A0A061ID39_CRIGR Loading...

Zinc finger and BTB domain containing 3

AlphaFold DB , UniProt , Accession A0A061ID39, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Zbtb3, Length 517 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	74.1	Confident	88.1	Confident	213 Å²	213	119 Å²	119	100%	1.049	59%	0.594	S	S	*	*				0	137.7	0	-64.9	-164.7	-56.7	0	0	106.9	F3	M1-F3 HydrophobicContact CE-CZ 4.12Å
2	E	85.8	Confident	88.5	Confident	186 Å²	186	118.8 Å²	118.8	87%	0.869	59%	0.589	S	S	*	*			trans	-104.1	149.1	-179.9	-68.4	167.8	-157.4	0	0	110.4
3	F	88.8	Confident	88.8	Confident	141 Å²	141	113.8 Å²	113.8	62%	0.618	57%	0.573	S	S	*	*			trans	-125.9	86.8	179.3	-65	-80.7	0	0	0	108.9	M1 E5 H6	M1-F3 HydrophobicContact CE-CZ 4.12Å; F3-E5 VanDerWaalsContact C-N 3.29Å; F3-E5 PolarHBondContact O-N 3.22Å; F3-H6 HydrophobicContact CB-CB 3.82Å; F3-H6 VanDerWaalsContact O-CB 3.24Å; F3-H6 WeakPolarHBondContact O-CB 3.49Å; F3-H6 PolarHBondContact O-N 3.08Å
4	P	86.4	Confident	89.1	Confident	103 Å²	103	107.9 Å²	107.9	67%	0.669	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-31	-164.7	17.2	-27	0	0	0	114.4
5	E	92.1	Very high	89.3	Confident	107 Å²	107	107.5 Å²	107.5	50%	0.5	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-9.3	178.4	-57	74.2	-161.6	0	0	113.9	F3 S7 Q8 Q9	F3-E5 VanDerWaalsContact C-N 3.29Å; F3-E5 PolarHBondContact O-N 3.22Å; E5-S7 PolarHBondContact O-N 2.99Å; E5-Q8 WeakPolarHBondContact O-CB 3.39Å; E5-Q8 PolarHBondContact O-N 3.35Å; E5-Q8 VanDerWaalsContact O-N 3.12Å; E5-Q9 WeakPolarHBondContact O-CG 3.47Å; E5-Q9 PolarHBondContact O-N 2.85Å
6	H	91.3	Very high	89.5	Confident	109 Å²	109	107.6 Å²	107.6	51%	0.505	53%	0.532	S	S	.	.	H	α-helix	trans	-62.8	-40.1	-168.1	-176.2	61.5	0	0	0	113.1	F3 Q8 Q9 L10	F3-H6 HydrophobicContact CB-CB 3.82Å; F3-H6 VanDerWaalsContact O-CB 3.24Å; F3-H6 WeakPolarHBondContact O-CB 3.49Å; F3-H6 PolarHBondContact O-N 3.08Å; H6-Q8 VanDerWaalsContact C-N 3.33Å; H6-Q8 PolarHBondContact O-N 3.16Å; H6-Q9 PolarHBondContact O-N 2.86Å; H6-L10 WeakPolarHBondContact O-CB 3.43Å; H6-L10 PolarHBondContact O-N 3.39Å
7	S	87.6	Confident	89.7	Confident	59 Å²	59	104.2 Å²	104.2	41%	0.413	51%	0.514	S	S	.	.	H	α-helix	trans	-64.9	-35.9	176.8	57.8	0	0	0	0	112.6	E5 L11	E5-S7 PolarHBondContact O-N 2.99Å; S7-L11 WeakPolarHBondContact O-CG 3.09Å; S7-L11 PolarHBondContact O-N 2.98Å
8	Q	88.9	Confident	89.9	Confident	133 Å²	133	100.8 Å²	100.8	62%	0.621	50%	0.495	S	S	*	.	H	α-helix	trans	-69.6	-42.8	175.7	-174.6	178.3	-0.9	0	0	111.4	E5 H6 L10 L11 Q12	E5-Q8 WeakPolarHBondContact O-CB 3.39Å; E5-Q8 PolarHBondContact O-N 3.35Å; E5-Q8 VanDerWaalsContact O-N 3.12Å; H6-Q8 VanDerWaalsContact C-N 3.33Å; H6-Q8 PolarHBondContact O-N 3.16Å; Q8-L10 VanDerWaalsContact C-N 3.35Å; Q8-L11 PolarHBondContact O-N 2.8Å; Q8-Q12 WeakPolarHBondContact O-CB 3.29Å; Q8-Q12 PolarHBondContact O-N 2.81Å
9	Q	91.9	Very high	90	Very high	117 Å²	117	100.3 Å²	100.3	55%	0.547	50%	0.502	S	S	.	.	H	α-helix	trans	-62.7	-41.4	175.3	-67.5	171.9	7.3	0	0	111.6	E5 H6 Q12 S13	E5-Q9 WeakPolarHBondContact O-CG 3.47Å; E5-Q9 PolarHBondContact O-N 2.85Å; H6-Q9 PolarHBondContact O-N 2.86Å; Q9-Q12 PolarHBondContact O-N 3.04Å; Q9-S13 PolarHBondContact O-N 3.32Å
10	L	91.2	Very high	90	Very high	81 Å²	81	101.9 Å²	101.9	42%	0.424	51%	0.508	S	S	.	.	H	α-helix	trans	-62	-48.2	175.4	180	60.5	0	0	0	111.8	H6 Q8 Q12 S13 L14	H6-L10 WeakPolarHBondContact O-CB 3.43Å; H6-L10 PolarHBondContact O-N 3.39Å; Q8-L10 VanDerWaalsContact C-N 3.35Å; L10-Q12 VanDerWaalsContact C-N 3.31Å; L10-Q12 PolarHBondContact O-N 2.9Å; L10-S13 PolarHBondContact O-N 3.4Å; L10-L14 HydrophobicContact CD1-CD1 4.14Å; L10-L14 HydrophobicContact CD1-CG 4.31Å; L10-L14 HydrophobicContact CG-CD1 3.96Å; L10-L14 WeakPolarHBondContact O-CB 3.4Å; L10-L14 VanDerWaalsContact O-CG 3.31Å; L10-L14 WeakPolarHBondContact O-CG 3.24Å; L10-L14 PolarHBondContact O-N 3Å
11	L	90.8	Very high	89.7	Confident	60 Å²	60	98.5 Å²	98.5	31%	0.314	50%	0.499	S	S	.	.	H	α-helix	trans	-63.6	-34.6	176.4	-77	171.6	0	0	0	113	S7 Q8 R15	S7-L11 WeakPolarHBondContact O-CG 3.09Å; S7-L11 PolarHBondContact O-N 2.98Å; Q8-L11 PolarHBondContact O-N 2.8Å; L11-R15 WeakPolarHBondContact O-CB 3.3Å; L11-R15 PolarHBondContact O-N 2.96Å
12	Q	92.8	Very high	90.3	Very high	116 Å²	116	93.9 Å²	93.9	54%	0.542	47%	0.473	S	S	.	.	H	α-helix	trans	-64.4	-48.3	173.6	-178.6	171.4	-13.9	0	0	111.3	Q8 Q9 L10 R15 E16	Q8-Q12 WeakPolarHBondContact O-CB 3.29Å; Q8-Q12 PolarHBondContact O-N 2.81Å; Q9-Q12 PolarHBondContact O-N 3.04Å; L10-Q12 VanDerWaalsContact C-N 3.31Å; L10-Q12 PolarHBondContact O-N 2.9Å; Q12-R15 PolarHBondContact O-N 3.05Å; Q12-E16 PolarHBondContact O-N 3.15Å; Q12-E16 VanDerWaalsContact O-N 3.09Å
13	S	92.4	Very high	90.3	Very high	54 Å²	54	90.6 Å²	90.6	38%	0.378	46%	0.461	S	S	.	.	H	α-helix	trans	-59.2	-47.2	176	-176.7	0	0	0	0	112.1	Q9 L10 R15 E16 Q17	Q9-S13 PolarHBondContact O-N 3.32Å; L10-S13 PolarHBondContact O-N 3.4Å; S13-R15 VanDerWaalsContact C-N 3.28Å; S13-R15 PolarHBondContact O-N 2.94Å; S13-E16 PolarHBondContact O-N 3.07Å; S13-E16 VanDerWaalsContact O-N 3.16Å; S13-Q17 WeakPolarHBondContact O-CG 3.4Å; S13-Q17 PolarHBondContact O-N 3.19Å
14	L	93.2	Very high	90.4	Very high	32 Å²	32	85.1 Å²	85.1	17%	0.168	44%	0.44	C	S	.	.	H	α-helix	trans	-60.8	-33.9	176.8	-73.5	168	0	0	0	112.8	L10 R18 V41 Y84	L10-L14 HydrophobicContact CD1-CD1 4.14Å; L10-L14 HydrophobicContact CD1-CG 4.31Å; L10-L14 HydrophobicContact CG-CD1 3.96Å; L10-L14 WeakPolarHBondContact O-CB 3.4Å; L10-L14 VanDerWaalsContact O-CG 3.31Å; L10-L14 WeakPolarHBondContact O-CG 3.24Å; L10-L14 PolarHBondContact O-N 3Å; L14-R18 VanDerWaalsContact O-CB 3.3Å; L14-R18 WeakPolarHBondContact O-CB 3.42Å; L14-R18 PolarHBondContact O-N 2.98Å; L14-V41 HydrophobicContact CD1-CG2 4.06Å; L14-Y84 HydrophobicContact CB-CD1 4.09Å; L14-Y84 HydrophobicContact CB-CE1 4Å; L14-Y84 WeakPolarHBondContact O-CE1 3.42Å
15	R	92.9	Very high	90.4	Very high	101 Å²	101	83.5 Å²	83.5	38%	0.381	43%	0.426	S	S	.	.	H	α-helix	trans	-70.7	-39	176.2	-165.6	-170.8	-47.4	149.7	18.2	112	L11 Q12 S13 R18 S19 Y84	L11-R15 WeakPolarHBondContact O-CB 3.3Å; L11-R15 PolarHBondContact O-N 2.96Å; Q12-R15 PolarHBondContact O-N 3.05Å; S13-R15 VanDerWaalsContact C-N 3.28Å; S13-R15 PolarHBondContact O-N 2.94Å; R15-R18 PolarHBondContact O-N 3.15Å; R15-S19 PolarHBondContact O-N 3.22Å; R15-Y84 HydrophobicContact CB-CD1 4.32Å; R15-Y84 VanDerWaalsContact CZ-O 3.27Å; R15-Y84 PolarHBondContact NE-O 3.17Å; R15-Y84 PolarHBondContact NH2-O 3.16Å
16	E	92.3	Very high	90.3	Very high	110 Å²	110	78.5 Å²	78.5	51%	0.514	40%	0.403	S	S	.	.	H	α-helix	trans	-69.6	-42.3	177.1	-178.8	163.9	-166	0	0	111.6	Q12 S13 R18 S19 Q20	Q12-E16 PolarHBondContact O-N 3.15Å; Q12-E16 VanDerWaalsContact O-N 3.09Å; S13-E16 PolarHBondContact O-N 3.07Å; S13-E16 VanDerWaalsContact O-N 3.16Å; E16-R18 VanDerWaalsContact C-N 3.33Å; E16-R18 PolarHBondContact O-N 2.98Å; E16-S19 PolarHBondContact O-N 3.02Å; E16-S19 PolarHBondContact O-OG 3.22Å; E16-Q20 WeakPolarHBondContact O-CG 3.46Å; E16-Q20 PolarHBondContact O-N 3.37Å
17	Q	92.7	Very high	90.3	Very high	50 Å²	50	74.8 Å²	74.8	23%	0.234	39%	0.388	C	S	.	.	H	α-helix	trans	-56.8	-47.3	169.8	-69.1	174.4	-6.4	0	0	110.9	S13 S19 Q20 G21 F22	S13-Q17 WeakPolarHBondContact O-CG 3.4Å; S13-Q17 PolarHBondContact O-N 3.19Å; Q17-S19 PolarHBondContact O-N 3.37Å; Q17-Q20 CarbonylContact O-C 3.52Å; Q17-Q20 PolarHBondContact O-N 2.66Å; Q17-G21 PolarHBondContact O-N 3.03Å; Q17-F22 HydrophobicContact CB-CB 4.36Å; Q17-F22 HydrophobicContact CG-CD1 4.15Å; Q17-F22 PolarHBondContact O-N 3.38Å
18	R	93.7	Very high	90.5	Very high	42 Å²	42	72 Å²	72	16%	0.158	37%	0.368	C	S	.	.	H	α-helix	trans	-59.6	-41.2	176.1	-168.3	-159.3	71.2	167.9	9.2	112.7	L14 R15 E16 Q20 G21 L36 L80 D81 Y84	L14-R18 VanDerWaalsContact O-CB 3.3Å; L14-R18 WeakPolarHBondContact O-CB 3.42Å; L14-R18 PolarHBondContact O-N 2.98Å; R15-R18 PolarHBondContact O-N 3.15Å; E16-R18 VanDerWaalsContact C-N 3.33Å; E16-R18 PolarHBondContact O-N 2.98Å; R18-Q20 VanDerWaalsContact C-N 3.29Å; R18-Q20 PolarHBondContact O-N 3.46Å; R18-G21 PolarHBondContact O-N 3.47Å; R18-G21 VanDerWaalsContact O-N 3.16Å; R18-L36 VanDerWaalsContact CG-O 3.3Å; R18-L36 WeakPolarHBondContact CG-O 3.48Å; R18-L80 PolarHBondContact NH1-O 2.79Å; R18-D81 IonicContact CZ-OD1 3.51Å; R18-D81 VanDerWaalsContact CZ-OD1 3.23Å; R18-D81 IonicContact NH1-OD1 3.85Å; R18-D81 PolarHBondContact NH1-OD1 2.99Å; R18-D81 IonicContact NH2-OD1 3.94Å; R18-D81 PolarHBondContact NH2-OD1 3.34Å; R18-Y84 HydrophobicContact CB-CD1 4.33Å; R18-Y84 HydrophobicContact CB-CE1 4.02Å; R18-Y84 HydrophobicContact CG-CE1 4.32Å
19	S	90.9	Very high	90.6	Very high	92 Å²	92	67.1 Å²	67.1	64%	0.643	35%	0.346	S	S	*	.	H	α-helix	trans	-71.8	-23.4	178.8	64.8	0	0	0	0	113.5	R15 E16 Q17	R15-S19 PolarHBondContact O-N 3.22Å; E16-S19 PolarHBondContact O-N 3.02Å; E16-S19 PolarHBondContact O-OG 3.22Å; Q17-S19 PolarHBondContact O-N 3.37Å
20	Q	90.1	Very high	90.6	Very high	131 Å²	131	61.7 Å²	61.7	61%	0.612	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-5.1	171.8	-62.9	175.1	22.7	0	0	112.8	E16 Q17 R18 F22	E16-Q20 WeakPolarHBondContact O-CG 3.46Å; E16-Q20 PolarHBondContact O-N 3.37Å; Q17-Q20 CarbonylContact O-C 3.52Å; Q17-Q20 PolarHBondContact O-N 2.66Å; R18-Q20 VanDerWaalsContact C-N 3.29Å; R18-Q20 PolarHBondContact O-N 3.46Å; Q20-F22 HydrophobicContact CB-CB 4.4Å; Q20-F22 PolarHBondContact O-N 3.49Å
21	G	84.8	Confident	90.3	Very high	31 Å²	31	60.7 Å²	60.7	32%	0.32	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.9	9.7	-172	0	0	0	0	0	114.3	Q17 R18	Q17-G21 PolarHBondContact O-N 3.03Å; R18-G21 PolarHBondContact O-N 3.47Å; R18-G21 VanDerWaalsContact O-N 3.16Å
22	F	85.9	Confident	90	Very high	117 Å²	117	63.3 Å²	63.3	51%	0.513	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	138.6	-177	-166.5	-109.2	0	0	0	110.6	Q17 Q20 C24 H38	Q17-F22 HydrophobicContact CB-CB 4.36Å; Q17-F22 HydrophobicContact CG-CD1 4.15Å; Q17-F22 PolarHBondContact O-N 3.38Å; Q20-F22 HydrophobicContact CB-CB 4.4Å; Q20-F22 PolarHBondContact O-N 3.49Å; F22-C24 PolarHBondContact O-N 3.11Å; F22-C24 PolarHBondContact O-SG 3.1Å; F22-C24 VanDerWaalsContact O-SG 3.42Å; F22-H38 PolarHBondContact O-NE2 3.32Å
23	L	85.6	Confident	89.9	Confident	117 Å²	117	59.1 Å²	59.1	61%	0.613	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	16.1	-179.8	-62.7	172.8	0	0	0	116.7	D25 H38	L23-D25 PolarHBondContact O-N 3.49Å; L23-H38 PolarHBondContact O-CD2 3.3Å; L23-H38 VanDerWaalsContact O-CD2 3.25Å
24	C	90.3	Very high	89.9	Confident	26 Å²	26	63.3 Å²	63.3	18%	0.176	35%	0.352	C	S	.	.			trans	-73.7	94.9	178.1	-68.7	0	0	0	0	111.4	F22 C26 L36 A37 H38	F22-C24 PolarHBondContact O-N 3.11Å; F22-C24 PolarHBondContact O-SG 3.1Å; F22-C24 VanDerWaalsContact O-SG 3.42Å; C24-C26 PolarHBondContact O-N 3.48Å; C24-L36 HydrophobicContact CB-CB 3.98Å; C24-A37 CarbonylContact C-O 3.6Å; C24-A37 WeakPolarHBondContact CA-O 3.17Å; C24-H38 VanDerWaalsContact SG-CE1 3.59Å
25	D	88.1	Confident	90	Very high	68 Å²	68	63.7 Å²	63.7	36%	0.364	35%	0.353	S	S	.	.			trans	-81.8	16.6	177.5	70	-28	0	0	0	113.8	L23 A37 H38 R39 D62	L23-D25 PolarHBondContact O-N 3.49Å; D25-A37 PolarHBondContact N-O 2.88Å; D25-H38 WeakPolarHBondContact OD1-CA 3.48Å; D25-R39 VanDerWaalsContact O-CD 3.23Å; D25-R39 WeakPolarHBondContact O-CD 3.47Å; D25-R39 WeakPolarHBondContact O-CG 3.42Å; D25-R39 PolarHBondContact OD1-N 2.97Å; D25-R39 WeakPolarHBondContact OD2-CB 3.3Å; D25-R39 VanDerWaalsContact OD2-CD 3.22Å; D25-R39 WeakPolarHBondContact OD2-CD 3.26Å; D25-R39 VanDerWaalsContact OD2-CG 3.31Å; D25-R39 WeakPolarHBondContact OD2-CG 3.39Å; D25-D62 WeakPolarHBondContact O-CB 3.31Å
26	C	89.3	Confident	90	Very high	3 Å²	3	62.8 Å²	62.8	2%	0.02	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	130.2	173.6	179.4	0	0	0	0	112.9	C24 A37 R39 L42 Y53	C24-C26 PolarHBondContact O-N 3.48Å; C26-A37 PolarHBondContact N-O 2.89Å; C26-A37 PolarHBondContact O-N 2.93Å; C26-A37 VanDerWaalsContact O-O 3.09Å; C26-R39 HydrophobicContact CB-CG 3.66Å; C26-L42 HydrophobicContact CB-CD1 4.26Å; C26-Y53 PolarHBondContact SG-OH 3.15Å
27	T	90.8	Very high	90.1	Very high	31 Å²	31	57.5 Å²	57.5	19%	0.19	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	119.4	160.6	-57.6	0	0	0	0	109.5	Q34 F35 D62 L63 V64	T27-Q34 HydrophobicContact CG2-CB 4.23Å; T27-F35 CarbonylContact C-O 3.59Å; T27-F35 WeakPolarHBondContact CA-O 3.44Å; T27-D62 PolarHBondContact N-O 3.24Å; T27-L63 HydrophobicContact CG2-CD1 3.93Å; T27-L63 CarbonylContact O-C 3.54Å; T27-L63 WeakPolarHBondContact O-CA 3.28Å; T27-V64 PolarHBondContact O-N 3.16Å
28	V	91.9	Very high	90.1	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	125.5	169.5	-169.9	0	0	0	0	109.2	V30 Q34 F35 L42 F49 V64 I66 F76	V28-V30 HydrophobicContact CG1-CG2 4.15Å; V28-Q34 WeakPolarHBondContact O-CA 3.45Å; V28-F35 HydrophobicContact CB-CB 4.42Å; V28-F35 PolarHBondContact N-O 3.42Å; V28-F35 PolarHBondContact O-N 3.33Å; V28-L42 HydrophobicContact CG2-CD1 3.73Å; V28-F49 HydrophobicContact CG1-CZ 4.29Å; V28-F49 HydrophobicContact CG2-CE1 4.02Å; V28-F49 HydrophobicContact CG2-CZ 4.12Å; V28-V64 CarbonylContact C-O 3.42Å; V28-V64 WeakPolarHBondContact CA-O 3.35Å; V28-V64 HydrophobicContact CG1-CB 4.43Å; V28-V64 HydrophobicContact CG2-CB 4.38Å; V28-I66 HydrophobicContact CG1-CD1 3.91Å; V28-I66 HydrophobicContact CG1-CG1 4.16Å; V28-F76 HydrophobicContact CB-CE1 4.01Å; V28-F76 HydrophobicContact CB-CZ 3.92Å; V28-F76 HydrophobicContact CG1-CE1 3.97Å; V28-F76 HydrophobicContact CG1-CE2 4.15Å; V28-F76 HydrophobicContact CG1-CZ 3.63Å; V28-F76 HydrophobicContact CG2-CE1 4.47Å; V28-F76 HydrophobicContact CG2-CZ 4.04Å
29	M	91.4	Very high	90	Very high	30 Å²	30	56.9 Å²	56.9	15%	0.148	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	127.1	171.9	-69.2	-166.2	73	0	0	110.7	A33 Q34 L63 V64 I66	M29-A33 WeakPolarHBondContact CA-O 3.42Å; M29-Q34 HydrophobicContact CE-CG 4.49Å; M29-Q34 HydrophobicContact CG-CG 4.34Å; M29-L63 HydrophobicContact CG-CD1 3.82Å; M29-L63 HydrophobicContact SD-CD1 4.05Å; M29-L63 HydrophobicContact SD-CD2 4.48Å; M29-V64 PolarHBondContact N-O 3.04Å; M29-I66 PolarHBondContact O-N 3.31Å
30	V	91.9	Very high	90	Very high	3 Å²	3	56.1 Å²	56.1	2%	0.018	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	104	175.5	-172.1	0	0	0	0	108.4	V28 S32 A33 F35 I66 V71 A73 F76	V28-V30 HydrophobicContact CG1-CG2 4.15Å; V30-S32 PolarHBondContact O-N 3.07Å; V30-S32 VanDerWaalsContact O-N 3.14Å; V30-A33 PolarHBondContact N-O 3.18Å; V30-A33 PolarHBondContact O-N 3.45Å; V30-F35 HydrophobicContact CB-CE2 4.1Å; V30-F35 HydrophobicContact CG2-CD2 4.15Å; V30-F35 HydrophobicContact CG2-CE2 4.03Å; V30-I66 HydrophobicContact CG2-CB 4.33Å; V30-I66 HydrophobicContact CG2-CD1 4.18Å; V30-V71 HydrophobicContact CG1-CB 4.5Å; V30-V71 HydrophobicContact CG1-CG1 4.01Å; V30-V71 WeakPolarHBondContact CG1-O 3.4Å; V30-A73 HydrophobicContact CB-CB 4.45Å; V30-A73 HydrophobicContact CG1-CB 4.35Å; V30-F76 HydrophobicContact CG1-CB 4.34Å; V30-F76 HydrophobicContact CG2-CB 3.96Å; V30-F76 HydrophobicContact CG2-CD1 3.73Å; V30-F76 HydrophobicContact CG2-CD2 4.13Å; V30-F76 HydrophobicContact CG2-CE1 4.31Å; V30-F76 HydrophobicContact CG2-CG 3.64Å
31	G	85.6	Confident	90.2	Very high	61 Å²	61	50.4 Å²	50.4	63%	0.629	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.2	-113.3	-168	0	0	0	0	0	111.4
32	S	83.4	Confident	90.6	Very high	115 Å²	115	48.9 Å²	48.9	80%	0.804	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-16.6	172.8	50.9	0	0	0	0	114.1	V30	V30-S32 PolarHBondContact O-N 3.07Å; V30-S32 VanDerWaalsContact O-N 3.14Å
33	A	91.3	Very high	90.9	Very high	28 Å²	28	44.5 Å²	44.5	23%	0.231	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	150.6	-177.3	0	0	0	0	0	111.7	M29 V30 F35 A73	M29-A33 WeakPolarHBondContact CA-O 3.42Å; V30-A33 PolarHBondContact N-O 3.18Å; V30-A33 PolarHBondContact O-N 3.45Å; A33-F35 HydrophobicContact CB-CD2 4.5Å; A33-F35 HydrophobicContact CB-CE2 3.66Å; A33-F35 HydrophobicContact CB-CZ 4.1Å; A33-A73 HydrophobicContact CB-CB 3.59Å
34	Q	92.1	Very high	91.3	Very high	142 Å²	142	42.3 Å²	42.3	66%	0.664	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.3	134.1	179.9	-64.3	177.5	64.8	0	0	109	T27 V28 M29	T27-Q34 HydrophobicContact CG2-CB 4.23Å; V28-Q34 WeakPolarHBondContact O-CA 3.45Å; M29-Q34 HydrophobicContact CE-CG 4.49Å; M29-Q34 HydrophobicContact CG-CG 4.34Å
35	F	94.5	Very high	91.5	Very high	40 Å²	40	42.5 Å²	42.5	18%	0.175	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	121.3	-178.5	-62	-92	0	0	0	109.7	T27 V28 V30 A33 A73 F76 L80	T27-F35 CarbonylContact C-O 3.59Å; T27-F35 WeakPolarHBondContact CA-O 3.44Å; V28-F35 HydrophobicContact CB-CB 4.42Å; V28-F35 PolarHBondContact N-O 3.42Å; V28-F35 PolarHBondContact O-N 3.33Å; V30-F35 HydrophobicContact CB-CE2 4.1Å; V30-F35 HydrophobicContact CG2-CD2 4.15Å; V30-F35 HydrophobicContact CG2-CE2 4.03Å; A33-F35 HydrophobicContact CB-CD2 4.5Å; A33-F35 HydrophobicContact CB-CE2 3.66Å; A33-F35 HydrophobicContact CB-CZ 4.1Å; F35-A73 HydrophobicContact CE2-CB 4.32Å; F35-A73 HydrophobicContact CZ-CB 4.23Å; F35-A73 WeakPolarHBondContact CZ-O 3.4Å; F35-F76 HydrophobicContact CB-CD1 4.43Å; F35-F76 HydrophobicContact CB-CE1 3.91Å; F35-F76 HydrophobicContact CD1-CD1 4.13Å; F35-F76 HydrophobicContact CD1-CE1 4.34Å; F35-F76 AromaticContact CD2-CD1 3.55Å; F35-F76 HydrophobicContact CD2-CD1 3.55Å; F35-F76 AromaticContact CD2-CE1 3.82Å; F35-F76 HydrophobicContact CD2-CE1 3.82Å; F35-F76 HydrophobicContact CE1-CD1 4.27Å; F35-F76 AromaticContact CE2-CD1 3.72Å; F35-F76 HydrophobicContact CE2-CD1 3.72Å; F35-F76 HydrophobicContact CE2-CE1 4.44Å; F35-F76 AromaticContact CG-CD1 3.78Å; F35-F76 HydrophobicContact CG-CD1 3.78Å; F35-F76 AromaticContact CG-CE1 3.77Å; F35-F76 HydrophobicContact CG-CE1 3.77Å; F35-F76 HydrophobicContact CZ-CD1 4.08Å; F35-L80 HydrophobicContact CB-CD2 3.78Å; F35-L80 HydrophobicContact CD1-CD2 3.96Å; F35-L80 HydrophobicContact CG-CD2 4.22Å
36	L	94.1	Very high	91.8	Very high	81 Å²	81	39.3 Å²	39.3	42%	0.424	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	135	172.4	-62.9	-179.9	0	0	0	109.9	R18 C24	R18-L36 VanDerWaalsContact CG-O 3.3Å; R18-L36 WeakPolarHBondContact CG-O 3.48Å; C24-L36 HydrophobicContact CB-CB 3.98Å
37	A	94.6	Very high	91.9	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	169.3	-177	0	0	0	0	0	111	C24 D25 C26 L42 L80	C24-A37 CarbonylContact C-O 3.6Å; C24-A37 WeakPolarHBondContact CA-O 3.17Å; D25-A37 PolarHBondContact N-O 2.88Å; C26-A37 PolarHBondContact N-O 2.89Å; C26-A37 PolarHBondContact O-N 2.93Å; C26-A37 VanDerWaalsContact O-O 3.09Å; A37-L42 HydrophobicContact CB-CD1 3.65Å; A37-L42 HydrophobicContact CB-CD2 4.19Å; A37-L42 HydrophobicContact CB-CG 3.91Å; A37-L80 HydrophobicContact CB-CD1 4.08Å
38	H	92.9	Very high	92	Very high	16 Å²	16	42 Å²	42	7%	0.074	26%	0.263	C	S	.	.			trans	-103.6	129.2	175.3	-56.2	74.2	0	0	0	109.2	F22 L23 C24 D25 A40 V41 L42 Y84	F22-H38 PolarHBondContact O-NE2 3.32Å; L23-H38 PolarHBondContact O-CD2 3.3Å; L23-H38 VanDerWaalsContact O-CD2 3.25Å; C24-H38 VanDerWaalsContact SG-CE1 3.59Å; D25-H38 WeakPolarHBondContact OD1-CA 3.48Å; H38-A40 PolarHBondContact O-N 2.99Å; H38-V41 HydrophobicContact CB-CG2 4.17Å; H38-V41 PolarHBondContact O-N 2.83Å; H38-V41 VanDerWaalsContact O-N 3.15Å; H38-L42 PolarHBondContact O-N 2.9Å; H38-Y84 WeakPolarHBondContact CB-OH 3.37Å; H38-Y84 PolarHBondContact N-OH 3.42Å; H38-Y84 AromaticContact ND1-CE1 3.8Å; H38-Y84 AromaticContact ND1-CZ 3.76Å; H38-Y84 PolarHBondContact ND1-OH 2.87Å
39	R	90.7	Very high	91.9	Very high	63 Å²	63	42 Å²	42	24%	0.238	26%	0.263	C	S	.	.	H	α-helix	trans	-57.2	-37.7	-176.9	-66.9	173.5	62.6	173.5	-7.8	112	D25 C26 L42 A43 Y53 D62	D25-R39 VanDerWaalsContact O-CD 3.23Å; D25-R39 WeakPolarHBondContact O-CD 3.47Å; D25-R39 WeakPolarHBondContact O-CG 3.42Å; D25-R39 PolarHBondContact OD1-N 2.97Å; D25-R39 WeakPolarHBondContact OD2-CB 3.3Å; D25-R39 VanDerWaalsContact OD2-CD 3.22Å; D25-R39 WeakPolarHBondContact OD2-CD 3.26Å; D25-R39 VanDerWaalsContact OD2-CG 3.31Å; D25-R39 WeakPolarHBondContact OD2-CG 3.39Å; C26-R39 HydrophobicContact CB-CG 3.66Å; R39-L42 PolarHBondContact O-N 2.86Å; R39-A43 VanDerWaalsContact O-CB 3.28Å; R39-A43 WeakPolarHBondContact O-CB 3.34Å; R39-A43 PolarHBondContact O-N 2.81Å; R39-Y53 HydrophobicContact CB-CD2 4.44Å; R39-Y53 HydrophobicContact CB-CE1 4.46Å; R39-Y53 HydrophobicContact CB-CE2 3.93Å; R39-Y53 HydrophobicContact CG-CE1 4Å; R39-Y53 HydrophobicContact CG-CE2 4.31Å; R39-Y53 WeakPolarHBondContact O-CE2 3.47Å; R39-D62 IonicContact NH1-OD1 3.5Å
40	A	90.4	Very high	91.8	Very high	75 Å²	75	44.7 Å²	44.7	62%	0.62	28%	0.275	S	S	*	.	H	α-helix	trans	-59.2	-49.8	176.8	0	0	0	0	0	112.3	H38 A43 S44	H38-A40 PolarHBondContact O-N 2.99Å; A40-A43 PolarHBondContact O-N 2.94Å; A40-S44 PolarHBondContact O-N 3.09Å; A40-S44 PolarHBondContact O-OG 2.98Å
41	V	94.1	Very high	91.5	Very high	11 Å²	11	49.4 Å²	49.4	7%	0.067	30%	0.299	C	S	.	.	H	α-helix	trans	-68	-36.6	179.6	-177.3	0	0	0	0	111.4	L14 H38 S44 C45 M83 Y84	L14-V41 HydrophobicContact CD1-CG2 4.06Å; H38-V41 HydrophobicContact CB-CG2 4.17Å; H38-V41 PolarHBondContact O-N 2.83Å; H38-V41 VanDerWaalsContact O-N 3.15Å; V41-S44 WeakPolarHBondContact CA-OG 3.24Å; V41-S44 PolarHBondContact O-OG 3.14Å; V41-S44 VanDerWaalsContact O-OG 3.08Å; V41-C45 PolarHBondContact O-N 3.46Å; V41-M83 HydrophobicContact CG1-CB 4.35Å; V41-Y84 HydrophobicContact CB-CE1 4.37Å; V41-Y84 HydrophobicContact CB-CE2 4.14Å; V41-Y84 HydrophobicContact CG1-CD1 4.5Å; V41-Y84 HydrophobicContact CG1-CD2 4.01Å; V41-Y84 HydrophobicContact CG1-CE1 4.14Å; V41-Y84 HydrophobicContact CG1-CE2 3.62Å; V41-Y84 HydrophobicContact CG1-CG 4.44Å; V41-Y84 HydrophobicContact CG2-CE1 4.1Å
42	L	93.9	Very high	91.5	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-63.6	-42.3	173.2	-70.9	179.7	0	0	0	111.8	C26 V28 A37 H38 R39 S46 F49 Y53 L80 M83	C26-L42 HydrophobicContact CB-CD1 4.26Å; V28-L42 HydrophobicContact CG2-CD1 3.73Å; A37-L42 HydrophobicContact CB-CD1 3.65Å; A37-L42 HydrophobicContact CB-CD2 4.19Å; A37-L42 HydrophobicContact CB-CG 3.91Å; H38-L42 PolarHBondContact O-N 2.9Å; R39-L42 PolarHBondContact O-N 2.86Å; L42-S46 WeakPolarHBondContact O-CB 3.26Å; L42-S46 PolarHBondContact O-N 3.33Å; L42-F49 HydrophobicContact CB-CB 4.05Å; L42-F49 HydrophobicContact CB-CD1 4.09Å; L42-F49 HydrophobicContact CB-CD2 4.14Å; L42-F49 HydrophobicContact CB-CG 3.86Å; L42-F49 HydrophobicContact CD1-CD1 4.13Å; L42-F49 HydrophobicContact CD1-CE1 3.93Å; L42-F49 HydrophobicContact CD1-CZ 4.3Å; L42-F49 HydrophobicContact CD2-CD2 4.27Å; L42-F49 HydrophobicContact CD2-CE2 3.98Å; L42-F49 HydrophobicContact CD2-CZ 4.12Å; L42-F49 WeakPolarHBondContact O-CB 3.43Å; L42-Y53 HydrophobicContact CB-CE2 4.09Å; L42-Y53 WeakPolarHBondContact CD1-OH 3.41Å; L42-L80 HydrophobicContact CD2-CD1 3.7Å; L42-M83 HydrophobicContact CD2-CE 3.73Å; L42-M83 HydrophobicContact CD2-SD 4.01Å
43	A	92.4	Very high	91.5	Very high	24 Å²	24	43.8 Å²	43.8	20%	0.198	24%	0.242	C	C	.	.	H	α-helix	trans	-71.2	-37.7	179.6	0	0	0	0	0	113.6	R39 A40 Q50 Y53	R39-A43 VanDerWaalsContact O-CB 3.28Å; R39-A43 WeakPolarHBondContact O-CB 3.34Å; R39-A43 PolarHBondContact O-N 2.81Å; A40-A43 PolarHBondContact O-N 2.94Å; A43-Q50 HydrophobicContact CB-CB 4.39Å; A43-Q50 HydrophobicContact CB-CG 4.45Å; A43-Y53 HydrophobicContact CB-CD2 4.03Å; A43-Y53 HydrophobicContact CB-CE2 4.31Å
44	S	93.1	Very high	90.8	Very high	72 Å²	72	50 Å²	50	50%	0.503	27%	0.265	S	S	.	.	H	α-helix	trans	-68.7	-34	-178.7	58.3	0	0	0	0	112.9	A40 V41	A40-S44 PolarHBondContact O-N 3.09Å; A40-S44 PolarHBondContact O-OG 2.98Å; V41-S44 WeakPolarHBondContact CA-OG 3.24Å; V41-S44 PolarHBondContact O-OG 3.14Å; V41-S44 VanDerWaalsContact O-OG 3.08Å
45	C	94.1	Very high	89.6	Confident	30 Å²	30	48.9 Å²	48.9	20%	0.203	26%	0.259	C	S	.	.	S	Bend	trans	-99.8	1.2	-175.7	-61.1	0	0	0	0	114.2	V41 M83	V41-C45 PolarHBondContact O-N 3.46Å; C45-M83 HydrophobicContact CB-CB 4.31Å; C45-M83 HydrophobicContact CB-CE 3.65Å; C45-M83 HydrophobicContact CB-CG 3.76Å
46	S	94.9	Very high	88.2	Confident	1 Å²	1	52 Å²	52	1%	0.007	27%	0.27	C	S	.	.			trans	-154.5	117.5	-176.7	171.8	0	0	0	0	113.3	L42 F48 F49 Q50 L106	L42-S46 WeakPolarHBondContact O-CB 3.26Å; L42-S46 PolarHBondContact O-N 3.33Å; S46-F48 PolarHBondContact O-N 3.46Å; S46-F48 PolarHBondContact OG-N 3.16Å; S46-F49 PolarHBondContact O-N 2.86Å; S46-F49 PolarHBondContact OG-N 3.02Å; S46-Q50 PolarHBondContact O-N 3.2Å; S46-L106 PolarHBondContact OG-O 3.18Å
47	P	92.7	Very high	86.4	Confident	55 Å²	55	56.9 Å²	56.9	36%	0.357	29%	0.29	S	S	.	.	H	α-helix	trans	-59.5	-27.8	171.9	-25.1	34.9	0	0	0	113.7	Q50 L51 H107	P47-Q50 PolarHBondContact O-N 2.98Å; P47-L51 WeakPolarHBondContact O-CB 3.39Å; P47-L51 VanDerWaalsContact O-CG 3.32Å; P47-L51 WeakPolarHBondContact O-CG 3.35Å; P47-L51 PolarHBondContact O-N 3.23Å; P47-H107 HydrophobicContact CB-CB 4.27Å; P47-H107 HydrophobicContact CG-CB 4.31Å
48	F	91.6	Very high	84.4	Confident	35 Å²	35	58.6 Å²	58.6	15%	0.154	30%	0.299	C	S	.	.	H	α-helix	trans	-60.7	-50.9	174.5	169.5	-90	0	0	0	111.1	S46 F52 Y105 L106	S46-F48 PolarHBondContact O-N 3.46Å; S46-F48 PolarHBondContact OG-N 3.16Å; F48-F52 VanDerWaalsContact O-CB 3.26Å; F48-F52 WeakPolarHBondContact O-CB 3.3Å; F48-F52 PolarHBondContact O-N 2.93Å; F48-Y105 HydrophobicContact CD2-CE1 4.42Å; F48-Y105 HydrophobicContact CE1-CE1 4.43Å; F48-Y105 AromaticContact CE2-CE1 3.77Å; F48-Y105 HydrophobicContact CE2-CE1 3.77Å; F48-Y105 AromaticContact CE2-CZ 3.83Å; F48-Y105 AromaticContact CZ-CE1 3.79Å; F48-Y105 HydrophobicContact CZ-CE1 3.79Å; F48-L106 HydrophobicContact CB-CD2 4.48Å; F48-L106 HydrophobicContact CD1-CD2 3.55Å; F48-L106 HydrophobicContact CE1-CD2 3.97Å; F48-L106 HydrophobicContact CG-CD2 4.08Å
49	F	91.1	Very high	82.3	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-68.7	-40.4	177.6	-75.9	-75	0	0	0	111.4	V28 L42 S46 L51 F52 Y53 V64 I66 F76 M83 L106	V28-F49 HydrophobicContact CG1-CZ 4.29Å; V28-F49 HydrophobicContact CG2-CE1 4.02Å; V28-F49 HydrophobicContact CG2-CZ 4.12Å; L42-F49 HydrophobicContact CB-CB 4.05Å; L42-F49 HydrophobicContact CB-CD1 4.09Å; L42-F49 HydrophobicContact CB-CD2 4.14Å; L42-F49 HydrophobicContact CB-CG 3.86Å; L42-F49 HydrophobicContact CD1-CD1 4.13Å; L42-F49 HydrophobicContact CD1-CE1 3.93Å; L42-F49 HydrophobicContact CD1-CZ 4.3Å; L42-F49 HydrophobicContact CD2-CD2 4.27Å; L42-F49 HydrophobicContact CD2-CE2 3.98Å; L42-F49 HydrophobicContact CD2-CZ 4.12Å; L42-F49 WeakPolarHBondContact O-CB 3.43Å; S46-F49 PolarHBondContact O-N 2.86Å; S46-F49 PolarHBondContact OG-N 3.02Å; F49-L51 VanDerWaalsContact C-N 3.34Å; F49-L51 PolarHBondContact O-N 2.73Å; F49-F52 PolarHBondContact O-N 3.3Å; F49-Y53 HydrophobicContact CB-CD2 4.34Å; F49-Y53 HydrophobicContact CB-CE2 3.85Å; F49-Y53 HydrophobicContact CD1-CE2 4.24Å; F49-Y53 AromaticContact CD1-CZ 3.97Å; F49-Y53 HydrophobicContact CG-CE2 4.48Å; F49-Y53 WeakPolarHBondContact O-CD2 3.32Å; F49-Y53 VanDerWaalsContact O-CG 3.29Å; F49-Y53 PolarHBondContact O-N 3.38Å; F49-V64 HydrophobicContact CD1-CG1 4.36Å; F49-V64 HydrophobicContact CE1-CB 4.22Å; F49-V64 HydrophobicContact CE1-CG1 3.8Å; F49-V64 HydrophobicContact CE1-CG2 4.29Å; F49-I66 HydrophobicContact CZ-CD1 4.48Å; F49-F76 HydrophobicContact CE2-CE2 4.19Å; F49-F76 AromaticContact CZ-CE2 3.95Å; F49-F76 HydrophobicContact CZ-CE2 3.95Å; F49-F76 HydrophobicContact CZ-CZ 4.09Å; F49-M83 HydrophobicContact CD2-CE 4.43Å; F49-L106 HydrophobicContact CD2-CD2 4.32Å; F49-L106 HydrophobicContact CE2-CD1 4.31Å; F49-L106 HydrophobicContact CE2-CD2 3.69Å; F49-L106 HydrophobicContact CZ-CD2 4.24Å
50	Q	89.3	Confident	80.4	Confident	87 Å²	87	70.1 Å²	70.1	41%	0.407	36%	0.357	S	S	.	.	H	α-helix	trans	-57.9	-43.6	176.6	-159	-167.5	45	0	0	112.4	A43 S46 P47 K54	A43-Q50 HydrophobicContact CB-CB 4.39Å; A43-Q50 HydrophobicContact CB-CG 4.45Å; S46-Q50 PolarHBondContact O-N 3.2Å; P47-Q50 PolarHBondContact O-N 2.98Å; Q50-K54 WeakPolarHBondContact O-CB 3.2Å; Q50-K54 WeakPolarHBondContact O-CG 3.22Å; Q50-K54 PolarHBondContact O-N 3.41Å; Q50-K54 VanDerWaalsContact O-N 3.15Å
51	L	85.6	Confident	78.8	Confident	101 Å²	101	75.4 Å²	75.4	53%	0.529	36%	0.361	S	S	.	.	H	α-helix	trans	-70.5	-42.2	173.9	-72.1	170.1	0	0	0	112	P47 F49 Y53 K54 E55	P47-L51 WeakPolarHBondContact O-CB 3.39Å; P47-L51 VanDerWaalsContact O-CG 3.32Å; P47-L51 WeakPolarHBondContact O-CG 3.35Å; P47-L51 PolarHBondContact O-N 3.23Å; F49-L51 VanDerWaalsContact C-N 3.34Å; F49-L51 PolarHBondContact O-N 2.73Å; L51-Y53 VanDerWaalsContact C-N 3.25Å; L51-Y53 PolarHBondContact O-N 3.44Å; L51-K54 PolarHBondContact O-N 3Å; L51-E55 VanDerWaalsContact O-CB 3.25Å; L51-E55 WeakPolarHBondContact O-CB 3.37Å; L51-E55 PolarHBondContact O-N 3.26Å
52	F	84.1	Confident	77.8	Confident	27 Å²	27	79.2 Å²	79.2	12%	0.118	38%	0.381	C	S	.	.	H	α-helix	trans	-57.6	-38.4	178	-173.6	-80.6	0	0	0	112.3	F48 F49 L58 V64	F48-F52 VanDerWaalsContact O-CB 3.26Å; F48-F52 WeakPolarHBondContact O-CB 3.3Å; F48-F52 PolarHBondContact O-N 2.93Å; F49-F52 PolarHBondContact O-N 3.3Å; F52-L58 HydrophobicContact CD1-CD1 4.15Å; F52-L58 HydrophobicContact CE1-CD1 4.05Å; F52-L58 HydrophobicContact CE1-CD2 4.24Å; F52-V64 HydrophobicContact CD1-CG1 4.32Å; F52-V64 HydrophobicContact CD1-CG2 4.09Å; F52-V64 HydrophobicContact CD2-CG1 4.39Å; F52-V64 HydrophobicContact CE1-CB 4.31Å; F52-V64 HydrophobicContact CE1-CG1 4.03Å; F52-V64 HydrophobicContact CE1-CG2 3.72Å; F52-V64 HydrophobicContact CE2-CG1 4.07Å; F52-V64 HydrophobicContact CZ-CB 4.4Å; F52-V64 HydrophobicContact CZ-CG1 3.89Å; F52-V64 HydrophobicContact CZ-CG2 4.29Å
53	Y	83.9	Confident	77.1	Confident	31 Å²	31	82 Å²	82	12%	0.122	40%	0.395	C	S	.	.	H	α-helix	trans	-81	-26.6	177.6	-59	-43.6	0	0	0	114.2	C26 R39 L42 A43 F49 L51 L58 V64	C26-Y53 PolarHBondContact SG-OH 3.15Å; R39-Y53 HydrophobicContact CB-CD2 4.44Å; R39-Y53 HydrophobicContact CB-CE1 4.46Å; R39-Y53 HydrophobicContact CB-CE2 3.93Å; R39-Y53 HydrophobicContact CG-CE1 4Å; R39-Y53 HydrophobicContact CG-CE2 4.31Å; R39-Y53 WeakPolarHBondContact O-CE2 3.47Å; L42-Y53 HydrophobicContact CB-CE2 4.09Å; L42-Y53 WeakPolarHBondContact CD1-OH 3.41Å; A43-Y53 HydrophobicContact CB-CD2 4.03Å; A43-Y53 HydrophobicContact CB-CE2 4.31Å; F49-Y53 HydrophobicContact CB-CD2 4.34Å; F49-Y53 HydrophobicContact CB-CE2 3.85Å; F49-Y53 HydrophobicContact CD1-CE2 4.24Å; F49-Y53 AromaticContact CD1-CZ 3.97Å; F49-Y53 HydrophobicContact CG-CE2 4.48Å; F49-Y53 WeakPolarHBondContact O-CD2 3.32Å; F49-Y53 VanDerWaalsContact O-CG 3.29Å; F49-Y53 PolarHBondContact O-N 3.38Å; L51-Y53 VanDerWaalsContact C-N 3.25Å; L51-Y53 PolarHBondContact O-N 3.44Å; Y53-L58 HydrophobicContact CD1-CD1 3.59Å; Y53-L58 HydrophobicContact CE1-CD1 4.34Å; Y53-V64 HydrophobicContact CE1-CG2 3.87Å
54	K	77.6	Confident	76.8	Confident	160 Å²	160	81 Å²	81	70%	0.696	39%	0.387	S	S	*	.	H	α-helix	trans	-83.9	-33.6	176.1	-77.6	-177.8	175.6	-177.5	0	113.5	Q50 L51	Q50-K54 WeakPolarHBondContact O-CB 3.2Å; Q50-K54 WeakPolarHBondContact O-CG 3.22Å; Q50-K54 PolarHBondContact O-N 3.41Å; Q50-K54 VanDerWaalsContact O-N 3.15Å; L51-K54 PolarHBondContact O-N 3Å
55	E	67	Low	76.4	Confident	117 Å²	117	79.5 Å²	79.5	55%	0.547	38%	0.376	S	S	.	.	H	α-helix	trans	-84.1	-15	-172.4	-163.4	174.5	-161.1	0	0	113.4	L51 R448	L51-E55 VanDerWaalsContact O-CB 3.25Å; L51-E55 WeakPolarHBondContact O-CB 3.37Å; L51-E55 PolarHBondContact O-N 3.26Å; E55-R448 PolarHBondContact O-NH2 2.69Å; E55-R448 IonicContact OE1-CZ 2.74Å; E55-R448 IonicContact OE1-NH1 2.69Å; E55-R448 PolarHBondContact OE1-NH1 3.26Å
56	R	64.7	Low	76	Confident	106 Å²	106	78.2 Å²	78.2	40%	0.4	37%	0.368	S	S	.	.	S	Bend	trans	-121.6	124.6	-177.1	-61.6	-179.7	178.5	-151.7	0.4	111.2	L58	R56-L58 VanDerWaalsContact C-N 3.32Å; R56-L58 HydrophobicContact CB-CD1 4.45Å; R56-L58 HydrophobicContact CB-CG 3.97Å; R56-L58 PolarHBondContact O-N 2.93Å
57	E	55.3	Low	74.8	Confident	183 Å²	183	82.5 Å²	82.5	86%	0.855	39%	0.387	S	S	*	.			trans	-64	93.7	160.1	-67.6	162.1	156.9	0	0	108	D59	E57-D59 PolarHBondContact O-N 3.25Å; E57-D59 VanDerWaalsContact O-N 3.09Å
58	L	53.9	Low	74	Confident	37 Å²	37	82 Å²	82	19%	0.194	38%	0.382	C	S	.	.			trans	-85.4	41.4	-173.2	-86.3	164.1	0	0	0	112.6	F52 Y53 R56 K60	F52-L58 HydrophobicContact CD1-CD1 4.15Å; F52-L58 HydrophobicContact CE1-CD1 4.05Å; F52-L58 HydrophobicContact CE1-CD2 4.24Å; Y53-L58 HydrophobicContact CD1-CD1 3.59Å; Y53-L58 HydrophobicContact CE1-CD1 4.34Å; R56-L58 VanDerWaalsContact C-N 3.32Å; R56-L58 HydrophobicContact CB-CD1 4.45Å; R56-L58 HydrophobicContact CB-CG 3.97Å; R56-L58 PolarHBondContact O-N 2.93Å; L58-K60 PolarHBondContact O-N 2.89Å
59	D	48.1	Very low	73.1	Confident	133 Å²	133	89.8 Å²	89.8	71%	0.711	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-20.2	-166.6	-77.6	10.6	0	0	0	116.2	E57	E57-D59 PolarHBondContact O-N 3.25Å; E57-D59 VanDerWaalsContact O-N 3.09Å
60	K	51.5	Low	72.7	Confident	187 Å²	187	94.6 Å²	94.6	81%	0.813	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-143.1	3.2	-163.6	-59.9	-173.6	-178.6	172.3	0	116.8	L58	L58-K60 PolarHBondContact O-N 2.89Å
61	R	56	Low	72.8	Confident	186 Å²	186	90.8 Å²	90.8	70%	0.702	43%	0.426	S	S	*	.			trans	-151.3	110.6	-178.5	-58.3	-176.2	-153	-130.6	2	113.1	L63	R61-L63 HydrophobicContact CB-CB 4.26Å; R61-L63 PolarHBondContact O-N 2.73Å
62	D	72.2	Confident	73.1	Confident	92 Å²	92	88 Å²	88	49%	0.492	41%	0.413	S	S	.	.			trans	-76.7	49.5	171.1	-52.5	-55.5	0	0	0	111.6	D25 T27 R39	D25-D62 WeakPolarHBondContact O-CB 3.31Å; T27-D62 PolarHBondContact N-O 3.24Å; R39-D62 IonicContact NH1-OD1 3.5Å
63	L	81.2	Confident	73.5	Confident	57 Å²	57	88 Å²	88	30%	0.298	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	108.2	-165.9	-169.4	71.3	0	0	0	111.7	T27 M29 R61	T27-L63 HydrophobicContact CG2-CD1 3.93Å; T27-L63 CarbonylContact O-C 3.54Å; T27-L63 WeakPolarHBondContact O-CA 3.28Å; M29-L63 HydrophobicContact CG-CD1 3.82Å; M29-L63 HydrophobicContact SD-CD1 4.05Å; M29-L63 HydrophobicContact SD-CD2 4.48Å; R61-L63 HydrophobicContact CB-CB 4.26Å; R61-L63 PolarHBondContact O-N 2.73Å
64	V	86.1	Confident	73.9	Confident	3 Å²	3	90.1 Å²	90.1	2%	0.018	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	110.4	175.3	-174.4	0	0	0	0	109.6	T27 V28 M29 F49 F52 Y53	T27-V64 PolarHBondContact O-N 3.16Å; V28-V64 CarbonylContact C-O 3.42Å; V28-V64 WeakPolarHBondContact CA-O 3.35Å; V28-V64 HydrophobicContact CG1-CB 4.43Å; V28-V64 HydrophobicContact CG2-CB 4.38Å; M29-V64 PolarHBondContact N-O 3.04Å; F49-V64 HydrophobicContact CD1-CG1 4.36Å; F49-V64 HydrophobicContact CE1-CB 4.22Å; F49-V64 HydrophobicContact CE1-CG1 3.8Å; F49-V64 HydrophobicContact CE1-CG2 4.29Å; F52-V64 HydrophobicContact CD1-CG1 4.32Å; F52-V64 HydrophobicContact CD1-CG2 4.09Å; F52-V64 HydrophobicContact CD2-CG1 4.39Å; F52-V64 HydrophobicContact CE1-CB 4.31Å; F52-V64 HydrophobicContact CE1-CG1 4.03Å; F52-V64 HydrophobicContact CE1-CG2 3.72Å; F52-V64 HydrophobicContact CE2-CG1 4.07Å; F52-V64 HydrophobicContact CZ-CB 4.4Å; F52-V64 HydrophobicContact CZ-CG1 3.89Å; F52-V64 HydrophobicContact CZ-CG2 4.29Å; Y53-V64 HydrophobicContact CE1-CG2 3.87Å
65	C	84.5	Confident	74.7	Confident	42 Å²	42	82.5 Å²	82.5	28%	0.284	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	110.7	179.4	-62.8	0	0	0	0	112.2	H67	C65-H67 VanDerWaalsContact CB-CE1 3.42Å; C65-H67 WeakPolarHBondContact CB-CE1 3.46Å; C65-H67 WeakPolarHBondContact CB-NE2 3.23Å; C65-H67 PolarHBondContact O-N 3.01Å
66	I	85.5	Confident	76.1	Confident	3 Å²	3	76.9 Å²	76.9	2%	0.015	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	101.1	169.9	-59.5	-179.1	0	0	0	108.2	V28 M29 V30 F49 N68 V71 F76 Y105 L106	V28-I66 HydrophobicContact CG1-CD1 3.91Å; V28-I66 HydrophobicContact CG1-CG1 4.16Å; M29-I66 PolarHBondContact O-N 3.31Å; V30-I66 HydrophobicContact CG2-CB 4.33Å; V30-I66 HydrophobicContact CG2-CD1 4.18Å; F49-I66 HydrophobicContact CZ-CD1 4.48Å; I66-N68 VanDerWaalsContact C-N 3.34Å; I66-N68 HydrophobicContact CG2-CB 4.29Å; I66-V71 HydrophobicContact CG2-CB 3.84Å; I66-V71 HydrophobicContact CG2-CG1 4.09Å; I66-V71 HydrophobicContact CG2-CG2 3.94Å; I66-F76 HydrophobicContact CD1-CD2 3.99Å; I66-F76 HydrophobicContact CD1-CE2 3.88Å; I66-Y105 HydrophobicContact CG1-CE1 4.47Å; I66-Y105 HydrophobicContact CG2-CD1 4.36Å; I66-Y105 HydrophobicContact CG2-CE1 3.75Å; I66-L106 HydrophobicContact CD1-CD2 4.09Å
67	H	68.5	Low	77.5	Confident	91 Å²	91	72.5 Å²	72.5	42%	0.421	36%	0.364	S	S	.	.			trans	-96.9	30.8	-179.9	-65.4	-34.8	0	0	0	113	C65 Y430	C65-H67 VanDerWaalsContact CB-CE1 3.42Å; C65-H67 WeakPolarHBondContact CB-CE1 3.46Å; C65-H67 WeakPolarHBondContact CB-NE2 3.23Å; C65-H67 PolarHBondContact O-N 3.01Å; H67-Y430 AromaticContact CE1-CE2 3.24Å; H67-Y430 WeakPolarHBondContact CE1-CE2 3.44Å; H67-Y430 AromaticContact CE1-CZ 3.43Å; H67-Y430 VanDerWaalsContact CE1-CZ 3.43Å; H67-Y430 PolarHBondContact CE1-OH 2.7Å; H67-Y430 AromaticContact ND1-CZ 3.76Å; H67-Y430 PolarHBondContact ND1-OH 3.35Å; H67-Y430 AromaticContact NE2-CE2 3.67Å; H67-Y430 AromaticContact NE2-CZ 3.9Å; H67-Y430 PolarHBondContact NE2-OH 3.16Å
68	N	76.4	Confident	79.3	Confident	45 Å²	45	65 Å²	65	24%	0.241	33%	0.33	C	S	.	.			trans	-106.4	120.2	-178.4	-171.4	4.2	0	0	0	110.2	I66 I70 V71 Y105	I66-N68 VanDerWaalsContact C-N 3.34Å; I66-N68 HydrophobicContact CG2-CB 4.29Å; N68-I70 PolarHBondContact O-N 3.47Å; N68-I70 VanDerWaalsContact O-N 3.13Å; N68-I70 WeakPolarHBondContact OD1-CB 3.19Å; N68-I70 WeakPolarHBondContact OD1-CG1 3.5Å; N68-I70 PolarHBondContact OD1-N 3.07Å; N68-V71 HydrophobicContact CB-CG2 4.19Å; N68-V71 PolarHBondContact O-N 2.9Å; N68-Y105 HydrophobicContact CB-CD2 4.44Å; N68-Y105 HydrophobicContact CB-CE2 4.01Å; N68-Y105 WeakPolarHBondContact ND2-CD2 3.35Å; N68-Y105 VanDerWaalsContact ND2-CE2 3.28Å; N68-Y105 WeakPolarHBondContact ND2-CE2 3.36Å
69	E	73.6	Confident	81.3	Confident	197 Å²	197	63.2 Å²	63.2	92%	0.921	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-17.7	178.6	-65.4	169.6	177.5	0	0	112.7	V71	E69-V71 VanDerWaalsContact C-N 3.34Å
70	I	81.8	Confident	83.5	Confident	102 Å²	102	57.1 Å²	57.1	52%	0.523	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-19.7	175.8	-59.2	171	0	0	0	112.5	N68 A101	N68-I70 PolarHBondContact O-N 3.47Å; N68-I70 VanDerWaalsContact O-N 3.13Å; N68-I70 WeakPolarHBondContact OD1-CB 3.19Å; N68-I70 WeakPolarHBondContact OD1-CG1 3.5Å; N68-I70 PolarHBondContact OD1-N 3.07Å; I70-A101 HydrophobicContact CG2-CB 3.62Å
71	V	90.5	Very high	85.5	Confident	7 Å²	7	51.9 Å²	51.9	4%	0.042	27%	0.269	C	S	.	.	S	Bend	trans	-103.1	98.9	-176.9	-174.2	0	0	0	0	109.5	V30 I66 N68 E69 F76 A102 Y105	V30-V71 HydrophobicContact CG1-CB 4.5Å; V30-V71 HydrophobicContact CG1-CG1 4.01Å; V30-V71 WeakPolarHBondContact CG1-O 3.4Å; I66-V71 HydrophobicContact CG2-CB 3.84Å; I66-V71 HydrophobicContact CG2-CG1 4.09Å; I66-V71 HydrophobicContact CG2-CG2 3.94Å; N68-V71 HydrophobicContact CB-CG2 4.19Å; N68-V71 PolarHBondContact O-N 2.9Å; E69-V71 VanDerWaalsContact C-N 3.34Å; V71-F76 HydrophobicContact CG1-CB 4.26Å; V71-A102 HydrophobicContact CG1-CB 4.03Å; V71-Y105 HydrophobicContact CG2-CD1 3.57Å; V71-Y105 HydrophobicContact CG2-CE1 4.25Å; V71-Y105 HydrophobicContact CG2-CG 3.75Å
72	T	92.3	Very high	87.3	Confident	42 Å²	42	44 Å²	44	26%	0.258	24%	0.24	S	C	.	.			trans	-77.7	147.7	176.3	65.7	0	0	0	0	111.2	A75 F76 D98	T72-A75 PolarHBondContact O-N 2.93Å; T72-A75 WeakPolarHBondContact OG1-CB 3.15Å; T72-F76 PolarHBondContact O-N 2.85Å; T72-D98 WeakPolarHBondContact CB-OD2 3.46Å; T72-D98 WeakPolarHBondContact CG2-OD2 3.5Å; T72-D98 PolarHBondContact OG1-OD2 2.98Å
73	A	92.6	Very high	88.4	Confident	28 Å²	28	39.9 Å²	39.9	23%	0.231	22%	0.217	C	C	.	.	H	α-helix	trans	-61.9	-39.6	-178.3	0	0	0	0	0	113.8	V30 A33 F35 F76 G77	V30-A73 HydrophobicContact CB-CB 4.45Å; V30-A73 HydrophobicContact CG1-CB 4.35Å; A33-A73 HydrophobicContact CB-CB 3.59Å; F35-A73 HydrophobicContact CE2-CB 4.32Å; F35-A73 HydrophobicContact CZ-CB 4.23Å; F35-A73 WeakPolarHBondContact CZ-O 3.4Å; A73-F76 PolarHBondContact O-N 2.82Å; A73-G77 PolarHBondContact O-N 3.42Å
74	P	93.4	Very high	89	Confident	74 Å²	74	37.2 Å²	37.2	48%	0.481	20%	0.203	S	C	.	.	H	α-helix	trans	-61.5	-44.6	174.1	-23.9	35.7	0	0	0	112.5	F76 G77 L78 T94	P74-F76 PolarHBondContact O-N 2.93Å; P74-G77 WeakPolarHBondContact O-CA 3.25Å; P74-G77 PolarHBondContact O-N 3.41Å; P74-G77 VanDerWaalsContact O-N 3.12Å; P74-L78 PolarHBondContact O-N 3.37Å; P74-T94 HydrophobicContact CB-CG2 4.18Å; P74-T94 WeakPolarHBondContact CB-OG1 3.43Å
75	A	94.2	Very high	89.2	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.6	-41	177.6	0	0	0	0	0	112.5	T72 G77 L78 L79 T94 D98 V99 A102	T72-A75 PolarHBondContact O-N 2.93Å; T72-A75 WeakPolarHBondContact OG1-CB 3.15Å; A75-G77 VanDerWaalsContact C-N 3.33Å; A75-G77 PolarHBondContact O-N 3.36Å; A75-L78 PolarHBondContact O-N 3.46Å; A75-L79 WeakPolarHBondContact O-CG 3.44Å; A75-L79 PolarHBondContact O-N 3.23Å; A75-L79 VanDerWaalsContact O-N 3.12Å; A75-T94 HydrophobicContact CB-CG2 4.12Å; A75-D98 HydrophobicContact CB-CB 3.94Å; A75-V99 HydrophobicContact CB-CG2 3.95Å; A75-A102 HydrophobicContact CB-CB 4.02Å
76	F	95.4	Very high	89.3	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-62	-40.7	171.6	-175.7	-95.8	0	0	0	112.2	V28 V30 F35 F49 I66 V71 T72 A73 P74 L79 L80 L106	V28-F76 HydrophobicContact CB-CE1 4.01Å; V28-F76 HydrophobicContact CB-CZ 3.92Å; V28-F76 HydrophobicContact CG1-CE1 3.97Å; V28-F76 HydrophobicContact CG1-CE2 4.15Å; V28-F76 HydrophobicContact CG1-CZ 3.63Å; V28-F76 HydrophobicContact CG2-CE1 4.47Å; V28-F76 HydrophobicContact CG2-CZ 4.04Å; V30-F76 HydrophobicContact CG1-CB 4.34Å; V30-F76 HydrophobicContact CG2-CB 3.96Å; V30-F76 HydrophobicContact CG2-CD1 3.73Å; V30-F76 HydrophobicContact CG2-CD2 4.13Å; V30-F76 HydrophobicContact CG2-CE1 4.31Å; V30-F76 HydrophobicContact CG2-CG 3.64Å; F35-F76 HydrophobicContact CB-CD1 4.43Å; F35-F76 HydrophobicContact CB-CE1 3.91Å; F35-F76 HydrophobicContact CD1-CD1 4.13Å; F35-F76 HydrophobicContact CD1-CE1 4.34Å; F35-F76 AromaticContact CD2-CD1 3.55Å; F35-F76 HydrophobicContact CD2-CD1 3.55Å; F35-F76 AromaticContact CD2-CE1 3.82Å; F35-F76 HydrophobicContact CD2-CE1 3.82Å; F35-F76 HydrophobicContact CE1-CD1 4.27Å; F35-F76 AromaticContact CE2-CD1 3.72Å; F35-F76 HydrophobicContact CE2-CD1 3.72Å; F35-F76 HydrophobicContact CE2-CE1 4.44Å; F35-F76 AromaticContact CG-CD1 3.78Å; F35-F76 HydrophobicContact CG-CD1 3.78Å; F35-F76 AromaticContact CG-CE1 3.77Å; F35-F76 HydrophobicContact CG-CE1 3.77Å; F35-F76 HydrophobicContact CZ-CD1 4.08Å; F49-F76 HydrophobicContact CE2-CE2 4.19Å; F49-F76 AromaticContact CZ-CE2 3.95Å; F49-F76 HydrophobicContact CZ-CE2 3.95Å; F49-F76 HydrophobicContact CZ-CZ 4.09Å; I66-F76 HydrophobicContact CD1-CD2 3.99Å; I66-F76 HydrophobicContact CD1-CE2 3.88Å; V71-F76 HydrophobicContact CG1-CB 4.26Å; T72-F76 PolarHBondContact O-N 2.85Å; A73-F76 PolarHBondContact O-N 2.82Å; P74-F76 PolarHBondContact O-N 2.93Å; F76-L79 PolarHBondContact O-N 3.21Å; F76-L80 HydrophobicContact CE1-CB 4.21Å; F76-L80 HydrophobicContact CE1-CD2 4.1Å; F76-L80 WeakPolarHBondContact O-CB 3.45Å; F76-L80 PolarHBondContact O-N 3.44Å; F76-L106 HydrophobicContact CD2-CD1 3.91Å; F76-L106 HydrophobicContact CE2-CD1 3.85Å
77	G	94.3	Very high	89.4	Confident	14 Å²	14	42.9 Å²	42.9	14%	0.144	24%	0.238	C	C	.	.	H	α-helix	trans	-58	-47.1	175.5	0	0	0	0	0	112.8	A73 P74 A75 L79 L80 D81	A73-G77 PolarHBondContact O-N 3.42Å; P74-G77 WeakPolarHBondContact O-CA 3.25Å; P74-G77 PolarHBondContact O-N 3.41Å; P74-G77 VanDerWaalsContact O-N 3.12Å; A75-G77 VanDerWaalsContact C-N 3.33Å; A75-G77 PolarHBondContact O-N 3.36Å; G77-L79 VanDerWaalsContact C-N 3.35Å; G77-L79 PolarHBondContact O-N 3.43Å; G77-L80 PolarHBondContact O-N 2.92Å; G77-D81 PolarHBondContact O-N 2.69Å
78	L	94	Very high	90.4	Very high	25 Å²	25	38.6 Å²	38.6	13%	0.131	22%	0.218	C	C	.	.	H	α-helix	trans	-63.1	-38.5	177	-66.2	-179.2	0	0	0	112.8	P74 A75 F82 L88 L90 T94 V99	P74-L78 PolarHBondContact O-N 3.37Å; A75-L78 PolarHBondContact O-N 3.46Å; L78-F82 PolarHBondContact O-N 3.21Å; L78-L88 HydrophobicContact CB-CD1 4.2Å; L78-L88 WeakPolarHBondContact O-CD1 3.44Å; L78-L90 HydrophobicContact CD1-CD2 4.28Å; L78-T94 HydrophobicContact CD1-CG2 4.02Å; L78-V99 HydrophobicContact CD1-CG2 4.02Å
79	L	95.4	Very high	90.7	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-68.5	-40.9	175	-65.8	174.4	0	0	0	111.7	A75 F76 G77 D81 F82 M83 L88 V99 A102 A103 L106 M108 I111	A75-L79 WeakPolarHBondContact O-CG 3.44Å; A75-L79 PolarHBondContact O-N 3.23Å; A75-L79 VanDerWaalsContact O-N 3.12Å; F76-L79 PolarHBondContact O-N 3.21Å; G77-L79 VanDerWaalsContact C-N 3.35Å; G77-L79 PolarHBondContact O-N 3.43Å; L79-D81 VanDerWaalsContact C-N 3.34Å; L79-F82 WeakPolarHBondContact O-CB 3.34Å; L79-F82 PolarHBondContact O-N 3.09Å; L79-M83 VanDerWaalsContact O-CG 3.23Å; L79-M83 WeakPolarHBondContact O-CG 3.29Å; L79-M83 PolarHBondContact O-N 2.9Å; L79-L88 HydrophobicContact CD2-CD1 4.43Å; L79-V99 HydrophobicContact CD2-CG1 3.91Å; L79-V99 HydrophobicContact CG-CG1 4.32Å; L79-A102 HydrophobicContact CD1-CB 3.56Å; L79-A103 HydrophobicContact CD1-CB 4.18Å; L79-A103 HydrophobicContact CD2-CB 4.11Å; L79-L106 HydrophobicContact CD1-CD1 4.09Å; L79-M108 HydrophobicContact CB-SD 4.23Å; L79-M108 HydrophobicContact CD1-SD 4.29Å; L79-M108 HydrophobicContact CD2-SD 4.2Å; L79-M108 HydrophobicContact CG-SD 4.48Å; L79-I111 HydrophobicContact CD2-CD1 3.54Å; L79-I111 HydrophobicContact CD2-CG2 3.96Å
80	L	95.1	Very high	91	Very high	5 Å²	5	29.9 Å²	29.9	3%	0.026	18%	0.184	C	C	.	.	H	α-helix	trans	-65.9	-36.1	175.9	-173.6	67.4	0	0	0	111.9	R18 F35 A37 L42 F76 G77 M83 Y84	R18-L80 PolarHBondContact NH1-O 2.79Å; F35-L80 HydrophobicContact CB-CD2 3.78Å; F35-L80 HydrophobicContact CD1-CD2 3.96Å; F35-L80 HydrophobicContact CG-CD2 4.22Å; A37-L80 HydrophobicContact CB-CD1 4.08Å; L42-L80 HydrophobicContact CD2-CD1 3.7Å; F76-L80 HydrophobicContact CE1-CB 4.21Å; F76-L80 HydrophobicContact CE1-CD2 4.1Å; F76-L80 WeakPolarHBondContact O-CB 3.45Å; F76-L80 PolarHBondContact O-N 3.44Å; G77-L80 PolarHBondContact O-N 2.92Å; L80-M83 HydrophobicContact CD1-SD 4.29Å; L80-M83 PolarHBondContact O-N 2.74Å; L80-Y84 HydrophobicContact CD1-CD2 4.29Å; L80-Y84 HydrophobicContact CD1-CE2 3.96Å; L80-Y84 WeakPolarHBondContact O-CD2 3.43Å; L80-Y84 PolarHBondContact O-N 3.48Å
81	D	93.3	Very high	90.5	Very high	77 Å²	77	33 Å²	33	41%	0.412	19%	0.189	S	C	.	.	H	α-helix	trans	-67.4	-41.1	172.6	-79.6	-13.1	0	0	0	111.8	R18 G77 L79 M83 Y84 A85	R18-D81 IonicContact CZ-OD1 3.51Å; R18-D81 VanDerWaalsContact CZ-OD1 3.23Å; R18-D81 IonicContact NH1-OD1 3.85Å; R18-D81 PolarHBondContact NH1-OD1 2.99Å; R18-D81 IonicContact NH2-OD1 3.94Å; R18-D81 PolarHBondContact NH2-OD1 3.34Å; G77-D81 PolarHBondContact O-N 2.69Å; L79-D81 VanDerWaalsContact C-N 3.34Å; D81-M83 VanDerWaalsContact C-N 3.31Å; D81-M83 PolarHBondContact O-N 2.93Å; D81-Y84 CarbonylContact O-C 3.57Å; D81-Y84 PolarHBondContact O-N 3.45Å; D81-Y84 VanDerWaalsContact O-N 3.14Å; D81-A85 WeakPolarHBondContact O-CB 3.34Å; D81-A85 PolarHBondContact O-N 2.92Å
82	F	93.9	Very high	89.2	Confident	21 Å²	21	36.6 Å²	36.6	9%	0.092	23%	0.227	C	C	.	.	H	α-helix	trans	-56.1	-43.9	169.8	163.5	-86.6	0	0	0	112	L78 L79 Y84 A85 G86 Q87 L88 M108 I111 V301	L78-F82 PolarHBondContact O-N 3.21Å; L79-F82 WeakPolarHBondContact O-CB 3.34Å; L79-F82 PolarHBondContact O-N 3.09Å; F82-Y84 PolarHBondContact O-N 3.3Å; F82-Y84 VanDerWaalsContact O-N 3.15Å; F82-A85 PolarHBondContact O-N 3.29Å; F82-G86 PolarHBondContact O-N 2.91Å; F82-Q87 WeakPolarHBondContact CA-O 3.31Å; F82-L88 HydrophobicContact CB-CB 4.3Å; F82-L88 HydrophobicContact CB-CD1 3.99Å; F82-L88 HydrophobicContact CD2-CB 4Å; F82-L88 HydrophobicContact CG-CB 4.47Å; F82-M108 HydrophobicContact CD1-CE 3.92Å; F82-M108 HydrophobicContact CE1-CE 4.05Å; F82-I111 HydrophobicContact CD1-CD1 3.61Å; F82-I111 HydrophobicContact CE1-CD1 3.74Å; F82-I111 HydrophobicContact CE1-CG1 4.37Å; F82-I111 HydrophobicContact CG-CD1 4.04Å; F82-I111 HydrophobicContact CZ-CD1 4.24Å; F82-I111 HydrophobicContact CZ-CG1 4.44Å; F82-V301 HydrophobicContact CE2-CG2 3.93Å; F82-V301 HydrophobicContact CZ-CG2 3.87Å
83	M	94.3	Very high	88.3	Confident	5 Å²	5	41.8 Å²	41.8	3%	0.025	25%	0.253	C	S	.	.	H	α-helix	trans	-61	-25.1	179.6	-66.3	163.6	102.2	0	0	113.3	V41 L42 C45 F49 L79 L80 D81 M108	V41-M83 HydrophobicContact CG1-CB 4.35Å; L42-M83 HydrophobicContact CD2-CE 3.73Å; L42-M83 HydrophobicContact CD2-SD 4.01Å; C45-M83 HydrophobicContact CB-CB 4.31Å; C45-M83 HydrophobicContact CB-CE 3.65Å; C45-M83 HydrophobicContact CB-CG 3.76Å; F49-M83 HydrophobicContact CD2-CE 4.43Å; L79-M83 VanDerWaalsContact O-CG 3.23Å; L79-M83 WeakPolarHBondContact O-CG 3.29Å; L79-M83 PolarHBondContact O-N 2.9Å; L80-M83 HydrophobicContact CD1-SD 4.29Å; L80-M83 PolarHBondContact O-N 2.74Å; D81-M83 VanDerWaalsContact C-N 3.31Å; D81-M83 PolarHBondContact O-N 2.93Å; M83-M108 HydrophobicContact CE-CE 4.34Å; M83-M108 HydrophobicContact CG-CE 3.69Å; M83-M108 HydrophobicContact SD-CE 4.03Å
84	Y	93.8	Very high	88.1	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.3	2.6	177	-76.4	-97.6	0	0	0	113.8	L14 R15 R18 H38 V41 L80 D81 F82	L14-Y84 HydrophobicContact CB-CD1 4.09Å; L14-Y84 HydrophobicContact CB-CE1 4Å; L14-Y84 WeakPolarHBondContact O-CE1 3.42Å; R15-Y84 HydrophobicContact CB-CD1 4.32Å; R15-Y84 VanDerWaalsContact CZ-O 3.27Å; R15-Y84 PolarHBondContact NE-O 3.17Å; R15-Y84 PolarHBondContact NH2-O 3.16Å; R18-Y84 HydrophobicContact CB-CD1 4.33Å; R18-Y84 HydrophobicContact CB-CE1 4.02Å; R18-Y84 HydrophobicContact CG-CE1 4.32Å; H38-Y84 WeakPolarHBondContact CB-OH 3.37Å; H38-Y84 PolarHBondContact N-OH 3.42Å; H38-Y84 AromaticContact ND1-CE1 3.8Å; H38-Y84 AromaticContact ND1-CZ 3.76Å; H38-Y84 PolarHBondContact ND1-OH 2.87Å; V41-Y84 HydrophobicContact CB-CE1 4.37Å; V41-Y84 HydrophobicContact CB-CE2 4.14Å; V41-Y84 HydrophobicContact CG1-CD1 4.5Å; V41-Y84 HydrophobicContact CG1-CD2 4.01Å; V41-Y84 HydrophobicContact CG1-CE1 4.14Å; V41-Y84 HydrophobicContact CG1-CE2 3.62Å; V41-Y84 HydrophobicContact CG1-CG 4.44Å; V41-Y84 HydrophobicContact CG2-CE1 4.1Å; L80-Y84 HydrophobicContact CD1-CD2 4.29Å; L80-Y84 HydrophobicContact CD1-CE2 3.96Å; L80-Y84 WeakPolarHBondContact O-CD2 3.43Å; L80-Y84 PolarHBondContact O-N 3.48Å; D81-Y84 CarbonylContact O-C 3.57Å; D81-Y84 PolarHBondContact O-N 3.45Å; D81-Y84 VanDerWaalsContact O-N 3.14Å; F82-Y84 PolarHBondContact O-N 3.3Å; F82-Y84 VanDerWaalsContact O-N 3.15Å
85	A	90.4	Very high	87.9	Confident	28 Å²	28	40.6 Å²	40.6	23%	0.231	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-134	-15.9	-175.2	0	0	0	0	0	115.8	D81 F82 Q87	D81-A85 WeakPolarHBondContact O-CB 3.34Å; D81-A85 PolarHBondContact O-N 2.92Å; F82-A85 PolarHBondContact O-N 3.29Å; A85-Q87 PolarHBondContact O-N 2.98Å
86	G	87.7	Confident	87.8	Confident	30 Å²	30	40.8 Å²	40.8	31%	0.309	24%	0.244	S	C	.	.	S	Bend	trans	64.4	9.6	-171.5	0	0	0	0	0	114.1	F82 V299	F82-G86 PolarHBondContact O-N 2.91Å; G86-V299 VanDerWaalsContact O-O 3.13Å
87	Q	86.8	Confident	87.7	Confident	110 Å²	110	45.7 Å²	45.7	51%	0.514	27%	0.267	S	S	.	.			trans	-139	133.8	-171.8	-63	-179.6	30.9	0	0	110.3	F82 A85	F82-Q87 WeakPolarHBondContact CA-O 3.31Å; A85-Q87 PolarHBondContact O-N 2.98Å
88	L	88.6	Confident	87.7	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.005	27%	0.272	C	S	.	.			trans	-109.9	84.4	-174.5	-175.9	63.2	0	0	0	110.9	L78 L79 F82 L90 V99 I111 V299	L78-L88 HydrophobicContact CB-CD1 4.2Å; L78-L88 WeakPolarHBondContact O-CD1 3.44Å; L79-L88 HydrophobicContact CD2-CD1 4.43Å; F82-L88 HydrophobicContact CB-CB 4.3Å; F82-L88 HydrophobicContact CB-CD1 3.99Å; F82-L88 HydrophobicContact CD2-CB 4Å; F82-L88 HydrophobicContact CG-CB 4.47Å; L88-L90 HydrophobicContact CD2-CD1 4.04Å; L88-L90 HydrophobicContact CG-CD1 4.1Å; L88-L90 HydrophobicContact CG-CG 4.18Å; L88-L90 PolarHBondContact O-N 3.41Å; L88-V99 HydrophobicContact CD2-CG1 4.26Å; L88-I111 HydrophobicContact CD2-CG2 3.65Å; L88-V299 HydrophobicContact CB-CG2 4.3Å
89	A	83.2	Confident	87.7	Confident	42 Å²	42	46.1 Å²	46.1	35%	0.347	27%	0.266	S	S	.	.			trans	-75.6	89.9	177.6	0	0	0	0	0	111.3	R91 L296	A89-R91 PolarHBondContact O-N 2.84Å; A89-L296 HydrophobicContact CB-CD2 3.86Å
90	L	80.7	Confident	87.6	Confident	16 Å²	16	47.3 Å²	47.3	8%	0.084	27%	0.272	C	S	.	.			trans	-72.1	91.5	177.5	-82.1	147.4	0	0	0	111.2	L78 L88 L96 V99	L78-L90 HydrophobicContact CD1-CD2 4.28Å; L88-L90 HydrophobicContact CD2-CD1 4.04Å; L88-L90 HydrophobicContact CG-CD1 4.1Å; L88-L90 HydrophobicContact CG-CG 4.18Å; L88-L90 PolarHBondContact O-N 3.41Å; L90-L96 HydrophobicContact CD1-CD1 3.81Å; L90-L96 HydrophobicContact CD2-CD1 4.09Å; L90-V99 HydrophobicContact CD2-CB 4.05Å; L90-V99 HydrophobicContact CD2-CG1 4.2Å; L90-V99 HydrophobicContact CD2-CG2 3.69Å
91	R	70.3	Confident	87.6	Confident	169 Å²	169	48.4 Å²	48.4	64%	0.638	28%	0.282	S	S	*	.			trans	-71.4	141.8	172.8	-66.6	-172.9	175.7	-133.2	-1	110.7	A89 D93 T94	A89-R91 PolarHBondContact O-N 2.84Å; R91-D93 PolarHBondContact O-N 3.05Å; R91-T94 PolarHBondContact O-N 2.84Å
92	G	63	Low	87.7	Confident	81 Å²	81	44.8 Å²	44.8	84%	0.835	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-17.7	-168.3	0	0	0	0	0	116.2	T94	G92-T94 VanDerWaalsContact C-N 3.28Å; G92-T94 PolarHBondContact O-N 3.22Å
93	D	74.9	Confident	87.8	Confident	151 Å²	151	43.8 Å²	43.8	81%	0.807	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-13.8	179.8	-42	-77	0	0	0	113.7	R91	R91-D93 PolarHBondContact O-N 3.05Å
94	T	87.5	Confident	87.8	Confident	18 Å²	18	45.9 Å²	45.9	11%	0.11	27%	0.274	C	S	.	.	S	Bend	trans	-115.4	120.7	178.3	-51.9	0	0	0	0	110.4	P74 A75 L78 R91 G92 D98 V99	P74-T94 HydrophobicContact CB-CG2 4.18Å; P74-T94 WeakPolarHBondContact CB-OG1 3.43Å; A75-T94 HydrophobicContact CB-CG2 4.12Å; L78-T94 HydrophobicContact CD1-CG2 4.02Å; R91-T94 PolarHBondContact O-N 2.84Å; G92-T94 VanDerWaalsContact C-N 3.28Å; G92-T94 PolarHBondContact O-N 3.22Å; T94-D98 HydrophobicContact CG2-CB 4.39Å; T94-V99 HydrophobicContact CG2-CG2 3.81Å
95	P	89.8	Confident	87.9	Confident	59 Å²	59	49.3 Å²	49.3	38%	0.383	29%	0.287	S	S	.	.			trans	-65.8	150.2	179.3	26.1	-31.9	0	0	0	111.6	E97 D98 V99	P95-E97 WeakPolarHBondContact CB-OE2 3.43Å; P95-E97 PolarHBondContact O-N 3.37Å; P95-D98 HydrophobicContact CG-CB 3.96Å; P95-D98 PolarHBondContact O-N 3.41Å; P95-V99 PolarHBondContact O-N 3.45Å
96	L	91.5	Very high	88.1	Confident	5 Å²	5	48 Å²	48	3%	0.026	28%	0.276	C	S	.	.	H	α-helix	trans	-69.8	-26.2	-177.5	-179.5	56.7	0	0	0	111.5	L90 V99 L100 C115 R118 L119	L90-L96 HydrophobicContact CD1-CD1 3.81Å; L90-L96 HydrophobicContact CD2-CD1 4.09Å; L96-V99 PolarHBondContact O-N 3.27Å; L96-L100 VanDerWaalsContact O-CB 3.29Å; L96-L100 WeakPolarHBondContact O-CB 3.3Å; L96-L100 PolarHBondContact O-N 3.34Å; L96-C115 HydrophobicContact CD1-CB 3.75Å; L96-C115 HydrophobicContact CG-CB 4.29Å; L96-R118 HydrophobicContact CD2-CB 3.88Å; L96-R118 HydrophobicContact CD2-CG 3.78Å; L96-L119 HydrophobicContact CB-CD2 4.02Å; L96-L119 HydrophobicContact CD2-CD2 3.79Å; L96-L119 HydrophobicContact CD2-CG 3.75Å; L96-L119 HydrophobicContact CG-CD2 3.96Å; L96-L119 HydrophobicContact CG-CG 3.94Å
97	E	93.3	Very high	88.4	Confident	102 Å²	102	50.9 Å²	50.9	48%	0.477	28%	0.281	S	S	.	.	H	α-helix	trans	-60.8	-47.4	173.5	-63.4	75.4	-171.5	0	0	111.4	P95 L100 A101 L119	P95-E97 WeakPolarHBondContact CB-OE2 3.43Å; P95-E97 PolarHBondContact O-N 3.37Å; E97-L100 PolarHBondContact O-N 3.15Å; E97-A101 VanDerWaalsContact O-CB 3.28Å; E97-A101 WeakPolarHBondContact O-CB 3.33Å; E97-A101 PolarHBondContact O-N 2.86Å; E97-L119 HydrophobicContact CG-CD2 4.26Å; E97-L119 WeakPolarHBondContact OE1-CD2 3.49Å
98	D	93.6	Very high	88.8	Confident	48 Å²	48	46.1 Å²	46.1	26%	0.257	26%	0.259	S	S	.	.	H	α-helix	trans	-63.3	-44.2	176	-85.6	25.1	0	0	0	111.3	T72 A75 T94 P95 A101 A102	T72-D98 WeakPolarHBondContact CB-OD2 3.46Å; T72-D98 WeakPolarHBondContact CG2-OD2 3.5Å; T72-D98 PolarHBondContact OG1-OD2 2.98Å; A75-D98 HydrophobicContact CB-CB 3.94Å; T94-D98 HydrophobicContact CG2-CB 4.39Å; P95-D98 HydrophobicContact CG-CB 3.96Å; P95-D98 PolarHBondContact O-N 3.41Å; D98-A101 PolarHBondContact O-N 3.41Å; D98-A102 WeakPolarHBondContact O-CB 3.19Å; D98-A102 PolarHBondContact O-N 2.88Å
99	V	93.9	Very high	89	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-67.9	-38.9	179.8	-178.6	0	0	0	0	111.1	A75 L78 L79 L88 L90 T94 P95 L96 A101 A103	A75-V99 HydrophobicContact CB-CG2 3.95Å; L78-V99 HydrophobicContact CD1-CG2 4.02Å; L79-V99 HydrophobicContact CD2-CG1 3.91Å; L79-V99 HydrophobicContact CG-CG1 4.32Å; L88-V99 HydrophobicContact CD2-CG1 4.26Å; L90-V99 HydrophobicContact CD2-CB 4.05Å; L90-V99 HydrophobicContact CD2-CG1 4.2Å; L90-V99 HydrophobicContact CD2-CG2 3.69Å; T94-V99 HydrophobicContact CG2-CG2 3.81Å; P95-V99 PolarHBondContact O-N 3.45Å; L96-V99 PolarHBondContact O-N 3.27Å; V99-A101 VanDerWaalsContact C-N 3.35Å; V99-A103 WeakPolarHBondContact O-CB 3.28Å; V99-A103 PolarHBondContact O-N 3.33Å
100	L	94.9	Very high	89.4	Confident	25 Å²	25	52.8 Å²	52.8	13%	0.131	29%	0.289	C	S	.	.	H	α-helix	trans	-60.8	-43	170.4	172.2	58.5	0	0	0	111.7	L96 E97 S104 V112 C115 K116 L119	L96-L100 VanDerWaalsContact O-CB 3.29Å; L96-L100 WeakPolarHBondContact O-CB 3.3Å; L96-L100 PolarHBondContact O-N 3.34Å; E97-L100 PolarHBondContact O-N 3.15Å; L100-S104 VanDerWaalsContact O-CB 3.27Å; L100-S104 WeakPolarHBondContact O-CB 3.37Å; L100-S104 PolarHBondContact O-N 2.85Å; L100-S104 PolarHBondContact O-OG 2.98Å; L100-V112 HydrophobicContact CD1-CB 4.2Å; L100-V112 HydrophobicContact CD1-CG1 3.83Å; L100-V112 HydrophobicContact CD1-CG2 4.31Å; L100-C115 HydrophobicContact CB-CB 3.86Å; L100-C115 HydrophobicContact CD1-CB 4.11Å; L100-C115 HydrophobicContact CG-CB 4.45Å; L100-K116 HydrophobicContact CD1-CG 3.92Å; L100-K116 HydrophobicContact CD2-CG 4Å; L100-L119 HydrophobicContact CD2-CD1 3.57Å
101	A	94.6	Very high	90	Very high	29 Å²	29	52.2 Å²	52.2	24%	0.24	29%	0.286	C	S	.	.	H	α-helix	trans	-68.7	-43.7	-178.5	0	0	0	0	0	112	I70 E97 D98 V99 S104 Y105	I70-A101 HydrophobicContact CG2-CB 3.62Å; E97-A101 VanDerWaalsContact O-CB 3.28Å; E97-A101 WeakPolarHBondContact O-CB 3.33Å; E97-A101 PolarHBondContact O-N 2.86Å; D98-A101 PolarHBondContact O-N 3.41Å; V99-A101 VanDerWaalsContact C-N 3.35Å; A101-S104 PolarHBondContact O-N 3.04Å; A101-Y105 PolarHBondContact O-N 3.24Å
102	A	95	Very high	91.2	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-63.8	-45.6	173.4	0	0	0	0	0	112.2	V71 A75 L79 D98 S104 Y105 L106	V71-A102 HydrophobicContact CG1-CB 4.03Å; A75-A102 HydrophobicContact CB-CB 4.02Å; L79-A102 HydrophobicContact CD1-CB 3.56Å; D98-A102 WeakPolarHBondContact O-CB 3.19Å; D98-A102 PolarHBondContact O-N 2.88Å; A102-S104 VanDerWaalsContact C-N 3.3Å; A102-S104 PolarHBondContact O-N 3.42Å; A102-Y105 PolarHBondContact O-N 3.19Å; A102-L106 WeakPolarHBondContact O-CG 3.37Å; A102-L106 PolarHBondContact O-N 2.92Å
103	A	95.5	Very high	92.6	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-63.2	-36.4	176.7	0	0	0	0	0	112.1	L79 V99 L106 H107 M108 I111 V112	L79-A103 HydrophobicContact CD1-CB 4.18Å; L79-A103 HydrophobicContact CD2-CB 4.11Å; V99-A103 WeakPolarHBondContact O-CB 3.28Å; V99-A103 PolarHBondContact O-N 3.33Å; A103-L106 CarbonylContact O-C 3.59Å; A103-L106 PolarHBondContact O-N 3.15Å; A103-H107 PolarHBondContact O-N 3.12Å; A103-M108 HydrophobicContact CB-CB 4.25Å; A103-M108 PolarHBondContact O-N 2.9Å; A103-I111 HydrophobicContact CB-CB 4.05Å; A103-I111 HydrophobicContact CB-CG2 3.74Å; A103-V112 HydrophobicContact CB-CG2 3.77Å
104	S	95.5	Very high	93.5	Very high	50 Å²	50	41.1 Å²	41.1	35%	0.35	22%	0.216	S	C	.	.	H	α-helix	trans	-66.1	-40.2	175.3	-60.7	0	0	0	0	112	L100 A101 A102 H107	L100-S104 VanDerWaalsContact O-CB 3.27Å; L100-S104 WeakPolarHBondContact O-CB 3.37Å; L100-S104 PolarHBondContact O-N 2.85Å; L100-S104 PolarHBondContact O-OG 2.98Å; A101-S104 PolarHBondContact O-N 3.04Å; A102-S104 VanDerWaalsContact C-N 3.3Å; A102-S104 PolarHBondContact O-N 3.42Å; S104-H107 PolarHBondContact O-N 3.47Å; S104-H107 PolarHBondContact O-ND1 3.49Å
105	Y	94.6	Very high	93.7	Very high	72 Å²	72	40.3 Å²	40.3	28%	0.282	21%	0.211	S	C	.	.	H	α-helix	trans	-67.3	-38.6	175.5	-178.5	-100	0	0	0	112.7	F48 I66 N68 V71 A101 A102 H107	F48-Y105 HydrophobicContact CD2-CE1 4.42Å; F48-Y105 HydrophobicContact CE1-CE1 4.43Å; F48-Y105 AromaticContact CE2-CE1 3.77Å; F48-Y105 HydrophobicContact CE2-CE1 3.77Å; F48-Y105 AromaticContact CE2-CZ 3.83Å; F48-Y105 AromaticContact CZ-CE1 3.79Å; F48-Y105 HydrophobicContact CZ-CE1 3.79Å; I66-Y105 HydrophobicContact CG1-CE1 4.47Å; I66-Y105 HydrophobicContact CG2-CD1 4.36Å; I66-Y105 HydrophobicContact CG2-CE1 3.75Å; N68-Y105 HydrophobicContact CB-CD2 4.44Å; N68-Y105 HydrophobicContact CB-CE2 4.01Å; N68-Y105 WeakPolarHBondContact ND2-CD2 3.35Å; N68-Y105 VanDerWaalsContact ND2-CE2 3.28Å; N68-Y105 WeakPolarHBondContact ND2-CE2 3.36Å; V71-Y105 HydrophobicContact CG2-CD1 3.57Å; V71-Y105 HydrophobicContact CG2-CE1 4.25Å; V71-Y105 HydrophobicContact CG2-CG 3.75Å; A101-Y105 PolarHBondContact O-N 3.24Å; A102-Y105 PolarHBondContact O-N 3.19Å; Y105-H107 VanDerWaalsContact C-N 3.26Å; Y105-H107 PolarHBondContact O-N 3.38Å
106	L	94.6	Very high	93.9	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	4.1	176.9	-63.1	179.6	0	0	0	113.9	S46 F48 F49 I66 F76 L79 A102 A103 M108	S46-L106 PolarHBondContact OG-O 3.18Å; F48-L106 HydrophobicContact CB-CD2 4.48Å; F48-L106 HydrophobicContact CD1-CD2 3.55Å; F48-L106 HydrophobicContact CE1-CD2 3.97Å; F48-L106 HydrophobicContact CG-CD2 4.08Å; F49-L106 HydrophobicContact CD2-CD2 4.32Å; F49-L106 HydrophobicContact CE2-CD1 4.31Å; F49-L106 HydrophobicContact CE2-CD2 3.69Å; F49-L106 HydrophobicContact CZ-CD2 4.24Å; I66-L106 HydrophobicContact CD1-CD2 4.09Å; F76-L106 HydrophobicContact CD2-CD1 3.91Å; F76-L106 HydrophobicContact CE2-CD1 3.85Å; L79-L106 HydrophobicContact CD1-CD1 4.09Å; A102-L106 WeakPolarHBondContact O-CG 3.37Å; A102-L106 PolarHBondContact O-N 2.92Å; A103-L106 CarbonylContact O-C 3.59Å; A103-L106 PolarHBondContact O-N 3.15Å; L106-M108 HydrophobicContact CB-CG 3.87Å; L106-M108 HydrophobicContact CB-SD 4.02Å; L106-M108 HydrophobicContact CD1-SD 4.09Å; L106-M108 PolarHBondContact O-N 3.29Å
107	H	95.1	Very high	93.9	Very high	90 Å²	90	48.2 Å²	48.2	42%	0.417	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	31.2	-178.1	-56.1	-38.1	0	0	0	114.6	P47 A103 S104 Y105 N109	P47-H107 HydrophobicContact CB-CB 4.27Å; P47-H107 HydrophobicContact CG-CB 4.31Å; A103-H107 PolarHBondContact O-N 3.12Å; S104-H107 PolarHBondContact O-N 3.47Å; S104-H107 PolarHBondContact O-ND1 3.49Å; Y105-H107 VanDerWaalsContact C-N 3.26Å; Y105-H107 PolarHBondContact O-N 3.38Å; H107-N109 VanDerWaalsContact C-N 3.25Å; H107-N109 PolarHBondContact O-N 3.23Å; H107-N109 PolarHBondContact O-ND2 2.68Å
108	M	94.6	Very high	93.8	Very high	10 Å²	10	44.8 Å²	44.8	5%	0.049	22%	0.224	C	C	.	.			trans	-82.1	69.3	178	-59	178.7	85.3	0	0	110	L79 F82 M83 A103 L106 D110 I111 V112	L79-M108 HydrophobicContact CB-SD 4.23Å; L79-M108 HydrophobicContact CD1-SD 4.29Å; L79-M108 HydrophobicContact CD2-SD 4.2Å; L79-M108 HydrophobicContact CG-SD 4.48Å; F82-M108 HydrophobicContact CD1-CE 3.92Å; F82-M108 HydrophobicContact CE1-CE 4.05Å; M83-M108 HydrophobicContact CE-CE 4.34Å; M83-M108 HydrophobicContact CG-CE 3.69Å; M83-M108 HydrophobicContact SD-CE 4.03Å; A103-M108 HydrophobicContact CB-CB 4.25Å; A103-M108 PolarHBondContact O-N 2.9Å; L106-M108 HydrophobicContact CB-CG 3.87Å; L106-M108 HydrophobicContact CB-SD 4.02Å; L106-M108 HydrophobicContact CD1-SD 4.09Å; L106-M108 PolarHBondContact O-N 3.29Å; M108-D110 VanDerWaalsContact C-N 3.28Å; M108-D110 PolarHBondContact O-N 2.83Å; M108-D110 VanDerWaalsContact O-N 3.12Å; M108-I111 HydrophobicContact CB-CB 4.44Å; M108-I111 HydrophobicContact CB-CD1 4.13Å; M108-I111 HydrophobicContact CB-CG1 4.48Å; M108-I111 HydrophobicContact CE-CD1 3.66Å; M108-I111 PolarHBondContact O-N 2.95Å; M108-I111 VanDerWaalsContact O-N 3.14Å; M108-I111 HydrophobicContact SD-CD1 4.18Å; M108-V112 WeakPolarHBondContact O-CG2 3.44Å; M108-V112 PolarHBondContact O-N 3.04Å; M108-V112 VanDerWaalsContact O-N 3.11Å
109	N	93.8	Very high	93.7	Very high	95 Å²	95	44.4 Å²	44.4	51%	0.508	22%	0.221	S	C	.	.	H	α-helix	trans	-54.9	-34.8	-164.7	-73.2	-61.2	0	0	0	114.9	H107 V112 K113	H107-N109 VanDerWaalsContact C-N 3.25Å; H107-N109 PolarHBondContact O-N 3.23Å; H107-N109 PolarHBondContact O-ND2 2.68Å; N109-V112 WeakPolarHBondContact O-CB 3.33Å; N109-V112 PolarHBondContact O-N 2.85Å; N109-K113 WeakPolarHBondContact O-CG 3.39Å; N109-K113 PolarHBondContact O-N 3.04Å
110	D	91.8	Very high	93.7	Very high	88 Å²	88	50.3 Å²	50.3	47%	0.471	25%	0.249	S	C	.	.	H	α-helix	trans	-75.2	-34.6	-177.4	-57.5	-70.9	0	0	0	112.7	M108 V112 K113 V114	M108-D110 VanDerWaalsContact C-N 3.28Å; M108-D110 PolarHBondContact O-N 2.83Å; M108-D110 VanDerWaalsContact O-N 3.12Å; D110-V112 VanDerWaalsContact C-N 3.32Å; D110-K113 WeakPolarHBondContact O-CB 3.06Å; D110-K113 PolarHBondContact O-N 3.45Å; D110-K113 WeakPolarHBondContact OD1-CE 3.09Å; D110-K113 IonicContact OD1-NZ 2.66Å; D110-K113 PolarHBondContact OD1-NZ 3.13Å; D110-V114 WeakPolarHBondContact O-CG2 3.26Å; D110-V114 PolarHBondContact O-N 3.39Å; D110-V114 VanDerWaalsContact O-N 3.09Å
111	I	93.2	Very high	93.4	Very high	4 Å²	4	51.9 Å²	51.9	2%	0.021	27%	0.266	C	S	.	.	H	α-helix	trans	-64.2	-41.3	167.9	-58.9	177	0	0	0	109.9	L79 F82 L88 A103 M108 K113 V114 C115	L79-I111 HydrophobicContact CD2-CD1 3.54Å; L79-I111 HydrophobicContact CD2-CG2 3.96Å; F82-I111 HydrophobicContact CD1-CD1 3.61Å; F82-I111 HydrophobicContact CE1-CD1 3.74Å; F82-I111 HydrophobicContact CE1-CG1 4.37Å; F82-I111 HydrophobicContact CG-CD1 4.04Å; F82-I111 HydrophobicContact CZ-CD1 4.24Å; F82-I111 HydrophobicContact CZ-CG1 4.44Å; L88-I111 HydrophobicContact CD2-CG2 3.65Å; A103-I111 HydrophobicContact CB-CB 4.05Å; A103-I111 HydrophobicContact CB-CG2 3.74Å; M108-I111 HydrophobicContact CB-CB 4.44Å; M108-I111 HydrophobicContact CB-CD1 4.13Å; M108-I111 HydrophobicContact CB-CG1 4.48Å; M108-I111 HydrophobicContact CE-CD1 3.66Å; M108-I111 PolarHBondContact O-N 2.95Å; M108-I111 VanDerWaalsContact O-N 3.14Å; M108-I111 HydrophobicContact SD-CD1 4.18Å; I111-K113 VanDerWaalsContact C-N 3.31Å; I111-K113 PolarHBondContact O-N 2.88Å; I111-V114 PolarHBondContact O-N 3.07Å; I111-C115 WeakPolarHBondContact O-CB 3.25Å; I111-C115 PolarHBondContact O-N 3.35Å; I111-C115 PolarHBondContact O-SG 3.13Å
112	V	94.8	Very high	93.2	Very high	12 Å²	12	55.1 Å²	55.1	7%	0.073	27%	0.272	C	S	.	.	H	α-helix	trans	-60.5	-37.7	175.8	172.5	0	0	0	0	111.9	L100 A103 M108 N109 D110 K116	L100-V112 HydrophobicContact CD1-CB 4.2Å; L100-V112 HydrophobicContact CD1-CG1 3.83Å; L100-V112 HydrophobicContact CD1-CG2 4.31Å; A103-V112 HydrophobicContact CB-CG2 3.77Å; M108-V112 WeakPolarHBondContact O-CG2 3.44Å; M108-V112 PolarHBondContact O-N 3.04Å; M108-V112 VanDerWaalsContact O-N 3.11Å; N109-V112 WeakPolarHBondContact O-CB 3.33Å; N109-V112 PolarHBondContact O-N 2.85Å; D110-V112 VanDerWaalsContact C-N 3.32Å; V112-K116 HydrophobicContact CG1-CD 4.11Å; V112-K116 WeakPolarHBondContact O-CB 3.38Å; V112-K116 WeakPolarHBondContact O-CD 3.2Å; V112-K116 VanDerWaalsContact O-CG 3.23Å; V112-K116 WeakPolarHBondContact O-CG 3.28Å; V112-K116 PolarHBondContact O-N 2.97Å
113	K	93.4	Very high	93	Very high	120 Å²	120	57.8 Å²	57.8	52%	0.522	29%	0.294	S	S	.	.	H	α-helix	trans	-62.4	-54.4	172.9	-67	166.6	-164.3	168.1	0	110.9	N109 D110 I111 C115 K116 Q117	N109-K113 WeakPolarHBondContact O-CG 3.39Å; N109-K113 PolarHBondContact O-N 3.04Å; D110-K113 WeakPolarHBondContact O-CB 3.06Å; D110-K113 PolarHBondContact O-N 3.45Å; D110-K113 WeakPolarHBondContact OD1-CE 3.09Å; D110-K113 IonicContact OD1-NZ 2.66Å; D110-K113 PolarHBondContact OD1-NZ 3.13Å; I111-K113 VanDerWaalsContact C-N 3.31Å; I111-K113 PolarHBondContact O-N 2.88Å; K113-C115 PolarHBondContact O-N 2.75Å; K113-K116 PolarHBondContact O-N 3.47Å; K113-Q117 WeakPolarHBondContact O-CG 3.39Å; K113-Q117 PolarHBondContact O-N 3.08Å
114	V	91.9	Very high	92.8	Very high	37 Å²	37	63.2 Å²	63.2	22%	0.224	32%	0.322	C	S	.	.	H	α-helix	trans	-61.8	-45.1	-176.8	172.9	0	0	0	0	111.9	D110 I111 K116 Q117 R118 V297 V299	D110-V114 WeakPolarHBondContact O-CG2 3.26Å; D110-V114 PolarHBondContact O-N 3.39Å; D110-V114 VanDerWaalsContact O-N 3.09Å; I111-V114 PolarHBondContact O-N 3.07Å; V114-K116 PolarHBondContact O-N 3.2Å; V114-Q117 PolarHBondContact O-N 3.23Å; V114-R118 PolarHBondContact O-N 3.35Å; V114-V297 HydrophobicContact CG1-CG1 4.26Å; V114-V299 HydrophobicContact CG1-CG2 4.1Å; V114-V299 HydrophobicContact CG2-CG1 4.16Å; V114-V299 HydrophobicContact CG2-CG2 4.41Å
115	C	92.9	Very high	92.6	Very high	1 Å²	1	63.8 Å²	63.8	1%	0.007	33%	0.33	C	S	.	.	H	α-helix	trans	-65.5	-39.1	-179.6	-60.5	0	0	0	0	111.5	L96 L100 I111 K113 R118 L119	L96-C115 HydrophobicContact CD1-CB 3.75Å; L96-C115 HydrophobicContact CG-CB 4.29Å; L100-C115 HydrophobicContact CB-CB 3.86Å; L100-C115 HydrophobicContact CD1-CB 4.11Å; L100-C115 HydrophobicContact CG-CB 4.45Å; I111-C115 WeakPolarHBondContact O-CB 3.25Å; I111-C115 PolarHBondContact O-N 3.35Å; I111-C115 PolarHBondContact O-SG 3.13Å; K113-C115 PolarHBondContact O-N 2.75Å; C115-R118 PolarHBondContact O-N 3.42Å; C115-L119 WeakPolarHBondContact O-CB 3.4Å; C115-L119 VanDerWaalsContact O-CG 3.32Å; C115-L119 WeakPolarHBondContact O-CG 3.47Å; C115-L119 PolarHBondContact O-N 3.03Å
116	K	93.3	Very high	92.3	Very high	107 Å²	107	66.4 Å²	66.4	47%	0.465	35%	0.345	S	S	.	.	H	α-helix	trans	-61.9	-46.2	172.9	-76.4	172.7	-179.9	176	0	112.2	L100 V112 K113 V114 R118 L119 Q120	L100-K116 HydrophobicContact CD1-CG 3.92Å; L100-K116 HydrophobicContact CD2-CG 4Å; V112-K116 HydrophobicContact CG1-CD 4.11Å; V112-K116 WeakPolarHBondContact O-CB 3.38Å; V112-K116 WeakPolarHBondContact O-CD 3.2Å; V112-K116 VanDerWaalsContact O-CG 3.23Å; V112-K116 WeakPolarHBondContact O-CG 3.28Å; V112-K116 PolarHBondContact O-N 2.97Å; K113-K116 PolarHBondContact O-N 3.47Å; V114-K116 PolarHBondContact O-N 3.2Å; K116-R118 PolarHBondContact O-N 2.91Å; K116-L119 PolarHBondContact O-N 3.46Å; K116-Q120 WeakPolarHBondContact O-CB 3.42Å; K116-Q120 VanDerWaalsContact O-CG 3.28Å; K116-Q120 WeakPolarHBondContact O-CG 3.06Å; K116-Q120 PolarHBondContact O-N 2.87Å
117	Q	92.9	Very high	92	Very high	123 Å²	123	68.4 Å²	68.4	58%	0.575	36%	0.361	S	S	*	.	H	α-helix	trans	-60.6	-42.9	178.1	-73.7	171.8	-21.1	0	0	112.1	K113 V114 Q120 A121	K113-Q117 WeakPolarHBondContact O-CG 3.39Å; K113-Q117 PolarHBondContact O-N 3.08Å; V114-Q117 PolarHBondContact O-N 3.23Å; Q117-Q120 PolarHBondContact O-N 3.33Å; Q117-A121 WeakPolarHBondContact O-CB 3.39Å; Q117-A121 PolarHBondContact O-N 2.96Å
118	R	89.4	Confident	91.3	Very high	30 Å²	30	68.6 Å²	68.6	11%	0.113	37%	0.365	C	S	.	.	H	α-helix	trans	-73.4	-32	-179.7	-174.9	167.6	166.6	-147.4	-6.5	113.1	L96 V114 C115 K116 R122 E295	L96-R118 HydrophobicContact CD2-CB 3.88Å; L96-R118 HydrophobicContact CD2-CG 3.78Å; V114-R118 PolarHBondContact O-N 3.35Å; C115-R118 PolarHBondContact O-N 3.42Å; K116-R118 PolarHBondContact O-N 2.91Å; R118-R122 WeakPolarHBondContact O-CG 3.42Å; R118-R122 PolarHBondContact O-N 3.35Å; R118-R122 VanDerWaalsContact O-N 3.09Å; R118-E295 VanDerWaalsContact CZ-CD 3.46Å; R118-E295 IonicContact CZ-OE1 2.84Å; R118-E295 IonicContact CZ-OE2 2.76Å; R118-E295 IonicContact NE-OE1 2.64Å; R118-E295 PolarHBondContact NE-OE1 3.22Å; R118-E295 IonicContact NE-OE2 3.17Å; R118-E295 IonicContact NH2-OE1 3.97Å; R118-E295 PolarHBondContact NH2-OE1 3.01Å; R118-E295 VanDerWaalsContact NH2-OE1 3.17Å; R118-E295 IonicContact NH2-OE2 3.21Å; R118-E295 PolarHBondContact NH2-OE2 2.96Å
119	L	91.6	Very high	90.5	Very high	39 Å²	39	71.7 Å²	71.7	20%	0.204	39%	0.388	C	S	.	.	H	α-helix	trans	-64.9	-43.5	167.7	-72.4	173.7	0	0	0	112	L96 E97 L100 C115 K116 A121 R122 A123	L96-L119 HydrophobicContact CB-CD2 4.02Å; L96-L119 HydrophobicContact CD2-CD2 3.79Å; L96-L119 HydrophobicContact CD2-CG 3.75Å; L96-L119 HydrophobicContact CG-CD2 3.96Å; L96-L119 HydrophobicContact CG-CG 3.94Å; E97-L119 HydrophobicContact CG-CD2 4.26Å; E97-L119 WeakPolarHBondContact OE1-CD2 3.49Å; L100-L119 HydrophobicContact CD2-CD1 3.57Å; C115-L119 WeakPolarHBondContact O-CB 3.4Å; C115-L119 VanDerWaalsContact O-CG 3.32Å; C115-L119 WeakPolarHBondContact O-CG 3.47Å; C115-L119 PolarHBondContact O-N 3.03Å; K116-L119 PolarHBondContact O-N 3.46Å; L119-A121 VanDerWaalsContact C-N 3.35Å; L119-A121 PolarHBondContact O-N 3.18Å; L119-R122 PolarHBondContact O-N 3.24Å; L119-A123 PolarHBondContact O-N 3.28Å
120	Q	93.6	Very high	89.5	Confident	125 Å²	125	71.4 Å²	71.4	58%	0.584	39%	0.39	S	S	*	.	H	α-helix	trans	-61.9	-41.7	175.6	-73.4	169.7	-24.6	0	0	111.8	K116 Q117 A123 L124	K116-Q120 WeakPolarHBondContact O-CB 3.42Å; K116-Q120 VanDerWaalsContact O-CG 3.28Å; K116-Q120 WeakPolarHBondContact O-CG 3.06Å; K116-Q120 PolarHBondContact O-N 2.87Å; Q117-Q120 PolarHBondContact O-N 3.33Å; Q120-A123 PolarHBondContact O-N 3Å; Q120-L124 WeakPolarHBondContact O-CG 3.48Å; Q120-L124 PolarHBondContact O-N 3.14Å
121	A	90.6	Very high	88.2	Confident	58 Å²	58	73 Å²	73	48%	0.479	39%	0.393	S	S	.	.	H	α-helix	trans	-63.2	-40.7	176.1	0	0	0	0	0	112.8	Q117 L119 L124 A125	Q117-A121 WeakPolarHBondContact O-CB 3.39Å; Q117-A121 PolarHBondContact O-N 2.96Å; L119-A121 VanDerWaalsContact C-N 3.35Å; L119-A121 PolarHBondContact O-N 3.18Å; A121-L124 PolarHBondContact O-N 3.39Å; A121-A125 PolarHBondContact O-N 3.04Å
122	R	89.1	Confident	86.5	Confident	96 Å²	96	80.8 Å²	80.8	36%	0.362	43%	0.426	S	S	.	.	H	α-helix	trans	-63.8	-49.1	175.1	-74.3	175.2	175.7	-169.3	-4.7	111.8	R118 L119 L124 A125 E126 E295	R118-R122 WeakPolarHBondContact O-CG 3.42Å; R118-R122 PolarHBondContact O-N 3.35Å; R118-R122 VanDerWaalsContact O-N 3.09Å; L119-R122 PolarHBondContact O-N 3.24Å; R122-L124 VanDerWaalsContact C-N 3.28Å; R122-L124 PolarHBondContact O-N 3.29Å; R122-A125 PolarHBondContact O-N 3.11Å; R122-A125 VanDerWaalsContact O-N 3.1Å; R122-E126 WeakPolarHBondContact O-CG 3.46Å; R122-E126 PolarHBondContact O-N 3.01Å; R122-E295 IonicContact CZ-OE2 3.35Å; R122-E295 IonicContact NH2-OE2 2.7Å; R122-E295 PolarHBondContact NH2-OE2 3.45Å
123	A	90.6	Very high	84.7	Confident	56 Å²	56	88 Å²	88	46%	0.463	46%	0.459	S	S	.	.	H	α-helix	trans	-59.9	-35	177.5	0	0	0	0	0	113.2	L119 Q120 A127	L119-A123 PolarHBondContact O-N 3.28Å; Q120-A123 PolarHBondContact O-N 3Å; A123-A127 VanDerWaalsContact O-CB 3.27Å; A123-A127 WeakPolarHBondContact O-CB 3.48Å; A123-A127 PolarHBondContact O-N 2.95Å
124	L	92.1	Very high	82.8	Confident	115 Å²	115	90.9 Å²	90.9	60%	0.602	47%	0.474	S	S	*	.	H	α-helix	trans	-68.8	-44.7	173.2	-72.3	170.7	0	0	0	112	Q120 A121 R122 E126 A127 D128	Q120-L124 WeakPolarHBondContact O-CG 3.48Å; Q120-L124 PolarHBondContact O-N 3.14Å; A121-L124 PolarHBondContact O-N 3.39Å; R122-L124 VanDerWaalsContact C-N 3.28Å; R122-L124 PolarHBondContact O-N 3.29Å; L124-E126 VanDerWaalsContact C-N 3.32Å; L124-E126 PolarHBondContact O-N 3.15Å; L124-A127 PolarHBondContact O-N 2.78Å; L124-D128 PolarHBondContact O-N 3.28Å
125	A	90.2	Very high	80.7	Confident	62 Å²	62	95.7 Å²	95.7	51%	0.512	50%	0.499	S	S	.	.	H	α-helix	trans	-61.6	-39	177.3	0	0	0	0	0	112.5	A121 R122 D128 S129	A121-A125 PolarHBondContact O-N 3.04Å; R122-A125 PolarHBondContact O-N 3.11Å; R122-A125 VanDerWaalsContact O-N 3.1Å; A125-D128 PolarHBondContact O-N 3.08Å; A125-S129 VanDerWaalsContact O-CB 3.31Å; A125-S129 WeakPolarHBondContact O-CB 3.49Å; A125-S129 PolarHBondContact O-N 2.99Å
126	E	89.1	Confident	78.3	Confident	127 Å²	127	100.9 Å²	100.9	59%	0.593	53%	0.527	S	S	*	.	H	α-helix	trans	-65.3	-42.9	173.6	-70.3	162.5	-161.7	0	0	111.8	R122 L124 D128 S129 T130	R122-E126 WeakPolarHBondContact O-CG 3.46Å; R122-E126 PolarHBondContact O-N 3.01Å; L124-E126 VanDerWaalsContact C-N 3.32Å; L124-E126 PolarHBondContact O-N 3.15Å; E126-D128 VanDerWaalsContact C-N 3.31Å; E126-D128 PolarHBondContact O-N 3.18Å; E126-S129 PolarHBondContact O-N 3.03Å; E126-T130 WeakPolarHBondContact O-CG2 3.44Å; E126-T130 PolarHBondContact O-N 3.36Å; E126-T130 VanDerWaalsContact O-N 3.13Å; E126-T130 PolarHBondContact O-OG1 3.39Å
127	A	88.4	Confident	76.1	Confident	41 Å²	41	101.9 Å²	101.9	34%	0.339	54%	0.544	S	S	.	.	H	α-helix	trans	-70.1	-21.3	178.2	0	0	0	0	0	114.2	A123 L124 T130 K131	A123-A127 VanDerWaalsContact O-CB 3.27Å; A123-A127 WeakPolarHBondContact O-CB 3.48Å; A123-A127 PolarHBondContact O-N 2.95Å; L124-A127 PolarHBondContact O-N 2.78Å; A127-T130 PolarHBondContact O-OG1 2.92Å; A127-K131 WeakPolarHBondContact O-CD 3.48Å; A127-K131 WeakPolarHBondContact O-CE 3.45Å; A127-K131 WeakPolarHBondContact O-CG 3.38Å; A127-K131 PolarHBondContact O-NZ 3.25Å
128	D	81.1	Confident	73.9	Confident	94 Å²	94	99.4 Å²	99.4	50%	0.503	54%	0.544	S	S	.	.	H	α-helix	trans	-95.2	-27.8	174.1	-73.8	-21.1	0	0	0	112.8	L124 A125 E126 K131	L124-D128 PolarHBondContact O-N 3.28Å; A125-D128 PolarHBondContact O-N 3.08Å; E126-D128 VanDerWaalsContact C-N 3.31Å; E126-D128 PolarHBondContact O-N 3.18Å; D128-K131 IonicContact OD1-NZ 2.61Å; D128-K131 PolarHBondContact OD1-NZ 3.03Å
129	S	76.9	Confident	71.6	Confident	76 Å²	76	103.7 Å²	103.7	53%	0.531	58%	0.579	S	S	.	*	H	α-helix	trans	-63.9	-45.8	170.8	-168.4	0	0	0	0	111.7	A125 E126 K131 K132 E133	A125-S129 VanDerWaalsContact O-CB 3.31Å; A125-S129 WeakPolarHBondContact O-CB 3.49Å; A125-S129 PolarHBondContact O-N 2.99Å; E126-S129 PolarHBondContact O-N 3.03Å; S129-K131 PolarHBondContact O-N 3.29Å; S129-K132 WeakPolarHBondContact O-CB 3.42Å; S129-K132 PolarHBondContact O-N 3.12Å; S129-E133 PolarHBondContact O-N 3.24Å
130	T	72.1	Confident	68.8	Low	89 Å²	89	109.9 Å²	109.9	55%	0.546	61%	0.609	S	S	.	*	H	α-helix	trans	-59	-41	180	40.8	0	0	0	0	113.3	E126 A127 K132 E133	E126-T130 WeakPolarHBondContact O-CG2 3.44Å; E126-T130 PolarHBondContact O-N 3.36Å; E126-T130 VanDerWaalsContact O-N 3.13Å; E126-T130 PolarHBondContact O-OG1 3.39Å; A127-T130 PolarHBondContact O-OG1 2.92Å; T130-K132 PolarHBondContact O-N 2.67Å; T130-E133 PolarHBondContact O-N 3.33Å
131	K	64.8	Low	66.2	Low	122 Å²	122	112.9 Å²	112.9	53%	0.53	62%	0.623	S	S	.	*	H	α-helix	trans	-64.8	-22.5	174.6	-62.5	167.7	-163.2	148	0	113.6	A127 D128 S129	A127-K131 WeakPolarHBondContact O-CD 3.48Å; A127-K131 WeakPolarHBondContact O-CE 3.45Å; A127-K131 WeakPolarHBondContact O-CG 3.38Å; A127-K131 PolarHBondContact O-NZ 3.25Å; D128-K131 IonicContact OD1-NZ 2.61Å; D128-K131 PolarHBondContact OD1-NZ 3.03Å; S129-K131 PolarHBondContact O-N 3.29Å
132	K	58.1	Low	63.4	Low	167 Å²	167	118.9 Å²	118.9	73%	0.726	64%	0.639	S	S	*	*	H	α-helix	trans	-81.2	-29.1	-177.1	-165.7	177.7	177.4	-175.8	0	112.4	S129 T130	S129-K132 WeakPolarHBondContact O-CB 3.42Å; S129-K132 PolarHBondContact O-N 3.12Å; T130-K132 PolarHBondContact O-N 2.67Å
133	E	56.7	Low	61	Low	162 Å²	162	121.6 Å²	121.6	76%	0.757	66%	0.66	S	S	*	*	H	α-helix	trans	-73.5	-40.4	173.4	-66.4	-151.9	108.4	0	0	112.3	S129 T130 N135 N136	S129-E133 PolarHBondContact O-N 3.24Å; T130-E133 PolarHBondContact O-N 3.33Å; E133-N135 PolarHBondContact O-N 3.46Å; E133-N135 VanDerWaalsContact O-N 3.11Å; E133-N136 PolarHBondContact O-N 3.01Å; E133-N136 VanDerWaalsContact O-N 3.13Å
134	E	54	Low	58.4	Low	181 Å²	181	124.9 Å²	124.9	85%	0.846	68%	0.679	S	S	*	*	H	α-helix	trans	-58.1	-25.8	175.5	-99.4	-168.6	114	0	0	113.4
135	N	47.1	Very low	55.5	Low	139 Å²	139	123.2 Å²	123.2	74%	0.743	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	18.6	-179.2	-162.5	38.4	0	0	0	114.1	E133 P137	E133-N135 PolarHBondContact O-N 3.46Å; E133-N135 VanDerWaalsContact O-N 3.11Å; N135-P137 WeakPolarHBondContact O-CD 3.17Å
136	N	42.2	Very low	52.6	Low	110 Å²	110	126.5 Å²	126.5	59%	0.588	71%	0.709	S	S	*	*			trans	-122.3	65.4	176.4	-169.7	26.5	0	0	0	114.4	E133 A138	E133-N136 PolarHBondContact O-N 3.01Å; E133-N136 VanDerWaalsContact O-N 3.13Å; N136-A138 PolarHBondContact O-N 3.49Å
137	P	48	Very low	50	Low	128 Å²	128	124.6 Å²	124.6	83%	0.831	71%	0.71	S	S	*	*			trans	-77.9	36.8	-179.2	35.1	-38.5	0	0	0	114.2	N135	N135-P137 WeakPolarHBondContact O-CD 3.17Å
138	A	46.4	Very low	47.3	Very low	70 Å²	70	134.2 Å²	134.2	58%	0.579	74%	0.737	S	S	*	*			trans	-158.1	81.3	179.8	0	0	0	0	0	114.8	N136	N136-A138 PolarHBondContact O-N 3.49Å
139	S	40.9	Very low	45	Very low	121 Å²	121	133.2 Å²	133.2	85%	0.846	75%	0.749	S	S	*	*			trans	177	85.3	141.1	-79.5	0	0	0	0	112
140	M	33.5	Very low	43.5	Very low	168 Å²	168	135.7 Å²	135.7	83%	0.828	76%	0.763	S	S	*	*			trans	-119.6	105.4	157.1	-95.9	-168.3	174.3	0	0	108.9	F142	M140-F142 HydrophobicContact CB-CD2 4.42Å; M140-F142 PolarHBondContact O-N 3.2Å; M140-F142 HydrophobicContact SD-CE2 3.92Å
141	E	38.7	Very low	41.8	Very low	188 Å²	188	139.5 Å²	139.5	88%	0.879	78%	0.775	S	S	*	*			trans	-73.9	119	164.9	-65.5	-169.9	112.4	0	0	109.1
142	F	32.1	Very low	40.6	Very low	185 Å²	185	138.7 Å²	138.7	81%	0.811	78%	0.782	S	S	*	*			trans	-111.1	102.8	172	-105.1	-81.5	0	0	0	110.1	M140	M140-F142 HydrophobicContact CB-CD2 4.42Å; M140-F142 PolarHBondContact O-N 3.2Å; M140-F142 HydrophobicContact SD-CE2 3.92Å
143	L	38.4	Very low	39.2	Very low	152 Å²	152	137.9 Å²	137.9	80%	0.796	79%	0.785	S	S	*	*			trans	-104.4	123.7	167.7	-71.5	176.8	0	0	0	110.2
144	S	36	Very low	38	Very low	126 Å²	126	136.8 Å²	136.8	88%	0.881	78%	0.784	S	S	*	*			trans	37.5	129.9	153.4	-57.9	0	0	0	0	120.3
145	G	30.1	Very low	36.6	Very low	80 Å²	80	133.1 Å²	133.1	83%	0.825	78%	0.784	S	S	*	*			cis	132.5	146.1	3.8	0	0	0	0	0	112.5
146	S	29.4	Very low	35.7	Very low	130 Å²	130	131.3 Å²	131.3	91%	0.909	78%	0.782	S	S	*	*			trans	-158.4	173.9	165.8	-164.3	0	0	0	0	110.9
147	S	34.9	Very low	35	Very low	87 Å²	87	132.9 Å²	132.9	61%	0.608	80%	0.795	S	S	*	*			trans	-142.3	161	-157.9	70.3	0	0	0	0	116.4
148	R	32.9	Very low	34.1	Very low	244 Å²	244	134 Å²	134	92%	0.921	79%	0.789	S	S	*	*			trans	75.1	136.5	174.7	-47.4	166.6	-170.9	-159.5	-1.2	113.4
149	G	32.4	Very low	33.8	Very low	72 Å²	72	135.8 Å²	135.8	74%	0.742	80%	0.795	S	S	*	*			cis	101.5	143.5	4.3	0	0	0	0	0	113
150	P	43.8	Very low	33.3	Very low	129 Å²	129	134.9 Å²	134.9	84%	0.838	79%	0.789	S	S	*	*			cis	-126.4	-175.1	6.9	43.1	-28	0	0	0	115.6
151	Q	36.7	Very low	33.1	Very low	169 Å²	169	131.1 Å²	131.1	79%	0.79	78%	0.784	S	S	*	*			trans	-90.2	157.2	168.5	-85.9	-79.9	-3	0	0	111.8
152	P	39.7	Very low	32.3	Very low	105 Å²	105	133.3 Å²	133.3	68%	0.682	79%	0.785	S	S	*	*				-150.7	148.2	103.4	38.2	-21.5	0	0	0	117.6
153	L	28.8	Very low	32.1	Very low	150 Å²	150	135.7 Å²	135.7	79%	0.785	79%	0.788	S	S	*	*			trans	35.3	144.1	130.5	-53.9	173.5	0	0	0	120.1
154	L	31.2	Very low	31.4	Very low	139 Å²	139	132.3 Å²	132.3	73%	0.728	78%	0.778	S	S	*	*			cis	-168.6	145.9	19	-135.2	168	0	0	0	110.5
155	A	24.6	Very low	31	Very low	103 Å²	103	133.2 Å²	133.2	85%	0.851	77%	0.766	S	S	*	*			trans	-162.8	133.3	151.5	0	0	0	0	0	110.7
156	S	28.7	Very low	31.2	Very low	101 Å²	101	136.9 Å²	136.9	71%	0.706	76%	0.761	S	S	*	*			trans	-112	158.1	179.8	-51.8	0	0	0	0	111.5
157	V	27.1	Very low	31.2	Very low	143 Å²	143	136 Å²	136	87%	0.867	74%	0.743	S	S	*	*				-174.6	130.7	125.7	144.6	0	0	0	0	110.2
158	E	29.2	Very low	30.9	Very low	151 Å²	151	141.1 Å²	141.1	71%	0.706	75%	0.749	S	S	*	*			trans	-135.8	155.7	155.4	-149.5	-144.1	115.7	0	0	105.5	S160	E158-S160 PolarHBondContact OE1-N 3.23Å
159	P	40.6	Very low	30.5	Very low	108 Å²	108	136.6 Å²	136.6	70%	0.701	74%	0.736	S	S	*	*				-155.7	148.2	89.2	39.5	-20.4	0	0	0	117.4
160	S	30.6	Very low	30.4	Very low	102 Å²	102	136 Å²	136	71%	0.713	73%	0.73	S	S	*	*				46.5	152.9	128.8	-69.7	0	0	0	0	122.4	E158	E158-S160 PolarHBondContact OE1-N 3.23Å
161	A	30.1	Very low	30.4	Very low	89 Å²	89	136.7 Å²	136.7	74%	0.736	74%	0.735	S	S	*	*			cis	-175.2	166.4	-14.4	0	0	0	0	0	109.4
162	R	21.2	Very low	29.9	Very low	234 Å²	234	133.1 Å²	133.1	88%	0.883	73%	0.734	S	S	*	*			trans	-157	121.2	158.1	-165.6	160.5	-73.5	-161.3	-3.1	114.7
163	W	27	Very low	29.3	Very low	235 Å²	235	134.5 Å²	134.5	89%	0.89	74%	0.74	S	S	*	*			trans	-12.6	155.8	152.3	-98.8	-103.6	0	0	0	118.3
164	S	25.2	Very low	29.8	Very low	81 Å²	81	132.8 Å²	132.8	57%	0.566	74%	0.738	S	S	*	*			cis	-175.3	147.4	-20.6	-89.4	0	0	0	0	106.6
165	K	28.1	Very low	29.9	Very low	146 Å²	146	134 Å²	134	64%	0.635	75%	0.745	S	S	*	*				60	138.4	74.2	-149.5	-132	168.9	-163.9	0	116.9	E167	K165-E167 VanDerWaalsContact CE-OE2 3.29Å; K165-E167 WeakPolarHBondContact CE-OE2 3.46Å; K165-E167 IonicContact NZ-OE1 3.96Å; K165-E167 PolarHBondContact NZ-OE1 2.92Å; K165-E167 IonicContact NZ-OE2 2.85Å; K165-E167 PolarHBondContact NZ-OE2 3.41Å
166	E	32.6	Very low	30.7	Very low	157 Å²	157	134 Å²	134	73%	0.734	74%	0.736	S	S	*	*			trans	130.8	148.9	155.1	-76.1	159	-138.4	0	0	111.5
167	E	30.8	Very low	30.5	Very low	112 Å²	112	136.9 Å²	136.9	52%	0.523	74%	0.742	S	S	.	*			cis	-171.8	173.8	-28	-151.4	94.8	69.1	0	0	105.6	K165	K165-E167 VanDerWaalsContact CE-OE2 3.29Å; K165-E167 WeakPolarHBondContact CE-OE2 3.46Å; K165-E167 IonicContact NZ-OE1 3.96Å; K165-E167 PolarHBondContact NZ-OE1 2.92Å; K165-E167 IonicContact NZ-OE2 2.85Å; K165-E167 PolarHBondContact NZ-OE2 3.41Å
168	W	27.7	Very low	30.5	Very low	193 Å²	193	133.3 Å²	133.3	73%	0.731	73%	0.727	S	S	*	*			cis	-162.3	-178.7	-2.6	-132.8	2.4	0	0	0	105.7
169	K	25.6	Very low	30.3	Very low	149 Å²	149	135 Å²	135	65%	0.648	74%	0.735	S	S	*	*			cis	-165.6	175.3	-3	-146.3	166.4	-162.8	159	0	109.2
170	G	28.6	Very low	29.5	Very low	59 Å²	59	134.9 Å²	134.9	61%	0.608	74%	0.736	S	S	*	*			trans	-88.7	-169.4	159.5	0	0	0	0	0	113
171	P	44	Very low	29.4	Very low	145 Å²	145	134.8 Å²	134.8	94%	0.942	74%	0.742	S	S	*	*				-153	-161	80.2	42.9	-22.8	0	0	0	116.6
172	A	27.7	Very low	29.2	Very low	94 Å²	94	138.5 Å²	138.5	78%	0.777	75%	0.75	S	S	*	*			trans	-101.6	-178.5	-158.7	0	0	0	0	0	117.6
173	T	26.5	Very low	29.6	Very low	133 Å²	133	135 Å²	135	82%	0.816	74%	0.743	S	S	*	*			trans	-67.4	151	-177.5	-23.3	0	0	0	0	115.7
174	P	39.4	Very low	30.9	Very low	114 Å²	114	128.9 Å²	128.9	74%	0.74	73%	0.734	S	S	*	*				-142.1	172.8	127.1	38.7	-25.4	0	0	0	115.2
175	L	33.6	Very low	31.1	Very low	165 Å²	165	129.4 Å²	129.4	86%	0.864	74%	0.743	S	S	*	*			trans	-114.6	164.7	163.6	-76.1	172.3	0	0	0	108
176	P	39.8	Very low	31.3	Very low	103 Å²	103	125.6 Å²	125.6	67%	0.669	75%	0.745	S	S	*	*			cis	-148.7	-172.7	30.9	43.8	-23.1	0	0	0	118.2
177	I	26.1	Very low	31.2	Very low	161 Å²	161	124.6 Å²	124.6	83%	0.826	76%	0.756	S	S	*	*			trans	72.6	148.1	152.9	-80.9	166.4	0	0	0	118.5
178	A	25.9	Very low	31.1	Very low	68 Å²	68	123 Å²	123	56%	0.562	77%	0.769	S	S	*	*			cis	-169.8	-177.6	-27.5	0	0	0	0	0	111.2
179	H	25.5	Very low	31.3	Very low	186 Å²	186	117.3 Å²	117.3	86%	0.861	77%	0.771	S	S	*	*			trans	71.7	149.1	175.7	-49.5	-73.5	0	0	0	116
180	S	24.7	Very low	31.7	Very low	106 Å²	106	116.3 Å²	116.3	74%	0.741	78%	0.777	S	S	*	*			cis	-149.3	130.3	-3.1	46.7	0	0	0	0	108.3
181	A	28.1	Very low	31.9	Very low	101 Å²	101	120.4 Å²	120.4	84%	0.835	79%	0.785	S	S	*	*				70.9	110.7	79.1	0	0	0	0	0	116.3
182	D	26.1	Very low	31.4	Very low	167 Å²	167	119.5 Å²	119.5	89%	0.893	78%	0.776	S	S	*	*			trans	-159	168.2	136.4	-139.5	-35.1	0	0	0	110.7
183	E	28.9	Very low	31.6	Very low	159 Å²	159	121.4 Å²	121.4	74%	0.743	78%	0.779	S	S	*	*			trans	-140.8	-162.2	-169.8	-115.1	-99.5	111.4	0	0	108.6
184	P	53.3	Low	31.8	Very low	108 Å²	108	123.4 Å²	123.4	70%	0.701	78%	0.779	S	S	*	*			cis	-131.2	174.5	-7.1	38.8	-20.9	0	0	0	118.1
185	A	29.3	Very low	32.3	Very low	92 Å²	92	123 Å²	123	76%	0.76	78%	0.776	S	S	*	*			trans	118.2	138.5	138.4	0	0	0	0	0	117.9
186	G	32.3	Very low	31.9	Very low	66 Å²	66	120.1 Å²	120.1	68%	0.68	77%	0.77	S	S	*	*			cis	165.8	142.9	-9.5	0	0	0	0	0	115.3
187	S	31.7	Very low	31.6	Very low	136 Å²	136	122.9 Å²	122.9	95%	0.951	78%	0.776	S	S	*	*			trans	67.6	146.2	176.3	74.9	0	0	0	0	118.3
188	G	28.6	Very low	31.8	Very low	77 Å²	77	122.7 Å²	122.7	79%	0.794	77%	0.771	S	S	*	*			cis	167.7	145.9	-11.9	0	0	0	0	0	114.8
189	G	31.2	Very low	32.1	Very low	75 Å²	75	125.5 Å²	125.5	77%	0.773	78%	0.781	S	S	*	*			trans	89.3	119.1	173.3	0	0	0	0	0	115.4
190	V	34.7	Very low	32.1	Very low	128 Å²	128	124 Å²	124	78%	0.776	78%	0.779	S	S	*	*			cis	96.8	105.1	15.5	-173.7	0	0	0	0	116.3
191	D	31.8	Very low	32.5	Very low	145 Å²	145	122.8 Å²	122.8	78%	0.775	77%	0.771	S	S	*	*			trans	46.1	159.6	147.7	-58.7	-34.2	0	0	0	121.4
192	T	34.3	Very low	33.6	Very low	125 Å²	125	124.2 Å²	124.2	77%	0.767	77%	0.772	S	S	*	*			cis	-156.9	179.2	17.4	-22.4	0	0	0	0	111.8
193	T	31.6	Very low	33.8	Very low	134 Å²	134	126 Å²	126	82%	0.822	77%	0.766	S	S	*	*			trans	92.7	136.5	151.2	-2	0	0	0	0	121.4
194	Q	31.7	Very low	33.8	Very low	176 Å²	176	125.2 Å²	125.2	82%	0.822	77%	0.766	S	S	*	*			trans	-86.2	-179.1	159.5	-81.5	-164.3	-25.6	0	0	110.4
195	P	48.1	Very low	32.6	Very low	105 Å²	105	131.3 Å²	131.3	68%	0.682	78%	0.775	S	S	*	*			cis	-142.4	-176.6	12.9	44.5	-25.7	0	0	0	118.5
196	S	25.5	Very low	32.6	Very low	105 Å²	105	131.1 Å²	131.1	73%	0.734	77%	0.774	S	S	*	*			trans	90.7	146.2	145.4	-62.2	0	0	0	0	122.1
197	M	33.5	Very low	33.8	Very low	160 Å²	160	133.8 Å²	133.8	79%	0.788	78%	0.779	S	S	*	*			trans	71.7	136.6	167.3	-43.8	-169.5	89.8	0	0	116.6
198	E	31.2	Very low	34.3	Very low	158 Å²	158	133.2 Å²	133.2	74%	0.738	77%	0.772	S	S	*	*			cis	-159	165.9	-12.1	-124.1	-177.7	153.5	0	0	111.1
199	V	32.3	Very low	34.8	Very low	127 Å²	127	138.1 Å²	138.1	77%	0.77	77%	0.774	S	S	*	*			trans	41.3	94	161.3	178.6	0	0	0	0	117.5
200	D	26	Very low	36.4	Very low	153 Å²	153	139.5 Å²	139.5	82%	0.818	77%	0.77	S	S	*	*				88.3	165	80.6	-147.9	-86	0	0	0	114.6
201	S	31.6	Very low	36.1	Very low	82 Å²	82	140.8 Å²	140.8	57%	0.573	78%	0.777	S	S	*	*			trans	-125.6	153.1	-151.9	-68.4	0	0	0	0	115.3	R203	S201-R203 PolarHBondContact O-N 3.46Å
202	P	51	Low	36.2	Very low	130 Å²	130	138.3 Å²	138.3	84%	0.844	78%	0.777	S	S	*	*			trans	-75.8	121.9	171.5	31	-33.4	0	0	0	111.5
203	R	32	Very low	35.8	Very low	206 Å²	206	139.5 Å²	139.5	78%	0.777	78%	0.778	S	S	*	*			trans	-146.8	118.1	175.6	-81.2	-163.9	175.6	-101.1	-5.1	116.3	S201	S201-R203 PolarHBondContact O-N 3.46Å
204	L	28.7	Very low	35.8	Very low	142 Å²	142	139.2 Å²	139.2	74%	0.743	78%	0.777	S	S	*	*			trans	69.9	161.8	146.7	-51.8	171.1	0	0	0	115.3
205	R	27	Very low	35.8	Very low	236 Å²	236	136.7 Å²	136.7	89%	0.891	78%	0.778	S	S	*	*			cis	-147	172.4	15.3	-158	166	-175.9	140.3	1.8	111.7
206	A	30.4	Very low	35	Very low	88 Å²	88	135.5 Å²	135.5	73%	0.727	78%	0.777	S	S	*	*			trans	-95.2	-160.5	-176.8	0	0	0	0	0	113.6
207	P	56.8	Low	35.4	Very low	121 Å²	121	135.7 Å²	135.7	79%	0.786	78%	0.779	S	S	*	*				-99.8	179.2	-112	44.6	-33	0	0	0	113.8
208	P	42.7	Very low	35.4	Very low	125 Å²	125	135.6 Å²	135.6	81%	0.812	78%	0.781	S	S	*	*				-150	-176.7	86.7	41.1	-22.3	0	0	0	116.2
209	Q	38.9	Very low	35.3	Very low	180 Å²	180	132 Å²	132	84%	0.841	78%	0.778	S	S	*	*			trans	-101.4	178.7	165.3	-72.8	-94.8	-9.7	0	0	109.4
210	P	64.3	Low	35.4	Very low	104 Å²	104	131.4 Å²	131.4	68%	0.675	78%	0.779	S	S	*	*			cis	-127.4	172.4	-32.8	37.7	-23.1	0	0	0	113
211	V	29.5	Very low	37.1	Very low	155 Å²	155	129.7 Å²	129.7	94%	0.939	78%	0.776	S	S	*	*			trans	-152.1	170.5	160.3	-85.4	0	0	0	0	111.4
212	A	33.3	Very low	36.9	Very low	92 Å²	92	132 Å²	132	76%	0.76	79%	0.792	S	S	*	*			trans	-115.8	-155.8	-170.4	0	0	0	0	0	114
213	D	26	Very low	36.1	Very low	150 Å²	150	131 Å²	131	80%	0.802	79%	0.789	S	S	*	*			trans	70.3	127.9	-170.3	-62.7	-40.3	0	0	0	115.6
214	V	31.8	Very low	36.8	Very low	129 Å²	129	126 Å²	126	78%	0.782	79%	0.786	S	S	*	*			cis	96.6	100.6	26.5	178.4	0	0	0	0	114.2
215	S	31.6	Very low	37.2	Very low	122 Å²	122	125.5 Å²	125.5	85%	0.853	79%	0.788	S	S	*	*			trans	166	149.5	148.8	38	0	0	0	0	108.9
216	A	30.8	Very low	37.7	Very low	81 Å²	81	122.8 Å²	122.8	67%	0.669	79%	0.786	S	S	*	*			cis	-154.4	136.8	-17.9	0	0	0	0	0	106.5
217	S	33.3	Very low	37.7	Very low	109 Å²	109	125 Å²	125	76%	0.762	79%	0.79	S	S	*	*				67.4	154.1	104.3	-44.4	0	0	0	0	115.1
218	L	34.2	Very low	36.5	Very low	158 Å²	158	126.8 Å²	126.8	83%	0.827	79%	0.792	S	S	*	*			cis	-136.9	147.1	17	-77.4	166.7	0	0	0	109.2
219	A	28.8	Very low	36.8	Very low	83 Å²	83	126.1 Å²	126.1	69%	0.686	79%	0.787	S	S	*	*				68.1	146	76.4	0	0	0	0	0	114.4
220	S	34.1	Very low	36.3	Very low	113 Å²	113	123.2 Å²	123.2	79%	0.79	78%	0.782	S	S	*	*			cis	-160.7	173.2	6.8	-125.3	0	0	0	0	112.4
221	P	62.5	Low	34.6	Very low	117 Å²	117	124.7 Å²	124.7	76%	0.76	78%	0.784	S	S	*	*			trans	-99	-172.1	-179.6	41	-35.4	0	0	0	113.6
222	S	27.1	Very low	34.7	Very low	130 Å²	130	126.5 Å²	126.5	91%	0.909	78%	0.775	S	S	*	*			trans	-153.1	161.6	167.4	-92	0	0	0	0	113.6
223	S	34.5	Very low	34.5	Very low	111 Å²	111	130.9 Å²	130.9	78%	0.776	78%	0.777	S	S	*	*			trans	-154.9	162.6	-177.7	171.7	0	0	0	0	111.9
224	S	45.9	Very low	34.6	Very low	101 Å²	101	128.8 Å²	128.8	71%	0.706	77%	0.774	S	S	*	*			trans	113.7	165.6	143.3	-54.2	0	0	0	0	120.2
225	T	38.4	Very low	34.6	Very low	130 Å²	130	128.7 Å²	128.7	80%	0.798	78%	0.78	S	S	*	*			trans	94.3	88.3	160.8	69.5	0	0	0	0	123
226	E	36.4	Very low	34.5	Very low	179 Å²	179	125.8 Å²	125.8	84%	0.836	77%	0.769	S	S	*	*				55.8	145.7	118.8	-60.7	-149.5	93.5	0	0	127.9
227	T	30	Very low	34.8	Very low	135 Å²	135	130.3 Å²	130.3	83%	0.828	78%	0.781	S	S	*	*			trans	93.9	151.2	147.1	35.8	0	0	0	0	124.3
228	I	31.3	Very low	34.7	Very low	159 Å²	159	129.3 Å²	129.3	82%	0.815	78%	0.78	S	S	*	*			trans	-104.5	-176.7	-161.9	9.8	172.6	0	0	0	112.3
229	P	49.5	Very low	34.4	Very low	110 Å²	110	126.4 Å²	126.4	71%	0.714	78%	0.778	S	S	*	*			cis	-149.7	-169.2	26.3	31	-2.1	0	0	0	119.7
230	V	28.3	Very low	34.3	Very low	119 Å²	119	128.9 Å²	128.9	72%	0.721	78%	0.784	S	S	*	*			trans	102	99.9	150.1	-165.7	0	0	0	0	122.9
231	N	30	Very low	34	Very low	135 Å²	135	128.6 Å²	128.6	72%	0.722	78%	0.783	S	S	*	*			trans	46.8	155.7	131	-59.6	2.1	0	0	0	127.9
232	Y	29.8	Very low	32.5	Very low	194 Å²	194	129.9 Å²	129.9	76%	0.761	79%	0.788	S	S	*	*			trans	77.8	139.4	165	-71.8	-79.2	0	0	0	117.4
233	F	29.9	Very low	32.5	Very low	183 Å²	183	131.8 Å²	131.8	80%	0.803	78%	0.782	S	S	*	*			cis	-131.3	176.6	10.5	-120.6	-80	0	0	0	113
234	S	28.1	Very low	33.6	Very low	106 Å²	106	131.2 Å²	131.2	74%	0.741	78%	0.776	S	S	*	*			trans	-141.5	158.6	-178	-47.6	0	0	0	0	113.6
235	S	32.7	Very low	32.6	Very low	128 Å²	128	134.4 Å²	134.4	90%	0.895	78%	0.784	S	S	*	*			trans	145.3	145.9	150.5	-68.4	0	0	0	0	111.3
236	G	29.1	Very low	32.1	Very low	61 Å²	61	134 Å²	134	63%	0.629	78%	0.782	S	S	*	*			cis	-160.5	150.6	-5.4	0	0	0	0	0	109.8
237	L	36.9	Very low	32.5	Very low	175 Å²	175	131 Å²	131	92%	0.916	78%	0.778	S	S	*	*				77.3	137.1	86.2	-71.6	-180	0	0	0	114.2
238	A	30.6	Very low	32.2	Very low	89 Å²	89	132 Å²	132	74%	0.736	78%	0.777	S	S	*	*			cis	-153.4	167.4	1.5	0	0	0	0	0	113.2
239	A	28.9	Very low	32	Very low	96 Å²	96	130.3 Å²	130.3	79%	0.793	77%	0.77	S	S	*	*			trans	-127.3	167.5	160	0	0	0	0	0	109.7
240	V	26.5	Very low	30.9	Very low	135 Å²	135	133.1 Å²	133.1	82%	0.818	78%	0.776	S	S	*	*			trans	-129.9	117.2	-174.5	-174.5	0	0	0	0	106.8
241	S	28.1	Very low	31.2	Very low	108 Å²	108	133.1 Å²	133.1	76%	0.755	78%	0.776	S	S	*	*				65	135.8	75.9	-85	0	0	0	0	113.1
242	V	29.5	Very low	31.8	Very low	143 Å²	143	132.2 Å²	132.2	87%	0.867	78%	0.777	S	S	*	*			cis	-139.8	174.7	12.9	-173.4	0	0	0	0	110.6
243	E	28.9	Very low	31.6	Very low	171 Å²	171	131.9 Å²	131.9	80%	0.799	78%	0.782	S	S	*	*			trans	-94.6	-154.6	-176.8	-154.9	-157.6	122.3	0	0	113.7
244	P	56.6	Low	31.7	Very low	98 Å²	98	127.9 Å²	127.9	64%	0.636	78%	0.777	S	S	*	*				-102.8	179.4	-112.1	42.9	-33.3	0	0	0	116.9
245	L	24.6	Very low	31.6	Very low	168 Å²	168	130.1 Å²	130.1	88%	0.88	78%	0.78	S	S	*	*			trans	-166.6	160.9	138.2	-107.3	171.5	0	0	0	112.6
246	T	29.1	Very low	31.5	Very low	123 Å²	123	134.5 Å²	134.5	76%	0.755	78%	0.777	S	S	*	*			trans	-151.4	179.6	177.8	62.8	0	0	0	0	109.7
247	P	43.6	Very low	31.3	Very low	116 Å²	116	138.1 Å²	138.1	75%	0.753	79%	0.786	S	S	*	*			cis	-121.8	-179.4	-33.1	38.5	-25.8	0	0	0	111.9
248	L	24.7	Very low	30.9	Very low	154 Å²	154	136 Å²	136	81%	0.806	78%	0.781	S	S	*	*			trans	-165.8	152.4	146.6	-104.2	-172.8	0	0	0	115
249	D	26.8	Very low	31.1	Very low	125 Å²	125	140.7 Å²	140.7	67%	0.668	79%	0.787	S	S	*	*			trans	64	119.1	150.2	-72.3	-37.1	0	0	0	127.4
250	M	26.9	Very low	31.4	Very low	169 Å²	169	141.6 Å²	141.6	83%	0.833	79%	0.785	S	S	*	*				79.3	157.7	128.6	-67.8	-163.2	74.5	0	0	123.8
251	V	33.4	Very low	31.6	Very low	119 Å²	119	145.7 Å²	145.7	72%	0.721	79%	0.786	S	S	*	*			trans	-127.1	148	-163	173.6	0	0	0	0	110
252	P	42.5	Very low	31.6	Very low	116 Å²	116	147 Å²	147	75%	0.753	78%	0.784	S	S	*	*			trans	-123	128	134	1.2	20.4	0	0	0	110.5
253	E	26	Very low	31.8	Very low	187 Å²	187	145.9 Å²	145.9	87%	0.874	78%	0.778	S	S	*	*				87.3	150.4	73.3	-80.1	-155.4	101	0	0	114.9
254	S	33.1	Very low	31.9	Very low	99 Å²	99	144.1 Å²	144.1	69%	0.692	78%	0.779	S	S	*	*			trans	-147.4	132.6	-164.6	59.3	0	0	0	0	114.7
255	L	25.8	Very low	30.6	Very low	153 Å²	153	142.5 Å²	142.5	80%	0.801	78%	0.779	S	S	*	*			trans	-136.9	78.6	-179.6	-72.6	178.8	0	0	0	115.7
256	R	30.3	Very low	31.7	Very low	219 Å²	219	139.9 Å²	139.9	83%	0.826	77%	0.773	S	S	*	*				16.3	126.5	127.9	32.2	174.8	156.8	156.2	-0	120.2
257	V	25.1	Very low	31.9	Very low	137 Å²	137	141.3 Å²	141.3	83%	0.83	78%	0.775	S	S	*	*			trans	-140.1	100.1	145.7	179.5	0	0	0	0	107.5
258	V	28.3	Very low	31.5	Very low	131 Å²	131	143.8 Å²	143.8	79%	0.794	78%	0.776	S	S	*	*				62.1	107	106.9	-176.9	0	0	0	0	116.1
259	E	34.4	Very low	31.8	Very low	188 Å²	188	140 Å²	140	88%	0.879	78%	0.775	S	S	*	*			trans	-106.8	147.7	150.9	-99.1	-169.9	116.3	0	0	109.7
260	P	35.8	Very low	32.3	Very low	115 Å²	115	143.2 Å²	143.2	75%	0.747	78%	0.783	S	S	*	*			trans	-86.1	156.5	170.8	35.1	-33.2	0	0	0	113
261	R	30.3	Very low	33.1	Very low	221 Å²	221	146 Å²	146	83%	0.834	79%	0.786	S	S	*	*			trans	-75.8	175	167.1	-60.9	177.9	168.9	152	-5	109.9
262	D	28.6	Very low	33.9	Very low	135 Å²	135	145.8 Å²	145.8	72%	0.722	79%	0.787	S	S	*	*			cis	-153.2	172.9	35.2	-83.9	-70.6	0	0	0	110
263	T	32.5	Very low	34	Very low	119 Å²	119	146.3 Å²	146.3	73%	0.73	79%	0.79	S	S	*	*			cis	-164.2	152	39.4	-4.5	0	0	0	0	112.6
264	V	32.7	Very low	35.1	Very low	135 Å²	135	141.5 Å²	141.5	82%	0.818	78%	0.783	S	S	*	*			trans	62	121.9	147.1	175	0	0	0	0	120.2
265	G	29.5	Very low	35.9	Very low	63 Å²	63	143.1 Å²	143.1	65%	0.649	79%	0.791	S	S	*	*			trans	-98.2	-129.8	161.6	0	0	0	0	0	111.7
266	P	47.1	Very low	36.9	Very low	114 Å²	114	140.1 Å²	140.1	74%	0.74	79%	0.788	S	S	*	*			cis	-143.4	-176.2	0.7	42.9	-23.6	0	0	0	116
267	L	33	Very low	38	Very low	153 Å²	153	135.1 Å²	135.1	80%	0.801	78%	0.784	S	S	*	*			trans	68.3	160.5	162.1	-54.3	177.6	0	0	0	118.7
268	Q	33.9	Very low	39.6	Very low	168 Å²	168	134.2 Å²	134.2	79%	0.785	78%	0.781	S	S	*	*			cis	-170.6	140.2	-39.3	-175	164.5	37	0	0	108
269	G	32.5	Very low	40.5	Very low	75 Å²	75	134.1 Å²	134.1	77%	0.773	78%	0.783	S	S	*	*			trans	175.2	114.7	171.9	0	0	0	0	0	115.2
270	F	37.4	Very low	41.1	Very low	191 Å²	191	129.3 Å²	129.3	84%	0.838	78%	0.776	S	S	*	*			trans	-92.4	124.8	169.2	-79.9	-104	0	0	0	110.2
271	Y	43.5	Very low	41.4	Very low	228 Å²	228	130 Å²	130	89%	0.894	78%	0.78	S	S	*	*			trans	-152.8	139.3	151.2	-95.5	-78.1	0	0	0	109.3
272	P	48.8	Very low	41.9	Very low	114 Å²	114	123.7 Å²	123.7	74%	0.74	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-75.4	146.7	173.4	31.5	-34.7	0	0	0	111.3
273	P	45.9	Very low	42.4	Very low	127 Å²	127	123.2 Å²	123.2	83%	0.825	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-72.9	140.7	176.4	30.1	-34.2	0	0	0	112
274	A	48.4	Very low	42.7	Very low	87 Å²	87	124 Å²	124	72%	0.719	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-73.4	155.1	168.4	0	0	0	0	0	111.1
275	P	49.8	Very low	42.7	Very low	132 Å²	132	125.4 Å²	125.4	86%	0.857	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-65.2	139.2	179.7	26.8	-34.9	0	0	0	112.3
276	A	47.8	Very low	42.9	Very low	91 Å²	91	127.5 Å²	127.5	75%	0.752	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-74.8	151.6	177	0	0	0	0	0	112.2
277	P	53	Low	42.5	Very low	114 Å²	114	131.3 Å²	131.3	74%	0.74	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-68.2	159.8	173.3	30.2	-35.9	0	0	0	112.1
278	P	57.6	Low	42.6	Very low	117 Å²	117	128.1 Å²	128.1	76%	0.76	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-64.4	152.4	178.1	27.9	-35.7	0	0	0	112.4
279	P	47.3	Very low	42.6	Very low	130 Å²	130	126 Å²	126	84%	0.844	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-67.5	144.4	-177.8	28.1	-35.1	0	0	0	112.6
280	A	47.1	Very low	42.8	Very low	87 Å²	87	126.5 Å²	126.5	72%	0.719	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-67.7	153.6	170.4	0	0	0	0	0	111.4
281	P	42.4	Very low	42.7	Very low	129 Å²	129	123.1 Å²	123.1	84%	0.838	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-62.3	140.9	178	26.3	-35	0	0	0	111.8
282	A	41.3	Very low	42.6	Very low	88 Å²	88	117 Å²	117	73%	0.727	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-65.9	147.4	179.1	0	0	0	0	0	111.9
283	P	38.1	Very low	42.1	Very low	125 Å²	125	120.7 Å²	120.7	81%	0.812	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-64.3	139.5	173.2	28.3	-34.5	0	0	0	110.6	L285	P283-L285 PolarHBondContact O-N 3.3Å
284	V	39.6	Very low	41.8	Very low	137 Å²	137	117.5 Å²	117.5	83%	0.83	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-64.5	120.6	174.5	178.2	0	0	0	0	108.8	S286	V284-S286 PolarHBondContact O-N 3.43Å
285	L	32.4	Very low	41.4	Very low	163 Å²	163	117.8 Å²	117.8	85%	0.853	76%	0.764	S	S	*	*			trans	-70.5	111.3	173.2	-162.9	83.1	0	0	0	108.6	P283 Q287	P283-L285 PolarHBondContact O-N 3.3Å; L285-Q287 PolarHBondContact O-N 2.89Å
286	S	33.9	Very low	41	Very low	108 Å²	108	117.6 Å²	117.6	76%	0.755	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-54.5	133.3	171.2	-60.6	0	0	0	0	109.8	V284 A288	V284-S286 PolarHBondContact O-N 3.43Å; S286-A288 PolarHBondContact O-N 3.36Å
287	Q	38.6	Very low	40.7	Very low	193 Å²	193	115.1 Å²	115.1	90%	0.902	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-58.2	126.9	177.1	-72.7	174.1	-36.1	0	0	109.8	L285	L285-Q287 PolarHBondContact O-N 2.89Å
288	A	34.7	Very low	39.8	Very low	86 Å²	86	116.9 Å²	116.9	71%	0.711	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-62.1	144.2	165.4	0	0	0	0	0	108.9	S286	S286-A288 PolarHBondContact O-N 3.36Å
289	P	34.7	Very low	39.1	Very low	123 Å²	123	112.1 Å²	112.1	80%	0.799	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-57.8	143.3	170.5	26.6	-34	0	0	0	109.5
290	A	35.8	Very low	38.4	Very low	86 Å²	86	113.6 Å²	113.6	71%	0.711	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-56.1	147	176.8	0	0	0	0	0	110.6	A292	A290-A292 PolarHBondContact O-N 2.88Å
291	P	37.1	Very low	38	Very low	121 Å²	121	112.5 Å²	112.5	79%	0.786	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-57.1	132.3	172.7	26.3	-34.2	0	0	0	108.8	E293	P291-E293 PolarHBondContact O-N 2.84Å
292	A	40.3	Very low	37.4	Very low	99 Å²	99	113 Å²	113	82%	0.818	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-53.7	128.1	179.9	0	0	0	0	0	109.9	A290 A294	A290-A292 PolarHBondContact O-N 2.88Å; A292-A294 PolarHBondContact O-N 3.04Å; A292-A294 VanDerWaalsContact O-N 3.11Å
293	E	37.9	Very low	37	Very low	192 Å²	192	112 Å²	112	90%	0.897	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-59.4	119.1	-175.6	-64	-170.8	126.8	0	0	109.6	P291 E295	P291-E293 PolarHBondContact O-N 2.84Å; E293-E295 PolarHBondContact O-N 3.39Å
294	A	39.3	Very low	36.8	Very low	60 Å²	60	111 Å²	111	50%	0.496	64%	0.644	S	S	.	*			trans	-65.9	108.9	175	0	0	0	0	0	108	A292 L296	A292-A294 PolarHBondContact O-N 3.04Å; A292-A294 VanDerWaalsContact O-N 3.11Å; A294-L296 PolarHBondContact O-N 3.21Å
295	E	41.6	Very low	36.2	Very low	93 Å²	93	109.8 Å²	109.8	44%	0.435	64%	0.637	S	S	.	*			trans	-69.9	78.5	-178.4	-164.8	-164.6	146.5	0	0	109.7	R118 R122 E293 V297	R118-E295 VanDerWaalsContact CZ-CD 3.46Å; R118-E295 IonicContact CZ-OE1 2.84Å; R118-E295 IonicContact CZ-OE2 2.76Å; R118-E295 IonicContact NE-OE1 2.64Å; R118-E295 PolarHBondContact NE-OE1 3.22Å; R118-E295 IonicContact NE-OE2 3.17Å; R118-E295 IonicContact NH2-OE1 3.97Å; R118-E295 PolarHBondContact NH2-OE1 3.01Å; R118-E295 VanDerWaalsContact NH2-OE1 3.17Å; R118-E295 IonicContact NH2-OE2 3.21Å; R118-E295 PolarHBondContact NH2-OE2 2.96Å; R122-E295 IonicContact CZ-OE2 3.35Å; R122-E295 IonicContact NH2-OE2 2.7Å; R122-E295 PolarHBondContact NH2-OE2 3.45Å; E293-E295 PolarHBondContact O-N 3.39Å; E295-V297 PolarHBondContact O-N 3.44Å
296	L	39.8	Very low	36.3	Very low	128 Å²	128	108.4 Å²	108.4	67%	0.67	63%	0.629	S	S	*	*			trans	-65.7	86.2	-177.2	-73.7	176.7	0	0	0	110.8	A89 A294 Q298	A89-L296 HydrophobicContact CB-CD2 3.86Å; A294-L296 PolarHBondContact O-N 3.21Å; L296-Q298 PolarHBondContact O-N 3.39Å
297	V	42.7	Very low	36	Very low	38 Å²	38	108 Å²	108	23%	0.23	63%	0.626	C	S	.	*			trans	-76.3	98.3	170.8	173.7	0	0	0	0	109.6	V114 E295 V299	V114-V297 HydrophobicContact CG1-CG1 4.26Å; E295-V297 PolarHBondContact O-N 3.44Å; V297-V299 HydrophobicContact CG1-CG2 3.81Å; V297-V299 PolarHBondContact O-N 2.92Å
298	Q	34.5	Very low	36.3	Very low	151 Å²	151	106 Å²	106	71%	0.706	62%	0.621	S	S	*	*			trans	-65.5	85.3	161.2	-75.4	-176.8	-30.2	0	0	109.4	L296 K300	L296-Q298 PolarHBondContact O-N 3.39Å; Q298-K300 PolarHBondContact O-N 3.37Å
299	V	41.5	Very low	36.3	Very low	18 Å²	18	109.9 Å²	109.9	11%	0.109	63%	0.625	C	S	.	*			trans	-66.8	91.6	157.8	-168.3	0	0	0	0	106.5	G86 L88 V114 V297 V301	G86-V299 VanDerWaalsContact O-O 3.13Å; L88-V299 HydrophobicContact CB-CG2 4.3Å; V114-V299 HydrophobicContact CG1-CG2 4.1Å; V114-V299 HydrophobicContact CG2-CG1 4.16Å; V114-V299 HydrophobicContact CG2-CG2 4.41Å; V297-V299 HydrophobicContact CG1-CG2 3.81Å; V297-V299 PolarHBondContact O-N 2.92Å; V299-V301 HydrophobicContact CB-CG2 4.48Å; V299-V301 HydrophobicContact CG1-CG2 3.64Å; V299-V301 PolarHBondContact O-N 3.39Å
300	K	32.9	Very low	36.9	Very low	161 Å²	161	113.7 Å²	113.7	70%	0.7	63%	0.632	S	S	*	*			trans	-69.6	77.8	169.3	-171.1	-154.3	178.2	-159.6	0	108.2	Q298 E302	Q298-K300 PolarHBondContact O-N 3.37Å; K300-E302 HydrophobicContact CD-CG 4.3Å; K300-E302 IonicContact NZ-OE1 2.75Å; K300-E302 PolarHBondContact NZ-OE1 2.88Å; K300-E302 PolarHBondContact O-N 3.1Å; K300-E302 VanDerWaalsContact O-N 3.14Å
301	V	38.4	Very low	36.6	Very low	64 Å²	64	114.6 Å²	114.6	39%	0.388	63%	0.629	S	S	.	*			trans	-67	108.9	162.4	-178.6	0	0	0	0	105.7	F82 V299	F82-V301 HydrophobicContact CE2-CG2 3.93Å; F82-V301 HydrophobicContact CZ-CG2 3.87Å; V299-V301 HydrophobicContact CB-CG2 4.48Å; V299-V301 HydrophobicContact CG1-CG2 3.64Å; V299-V301 PolarHBondContact O-N 3.39Å
302	E	31.3	Very low	36.6	Very low	140 Å²	140	116.4 Å²	116.4	65%	0.654	63%	0.632	S	S	*	*			trans	-61.5	144.5	172.2	-55.4	-163	130.5	0	0	108.5	K300 I304	K300-E302 HydrophobicContact CD-CG 4.3Å; K300-E302 IonicContact NZ-OE1 2.75Å; K300-E302 PolarHBondContact NZ-OE1 2.88Å; K300-E302 PolarHBondContact O-N 3.1Å; K300-E302 VanDerWaalsContact O-N 3.14Å; E302-I304 PolarHBondContact O-N 2.85Å
303	A	31.2	Very low	36	Very low	65 Å²	65	119.4 Å²	119.4	54%	0.537	63%	0.633	S	S	.	*			trans	-52.9	138.4	-157.7	0	0	0	0	0	112.5	V305	A303-V305 PolarHBondContact O-N 2.98Å
304	I	35.4	Very low	35.6	Very low	106 Å²	106	115.7 Å²	115.7	54%	0.544	63%	0.628	S	S	.	*			trans	-64.6	96.1	162.6	-60.4	175.6	0	0	0	105.7	E302 I306	E302-I304 PolarHBondContact O-N 2.85Å; I304-I306 PolarHBondContact O-N 3.03Å; I304-I306 VanDerWaalsContact O-N 3.16Å
305	V	26.8	Very low	35.4	Very low	111 Å²	111	122.1 Å²	122.1	67%	0.673	65%	0.648	S	S	*	*			trans	-67.9	112.5	176.3	-175	0	0	0	0	107.1	A303 S307	A303-V305 PolarHBondContact O-N 2.98Å; V305-S307 VanDerWaalsContact C-N 3.25Å; V305-S307 WeakPolarHBondContact CG1-OG 3.43Å; V305-S307 PolarHBondContact O-N 3.2Å
306	I	34.2	Very low	34.9	Very low	134 Å²	134	126.7 Å²	126.7	69%	0.687	67%	0.67	S	S	*	*			trans	-79.9	83.8	169.5	-56.4	174.5	0	0	0	106.4	I304 D308	I304-I306 PolarHBondContact O-N 3.03Å; I304-I306 VanDerWaalsContact O-N 3.16Å; I306-D308 PolarHBondContact O-N 3.12Å
307	S	27.2	Very low	34.2	Very low	98 Å²	98	128.9 Å²	128.9	69%	0.685	68%	0.677	S	S	*	*			trans	-88.5	85.3	167.8	-71	0	0	0	0	109.4	V305 E309	V305-S307 VanDerWaalsContact C-N 3.25Å; V305-S307 WeakPolarHBondContact CG1-OG 3.43Å; V305-S307 PolarHBondContact O-N 3.2Å; S307-E309 PolarHBondContact O-N 3.33Å
308	D	44.3	Very low	33.7	Very low	152 Å²	152	132.8 Å²	132.8	81%	0.813	70%	0.702	S	S	*	*			trans	-80	88.3	152.9	-82.5	-42.9	0	0	0	107.7	I306	I306-D308 PolarHBondContact O-N 3.12Å
309	E	36.2	Very low	33.4	Very low	168 Å²	168	135.3 Å²	135.3	79%	0.785	71%	0.714	S	S	*	*			trans	-158.6	108.5	164.3	-119.1	168.3	170.1	0	0	110.5	S307	S307-E309 PolarHBondContact O-N 3.33Å
310	E	45.7	Very low	32.7	Very low	202 Å²	202	137.7 Å²	137.7	94%	0.944	74%	0.742	S	S	*	*			trans	-81.8	125.8	160.2	-67.8	-163.6	131.8	0	0	108.2
311	T	31.3	Very low	33.1	Very low	106 Å²	106	135.5 Å²	135.5	65%	0.65	75%	0.745	S	S	*	*			trans	-134.6	120	174.5	44.7	0	0	0	0	110.7
312	D	35.6	Very low	32.8	Very low	159 Å²	159	142 Å²	142	85%	0.85	77%	0.771	S	S	*	*			trans	-57.1	135.1	167.9	-89.5	-63.4	0	0	0	110.9
313	L	28.4	Very low	32.6	Very low	161 Å²	161	138.6 Å²	138.6	84%	0.843	77%	0.773	S	S	*	*			trans	-112.2	85.9	167.7	-68.8	180	0	0	0	109.7
314	S	30	Very low	32.6	Very low	114 Å²	114	144.1 Å²	144.1	80%	0.797	79%	0.792	S	S	*	*			trans	-79.5	117.2	160.1	-67.8	0	0	0	0	109	E316	S314-E316 PolarHBondContact O-N 3.01Å
315	E	33.5	Very low	32.4	Very low	195 Å²	195	148 Å²	148	91%	0.911	81%	0.806	S	S	*	*			trans	-75.9	120.7	176.4	-65.9	-176.2	95.6	0	0	111.7
316	E	31.2	Very low	33.3	Very low	190 Å²	190	148.7 Å²	148.7	89%	0.888	81%	0.812	S	S	*	*			trans	-110.3	128.3	157.9	-88.9	-125.6	92.6	0	0	109.4	S314	S314-E316 PolarHBondContact O-N 3.01Å
317	Q	26.1	Very low	33.2	Very low	174 Å²	174	147.3 Å²	147.3	81%	0.813	82%	0.815	S	S	*	*			trans	-142.6	133.2	176.3	-174.1	70.9	-24	0	0	108.3
318	P	32	Very low	33.2	Very low	119 Å²	119	146.7 Å²	146.7	77%	0.773	82%	0.824	S	S	*	*			trans	-83.2	163.5	-151.9	30.9	-37.4	0	0	0	116.9
319	Q	29.1	Very low	32.6	Very low	204 Å²	204	143 Å²	143	95%	0.953	82%	0.821	S	S	*	*			trans	-78	152.7	-173.5	-64.2	-177.2	-19.8	0	0	116.2
320	G	26.2	Very low	32.3	Very low	68 Å²	68	140 Å²	140	70%	0.701	83%	0.825	S	S	*	*			trans	142.4	157.2	141.7	0	0	0	0	0	115.9
321	P	41.5	Very low	31.7	Very low	116 Å²	116	138.2 Å²	138.2	75%	0.753	82%	0.819	S	S	*	*			cis	-137.2	171	-35	41.5	-27.2	0	0	0	113.9
322	E	30.6	Very low	31.7	Very low	201 Å²	201	144 Å²	144	94%	0.939	83%	0.83	S	S	*	*			trans	65.2	143.8	169.2	-47.2	-168.8	124.5	0	0	117.2
323	G	29	Very low	31.4	Very low	67 Å²	67	140 Å²	140	69%	0.691	83%	0.827	S	S	*	*			cis	179.6	-169.4	-4.3	0	0	0	0	0	112.2
324	L	29.4	Very low	31.4	Very low	181 Å²	181	136.3 Å²	136.3	95%	0.948	83%	0.828	S	S	*	*			trans	83.3	111.1	172.1	-53.8	172.3	0	0	0	119.9
325	F	31	Very low	31.3	Very low	189 Å²	189	139.6 Å²	139.6	83%	0.829	83%	0.831	S	S	*	*			trans	-80.9	164.5	157.1	-78.9	-79	0	0	0	110.5
326	P	46.2	Very low	32	Very low	124 Å²	124	134.6 Å²	134.6	81%	0.805	82%	0.815	S	S	*	*				-152.5	-160	51.5	41.4	-18.4	0	0	0	116.9
327	S	32.7	Very low	31.9	Very low	105 Å²	105	130.5 Å²	130.5	73%	0.734	81%	0.808	S	S	*	*				-175	140.5	-61.4	-76.4	0	0	0	0	111.3
328	G	27.8	Very low	32.1	Very low	85 Å²	85	130.1 Å²	130.1	88%	0.876	81%	0.806	S	S	*	*			trans	122.1	156.7	168.3	0	0	0	0	0	115.2
329	G	30.3	Very low	31.7	Very low	74 Å²	74	132 Å²	132	76%	0.763	81%	0.808	S	S	*	*			cis	166.9	160.5	-8.3	0	0	0	0	0	114
330	A	30.1	Very low	31.7	Very low	105 Å²	105	128.5 Å²	128.5	87%	0.868	80%	0.796	S	S	*	*			trans	67.3	166.5	170.5	0	0	0	0	0	118.6
331	M	34.1	Very low	31.6	Very low	165 Å²	165	130.5 Å²	130.5	81%	0.813	80%	0.795	S	S	*	*				-175.5	160.4	-53.9	-104.9	-75	-172.8	0	0	109.9
332	Y	30.2	Very low	30.7	Very low	227 Å²	227	133.6 Å²	133.6	89%	0.89	80%	0.797	S	S	*	*			trans	64.2	156.9	178.8	-63	-87.7	0	0	0	117.1
333	G	30.8	Very low	30.6	Very low	75 Å²	75	131.2 Å²	131.2	77%	0.773	79%	0.786	S	S	*	*			cis	134.2	107.9	-13.6	0	0	0	0	0	115.5
334	G	27.5	Very low	30.7	Very low	84 Å²	84	135.6 Å²	135.6	87%	0.866	79%	0.789	S	S	*	*			trans	154.9	148.1	168.9	0	0	0	0	0	116.7
335	Q	28.8	Very low	31.7	Very low	184 Å²	184	132.7 Å²	132.7	86%	0.86	78%	0.781	S	S	*	*			trans	-131.7	-167.7	171	-133.7	-139.8	-12.9	0	0	107.2
336	P	46.4	Very low	31.5	Very low	89 Å²	89	127 Å²	127	58%	0.578	78%	0.775	S	S	*	*			cis	-138.6	-170.5	3.8	44.1	-25.2	0	0	0	116.3
337	S	29.6	Very low	30.8	Very low	105 Å²	105	125.9 Å²	125.9	73%	0.734	78%	0.776	S	S	*	*			trans	68.7	156.8	147.4	-69.9	0	0	0	0	120.4
338	Q	30.3	Very low	30.6	Very low	165 Å²	165	128.3 Å²	128.3	77%	0.771	79%	0.787	S	S	*	*			cis	173.5	137.8	-25.9	-110.3	-86.4	29	0	0	106.2
339	L	24	Very low	30.7	Very low	159 Å²	159	127.4 Å²	127.4	83%	0.832	78%	0.777	S	S	*	*			trans	-177.6	147.5	155.6	-109.4	164.4	0	0	0	116.3
340	D	29.1	Very low	30.8	Very low	130 Å²	130	132.3 Å²	132.3	70%	0.695	79%	0.785	S	S	*	*			trans	-62.8	-177.3	174.8	-72.3	-88.5	0	0	0	118.5
341	T	23.8	Very low	30.8	Very low	111 Å²	111	135.6 Å²	135.6	68%	0.681	78%	0.782	S	S	*	*			cis	177	129.1	-31.9	-77.9	0	0	0	0	107.6
342	F	22.5	Very low	30.9	Very low	180 Å²	180	136.2 Å²	136.2	79%	0.789	78%	0.784	S	S	*	*			trans	-176.9	171.8	166.2	-134.8	-118.8	0	0	0	111.3
343	E	28.6	Very low	31	Very low	152 Å²	152	131.5 Å²	131.5	71%	0.71	78%	0.778	S	S	*	*				-155.3	172.3	-63.8	-165.7	157	98.8	0	0	109.2
344	E	31.8	Very low	31.1	Very low	159 Å²	159	130.9 Å²	130.9	74%	0.743	77%	0.771	S	S	*	*			trans	-101.8	-167.9	178.5	-101.2	-81.1	110.3	0	0	110.2
345	P	49.3	Very low	32.2	Very low	120 Å²	120	132.6 Å²	132.6	78%	0.779	77%	0.767	S	S	*	*			cis	-140.7	176.6	10.1	44	-25.1	0	0	0	119
346	G	28	Very low	32.5	Very low	69 Å²	69	128.1 Å²	128.1	71%	0.711	76%	0.756	S	S	*	*			trans	-172.9	125.5	157.6	0	0	0	0	0	115.1
347	A	31.1	Very low	31.8	Very low	100 Å²	100	129.5 Å²	129.5	83%	0.826	76%	0.759	S	S	*	*			trans	-130	148.5	-161.3	0	0	0	0	0	117.6
348	T	29.1	Very low	32.2	Very low	156 Å²	156	132 Å²	132	96%	0.957	76%	0.758	S	S	*	*			trans	-174.2	141.4	155.6	23	0	0	0	0	109.1
349	G	30.2	Very low	32	Very low	66 Å²	66	132 Å²	132	68%	0.68	76%	0.756	S	S	*	*			cis	163	112	-15.2	0	0	0	0	0	113.9
350	L	32.2	Very low	32.5	Very low	178 Å²	178	131.3 Å²	131.3	93%	0.932	75%	0.753	S	S	*	*			trans	69.1	148.3	169.9	-50.7	174.8	0	0	0	116.6
351	E	29.5	Very low	32.9	Very low	173 Å²	173	130.4 Å²	130.4	81%	0.808	75%	0.754	S	S	*	*			cis	-125.3	145.3	-4	-69	-175.4	96.4	0	0	109.3
352	E	36.1	Very low	34	Very low	179 Å²	179	130.6 Å²	130.6	84%	0.836	76%	0.757	S	S	*	*				38.6	134.4	100.3	-81.7	-159	99.4	0	0	116.8
353	V	32.8	Very low	34.3	Very low	128 Å²	128	130.6 Å²	130.6	78%	0.776	76%	0.76	S	S	*	*			cis	-141.6	153.2	25.4	172.4	0	0	0	0	111.8
354	G	32.8	Very low	34.3	Very low	61 Å²	61	127 Å²	127	63%	0.629	75%	0.751	S	S	*	*			trans	-121.7	-149.7	169.5	0	0	0	0	0	112.8
355	P	50.3	Low	34.3	Very low	120 Å²	120	127.9 Å²	127.9	78%	0.779	76%	0.755	S	S	*	*			cis	-138	-164.6	-7.8	40.8	-20.9	0	0	0	114.2
356	S	35	Very low	33.8	Very low	90 Å²	90	130.2 Å²	130.2	63%	0.629	76%	0.76	S	S	*	*			trans	80.2	144.8	151.8	-61.6	0	0	0	0	122.3
357	D	32.1	Very low	34.2	Very low	118 Å²	118	132.8 Å²	132.8	63%	0.631	76%	0.764	S	S	*	*			cis	-165.2	125.3	-26.8	-100.3	-34.6	0	0	0	112.1
358	H	37	Very low	34.1	Very low	157 Å²	157	137.7 Å²	137.7	73%	0.727	76%	0.763	S	S	*	*			trans	51.1	-179.4	155.8	-49.8	-61.5	0	0	0	119.3
359	F	27.8	Very low	34.3	Very low	166 Å²	166	138 Å²	138	73%	0.728	75%	0.753	S	S	*	*			cis	-145.3	139.4	-0.3	-128.7	-71.6	0	0	0	109.9
360	L	32.8	Very low	34.4	Very low	144 Å²	144	143 Å²	143	75%	0.754	76%	0.763	S	S	*	*			trans	-4.8	177.7	158.5	-52.4	179.4	0	0	0	122.6
361	P	38.9	Very low	34.5	Very low	111 Å²	111	142.2 Å²	142.2	72%	0.721	76%	0.759	S	S	*	*			cis	-131.8	-172.2	-32	28	-4.8	0	0	0	113
362	P	46.7	Very low	35.1	Very low	115 Å²	115	140 Å²	140	75%	0.747	76%	0.76	S	S	*	*			trans	-100.7	-166.5	176.5	40.2	-35.5	0	0	0	115.2
363	E	27.6	Very low	34.7	Very low	181 Å²	181	134.8 Å²	134.8	85%	0.846	75%	0.753	S	S	*	*			trans	81.4	151	175.9	-64.1	-159.1	-174.7	0	0	117.5
364	S	30.3	Very low	34.7	Very low	76 Å²	76	134.6 Å²	134.6	53%	0.531	76%	0.758	S	S	.	*			cis	-166.7	174.3	-18.4	49.8	0	0	0	0	111.1
365	H	30.1	Very low	34.6	Very low	178 Å²	178	135.5 Å²	135.5	82%	0.824	77%	0.767	S	S	*	*			trans	69.7	140.6	169	-57.4	-74.4	0	0	0	121.7
366	L	39.8	Very low	33.9	Very low	169 Å²	169	136.8 Å²	136.8	89%	0.885	76%	0.763	S	S	*	*			trans	-108.8	149.9	158.5	-73.6	170.6	0	0	0	109.4
367	P	36.2	Very low	33.5	Very low	122 Å²	122	141.6 Å²	141.6	79%	0.792	77%	0.769	S	S	*	*			trans	-136.4	-179.5	133.8	27.5	-8.8	0	0	0	114.3
368	Y	28.8	Very low	33.5	Very low	204 Å²	204	144.8 Å²	144.8	80%	0.8	78%	0.779	S	S	*	*			trans	-87.5	175.1	-160.5	-78.1	-106.5	0	0	0	117.2
369	H	34.5	Very low	33.1	Very low	163 Å²	163	148.8 Å²	148.8	76%	0.755	79%	0.788	S	S	*	*			trans	85.1	98.9	145.4	-66.3	-54	0	0	0	120.7
370	L	31.3	Very low	33.3	Very low	169 Å²	169	144.3 Å²	144.3	89%	0.885	79%	0.789	S	S	*	*				170.4	151.4	99.7	-93.3	162.5	0	0	0	113.4
371	L	34.4	Very low	33.4	Very low	162 Å²	162	146 Å²	146	85%	0.848	80%	0.798	S	S	*	*			trans	-90.9	154.6	166.1	-73.1	165.2	0	0	0	110
372	P	42.3	Very low	33	Very low	128 Å²	128	146.8 Å²	146.8	83%	0.831	80%	0.8	S	S	*	*				-150.8	173	102.4	39.6	-24.2	0	0	0	115.5
373	G	27.7	Very low	32.2	Very low	68 Å²	68	148 Å²	148	70%	0.701	81%	0.806	S	S	*	*			trans	113	72.6	144.6	0	0	0	0	0	119.1
374	S	32.4	Very low	32.5	Very low	125 Å²	125	144.3 Å²	144.3	87%	0.874	80%	0.8	S	S	*	*			trans	3.7	123.9	146.7	55.9	0	0	0	0	120.4
375	G	31.3	Very low	33	Very low	80 Å²	80	146.9 Å²	146.9	83%	0.825	81%	0.814	S	S	*	*			trans	-139.9	138.9	156.8	0	0	0	0	0	110.5
376	Q	35.5	Very low	33	Very low	147 Å²	147	146 Å²	146	69%	0.687	82%	0.815	S	S	*	*			trans	-119.9	154.8	-174.6	-66	-176.5	-18.5	0	0	112.5
377	Y	26.6	Very low	33.4	Very low	191 Å²	191	143.1 Å²	143.1	75%	0.749	81%	0.806	S	S	*	*			trans	69.2	161.5	171.7	-42.2	-75.3	0	0	0	115.4
378	H	31.4	Very low	33	Very low	184 Å²	184	141.7 Å²	141.7	85%	0.852	81%	0.805	S	S	*	*			cis	-133.6	164.7	9.1	-122.3	-73.9	0	0	0	113.2
379	R	29.4	Very low	33.5	Very low	242 Å²	242	137.9 Å²	137.9	91%	0.913	81%	0.805	S	S	*	*			trans	-98.3	117.6	-174.8	177.1	-175.5	-179.2	176.3	1.6	113.4
380	G	30.5	Very low	33.9	Very low	72 Å²	72	136.2 Å²	136.2	74%	0.742	81%	0.808	S	S	*	*			trans	89.2	147.5	143.3	0	0	0	0	0	119.2
381	L	34.6	Very low	33.9	Very low	180 Å²	180	132.7 Å²	132.7	94%	0.942	80%	0.804	S	S	*	*			trans	-153.9	162.9	141.1	-108.8	175.2	0	0	0	108.9
382	V	31	Very low	33.9	Very low	126 Å²	126	133.5 Å²	133.5	76%	0.764	81%	0.808	S	S	*	*			trans	-113.3	135.4	-170.1	175.6	0	0	0	0	111.1
383	T	31.5	Very low	33.5	Very low	142 Å²	142	135.5 Å²	135.5	87%	0.871	81%	0.811	S	S	*	*			trans	-142.3	143.7	163.3	29	0	0	0	0	110.9
384	S	32.9	Very low	33.9	Very low	103 Å²	103	141.2 Å²	141.2	72%	0.72	82%	0.819	S	S	*	*			trans	-143.5	143.8	173.9	-54.1	0	0	0	0	109.5
385	P	39.8	Very low	34.3	Very low	129 Å²	129	140.7 Å²	140.7	84%	0.838	81%	0.813	S	S	*	*			trans	-125.1	153	154.7	17.6	3.2	0	0	0	113.2
386	L	31.2	Very low	34.8	Very low	159 Å²	159	145.2 Å²	145.2	83%	0.832	82%	0.818	S	S	*	*			trans	-100.4	177.6	169.9	-85	89.8	0	0	0	109.4
387	P	47.8	Very low	34.8	Very low	110 Å²	110	148.4 Å²	148.4	71%	0.714	83%	0.825	S	S	*	*			cis	-139.4	-174.5	-36.6	36.8	-18.8	0	0	0	114.5
388	A	28.6	Very low	35.7	Very low	91 Å²	91	144.1 Å²	144.1	75%	0.752	82%	0.82	S	S	*	*			trans	80.1	158.1	145.5	0	0	0	0	0	120
389	P	39.2	Very low	36	Very low	125 Å²	125	141.2 Å²	141.2	81%	0.812	82%	0.818	S	S	*	*			cis	-122.7	-142.5	-13.6	47.8	-31.8	0	0	0	111
390	P	43.3	Very low	36.7	Very low	127 Å²	127	134.8 Å²	134.8	83%	0.825	82%	0.816	S	S	*	*			trans	-113.3	148.9	-141	34.7	-14.3	0	0	0	116.6
391	A	30.8	Very low	37	Very low	95 Å²	95	140 Å²	140	79%	0.785	82%	0.821	S	S	*	*			trans	-144.9	117.9	166.8	0	0	0	0	0	112.4
392	L	34.2	Very low	37.2	Very low	179 Å²	179	142.1 Å²	142.1	94%	0.937	82%	0.818	S	S	*	*			trans	29.1	89.5	154.3	-52.7	-178.6	0	0	0	118.1
393	L	33.7	Very low	37.5	Very low	171 Å²	171	144.6 Å²	144.6	90%	0.895	82%	0.822	S	S	*	*			trans	-98.1	107.4	156	-103.4	164.8	0	0	0	108.7
394	E	35.1	Very low	37.8	Very low	187 Å²	187	142.8 Å²	142.8	87%	0.874	82%	0.821	S	S	*	*			trans	-99.3	120.5	170.3	-160.4	164.9	128.3	0	0	108.9
395	P	41.3	Very low	37.9	Very low	115 Å²	115	142.4 Å²	142.4	75%	0.747	82%	0.824	S	S	*	*			trans	-77.9	144.5	-165.1	-18.7	33.3	0	0	0	115.6	Y397	P395-Y397 PolarHBondContact O-N 3.06Å
396	L	41.9	Very low	38.2	Very low	175 Å²	175	142.6 Å²	142.6	92%	0.916	83%	0.825	S	S	*	*			trans	-76.9	93.2	165	-69.5	169.5	0	0	0	111
397	Y	36.7	Very low	38.9	Very low	214 Å²	214	138.8 Å²	138.8	84%	0.839	82%	0.824	S	S	*	*			trans	-161.6	138.7	151.6	-131	-92.8	0	0	0	112	P395	P395-Y397 PolarHBondContact O-N 3.06Å
398	P	43.7	Very low	38.2	Very low	100 Å²	100	141.4 Å²	141.4	65%	0.649	83%	0.832	S	S	*	*			trans	-74.9	155.1	172.1	31.2	-35.7	0	0	0	112.3
399	P	38	Very low	38.6	Very low	124 Å²	124	146.8 Å²	146.8	81%	0.805	84%	0.839	S	S	*	*			trans	-65	147.4	175.6	-20.2	33.1	0	0	0	113.2
400	A	45.8	Very low	38.9	Very low	106 Å²	106	144.1 Å²	144.1	88%	0.876	83%	0.834	S	S	*	*			trans	-112	80.5	-179.4	0	0	0	0	0	111.7
401	E	36.8	Very low	38.6	Very low	183 Å²	183	142.5 Å²	142.5	86%	0.855	83%	0.831	S	S	*	*			trans	-137.2	134	167.8	-63.3	177.6	-147.1	0	0	106.4
402	Y	37.9	Very low	39	Very low	223 Å²	223	147.8 Å²	147.8	88%	0.875	84%	0.837	S	S	*	*			cis	-139.5	174.4	18.9	63.7	-79.9	0	0	0	111.6
403	E	38.1	Very low	39.3	Very low	179 Å²	179	145.3 Å²	145.3	84%	0.836	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-74.6	156.9	-174.9	-63.7	-159.5	129	0	0	115.5
404	A	37.7	Very low	40.3	Very low	104 Å²	104	145.3 Å²	145.3	86%	0.86	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-79	126.1	179.9	0	0	0	0	0	112.9
405	A	35.2	Very low	41.7	Very low	94 Å²	94	143.5 Å²	143.5	78%	0.777	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-98.7	127.8	163.2	0	0	0	0	0	110
406	P	45.5	Very low	43.3	Very low	134 Å²	134	141.7 Å²	141.7	87%	0.87	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-80.9	127.2	-178.1	31	-33.4	0	0	0	112.2
407	G	45	Very low	45	Very low	78 Å²	78	134.8 Å²	134.8	80%	0.804	77%	0.773	S	S	*	*			trans	91.6	86.8	160.5	0	0	0	0	0	116.7
408	N	33.8	Very low	47.2	Very low	166 Å²	166	127.7 Å²	127.7	89%	0.888	75%	0.753	S	S	*	*			trans	-142.4	153.6	141.8	-158.4	2.1	0	0	0	110
409	F	37.5	Very low	49.2	Very low	204 Å²	204	123.1 Å²	123.1	90%	0.895	72%	0.723	S	S	*	*			trans	-74.6	150.8	-173.1	-115.5	-109.7	0	0	0	112.6
410	G	43.9	Very low	51.3	Low	69 Å²	69	127.3 Å²	127.3	71%	0.711	73%	0.728	S	S	*	*			trans	-59.8	131.2	-159.9	0	0	0	0	0	116.3
411	A	38.9	Very low	53	Low	92 Å²	92	127.1 Å²	127.1	76%	0.76	72%	0.716	S	S	*	*			trans	-102.4	95.4	159.4	0	0	0	0	0	108.9	T413	A411-T413 VanDerWaalsContact C-N 3.31Å; A411-T413 PolarHBondContact O-N 2.88Å
412	F	37.4	Very low	55.3	Low	206 Å²	206	120.8 Å²	120.8	90%	0.904	69%	0.692	S	S	*	*			trans	-72.1	89	166.4	-83	-89	0	0	0	109	E414	F412-E414 VanDerWaalsContact C-N 3.34Å; F412-E414 PolarHBondContact O-N 2.74Å; F412-E414 VanDerWaalsContact O-N 3.08Å
413	T	41.3	Very low	57.4	Low	128 Å²	128	113.1 Å²	113.1	79%	0.785	68%	0.68	S	S	*	*			trans	-71.6	95.3	159.6	51.4	0	0	0	0	107.7	A411 D415	A411-T413 VanDerWaalsContact C-N 3.31Å; A411-T413 PolarHBondContact O-N 2.88Å; T413-D415 PolarHBondContact O-N 2.9Å; T413-D415 VanDerWaalsContact O-N 3.16Å
414	E	54.5	Low	59.7	Low	171 Å²	171	110.5 Å²	110.5	80%	0.799	67%	0.666	S	S	*	*			trans	-55.7	120.7	163.5	-66.9	-167.1	157.1	0	0	107.9	F412 V416	F412-E414 VanDerWaalsContact C-N 3.34Å; F412-E414 PolarHBondContact O-N 2.74Å; F412-E414 VanDerWaalsContact O-N 3.08Å; E414-V416 WeakPolarHBondContact O-CG2 3.47Å; E414-V416 PolarHBondContact O-N 2.73Å
415	D	65.3	Low	61.7	Low	148 Å²	148	110.1 Å²	110.1	79%	0.791	65%	0.653	S	S	*	*			trans	-76.5	78.7	-170.5	-156.1	-27.5	0	0	0	109.6	T413 P417	T413-D415 PolarHBondContact O-N 2.9Å; T413-D415 VanDerWaalsContact O-N 3.16Å; D415-P417 WeakPolarHBondContact O-CD 3.37Å
416	V	75.1	Confident	63.9	Low	78 Å²	78	107.8 Å²	107.8	47%	0.473	63%	0.626	S	S	.	*			trans	-52.1	111.5	-171	179.4	0	0	0	0	109.3	E414 T418 T425	E414-V416 WeakPolarHBondContact O-CG2 3.47Å; E414-V416 PolarHBondContact O-N 2.73Å; V416-T418 WeakPolarHBondContact O-CG2 3.23Å; V416-T418 PolarHBondContact O-N 2.76Å; V416-T425 HydrophobicContact CG1-CG2 3.78Å
417	P	76.7	Confident	65.4	Low	29 Å²	29	107 Å²	107	19%	0.188	62%	0.624	C	S	.	*			trans	-61.5	101.9	-168.3	-31.6	40	0	0	0	113.5	D415 F426 L432	D415-P417 WeakPolarHBondContact O-CD 3.37Å; P417-F426 WeakPolarHBondContact CD-O 3.43Å; P417-F426 WeakPolarHBondContact O-CB 3.4Å; P417-F426 PolarHBondContact O-N 3.17Å; P417-L432 HydrophobicContact CB-CB 4.02Å; P417-L432 HydrophobicContact CB-CD2 3.77Å
418	T	83.1	Confident	66.9	Low	66 Å²	66	105.7 Å²	105.7	41%	0.405	60%	0.601	S	S	.	*	B	Isolated β-bridge	trans	-101.2	142.6	-176.3	44	0	0	0	0	113	V416 K420 K424 T425 L432	V416-T418 WeakPolarHBondContact O-CG2 3.23Å; V416-T418 PolarHBondContact O-N 2.76Å; T418-K420 PolarHBondContact O-N 3.15Å; T418-K424 CarbonylContact C-O 3.59Å; T418-K424 WeakPolarHBondContact CA-O 3.28Å; T418-T425 HydrophobicContact CG2-CG2 3.6Å; T418-L432 WeakPolarHBondContact O-CD1 3.35Å; T418-L432 WeakPolarHBondContact O-CD2 3.44Å
419	C	86.1	Confident	68.8	Low	3 Å²	3	101.1 Å²	101.1	2%	0.02	58%	0.583	C	S	.	*			trans	-85.9	106.1	174.4	-174.4	0	0	0	0	111.2	T421 C422 G423 K424 F426 L432	C419-T421 PolarHBondContact O-N 3.12Å; C419-C422 VanDerWaalsContact CB-SG 3.57Å; C419-C422 PolarHBondContact O-N 2.98Å; C419-C422 VanDerWaalsContact SG-SG 3.64Å; C419-G423 PolarHBondContact O-N 3.14Å; C419-K424 PolarHBondContact N-O 2.88Å; C419-F426 HydrophobicContact CB-CE2 3.9Å; C419-L432 VanDerWaalsContact CA-CD1 3.42Å; C419-L432 HydrophobicContact CB-CD1 3.57Å
420	K	82.1	Confident	70.4	Confident	213 Å²	213	94.4 Å²	94.4	93%	0.926	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.3	-22.1	177.7	-58.9	-171.8	178.7	-172.6	0	114.2	T418	T418-K420 PolarHBondContact O-N 3.15Å
421	T	81.2	Confident	72	Confident	101 Å²	101	92.3 Å²	92.3	62%	0.62	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-20	179.6	-39.9	0	0	0	0	114.1	C419 H439	C419-T421 PolarHBondContact O-N 3.12Å; T421-H439 HydrophobicContact CG2-CB 4Å
422	C	85.6	Confident	74.1	Confident	50 Å²	50	89.7 Å²	89.7	34%	0.338	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-147.4	6.6	-172.9	72.8	0	0	0	0	115.7	C419 K424 H435	C419-C422 VanDerWaalsContact CB-SG 3.57Å; C419-C422 PolarHBondContact O-N 2.98Å; C419-C422 VanDerWaalsContact SG-SG 3.64Å; C422-K424 PolarHBondContact O-N 3.28Å; C422-H435 PolarHBondContact SG-NE2 3.11Å
423	G	81.4	Confident	76	Confident	62 Å²	62	86.4 Å²	86.4	64%	0.639	48%	0.48	S	S	*	.			trans	71.1	-8.9	178.6	0	0	0	0	0	116.1	C419 T425	C419-G423 PolarHBondContact O-N 3.14Å; G423-T425 PolarHBondContact O-N 2.89Å
424	K	85.4	Confident	77.6	Confident	125 Å²	125	85.5 Å²	85.5	54%	0.543	46%	0.462	S	S	.	.			trans	-65.2	127.4	-175.4	-68.3	-176.1	178.9	-173	0	111.8	T418 C419 C422 F426	T418-K424 CarbonylContact C-O 3.59Å; T418-K424 WeakPolarHBondContact CA-O 3.28Å; C419-K424 PolarHBondContact N-O 2.88Å; C422-K424 PolarHBondContact O-N 3.28Å; K424-F426 HydrophobicContact CB-CE2 3.59Å; K424-F426 HydrophobicContact CB-CZ 3.81Å; K424-F426 HydrophobicContact CD-CZ 4.49Å; K424-F426 VanDerWaalsContact O-CD2 3.29Å; K424-F426 WeakPolarHBondContact O-CD2 3.35Å; K424-F426 VanDerWaalsContact O-CE2 3.24Å; K424-F426 WeakPolarHBondContact O-CE2 3.45Å
425	T	81.4	Confident	78.9	Confident	95 Å²	95	78.9 Å²	78.9	58%	0.583	43%	0.431	S	S	*	.	B	Isolated β-bridge	trans	-74.8	147.7	166.3	45.5	0	0	0	0	110.6	V416 T418 G423	V416-T425 HydrophobicContact CG1-CG2 3.78Å; T418-T425 HydrophobicContact CG2-CG2 3.6Å; G423-T425 PolarHBondContact O-N 2.89Å
426	F	81.7	Confident	79.4	Confident	45 Å²	45	73.7 Å²	73.7	20%	0.197	41%	0.408	C	S	.	.			trans	-134.4	150.9	176.4	-67.9	-85.2	0	0	0	109.9	P417 C419 K424 C428 L432 H435	P417-F426 WeakPolarHBondContact CD-O 3.43Å; P417-F426 WeakPolarHBondContact O-CB 3.4Å; P417-F426 PolarHBondContact O-N 3.17Å; C419-F426 HydrophobicContact CB-CE2 3.9Å; K424-F426 HydrophobicContact CB-CE2 3.59Å; K424-F426 HydrophobicContact CB-CZ 3.81Å; K424-F426 HydrophobicContact CD-CZ 4.49Å; K424-F426 VanDerWaalsContact O-CD2 3.29Å; K424-F426 WeakPolarHBondContact O-CD2 3.35Å; K424-F426 VanDerWaalsContact O-CE2 3.24Å; K424-F426 WeakPolarHBondContact O-CE2 3.45Å; F426-C428 PolarHBondContact O-N 2.68Å; F426-L432 HydrophobicContact CB-CB 4.13Å; F426-L432 HydrophobicContact CD2-CB 3.98Å; F426-L432 HydrophobicContact CD2-CD1 4.09Å; F426-L432 HydrophobicContact CE2-CD1 4.38Å; F426-L432 HydrophobicContact CG-CB 4.17Å; F426-H435 HydrophobicContact CE1-CB 3.83Å; F426-H435 HydrophobicContact CE2-CB 4.04Å; F426-H435 AromaticContact CE2-CD2 3.58Å; F426-H435 AromaticContact CE2-CG 3.95Å; F426-H435 HydrophobicContact CZ-CB 3.49Å; F426-H435 VanDerWaalsContact CZ-CB 3.49Å; F426-H435 AromaticContact CZ-CD2 3.3Å; F426-H435 WeakPolarHBondContact CZ-CD2 3.32Å; F426-H435 AromaticContact CZ-CG 3.31Å
427	S	76.6	Confident	79.4	Confident	118 Å²	118	71.6 Å²	71.6	83%	0.825	40%	0.396	S	S	*	.	S	Bend	trans	-71.6	-14.6	-179.4	52.5	0	0	0	0	114.1
428	C	76.5	Confident	79.4	Confident	50 Å²	50	74.3 Å²	74.3	34%	0.338	41%	0.412	S	S	.	.	S	Bend	trans	-156.8	158.4	173.2	68.6	0	0	0	0	112.7	F426 Y430 T431 L432	F426-C428 PolarHBondContact O-N 2.68Å; C428-Y430 PolarHBondContact O-N 3.23Å; C428-T431 PolarHBondContact N-OG1 2.91Å; C428-T431 PolarHBondContact O-N 3.37Å; C428-T431 PolarHBondContact O-OG1 3.07Å; C428-T431 PolarHBondContact SG-N 3.46Å; C428-T431 PolarHBondContact SG-OG1 3.09Å; C428-T431 VanDerWaalsContact SG-OG1 3.32Å; C428-L432 PolarHBondContact O-N 3.42Å; C428-L432 VanDerWaalsContact O-N 3.15Å
429	S	72.4	Confident	79.1	Confident	71 Å²	71	74.4 Å²	74.4	50%	0.497	41%	0.408	S	S	.	.	H	α-helix	trans	-63.1	-25.3	-178.6	60.3	0	0	0	0	113.1	R433	S429-R433 VanDerWaalsContact O-CB 3.3Å; S429-R433 WeakPolarHBondContact O-CB 3.35Å; S429-R433 PolarHBondContact O-N 3.5Å
430	Y	72.8	Confident	78.4	Confident	63 Å²	63	78 Å²	78	25%	0.247	43%	0.429	C	S	.	.	H	α-helix	trans	-66.9	-46.1	170.9	167.6	-112.1	0	0	0	112.7	H67 C428 L432 R433 R434	H67-Y430 AromaticContact CE1-CE2 3.24Å; H67-Y430 WeakPolarHBondContact CE1-CE2 3.44Å; H67-Y430 AromaticContact CE1-CZ 3.43Å; H67-Y430 VanDerWaalsContact CE1-CZ 3.43Å; H67-Y430 PolarHBondContact CE1-OH 2.7Å; H67-Y430 AromaticContact ND1-CZ 3.76Å; H67-Y430 PolarHBondContact ND1-OH 3.35Å; H67-Y430 AromaticContact NE2-CE2 3.67Å; H67-Y430 AromaticContact NE2-CZ 3.9Å; H67-Y430 PolarHBondContact NE2-OH 3.16Å; C428-Y430 PolarHBondContact O-N 3.23Å; Y430-L432 VanDerWaalsContact C-N 3.33Å; Y430-L432 PolarHBondContact O-N 3.2Å; Y430-R433 PolarHBondContact O-N 3.36Å; Y430-R434 WeakPolarHBondContact O-CB 3.42Å; Y430-R434 PolarHBondContact O-N 3.44Å
431	T	76.8	Confident	77.8	Confident	25 Å²	25	78 Å²	78	15%	0.153	42%	0.423	C	S	.	.	H	α-helix	trans	-69.7	-33.6	-179.6	49.1	0	0	0	0	111.9	C428 H435	C428-T431 PolarHBondContact N-OG1 2.91Å; C428-T431 PolarHBondContact O-N 3.37Å; C428-T431 PolarHBondContact O-OG1 3.07Å; C428-T431 PolarHBondContact SG-N 3.46Å; C428-T431 PolarHBondContact SG-OG1 3.09Å; C428-T431 VanDerWaalsContact SG-OG1 3.32Å; T431-H435 WeakPolarHBondContact O-CB 3.24Å; T431-H435 PolarHBondContact O-N 2.83Å
432	L	82.2	Confident	77.3	Confident	37 Å²	37	78.8 Å²	78.8	19%	0.194	42%	0.42	C	S	.	.	H	α-helix	trans	-57	-53.3	164.2	165.1	59.8	0	0	0	112.2	P417 T418 C419 F426 C428 Y430 R434 H435 A436	P417-L432 HydrophobicContact CB-CB 4.02Å; P417-L432 HydrophobicContact CB-CD2 3.77Å; T418-L432 WeakPolarHBondContact O-CD1 3.35Å; T418-L432 WeakPolarHBondContact O-CD2 3.44Å; C419-L432 VanDerWaalsContact CA-CD1 3.42Å; C419-L432 HydrophobicContact CB-CD1 3.57Å; F426-L432 HydrophobicContact CB-CB 4.13Å; F426-L432 HydrophobicContact CD2-CB 3.98Å; F426-L432 HydrophobicContact CD2-CD1 4.09Å; F426-L432 HydrophobicContact CE2-CD1 4.38Å; F426-L432 HydrophobicContact CG-CB 4.17Å; C428-L432 PolarHBondContact O-N 3.42Å; C428-L432 VanDerWaalsContact O-N 3.15Å; Y430-L432 VanDerWaalsContact C-N 3.33Å; Y430-L432 PolarHBondContact O-N 3.2Å; L432-R434 VanDerWaalsContact C-N 3.29Å; L432-R434 PolarHBondContact O-N 3.42Å; L432-H435 WeakPolarHBondContact O-CA 3.33Å; L432-H435 WeakPolarHBondContact O-CB 3.48Å; L432-H435 PolarHBondContact O-N 3.06Å; L432-A436 PolarHBondContact O-N 3.14Å
433	R	77.1	Confident	76.7	Confident	137 Å²	137	82.5 Å²	82.5	52%	0.517	43%	0.427	S	S	.	.	H	α-helix	trans	-60.5	-38.6	-178.8	-168.3	-173	-60.1	159	0.9	111.9	S429 Y430 A436	S429-R433 VanDerWaalsContact O-CB 3.3Å; S429-R433 WeakPolarHBondContact O-CB 3.35Å; S429-R433 PolarHBondContact O-N 3.5Å; Y430-R433 PolarHBondContact O-N 3.36Å; R433-A436 PolarHBondContact O-N 3.42Å
434	R	75.2	Confident	76.2	Confident	108 Å²	108	83.8 Å²	83.8	41%	0.408	42%	0.424	S	S	.	.	H	α-helix	trans	-66.7	-33	172.5	-175.6	179.2	68.1	174.8	-1.6	112.6	Y430 L432 T437	Y430-R434 WeakPolarHBondContact O-CB 3.42Å; Y430-R434 PolarHBondContact O-N 3.44Å; L432-R434 VanDerWaalsContact C-N 3.29Å; L432-R434 PolarHBondContact O-N 3.42Å; R434-T437 PolarHBondContact O-OG1 2.93Å
435	H	81.7	Confident	75.9	Confident	33 Å²	33	81.4 Å²	81.4	15%	0.153	41%	0.412	C	S	.	.	H	α-helix	trans	-71.6	-33.4	174.3	-179.7	54.2	0	0	0	112.5	C422 F426 T431 L432 T437 V438 H439	C422-H435 PolarHBondContact SG-NE2 3.11Å; F426-H435 HydrophobicContact CE1-CB 3.83Å; F426-H435 HydrophobicContact CE2-CB 4.04Å; F426-H435 AromaticContact CE2-CD2 3.58Å; F426-H435 AromaticContact CE2-CG 3.95Å; F426-H435 HydrophobicContact CZ-CB 3.49Å; F426-H435 VanDerWaalsContact CZ-CB 3.49Å; F426-H435 AromaticContact CZ-CD2 3.3Å; F426-H435 WeakPolarHBondContact CZ-CD2 3.32Å; F426-H435 AromaticContact CZ-CG 3.31Å; T431-H435 WeakPolarHBondContact O-CB 3.24Å; T431-H435 PolarHBondContact O-N 2.83Å; L432-H435 WeakPolarHBondContact O-CA 3.33Å; L432-H435 WeakPolarHBondContact O-CB 3.48Å; L432-H435 PolarHBondContact O-N 3.06Å; H435-T437 VanDerWaalsContact C-N 3.26Å; H435-T437 PolarHBondContact O-N 3.46Å; H435-V438 VanDerWaalsContact O-CB 3.26Å; H435-V438 WeakPolarHBondContact O-CB 3.41Å; H435-V438 WeakPolarHBondContact O-CG2 3.15Å; H435-V438 PolarHBondContact O-N 2.8Å; H435-H439 AromaticContact CD2-NE2 3.65Å; H435-H439 AromaticContact CE1-NE2 3.7Å; H435-H439 AromaticContact NE2-CE1 3.68Å; H435-H439 AromaticContact NE2-NE2 3.05Å; H435-H439 PolarHBondContact NE2-NE2 3.29Å
436	A	75.9	Confident	76	Confident	38 Å²	38	81.7 Å²	81.7	31%	0.314	41%	0.407	S	S	.	.	H	α-helix	trans	-58.5	-33	-177.8	0	0	0	0	0	114	L432 R433 V438 H439 T440	L432-A436 PolarHBondContact O-N 3.14Å; R433-A436 PolarHBondContact O-N 3.42Å; A436-V438 PolarHBondContact O-N 2.75Å; A436-H439 PolarHBondContact O-N 3.09Å; A436-T440 PolarHBondContact O-N 2.97Å
437	T	76.2	Confident	76	Confident	35 Å²	35	79.6 Å²	79.6	22%	0.215	40%	0.398	C	S	.	.	H	α-helix	trans	-67.3	-17.3	177.8	64.3	0	0	0	0	113.5	R434 H435 H439 T440 R441	R434-T437 PolarHBondContact O-OG1 2.93Å; H435-T437 VanDerWaalsContact C-N 3.26Å; H435-T437 PolarHBondContact O-N 3.46Å; T437-H439 VanDerWaalsContact C-N 3.26Å; T437-H439 PolarHBondContact O-N 3.45Å; T437-T440 PolarHBondContact O-OG1 3.47Å; T437-R441 PolarHBondContact O-N 3.28Å; T437-R441 VanDerWaalsContact O-N 3.11Å
438	V	76.6	Confident	76.2	Confident	85 Å²	85	82.2 Å²	82.2	52%	0.515	39%	0.39	S	S	.	.	H	α-helix	trans	-66.7	-31.5	171.5	-177.1	0	0	0	0	110.9	H435 A436	H435-V438 VanDerWaalsContact O-CB 3.26Å; H435-V438 WeakPolarHBondContact O-CB 3.41Å; H435-V438 WeakPolarHBondContact O-CG2 3.15Å; H435-V438 PolarHBondContact O-N 2.8Å; A436-V438 PolarHBondContact O-N 2.75Å
439	H	76.5	Confident	76.4	Confident	69 Å²	69	84.4 Å²	84.4	32%	0.319	39%	0.392	S	S	.	.	H	α-helix	trans	-83.3	-40.1	179.9	-58.5	-57.3	0	0	0	112.5	T421 H435 A436 T437 R441	T421-H439 HydrophobicContact CG2-CB 4Å; H435-H439 AromaticContact CD2-NE2 3.65Å; H435-H439 AromaticContact CE1-NE2 3.7Å; H435-H439 AromaticContact NE2-CE1 3.68Å; H435-H439 AromaticContact NE2-NE2 3.05Å; H435-H439 PolarHBondContact NE2-NE2 3.29Å; A436-H439 PolarHBondContact O-N 3.09Å; T437-H439 VanDerWaalsContact C-N 3.26Å; T437-H439 PolarHBondContact O-N 3.45Å; H439-R441 PolarHBondContact O-N 3.09Å
440	T	71.9	Confident	77	Confident	78 Å²	78	83.9 Å²	83.9	48%	0.479	39%	0.387	S	S	.	.	H	α-helix	trans	-70.6	-20.6	175.4	67	0	0	0	0	112.6	A436 T437 E442	A436-T440 PolarHBondContact O-N 2.97Å; T437-T440 PolarHBondContact O-OG1 3.47Å; T440-E442 WeakPolarHBondContact CB-OE2 3.29Å; T440-E442 PolarHBondContact O-N 3.46Å; T440-E442 VanDerWaalsContact O-N 3.1Å; T440-E442 WeakPolarHBondContact OG1-CG 3.49Å; T440-E442 PolarHBondContact OG1-N 2.87Å; T440-E442 PolarHBondContact OG1-OE2 3.01Å
441	R	68.7	Low	77.4	Confident	212 Å²	212	86.8 Å²	86.8	80%	0.8	41%	0.406	S	S	*	.			trans	59.4	10.3	-174	-56.2	-177.7	176.4	-174.3	0.1	114.2	T437 H439	T437-R441 PolarHBondContact O-N 3.28Å; T437-R441 VanDerWaalsContact O-N 3.11Å; H439-R441 PolarHBondContact O-N 3.09Å
442	E	69.9	Low	77.6	Confident	119 Å²	119	93.3 Å²	93.3	56%	0.556	43%	0.428	S	S	*	.			trans	-66.2	134.7	177.2	-65.5	163.2	136.6	0	0	110	T440 P444	T440-E442 WeakPolarHBondContact CB-OE2 3.29Å; T440-E442 PolarHBondContact O-N 3.46Å; T440-E442 VanDerWaalsContact O-N 3.1Å; T440-E442 WeakPolarHBondContact OG1-CG 3.49Å; T440-E442 PolarHBondContact OG1-N 2.87Å; T440-E442 PolarHBondContact OG1-OE2 3.01Å; E442-P444 VanDerWaalsContact O-CD 3.28Å; E442-P444 WeakPolarHBondContact O-CD 3.11Å
443	R	73.6	Confident	77.6	Confident	128 Å²	128	93.2 Å²	93.2	48%	0.483	43%	0.431	S	S	.	.			trans	-121.1	65.3	-177.9	-60.1	175.7	75.4	100	1.9	109.8	Y445 S453 Y454 T455	R443-Y445 PolarHBondContact O-N 3.39Å; R443-S453 WeakPolarHBondContact CB-OG 3.27Å; R443-S453 WeakPolarHBondContact CD-OG 3.46Å; R443-S453 PolarHBondContact NE-O 2.94Å; R443-S453 PolarHBondContact NE-OG 3.32Å; R443-S453 PolarHBondContact NH2-O 3.32Å; R443-S453 WeakPolarHBondContact O-CB 3.36Å; R443-Y454 CarbonylContact C-O 3.52Å; R443-Y454 VanDerWaalsContact CA-O 3.26Å; R443-Y454 WeakPolarHBondContact CA-O 3.32Å; R443-T455 HydrophobicContact CG-CG2 4.02Å
444	P	71.4	Confident	77.7	Confident	89 Å²	89	88.4 Å²	88.4	58%	0.578	41%	0.413	S	S	*	.			trans	-71.6	1.3	-167	31.3	-38.2	0	0	0	115	E442	E442-P444 VanDerWaalsContact O-CD 3.28Å; E442-P444 WeakPolarHBondContact O-CD 3.11Å
445	Y	78.7	Confident	77.8	Confident	74 Å²	74	85 Å²	85	29%	0.29	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	93.6	-179.8	-58	-70.7	0	0	0	110.3	R443 S453 Y454	R443-Y445 PolarHBondContact O-N 3.39Å; Y445-S453 CarbonylContact O-C 3.11Å; Y445-Y454 PolarHBondContact N-O 2.96Å; Y445-Y454 VanDerWaalsContact N-O 3.16Å; Y445-Y454 WeakPolarHBondContact O-CB 3.38Å; Y445-Y454 PolarHBondContact O-N 3.29Å
446	E	84.5	Confident	77.6	Confident	102 Å²	102	86.6 Å²	86.6	48%	0.477	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	141	-176.6	-163	171.4	145.1	0	0	113.6	R448 L451	E446-R448 PolarHBondContact O-N 2.92Å; E446-L451 WeakPolarHBondContact OE1-CA 3.37Å; E446-L451 WeakPolarHBondContact OE1-CB 3.41Å; E446-L451 WeakPolarHBondContact OE1-CD2 3.47Å
447	C	80.9	Confident	77.6	Confident	0 Å²	0	86.5 Å²	86.5	0%	0	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	108.5	174.7	-173.8	0	0	0	0	111.4	Y449 C450 L451 R452 L460 H463	C447-Y449 PolarHBondContact O-N 2.66Å; C447-C450 PolarHBondContact O-N 3.47Å; C447-C450 VanDerWaalsContact O-N 3.13Å; C447-L451 VanDerWaalsContact O-CA 3.29Å; C447-L451 WeakPolarHBondContact O-CA 3.39Å; C447-L451 PolarHBondContact O-N 3.01Å; C447-R452 HydrophobicContact CB-CB 4.48Å; C447-R452 WeakPolarHBondContact CB-O 3.49Å; C447-R452 PolarHBondContact N-O 3.28Å; C447-L460 HydrophobicContact CB-CD1 3.6Å; C447-H463 WeakPolarHBondContact CB-NE2 3.4Å; C447-H463 PolarHBondContact SG-NE2 2.97Å
448	R	81.8	Confident	77.7	Confident	174 Å²	174	86.8 Å²	86.8	66%	0.657	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-18.4	177.5	-68.3	179.6	171.8	165.5	-4.4	114.8	E55 E446	E55-R448 PolarHBondContact O-NH2 2.69Å; E55-R448 IonicContact OE1-CZ 2.74Å; E55-R448 IonicContact OE1-NH1 2.69Å; E55-R448 PolarHBondContact OE1-NH1 3.26Å; E446-R448 PolarHBondContact O-N 2.92Å
449	Y	78.8	Confident	77.8	Confident	96 Å²	96	84.4 Å²	84.4	38%	0.376	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-20.2	-179.5	-57.1	-81.9	0	0	0	115	C447 I464 H468 D471	C447-Y449 PolarHBondContact O-N 2.66Å; Y449-I464 HydrophobicContact CD2-CG2 4.25Å; Y449-I464 HydrophobicContact CE2-CG2 3.87Å; Y449-H468 VanDerWaalsContact CB-CE1 3.44Å; Y449-H468 WeakPolarHBondContact CB-CE1 3.38Å; Y449-H468 VanDerWaalsContact CB-CG 3.48Å; Y449-H468 VanDerWaalsContact CB-ND1 3.33Å; Y449-H468 WeakPolarHBondContact CB-ND1 3.44Å; Y449-H468 HydrophobicContact CD2-CB 3.89Å; Y449-H468 AromaticContact CD2-CG 3.91Å; Y449-H468 HydrophobicContact CE2-CB 4.32Å; Y449-H468 HydrophobicContact CG-CB 4Å; Y449-H468 AromaticContact CG-CG 3.76Å; Y449-H468 AromaticContact CG-ND1 3.94Å; Y449-D471 HydrophobicContact CD1-CB 3.84Å; Y449-D471 HydrophobicContact CE1-CB 3.53Å
450	C	85.5	Confident	78.2	Confident	59 Å²	59	82.3 Å²	82.3	40%	0.399	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-148.3	15.6	179.9	66.4	0	0	0	0	114.8	C447 R452 H463 H468	C447-C450 PolarHBondContact O-N 3.47Å; C447-C450 VanDerWaalsContact O-N 3.13Å; C450-R452 PolarHBondContact O-N 3.1Å; C450-H463 VanDerWaalsContact SG-CE1 3.57Å; C450-H463 PolarHBondContact SG-NE2 3.36Å; C450-H468 PolarHBondContact SG-NE2 3.46Å
451	L	82.2	Confident	78.6	Confident	124 Å²	124	85.3 Å²	85.3	65%	0.649	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	23.9	177.9	-51.1	-176	0	0	0	114.2	E446 C447	E446-L451 WeakPolarHBondContact OE1-CA 3.37Å; E446-L451 WeakPolarHBondContact OE1-CB 3.41Å; E446-L451 WeakPolarHBondContact OE1-CD2 3.47Å; C447-L451 VanDerWaalsContact O-CA 3.29Å; C447-L451 WeakPolarHBondContact O-CA 3.39Å; C447-L451 PolarHBondContact O-N 3.01Å
452	R	81.1	Confident	79.1	Confident	163 Å²	163	81.5 Å²	81.5	62%	0.615	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.5	117	-177.3	-155	167.2	-160.4	166	6.6	109.6	C447 C450 Y454	C447-R452 HydrophobicContact CB-CB 4.48Å; C447-R452 WeakPolarHBondContact CB-O 3.49Å; C447-R452 PolarHBondContact N-O 3.28Å; C450-R452 PolarHBondContact O-N 3.1Å; R452-Y454 HydrophobicContact CB-CE2 4.12Å; R452-Y454 HydrophobicContact CG-CE2 4.25Å; R452-Y454 VanDerWaalsContact O-CD2 3.25Å; R452-Y454 WeakPolarHBondContact O-CD2 3.28Å; R452-Y454 WeakPolarHBondContact O-CE2 3.47Å
453	S	81.1	Confident	79.8	Confident	35 Å²	35	77.1 Å²	77.1	25%	0.245	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	149.2	-175	63.3	0	0	0	0	113	R443 Y445	R443-S453 WeakPolarHBondContact CB-OG 3.27Å; R443-S453 WeakPolarHBondContact CD-OG 3.46Å; R443-S453 PolarHBondContact NE-O 2.94Å; R443-S453 PolarHBondContact NE-OG 3.32Å; R443-S453 PolarHBondContact NH2-O 3.32Å; R443-S453 WeakPolarHBondContact O-CB 3.36Å; Y445-S453 CarbonylContact O-C 3.11Å
454	Y	80.6	Confident	80.2	Confident	36 Å²	36	72.4 Å²	72.4	14%	0.141	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	150.3	-176.9	-65.7	-90.6	0	0	0	111.5	R443 Y445 R452 Q456 D459 L460 H463	R443-Y454 CarbonylContact C-O 3.52Å; R443-Y454 VanDerWaalsContact CA-O 3.26Å; R443-Y454 WeakPolarHBondContact CA-O 3.32Å; Y445-Y454 PolarHBondContact N-O 2.96Å; Y445-Y454 VanDerWaalsContact N-O 3.16Å; Y445-Y454 WeakPolarHBondContact O-CB 3.38Å; Y445-Y454 PolarHBondContact O-N 3.29Å; R452-Y454 HydrophobicContact CB-CE2 4.12Å; R452-Y454 HydrophobicContact CG-CE2 4.25Å; R452-Y454 VanDerWaalsContact O-CD2 3.25Å; R452-Y454 WeakPolarHBondContact O-CD2 3.28Å; R452-Y454 WeakPolarHBondContact O-CE2 3.47Å; Y454-Q456 VanDerWaalsContact C-N 3.33Å; Y454-D459 HydrophobicContact CD1-CB 3.76Å; Y454-D459 HydrophobicContact CG-CB 4.31Å; Y454-L460 HydrophobicContact CD2-CB 4.01Å; Y454-L460 HydrophobicContact CD2-CD1 3.93Å; Y454-L460 HydrophobicContact CE2-CD1 4.24Å; Y454-L460 HydrophobicContact CG-CB 4.26Å; Y454-H463 HydrophobicContact CE1-CB 4.25Å; Y454-H463 HydrophobicContact CE2-CB 4.12Å; Y454-H463 AromaticContact CE2-CD2 3.44Å; Y454-H463 VanDerWaalsContact CE2-CD2 3.44Å; Y454-H463 WeakPolarHBondContact CE2-CD2 3.45Å; Y454-H463 AromaticContact CE2-CG 3.91Å; Y454-H463 AromaticContact CZ-CD2 3.68Å; Y454-H463 AromaticContact CZ-CG 3.66Å; Y454-H463 WeakPolarHBondContact OH-CB 3.33Å; Y454-H463 PolarHBondContact OH-CD2 3.13Å
455	T	76.4	Confident	80.8	Confident	37 Å²	37	74.8 Å²	74.8	23%	0.227	34%	0.344	C	S	.	.	S	Bend	trans	-80.7	-12.8	176.2	53.4	0	0	0	0	113.1	R443	R443-T455 HydrophobicContact CG-CG2 4.02Å
456	Q	76.8	Confident	80.9	Confident	66 Å²	66	79.7 Å²	79.7	31%	0.308	37%	0.367	S	S	.	.	S	Bend	trans	-138.6	142	-179.3	-53.2	-178	55.1	0	0	111.6	Y454 G458 D459 L460	Y454-Q456 VanDerWaalsContact C-N 3.33Å; Q456-G458 VanDerWaalsContact C-N 3.34Å; Q456-G458 PolarHBondContact O-N 3.31Å; Q456-D459 HydrophobicContact CB-CB 4.39Å; Q456-D459 PolarHBondContact O-N 3.48Å; Q456-L460 PolarHBondContact O-N 3.41Å
457	S	76.1	Confident	80.8	Confident	36 Å²	36	77.5 Å²	77.5	25%	0.252	37%	0.366	S	S	.	.	H	α-helix	trans	-63.6	-35.7	177.7	52.4	0	0	0	0	113.2	D459 L460 Y461	S457-D459 VanDerWaalsContact C-N 3.31Å; S457-D459 PolarHBondContact O-N 2.98Å; S457-L460 PolarHBondContact O-N 3.21Å; S457-Y461 PolarHBondContact O-N 2.89Å
458	G	78.4	Confident	81	Confident	40 Å²	40	78.6 Å²	78.6	41%	0.412	37%	0.371	S	S	.	.	H	α-helix	trans	-67.1	-29.2	175.8	0	0	0	0	0	113.6	Q456 R462	Q456-G458 VanDerWaalsContact C-N 3.34Å; Q456-G458 PolarHBondContact O-N 3.31Å; G458-R462 WeakPolarHBondContact O-CB 3.3Å; G458-R462 PolarHBondContact O-N 3.22Å; G458-R462 PolarHBondContact O-NH1 2.64Å
459	D	79.8	Confident	80.6	Confident	35 Å²	35	75 Å²	75	19%	0.187	37%	0.365	C	S	.	.	H	α-helix	trans	-73.4	-42.2	174.4	-65.9	-30.2	0	0	0	111.1	Y454 Q456 S457 R462 H463	Y454-D459 HydrophobicContact CD1-CB 3.76Å; Y454-D459 HydrophobicContact CG-CB 4.31Å; Q456-D459 HydrophobicContact CB-CB 4.39Å; Q456-D459 PolarHBondContact O-N 3.48Å; S457-D459 VanDerWaalsContact C-N 3.31Å; S457-D459 PolarHBondContact O-N 2.98Å; D459-R462 PolarHBondContact O-N 3.49Å; D459-R462 IonicContact OD1-CZ 2.69Å; D459-R462 IonicContact OD1-NH1 3.17Å; D459-R462 PolarHBondContact OD1-NH1 2.9Å; D459-R462 IonicContact OD1-NH2 2.73Å; D459-R462 PolarHBondContact OD1-NH2 3.19Å; D459-H463 WeakPolarHBondContact O-CB 3.23Å; D459-H463 PolarHBondContact O-N 2.91Å
460	L	84.4	Confident	80.2	Confident	25 Å²	25	77.3 Å²	77.3	13%	0.131	38%	0.379	C	S	.	.	H	α-helix	trans	-57.6	-52.2	171.1	172	61.4	0	0	0	111.4	C447 Y454 Q456 S457 R462 H463 I464	C447-L460 HydrophobicContact CB-CD1 3.6Å; Y454-L460 HydrophobicContact CD2-CB 4.01Å; Y454-L460 HydrophobicContact CD2-CD1 3.93Å; Y454-L460 HydrophobicContact CE2-CD1 4.24Å; Y454-L460 HydrophobicContact CG-CB 4.26Å; Q456-L460 PolarHBondContact O-N 3.41Å; S457-L460 PolarHBondContact O-N 3.21Å; L460-R462 VanDerWaalsContact C-N 3.34Å; L460-R462 PolarHBondContact O-N 2.76Å; L460-H463 WeakPolarHBondContact O-CA 3.31Å; L460-H463 WeakPolarHBondContact O-CB 3.49Å; L460-H463 PolarHBondContact O-N 3.34Å; L460-H463 VanDerWaalsContact O-N 3.08Å; L460-I464 HydrophobicContact CD1-CD1 3.78Å; L460-I464 HydrophobicContact CD1-CG1 4Å; L460-I464 HydrophobicContact CG-CD1 3.91Å; L460-I464 HydrophobicContact CG-CG1 4.48Å; L460-I464 WeakPolarHBondContact O-CG1 3.4Å; L460-I464 PolarHBondContact O-N 2.93Å
461	Y	79.5	Confident	79.1	Confident	141 Å²	141	76.8 Å²	76.8	55%	0.553	37%	0.372	S	S	*	.	H	α-helix	trans	-62.5	-39.2	-179.3	-176.1	-103.4	0	0	0	112.6	S457 H463 I464 R465	S457-Y461 PolarHBondContact O-N 2.89Å; Y461-H463 VanDerWaalsContact C-N 3.3Å; Y461-H463 PolarHBondContact O-N 2.94Å; Y461-I464 PolarHBondContact O-N 3.44Å; Y461-R465 HydrophobicContact CE1-CG 4.22Å; Y461-R465 VanDerWaalsContact CE1-NE 3.33Å; Y461-R465 PolarHBondContact O-N 3.23Å
462	R	80.5	Confident	78.1	Confident	133 Å²	133	74.3 Å²	74.3	50%	0.502	36%	0.359	S	S	.	.	H	α-helix	trans	-66.4	-31.6	174.4	-173	171.9	72	-101.5	2.2	112.4	G458 D459 L460 K466	G458-R462 WeakPolarHBondContact O-CB 3.3Å; G458-R462 PolarHBondContact O-N 3.22Å; G458-R462 PolarHBondContact O-NH1 2.64Å; D459-R462 PolarHBondContact O-N 3.49Å; D459-R462 IonicContact OD1-CZ 2.69Å; D459-R462 IonicContact OD1-NH1 3.17Å; D459-R462 PolarHBondContact OD1-NH1 2.9Å; D459-R462 IonicContact OD1-NH2 2.73Å; D459-R462 PolarHBondContact OD1-NH2 3.19Å; L460-R462 VanDerWaalsContact C-N 3.34Å; L460-R462 PolarHBondContact O-N 2.76Å; R462-K466 WeakPolarHBondContact O-CB 3.48Å; R462-K466 WeakPolarHBondContact O-CG 3.32Å
463	H	83.9	Confident	77.1	Confident	27 Å²	27	69.1 Å²	69.1	13%	0.125	35%	0.351	C	S	.	.	H	α-helix	trans	-70.8	-51.1	171.9	157.3	56.9	0	0	0	111.7	C447 C450 Y454 D459 L460 Y461 R465 K466 A467 H468	C447-H463 WeakPolarHBondContact CB-NE2 3.4Å; C447-H463 PolarHBondContact SG-NE2 2.97Å; C450-H463 VanDerWaalsContact SG-CE1 3.57Å; C450-H463 PolarHBondContact SG-NE2 3.36Å; Y454-H463 HydrophobicContact CE1-CB 4.25Å; Y454-H463 HydrophobicContact CE2-CB 4.12Å; Y454-H463 AromaticContact CE2-CD2 3.44Å; Y454-H463 VanDerWaalsContact CE2-CD2 3.44Å; Y454-H463 WeakPolarHBondContact CE2-CD2 3.45Å; Y454-H463 AromaticContact CE2-CG 3.91Å; Y454-H463 AromaticContact CZ-CD2 3.68Å; Y454-H463 AromaticContact CZ-CG 3.66Å; Y454-H463 WeakPolarHBondContact OH-CB 3.33Å; Y454-H463 PolarHBondContact OH-CD2 3.13Å; D459-H463 WeakPolarHBondContact O-CB 3.23Å; D459-H463 PolarHBondContact O-N 2.91Å; L460-H463 WeakPolarHBondContact O-CA 3.31Å; L460-H463 WeakPolarHBondContact O-CB 3.49Å; L460-H463 PolarHBondContact O-N 3.34Å; L460-H463 VanDerWaalsContact O-N 3.08Å; Y461-H463 VanDerWaalsContact C-N 3.3Å; Y461-H463 PolarHBondContact O-N 2.94Å; H463-R465 PolarHBondContact O-N 3.42Å; H463-K466 CarbonylContact O-C 3.53Å; H463-K466 PolarHBondContact O-N 3.44Å; H463-A467 VanDerWaalsContact CE1-CB 3.48Å; H463-A467 WeakPolarHBondContact CE1-CB 3.04Å; H463-A467 WeakPolarHBondContact ND1-CB 3.47Å; H463-A467 WeakPolarHBondContact O-CB 3.27Å; H463-A467 PolarHBondContact O-N 3.48Å; H463-H468 AromaticContact CE1-CD2 3.77Å; H463-H468 AromaticContact CE1-NE2 3.59Å; H463-H468 AromaticContact NE2-CD2 3.79Å; H463-H468 AromaticContact NE2-NE2 3.71Å
464	I	81.6	Confident	76	Confident	28 Å²	28	73.4 Å²	73.4	14%	0.144	37%	0.366	C	S	.	.	H	α-helix	trans	-56	-49.5	-179.9	-62.9	168.3	0	0	0	110.3	Y449 L460 Y461 K466 A467 H468 L472	Y449-I464 HydrophobicContact CD2-CG2 4.25Å; Y449-I464 HydrophobicContact CE2-CG2 3.87Å; L460-I464 HydrophobicContact CD1-CD1 3.78Å; L460-I464 HydrophobicContact CD1-CG1 4Å; L460-I464 HydrophobicContact CG-CD1 3.91Å; L460-I464 HydrophobicContact CG-CG1 4.48Å; L460-I464 WeakPolarHBondContact O-CG1 3.4Å; L460-I464 PolarHBondContact O-N 2.93Å; Y461-I464 PolarHBondContact O-N 3.44Å; I464-K466 PolarHBondContact O-N 3.48Å; I464-K466 VanDerWaalsContact O-N 3.1Å; I464-A467 PolarHBondContact O-N 3.41Å; I464-H468 HydrophobicContact CG2-CB 4.18Å; I464-H468 CarbonylContact O-C 3.56Å; I464-H468 WeakPolarHBondContact O-CA 3.43Å; I464-H468 PolarHBondContact O-N 2.96Å; I464-L472 HydrophobicContact CG2-CD1 3.97Å; I464-L472 HydrophobicContact CG2-CD2 3.99Å; I464-L472 HydrophobicContact CG2-CG 4.04Å
465	R	84.3	Confident	74.6	Confident	139 Å²	139	82.2 Å²	82.2	53%	0.525	40%	0.399	S	S	.	.	H	α-helix	trans	-60.7	-21.3	177.4	-80.1	-151.4	-66.8	153.9	-7.8	115	Y461 H463 N469 L472	Y461-R465 HydrophobicContact CE1-CG 4.22Å; Y461-R465 VanDerWaalsContact CE1-NE 3.33Å; Y461-R465 PolarHBondContact O-N 3.23Å; H463-R465 PolarHBondContact O-N 3.42Å; R465-N469 PolarHBondContact O-ND2 3.03Å; R465-L472 HydrophobicContact CG-CD1 4.39Å
466	K	81.7	Confident	73.3	Confident	178 Å²	178	85.2 Å²	85.2	77%	0.774	42%	0.421	S	S	*	.	H	α-helix	trans	-102.2	-23.9	-178.7	-75.3	-168.4	173	-161.3	0	114.7	R462 H463 I464	R462-K466 WeakPolarHBondContact O-CB 3.48Å; R462-K466 WeakPolarHBondContact O-CG 3.32Å; H463-K466 CarbonylContact O-C 3.53Å; H463-K466 PolarHBondContact O-N 3.44Å; I464-K466 PolarHBondContact O-N 3.48Å; I464-K466 VanDerWaalsContact O-N 3.1Å
467	A	82.4	Confident	71.7	Confident	56 Å²	56	89.9 Å²	89.9	46%	0.463	44%	0.44	S	S	.	.	H	α-helix	trans	-115.8	-21.8	-174.2	0	0	0	0	0	113.9	H463 I464	H463-A467 VanDerWaalsContact CE1-CB 3.48Å; H463-A467 WeakPolarHBondContact CE1-CB 3.04Å; H463-A467 WeakPolarHBondContact ND1-CB 3.47Å; H463-A467 WeakPolarHBondContact O-CB 3.27Å; H463-A467 PolarHBondContact O-N 3.48Å; I464-A467 PolarHBondContact O-N 3.41Å
468	H	83.8	Confident	69.9	Low	23 Å²	23	94.1 Å²	94.1	11%	0.106	47%	0.467	C	S	.	.	S	Bend	trans	-130.6	32.1	-174.1	-60.6	-65.4	0	0	0	111.1	Y449 C450 H463 I464 E470 D471 L472	Y449-H468 VanDerWaalsContact CB-CE1 3.44Å; Y449-H468 WeakPolarHBondContact CB-CE1 3.38Å; Y449-H468 VanDerWaalsContact CB-CG 3.48Å; Y449-H468 VanDerWaalsContact CB-ND1 3.33Å; Y449-H468 WeakPolarHBondContact CB-ND1 3.44Å; Y449-H468 HydrophobicContact CD2-CB 3.89Å; Y449-H468 AromaticContact CD2-CG 3.91Å; Y449-H468 HydrophobicContact CE2-CB 4.32Å; Y449-H468 HydrophobicContact CG-CB 4Å; Y449-H468 AromaticContact CG-CG 3.76Å; Y449-H468 AromaticContact CG-ND1 3.94Å; C450-H468 PolarHBondContact SG-NE2 3.46Å; H463-H468 AromaticContact CE1-CD2 3.77Å; H463-H468 AromaticContact CE1-NE2 3.59Å; H463-H468 AromaticContact NE2-CD2 3.79Å; H463-H468 AromaticContact NE2-NE2 3.71Å; I464-H468 HydrophobicContact CG2-CB 4.18Å; I464-H468 CarbonylContact O-C 3.56Å; I464-H468 WeakPolarHBondContact O-CA 3.43Å; I464-H468 PolarHBondContact O-N 2.96Å; H468-E470 VanDerWaalsContact C-N 3.34Å; H468-E470 PolarHBondContact O-N 3.21Å; H468-D471 HydrophobicContact CB-CB 4.36Å; H468-D471 IonicContact CG-OD2 3.23Å; H468-D471 IonicContact ND1-OD2 2.75Å; H468-D471 PolarHBondContact ND1-OD2 2.93Å; H468-D471 PolarHBondContact O-N 3.46Å; H468-L472 PolarHBondContact O-N 3.25Å; H468-L472 VanDerWaalsContact O-N 3.09Å
469	N	73.3	Confident	68	Low	99 Å²	99	99 Å²	99	53%	0.529	48%	0.483	S	S	.	.	H	α-helix	trans	-61.7	-42.2	-176	-162	-80.2	0	0	0	111.7	R465 D471 L472 A473	R465-N469 PolarHBondContact O-ND2 3.03Å; N469-D471 VanDerWaalsContact C-N 3.34Å; N469-D471 PolarHBondContact O-N 3.03Å; N469-L472 PolarHBondContact O-N 3.06Å; N469-A473 PolarHBondContact O-N 3.06Å
470	E	70.1	Confident	66.5	Low	143 Å²	143	102.3 Å²	102.3	67%	0.668	51%	0.507	S	S	*	.	H	α-helix	trans	-68.5	-32.2	176.8	-56.9	-174.8	156.1	0	0	112.5	H468 A473 K474	H468-E470 VanDerWaalsContact C-N 3.34Å; H468-E470 PolarHBondContact O-N 3.21Å; E470-A473 PolarHBondContact O-N 3.13Å; E470-K474 VanDerWaalsContact O-CG 3.3Å; E470-K474 WeakPolarHBondContact O-CG 3.29Å; E470-K474 PolarHBondContact O-N 3.27Å
471	D	63.3	Low	64.5	Low	48 Å²	48	110 Å²	110	26%	0.257	54%	0.542	S	S	.	.	H	α-helix	trans	-76.8	-27	-179.4	-52.4	-45.7	0	0	0	112.2	Y449 H468 N469 K474	Y449-D471 HydrophobicContact CD1-CB 3.84Å; Y449-D471 HydrophobicContact CE1-CB 3.53Å; H468-D471 HydrophobicContact CB-CB 4.36Å; H468-D471 IonicContact CG-OD2 3.23Å; H468-D471 IonicContact ND1-OD2 2.75Å; H468-D471 PolarHBondContact ND1-OD2 2.93Å; H468-D471 PolarHBondContact O-N 3.46Å; N469-D471 VanDerWaalsContact C-N 3.34Å; N469-D471 PolarHBondContact O-N 3.03Å; D471-K474 IonicContact OD1-NZ 2.66Å; D471-K474 PolarHBondContact OD1-NZ 3.11Å
472	L	60.6	Low	62.9	Low	73 Å²	73	107.7 Å²	107.7	38%	0.382	55%	0.552	S	S	.	*	H	α-helix	trans	-64.9	-42.6	163.6	-68.1	174.8	0	0	0	111.3	I464 R465 H468 N469 R475	I464-L472 HydrophobicContact CG2-CD1 3.97Å; I464-L472 HydrophobicContact CG2-CD2 3.99Å; I464-L472 HydrophobicContact CG2-CG 4.04Å; R465-L472 HydrophobicContact CG-CD1 4.39Å; H468-L472 PolarHBondContact O-N 3.25Å; H468-L472 VanDerWaalsContact O-N 3.09Å; N469-L472 PolarHBondContact O-N 3.06Å; L472-R475 PolarHBondContact O-N 3.25Å
473	A	60.2	Low	61.1	Low	54 Å²	54	106.2 Å²	106.2	45%	0.446	56%	0.562	S	S	.	*	H	α-helix	trans	-72.1	-32.1	-177.6	0	0	0	0	0	113.6	N469 E470 R475 S476	N469-A473 PolarHBondContact O-N 3.06Å; E470-A473 PolarHBondContact O-N 3.13Å; A473-R475 VanDerWaalsContact C-N 3.33Å; A473-R475 PolarHBondContact O-N 2.66Å; A473-S476 PolarHBondContact O-N 3.25Å; A473-S476 PolarHBondContact O-OG 2.75Å
474	K	58.2	Low	58.8	Low	125 Å²	125	110.4 Å²	110.4	54%	0.543	59%	0.594	S	S	.	*	H	α-helix	trans	-59.4	-44.7	172.5	-70.9	161.8	-156.4	164.8	0	110.7	E470 D471 S476 K477	E470-K474 VanDerWaalsContact O-CG 3.3Å; E470-K474 WeakPolarHBondContact O-CG 3.29Å; E470-K474 PolarHBondContact O-N 3.27Å; D471-K474 IonicContact OD1-NZ 2.66Å; D471-K474 PolarHBondContact OD1-NZ 3.11Å; K474-S476 PolarHBondContact O-N 3.49Å; K474-K477 PolarHBondContact O-N 2.61Å
475	R	50.4	Low	57.1	Low	221 Å²	221	116.7 Å²	116.7	83%	0.834	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	-3.4	-179	-145.4	-179.9	-163.4	-105.1	2	114.9	L472 A473	L472-R475 PolarHBondContact O-N 3.25Å; A473-R475 VanDerWaalsContact C-N 3.33Å; A473-R475 PolarHBondContact O-N 2.66Å
476	S	51	Low	54.8	Low	99 Å²	99	118.2 Å²	118.2	69%	0.692	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	5.3	171.4	63.3	0	0	0	0	114	A473 K474	A473-S476 PolarHBondContact O-N 3.25Å; A473-S476 PolarHBondContact O-OG 2.75Å; K474-S476 PolarHBondContact O-N 3.49Å
477	K	41.8	Very low	52.8	Low	165 Å²	165	113.4 Å²	113.4	72%	0.717	65%	0.645	S	S	*	*	S	Bend	trans	-109.5	134.7	162	-67	-177.9	177.9	-177.8	0	108.4	K474	K474-K477 PolarHBondContact O-N 2.61Å
478	P	38.2	Very low	50.6	Low	125 Å²	125	117.5 Å²	117.5	81%	0.812	66%	0.664	S	S	*	*			trans	-70	136	164.3	30.1	-32	0	0	0	109.1
479	D	38.3	Very low	48.6	Very low	141 Å²	141	125 Å²	125	75%	0.754	70%	0.699	S	S	*	*			trans	-73.6	134.8	172.6	-93	-54.7	0	0	0	110.5
480	P	48.1	Very low	46.8	Very low	106 Å²	106	126.2 Å²	126.2	69%	0.688	71%	0.713	S	S	*	*	S	Bend	trans	-78.9	-17.3	178.6	31.7	-34.7	0	0	0	113.3	A482	P480-A482 PolarHBondContact O-N 3.47Å
481	E	44.3	Very low	45	Very low	187 Å²	187	127.6 Å²	127.6	87%	0.874	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85	33.1	-172.8	-59.7	-156	113.8	0	0	114.3
482	A	44.5	Very low	43.5	Very low	91 Å²	91	131.5 Å²	131.5	75%	0.752	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.6	-3.3	168.8	0	0	0	0	0	113.7	P480	P480-A482 PolarHBondContact O-N 3.47Å
483	S	42.7	Very low	42.1	Very low	103 Å²	103	131.3 Å²	131.3	72%	0.72	77%	0.77	S	S	*	*			trans	-136.4	73.4	-174.7	-62.4	0	0	0	0	112.4
484	S	35.9	Very low	40.7	Very low	114 Å²	114	134.8 Å²	134.8	80%	0.797	79%	0.791	S	S	*	*			trans	-156.5	64.5	170.1	-81.7	0	0	0	0	113.4
485	I	46.3	Very low	39.5	Very low	161 Å²	161	137.4 Å²	137.4	83%	0.826	81%	0.805	S	S	*	*	S	Bend	trans	-115.9	144.1	145.9	-64.2	-178.3	0	0	0	106.1
486	L	35.8	Very low	38.4	Very low	170 Å²	170	133.1 Å²	133.1	89%	0.89	80%	0.804	S	S	*	*	S	Bend	trans	69.2	95.9	-163.5	-47.3	-178.1	0	0	0	112.5
487	G	39.2	Very low	37.5	Very low	77 Å²	77	133.9 Å²	133.9	79%	0.794	81%	0.805	S	S	*	*			trans	-100.3	138.9	-178.2	0	0	0	0	0	113.7
488	V	37	Very low	36.8	Very low	142 Å²	142	135.6 Å²	135.6	86%	0.861	82%	0.815	S	S	*	*			trans	-134.9	135.9	160	-178.8	0	0	0	0	107.5
489	Q	41.5	Very low	36.5	Very low	181 Å²	181	140.8 Å²	140.8	85%	0.846	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-85.8	133.9	179.6	-66.1	178.4	51.1	0	0	111.9
490	P	35.9	Very low	36.3	Very low	125 Å²	125	142.4 Å²	142.4	81%	0.812	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-84.8	142.3	155.3	-10.7	29.2	0	0	0	111.3
491	L	31.2	Very low	35.5	Very low	171 Å²	171	142.4 Å²	142.4	90%	0.895	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-86.9	154.6	178.4	-80.5	158.2	0	0	0	112.8
492	S	32.4	Very low	35	Very low	131 Å²	131	140.2 Å²	140.2	92%	0.916	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-75.5	138.1	-177.5	-58.3	0	0	0	0	114.8
493	G	30.9	Very low	34.3	Very low	68 Å²	68	139.3 Å²	139.3	70%	0.701	82%	0.823	S	S	*	*			trans	163.3	137.1	166.7	0	0	0	0	0	110.2
494	S	31.1	Very low	33.7	Very low	128 Å²	128	138.6 Å²	138.6	90%	0.895	83%	0.832	S	S	*	*			cis	-147	165.4	9.6	-68.7	0	0	0	0	111.4
495	Q	32.6	Very low	33.4	Very low	179 Å²	179	137.2 Å²	137.2	84%	0.836	84%	0.836	S	S	*	*			trans	-88.6	138.8	-177.9	-59.2	175.2	10.9	0	0	113.2
496	T	28	Very low	32.6	Very low	131 Å²	131	133.1 Å²	133.1	80%	0.804	83%	0.833	S	S	*	*			trans	-140.2	94.1	145.2	40	0	0	0	0	107.7
497	T	31.1	Very low	33.1	Very low	116 Å²	116	131.2 Å²	131.2	71%	0.712	83%	0.831	S	S	*	*				59	91.6	90.4	64.2	0	0	0	0	115.3
498	E	28.5	Very low	34.3	Very low	200 Å²	200	133.2 Å²	133.2	94%	0.935	83%	0.83	S	S	*	*				-144.9	146.4	128.8	-122.6	-177.1	154.2	0	0	113.5
499	R	30.9	Very low	34.1	Very low	234 Å²	234	135.7 Å²	135.7	88%	0.883	83%	0.829	S	S	*	*			trans	-63.2	132.9	-172.6	-106	156.7	153.9	-150.1	-3.4	111.8
500	Q	33.6	Very low	33.6	Very low	175 Å²	175	133.1 Å²	133.1	82%	0.818	82%	0.822	S	S	*	*				68.9	140.4	63.5	-84.2	-164.6	3.7	0	0	117.4
501	S	32.5	Very low	33.4	Very low	107 Å²	107	136.4 Å²	136.4	75%	0.748	82%	0.823	S	S	*	*			trans	84.4	134.8	172.9	-59.7	0	0	0	0	116.9
502	T	32.7	Very low	33.4	Very low	141 Å²	141	134 Å²	134	87%	0.865	82%	0.815	S	S	*	*			cis	-165.2	154	-8.5	16.8	0	0	0	0	107.6
503	G	30.1	Very low	33.8	Very low	71 Å²	71	136 Å²	136	73%	0.732	82%	0.815	S	S	*	*			cis	163.7	159	-3	0	0	0	0	0	111.4
504	G	30.7	Very low	33.7	Very low	88 Å²	88	136 Å²	136	91%	0.907	82%	0.815	S	S	*	*			trans	77.2	144.2	173.6	0	0	0	0	0	116.2
505	G	30.3	Very low	34.8	Very low	86 Å²	86	136.5 Å²	136.5	89%	0.887	82%	0.815	S	S	*	*			cis	135.9	96.3	-6	0	0	0	0	0	113.3
506	G	29.7	Very low	35.4	Very low	74 Å²	74	137.5 Å²	137.5	76%	0.763	82%	0.817	S	S	*	*			trans	171.1	120.3	178.5	0	0	0	0	0	113.4
507	P	44.8	Very low	36	Very low	130 Å²	130	142.8 Å²	142.8	84%	0.844	84%	0.84	S	S	*	*			trans	-106.4	-174.7	-169.9	42.3	-35	0	0	0	114
508	P	65.1	Low	36.2	Very low	119 Å²	119	144.2 Å²	144.2	77%	0.773	85%	0.847	S	S	*	*			trans	-108.7	166.4	-142.5	41.6	-39.6	0	0	0	117
509	K	32.2	Very low	36.6	Very low	194 Å²	194	141.2 Å²	141.2	84%	0.843	84%	0.842	S	S	*	*			trans	-151.4	116.3	163	-69.6	-161.8	175.7	-174	0	115.6
510	D	32.3	Very low	36.9	Very low	128 Å²	128	136.1 Å²	136.1	68%	0.684	84%	0.84	S	S	*	*				46.5	116.9	122.3	-54.1	-53.3	0	0	0	124.7
511	F	31.5	Very low	37.1	Very low	194 Å²	194	133.8 Å²	133.8	85%	0.851	84%	0.841	S	S	*	*				72.4	155.2	125.5	-90.4	-88.2	0	0	0	125.4
512	V	31.4	Very low	37.4	Very low	120 Å²	120	135.4 Å²	135.4	73%	0.727	85%	0.847	S	S	*	*			trans	92.9	100.8	159.8	-162.5	0	0	0	0	120.5
513	L	39.8	Very low	37.7	Very low	172 Å²	172	135.1 Å²	135.1	90%	0.901	85%	0.846	S	S	*	*			trans	21.5	132.4	136.2	-61.3	165.8	0	0	0	122.2
514	G	29.8	Very low	38.3	Very low	69 Å²	69	139.6 Å²	139.6	71%	0.711	85%	0.854	S	S	*	*			trans	-142.6	150.5	155.3	0	0	0	0	0	110.9
515	P	52.5	Low	38.9	Very low	138 Å²	138	143.6 Å²	143.6	90%	0.896	85%	0.85	S	S	*	*			trans	-94	168.9	-157.6	36.5	-37.7	0	0	0	116.8
516	K	46.2	Very low	39.6	Very low	200 Å²	200	148.4 Å²	148.4	87%	0.87	85%	0.847	S	S	*	*			trans	-75.1	155.8	172.6	-59.1	171.1	178.7	173.9	0	112.7
517	N	39.8	Very low	40.5	Very low	243 Å²	243	155.2 Å²	155.2	100%	1.299	86%	0.855	S	S	*	*				-134.7	0	127.9	-106.4	-19	0	0	0	107.7

Retrieved 517 of 517 residues in 61.3 ms (Link to these results)

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