517 PolarHBondContact O-CD2 3.46Å; T513-H517 PolarHBondContact O-N 3.16Å
514	L	61.1	Low	69.2	Low	102 Å²	102	100.1 Å²	100.1	53%	0.534	49%	0.488	S	S	.	.	H	α-helix	trans	-64.8	-37.4	173	-77.1	177.2	0	0	0	112.6	F484 N510 E516 H517 A518	F484-L514 HydrophobicContact CD2-CD1 4.4Å; F484-L514 HydrophobicContact CE2-CD1 3.65Å; N510-L514 PolarHBondContact O-N 3.3Å; L514-E516 VanDerWaalsContact C-N 3.27Å; L514-E516 PolarHBondContact O-N 3.3Å; L514-H517 PolarHBondContact O-N 3.06Å; L514-A518 VanDerWaalsContact O-CB 3.3Å; L514-A518 WeakPolarHBondContact O-CB 3.38Å; L514-A518 PolarHBondContact O-N 3.32Å
515	S	59.6	Low	68.5	Low	58 Å²	58	99.4 Å²	99.4	41%	0.406	49%	0.487	S	S	.	.	H	α-helix	trans	-65.4	-32.3	177.3	81.8	0	0	0	0	112.2	Q511 S512 T513 K519	Q511-S515 WeakPolarHBondContact O-CB 3.37Å; Q511-S515 PolarHBondContact O-N 3.04Å; S512-S515 PolarHBondContact O-N 3.15Å; S512-S515 PolarHBondContact O-OG 3.43Å; T513-S515 PolarHBondContact O-N 2.99Å; S515-K519 WeakPolarHBondContact O-CB 3.39Å; S515-K519 VanDerWaalsContact O-CG 3.28Å; S515-K519 WeakPolarHBondContact O-CG 3.3Å; S515-K519 PolarHBondContact O-N 3.41Å; S515-K519 VanDerWaalsContact O-N 3.1Å
516	E	61	Low	68	Low	112 Å²	112	97 Å²	97	52%	0.523	48%	0.483	S	S	.	.	H	α-helix	trans	-75.2	-41.7	174.3	-70.9	-179.2	167	0	0	112.2	S512 T513 L514 K519 R520	S512-E516 WeakPolarHBondContact O-CG 3.36Å; S512-E516 PolarHBondContact O-N 2.95Å; S512-E516 VanDerWaalsContact O-N 3.11Å; T513-E516 PolarHBondContact O-N 3.42Å; L514-E516 VanDerWaalsContact C-N 3.27Å; L514-E516 PolarHBondContact O-N 3.3Å; E516-K519 PolarHBondContact O-N 3.42Å; E516-R520 WeakPolarHBondContact O-CB 3.36Å; E516-R520 PolarHBondContact O-N 3.29Å
517	H	60.9	Low	67.3	Low	118 Å²	118	95 Å²	95	55%	0.546	48%	0.48	S	S	.	.	H	α-helix	trans	-63.4	-43.5	174	-89.4	-83.8	0	0	0	111.9	T513 L514 K519 R520 E521	T513-H517 PolarHBondContact O-CD2 3.46Å; T513-H517 PolarHBondContact O-N 3.16Å; L514-H517 PolarHBondContact O-N 3.06Å; H517-K519 VanDerWaalsContact C-N 3.33Å; H517-K519 PolarHBondContact O-N 3.22Å; H517-R520 CarbonylContact O-C 3.56Å; H517-R520 PolarHBondContact O-N 3.42Å; H517-E521 WeakPolarHBondContact O-CB 3.44Å; H517-E521 PolarHBondContact O-N 3.28Å
518	A	62.1	Low	66.2	Low	50 Å²	50	103 Å²	103	41%	0.413	51%	0.508	S	S	.	.	H	α-helix	trans	-64.4	-35.6	175.3	0	0	0	0	0	112.5	L514 K522	L514-A518 VanDerWaalsContact O-CB 3.3Å; L514-A518 WeakPolarHBondContact O-CB 3.38Å; L514-A518 PolarHBondContact O-N 3.32Å; A518-K522 WeakPolarHBondContact O-CB 3.21Å; A518-K522 WeakPolarHBondContact O-CG 3.36Å; A518-K522 PolarHBondContact O-N 3.22Å
519	K	58.4	Low	65.5	Low	157 Å²	157	109.5 Å²	109.5	68%	0.683	54%	0.54	S	S	*	.	H	α-helix	trans	-65.9	-43.8	171.2	-81.5	174.8	-179.3	177.2	0	111.7	S515 E516 H517 E521 K522 L523	S515-K519 WeakPolarHBondContact O-CB 3.39Å; S515-K519 VanDerWaalsContact O-CG 3.28Å; S515-K519 WeakPolarHBondContact O-CG 3.3Å; S515-K519 PolarHBondContact O-N 3.41Å; S515-K519 VanDerWaalsContact O-N 3.1Å; E516-K519 PolarHBondContact O-N 3.42Å; H517-K519 VanDerWaalsContact C-N 3.33Å; H517-K519 PolarHBondContact O-N 3.22Å; K519-E521 VanDerWaalsContact C-N 3.35Å; K519-K522 PolarHBondContact O-N 2.78Å; K519-L523 WeakPolarHBondContact O-CB 3.16Å; K519-L523 PolarHBondContact O-N 3.05Å
520	R	65.5	Low	64.1	Low	171 Å²	171	108.6 Å²	108.6	65%	0.645	55%	0.546	S	S	*	.	H	α-helix	trans	-65	-36.8	176	-83.6	179.6	164.3	160.6	-2.8	112.4	E516 H517 L523 R524	E516-R520 WeakPolarHBondContact O-CB 3.36Å; E516-R520 PolarHBondContact O-N 3.29Å; H517-R520 CarbonylContact O-C 3.56Å; H517-R520 PolarHBondContact O-N 3.42Å; R520-L523 PolarHBondContact O-N 3.07Å; R520-R524 WeakPolarHBondContact O-CB 3.48Å; R520-R524 PolarHBondContact O-N 3.12Å
521	E	69.6	Low	63.4	Low	136 Å²	136	110.8 Å²	110.8	64%	0.636	56%	0.561	S	S	*	*	H	α-helix	trans	-72.6	-40.5	178.8	-163.1	165.5	-151.9	0	0	111.5	H517 K519 L523 R524 T525	H517-E521 WeakPolarHBondContact O-CB 3.44Å; H517-E521 PolarHBondContact O-N 3.28Å; K519-E521 VanDerWaalsContact C-N 3.35Å; E521-L523 VanDerWaalsContact C-N 3.31Å; E521-L523 PolarHBondContact O-N 3.33Å; E521-R524 PolarHBondContact O-N 2.88Å; E521-T525 PolarHBondContact O-N 3Å; E521-T525 PolarHBondContact O-OG1 3.15Å
522	K	66.9	Low	62.2	Low	166 Å²	166	113 Å²	113	72%	0.722	58%	0.581	S	S	*	*	H	α-helix	trans	-57.6	-43.9	167.8	-80	-177.7	178.2	-177.6	0	111.8	A518 K519 R524 T525 S526	A518-K522 WeakPolarHBondContact O-CB 3.21Å; A518-K522 WeakPolarHBondContact O-CG 3.36Å; A518-K522 PolarHBondContact O-N 3.22Å; K519-K522 PolarHBondContact O-N 2.78Å; K522-R524 VanDerWaalsContact C-N 3.34Å; K522-R524 PolarHBondContact O-N 2.86Å; K522-T525 PolarHBondContact O-N 3.19Å; K522-S526 PolarHBondContact O-N 2.93Å; K522-S526 PolarHBondContact O-OG 2.83Å
523	L	69	Low	61.3	Low	114 Å²	114	117.1 Å²	117.1	60%	0.597	61%	0.607	S	S	*	*	H	α-helix	trans	-63.8	-38.1	177	-169.5	67.1	0	0	0	112.3	K519 R520 E521 S526 L527	K519-L523 WeakPolarHBondContact O-CB 3.16Å; K519-L523 PolarHBondContact O-N 3.05Å; R520-L523 PolarHBondContact O-N 3.07Å; E521-L523 VanDerWaalsContact C-N 3.31Å; E521-L523 PolarHBondContact O-N 3.33Å; L523-S526 VanDerWaalsContact C-OG 3.23Å; L523-S526 VanDerWaalsContact CA-OG 3.25Å; L523-S526 WeakPolarHBondContact CA-OG 3.38Å; L523-S526 PolarHBondContact O-N 3.06Å; L523-S526 PolarHBondContact O-OG 2.67Å; L523-L527 PolarHBondContact O-N 2.85Å; L523-L527 VanDerWaalsContact O-N 3.11Å
524	R	68.8	Low	60.1	Low	172 Å²	172	117.6 Å²	117.6	65%	0.649	62%	0.624	S	S	*	*	H	α-helix	trans	-71.7	-35.6	178.7	-156.7	175	-172.8	177.5	1.6	112.2	R520 E521 K522 L527 R528	R520-R524 WeakPolarHBondContact O-CB 3.48Å; R520-R524 PolarHBondContact O-N 3.12Å; E521-R524 PolarHBondContact O-N 2.88Å; K522-R524 VanDerWaalsContact C-N 3.34Å; K522-R524 PolarHBondContact O-N 2.86Å; R524-L527 PolarHBondContact O-N 3.29Å; R524-R528 PolarHBondContact O-N 2.86Å; R524-R528 VanDerWaalsContact O-N 3.16Å
525	T	69.6	Low	58.8	Low	82 Å²	82	123 Å²	123	50%	0.503	64%	0.643	S	S	.	*	H	α-helix	trans	-67.4	-39.5	173.7	-55.2	0	0	0	0	111.2	E521 K522 L527 R528	E521-T525 PolarHBondContact O-N 3Å; E521-T525 PolarHBondContact O-OG1 3.15Å; K522-T525 PolarHBondContact O-N 3.19Å; T525-L527 VanDerWaalsContact C-N 3.31Å; T525-L527 PolarHBondContact O-N 2.94Å; T525-R528 PolarHBondContact O-N 2.89Å
526	S	70.5	Confident	57.4	Low	67 Å²	67	125.3 Å²	125.3	47%	0.469	66%	0.66	S	S	.	*	H	α-helix	trans	-64.6	-32.3	171.7	39.2	0	0	0	0	113.3	K522 L523	K522-S526 PolarHBondContact O-N 2.93Å; K522-S526 PolarHBondContact O-OG 2.83Å; L523-S526 VanDerWaalsContact C-OG 3.23Å; L523-S526 VanDerWaalsContact CA-OG 3.25Å; L523-S526 WeakPolarHBondContact CA-OG 3.38Å; L523-S526 PolarHBondContact O-N 3.06Å; L523-S526 PolarHBondContact O-OG 2.67Å
527	L	66.2	Low	56	Low	122 Å²	122	129.7 Å²	129.7	64%	0.639	68%	0.677	S	S	*	*	H	α-helix	trans	-72.8	-32.6	177.5	-122.2	79.2	0	0	0	113.3	L523 R524 T525 L529 A530	L523-L527 PolarHBondContact O-N 2.85Å; L523-L527 VanDerWaalsContact O-N 3.11Å; R524-L527 PolarHBondContact O-N 3.29Å; T525-L527 VanDerWaalsContact C-N 3.31Å; T525-L527 PolarHBondContact O-N 2.94Å; L527-L529 VanDerWaalsContact C-N 3.3Å; L527-L529 PolarHBondContact O-N 3.05Å; L527-A530 PolarHBondContact O-N 3.41Å
528	R	59.7	Low	54.3	Low	185 Å²	185	133.3 Å²	133.3	70%	0.698	69%	0.691	S	S	*	*	H	α-helix	trans	-70.5	-25	178.7	-75.7	-177.9	-179.2	173.7	0.6	113.5	R524 T525 A530	R524-R528 PolarHBondContact O-N 2.86Å; R524-R528 VanDerWaalsContact O-N 3.16Å; T525-R528 PolarHBondContact O-N 2.89Å; R528-A530 PolarHBondContact O-N 2.78Å
529	L	63.5	Low	52.7	Low	150 Å²	150	134.8 Å²	134.8	79%	0.785	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	-11.1	175.5	-77.9	155.3	0	0	0	113.1	L527	L527-L529 VanDerWaalsContact C-N 3.3Å; L527-L529 PolarHBondContact O-N 3.05Å
530	A	49.1	Very low	51.1	Low	77 Å²	77	133.4 Å²	133.4	64%	0.636	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	1.7	-174.8	0	0	0	0	0	114.8	L527 R528 P532	L527-A530 PolarHBondContact O-N 3.41Å; R528-A530 PolarHBondContact O-N 2.78Å; A530-P532 WeakPolarHBondContact O-CD 3.49Å
531	V	58.8	Low	49.2	Very low	117 Å²	117	133.2 Å²	133.2	71%	0.709	71%	0.71	S	S	*	*			trans	-105.1	111.3	179.7	-175.5	0	0	0	0	110.6
532	P	41.7	Very low	47	Very low	107 Å²	107	132 Å²	132	70%	0.695	72%	0.716	S	S	*	*			trans	-74.9	152.6	177.7	27.6	-31.5	0	0	0	112.5	A530 G534	A530-P532 WeakPolarHBondContact O-CD 3.49Å; P532-G534 PolarHBondContact O-N 2.92Å
533	P	42.4	Very low	45.1	Very low	133 Å²	133	128.7 Å²	128.7	86%	0.864	72%	0.72	S	S	*	*			trans	-76.5	110.2	-170.8	29.2	-32.9	0	0	0	112.2
534	G	38.7	Very low	43.1	Very low	74 Å²	74	131 Å²	131	76%	0.763	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-86.1	133.6	170.4	0	0	0	0	0	112	P532	P532-G534 PolarHBondContact O-N 2.92Å
535	K	33.5	Very low	40.9	Very low	214 Å²	214	127.7 Å²	127.7	93%	0.93	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-68.9	133.1	-165.6	-67.3	169.1	178.6	173	0	114.3
536	S	29.6	Very low	39.4	Very low	107 Å²	107	129 Å²	129	75%	0.748	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-72.3	158.8	164.7	-14.7	0	0	0	0	112.5
537	K	30.6	Very low	37.3	Very low	205 Å²	205	131.9 Å²	131.9	89%	0.891	76%	0.761	S	S	*	*			trans	125	124.1	167.7	-74.7	170.8	-176.1	-172.3	0	108.9
538	K	26.5	Very low	35.2	Very low	194 Å²	194	131.7 Å²	131.7	84%	0.843	77%	0.765	S	S	*	*			cis	-158	140.4	34.5	-98	169.2	177.3	-176	0	106.8
539	A	27	Very low	33.6	Very low	81 Å²	81	128.6 Å²	128.6	67%	0.669	77%	0.767	S	S	*	*				95.1	133	74.4	0	0	0	0	0	114.2
540	N	25.7	Very low	31.8	Very low	127 Å²	127	127.4 Å²	127.4	68%	0.679	76%	0.761	S	S	*	*			trans	81.9	114.4	157.4	-68	26	0	0	0	118.9
541	E	25	Very low	30.6	Very low	168 Å²	168	132.4 Å²	132.4	79%	0.785	77%	0.769	S	S	*	*				78.6	136	101	-71.9	172.3	140	0	0	110.5
542	S	24.9	Very low	29.1	Very low	109 Å²	109	133.3 Å²	133.3	76%	0.762	77%	0.774	S	S	*	*			cis	-176.9	154.1	12.4	35.3	0	0	0	0	106.7
543	A	25.3	Very low	28.4	Very low	98 Å²	98	133.6 Å²	133.6	81%	0.81	78%	0.776	S	S	*	*			trans	38.6	118.7	154.2	0	0	0	0	0	120.8
544	D	27.7	Very low	27.7	Very low	161 Å²	161	133.3 Å²	133.3	86%	0.861	77%	0.774	S	S	*	*				-174.3	156.7	98.2	-142.1	-18.7	0	0	0	111.3
545	S	24	Very low	27.1	Very low	104 Å²	104	138.4 Å²	138.4	73%	0.727	78%	0.783	S	S	*	*			trans	-87.5	-159.2	-180	-50	0	0	0	0	111
546	P	37.8	Very low	26.7	Very low	109 Å²	109	132.6 Å²	132.6	71%	0.708	78%	0.775	S	S	*	*			cis	-125.5	165.3	-48.5	31.1	-15.8	0	0	0	111.4
547	T	25.3	Very low	26.5	Very low	127 Å²	127	131.6 Å²	131.6	78%	0.779	77%	0.773	S	S	*	*				-179.9	120.8	127.3	11.9	0	0	0	0	113.6
548	T	22.6	Very low	26.2	Very low	119 Å²	119	129.7 Å²	129.7	73%	0.73	77%	0.773	S	S	*	*			trans	37.4	133.4	133	56.3	0	0	0	0	121.7
549	V	25.6	Very low	26.1	Very low	119 Å²	119	128.8 Å²	128.8	72%	0.721	77%	0.771	S	S	*	*				167	121.4	105	160.9	0	0	0	0	112.3
550	N	26.1	Very low	26	Very low	126 Å²	126	131.7 Å²	131.7	67%	0.674	78%	0.781	S	S	*	*			trans	70.5	120.9	143.3	-68.8	-17.8	0	0	0	126
551	K	23.1	Very low	26.1	Very low	182 Å²	182	130.4 Å²	130.4	79%	0.791	79%	0.788	S	S	*	*				65.1	120.9	122.4	-67.4	178.7	176.7	-179.8	0	119.5
552	V	28.5	Very low	26.1	Very low	135 Å²	135	131.8 Å²	131.8	82%	0.818	80%	0.795	S	S	*	*				-163.9	141.4	99.5	159.2	0	0	0	0	107.7
553	P	26	Very low	26.3	Very low	113 Å²	113	131.4 Å²	131.4	73%	0.734	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-92.1	151.5	-170.8	34.3	-30.3	0	0	0	113.7
554	P	27.7	Very low	26.5	Very low	127 Å²	127	135.1 Å²	135.1	83%	0.825	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-98	144.2	173.2	33.9	-27	0	0	0	113
555	L	27.7	Very low	26.4	Very low	181 Å²	181	138.6 Å²	138.6	95%	0.948	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-66.3	148.6	173.3	-87.6	100.2	0	0	0	112.6
556	A	24.4	Very low	26.3	Very low	92 Å²	92	141 Å²	141	76%	0.76	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-80.2	159.1	-176.2	0	0	0	0	0	115.3
557	A	25.2	Very low	25.7	Very low	87 Å²	87	142.6 Å²	142.6	72%	0.719	81%	0.806	S	S	*	*			trans	62.1	109.5	144.3	0	0	0	0	0	120.5
558	N	24.6	Very low	25.8	Very low	165 Å²	165	145.2 Å²	145.2	88%	0.882	81%	0.809	S	S	*	*				-160.7	140.9	98.4	-102.4	-8.4	0	0	0	112.2
559	E	24.8	Very low	26.2	Very low	174 Å²	174	145.1 Å²	145.1	81%	0.813	81%	0.811	S	S	*	*			trans	-77.7	139	178.4	-59.1	169.9	134.5	0	0	111
560	T	24.9	Very low	26	Very low	142 Å²	142	149.3 Å²	149.3	87%	0.871	82%	0.819	S	S	*	*				165.1	143.9	117.1	33.9	0	0	0	0	112
561	A	26.7	Very low	26.2	Very low	101 Å²	101	151.5 Å²	151.5	84%	0.835	83%	0.829	S	S	*	*			trans	73.6	81.5	160.1	0	0	0	0	0	118.6
562	Q	25.6	Very low	26.2	Very low	196 Å²	196	145.5 Å²	145.5	92%	0.916	82%	0.819	S	S	*	*			trans	-64.8	137.1	146	-64.1	169.7	-12.5	0	0	110.2
563	S	28.4	Very low	26.2	Very low	102 Å²	102	144.8 Å²	144.8	71%	0.713	82%	0.815	S	S	*	*				179.4	110.4	123.4	-169.5	0	0	0	0	112.5
564	Q	30.2	Very low	26.2	Very low	176 Å²	176	148.2 Å²	148.2	82%	0.822	82%	0.818	S	S	*	*			trans	49.2	112.6	130.5	-56.6	-176.2	-6.7	0	0	122.2
565	R	24.7	Very low	26.1	Very low	234 Å²	234	152.8 Å²	152.8	88%	0.883	82%	0.819	S	S	*	*				44.1	123.2	121.4	-76.2	-175.4	-173.6	174.2	3.4	120.5
566	N	22.6	Very low	25.9	Very low	155 Å²	155	149.8 Å²	149.8	83%	0.829	81%	0.808	S	S	*	*			trans	45.9	115.6	134.6	-86	-0.2	0	0	0	118.8
567	V	25.7	Very low	25.9	Very low	141 Å²	141	151 Å²	151	86%	0.855	81%	0.806	S	S	*	*				172.4	136.4	115.4	155.6	0	0	0	0	108.9
568	Q	27.1	Very low	25.6	Very low	182 Å²	182	153.5 Å²	153.5	85%	0.85	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-77.5	165.3	178.9	-92.2	-176.4	18.8	0	0	113.3
569	P	30.4	Very low	25.7	Very low	118 Å²	118	152.4 Å²	152.4	77%	0.766	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-92.7	141.2	-136.1	34	-34.3	0	0	0	114.8
570	K	22.1	Very low	25.5	Very low	207 Å²	207	149.5 Å²	149.5	90%	0.9	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-100.7	123.2	160	-83.6	-178.2	175.6	177.6	0	109.3
571	I	29.7	Very low	25.6	Very low	172 Å²	172	151.8 Å²	151.8	88%	0.882	80%	0.797	S	S	*	*			trans	-77.7	114.8	160.1	-67.6	168.1	0	0	0	106.6
572	G	23.1	Very low	25.3	Very low	55 Å²	55	152 Å²	152	57%	0.567	79%	0.792	S	S	*	*			trans	-86.5	160.8	167.4	0	0	0	0	0	110.9
573	T	27.8	Very low	25.4	Very low	121 Å²	121	150.2 Å²	150.2	74%	0.742	79%	0.789	S	S	*	*				-177.1	115.2	111.8	-65.1	0	0	0	0	110.8
574	K	26	Very low	25.8	Very low	185 Å²	185	149.9 Å²	149.9	80%	0.804	78%	0.784	S	S	*	*			trans	72.3	130	141.9	-71.8	173	-174.9	175.7	0	124.1
575	R	27.1	Very low	25.3	Very low	222 Å²	222	148.9 Å²	148.9	84%	0.838	79%	0.785	S	S	*	*			trans	98.7	93.6	131.6	-88.7	-176.5	162.9	165.8	-5.5	119.6
576	T	22.2	Very low	25.6	Very low	118 Å²	118	142.2 Å²	142.2	72%	0.724	78%	0.78	S	S	*	*				49.7	123.3	115.9	46.1	0	0	0	0	122.7
577	V	24.2	Very low	25.7	Very low	119 Å²	119	143.6 Å²	143.6	72%	0.721	78%	0.781	S	S	*	*				97.3	110.1	126.7	175.2	0	0	0	0	119.6
578	N	20.6	Very low	25.6	Very low	139 Å²	139	144.5 Å²	144.5	74%	0.743	78%	0.776	S	S	*	*			trans	62.6	144.1	136.3	-64	-2.5	0	0	0	125
579	N	25.2	Very low	25.8	Very low	141 Å²	141	142.8 Å²	142.8	75%	0.754	78%	0.778	S	S	*	*			trans	93.5	103.1	148.7	-79.9	6.8	0	0	0	120.7
580	T	21.3	Very low	25.4	Very low	113 Å²	113	146 Å²	146	69%	0.693	78%	0.779	S	S	*	*				23.5	119.2	121.1	52	0	0	0	0	119
581	Q	27.7	Very low	25.7	Very low	191 Å²	191	144.5 Å²	144.5	89%	0.893	78%	0.778	S	S	*	*				175.8	146.8	111.8	-96.3	170.7	-3.5	0	0	112.1
582	S	20.9	Very low	25.5	Very low	105 Å²	105	140.1 Å²	140.1	73%	0.734	76%	0.762	S	S	*	*			trans	-65.7	145.4	174.1	45.6	0	0	0	0	115.4
583	N	26.7	Very low	25.6	Very low	158 Å²	158	143.3 Å²	143.3	85%	0.845	77%	0.771	S	S	*	*				171.7	164.8	110.8	-123.8	8.9	0	0	0	112.9
584	P	36.1	Very low	26	Very low	96 Å²	96	145.3 Å²	145.3	62%	0.623	78%	0.777	S	S	*	*			trans	-107.4	-179.7	-167.9	42.2	-35.3	0	0	0	115.7
585	N	20.9	Very low	26	Very low	155 Å²	155	145 Å²	145	83%	0.829	78%	0.779	S	S	*	*			trans	91.5	120.1	162.6	-69.9	-6	0	0	0	120.2
586	A	30.8	Very low	26.3	Very low	94 Å²	94	141.8 Å²	141.8	78%	0.777	78%	0.778	S	S	*	*			trans	165.4	95.9	141.2	0	0	0	0	0	106.3
587	E	25.2	Very low	26.4	Very low	183 Å²	183	146.1 Å²	146.1	86%	0.855	78%	0.781	S	S	*	*				75.5	141.2	70.5	-152	160.9	169.5	0	0	114.6
588	Q	22	Very low	26.9	Very low	161 Å²	161	144.7 Å²	144.7	75%	0.752	78%	0.782	S	S	*	*			trans	-62.5	152.5	-161.6	-66.4	162.9	-49.2	0	0	115.3
589	V	31.9	Very low	27.4	Very low	146 Å²	146	145.6 Å²	145.6	89%	0.885	78%	0.782	S	S	*	*			trans	-132.9	111.2	146.6	179.5	0	0	0	0	109.6
590	K	21.4	Very low	28.1	Very low	184 Å²	184	142.8 Å²	142.8	80%	0.8	79%	0.786	S	S	*	*			trans	-85.4	149.9	155.8	-94	175.9	172.7	175.5	0	108.4
591	M	29.4	Very low	28.4	Very low	176 Å²	176	147.2 Å²	147.2	87%	0.867	80%	0.796	S	S	*	*			trans	173.7	152.1	146.7	-100.2	176.8	72.1	0	0	106.9
592	S	25.8	Very low	29	Very low	80 Å²	80	143.4 Å²	143.4	56%	0.559	79%	0.79	S	S	*	*			cis	172.1	142	-26.2	45.1	0	0	0	0	104.7
593	T	24.8	Very low	29.4	Very low	122 Å²	122	147.4 Å²	147.4	75%	0.748	79%	0.794	S	S	*	*			trans	35.6	128.3	149	46.1	0	0	0	0	121.4
594	D	35.6	Very low	30.6	Very low	163 Å²	163	151.3 Å²	151.3	87%	0.872	82%	0.815	S	S	*	*			trans	-148	128.9	131.4	-95.8	-35	0	0	0	112.2
595	Q	26.6	Very low	30.3	Very low	180 Å²	180	154.1 Å²	154.1	84%	0.841	83%	0.825	S	S	*	*			trans	-102.7	137.6	165.8	-75.8	174.7	-29.5	0	0	107.9
596	N	33.1	Very low	30.8	Very low	153 Å²	153	154.1 Å²	154.1	82%	0.818	83%	0.825	S	S	*	*			trans	-167.5	114	154.9	-86.4	-41	0	0	0	106.6
597	R	24.1	Very low	30.8	Very low	209 Å²	209	157.4 Å²	157.4	79%	0.789	83%	0.827	S	S	*	*				71.9	114.2	66.7	-168.9	175.9	-173.7	159.8	4.4	114.6	E599	R597-E599 IonicContact CZ-OE2 3.32Å; R597-E599 IonicContact NE-OE2 2.81Å; R597-E599 IonicContact NH2-OE2 3.83Å; R597-E599 PolarHBondContact NH2-OE2 3.01Å
598	A	36	Very low	31.1	Very low	90 Å²	90	155.9 Å²	155.9	74%	0.744	83%	0.826	S	S	*	*			trans	164.3	100	140.1	0	0	0	0	0	107.7
599	E	30.1	Very low	31.7	Very low	158 Å²	158	155.6 Å²	155.6	74%	0.738	83%	0.83	S	S	*	*				47.5	113.3	83.1	-71.3	-170.3	123.5	0	0	115.4	R597	R597-E599 IonicContact CZ-OE2 3.32Å; R597-E599 IonicContact NE-OE2 2.81Å; R597-E599 IonicContact NH2-OE2 3.83Å; R597-E599 PolarHBondContact NH2-OE2 3.01Å
600	G	39.2	Very low	31.7	Very low	82 Å²	82	156.2 Å²	156.2	85%	0.845	83%	0.826	S	S	*	*			trans	-162.8	89.3	168.5	0	0	0	0	0	110.9
601	K	29	Very low	32.4	Very low	206 Å²	206	154.2 Å²	154.2	90%	0.896	83%	0.828	S	S	*	*			trans	-77.9	149.9	168.7	-76	170	172.8	167.7	0	110.6
602	S	38.5	Very low	32.6	Very low	110 Å²	110	152.5 Å²	152.5	77%	0.769	83%	0.825	S	S	*	*			trans	167	105.9	133.9	-169.2	0	0	0	0	107.9
603	K	30.3	Very low	33.2	Very low	190 Å²	190	158.6 Å²	158.6	83%	0.826	85%	0.847	S	S	*	*				33.4	104	94.2	-77.8	-168.4	176.5	-174.3	0	114.7
604	N	51.2	Low	34	Very low	240 Å²	240	161.9 Å²	161.9	100%	1.283	86%	0.857	S	S	*	*				-150.5	0	110.7	-101.3	-9.6	0	0	0	109.1

Retrieved 604 of 604 residues in 526.4 ms (Link to these results)

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