KIF3B_HUMAN Loading...

Kinesin-like protein KIF3B

Microtubule-based molecular motor that transport intracellular cargos, such as vesicles, organelles and protein complexes. Uses ATP hydrolysis to generate force to bind and move along the microtubule (By similarity). Plays a role in cilia formation¹. Involved in photoreceptor integrity and opsin trafficking in rod photoreceptors². Transports vesicles containing N-methyl-D-aspartate (NMDA) receptor subunit GRIN2A into neuronal dendrites (By similarity).

AlphaFold DB , UniProt , Accession O15066, Species HUMAN (Homo sapiens, Human), Gene KIF3B, Length 747 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.5	Very low	63.8	Low	245 Å²	245	110.9 Å²	110.9	100%	1.207	59%	0.588	S	S	*	*				0	120.6	0	-67.9	-163.9	-114.5	0	0	108.3	K3	M1-K3 PolarHBondContact O-N 3.23Å
2	S	34.5	Very low	66.5	Low	116 Å²	116	101.7 Å²	101.7	81%	0.811	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-67.9	119.4	169.9	39.8	0	0	0	0	108.7	L4	S2-L4 PolarHBondContact O-N 3.42Å; S2-L4 VanDerWaalsContact O-N 3.07Å
3	K	39.3	Very low	68.8	Low	200 Å²	200	94 Å²	94	87%	0.87	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-56.8	118.1	165	-74.7	-179.3	177.6	176.9	0	106.5	M1 K5	M1-K3 PolarHBondContact O-N 3.23Å; K3-K5 PolarHBondContact O-N 3.39Å
4	L	40.5	Very low	70.9	Confident	165 Å²	165	87.4 Å²	87.4	86%	0.864	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-52.7	117.8	171.2	-77.2	126	0	0	0	107	S2 S6	S2-L4 PolarHBondContact O-N 3.42Å; S2-L4 VanDerWaalsContact O-N 3.07Å; L4-S6 VanDerWaalsContact C-N 3.32Å; L4-S6 PolarHBondContact O-N 3.04Å
5	K	47.7	Very low	72.6	Confident	202 Å²	202	82.5 Å²	82.5	88%	0.878	44%	0.436	S	S	*	.			trans	-62.6	97.3	176	-72.3	-174.5	176.1	-175.5	0	107.1	K3 S7	K3-K5 PolarHBondContact O-N 3.39Å; K5-S7 PolarHBondContact O-N 3.35Å
6	S	61	Low	74.1	Confident	106 Å²	106	77.4 Å²	77.4	74%	0.741	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-63.2	120.1	-175.5	52.9	0	0	0	0	109.2	L4 E8	L4-S6 VanDerWaalsContact C-N 3.32Å; L4-S6 PolarHBondContact O-N 3.04Å; S6-E8 PolarHBondContact O-N 2.85Å
7	S	77.9	Confident	75.4	Confident	66 Å²	66	75.1 Å²	75.1	46%	0.462	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-64.4	132.7	169.2	43.9	0	0	0	0	109.8	K5 N342	K5-S7 PolarHBondContact O-N 3.35Å; S7-N342 WeakPolarHBondContact CA-O 3.31Å
8	E	88.1	Confident	76.4	Confident	55 Å²	55	75 Å²	75	26%	0.257	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	132.5	175	-164.1	175	148.7	0	0	107.8	S6 K310 N342 P344	S6-E8 PolarHBondContact O-N 2.85Å; E8-K310 WeakPolarHBondContact OE2-CD 3.3Å; E8-K310 WeakPolarHBondContact OE2-CE 3.4Å; E8-K310 WeakPolarHBondContact OE2-CG 3.47Å; E8-K310 IonicContact OE2-NZ 2.76Å; E8-N342 PolarHBondContact N-O 3.37Å; E8-N342 PolarHBondContact O-N 2.81Å; E8-P344 HydrophobicContact CB-CG 4Å
9	S	90.9	Very high	77.2	Confident	41 Å²	41	73.1 Å²	73.1	29%	0.287	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	148.4	169	-73.4	0	0	0	0	110	R11 I340 K341	S9-R11 PolarHBondContact O-N 2.94Å; S9-I340 WeakPolarHBondContact CA-O 3.5Å; S9-K341 PolarHBondContact OG-NZ 3.06Å
10	V	93.9	Very high	77.9	Confident	1 Å²	1	72.3 Å²	72.3	1%	0.006	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-60.6	123.1	159.9	175.2	0	0	0	0	108.3	V12 T311 I340	V10-V12 HydrophobicContact CG1-CG2 4.39Å; V10-T311 HydrophobicContact CG1-CG2 4.06Å; V10-I340 HydrophobicContact CB-CB 4.3Å; V10-I340 HydrophobicContact CG2-CB 3.73Å; V10-I340 HydrophobicContact CG2-CG2 3.76Å; V10-I340 PolarHBondContact N-O 3.2Å
11	R	94.7	Very high	78.5	Confident	23 Å²	23	71.7 Å²	71.7	9%	0.087	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	135.3	176.7	-71.7	-172	-74	137.5	-0.5	109.3	S9 T76 T311 V312 M313	S9-R11 PolarHBondContact O-N 2.94Å; R11-T76 PolarHBondContact NH1-O 3.26Å; R11-T311 PolarHBondContact N-O 3.11Å; R11-V312 HydrophobicContact CB-CG2 4.17Å; R11-V312 CarbonylContact O-C 3.54Å; R11-V312 VanDerWaalsContact O-CA 3.28Å; R11-V312 WeakPolarHBondContact O-CA 3.47Å; R11-M313 PolarHBondContact O-N 2.89Å
12	V	96.3	Very high	81.1	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	126.2	-177.2	-177.1	0	0	0	0	109.6	V10 F59 D60 M313 A334 A337 K338	V10-V12 HydrophobicContact CG1-CG2 4.39Å; V12-F59 HydrophobicContact CB-CD1 4.22Å; V12-F59 HydrophobicContact CG1-CD1 3.7Å; V12-F59 HydrophobicContact CG1-CE1 4.04Å; V12-D60 PolarHBondContact N-OD2 3.35Å; V12-D60 PolarHBondContact O-N 3.35Å; V12-M313 HydrophobicContact CG1-CB 4.31Å; V12-M313 HydrophobicContact CG1-CG 4.41Å; V12-M313 HydrophobicContact CG1-SD 4.3Å; V12-M313 HydrophobicContact CG2-CB 4.11Å; V12-A334 HydrophobicContact CG1-CB 3.76Å; V12-A337 HydrophobicContact CG2-CB 4.09Å; V12-K338 HydrophobicContact CB-CB 4.06Å; V12-K338 HydrophobicContact CG2-CB 3.57Å
13	V	96.7	Very high	83.7	Confident	2 Å²	2	63.4 Å²	63.4	1%	0.012	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	140.9	176	-55.6	0	0	0	0	111	A61 Y63 T76 M313 V314 A315	V13-A61 VanDerWaalsContact CA-O 3.24Å; V13-A61 WeakPolarHBondContact CA-O 3.39Å; V13-A61 HydrophobicContact CB-CB 4.43Å; V13-A61 WeakPolarHBondContact CB-O 3.32Å; V13-A61 HydrophobicContact CG1-CB 3.79Å; V13-Y63 HydrophobicContact CB-CD2 4.36Å; V13-Y63 HydrophobicContact CB-CE2 4.03Å; V13-Y63 HydrophobicContact CG1-CE2 4.34Å; V13-Y63 HydrophobicContact CG2-CE2 4.36Å; V13-T76 HydrophobicContact CG1-CG2 3.68Å; V13-T76 HydrophobicContact CG2-CG2 4.11Å; V13-M313 PolarHBondContact N-O 2.63Å; V13-V314 HydrophobicContact CG2-CB 4.4Å; V13-V314 HydrophobicContact CG2-CG1 4.33Å; V13-V314 HydrophobicContact CG2-CG2 4.04Å; V13-V314 WeakPolarHBondContact O-CA 3.26Å; V13-A315 PolarHBondContact O-N 3.47Å
14	V	97.4	Very high	86.2	Confident	1 Å²	1	60.5 Å²	60.5	1%	0.006	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	136.5	175.8	-178.7	0	0	0	0	110	V41 F59 A61 V62 Y63 A315 V317 L331	V14-V41 HydrophobicContact CB-CG2 3.98Å; V14-V41 HydrophobicContact CG1-CG2 3.96Å; V14-V41 HydrophobicContact CG2-CG2 4.22Å; V14-F59 HydrophobicContact CB-CD2 4.44Å; V14-F59 HydrophobicContact CG2-CD1 4.07Å; V14-F59 HydrophobicContact CG2-CD2 3.41Å; V14-F59 VanDerWaalsContact CG2-CD2 3.41Å; V14-F59 HydrophobicContact CG2-CE1 4.04Å; V14-F59 HydrophobicContact CG2-CE2 3.37Å; V14-F59 HydrophobicContact CG2-CG 3.77Å; V14-F59 HydrophobicContact CG2-CZ 3.7Å; V14-A61 PolarHBondContact N-O 3.4Å; V14-V62 HydrophobicContact CB-CG1 4.33Å; V14-V62 CarbonylContact O-C 3.51Å; V14-V62 WeakPolarHBondContact O-CA 3.29Å; V14-Y63 PolarHBondContact O-N 2.59Å; V14-A315 CarbonylContact C-O 3.57Å; V14-A315 WeakPolarHBondContact CA-O 3.48Å; V14-A315 HydrophobicContact CG2-CB 4.15Å; V14-V317 HydrophobicContact CG1-CG1 4.44Å; V14-V317 HydrophobicContact CG1-CG2 3.77Å; V14-L331 HydrophobicContact CB-CD2 4.48Å; V14-L331 HydrophobicContact CG1-CD2 3.91Å; V14-L331 HydrophobicContact CG2-CD2 3.7Å
15	R	97.1	Very high	88.8	Confident	15 Å²	15	56.8 Å²	56.8	6%	0.057	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	113.5	172.3	-170.5	-175.9	-166.3	175	12.7	111	A67 Q69 T105 A315 N316 V317	R15-A67 PolarHBondContact NH2-O 3.08Å; R15-Q69 VanDerWaalsContact CZ-OE1 3.23Å; R15-T105 PolarHBondContact NH1-OG1 2.98Å; R15-A315 PolarHBondContact N-O 2.85Å; R15-N316 WeakPolarHBondContact O-CA 3.29Å; R15-V317 PolarHBondContact O-N 2.87Å
16	C	96.8	Very high	90.9	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.007	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	115.3	173.9	-171.1	0	0	0	0	109.9	V32 V34 Y63 D64 W65 V317	C16-V32 HydrophobicContact CB-CG1 4.5Å; C16-V34 HydrophobicContact CB-CG2 3.83Å; C16-Y63 PolarHBondContact N-O 3.19Å; C16-D64 CarbonylContact O-C 3.37Å; C16-D64 VanDerWaalsContact O-C 3.26Å; C16-W65 WeakPolarHBondContact O-CA 3.34Å; C16-W65 PolarHBondContact O-N 3.01Å; C16-V317 HydrophobicContact CB-CG2 3.88Å
17	R	95	Very high	92.3	Very high	37 Å²	37	49.2 Å²	49.2	14%	0.14	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-75.3	162.5	179.9	65.4	153	173.7	70.9	4.7	112.5	N20 E23 G99 T100 V317 P319	R17-N20 PolarHBondContact NH2-ND2 3.37Å; R17-E23 IonicContact CZ-OE1 3.56Å; R17-E23 IonicContact CZ-OE2 3.01Å; R17-E23 IonicContact NH1-OE1 2.71Å; R17-E23 PolarHBondContact NH1-OE1 2.91Å; R17-E23 IonicContact NH1-OE2 2.62Å; R17-E23 PolarHBondContact NH1-OE2 3.46Å; R17-E23 IonicContact NH2-OE1 3.5Å; R17-E23 PolarHBondContact NH2-OE1 3.41Å; R17-E23 IonicContact NH2-OE2 2.7Å; R17-G99 PolarHBondContact NE-O 2.92Å; R17-T100 WeakPolarHBondContact CD-O 3.35Å; R17-T100 WeakPolarHBondContact CG-O 3.48Å; R17-V317 PolarHBondContact N-O 3.16Å; R17-P319 WeakPolarHBondContact O-CD 3.44Å; R17-P319 WeakPolarHBondContact O-CG 3.48Å
18	P	94.6	Very high	93	Very high	74 Å²	74	49.9 Å²	49.9	48%	0.481	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-53.4	149.5	164.2	-24.1	32.1	0	0	0	112.8	N20 W65	P18-N20 PolarHBondContact O-N 3.09Å; P18-W65 HydrophobicContact CB-CB 4.35Å; P18-W65 HydrophobicContact CG-CB 4.05Å; P18-W65 WeakPolarHBondContact CG-O 3.48Å
19	M	91.9	Very high	93.1	Very high	38 Å²	38	52.3 Å²	52.3	19%	0.187	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-66	126.9	170.7	-171.5	177	-99.8	0	0	109.8	E23 K24 Y28 P319 A320	M19-E23 WeakPolarHBondContact CA-OE2 3.43Å; M19-E23 HydrophobicContact CE-CB 4.48Å; M19-E23 HydrophobicContact CG-CB 3.46Å; M19-E23 VanDerWaalsContact CG-CB 3.46Å; M19-E23 HydrophobicContact CG-CG 4.45Å; M19-E23 WeakPolarHBondContact CG-OE2 3.48Å; M19-E23 HydrophobicContact SD-CB 4.23Å; M19-K24 HydrophobicContact CB-CG 4.41Å; M19-K24 HydrophobicContact CG-CG 3.91Å; M19-K24 VanDerWaalsContact O-CE 3.29Å; M19-K24 WeakPolarHBondContact O-CE 3.49Å; M19-K24 HydrophobicContact SD-CG 3.93Å; M19-Y28 WeakPolarHBondContact CE-O 3.32Å; M19-P319 HydrophobicContact CB-CG 3.82Å; M19-P319 HydrophobicContact CG-CG 4.45Å; M19-A320 HydrophobicContact CE-CB 3.73Å
20	N	89.5	Confident	93.3	Very high	57 Å²	57	54 Å²	54	31%	0.305	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-80.4	169.5	-172.3	77.3	46.6	0	0	0	111.9	R17 P18 K22 E23 K24	R17-N20 PolarHBondContact NH2-ND2 3.37Å; P18-N20 PolarHBondContact O-N 3.09Å; N20-K22 VanDerWaalsContact C-N 3.32Å; N20-K22 PolarHBondContact O-N 2.96Å; N20-K22 WeakPolarHBondContact OD1-CA 3.47Å; N20-K22 WeakPolarHBondContact OD1-CB 3.24Å; N20-K22 PolarHBondContact OD1-N 3.16Å; N20-E23 PolarHBondContact N-OE2 2.97Å; N20-E23 PolarHBondContact ND2-OE1 3Å; N20-E23 PolarHBondContact ND2-OE2 3.13Å; N20-E23 PolarHBondContact O-N 3.18Å; N20-E23 PolarHBondContact OD1-N 3.14Å; N20-K24 WeakPolarHBondContact O-CG 3.36Å; N20-K24 PolarHBondContact O-N 3.08Å
21	G	90.3	Very high	93.2	Very high	60 Å²	60	54.2 Å²	54.2	62%	0.619	30%	0.304	S	S	*	.	H	α-helix	trans	-60.8	-35.6	-177.3	0	0	0	0	0	114.3	A25	G21-A25 VanDerWaalsContact O-CB 3.29Å; G21-A25 WeakPolarHBondContact O-CB 3.34Å; G21-A25 PolarHBondContact O-N 3.21Å
22	K	88.2	Confident	93.3	Very high	179 Å²	179	53.2 Å²	53.2	78%	0.778	30%	0.3	S	S	*	.	H	α-helix	trans	-70.6	-42.2	177.7	-63.5	-177.7	178.3	179.6	0	111.5	N20 A25 A26	N20-K22 VanDerWaalsContact C-N 3.32Å; N20-K22 PolarHBondContact O-N 2.96Å; N20-K22 WeakPolarHBondContact OD1-CA 3.47Å; N20-K22 WeakPolarHBondContact OD1-CB 3.24Å; N20-K22 PolarHBondContact OD1-N 3.16Å; K22-A25 PolarHBondContact O-N 3.15Å; K22-A26 WeakPolarHBondContact O-CB 3.41Å; K22-A26 PolarHBondContact O-N 3.49Å
23	E	90.7	Very high	93.2	Very high	8 Å²	8	55.7 Å²	55.7	4%	0.037	31%	0.314	C	S	.	.	H	α-helix	trans	-64	-40.4	178	-69.5	165.9	161.6	0	0	112	R17 M19 N20 A26 S27 Y28 A320	R17-E23 IonicContact CZ-OE1 3.56Å; R17-E23 IonicContact CZ-OE2 3.01Å; R17-E23 IonicContact NH1-OE1 2.71Å; R17-E23 PolarHBondContact NH1-OE1 2.91Å; R17-E23 IonicContact NH1-OE2 2.62Å; R17-E23 PolarHBondContact NH1-OE2 3.46Å; R17-E23 IonicContact NH2-OE1 3.5Å; R17-E23 PolarHBondContact NH2-OE1 3.41Å; R17-E23 IonicContact NH2-OE2 2.7Å; M19-E23 WeakPolarHBondContact CA-OE2 3.43Å; M19-E23 HydrophobicContact CE-CB 4.48Å; M19-E23 HydrophobicContact CG-CB 3.46Å; M19-E23 VanDerWaalsContact CG-CB 3.46Å; M19-E23 HydrophobicContact CG-CG 4.45Å; M19-E23 WeakPolarHBondContact CG-OE2 3.48Å; M19-E23 HydrophobicContact SD-CB 4.23Å; N20-E23 PolarHBondContact N-OE2 2.97Å; N20-E23 PolarHBondContact ND2-OE1 3Å; N20-E23 PolarHBondContact ND2-OE2 3.13Å; N20-E23 PolarHBondContact O-N 3.18Å; N20-E23 PolarHBondContact OD1-N 3.14Å; E23-A26 PolarHBondContact O-N 2.95Å; E23-S27 PolarHBondContact O-N 3.5Å; E23-Y28 HydrophobicContact CB-CD2 4.16Å; E23-Y28 HydrophobicContact CG-CD2 4.22Å; E23-Y28 PolarHBondContact O-N 3.1Å; E23-A320 HydrophobicContact CB-CB 4.14Å; E23-A320 HydrophobicContact CG-CB 3.78Å
24	K	92.1	Very high	93.1	Very high	139 Å²	139	56.8 Å²	56.8	60%	0.604	32%	0.32	S	S	*	.	H	α-helix	trans	-65.7	-43.4	173.1	-70.1	178.2	179.1	176.9	0	112.1	M19 N20 A26 S27	M19-K24 HydrophobicContact CB-CG 4.41Å; M19-K24 HydrophobicContact CG-CG 3.91Å; M19-K24 VanDerWaalsContact O-CE 3.29Å; M19-K24 WeakPolarHBondContact O-CE 3.49Å; M19-K24 HydrophobicContact SD-CG 3.93Å; N20-K24 WeakPolarHBondContact O-CG 3.36Å; N20-K24 PolarHBondContact O-N 3.08Å; K24-A26 VanDerWaalsContact C-N 3.29Å; K24-A26 PolarHBondContact O-N 3.03Å; K24-S27 PolarHBondContact O-N 3.19Å; K24-S27 VanDerWaalsContact O-N 3.15Å
25	A	94	Very high	92.9	Very high	87 Å²	87	60.1 Å²	60.1	72%	0.719	34%	0.338	S	S	*	.	H	α-helix	trans	-67.3	-28.8	178.8	0	0	0	0	0	113.2	G21 K22 S27	G21-A25 VanDerWaalsContact O-CB 3.29Å; G21-A25 WeakPolarHBondContact O-CB 3.34Å; G21-A25 PolarHBondContact O-N 3.21Å; K22-A25 PolarHBondContact O-N 3.15Å; A25-S27 VanDerWaalsContact C-N 3.29Å
26	A	91.8	Very high	92.6	Very high	46 Å²	46	62 Å²	62	38%	0.38	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	3	174	0	0	0	0	0	113.9	K22 E23 K24 Y28	K22-A26 WeakPolarHBondContact O-CB 3.41Å; K22-A26 PolarHBondContact O-N 3.49Å; E23-A26 PolarHBondContact O-N 2.95Å; K24-A26 VanDerWaalsContact C-N 3.29Å; K24-A26 PolarHBondContact O-N 3.03Å; A26-Y28 VanDerWaalsContact C-N 3.27Å; A26-Y28 HydrophobicContact CB-CD1 4.4Å; A26-Y28 HydrophobicContact CB-CD2 3.93Å; A26-Y28 HydrophobicContact CB-CE1 4.06Å; A26-Y28 HydrophobicContact CB-CE2 3.55Å; A26-Y28 HydrophobicContact CB-CG 4.32Å; A26-Y28 PolarHBondContact O-N 3.4Å
27	S	91.1	Very high	92.2	Very high	103 Å²	103	69.9 Å²	69.9	72%	0.72	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	37.7	-179.6	-58.2	0	0	0	0	114.4	E23 K24 A25	E23-S27 PolarHBondContact O-N 3.5Å; K24-S27 PolarHBondContact O-N 3.19Å; K24-S27 VanDerWaalsContact O-N 3.15Å; A25-S27 VanDerWaalsContact C-N 3.29Å
28	Y	91.8	Very high	91.9	Very high	81 Å²	81	69.5 Å²	69.5	32%	0.318	39%	0.386	S	S	.	.			trans	-74.1	139.1	174.2	-62.1	-40.9	0	0	0	111.6	M19 E23 A26 A320 Y322	M19-Y28 WeakPolarHBondContact CE-O 3.32Å; E23-Y28 HydrophobicContact CB-CD2 4.16Å; E23-Y28 HydrophobicContact CG-CD2 4.22Å; E23-Y28 PolarHBondContact O-N 3.1Å; A26-Y28 VanDerWaalsContact C-N 3.27Å; A26-Y28 HydrophobicContact CB-CD1 4.4Å; A26-Y28 HydrophobicContact CB-CD2 3.93Å; A26-Y28 HydrophobicContact CB-CE1 4.06Å; A26-Y28 HydrophobicContact CB-CE2 3.55Å; A26-Y28 HydrophobicContact CB-CG 4.32Å; A26-Y28 PolarHBondContact O-N 3.4Å; Y28-A320 HydrophobicContact CD2-CB 4.34Å; Y28-Y322 HydrophobicContact CD2-CG 4.47Å; Y28-Y322 HydrophobicContact CE1-CD2 4.21Å; Y28-Y322 HydrophobicContact CE1-CG 4.27Å; Y28-Y322 HydrophobicContact CE2-CD1 4.3Å; Y28-Y322 HydrophobicContact CE2-CD2 4.39Å; Y28-Y322 AromaticContact CE2-CG 3.83Å; Y28-Y322 HydrophobicContact CE2-CG 3.83Å; Y28-Y322 AromaticContact CZ-CD2 3.82Å; Y28-Y322 AromaticContact CZ-CG 3.73Å
29	D	91.3	Very high	91.7	Very high	105 Å²	105	66 Å²	66	56%	0.561	36%	0.363	S	S	*	.			trans	-69.5	152	175.7	-58.6	-67.6	0	0	0	112.6	V31 A320 S321	D29-V31 HydrophobicContact CB-CG1 4.47Å; D29-V31 PolarHBondContact O-N 2.97Å; D29-A320 CarbonylContact O-C 3.6Å; D29-A320 WeakPolarHBondContact O-CA 3.32Å; D29-S321 PolarHBondContact N-OG 3.5Å; D29-S321 PolarHBondContact O-N 3.36Å
30	K	93.5	Very high	91.8	Very high	78 Å²	78	66.2 Å²	66.2	34%	0.339	36%	0.364	S	S	.	.	B	Isolated β-bridge	trans	-81.4	108	166.7	176.4	172.5	176.2	-67.9	0	109.5	V32 D33 P319	K30-V32 VanDerWaalsContact CE-O 3.29Å; K30-V32 WeakPolarHBondContact CE-O 3.28Å; K30-V32 PolarHBondContact NZ-O 3.46Å; K30-D33 IonicContact NZ-OD1 2.62Å; K30-D33 PolarHBondContact NZ-OD1 2.85Å; K30-P319 CarbonylContact C-O 3.56Å; K30-P319 WeakPolarHBondContact CA-O 3.37Å; K30-P319 HydrophobicContact CG-CB 4.31Å
31	V	93.4	Very high	92	Very high	5 Å²	5	63.5 Å²	63.5	3%	0.03	35%	0.349	C	S	.	.			trans	-101.3	-14.6	-178.6	-64.8	0	0	0	0	114.2	D29 V43 K44 P46 P319 V324	D29-V31 HydrophobicContact CB-CG1 4.47Å; D29-V31 PolarHBondContact O-N 2.97Å; V31-V43 WeakPolarHBondContact O-CA 3.17Å; V31-K44 HydrophobicContact CB-CB 4.46Å; V31-K44 WeakPolarHBondContact CB-O 3.3Å; V31-K44 PolarHBondContact O-N 3.46Å; V31-P46 HydrophobicContact CG1-CG 4.26Å; V31-P319 PolarHBondContact N-O 3.01Å; V31-V324 HydrophobicContact CG2-CB 4.26Å; V31-V324 HydrophobicContact CG2-CG2 4.17Å
32	V	95	Very high	92.2	Very high	1 Å²	1	61.9 Å²	61.9	1%	0.006	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	122.6	178.4	-172.3	0	0	0	0	110	C16 K30 V34 V41 V43 G318 T327	C16-V32 HydrophobicContact CB-CG1 4.5Å; K30-V32 VanDerWaalsContact CE-O 3.29Å; K30-V32 WeakPolarHBondContact CE-O 3.28Å; K30-V32 PolarHBondContact NZ-O 3.46Å; V32-V34 HydrophobicContact CG1-CG2 4.11Å; V32-V41 HydrophobicContact CG1-CG1 3.63Å; V32-V43 HydrophobicContact CG2-CG2 4.49Å; V32-G318 WeakPolarHBondContact CG2-O 3.21Å; V32-T327 HydrophobicContact CG2-CG2 3.9Å
33	D	94.3	Very high	92.4	Very high	52 Å²	52	53.6 Å²	53.6	28%	0.278	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	139.9	168.8	-68.6	-45.5	0	0	0	109.7	K30 V41 S42 K44	K30-D33 IonicContact NZ-OD1 2.62Å; K30-D33 PolarHBondContact NZ-OD1 2.85Å; D33-V41 WeakPolarHBondContact O-CA 3.47Å; D33-S42 PolarHBondContact N-O 3.28Å; D33-S42 PolarHBondContact O-N 3.31Å; D33-K44 WeakPolarHBondContact OD2-CE 3.46Å; D33-K44 IonicContact OD2-NZ 3.24Å; D33-K44 PolarHBondContact OD2-NZ 3.12Å
34	V	95.4	Very high	92.4	Very high	26 Å²	26	57.7 Å²	57.7	16%	0.158	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	119	-171.4	179.8	0	0	0	0	108.4	C16 V32 V36 V41 V62 D64	C16-V34 HydrophobicContact CB-CG2 3.83Å; V32-V34 HydrophobicContact CG1-CG2 4.11Å; V34-V36 HydrophobicContact CG1-CG2 4.17Å; V34-V41 HydrophobicContact CG2-CG1 4.48Å; V34-V62 HydrophobicContact CG1-CB 3.83Å; V34-V62 HydrophobicContact CG1-CG2 3.46Å; V34-V62 VanDerWaalsContact CG1-CG2 3.46Å; V34-D64 HydrophobicContact CB-CB 4.17Å; V34-D64 HydrophobicContact CG1-CB 4.19Å
35	D	93.1	Very high	92	Very high	70 Å²	70	52.7 Å²	52.7	37%	0.374	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	98.4	171.4	-166.7	-40.6	0	0	0	109.8	K37 L38 G39 Q40 V62	D35-K37 PolarHBondContact O-N 3.48Å; D35-K37 WeakPolarHBondContact OD1-CA 3.38Å; D35-K37 WeakPolarHBondContact OD1-CB 3.28Å; D35-K37 PolarHBondContact OD1-N 3.12Å; D35-L38 HydrophobicContact CB-CB 4.31Å; D35-L38 PolarHBondContact O-N 2.81Å; D35-L38 PolarHBondContact OD1-N 2.7Å; D35-G39 PolarHBondContact O-N 2.99Å; D35-Q40 HydrophobicContact CB-CB 4.35Å; D35-Q40 PolarHBondContact N-O 2.94Å; D35-Q40 PolarHBondContact O-N 3.49Å; D35-V62 WeakPolarHBondContact O-CG2 3Å
36	V	91.7	Very high	91.4	Very high	55 Å²	55	51.6 Å²	51.6	33%	0.333	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-26.7	-178.8	-178.5	0	0	0	0	112.5	V34 D64 R507	V34-V36 HydrophobicContact CG1-CG2 4.17Å; V36-D64 HydrophobicContact CG2-CB 4.16Å; V36-R507 PolarHBondContact O-NE 3.49Å; V36-R507 PolarHBondContact O-NH2 3.24Å
37	K	87.5	Confident	90.8	Very high	166 Å²	166	56.4 Å²	56.4	72%	0.722	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-41.9	179.2	-66.3	-170.1	174.7	-165.8	0	111.3	D35 R507	D35-K37 PolarHBondContact O-N 3.48Å; D35-K37 WeakPolarHBondContact OD1-CA 3.38Å; D35-K37 WeakPolarHBondContact OD1-CB 3.28Å; D35-K37 PolarHBondContact OD1-N 3.12Å; K37-R507 WeakPolarHBondContact O-CG 3.26Å
38	L	87.8	Confident	90.1	Very high	29 Å²	29	53 Å²	53	15%	0.152	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-11.1	-179.1	-55.2	-172.6	0	0	0	113.3	D35 Q40 Q510 Q511 E514	D35-L38 HydrophobicContact CB-CB 4.31Å; D35-L38 PolarHBondContact O-N 2.81Å; D35-L38 PolarHBondContact OD1-N 2.7Å; L38-Q40 VanDerWaalsContact C-N 3.27Å; L38-Q40 HydrophobicContact CB-CB 4.22Å; L38-Q40 HydrophobicContact CB-CG 3.72Å; L38-Q510 HydrophobicContact CD2-CG 3.44Å; L38-Q510 VanDerWaalsContact CD2-CG 3.44Å; L38-Q511 WeakPolarHBondContact O-CG 3.38Å; L38-Q511 PolarHBondContact O-NE2 2.92Å; L38-E514 WeakPolarHBondContact CD1-OE1 3.45Å; L38-E514 WeakPolarHBondContact CD2-OE1 3.46Å
39	G	91	Very high	89.2	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.5	27.8	-171.8	0	0	0	0	0	112.3	D35 T58 F59 V62	D35-G39 PolarHBondContact O-N 2.99Å; G39-T58 WeakPolarHBondContact O-CA 3.45Å; G39-F59 PolarHBondContact O-N 2.96Å; G39-V62 VanDerWaalsContact C-CG1 3.4Å; G39-V62 VanDerWaalsContact O-CG1 3.27Å; G39-V62 WeakPolarHBondContact O-CG1 3.47Å
40	Q	93.3	Very high	88	Confident	44 Å²	44	54.5 Å²	54.5	21%	0.206	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	143.6	-171.9	-66	-176.4	21.8	0	0	112.6	D35 L38 T56 F57 T58 E514	D35-Q40 HydrophobicContact CB-CB 4.35Å; D35-Q40 PolarHBondContact N-O 2.94Å; D35-Q40 PolarHBondContact O-N 3.49Å; L38-Q40 VanDerWaalsContact C-N 3.27Å; L38-Q40 HydrophobicContact CB-CB 4.22Å; L38-Q40 HydrophobicContact CB-CG 3.72Å; Q40-T56 HydrophobicContact CB-CG2 4.15Å; Q40-T56 HydrophobicContact CG-CG2 4.42Å; Q40-F57 CarbonylContact C-O 3.51Å; Q40-F57 VanDerWaalsContact CA-O 3.3Å; Q40-F57 WeakPolarHBondContact CA-O 3.44Å; Q40-T58 HydrophobicContact CG-CG2 4.1Å; Q40-E514 PolarHBondContact NE2-OE2 3.41Å
41	V	95.1	Very high	87	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	122	170.7	-175.4	0	0	0	0	108.5	V14 V32 D33 V34 V43 T56 F57 F59 V62 L331	V14-V41 HydrophobicContact CB-CG2 3.98Å; V14-V41 HydrophobicContact CG1-CG2 3.96Å; V14-V41 HydrophobicContact CG2-CG2 4.22Å; V32-V41 HydrophobicContact CG1-CG1 3.63Å; D33-V41 WeakPolarHBondContact O-CA 3.47Å; V34-V41 HydrophobicContact CG2-CG1 4.48Å; V41-V43 HydrophobicContact CG1-CG2 4.48Å; V41-T56 CarbonylContact O-C 3.39Å; V41-T56 WeakPolarHBondContact O-CA 3.33Å; V41-F57 PolarHBondContact N-O 2.61Å; V41-F57 PolarHBondContact O-N 3.12Å; V41-F59 HydrophobicContact CB-CE2 4.49Å; V41-F59 HydrophobicContact CG2-CD2 4.27Å; V41-F59 HydrophobicContact CG2-CE2 4.29Å; V41-V62 HydrophobicContact CG2-CB 4.07Å; V41-V62 HydrophobicContact CG2-CG1 3.66Å; V41-L331 HydrophobicContact CB-CD2 4.47Å; V41-L331 HydrophobicContact CG1-CD1 4.03Å; V41-L331 HydrophobicContact CG1-CD2 4.32Å
42	S	93.6	Very high	86	Confident	26 Å²	26	57.6 Å²	57.6	18%	0.182	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	128.5	175.9	-159.7	0	0	0	0	110.4	D33 P54 K55 T56	D33-S42 PolarHBondContact N-O 3.28Å; D33-S42 PolarHBondContact O-N 3.31Å; S42-P54 WeakPolarHBondContact OG-CB 3.46Å; S42-K55 CarbonylContact C-O 3.6Å; S42-K55 WeakPolarHBondContact CA-O 3.34Å; S42-T56 WeakPolarHBondContact CB-OG1 3.46Å; S42-T56 PolarHBondContact OG-OG1 2.95Å
43	V	93.6	Very high	85.2	Confident	4 Å²	4	61.6 Å²	61.6	2%	0.024	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	117.5	178.7	-175.9	0	0	0	0	109.6	V31 V32 V41 P54 K55 V324 T327 L328 L331	V31-V43 WeakPolarHBondContact O-CA 3.17Å; V32-V43 HydrophobicContact CG2-CG2 4.49Å; V41-V43 HydrophobicContact CG1-CG2 4.48Å; V43-P54 CarbonylContact O-C 3.6Å; V43-P54 VanDerWaalsContact O-CA 3.31Å; V43-P54 WeakPolarHBondContact O-CA 3.42Å; V43-K55 PolarHBondContact N-O 2.82Å; V43-K55 PolarHBondContact O-N 2.92Å; V43-V324 HydrophobicContact CG1-CG2 3.62Å; V43-T327 HydrophobicContact CG2-CG2 4.21Å; V43-L328 HydrophobicContact CB-CD2 3.89Å; V43-L328 HydrophobicContact CG1-CD2 3.86Å; V43-L328 HydrophobicContact CG1-CG 4.16Å; V43-L328 HydrophobicContact CG2-CD2 4.21Å; V43-L331 HydrophobicContact CG2-CD1 3.38Å
44	K	90.3	Very high	84.8	Confident	94 Å²	94	61.5 Å²	61.5	41%	0.409	34%	0.339	S	S	.	.			trans	-83.2	137.7	176	-69.6	164.4	173.9	165.1	0	110.3	V31 D33 P54	V31-K44 HydrophobicContact CB-CB 4.46Å; V31-K44 WeakPolarHBondContact CB-O 3.3Å; V31-K44 PolarHBondContact O-N 3.46Å; D33-K44 WeakPolarHBondContact OD2-CE 3.46Å; D33-K44 IonicContact OD2-NZ 3.24Å; D33-K44 PolarHBondContact OD2-NZ 3.12Å; K44-P54 HydrophobicContact CG-CB 4.26Å; K44-P54 HydrophobicContact CG-CG 4.16Å
45	N	84.2	Confident	84.4	Confident	34 Å²	34	61.8 Å²	61.8	18%	0.182	34%	0.338	C	S	.	.			trans	-70	131.2	167.8	-168.1	-49.6	0	0	0	109.1	K47 G48 E52	N45-K47 PolarHBondContact O-N 2.94Å; N45-K47 VanDerWaalsContact O-N 3.11Å; N45-K47 WeakPolarHBondContact OD1-CB 3.2Å; N45-K47 PolarHBondContact OD1-N 3.47Å; N45-G48 PolarHBondContact O-N 3.37Å; N45-E52 HydrophobicContact CB-CB 3.96Å; N45-E52 PolarHBondContact ND2-OE2 3.06Å
46	P	80.6	Confident	84.3	Confident	65 Å²	65	61.9 Å²	61.9	42%	0.422	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-25	177.1	-24.5	32.5	0	0	0	114	V31 G48 V324	V31-P46 HydrophobicContact CG1-CG 4.26Å; P46-G48 PolarHBondContact O-N 2.7Å; P46-V324 HydrophobicContact CG-CB 4.41Å; P46-V324 HydrophobicContact CG-CG1 3.95Å
47	K	80	Confident	84.3	Confident	146 Å²	146	60 Å²	60	64%	0.635	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	0.3	175.8	-56.5	179.1	-174.8	172.9	0	113.6	N45 H51	N45-K47 PolarHBondContact O-N 2.94Å; N45-K47 VanDerWaalsContact O-N 3.11Å; N45-K47 WeakPolarHBondContact OD1-CB 3.2Å; N45-K47 PolarHBondContact OD1-N 3.47Å; K47-H51 HydrophobicContact CB-CB 3.88Å; K47-H51 WeakPolarHBondContact CD-CD2 3.33Å; K47-H51 WeakPolarHBondContact CD-NE2 3.44Å; K47-H51 PolarHBondContact NZ-NE2 2.67Å
48	G	74.8	Confident	84.6	Confident	33 Å²	33	54.5 Å²	54.5	34%	0.34	31%	0.309	S	S	.	.			trans	80	172.6	177.2	0	0	0	0	0	114.9	N45 P46 A50 H51 E52	N45-G48 PolarHBondContact O-N 3.37Å; P46-G48 PolarHBondContact O-N 2.7Å; G48-A50 PolarHBondContact O-N 3.47Å; G48-A50 VanDerWaalsContact O-N 3.13Å; G48-H51 PolarHBondContact O-N 3.03Å; G48-H51 VanDerWaalsContact O-N 3.1Å; G48-E52 PolarHBondContact O-N 3.25Å
49	T	73.6	Confident	84.9	Confident	111 Å²	111	53.3 Å²	53.3	68%	0.681	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-16.4	-174.8	53.2	0	0	0	0	114.7	H51 E52 P54	T49-H51 VanDerWaalsContact C-N 3.31Å; T49-E52 WeakPolarHBondContact CA-O 3.34Å; T49-P54 HydrophobicContact CG2-CG 4.46Å
50	A	67	Low	85	Confident	106 Å²	106	56.2 Å²	56.2	88%	0.876	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-26.8	174.9	0	0	0	0	0	113	G48	G48-A50 PolarHBondContact O-N 3.47Å; G48-A50 VanDerWaalsContact O-N 3.13Å
51	H	70.8	Confident	85	Confident	118 Å²	118	54.2 Å²	54.2	55%	0.546	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-39	175.9	-167.2	-52.2	0	0	0	111.4	K47 G48 T49	K47-H51 HydrophobicContact CB-CB 3.88Å; K47-H51 WeakPolarHBondContact CD-CD2 3.33Å; K47-H51 WeakPolarHBondContact CD-NE2 3.44Å; K47-H51 PolarHBondContact NZ-NE2 2.67Å; G48-H51 PolarHBondContact O-N 3.03Å; G48-H51 VanDerWaalsContact O-N 3.1Å; T49-H51 VanDerWaalsContact C-N 3.31Å
52	E	73.3	Confident	85	Confident	29 Å²	29	54.2 Å²	54.2	14%	0.136	31%	0.31	C	S	.	.			trans	-158.3	138.6	-175.9	-162.6	-179.7	-157.3	0	0	112.3	N45 G48 T49 K55	N45-E52 HydrophobicContact CB-CB 3.96Å; N45-E52 PolarHBondContact ND2-OE2 3.06Å; G48-E52 PolarHBondContact O-N 3.25Å; T49-E52 WeakPolarHBondContact CA-O 3.34Å; E52-K55 WeakPolarHBondContact OE1-CE 3.43Å; E52-K55 IonicContact OE1-NZ 3.87Å; E52-K55 PolarHBondContact OE1-NZ 3.12Å; E52-K55 IonicContact OE2-NZ 2.83Å; E52-K55 PolarHBondContact OE2-NZ 2.97Å
53	M	78.6	Confident	85.2	Confident	85 Å²	85	53.4 Å²	53.4	42%	0.419	30%	0.302	S	S	.	.			trans	-68.4	151.1	171.9	-64.1	-150.5	-52.3	0	0	111.4	K55 A550	M53-K55 PolarHBondContact O-N 3.34Å; M53-A550 HydrophobicContact CE-CB 4.16Å
54	P	84.8	Confident	85.2	Confident	50 Å²	50	54.7 Å²	54.7	33%	0.325	31%	0.309	S	S	.	.			trans	-59	135.8	174.8	-21.5	33.9	0	0	0	111.6	S42 V43 K44 T49	S42-P54 WeakPolarHBondContact OG-CB 3.46Å; V43-P54 CarbonylContact O-C 3.6Å; V43-P54 VanDerWaalsContact O-CA 3.31Å; V43-P54 WeakPolarHBondContact O-CA 3.42Å; K44-P54 HydrophobicContact CG-CB 4.26Å; K44-P54 HydrophobicContact CG-CG 4.16Å; T49-P54 HydrophobicContact CG2-CG 4.46Å
55	K	87.6	Confident	85.4	Confident	33 Å²	33	55.7 Å²	55.7	14%	0.143	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	115.5	176.9	-71.9	163.1	175.7	141	0	109	S42 V43 E52 M53 F57 L328 D557	S42-K55 CarbonylContact C-O 3.6Å; S42-K55 WeakPolarHBondContact CA-O 3.34Å; V43-K55 PolarHBondContact N-O 2.82Å; V43-K55 PolarHBondContact O-N 2.92Å; E52-K55 WeakPolarHBondContact OE1-CE 3.43Å; E52-K55 IonicContact OE1-NZ 3.87Å; E52-K55 PolarHBondContact OE1-NZ 3.12Å; E52-K55 IonicContact OE2-NZ 2.83Å; E52-K55 PolarHBondContact OE2-NZ 2.97Å; M53-K55 PolarHBondContact O-N 3.34Å; K55-F57 HydrophobicContact CB-CE2 3.84Å; K55-F57 HydrophobicContact CB-CZ 4.25Å; K55-L328 HydrophobicContact CB-CD2 4.23Å; K55-L328 HydrophobicContact CD-CD1 4.13Å; K55-L328 HydrophobicContact CD-CD2 3.64Å; K55-D557 WeakPolarHBondContact CE-OD2 3.48Å; K55-D557 IonicContact NZ-OD2 2.71Å; K55-D557 PolarHBondContact NZ-OD2 3.49Å
56	T	90.6	Very high	85.8	Confident	72 Å²	72	59 Å²	59	44%	0.442	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	132.4	-178.9	-59.2	0	0	0	0	110.8	Q40 V41 S42	Q40-T56 HydrophobicContact CB-CG2 4.15Å; Q40-T56 HydrophobicContact CG-CG2 4.42Å; V41-T56 CarbonylContact O-C 3.39Å; V41-T56 WeakPolarHBondContact O-CA 3.33Å; S42-T56 WeakPolarHBondContact CB-OG1 3.46Å; S42-T56 PolarHBondContact OG-OG1 2.95Å
57	F	93	Very high	86.4	Confident	15 Å²	15	56.7 Å²	56.7	7%	0.066	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	138.7	-177.9	-58.8	-91.4	0	0	0	110.2	Q40 V41 K55 F59 L328 L331 R332 N335	Q40-F57 CarbonylContact C-O 3.51Å; Q40-F57 VanDerWaalsContact CA-O 3.3Å; Q40-F57 WeakPolarHBondContact CA-O 3.44Å; V41-F57 PolarHBondContact N-O 2.61Å; V41-F57 PolarHBondContact O-N 3.12Å; K55-F57 HydrophobicContact CB-CE2 3.84Å; K55-F57 HydrophobicContact CB-CZ 4.25Å; F57-F59 HydrophobicContact CB-CD2 4.32Å; F57-F59 HydrophobicContact CB-CE2 3.4Å; F57-F59 HydrophobicContact CB-CZ 3.74Å; F57-F59 HydrophobicContact CG-CE2 4.44Å; F57-F59 HydrophobicContact CG-CZ 4.45Å; F57-L328 HydrophobicContact CE2-CD2 4.11Å; F57-L328 HydrophobicContact CZ-CD2 4.38Å; F57-L331 HydrophobicContact CD2-CB 4Å; F57-L331 HydrophobicContact CD2-CD1 3.94Å; F57-L331 HydrophobicContact CE1-CB 4.46Å; F57-L331 HydrophobicContact CE2-CB 3.95Å; F57-L331 HydrophobicContact CE2-CD1 4.04Å; F57-L331 HydrophobicContact CG-CB 4.28Å; F57-L331 HydrophobicContact CZ-CB 4.19Å; F57-R332 HydrophobicContact CE1-CG 4.43Å; F57-R332 HydrophobicContact CZ-CG 4.44Å; F57-N335 HydrophobicContact CD1-CB 4.09Å
58	T	92.7	Very high	87	Confident	50 Å²	50	54.5 Å²	54.5	31%	0.307	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	133.8	-179.8	-44.3	0	0	0	0	111.5	G39 Q40 K338 Q511	G39-T58 WeakPolarHBondContact O-CA 3.45Å; Q40-T58 HydrophobicContact CG-CG2 4.1Å; T58-K338 PolarHBondContact O-NZ 2.83Å; T58-Q511 HydrophobicContact CG2-CG 4.27Å
59	F	95	Very high	87.9	Confident	5 Å²	5	53.2 Å²	53.2	2%	0.022	29%	0.29	C	S	.	.			trans	-133.2	170.6	-174.7	-60.6	-80.3	0	0	0	111.7	V12 V14 G39 V41 F57 A61 V62 L331 A334 N335 Q511	V12-F59 HydrophobicContact CB-CD1 4.22Å; V12-F59 HydrophobicContact CG1-CD1 3.7Å; V12-F59 HydrophobicContact CG1-CE1 4.04Å; V14-F59 HydrophobicContact CB-CD2 4.44Å; V14-F59 HydrophobicContact CG2-CD1 4.07Å; V14-F59 HydrophobicContact CG2-CD2 3.41Å; V14-F59 VanDerWaalsContact CG2-CD2 3.41Å; V14-F59 HydrophobicContact CG2-CE1 4.04Å; V14-F59 HydrophobicContact CG2-CE2 3.37Å; V14-F59 HydrophobicContact CG2-CG 3.77Å; V14-F59 HydrophobicContact CG2-CZ 3.7Å; G39-F59 PolarHBondContact O-N 2.96Å; V41-F59 HydrophobicContact CB-CE2 4.49Å; V41-F59 HydrophobicContact CG2-CD2 4.27Å; V41-F59 HydrophobicContact CG2-CE2 4.29Å; F57-F59 HydrophobicContact CB-CD2 4.32Å; F57-F59 HydrophobicContact CB-CE2 3.4Å; F57-F59 HydrophobicContact CB-CZ 3.74Å; F57-F59 HydrophobicContact CG-CE2 4.44Å; F57-F59 HydrophobicContact CG-CZ 4.45Å; F59-A61 VanDerWaalsContact C-N 3.3Å; F59-A61 PolarHBondContact O-N 3.01Å; F59-V62 HydrophobicContact CB-CG1 4.05Å; F59-V62 HydrophobicContact CD2-CG1 4.04Å; F59-L331 HydrophobicContact CE2-CD2 3.86Å; F59-L331 HydrophobicContact CZ-CD2 3.88Å; F59-A334 HydrophobicContact CE1-CB 3.68Å; F59-A334 HydrophobicContact CZ-CB 4.17Å; F59-N335 HydrophobicContact CE1-CB 4.35Å; F59-N335 HydrophobicContact CZ-CB 4.49Å; F59-Q511 PolarHBondContact O-NE2 3.48Å
60	D	93	Very high	88.6	Confident	60 Å²	60	50.7 Å²	50.7	32%	0.321	27%	0.27	S	S	.	.	S	Bend	trans	-62.2	-37.9	179.1	-59.1	-97.8	0	0	0	112.3	V12 R507	V12-D60 PolarHBondContact N-OD2 3.35Å; V12-D60 PolarHBondContact O-N 3.35Å; D60-R507 WeakPolarHBondContact O-CD 3.39Å; D60-R507 PolarHBondContact O-NH1 2.93Å
61	A	93.6	Very high	89.6	Confident	3 Å²	3	49.3 Å²	49.3	3%	0.025	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	154	169.6	0	0	0	0	0	110.5	V13 V14 F59 Y63	V13-A61 VanDerWaalsContact CA-O 3.24Å; V13-A61 WeakPolarHBondContact CA-O 3.39Å; V13-A61 HydrophobicContact CB-CB 4.43Å; V13-A61 WeakPolarHBondContact CB-O 3.32Å; V13-A61 HydrophobicContact CG1-CB 3.79Å; V14-A61 PolarHBondContact N-O 3.4Å; F59-A61 VanDerWaalsContact C-N 3.3Å; F59-A61 PolarHBondContact O-N 3.01Å; A61-Y63 HydrophobicContact CB-CE2 3.74Å
62	V	95.5	Very high	90.6	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	142.6	175.2	-55.7	0	0	0	0	109.9	V14 V34 D35 G39 V41 F59	V14-V62 HydrophobicContact CB-CG1 4.33Å; V14-V62 CarbonylContact O-C 3.51Å; V14-V62 WeakPolarHBondContact O-CA 3.29Å; V34-V62 HydrophobicContact CG1-CB 3.83Å; V34-V62 HydrophobicContact CG1-CG2 3.46Å; V34-V62 VanDerWaalsContact CG1-CG2 3.46Å; D35-V62 WeakPolarHBondContact O-CG2 3Å; G39-V62 VanDerWaalsContact C-CG1 3.4Å; G39-V62 VanDerWaalsContact O-CG1 3.27Å; G39-V62 WeakPolarHBondContact O-CG1 3.47Å; V41-V62 HydrophobicContact CG2-CB 4.07Å; V41-V62 HydrophobicContact CG2-CG1 3.66Å; F59-V62 HydrophobicContact CB-CG1 4.05Å; F59-V62 HydrophobicContact CD2-CG1 4.04Å
63	Y	96.1	Very high	91.6	Very high	8 Å²	8	42.5 Å²	42.5	3%	0.031	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	120	-171.2	-65.8	-78.9	0	0	0	109.2	V13 V14 C16 A61 A67 L72 E75 T76	V13-Y63 HydrophobicContact CB-CD2 4.36Å; V13-Y63 HydrophobicContact CB-CE2 4.03Å; V13-Y63 HydrophobicContact CG1-CE2 4.34Å; V13-Y63 HydrophobicContact CG2-CE2 4.36Å; V14-Y63 PolarHBondContact O-N 2.59Å; C16-Y63 PolarHBondContact N-O 3.19Å; A61-Y63 HydrophobicContact CB-CE2 3.74Å; Y63-A67 HydrophobicContact CD1-CB 3.82Å; Y63-A67 HydrophobicContact CG-CB 4.21Å; Y63-L72 HydrophobicContact CD1-CD1 4.16Å; Y63-L72 HydrophobicContact CD2-CD1 3.43Å; Y63-L72 VanDerWaalsContact CD2-CD1 3.43Å; Y63-L72 HydrophobicContact CE1-CB 4.36Å; Y63-L72 HydrophobicContact CE1-CD1 3.98Å; Y63-L72 HydrophobicContact CE2-CD1 3.19Å; Y63-L72 HydrophobicContact CG-CD1 3.9Å; Y63-L72 VanDerWaalsContact CZ-CD1 3.49Å; Y63-E75 VanDerWaalsContact CE1-OE2 3.29Å; Y63-E75 WeakPolarHBondContact CE1-OE2 3.4Å; Y63-E75 WeakPolarHBondContact OH-CG 3.5Å; Y63-E75 PolarHBondContact OH-OE2 3Å; Y63-T76 PolarHBondContact OH-OG1 2.84Å
64	D	94.9	Very high	92.1	Very high	32 Å²	32	39.3 Å²	39.3	17%	0.171	20%	0.198	C	C	.	.			trans	-79.2	-173.1	179.3	81.6	-17	0	0	0	111.7	C16 V34 V36 N66 A67	C16-D64 CarbonylContact O-C 3.37Å; C16-D64 VanDerWaalsContact O-C 3.26Å; V34-D64 HydrophobicContact CB-CB 4.17Å; V34-D64 HydrophobicContact CG1-CB 4.19Å; V36-D64 HydrophobicContact CG2-CB 4.16Å; D64-N66 PolarHBondContact O-N 3.46Å; D64-N66 WeakPolarHBondContact OD1-CA 3.25Å; D64-N66 WeakPolarHBondContact OD1-CB 3.47Å; D64-N66 PolarHBondContact OD1-N 3.26Å; D64-N66 PolarHBondContact OD2-ND2 2.73Å; D64-A67 WeakPolarHBondContact O-CB 3.37Å; D64-A67 PolarHBondContact O-N 3.46Å; D64-A67 PolarHBondContact OD1-N 3.23Å; D64-A67 VanDerWaalsContact OD1-N 3.14Å
65	W	93.2	Very high	92.3	Very high	114 Å²	114	38.1 Å²	38.1	43%	0.432	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-10.1	179.8	64	81.6	0	0	0	114.2	C16 P18	C16-W65 WeakPolarHBondContact O-CA 3.34Å; C16-W65 PolarHBondContact O-N 3.01Å; P18-W65 HydrophobicContact CB-CB 4.35Å; P18-W65 HydrophobicContact CG-CB 4.05Å; P18-W65 WeakPolarHBondContact CG-O 3.48Å
66	N	94.2	Very high	92.5	Very high	105 Å²	105	36.8 Å²	36.8	56%	0.561	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-15.5	177.8	-56.6	-59.7	0	0	0	112.5	D64 K68	D64-N66 PolarHBondContact O-N 3.46Å; D64-N66 WeakPolarHBondContact OD1-CA 3.25Å; D64-N66 WeakPolarHBondContact OD1-CB 3.47Å; D64-N66 PolarHBondContact OD1-N 3.26Å; D64-N66 PolarHBondContact OD2-ND2 2.73Å; N66-K68 PolarHBondContact O-N 3.35Å
67	A	92.9	Very high	92.7	Very high	15 Å²	15	33.5 Å²	33.5	12%	0.124	16%	0.163	C	C	.	.			trans	-59	120	-173.6	0	0	0	0	0	114.2	R15 Y63 D64	R15-A67 PolarHBondContact NH2-O 3.08Å; Y63-A67 HydrophobicContact CD1-CB 3.82Å; Y63-A67 HydrophobicContact CG-CB 4.21Å; D64-A67 WeakPolarHBondContact O-CB 3.37Å; D64-A67 PolarHBondContact O-N 3.46Å; D64-A67 PolarHBondContact OD1-N 3.23Å; D64-A67 VanDerWaalsContact OD1-N 3.14Å
68	K	92.9	Very high	92.7	Very high	101 Å²	101	33.7 Å²	33.7	44%	0.439	16%	0.163	S	C	.	.			trans	-82.4	158.7	-177.8	-55.6	-175.1	-178.2	-173.1	0	111.8	N66 F70 E71 L72	N66-K68 PolarHBondContact O-N 3.35Å; K68-F70 HydrophobicContact CB-CD1 4.07Å; K68-F70 HydrophobicContact CB-CE1 3.8Å; K68-F70 HydrophobicContact CB-CZ 4.27Å; K68-F70 HydrophobicContact CD-CE1 3.49Å; K68-F70 VanDerWaalsContact CD-CE1 3.49Å; K68-F70 HydrophobicContact CD-CZ 3.68Å; K68-F70 HydrophobicContact CG-CE1 4.3Å; K68-F70 PolarHBondContact O-N 2.96Å; K68-E71 HydrophobicContact CB-CG 4.07Å; K68-E71 WeakPolarHBondContact CB-OE2 3.3Å; K68-E71 PolarHBondContact N-OE2 3.46Å; K68-E71 PolarHBondContact O-N 3.27Å; K68-L72 PolarHBondContact O-N 2.85Å
69	Q	92.7	Very high	92.7	Very high	6 Å²	6	33.6 Å²	33.6	3%	0.028	16%	0.163	C	C	.	.	H	α-helix	trans	-64.5	-42.2	-176.8	-58.6	-80.3	59	0	0	112.8	R15 Y73 Y104 K115 R116	R15-Q69 VanDerWaalsContact CZ-OE1 3.23Å; Q69-Y73 WeakPolarHBondContact O-CB 3.33Å; Q69-Y73 PolarHBondContact O-N 2.91Å; Q69-Y104 PolarHBondContact NE2-O 2.91Å; Q69-K115 PolarHBondContact NE2-O 2.86Å; Q69-R116 WeakPolarHBondContact CB-O 3.45Å; Q69-R116 WeakPolarHBondContact CG-O 3.28Å
70	F	88.1	Confident	92.7	Very high	58 Å²	58	33.4 Å²	33.4	25%	0.254	16%	0.162	S	C	.	.	H	α-helix	trans	-70.6	-33.1	-178.6	67.8	-97.4	0	0	0	112.2	K68 Y73 D74	K68-F70 HydrophobicContact CB-CD1 4.07Å; K68-F70 HydrophobicContact CB-CE1 3.8Å; K68-F70 HydrophobicContact CB-CZ 4.27Å; K68-F70 HydrophobicContact CD-CE1 3.49Å; K68-F70 VanDerWaalsContact CD-CE1 3.49Å; K68-F70 HydrophobicContact CD-CZ 3.68Å; K68-F70 HydrophobicContact CG-CE1 4.3Å; K68-F70 PolarHBondContact O-N 2.96Å; F70-Y73 PolarHBondContact O-N 3.13Å; F70-D74 WeakPolarHBondContact O-CB 3.41Å; F70-D74 PolarHBondContact O-N 3.49Å
71	E	88.6	Confident	92.8	Very high	76 Å²	76	30.5 Å²	30.5	36%	0.355	15%	0.147	S	C	.	.	H	α-helix	trans	-64.7	-47.6	176.2	-62.3	172	154.2	0	0	110.5	K68 Y73 D74 E75	K68-E71 HydrophobicContact CB-CG 4.07Å; K68-E71 WeakPolarHBondContact CB-OE2 3.3Å; K68-E71 PolarHBondContact N-OE2 3.46Å; K68-E71 PolarHBondContact O-N 3.27Å; E71-Y73 VanDerWaalsContact C-N 3.27Å; E71-Y73 PolarHBondContact O-N 2.85Å; E71-D74 PolarHBondContact O-N 3.45Å; E71-E75 WeakPolarHBondContact O-CB 3.25Å; E71-E75 PolarHBondContact O-N 2.95Å
72	L	91.6	Very high	92.8	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-58.8	-38.8	173.4	177.4	63.4	0	0	0	111.9	Y63 K68 T76 F77 T105	Y63-L72 HydrophobicContact CD1-CD1 4.16Å; Y63-L72 HydrophobicContact CD2-CD1 3.43Å; Y63-L72 VanDerWaalsContact CD2-CD1 3.43Å; Y63-L72 HydrophobicContact CE1-CB 4.36Å; Y63-L72 HydrophobicContact CE1-CD1 3.98Å; Y63-L72 HydrophobicContact CE2-CD1 3.19Å; Y63-L72 HydrophobicContact CG-CD1 3.9Å; Y63-L72 VanDerWaalsContact CZ-CD1 3.49Å; K68-L72 PolarHBondContact O-N 2.85Å; L72-T76 WeakPolarHBondContact O-CB 3.41Å; L72-T76 PolarHBondContact O-N 2.93Å; L72-T76 VanDerWaalsContact O-N 3.14Å; L72-F77 HydrophobicContact CD1-CE2 4.23Å; L72-F77 HydrophobicContact CD1-CZ 4.04Å; L72-F77 HydrophobicContact CD2-CE2 3.94Å; L72-F77 HydrophobicContact CD2-CZ 4.16Å; L72-F77 HydrophobicContact CG-CD2 4.4Å; L72-F77 HydrophobicContact CG-CE2 3.57Å; L72-F77 HydrophobicContact CG-CZ 3.86Å; L72-T105 HydrophobicContact CD2-CG2 3.64Å
73	Y	93.3	Very high	92.8	Very high	4 Å²	4	33.5 Å²	33.5	2%	0.016	16%	0.163	C	C	.	.	I	π-helix	trans	-68.4	-53.4	176.8	-173.1	-90.2	0	0	0	112.9	Q69 F70 E71 E75 F77 R78 V118 N121 S122 H125	Q69-Y73 WeakPolarHBondContact O-CB 3.33Å; Q69-Y73 PolarHBondContact O-N 2.91Å; F70-Y73 PolarHBondContact O-N 3.13Å; E71-Y73 VanDerWaalsContact C-N 3.27Å; E71-Y73 PolarHBondContact O-N 2.85Å; Y73-E75 VanDerWaalsContact C-N 3.33Å; Y73-E75 PolarHBondContact O-N 3.48Å; Y73-F77 HydrophobicContact CD2-CB 3.86Å; Y73-F77 HydrophobicContact CD2-CD2 4.01Å; Y73-F77 HydrophobicContact CD2-CG 4.46Å; Y73-F77 HydrophobicContact CE2-CB 4.07Å; Y73-F77 HydrophobicContact CG-CB 4.45Å; Y73-F77 PolarHBondContact O-N 3.27Å; Y73-R78 HydrophobicContact CD1-CB 4.32Å; Y73-R78 HydrophobicContact CE1-CB 4.02Å; Y73-R78 WeakPolarHBondContact O-CB 3.39Å; Y73-R78 PolarHBondContact O-N 3.45Å; Y73-V118 HydrophobicContact CD2-CB 4.43Å; Y73-V118 HydrophobicContact CD2-CG2 3.94Å; Y73-V118 HydrophobicContact CE2-CG2 4Å; Y73-N121 HydrophobicContact CD1-CB 4.06Å; Y73-N121 HydrophobicContact CD2-CB 3.31Å; Y73-N121 HydrophobicContact CE1-CB 4.19Å; Y73-N121 HydrophobicContact CE2-CB 3.47Å; Y73-N121 VanDerWaalsContact CE2-CB 3.47Å; Y73-N121 HydrophobicContact CG-CB 3.65Å; Y73-S122 WeakPolarHBondContact OH-CA 3.21Å; Y73-H125 HydrophobicContact CE1-CB 4.28Å; Y73-H125 VanDerWaalsContact OH-CB 3.23Å; Y73-H125 WeakPolarHBondContact OH-CB 3.47Å; Y73-H125 PolarHBondContact OH-ND1 2.93Å; Y73-H125 VanDerWaalsContact OH-ND1 3.09Å
74	D	89.9	Confident	92.7	Very high	18 Å²	18	33.1 Å²	33.1	10%	0.096	16%	0.162	C	C	.	.	I	π-helix	trans	-64.4	-35.3	-176.2	-76.3	-28	0	0	0	112.1	F70 E71 R78 R496	F70-D74 WeakPolarHBondContact O-CB 3.41Å; F70-D74 PolarHBondContact O-N 3.49Å; E71-D74 PolarHBondContact O-N 3.45Å; D74-R78 IonicContact OD1-CZ 2.64Å; D74-R78 VanDerWaalsContact OD1-CZ 3.24Å; D74-R78 IonicContact OD1-NE 3.93Å; D74-R78 PolarHBondContact OD1-NE 3.01Å; D74-R78 IonicContact OD1-NH2 3.2Å; D74-R78 PolarHBondContact OD1-NH2 3.5Å; D74-R496 IonicContact OD2-NH1 2.72Å
75	E	89.5	Confident	92.6	Very high	25 Å²	25	31.7 Å²	31.7	12%	0.117	15%	0.154	C	C	.	.	I	π-helix	trans	-81.8	-46.7	-179.9	-174.9	-177.3	-175.6	0	0	113.7	Y63 E71 Y73 A500 R507	Y63-E75 VanDerWaalsContact CE1-OE2 3.29Å; Y63-E75 WeakPolarHBondContact CE1-OE2 3.4Å; Y63-E75 WeakPolarHBondContact OH-CG 3.5Å; Y63-E75 PolarHBondContact OH-OE2 3Å; E71-E75 WeakPolarHBondContact O-CB 3.25Å; E71-E75 PolarHBondContact O-N 2.95Å; Y73-E75 VanDerWaalsContact C-N 3.33Å; Y73-E75 PolarHBondContact O-N 3.48Å; E75-A500 HydrophobicContact CB-CB 4.44Å; E75-R507 IonicContact OE1-CZ 2.71Å; E75-R507 IonicContact OE1-NH1 3.15Å; E75-R507 PolarHBondContact OE1-NH1 3.4Å; E75-R507 IonicContact OE1-NH2 2.92Å; E75-R507 PolarHBondContact OE1-NH2 3.07Å
76	T	91.4	Very high	92.5	Very high	5 Å²	5	30.4 Å²	30.4	3%	0.031	15%	0.153	C	C	.	.	I	π-helix	trans	-101.4	-49.2	-170.5	-64.7	0	0	0	0	113.1	R11 V13 Y63 L72 V312	R11-T76 PolarHBondContact NH1-O 3.26Å; V13-T76 HydrophobicContact CG1-CG2 3.68Å; V13-T76 HydrophobicContact CG2-CG2 4.11Å; Y63-T76 PolarHBondContact OH-OG1 2.84Å; L72-T76 WeakPolarHBondContact O-CB 3.41Å; L72-T76 PolarHBondContact O-N 2.93Å; L72-T76 VanDerWaalsContact O-N 3.14Å; T76-V312 HydrophobicContact CG2-CG1 3.68Å; T76-V312 HydrophobicContact CG2-CG2 4.41Å
77	F	94.9	Very high	92.4	Very high	3 Å²	3	25.5 Å²	25.5	1%	0.013	13%	0.127	C	C	.	.	I	π-helix	trans	-88.9	-36.6	-165.4	-54.5	-39.2	0	0	0	113.4	L72 Y73 L80 V81 I92 T105 V118 V312 V314	L72-F77 HydrophobicContact CD1-CE2 4.23Å; L72-F77 HydrophobicContact CD1-CZ 4.04Å; L72-F77 HydrophobicContact CD2-CE2 3.94Å; L72-F77 HydrophobicContact CD2-CZ 4.16Å; L72-F77 HydrophobicContact CG-CD2 4.4Å; L72-F77 HydrophobicContact CG-CE2 3.57Å; L72-F77 HydrophobicContact CG-CZ 3.86Å; Y73-F77 HydrophobicContact CD2-CB 3.86Å; Y73-F77 HydrophobicContact CD2-CD2 4.01Å; Y73-F77 HydrophobicContact CD2-CG 4.46Å; Y73-F77 HydrophobicContact CE2-CB 4.07Å; Y73-F77 HydrophobicContact CG-CB 4.45Å; Y73-F77 PolarHBondContact O-N 3.27Å; F77-L80 WeakPolarHBondContact O-CA 3.35Å; F77-L80 VanDerWaalsContact O-CB 3.26Å; F77-L80 WeakPolarHBondContact O-CB 3.31Å; F77-L80 PolarHBondContact O-N 2.83Å; F77-V81 PolarHBondContact O-N 3.16Å; F77-V81 VanDerWaalsContact O-N 3.1Å; F77-I92 HydrophobicContact CB-CD1 3.96Å; F77-I92 HydrophobicContact CD1-CD1 3.83Å; F77-I92 HydrophobicContact CD1-CG1 4.48Å; F77-I92 HydrophobicContact CD1-CG2 4.14Å; F77-I92 HydrophobicContact CE1-CG2 3.92Å; F77-I92 HydrophobicContact CG-CD1 4Å; F77-T105 HydrophobicContact CE2-CG2 4.45Å; F77-T105 HydrophobicContact CZ-CG2 4.38Å; F77-V118 HydrophobicContact CB-CG2 3.84Å; F77-V118 HydrophobicContact CD1-CG2 4.39Å; F77-V118 HydrophobicContact CD2-CB 3.6Å; F77-V118 HydrophobicContact CD2-CG2 3.32Å; F77-V118 HydrophobicContact CE2-CB 3.74Å; F77-V118 HydrophobicContact CE2-CG1 4.41Å; F77-V118 HydrophobicContact CE2-CG2 3.93Å; F77-V118 HydrophobicContact CG-CB 4.35Å; F77-V118 HydrophobicContact CG-CG2 3.61Å; F77-V312 HydrophobicContact CD1-CG1 4.07Å; F77-V312 HydrophobicContact CE1-CG1 3.81Å; F77-V314 HydrophobicContact CE1-CG2 3.53Å; F77-V314 HydrophobicContact CZ-CG2 3.54Å
78	R	93.3	Very high	92.4	Very high	19 Å²	19	26.8 Å²	26.8	7%	0.072	13%	0.13	C	C	.	.	H	α-helix	trans	-50.5	-52.3	-179.9	167.5	-180	-63.5	-88	14.2	112.9	Y73 D74 L80 V81 D82 H125 E493	Y73-R78 HydrophobicContact CD1-CB 4.32Å; Y73-R78 HydrophobicContact CE1-CB 4.02Å; Y73-R78 WeakPolarHBondContact O-CB 3.39Å; Y73-R78 PolarHBondContact O-N 3.45Å; D74-R78 IonicContact OD1-CZ 2.64Å; D74-R78 VanDerWaalsContact OD1-CZ 3.24Å; D74-R78 IonicContact OD1-NE 3.93Å; D74-R78 PolarHBondContact OD1-NE 3.01Å; D74-R78 IonicContact OD1-NH2 3.2Å; D74-R78 PolarHBondContact OD1-NH2 3.5Å; R78-L80 PolarHBondContact O-N 3.16Å; R78-V81 PolarHBondContact O-N 2.9Å; R78-D82 VanDerWaalsContact C-OD2 3.25Å; R78-D82 WeakPolarHBondContact CG-OD2 3.18Å; R78-D82 PolarHBondContact O-N 3.24Å; R78-H125 PolarHBondContact NH1-CD2 2.85Å; R78-H125 VanDerWaalsContact NH1-CD2 3.33Å; R78-H125 PolarHBondContact NH1-NE2 3.35Å; R78-E493 IonicContact CZ-OE1 2.84Å; R78-E493 VanDerWaalsContact CZ-OE1 3.26Å; R78-E493 IonicContact NH1-OE1 3.92Å; R78-E493 PolarHBondContact NH1-OE1 2.94Å; R78-E493 IonicContact NH2-OE1 3.56Å; R78-E493 PolarHBondContact NH2-OE1 3.46Å
79	P	92.8	Very high	92.5	Very high	47 Å²	47	23.1 Å²	23.1	31%	0.305	12%	0.115	S	C	.	.	H	α-helix	trans	-60.3	-22.9	177.1	-25	34.5	0	0	0	115.2	S83	P79-S83 PolarHBondContact O-N 3.14Å; P79-S83 PolarHBondContact O-OG 2.86Å
80	L	94.9	Very high	92.6	Very high	1 Å²	1	22.8 Å²	22.8	1%	0.005	11%	0.114	C	C	.	.	H	α-helix	trans	-74.6	-47.4	171.8	-168.1	90	0	0	0	110.6	F77 R78 D82 S83 V84 I92 L241 K310 V312	F77-L80 WeakPolarHBondContact O-CA 3.35Å; F77-L80 VanDerWaalsContact O-CB 3.26Å; F77-L80 WeakPolarHBondContact O-CB 3.31Å; F77-L80 PolarHBondContact O-N 2.83Å; R78-L80 PolarHBondContact O-N 3.16Å; L80-D82 VanDerWaalsContact C-N 3.32Å; L80-D82 PolarHBondContact O-N 2.87Å; L80-S83 WeakPolarHBondContact O-CA 3.38Å; L80-S83 VanDerWaalsContact O-CB 3.32Å; L80-S83 WeakPolarHBondContact O-CB 3.43Å; L80-S83 PolarHBondContact O-N 3.43Å; L80-V84 PolarHBondContact O-N 2.91Å; L80-I92 HydrophobicContact CD2-CD1 3.79Å; L80-I92 HydrophobicContact CD2-CG1 3.29Å; L80-L241 HydrophobicContact CD2-CD1 3.9Å; L80-K310 HydrophobicContact CD1-CB 3.45Å; L80-K310 VanDerWaalsContact CD1-CB 3.45Å; L80-V312 HydrophobicContact CD1-CG2 4.22Å
81	V	95.3	Very high	93	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-63.1	-40	178.6	-178.9	0	0	0	0	110.9	F77 R78 S83 V84 L85 H125 I126 L241	F77-V81 PolarHBondContact O-N 3.16Å; F77-V81 VanDerWaalsContact O-N 3.1Å; R78-V81 PolarHBondContact O-N 2.9Å; V81-S83 VanDerWaalsContact C-N 3.29Å; V81-S83 PolarHBondContact O-N 3.46Å; V81-V84 PolarHBondContact O-N 3.5Å; V81-L85 HydrophobicContact CG1-CD1 4.24Å; V81-L85 WeakPolarHBondContact O-CG 3.41Å; V81-L85 PolarHBondContact O-N 2.95Å; V81-H125 WeakPolarHBondContact CG1-ND1 3.39Å; V81-I126 HydrophobicContact CG1-CD1 4.25Å; V81-I126 HydrophobicContact CG1-CG1 3.76Å; V81-L241 HydrophobicContact CG2-CD2 4.05Å
82	D	93.5	Very high	93.5	Very high	49 Å²	49	16.4 Å²	16.4	26%	0.262	9%	0.085	S	C	.	.	H	α-helix	trans	-56.2	-43.3	170.3	-67.3	-49.8	0	0	0	111.6	R78 L80 V84 L85 Q86 H125	R78-D82 VanDerWaalsContact C-OD2 3.25Å; R78-D82 WeakPolarHBondContact CG-OD2 3.18Å; R78-D82 PolarHBondContact O-N 3.24Å; L80-D82 VanDerWaalsContact C-N 3.32Å; L80-D82 PolarHBondContact O-N 2.87Å; D82-V84 VanDerWaalsContact C-N 3.33Å; D82-V84 PolarHBondContact O-N 3.2Å; D82-L85 PolarHBondContact O-N 3.28Å; D82-Q86 WeakPolarHBondContact O-CG 3.48Å; D82-Q86 PolarHBondContact O-N 3.44Å; D82-Q86 VanDerWaalsContact O-N 3.16Å; D82-H125 IonicContact OD1-CE1 3.56Å; D82-H125 PolarHBondContact OD1-CE1 2.72Å; D82-H125 IonicContact OD1-NE2 3.89Å; D82-H125 PolarHBondContact OD1-NE2 3.21Å; D82-H125 IonicContact OD2-CE1 3.59Å
83	S	94.2	Very high	93.6	Very high	16 Å²	16	16.5 Å²	16.5	11%	0.112	9%	0.085	C	C	.	.	H	α-helix	trans	-64.1	-36.6	175.7	-58.8	0	0	0	0	112.2	P79 L80 V81 Q86 G87 F88 K310	P79-S83 PolarHBondContact O-N 3.14Å; P79-S83 PolarHBondContact O-OG 2.86Å; L80-S83 WeakPolarHBondContact O-CA 3.38Å; L80-S83 VanDerWaalsContact O-CB 3.32Å; L80-S83 WeakPolarHBondContact O-CB 3.43Å; L80-S83 PolarHBondContact O-N 3.43Å; V81-S83 VanDerWaalsContact C-N 3.29Å; V81-S83 PolarHBondContact O-N 3.46Å; S83-Q86 PolarHBondContact O-N 2.87Å; S83-G87 PolarHBondContact O-N 3.04Å; S83-F88 WeakPolarHBondContact O-CB 3.31Å; S83-F88 WeakPolarHBondContact O-CD2 3.32Å; S83-F88 PolarHBondContact O-N 3.2Å; S83-K310 WeakPolarHBondContact OG-CD 3.28Å; S83-K310 PolarHBondContact OG-NZ 3.39Å
84	V	95.1	Very high	93.7	Very high	1 Å²	1	16.3 Å²	16.3	1%	0.006	8%	0.084	C	C	.	.	H	α-helix	trans	-69.3	-38.1	176.4	-177.1	0	0	0	0	111.7	L80 V81 D82 Q86 G87 F88 I223 G239 L241	L80-V84 PolarHBondContact O-N 2.91Å; V81-V84 PolarHBondContact O-N 3.5Å; D82-V84 VanDerWaalsContact C-N 3.33Å; D82-V84 PolarHBondContact O-N 3.2Å; V84-Q86 PolarHBondContact O-N 3.05Å; V84-G87 PolarHBondContact O-N 3.07Å; V84-F88 WeakPolarHBondContact CA-O 3.35Å; V84-I223 HydrophobicContact CG1-CD1 4.11Å; V84-G239 VanDerWaalsContact CG1-C 3.48Å; V84-L241 HydrophobicContact CB-CB 4.47Å; V84-L241 HydrophobicContact CG1-CB 4.03Å; V84-L241 HydrophobicContact CG2-CB 4.09Å; V84-L241 HydrophobicContact CG2-CD1 4.25Å
85	L	92.6	Very high	93.9	Very high	2 Å²	2	16.1 Å²	16.1	1%	0.01	8%	0.082	C	C	.	.	H	α-helix	trans	-60.9	-28	173.3	-71.9	159.1	0	0	0	112.4	V81 D82 G87 I126 H129 Y138 I223	V81-L85 HydrophobicContact CG1-CD1 4.24Å; V81-L85 WeakPolarHBondContact O-CG 3.41Å; V81-L85 PolarHBondContact O-N 2.95Å; D82-L85 PolarHBondContact O-N 3.28Å; L85-G87 VanDerWaalsContact C-N 3.32Å; L85-I126 HydrophobicContact CD2-CG1 4.41Å; L85-I126 HydrophobicContact CD2-CG2 4.31Å; L85-H129 HydrophobicContact CD1-CB 3.76Å; L85-H129 HydrophobicContact CD2-CB 4.21Å; L85-Y138 HydrophobicContact CD2-CE1 4.46Å; L85-I223 HydrophobicContact CD2-CD1 3.87Å; L85-I223 HydrophobicContact CG-CD1 4.29Å
86	Q	91.2	Very high	94	Very high	87 Å²	87	15 Å²	15	41%	0.407	8%	0.077	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	5.1	172.1	-61.4	-57.6	-43.3	0	0	114.3	D82 S83 V84 F88 V346	D82-Q86 WeakPolarHBondContact O-CG 3.48Å; D82-Q86 PolarHBondContact O-N 3.44Å; D82-Q86 VanDerWaalsContact O-N 3.16Å; S83-Q86 PolarHBondContact O-N 2.87Å; V84-Q86 PolarHBondContact O-N 3.05Å; Q86-F88 HydrophobicContact CB-CD2 4.34Å; Q86-V346 WeakPolarHBondContact O-CG1 3.46Å
87	G	91.4	Very high	93.9	Very high	1 Å²	1	15.6 Å²	15.6	1%	0.01	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.5	14.6	176.3	0	0	0	0	0	116.1	S83 V84 L85 N347	S83-G87 PolarHBondContact O-N 3.04Å; V84-G87 PolarHBondContact O-N 3.07Å; L85-G87 VanDerWaalsContact C-N 3.32Å; G87-N347 PolarHBondContact O-N 2.95Å; G87-N347 PolarHBondContact O-ND2 3.32Å
88	F	93.4	Very high	93.4	Very high	43 Å²	43	17.4 Å²	17.4	19%	0.189	9%	0.091	C	C	.	.	B	Isolated β-bridge	trans	-82.6	156.3	167.3	-68.7	-92.8	0	0	0	111.2	S83 V84 Q86 G239 P344 R345 V346	S83-F88 WeakPolarHBondContact O-CB 3.31Å; S83-F88 WeakPolarHBondContact O-CD2 3.32Å; S83-F88 PolarHBondContact O-N 3.2Å; V84-F88 WeakPolarHBondContact CA-O 3.35Å; Q86-F88 HydrophobicContact CB-CD2 4.34Å; F88-G239 WeakPolarHBondContact O-CA 3.48Å; F88-P344 HydrophobicContact CD1-CB 3.89Å; F88-P344 HydrophobicContact CE1-CB 4.23Å; F88-R345 VanDerWaalsContact CD1-O 3.23Å; F88-R345 WeakPolarHBondContact CD1-O 3.43Å; F88-V346 HydrophobicContact CD2-CG2 4.13Å; F88-V346 HydrophobicContact CE1-CG2 4.06Å; F88-V346 HydrophobicContact CE2-CG2 3.58Å; F88-V346 HydrophobicContact CZ-CG2 3.54Å
89	N	94.4	Very high	93	Very high	23 Å²	23	19.1 Å²	19.1	12%	0.123	11%	0.114	C	C	.	.			trans	-77.3	140.2	161.8	-63.6	-33.6	0	0	0	110.3	K240 N308 A309 K310 N347	N89-K240 CarbonylContact C-O 3.55Å; N89-K240 WeakPolarHBondContact CA-O 3.4Å; N89-K240 WeakPolarHBondContact OD1-CB 3.45Å; N89-N308 VanDerWaalsContact CB-O 3.28Å; N89-N308 WeakPolarHBondContact CB-O 3.4Å; N89-N308 PolarHBondContact ND2-O 2.88Å; N89-A309 HydrophobicContact CB-CB 3.76Å; N89-A309 CarbonylContact O-C 3.56Å; N89-A309 WeakPolarHBondContact O-CA 3.33Å; N89-K310 PolarHBondContact O-N 3.41Å; N89-N347 PolarHBondContact ND2-ND2 2.98Å; N89-N347 PolarHBondContact OD1-ND2 2.95Å
90	G	95.4	Very high	92.9	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	141.6	177.2	0	0	0	0	0	111	K240 L241 N242 K310	G90-K240 PolarHBondContact N-O 3.35Å; G90-K240 VanDerWaalsContact O-O 3.13Å; G90-L241 CarbonylContact O-C 3.48Å; G90-L241 VanDerWaalsContact O-CA 3.3Å; G90-L241 WeakPolarHBondContact O-CA 3.33Å; G90-N242 PolarHBondContact O-N 3.32Å; G90-K310 CarbonylContact C-O 3.58Å; G90-K310 VanDerWaalsContact CA-O 3.31Å; G90-K310 WeakPolarHBondContact CA-O 3.42Å
91	T	97.1	Very high	92.7	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	131.9	172	-63.6	0	0	0	0	110.4	F93 N242 V244 L301 S304 K310 T311 V312	T91-F93 HydrophobicContact CG2-CD1 4.33Å; T91-N242 CarbonylContact C-O 3.16Å; T91-N242 WeakPolarHBondContact CA-O 3.44Å; T91-N242 HydrophobicContact CG2-CB 4.14Å; T91-N242 PolarHBondContact OG1-ND2 2.88Å; T91-V244 HydrophobicContact CG2-CG2 4.32Å; T91-L301 HydrophobicContact CG2-CD2 4.26Å; T91-S304 WeakPolarHBondContact CB-OG 3.09Å; T91-S304 PolarHBondContact OG1-OG 3.3Å; T91-K310 PolarHBondContact N-O 3.4Å; T91-T311 HydrophobicContact CG2-CG2 4.32Å; T91-T311 CarbonylContact O-C 3.39Å; T91-T311 WeakPolarHBondContact O-CA 3.32Å; T91-V312 PolarHBondContact O-N 3.24Å
92	I	97.3	Very high	92.6	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	122	168.5	-53.9	178.6	0	0	0	106.8	F77 L80 M106 V118 L241 N242 L243 V244 V312 V314	F77-I92 HydrophobicContact CB-CD1 3.96Å; F77-I92 HydrophobicContact CD1-CD1 3.83Å; F77-I92 HydrophobicContact CD1-CG1 4.48Å; F77-I92 HydrophobicContact CD1-CG2 4.14Å; F77-I92 HydrophobicContact CE1-CG2 3.92Å; F77-I92 HydrophobicContact CG-CD1 4Å; L80-I92 HydrophobicContact CD2-CD1 3.79Å; L80-I92 HydrophobicContact CD2-CG1 3.29Å; I92-M106 HydrophobicContact CG2-SD 4.42Å; I92-V118 HydrophobicContact CD1-CG2 3.59Å; I92-L241 HydrophobicContact CG1-CD1 4.47Å; I92-N242 PolarHBondContact N-O 3.39Å; I92-L243 HydrophobicContact CB-CD2 4.25Å; I92-L243 HydrophobicContact CD1-CD2 4.03Å; I92-L243 HydrophobicContact CG1-CD2 4.42Å; I92-V244 PolarHBondContact O-N 3.26Å; I92-V312 WeakPolarHBondContact CA-O 3.39Å; I92-V312 HydrophobicContact CG1-CB 4.48Å; I92-V314 HydrophobicContact CG2-CG2 4.2Å
93	F	95.6	Very high	92.5	Very high	2 Å²	2	18.6 Å²	18.6	1%	0.009	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	130.4	175.6	69.4	-89.2	0	0	0	112.4	T91 V244 L246 L305 T311 V312 M313 V314	T91-F93 HydrophobicContact CG2-CD1 4.33Å; F93-V244 WeakPolarHBondContact CA-O 3.25Å; F93-V244 HydrophobicContact CB-CB 3.7Å; F93-V244 HydrophobicContact CB-CG1 4.08Å; F93-V244 HydrophobicContact CB-CG2 4.35Å; F93-L246 HydrophobicContact CD2-CD1 3.91Å; F93-L305 HydrophobicContact CE1-CD2 4.25Å; F93-L305 HydrophobicContact CZ-CD2 4.39Å; F93-T311 HydrophobicContact CD1-CG2 3.93Å; F93-T311 HydrophobicContact CE1-CG2 3.65Å; F93-V312 PolarHBondContact N-O 2.89Å; F93-M313 HydrophobicContact CD2-CG 4.16Å; F93-M313 HydrophobicContact CE1-CB 3.88Å; F93-M313 HydrophobicContact CE1-CG 4.39Å; F93-M313 HydrophobicContact CE2-CB 3.88Å; F93-M313 HydrophobicContact CE2-CE 4.28Å; F93-M313 HydrophobicContact CE2-CG 3.45Å; F93-M313 VanDerWaalsContact CE2-CG 3.45Å; F93-M313 HydrophobicContact CE2-SD 3.86Å; F93-M313 HydrophobicContact CZ-CB 3.52Å; F93-M313 HydrophobicContact CZ-CG 3.6Å; F93-M313 HydrophobicContact CZ-SD 3.91Å; F93-V314 PolarHBondContact O-N 3.06Å
94	A	95.3	Very high	92.4	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	128.4	173.4	0	0	0	0	0	110.4	K102 M106 V244 L246 V314	A94-K102 HydrophobicContact CB-CB 3.85Å; A94-K102 HydrophobicContact CB-CG 4.25Å; A94-M106 HydrophobicContact CB-CG 3.71Å; A94-M106 HydrophobicContact CB-SD 3.85Å; A94-V244 PolarHBondContact N-O 3.34Å; A94-L246 VanDerWaalsContact O-CB 3.3Å; A94-L246 WeakPolarHBondContact O-CB 3.47Å; A94-L246 WeakPolarHBondContact O-CG 3.26Å; A94-L246 PolarHBondContact O-N 3.27Å; A94-V314 WeakPolarHBondContact CA-O 3.28Å
95	Y	94.2	Very high	92.4	Very high	15 Å²	15	22.3 Å²	22.3	6%	0.059	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	148.4	-174.9	179	-85.3	0	0	0	111.2	L246 S249 L272 M313 V314 N316 T330 Y333	Y95-L246 HydrophobicContact CD2-CD1 3.8Å; Y95-L246 HydrophobicContact CG-CD1 4.47Å; Y95-S249 WeakPolarHBondContact OH-CB 3.39Å; Y95-L272 HydrophobicContact CE2-CD2 4.19Å; Y95-M313 HydrophobicContact CD1-CE 3.68Å; Y95-M313 HydrophobicContact CG-CE 3.79Å; Y95-V314 PolarHBondContact N-O 3.46Å; Y95-N316 PolarHBondContact O-N 3.39Å; Y95-T330 HydrophobicContact CD1-CG2 4.05Å; Y95-T330 HydrophobicContact CE1-CG2 4.18Å; Y95-Y333 AromaticContact CD1-CD1 3.9Å; Y95-Y333 HydrophobicContact CD1-CD1 3.9Å; Y95-Y333 HydrophobicContact CD1-CE1 4.45Å; Y95-Y333 HydrophobicContact CD2-CD1 4.15Å; Y95-Y333 AromaticContact CD2-CE1 3.91Å; Y95-Y333 HydrophobicContact CD2-CE1 3.91Å; Y95-Y333 AromaticContact CE1-CD1 3.52Å; Y95-Y333 HydrophobicContact CE1-CD1 3.52Å; Y95-Y333 HydrophobicContact CE1-CE1 4.24Å; Y95-Y333 HydrophobicContact CE1-CG 4.33Å; Y95-Y333 AromaticContact CE2-CD1 3.76Å; Y95-Y333 HydrophobicContact CE2-CD1 3.76Å; Y95-Y333 AromaticContact CE2-CE1 3.62Å; Y95-Y333 HydrophobicContact CE2-CE1 3.62Å; Y95-Y333 HydrophobicContact CG-CD1 4.22Å; Y95-Y333 HydrophobicContact CG-CE1 4.33Å; Y95-Y333 AromaticContact CZ-CD1 3.44Å; Y95-Y333 VanDerWaalsContact CZ-CD1 3.44Å; Y95-Y333 AromaticContact CZ-CE1 3.81Å
96	G	91.4	Very high	92.5	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.126	C	C	.	.	S	Bend	trans	137	-178.4	175.4	0	0	0	0	0	113.2	K102 S249	G96-K102 PolarHBondContact O-NZ 3.09Å; G96-S249 PolarHBondContact O-N 3.44Å
97	Q	88.2	Confident	92.5	Very high	19 Å²	19	19.7 Å²	19.7	9%	0.089	11%	0.114	C	C	.	.	S	Bend	trans	-59	152.6	-179.8	174.5	-172	44.6	0	0	112.4	T100 K102 S249 E250 N323 E326	Q97-T100 HydrophobicContact CB-CG2 3.7Å; Q97-T100 HydrophobicContact CG-CG2 4.4Å; Q97-T100 WeakPolarHBondContact O-CB 3.28Å; Q97-T100 WeakPolarHBondContact O-CG2 3.46Å; Q97-T100 PolarHBondContact O-N 3.33Å; Q97-T100 PolarHBondContact O-OG1 3.22Å; Q97-K102 PolarHBondContact O-NZ 3.47Å; Q97-S249 PolarHBondContact N-OG 2.78Å; Q97-S249 VanDerWaalsContact N-OG 3.16Å; Q97-E250 WeakPolarHBondContact CA-OE2 3.34Å; Q97-E250 HydrophobicContact CG-CB 4.24Å; Q97-N323 PolarHBondContact NE2-OD1 3.28Å; Q97-N323 PolarHBondContact OE1-OD1 3.41Å; Q97-E326 HydrophobicContact CB-CB 4.19Å; Q97-E326 HydrophobicContact CG-CB 4.49Å
98	T	85.4	Confident	92.5	Very high	41 Å²	41	20.3 Å²	20.3	25%	0.252	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	136.9	169.7	-68.6	0	0	0	0	112.2	T100 S213 G248 E250	T98-T100 VanDerWaalsContact C-N 3.26Å; T98-T100 PolarHBondContact O-N 2.89Å; T98-S213 WeakPolarHBondContact OG1-CB 3.3Å; T98-G248 VanDerWaalsContact OG1-CA 3.28Å; T98-G248 WeakPolarHBondContact OG1-CA 3.45Å; T98-E250 WeakPolarHBondContact CB-OE1 3.34Å; T98-E250 PolarHBondContact N-OE2 3.22Å; T98-E250 VanDerWaalsContact OG1-CD 3.31Å; T98-E250 PolarHBondContact OG1-OE1 2.9Å; T98-E250 PolarHBondContact OG1-OE2 2.85Å
99	G	84.9	Confident	92.3	Very high	54 Å²	54	22.2 Å²	22.2	56%	0.557	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.6	6.1	-178.7	0	0	0	0	0	115.6	R17 G101	R17-G99 PolarHBondContact NE-O 2.92Å; G99-G101 VanDerWaalsContact C-N 3.33Å
100	T	90.8	Very high	91.4	Very high	2 Å²	2	27.5 Å²	27.5	1%	0.012	15%	0.15	C	C	.	.	S	Bend	trans	-75.3	-19.5	170.2	56.3	0	0	0	0	113.7	R17 Q97 T98 N316	R17-T100 WeakPolarHBondContact CD-O 3.35Å; R17-T100 WeakPolarHBondContact CG-O 3.48Å; Q97-T100 HydrophobicContact CB-CG2 3.7Å; Q97-T100 HydrophobicContact CG-CG2 4.4Å; Q97-T100 WeakPolarHBondContact O-CB 3.28Å; Q97-T100 WeakPolarHBondContact O-CG2 3.46Å; Q97-T100 PolarHBondContact O-N 3.33Å; Q97-T100 PolarHBondContact O-OG1 3.22Å; T98-T100 VanDerWaalsContact C-N 3.26Å; T98-T100 PolarHBondContact O-N 2.89Å; T100-N316 WeakPolarHBondContact CB-O 3.49Å; T100-N316 VanDerWaalsContact OG1-CB 3.3Å; T100-N316 WeakPolarHBondContact OG1-CB 3.4Å; T100-N316 PolarHBondContact OG1-O 3.05Å
101	G	90.9	Very high	90.3	Very high	16 Å²	16	31.2 Å²	31.2	17%	0.165	19%	0.188	C	C	.	.	S	Bend	trans	117.2	22.3	175.5	0	0	0	0	0	116.2	G99 Y104 T105	G99-G101 VanDerWaalsContact C-N 3.33Å; G101-Y104 PolarHBondContact O-N 2.74Å; G101-T105 WeakPolarHBondContact O-CB 3.13Å; G101-T105 PolarHBondContact O-N 3.39Å; G101-T105 PolarHBondContact O-OG1 3.33Å
102	K	92.5	Very high	89.8	Confident	11 Å²	11	33.2 Å²	33.2	5%	0.048	20%	0.199	C	C	.	.	H	α-helix	trans	-53.1	-66.7	174.7	-57.6	-168.9	-64.3	-80.1	0	112.5	A94 G96 Q97 Y104 T105 M106 D245 L246 A247 N316	A94-K102 HydrophobicContact CB-CB 3.85Å; A94-K102 HydrophobicContact CB-CG 4.25Å; G96-K102 PolarHBondContact O-NZ 3.09Å; Q97-K102 PolarHBondContact O-NZ 3.47Å; K102-Y104 VanDerWaalsContact C-N 3.25Å; K102-Y104 PolarHBondContact O-N 2.85Å; K102-T105 CarbonylContact O-C 3.6Å; K102-T105 WeakPolarHBondContact O-CA 3.31Å; K102-T105 WeakPolarHBondContact O-CB 3.44Å; K102-T105 PolarHBondContact O-N 3.43Å; K102-M106 PolarHBondContact O-N 2.66Å; K102-D245 VanDerWaalsContact C-OD1 3.28Å; K102-D245 VanDerWaalsContact CB-OD1 3.23Å; K102-D245 WeakPolarHBondContact CB-OD1 3.47Å; K102-L246 WeakPolarHBondContact CE-O 3.21Å; K102-A247 WeakPolarHBondContact CE-O 3.38Å; K102-A247 PolarHBondContact NZ-O 3.38Å; K102-N316 WeakPolarHBondContact CA-OD1 3.46Å; K102-N316 HydrophobicContact CG-CB 4.12Å
103	T	91.3	Very high	89.1	Confident	57 Å²	57	38 Å²	38	35%	0.35	23%	0.23	S	C	.	.	H	α-helix	trans	-58.4	-33.3	176.6	-40.7	0	0	0	0	113.1	T105 M106 E107 G108 D245	T103-T105 VanDerWaalsContact C-N 3.31Å; T103-T105 PolarHBondContact O-N 2.86Å; T103-M106 PolarHBondContact O-N 2.69Å; T103-E107 PolarHBondContact O-N 2.8Å; T103-G108 PolarHBondContact O-N 3.2Å; T103-D245 WeakPolarHBondContact CA-OD2 3.19Å; T103-D245 VanDerWaalsContact CB-OD2 3.3Å; T103-D245 WeakPolarHBondContact CB-OD2 3.5Å; T103-D245 WeakPolarHBondContact CG2-OD2 3.35Å; T103-D245 PolarHBondContact N-OD1 3.32Å; T103-D245 VanDerWaalsContact N-OD1 3.09Å; T103-D245 PolarHBondContact OG1-OD2 3.18Å
104	Y	92.8	Very high	88.7	Confident	95 Å²	95	43.5 Å²	43.5	37%	0.373	26%	0.256	S	S	.	.	H	α-helix	trans	-66.9	-31.6	173	-179.6	-99.2	0	0	0	112.4	Q69 G101 K102 G108 I109	Q69-Y104 PolarHBondContact NE2-O 2.91Å; G101-Y104 PolarHBondContact O-N 2.74Å; K102-Y104 VanDerWaalsContact C-N 3.25Å; K102-Y104 PolarHBondContact O-N 2.85Å; Y104-G108 WeakPolarHBondContact O-CA 3.39Å; Y104-G108 PolarHBondContact O-N 3.49Å; Y104-I109 HydrophobicContact CE2-CD1 4.29Å; Y104-I109 HydrophobicContact CE2-CG1 4.23Å
105	T	94.8	Very high	88.4	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.006	27%	0.273	C	S	.	.	H	α-helix	trans	-77.7	-37.4	173.9	-51.2	0	0	0	0	111.1	R15 L72 F77 G101 K102 T103 G117 V118 V314 N316	R15-T105 PolarHBondContact NH1-OG1 2.98Å; L72-T105 HydrophobicContact CD2-CG2 3.64Å; F77-T105 HydrophobicContact CE2-CG2 4.45Å; F77-T105 HydrophobicContact CZ-CG2 4.38Å; G101-T105 WeakPolarHBondContact O-CB 3.13Å; G101-T105 PolarHBondContact O-N 3.39Å; G101-T105 PolarHBondContact O-OG1 3.33Å; K102-T105 CarbonylContact O-C 3.6Å; K102-T105 WeakPolarHBondContact O-CA 3.31Å; K102-T105 WeakPolarHBondContact O-CB 3.44Å; K102-T105 PolarHBondContact O-N 3.43Å; T103-T105 VanDerWaalsContact C-N 3.31Å; T103-T105 PolarHBondContact O-N 2.86Å; T105-G117 CarbonylContact O-C 3.6Å; T105-G117 WeakPolarHBondContact O-CA 3.36Å; T105-V118 PolarHBondContact O-N 3.03Å; T105-V314 HydrophobicContact CG2-CG1 4.08Å; T105-N316 PolarHBondContact OG1-ND2 3.42Å; T105-N316 VanDerWaalsContact OG1-ND2 3.08Å
106	M	94.1	Very high	88.3	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.01	28%	0.282	C	S	.	.	H	α-helix	trans	-73.6	-63.3	-179.7	-62.2	-52.9	-67.9	0	0	113.1	I92 A94 K102 T103 G117 V118 I119 L243 D245	I92-M106 HydrophobicContact CG2-SD 4.42Å; A94-M106 HydrophobicContact CB-CG 3.71Å; A94-M106 HydrophobicContact CB-SD 3.85Å; K102-M106 PolarHBondContact O-N 2.66Å; T103-M106 PolarHBondContact O-N 2.69Å; M106-G117 CarbonylContact O-C 3.6Å; M106-V118 HydrophobicContact CE-CG1 3.84Å; M106-V118 PolarHBondContact O-N 2.96Å; M106-V118 VanDerWaalsContact O-N 3.08Å; M106-V118 HydrophobicContact SD-CG1 3.58Å; M106-V118 VanDerWaalsContact SD-CG1 3.58Å; M106-I119 HydrophobicContact CB-CD1 3.99Å; M106-I119 HydrophobicContact CB-CG1 4.46Å; M106-I119 HydrophobicContact CE-CD1 4.29Å; M106-I119 HydrophobicContact CE-CG1 4.2Å; M106-I119 WeakPolarHBondContact O-CB 3.35Å; M106-I119 VanDerWaalsContact O-CG1 3.32Å; M106-I119 WeakPolarHBondContact O-CG1 2.75Å; M106-I119 PolarHBondContact O-N 2.84Å; M106-L243 HydrophobicContact CE-CB 3.88Å; M106-L243 HydrophobicContact CE-CD2 4.24Å; M106-D245 HydrophobicContact CB-CB 4.3Å; M106-D245 HydrophobicContact CG-CB 4Å
107	E	92	Very high	88.4	Confident	31 Å²	31	49.8 Å²	49.8	15%	0.145	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-42.7	179.7	176.1	173.5	166	0	0	112.5	T103 R110 G117 M194 N198	T103-E107 PolarHBondContact O-N 2.8Å; E107-R110 HydrophobicContact CG-CG 4.2Å; E107-R110 IonicContact OE1-CZ 3.93Å; E107-R110 IonicContact OE1-NE 3.23Å; E107-R110 PolarHBondContact OE1-NE 3.49Å; E107-R110 IonicContact OE1-NH2 3.34Å; E107-R110 PolarHBondContact OE1-NH2 3.04Å; E107-G117 WeakPolarHBondContact O-CA 3.16Å; E107-G117 PolarHBondContact O-N 3.3Å; E107-M194 HydrophobicContact CB-CE 3.75Å; E107-M194 HydrophobicContact CG-CE 3.59Å; E107-N198 PolarHBondContact OE1-ND2 3.34Å; E107-N198 PolarHBondContact OE2-ND2 3.39Å
108	G	91.1	Very high	88.8	Confident	15 Å²	15	49 Å²	49	16%	0.155	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	66.6	-140.8	-172.7	0	0	0	0	0	112.6	T103 Y104 K115	T103-G108 PolarHBondContact O-N 3.2Å; Y104-G108 WeakPolarHBondContact O-CA 3.39Å; Y104-G108 PolarHBondContact O-N 3.49Å; G108-K115 CarbonylContact C-O 3.59Å; G108-K115 VanDerWaalsContact CA-O 3.32Å; G108-K115 WeakPolarHBondContact CA-O 3.49Å
109	I	88.2	Confident	89.2	Confident	82 Å²	82	47.4 Å²	47.4	42%	0.421	27%	0.269	S	S	.	.			trans	-114.6	105.4	177.4	-60.9	177.9	0	0	0	108.7	Y104 G111 D112 K115	Y104-I109 HydrophobicContact CE2-CD1 4.29Å; Y104-I109 HydrophobicContact CE2-CG1 4.23Å; I109-G111 VanDerWaalsContact C-N 3.28Å; I109-G111 PolarHBondContact O-N 3.39Å; I109-D112 HydrophobicContact CB-CB 4.32Å; I109-D112 HydrophobicContact CG2-CB 3.94Å; I109-D112 PolarHBondContact O-N 2.83Å; I109-D112 VanDerWaalsContact O-N 3.12Å; I109-K115 HydrophobicContact CB-CB 3.96Å; I109-K115 HydrophobicContact CD1-CB 4.29Å; I109-K115 HydrophobicContact CD1-CD 3.93Å; I109-K115 HydrophobicContact CG1-CB 4.32Å; I109-K115 PolarHBondContact N-O 3.37Å
110	R	75.2	Confident	89.6	Confident	134 Å²	134	45.2 Å²	45.2	51%	0.506	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-37.2	-173.7	-76.7	179.8	-85.1	147.4	1.8	114.7	E107 D112 N195	E107-R110 HydrophobicContact CG-CG 4.2Å; E107-R110 IonicContact OE1-CZ 3.93Å; E107-R110 IonicContact OE1-NE 3.23Å; E107-R110 PolarHBondContact OE1-NE 3.49Å; E107-R110 IonicContact OE1-NH2 3.34Å; E107-R110 PolarHBondContact OE1-NH2 3.04Å; R110-D112 VanDerWaalsContact C-N 3.34Å; R110-D112 PolarHBondContact O-N 2.99Å; R110-N195 WeakPolarHBondContact CD-OD1 3.36Å; R110-N195 PolarHBondContact NH1-OD1 3.47Å
111	G	73.5	Confident	89.7	Confident	78 Å²	78	45.5 Å²	45.5	80%	0.804	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-0.7	-177.8	0	0	0	0	0	115.7	I109	I109-G111 VanDerWaalsContact C-N 3.28Å; I109-G111 PolarHBondContact O-N 3.39Å
112	D	85.4	Confident	89.9	Confident	42 Å²	42	44.8 Å²	44.8	23%	0.225	24%	0.238	C	C	.	.			trans	-125.7	106.7	-173.7	-178	-25.3	0	0	0	110.1	I109 R110 E114 K115 R116	I109-D112 HydrophobicContact CB-CB 4.32Å; I109-D112 HydrophobicContact CG2-CB 3.94Å; I109-D112 PolarHBondContact O-N 2.83Å; I109-D112 VanDerWaalsContact O-N 3.12Å; R110-D112 VanDerWaalsContact C-N 3.34Å; R110-D112 PolarHBondContact O-N 2.99Å; D112-E114 PolarHBondContact O-N 3.22Å; D112-E114 VanDerWaalsContact O-N 3.15Å; D112-E114 PolarHBondContact OD1-N 3.33Å; D112-K115 HydrophobicContact CB-CB 4.04Å; D112-K115 HydrophobicContact CB-CG 4.47Å; D112-K115 CarbonylContact O-C 3.6Å; D112-K115 PolarHBondContact O-N 2.72Å; D112-K115 PolarHBondContact OD1-N 2.76Å; D112-K115 VanDerWaalsContact OD2-CD 3.3Å; D112-K115 WeakPolarHBondContact OD2-CD 3.38Å; D112-K115 WeakPolarHBondContact OD2-CE 3.41Å; D112-K115 WeakPolarHBondContact OD2-CG 3.49Å; D112-K115 IonicContact OD2-NZ 3.26Å; D112-K115 PolarHBondContact OD2-NZ 2.99Å; D112-R116 PolarHBondContact O-N 3.29Å
113	P	83.4	Confident	90	Very high	101 Å²	101	44.2 Å²	44.2	66%	0.656	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-27.4	-177.8	-27.8	36.1	0	0	0	115
114	E	86.5	Confident	90	Very high	118 Å²	118	44 Å²	44	55%	0.551	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-24.4	176.2	-60.9	-162	146.9	0	0	112.5	D112	D112-E114 PolarHBondContact O-N 3.22Å; D112-E114 VanDerWaalsContact O-N 3.15Å; D112-E114 PolarHBondContact OD1-N 3.33Å
115	K	90.7	Very high	90	Very high	80 Å²	80	40 Å²	40	35%	0.348	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.3	0.3	-173.7	-58.2	-172.2	-168.9	80.7	0	114.2	Q69 G108 I109 D112	Q69-K115 PolarHBondContact NE2-O 2.86Å; G108-K115 CarbonylContact C-O 3.59Å; G108-K115 VanDerWaalsContact CA-O 3.32Å; G108-K115 WeakPolarHBondContact CA-O 3.49Å; I109-K115 HydrophobicContact CB-CB 3.96Å; I109-K115 HydrophobicContact CD1-CB 4.29Å; I109-K115 HydrophobicContact CD1-CD 3.93Å; I109-K115 HydrophobicContact CG1-CB 4.32Å; I109-K115 PolarHBondContact N-O 3.37Å; D112-K115 HydrophobicContact CB-CB 4.04Å; D112-K115 HydrophobicContact CB-CG 4.47Å; D112-K115 CarbonylContact O-C 3.6Å; D112-K115 PolarHBondContact O-N 2.72Å; D112-K115 PolarHBondContact OD1-N 2.76Å; D112-K115 VanDerWaalsContact OD2-CD 3.3Å; D112-K115 WeakPolarHBondContact OD2-CD 3.38Å; D112-K115 WeakPolarHBondContact OD2-CE 3.41Å; D112-K115 WeakPolarHBondContact OD2-CG 3.49Å; D112-K115 IonicContact OD2-NZ 3.26Å; D112-K115 PolarHBondContact OD2-NZ 2.99Å
116	R	92.1	Very high	89.9	Confident	66 Å²	66	40 Å²	40	25%	0.249	22%	0.217	C	C	.	.	B	Isolated β-bridge	trans	-61.2	134.3	172.7	79	-172.7	-172.9	168	5.3	111.6	Q69 D112 P120 N121 D124	Q69-R116 WeakPolarHBondContact CB-O 3.45Å; Q69-R116 WeakPolarHBondContact CG-O 3.28Å; D112-R116 PolarHBondContact O-N 3.29Å; R116-P120 HydrophobicContact CB-CB 4.33Å; R116-P120 HydrophobicContact CB-CG 3.8Å; R116-P120 HydrophobicContact CG-CG 4.38Å; R116-N121 VanDerWaalsContact CZ-OD1 3.25Å; R116-N121 PolarHBondContact NE-OD1 3.07Å; R116-N121 PolarHBondContact NH2-OD1 2.91Å; R116-N121 PolarHBondContact O-ND2 3.21Å; R116-D124 IonicContact CZ-OD2 2.68Å; R116-D124 IonicContact NH1-OD2 3.73Å; R116-D124 PolarHBondContact NH1-OD2 3.29Å; R116-D124 IonicContact NH2-OD2 3.52Å; R116-D124 PolarHBondContact NH2-OD2 3.44Å
117	G	93.7	Very high	89.8	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.01	22%	0.221	C	C	.	.			trans	-80.4	-170.8	-175.3	0	0	0	0	0	114.6	T105 M106 E107 I119 P120 N121	T105-G117 CarbonylContact O-C 3.6Å; T105-G117 WeakPolarHBondContact O-CA 3.36Å; M106-G117 CarbonylContact O-C 3.6Å; E107-G117 WeakPolarHBondContact O-CA 3.16Å; E107-G117 PolarHBondContact O-N 3.3Å; G117-I119 VanDerWaalsContact C-N 3.31Å; G117-I119 PolarHBondContact O-N 3.33Å; G117-P120 WeakPolarHBondContact O-CD 3.5Å; G117-P120 WeakPolarHBondContact O-CG 3.5Å; G117-N121 WeakPolarHBondContact O-CB 3.08Å; G117-N121 PolarHBondContact O-N 3Å; G117-N121 PolarHBondContact O-ND2 2.86Å
118	V	95.2	Very high	89.7	Confident	2 Å²	2	41 Å²	41	1%	0.012	22%	0.224	C	C	.	.	H	α-helix	trans	-62.8	-34.7	-179.4	61	0	0	0	0	113.2	Y73 F77 I92 T105 M106 S122 L243	Y73-V118 HydrophobicContact CD2-CB 4.43Å; Y73-V118 HydrophobicContact CD2-CG2 3.94Å; Y73-V118 HydrophobicContact CE2-CG2 4Å; F77-V118 HydrophobicContact CB-CG2 3.84Å; F77-V118 HydrophobicContact CD1-CG2 4.39Å; F77-V118 HydrophobicContact CD2-CB 3.6Å; F77-V118 HydrophobicContact CD2-CG2 3.32Å; F77-V118 HydrophobicContact CE2-CB 3.74Å; F77-V118 HydrophobicContact CE2-CG1 4.41Å; F77-V118 HydrophobicContact CE2-CG2 3.93Å; F77-V118 HydrophobicContact CG-CB 4.35Å; F77-V118 HydrophobicContact CG-CG2 3.61Å; I92-V118 HydrophobicContact CD1-CG2 3.59Å; T105-V118 PolarHBondContact O-N 3.03Å; M106-V118 HydrophobicContact CE-CG1 3.84Å; M106-V118 PolarHBondContact O-N 2.96Å; M106-V118 VanDerWaalsContact O-N 3.08Å; M106-V118 HydrophobicContact SD-CG1 3.58Å; M106-V118 VanDerWaalsContact SD-CG1 3.58Å; V118-S122 WeakPolarHBondContact O-CB 3.5Å; V118-S122 PolarHBondContact O-N 3.08Å; V118-L243 HydrophobicContact CG1-CD2 4.34Å; V118-L243 HydrophobicContact CG2-CD2 4.27Å
119	I	94.5	Very high	89.6	Confident	8 Å²	8	42.7 Å²	42.7	4%	0.041	23%	0.228	C	C	.	.	H	α-helix	trans	-61.5	-60.8	-179.7	-61.8	173.1	0	0	0	110.8	M106 G117 N121 S122 F123 M194 L243	M106-I119 HydrophobicContact CB-CD1 3.99Å; M106-I119 HydrophobicContact CB-CG1 4.46Å; M106-I119 HydrophobicContact CE-CD1 4.29Å; M106-I119 HydrophobicContact CE-CG1 4.2Å; M106-I119 WeakPolarHBondContact O-CB 3.35Å; M106-I119 VanDerWaalsContact O-CG1 3.32Å; M106-I119 WeakPolarHBondContact O-CG1 2.75Å; M106-I119 PolarHBondContact O-N 2.84Å; G117-I119 VanDerWaalsContact C-N 3.31Å; G117-I119 PolarHBondContact O-N 3.33Å; I119-N121 PolarHBondContact O-N 2.95Å; I119-S122 WeakPolarHBondContact O-CB 3.45Å; I119-S122 PolarHBondContact O-N 2.89Å; I119-S122 PolarHBondContact O-OG 3.2Å; I119-F123 HydrophobicContact CG2-CE1 3.66Å; I119-F123 HydrophobicContact CG2-CE2 3.9Å; I119-F123 HydrophobicContact CG2-CZ 3.26Å; I119-F123 WeakPolarHBondContact O-CD1 3.38Å; I119-F123 PolarHBondContact O-N 2.85Å; I119-M194 HydrophobicContact CB-CE 4.14Å; I119-M194 HydrophobicContact CB-SD 4.49Å; I119-M194 HydrophobicContact CD1-CE 3.98Å; I119-M194 HydrophobicContact CG2-CE 3.77Å; I119-M194 HydrophobicContact CG2-SD 3.63Å; I119-L243 HydrophobicContact CD1-CB 4.37Å; I119-L243 HydrophobicContact CG1-CB 3.98Å; I119-L243 HydrophobicContact CG1-CD1 4.11Å; I119-L243 HydrophobicContact CG1-CD2 4.28Å; I119-L243 HydrophobicContact CG1-CG 4.33Å; I119-L243 HydrophobicContact CG2-CD1 4.41Å
120	P	93.4	Very high	89.6	Confident	8 Å²	8	39.1 Å²	39.1	5%	0.052	21%	0.209	C	C	.	.	H	α-helix	trans	-65.1	-33	178.5	24.9	-35	0	0	0	113.9	R116 G117 S122 F123 D124	R116-P120 HydrophobicContact CB-CB 4.33Å; R116-P120 HydrophobicContact CB-CG 3.8Å; R116-P120 HydrophobicContact CG-CG 4.38Å; G117-P120 WeakPolarHBondContact O-CD 3.5Å; G117-P120 WeakPolarHBondContact O-CG 3.5Å; P120-S122 VanDerWaalsContact C-N 3.29Å; P120-S122 PolarHBondContact O-N 3.29Å; P120-F123 PolarHBondContact O-N 3.06Å; P120-D124 PolarHBondContact O-N 2.95Å
121	N	93.2	Very high	90.1	Very high	8 Å²	8	35.1 Å²	35.1	4%	0.043	20%	0.202	C	C	.	.	H	α-helix	trans	-62.7	-36.3	171.3	-79.5	-65.3	0	0	0	111.8	Y73 R116 G117 I119 H125	Y73-N121 HydrophobicContact CD1-CB 4.06Å; Y73-N121 HydrophobicContact CD2-CB 3.31Å; Y73-N121 HydrophobicContact CE1-CB 4.19Å; Y73-N121 HydrophobicContact CE2-CB 3.47Å; Y73-N121 VanDerWaalsContact CE2-CB 3.47Å; Y73-N121 HydrophobicContact CG-CB 3.65Å; R116-N121 VanDerWaalsContact CZ-OD1 3.25Å; R116-N121 PolarHBondContact NE-OD1 3.07Å; R116-N121 PolarHBondContact NH2-OD1 2.91Å; R116-N121 PolarHBondContact O-ND2 3.21Å; G117-N121 WeakPolarHBondContact O-CB 3.08Å; G117-N121 PolarHBondContact O-N 3Å; G117-N121 PolarHBondContact O-ND2 2.86Å; I119-N121 PolarHBondContact O-N 2.95Å; N121-H125 WeakPolarHBondContact O-CB 3.23Å; N121-H125 PolarHBondContact O-N 2.82Å
122	S	94.5	Very high	90.6	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-66.8	-36	177	77.4	0	0	0	0	112.8	Y73 V118 I119 P120 H125 I126	Y73-S122 WeakPolarHBondContact OH-CA 3.21Å; V118-S122 WeakPolarHBondContact O-CB 3.5Å; V118-S122 PolarHBondContact O-N 3.08Å; I119-S122 WeakPolarHBondContact O-CB 3.45Å; I119-S122 PolarHBondContact O-N 2.89Å; I119-S122 PolarHBondContact O-OG 3.2Å; P120-S122 VanDerWaalsContact C-N 3.29Å; P120-S122 PolarHBondContact O-N 3.29Å; S122-H125 PolarHBondContact O-N 2.85Å; S122-I126 WeakPolarHBondContact O-CB 3.35Å; S122-I126 VanDerWaalsContact O-CD1 3.31Å; S122-I126 WeakPolarHBondContact O-CD1 2.95Å; S122-I126 WeakPolarHBondContact O-CG1 3.12Å; S122-I126 PolarHBondContact O-N 3.32Å
123	F	94.1	Very high	90.6	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-61.3	-52.6	175.3	-56.7	-18.5	0	0	0	110.8	I119 P120 H125 I126 F127 V187 I190 E191 M194 F219 I221	I119-F123 HydrophobicContact CG2-CE1 3.66Å; I119-F123 HydrophobicContact CG2-CE2 3.9Å; I119-F123 HydrophobicContact CG2-CZ 3.26Å; I119-F123 WeakPolarHBondContact O-CD1 3.38Å; I119-F123 PolarHBondContact O-N 2.85Å; P120-F123 PolarHBondContact O-N 3.06Å; F123-H125 VanDerWaalsContact C-N 3.33Å; F123-H125 PolarHBondContact O-N 3.2Å; F123-I126 PolarHBondContact O-N 3.46Å; F123-F127 VanDerWaalsContact O-CD2 3.28Å; F123-F127 WeakPolarHBondContact O-CD2 3.33Å; F123-F127 PolarHBondContact O-N 3.1Å; F123-V187 HydrophobicContact CB-CG1 4.2Å; F123-I190 HydrophobicContact CB-CG2 3.72Å; F123-I190 HydrophobicContact CD1-CD1 3.65Å; F123-I190 HydrophobicContact CD1-CG1 3.94Å; F123-I190 HydrophobicContact CD1-CG2 3.92Å; F123-I190 HydrophobicContact CD2-CG1 4.45Å; F123-I190 HydrophobicContact CD2-CG2 3.6Å; F123-I190 HydrophobicContact CE1-CD1 3.62Å; F123-I190 HydrophobicContact CE1-CG1 3.69Å; F123-I190 HydrophobicContact CE1-CG2 4.41Å; F123-I190 HydrophobicContact CE2-CG1 4.22Å; F123-I190 HydrophobicContact CE2-CG2 4.12Å; F123-I190 HydrophobicContact CG-CD1 4.36Å; F123-I190 HydrophobicContact CG-CG1 4.32Å; F123-I190 HydrophobicContact CG-CG2 3.48Å; F123-I190 VanDerWaalsContact CG-CG2 3.48Å; F123-I190 HydrophobicContact CZ-CD1 4.28Å; F123-I190 HydrophobicContact CZ-CG1 3.83Å; F123-I190 HydrophobicContact CZ-CG2 4.48Å; F123-E191 HydrophobicContact CD2-CG 3.91Å; F123-E191 HydrophobicContact CE2-CG 4.25Å; F123-M194 HydrophobicContact CE2-CB 4.31Å; F123-M194 HydrophobicContact CE2-SD 3.94Å; F123-M194 HydrophobicContact CZ-CB 4.38Å; F123-M194 HydrophobicContact CZ-SD 4.14Å; F123-F219 HydrophobicContact CE1-CD1 4.25Å; F123-F219 AromaticContact CE1-CE1 3.59Å; F123-F219 HydrophobicContact CE1-CE1 3.59Å; F123-F219 HydrophobicContact CE1-CZ 4.09Å; F123-F219 HydrophobicContact CZ-CD1 4.41Å; F123-F219 AromaticContact CZ-CE1 3.71Å; F123-F219 HydrophobicContact CZ-CE1 3.71Å; F123-F219 HydrophobicContact CZ-CE2 4.48Å; F123-F219 AromaticContact CZ-CZ 3.76Å; F123-F219 HydrophobicContact CZ-CZ 3.76Å; F123-I221 HydrophobicContact CD1-CD1 3.78Å; F123-I221 HydrophobicContact CE1-CD1 3.7Å; F123-I221 HydrophobicContact CE1-CG1 4.48Å
124	D	91.5	Very high	90.4	Very high	51 Å²	51	36.5 Å²	36.5	27%	0.273	18%	0.175	S	C	.	.	H	α-helix	trans	-56.5	-46.8	178.1	-169.2	11	0	0	0	111.3	R116 P120 T128	R116-D124 IonicContact CZ-OD2 2.68Å; R116-D124 IonicContact NH1-OD2 3.73Å; R116-D124 PolarHBondContact NH1-OD2 3.29Å; R116-D124 IonicContact NH2-OD2 3.52Å; R116-D124 PolarHBondContact NH2-OD2 3.44Å; P120-D124 PolarHBondContact O-N 2.95Å; D124-T128 WeakPolarHBondContact O-CB 3.2Å; D124-T128 PolarHBondContact O-N 2.87Å; D124-T128 PolarHBondContact O-OG1 3.11Å; D124-T128 PolarHBondContact OD1-OG1 3.43Å
125	H	92.1	Very high	90	Very high	13 Å²	13	38.2 Å²	38.2	6%	0.06	19%	0.188	C	C	.	.	H	α-helix	trans	-62.7	-46	178.1	-172.9	-155.1	0	0	0	113.1	Y73 R78 V81 D82 N121 S122 F123 T128 H129	Y73-H125 HydrophobicContact CE1-CB 4.28Å; Y73-H125 VanDerWaalsContact OH-CB 3.23Å; Y73-H125 WeakPolarHBondContact OH-CB 3.47Å; Y73-H125 PolarHBondContact OH-ND1 2.93Å; Y73-H125 VanDerWaalsContact OH-ND1 3.09Å; R78-H125 PolarHBondContact NH1-CD2 2.85Å; R78-H125 VanDerWaalsContact NH1-CD2 3.33Å; R78-H125 PolarHBondContact NH1-NE2 3.35Å; V81-H125 WeakPolarHBondContact CG1-ND1 3.39Å; D82-H125 IonicContact OD1-CE1 3.56Å; D82-H125 PolarHBondContact OD1-CE1 2.72Å; D82-H125 IonicContact OD1-NE2 3.89Å; D82-H125 PolarHBondContact OD1-NE2 3.21Å; D82-H125 IonicContact OD2-CE1 3.59Å; N121-H125 WeakPolarHBondContact O-CB 3.23Å; N121-H125 PolarHBondContact O-N 2.82Å; S122-H125 PolarHBondContact O-N 2.85Å; F123-H125 VanDerWaalsContact C-N 3.33Å; F123-H125 PolarHBondContact O-N 3.2Å; H125-T128 PolarHBondContact O-N 3.13Å; H125-H129 WeakPolarHBondContact O-CB 3.3Å; H125-H129 PolarHBondContact O-N 2.91Å
126	I	93.7	Very high	89.7	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-62.8	-52.1	-180	-71.1	161.8	0	0	0	110.7	V81 L85 S122 F123 T128 H129 I130 V140 I221 I223 L241	V81-I126 HydrophobicContact CG1-CD1 4.25Å; V81-I126 HydrophobicContact CG1-CG1 3.76Å; L85-I126 HydrophobicContact CD2-CG1 4.41Å; L85-I126 HydrophobicContact CD2-CG2 4.31Å; S122-I126 WeakPolarHBondContact O-CB 3.35Å; S122-I126 VanDerWaalsContact O-CD1 3.31Å; S122-I126 WeakPolarHBondContact O-CD1 2.95Å; S122-I126 WeakPolarHBondContact O-CG1 3.12Å; S122-I126 PolarHBondContact O-N 3.32Å; F123-I126 PolarHBondContact O-N 3.46Å; I126-T128 VanDerWaalsContact C-N 3.33Å; I126-T128 PolarHBondContact O-N 2.86Å; I126-H129 PolarHBondContact O-N 2.88Å; I126-I130 HydrophobicContact CG2-CD1 3.73Å; I126-I130 VanDerWaalsContact O-CG1 3.25Å; I126-I130 WeakPolarHBondContact O-CG1 3.31Å; I126-I130 PolarHBondContact O-N 2.82Å; I126-V140 HydrophobicContact CG2-CG2 4.14Å; I126-I221 HydrophobicContact CD1-CD1 3.79Å; I126-I221 HydrophobicContact CD1-CG2 4.26Å; I126-I223 HydrophobicContact CD1-CD1 3.82Å; I126-I223 HydrophobicContact CG1-CD1 3.85Å; I126-I223 HydrophobicContact CG2-CD1 3.88Å; I126-L241 HydrophobicContact CD1-CD2 4.46Å
127	F	92.1	Very high	89.4	Confident	20 Å²	20	35.7 Å²	35.7	9%	0.088	18%	0.18	C	C	.	.	H	α-helix	trans	-70.4	-28.7	-178.5	-74.1	-73.5	0	0	0	112.9	F123 S131 V140 T184 K185 V187 I190 L475	F123-F127 VanDerWaalsContact O-CD2 3.28Å; F123-F127 WeakPolarHBondContact O-CD2 3.33Å; F123-F127 PolarHBondContact O-N 3.1Å; F127-S131 WeakPolarHBondContact O-CB 3.45Å; F127-S131 PolarHBondContact O-N 2.85Å; F127-S131 PolarHBondContact O-OG 3.47Å; F127-V140 HydrophobicContact CE1-CG2 4.42Å; F127-V140 HydrophobicContact CZ-CB 4.28Å; F127-V140 HydrophobicContact CZ-CG1 4.23Å; F127-V140 HydrophobicContact CZ-CG2 4.48Å; F127-T184 WeakPolarHBondContact CZ-O 3.48Å; F127-K185 WeakPolarHBondContact CE1-O 3.47Å; F127-V187 HydrophobicContact CB-CG2 3.75Å; F127-V187 HydrophobicContact CD2-CB 4.49Å; F127-V187 HydrophobicContact CD2-CG2 3.83Å; F127-V187 HydrophobicContact CG-CG2 4.07Å; F127-I190 HydrophobicContact CD2-CG2 4.39Å; F127-I190 HydrophobicContact CE2-CB 4.27Å; F127-I190 HydrophobicContact CE2-CG2 3.67Å; F127-L475 HydrophobicContact CD1-CD1 4.19Å; F127-L475 HydrophobicContact CE1-CD1 3.72Å
128	T	89	Confident	89.2	Confident	33 Å²	33	35.7 Å²	35.7	20%	0.202	18%	0.18	C	C	.	.	H	α-helix	trans	-70.8	-35	171.4	-64.9	0	0	0	0	112.2	D124 H125 I126 S131 R132	D124-T128 WeakPolarHBondContact O-CB 3.2Å; D124-T128 PolarHBondContact O-N 2.87Å; D124-T128 PolarHBondContact O-OG1 3.11Å; D124-T128 PolarHBondContact OD1-OG1 3.43Å; H125-T128 PolarHBondContact O-N 3.13Å; I126-T128 VanDerWaalsContact C-N 3.33Å; I126-T128 PolarHBondContact O-N 2.86Å; T128-S131 PolarHBondContact O-OG 2.64Å; T128-R132 VanDerWaalsContact CG2-CZ 3.46Å; T128-R132 WeakPolarHBondContact O-CB 3.49Å; T128-R132 WeakPolarHBondContact O-CD 3.45Å; T128-R132 VanDerWaalsContact O-CG 3.25Å; T128-R132 WeakPolarHBondContact O-CG 3.49Å; T128-R132 PolarHBondContact O-N 3.39Å
129	H	89.2	Confident	89	Confident	51 Å²	51	35.6 Å²	35.6	24%	0.236	18%	0.179	C	C	.	.	H	α-helix	trans	-66.3	-47.3	172.1	-171.2	100.6	0	0	0	111.2	L85 H125 I126 S131 R132 S133	L85-H129 HydrophobicContact CD1-CB 3.76Å; L85-H129 HydrophobicContact CD2-CB 4.21Å; H125-H129 WeakPolarHBondContact O-CB 3.3Å; H125-H129 PolarHBondContact O-N 2.91Å; I126-H129 PolarHBondContact O-N 2.88Å; H129-S131 PolarHBondContact O-N 2.97Å; H129-R132 PolarHBondContact O-N 3.35Å; H129-S133 PolarHBondContact O-N 2.65Å
130	I	88.8	Confident	89	Confident	6 Å²	6	35.2 Å²	35.2	3%	0.031	18%	0.177	C	C	.	.	H	α-helix	trans	-62.5	-38.9	179.9	-66.2	167.9	0	0	0	111.9	I126 R132 S133 Y138 V140 L475 G477	I126-I130 HydrophobicContact CG2-CD1 3.73Å; I126-I130 VanDerWaalsContact O-CG1 3.25Å; I126-I130 WeakPolarHBondContact O-CG1 3.31Å; I126-I130 PolarHBondContact O-N 2.82Å; I130-R132 VanDerWaalsContact C-N 3.32Å; I130-R132 PolarHBondContact O-N 3.03Å; I130-S133 PolarHBondContact O-OG 3.21Å; I130-Y138 HydrophobicContact CB-CD2 4.41Å; I130-Y138 HydrophobicContact CB-CG 4.42Å; I130-Y138 HydrophobicContact CD1-CD1 4.08Å; I130-Y138 HydrophobicContact CD1-CG 4.06Å; I130-Y138 HydrophobicContact CG1-CD1 3.77Å; I130-Y138 HydrophobicContact CG1-CD2 4.01Å; I130-Y138 HydrophobicContact CG1-CE1 4.18Å; I130-Y138 HydrophobicContact CG1-CE2 4.43Å; I130-Y138 HydrophobicContact CG1-CG 3.65Å; I130-Y138 HydrophobicContact CG2-CD2 4.02Å; I130-Y138 HydrophobicContact CG2-CG 4.09Å; I130-V140 HydrophobicContact CD1-CG2 3.44Å; I130-V140 VanDerWaalsContact CD1-CG2 3.44Å; I130-L475 HydrophobicContact CD1-CD1 4.22Å; I130-L475 HydrophobicContact CG2-CB 3.62Å; I130-L475 HydrophobicContact CG2-CD1 4.16Å; I130-L475 HydrophobicContact CG2-CG 4.47Å; I130-G477 VanDerWaalsContact O-CA 3.26Å; I130-G477 WeakPolarHBondContact O-CA 2.97Å
131	S	86.5	Confident	89	Confident	51 Å²	51	37 Å²	37	36%	0.357	18%	0.183	S	C	.	.	H	α-helix	trans	-70.1	-29.5	179	65.1	0	0	0	0	113.3	F127 T128 H129 G478	F127-S131 WeakPolarHBondContact O-CB 3.45Å; F127-S131 PolarHBondContact O-N 2.85Å; F127-S131 PolarHBondContact O-OG 3.47Å; T128-S131 PolarHBondContact O-OG 2.64Å; H129-S131 PolarHBondContact O-N 2.97Å; S131-G478 PolarHBondContact O-N 2.87Å; S131-G478 VanDerWaalsContact O-N 3.14Å
132	R	84	Confident	89.1	Confident	91 Å²	91	36.6 Å²	36.6	34%	0.343	18%	0.181	S	C	.	.	H	α-helix	trans	-86.5	-16.8	178.5	-69.7	174.9	-179	170.1	5.1	114.4	T128 H129 I130 E493	T128-R132 VanDerWaalsContact CG2-CZ 3.46Å; T128-R132 WeakPolarHBondContact O-CB 3.49Å; T128-R132 WeakPolarHBondContact O-CD 3.45Å; T128-R132 VanDerWaalsContact O-CG 3.25Å; T128-R132 WeakPolarHBondContact O-CG 3.49Å; T128-R132 PolarHBondContact O-N 3.39Å; H129-R132 PolarHBondContact O-N 3.35Å; I130-R132 VanDerWaalsContact C-N 3.32Å; I130-R132 PolarHBondContact O-N 3.03Å; R132-E493 IonicContact CZ-OE2 3.69Å; R132-E493 VanDerWaalsContact CZ-OE2 3.23Å; R132-E493 IonicContact NH1-OE2 2.91Å; R132-E493 PolarHBondContact NH1-OE2 3.07Å; R132-E493 IonicContact NH2-OE2 2.76Å; R132-E493 PolarHBondContact NH2-OE2 2.8Å
133	S	83.8	Confident	89.2	Confident	13 Å²	13	37 Å²	37	9%	0.091	18%	0.184	C	C	.	.			trans	-66.7	158.3	175.8	68.7	0	0	0	0	110.7	H129 I130 Y138 G477 G478	H129-S133 PolarHBondContact O-N 2.65Å; I130-S133 PolarHBondContact O-OG 3.21Å; S133-Y138 WeakPolarHBondContact OG-CE2 3.18Å; S133-G477 CarbonylContact O-C 3.56Å; S133-G477 WeakPolarHBondContact O-CA 3.5Å; S133-G478 PolarHBondContact O-N 3.42Å
134	Q	79.4	Confident	89.3	Confident	145 Å²	145	37.4 Å²	37.4	68%	0.678	19%	0.186	S	C	*	.	S	Bend	trans	-130.9	148.8	173.7	-68.4	-179.3	-16.6	0	0	107.7	Q136	Q134-Q136 PolarHBondContact O-N 2.64Å
135	N	78.2	Confident	89.4	Confident	154 Å²	154	35.2 Å²	35.2	82%	0.824	17%	0.174	S	C	*	.	S	Bend	trans	58.1	17.4	177.2	-52.9	-17.5	0	0	0	115.7
136	Q	84.7	Confident	89.4	Confident	28 Å²	28	34.9 Å²	34.9	13%	0.131	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	139.1	179.3	-68.6	172.9	-9.3	0	0	110.2	Q134 Y138 S226 E227	Q134-Q136 PolarHBondContact O-N 2.64Å; Q136-Y138 HydrophobicContact CB-CD2 4.24Å; Q136-Y138 HydrophobicContact CB-CE2 3.65Å; Q136-Y138 PolarHBondContact OE1-OH 2.95Å; Q136-S226 WeakPolarHBondContact CA-O 3.36Å; Q136-E227 HydrophobicContact CG-CB 4.15Å; Q136-E227 HydrophobicContact CG-CG 4.06Å; Q136-E227 VanDerWaalsContact NE2-CD 3.31Å; Q136-E227 PolarHBondContact NE2-OE1 3.07Å
137	Q	85.8	Confident	89.2	Confident	65 Å²	65	34.9 Å²	34.9	30%	0.304	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	130	174.9	-62.1	-172.3	7.4	0	0	110	C225 S226 V476	Q137-C225 CarbonylContact O-C 3.59Å; Q137-C225 WeakPolarHBondContact O-CA 3.18Å; Q137-S226 PolarHBondContact N-O 2.81Å; Q137-S226 PolarHBondContact O-N 2.85Å; Q137-V476 HydrophobicContact CG-CG2 4.46Å
138	Y	90.3	Very high	88.9	Confident	1 Å²	1	34.4 Å²	34.4	0%	0.004	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	142.1	-178.7	-75	-94.8	0	0	0	112.4	L85 I130 S133 Q136 I223 E224 C225 L475	L85-Y138 HydrophobicContact CD2-CE1 4.46Å; I130-Y138 HydrophobicContact CB-CD2 4.41Å; I130-Y138 HydrophobicContact CB-CG 4.42Å; I130-Y138 HydrophobicContact CD1-CD1 4.08Å; I130-Y138 HydrophobicContact CD1-CG 4.06Å; I130-Y138 HydrophobicContact CG1-CD1 3.77Å; I130-Y138 HydrophobicContact CG1-CD2 4.01Å; I130-Y138 HydrophobicContact CG1-CE1 4.18Å; I130-Y138 HydrophobicContact CG1-CE2 4.43Å; I130-Y138 HydrophobicContact CG1-CG 3.65Å; I130-Y138 HydrophobicContact CG2-CD2 4.02Å; I130-Y138 HydrophobicContact CG2-CG 4.09Å; S133-Y138 WeakPolarHBondContact OG-CE2 3.18Å; Q136-Y138 HydrophobicContact CB-CD2 4.24Å; Q136-Y138 HydrophobicContact CB-CE2 3.65Å; Q136-Y138 PolarHBondContact OE1-OH 2.95Å; Y138-I223 HydrophobicContact CD1-CG2 3.74Å; Y138-I223 HydrophobicContact CE1-CG2 4.12Å; Y138-E224 CarbonylContact C-O 3.58Å; Y138-E224 VanDerWaalsContact CA-O 3.31Å; Y138-E224 WeakPolarHBondContact CA-O 3.37Å; Y138-C225 HydrophobicContact CD1-CB 3.88Å; Y138-C225 HydrophobicContact CE1-CB 3.59Å; Y138-L475 PolarHBondContact N-O 2.84Å; Y138-L475 WeakPolarHBondContact O-CB 3.42Å; Y138-L475 PolarHBondContact O-N 3.24Å
139	L	90.9	Very high	88.5	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	110.1	169.6	179.1	69.4	0	0	0	108.8	V183 E224 L354 L355 F358	L139-V183 HydrophobicContact CD1-CG1 3.61Å; L139-V183 HydrophobicContact CD1-CG2 4.22Å; L139-E224 HydrophobicContact CB-CB 4.34Å; L139-E224 PolarHBondContact N-O 2.92Å; L139-E224 PolarHBondContact O-N 2.84Å; L139-L354 HydrophobicContact CD2-CB 4.22Å; L139-L354 HydrophobicContact CD2-CD2 4.2Å; L139-L354 HydrophobicContact CD2-CG 4.17Å; L139-L355 HydrophobicContact CB-CB 4.31Å; L139-L355 HydrophobicContact CB-CD1 4.02Å; L139-L355 HydrophobicContact CB-CG 4.25Å; L139-L355 HydrophobicContact CD2-CB 4.13Å; L139-F358 HydrophobicContact CD1-CE2 4.4Å; L139-F358 HydrophobicContact CD2-CD2 3.81Å; L139-F358 HydrophobicContact CD2-CE2 3.99Å
140	V	93.8	Very high	88.4	Confident	1 Å²	1	35 Å²	35	1%	0.006	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	126.9	177.6	-175.2	0	0	0	0	109.4	I126 F127 I130 V183 T184 I221 I223 L475	I126-V140 HydrophobicContact CG2-CG2 4.14Å; F127-V140 HydrophobicContact CE1-CG2 4.42Å; F127-V140 HydrophobicContact CZ-CB 4.28Å; F127-V140 HydrophobicContact CZ-CG1 4.23Å; F127-V140 HydrophobicContact CZ-CG2 4.48Å; I130-V140 HydrophobicContact CD1-CG2 3.44Å; I130-V140 VanDerWaalsContact CD1-CG2 3.44Å; V140-V183 WeakPolarHBondContact O-CA 3.36Å; V140-T184 PolarHBondContact O-N 3.02Å; V140-T184 PolarHBondContact O-OG1 3.3Å; V140-I221 HydrophobicContact CG1-CG2 3.69Å; V140-I223 HydrophobicContact CG2-CG2 4.47Å; V140-L475 HydrophobicContact CG2-CD1 4.26Å
141	R	94.2	Very high	88.4	Confident	44 Å²	44	38 Å²	38	17%	0.166	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	144.7	171.4	62.6	176	168.9	-84.6	14.3	111.5	S181 F182 I221 T222 E224	R141-S181 WeakPolarHBondContact CD-OG 3.39Å; R141-F182 CarbonylContact C-O 3.58Å; R141-F182 VanDerWaalsContact CA-O 3.27Å; R141-F182 WeakPolarHBondContact CA-O 3.23Å; R141-I221 WeakPolarHBondContact O-CA 3.37Å; R141-T222 PolarHBondContact N-O 3.48Å; R141-T222 PolarHBondContact O-N 2.87Å; R141-E224 IonicContact CZ-OE1 3.13Å; R141-E224 VanDerWaalsContact NH1-CD 3.25Å; R141-E224 IonicContact NH1-OE1 2.74Å; R141-E224 PolarHBondContact NH1-OE1 2.93Å; R141-E224 IonicContact NH2-OE1 2.72Å; R141-E224 PolarHBondContact NH2-OE1 2.94Å
142	A	95.7	Very high	88.7	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	135.2	176	0	0	0	0	0	110.9	S181 F182 T184 I190 V193 F219 V220	A142-S181 WeakPolarHBondContact O-CA 3.49Å; A142-F182 PolarHBondContact N-O 3.09Å; A142-F182 PolarHBondContact O-N 2.98Å; A142-T184 HydrophobicContact CB-CG2 4.27Å; A142-I190 HydrophobicContact CB-CD1 4.03Å; A142-I190 HydrophobicContact CB-CG1 4.04Å; A142-V193 HydrophobicContact CB-CG1 4.07Å; A142-F219 HydrophobicContact CB-CE1 4.04Å; A142-F219 HydrophobicContact CB-CZ 3.88Å; A142-V220 WeakPolarHBondContact CA-O 3.25Å
143	S	95.4	Very high	89	Confident	10 Å²	10	33.4 Å²	33.4	7%	0.07	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	144.4	169.7	-69	0	0	0	0	108.5	S180 S181 V220	S143-S180 WeakPolarHBondContact CB-O 3.39Å; S143-S180 PolarHBondContact OG-O 3.4Å; S143-S181 WeakPolarHBondContact OG-CA 3.26Å; S143-S181 VanDerWaalsContact OG-CB 3.23Å; S143-S181 WeakPolarHBondContact OG-CB 3.18Å; S143-S181 PolarHBondContact OG-OG 3.3Å; S143-V220 PolarHBondContact N-O 3.48Å; S143-V220 PolarHBondContact O-N 2.83Å
144	Y	95.8	Very high	89.5	Confident	8 Å²	8	33.2 Å²	33.2	3%	0.031	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	122.6	-178	-168.7	-166.2	0	0	0	109.8	L155 L156 N198 A217 F219	Y144-L155 HydrophobicContact CD1-CB 4.17Å; Y144-L155 HydrophobicContact CD1-CD1 3.92Å; Y144-L155 HydrophobicContact CD2-CD1 3.83Å; Y144-L155 HydrophobicContact CE1-CD1 3.81Å; Y144-L155 HydrophobicContact CE2-CD1 3.74Å; Y144-L155 HydrophobicContact CG-CB 4.22Å; Y144-L155 HydrophobicContact CG-CD1 3.91Å; Y144-L155 WeakPolarHBondContact O-CB 3.28Å; Y144-L155 PolarHBondContact O-N 2.84Å; Y144-L156 HydrophobicContact CD1-CD2 4.39Å; Y144-N198 WeakPolarHBondContact CE1-OD1 3.47Å; Y144-N198 PolarHBondContact OH-OD1 2.97Å; Y144-A217 HydrophobicContact CE2-CB 4Å; Y144-F219 AromaticContact CD1-CD2 3.7Å; Y144-F219 HydrophobicContact CD1-CD2 3.7Å; Y144-F219 HydrophobicContact CD1-CE2 4.05Å; Y144-F219 HydrophobicContact CD2-CB 3.9Å; Y144-F219 AromaticContact CD2-CD2 3.69Å; Y144-F219 HydrophobicContact CD2-CD2 3.69Å; Y144-F219 HydrophobicContact CD2-CG 4.25Å; Y144-F219 HydrophobicContact CE1-CD2 4.18Å; Y144-F219 HydrophobicContact CE2-CB 4.13Å; Y144-F219 HydrophobicContact CE2-CD2 4.14Å; Y144-F219 AromaticContact CG-CD2 3.46Å; Y144-F219 HydrophobicContact CG-CD2 3.46Å; Y144-F219 VanDerWaalsContact CG-CD2 3.46Å; Y144-F219 HydrophobicContact CG-CE2 4.08Å; Y144-F219 HydrophobicContact CG-CG 4.38Å
145	L	94.2	Very high	90.1	Very high	4 Å²	4	26.3 Å²	26.3	2%	0.021	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	160.2	-175.6	68.6	89.2	0	0	0	111.8	I147 I152 R153 V176 L179 I218 L300	L145-I147 HydrophobicContact CD1-CG1 4.02Å; L145-I152 HydrophobicContact CB-CG2 4.41Å; L145-I152 HydrophobicContact CD1-CG2 4.31Å; L145-R153 CarbonylContact C-O 3.59Å; L145-R153 VanDerWaalsContact CA-O 3.26Å; L145-R153 WeakPolarHBondContact CA-O 3.5Å; L145-R153 WeakPolarHBondContact CB-O 3.25Å; L145-V176 HydrophobicContact CD2-CG2 3.96Å; L145-L179 HydrophobicContact CB-CD1 4.04Å; L145-L179 HydrophobicContact CD2-CD1 4.25Å; L145-L179 HydrophobicContact CD2-CD2 3.77Å; L145-I218 HydrophobicContact CD1-CB 3.88Å; L145-I218 HydrophobicContact CD1-CD1 4.2Å; L145-I218 HydrophobicContact CD1-CG1 4.14Å; L145-I218 HydrophobicContact CG-CB 4.04Å; L145-I218 PolarHBondContact N-O 2.86Å; L145-I218 PolarHBondContact O-N 2.78Å; L145-L300 HydrophobicContact CD1-CD1 4.4Å
146	E	92.1	Very high	90.8	Very high	6 Å²	6	19.6 Å²	19.6	3%	0.028	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	135	176.9	-176.8	166	-127.1	0	0	109.7	I152 R153 L155 R201 H211 S215 H216	E146-I152 WeakPolarHBondContact O-CA 3.3Å; E146-R153 PolarHBondContact N-O 3.3Å; E146-R153 PolarHBondContact O-N 2.87Å; E146-L155 HydrophobicContact CB-CD1 4.11Å; E146-L155 HydrophobicContact CB-CD2 3.98Å; E146-L155 HydrophobicContact CB-CG 4.02Å; E146-R201 WeakPolarHBondContact OE1-CD 3.5Å; E146-R201 VanDerWaalsContact OE1-CG 3.28Å; E146-R201 WeakPolarHBondContact OE1-CG 3.45Å; E146-R201 IonicContact OE1-CZ 3.72Å; E146-R201 IonicContact OE1-NE 2.81Å; E146-R201 PolarHBondContact OE1-NE 3.29Å; E146-R201 IonicContact OE1-NH2 3.43Å; E146-H211 IonicContact OE1-CD2 2.72Å; E146-H211 IonicContact OE1-NE2 3.4Å; E146-H211 IonicContact OE2-NE2 2.73Å; E146-S215 VanDerWaalsContact OE1-CB 3.22Å; E146-S215 WeakPolarHBondContact OE1-CB 3.41Å; E146-S215 PolarHBondContact OE1-OG 3.44Å; E146-H216 CarbonylContact C-O 3.6Å; E146-H216 WeakPolarHBondContact CA-O 3.15Å
147	I	90.5	Very high	91.1	Very high	2 Å²	2	19.7 Å²	19.7	1%	0.01	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	116.1	169	-47.2	178.9	0	0	0	107.1	L145 E151 I152 S215 H216 I218 K296 L297 L300	L145-I147 HydrophobicContact CD1-CG1 4.02Å; I147-E151 WeakPolarHBondContact CA-O 3.41Å; I147-I152 HydrophobicContact CG1-CG1 4.47Å; I147-S215 WeakPolarHBondContact O-CA 3.44Å; I147-H216 HydrophobicContact CB-CB 4.25Å; I147-H216 PolarHBondContact N-O 2.93Å; I147-H216 PolarHBondContact O-N 3.21Å; I147-I218 HydrophobicContact CD1-CD1 4.05Å; I147-K296 HydrophobicContact CG2-CB 4.43Å; I147-L297 HydrophobicContact CD1-CB 3.98Å; I147-L297 HydrophobicContact CD1-CD1 3.99Å; I147-L300 HydrophobicContact CD1-CD1 3.82Å; I147-L300 HydrophobicContact CG1-CD1 4.49Å
148	Y	85.3	Confident	91.1	Very high	10 Å²	10	27 Å²	27	4%	0.039	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	127.7	179	175.2	-110	0	0	0	109.8	E150 E151 H211 R214 E264	Y148-E150 PolarHBondContact O-N 2.93Å; Y148-E151 PolarHBondContact N-O 2.82Å; Y148-E151 WeakPolarHBondContact O-CB 3.41Å; Y148-E151 PolarHBondContact O-N 3.39Å; Y148-H211 AromaticContact CD1-CE1 3.65Å; Y148-H211 AromaticContact CD2-CE1 3.19Å; Y148-H211 WeakPolarHBondContact CD2-CE1 3.47Å; Y148-H211 AromaticContact CD2-ND1 3.77Å; Y148-H211 AromaticContact CE1-CE1 3.69Å; Y148-H211 AromaticContact CE2-CE1 3.25Å; Y148-H211 WeakPolarHBondContact CE2-CE1 3.44Å; Y148-H211 AromaticContact CE2-ND1 3.44Å; Y148-H211 WeakPolarHBondContact CE2-ND1 3.43Å; Y148-H211 AromaticContact CG-CE1 3.38Å; Y148-H211 AromaticContact CZ-CE1 3.48Å; Y148-H211 VanDerWaalsContact CZ-CE1 3.48Å; Y148-H211 AromaticContact CZ-ND1 3.74Å; Y148-R214 WeakPolarHBondContact CD2-O 3.37Å; Y148-E264 HydrophobicContact CE2-CG 3.77Å; Y148-E264 WeakPolarHBondContact CE2-OE1 3.19Å; Y148-E264 VanDerWaalsContact OH-CD 3.27Å; Y148-E264 PolarHBondContact OH-OE1 2.76Å; Y148-E264 VanDerWaalsContact OH-OE1 3.06Å
149	Q	80.9	Confident	90.9	Very high	55 Å²	55	30.4 Å²	30.4	26%	0.257	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	35.6	-177.4	-63.3	-171.1	14.9	0	0	114.6	E151 E264 K267	Q149-E151 PolarHBondContact O-N 3.36Å; Q149-E264 HydrophobicContact CG-CG 4.42Å; Q149-K267 HydrophobicContact CB-CD 3.58Å; Q149-K267 HydrophobicContact CG-CD 4.07Å; Q149-K267 WeakPolarHBondContact O-CD 3.32Å; Q149-K267 PolarHBondContact O-NZ 3.06Å
150	E	86.5	Confident	90.5	Very high	40 Å²	40	32.9 Å²	32.9	19%	0.187	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.1	16.2	-171.9	-66	-60	102.1	0	0	115.4	Y148 S271 S295 K296	Y148-E150 PolarHBondContact O-N 2.93Å; E150-S271 WeakPolarHBondContact OE1-CB 3.45Å; E150-S295 VanDerWaalsContact OE2-CA 3.24Å; E150-S295 WeakPolarHBondContact OE2-CA 3.39Å; E150-S295 WeakPolarHBondContact OE2-CB 3.46Å; E150-K296 WeakPolarHBondContact O-CG 3.31Å; E150-K296 WeakPolarHBondContact OE2-CG 3.16Å; E150-K296 PolarHBondContact OE2-N 3Å
151	E	88.8	Confident	90	Very high	70 Å²	70	38.1 Å²	38.1	33%	0.327	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	143	166.8	-44.1	-174.7	125.1	0	0	110.8	I147 Y148 Q149 R153 R163	I147-E151 WeakPolarHBondContact CA-O 3.41Å; Y148-E151 PolarHBondContact N-O 2.82Å; Y148-E151 WeakPolarHBondContact O-CB 3.41Å; Y148-E151 PolarHBondContact O-N 3.39Å; Q149-E151 PolarHBondContact O-N 3.36Å; E151-R153 IonicContact OE2-NE 3.47Å; E151-R153 IonicContact OE2-NH2 3.88Å; E151-R153 PolarHBondContact OE2-NH2 2.96Å; E151-R163 HydrophobicContact CB-CG 4.4Å; E151-R163 IonicContact OE1-NE 3.89Å; E151-R163 WeakPolarHBondContact OE2-CD 3.35Å; E151-R163 IonicContact OE2-CZ 3.8Å; E151-R163 IonicContact OE2-NE 2.9Å; E151-R163 PolarHBondContact OE2-NE 2.93Å; E151-R163 IonicContact OE2-NH2 2.63Å
152	I	91.8	Very high	89.7	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.01	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	132.1	173.1	-59.5	173.9	0	0	0	109.8	L145 E146 I147 R163 L164 L166 V176 K296 L300	L145-I152 HydrophobicContact CB-CG2 4.41Å; L145-I152 HydrophobicContact CD1-CG2 4.31Å; E146-I152 WeakPolarHBondContact O-CA 3.3Å; I147-I152 HydrophobicContact CG1-CG1 4.47Å; I152-R163 WeakPolarHBondContact O-CA 3.4Å; I152-L164 HydrophobicContact CB-CB 4.28Å; I152-L164 HydrophobicContact CG2-CB 4.12Å; I152-L164 PolarHBondContact O-N 3.02Å; I152-L166 HydrophobicContact CD1-CD1 4.21Å; I152-L166 HydrophobicContact CD1-CD2 3.37Å; I152-L166 HydrophobicContact CD1-CG 3.54Å; I152-V176 HydrophobicContact CD1-CG2 4.23Å; I152-V176 HydrophobicContact CG2-CG1 3.97Å; I152-K296 HydrophobicContact CD1-CB 4.48Å; I152-L300 HydrophobicContact CD1-CD1 4Å
153	R	91	Very high	89.3	Confident	43 Å²	43	44 Å²	44	16%	0.162	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	141	175.2	-58.5	-179.2	-174	-173.9	-0.8	109.9	L145 E146 E151 R163	L145-R153 CarbonylContact C-O 3.59Å; L145-R153 VanDerWaalsContact CA-O 3.26Å; L145-R153 WeakPolarHBondContact CA-O 3.5Å; L145-R153 WeakPolarHBondContact CB-O 3.25Å; E146-R153 PolarHBondContact N-O 3.3Å; E146-R153 PolarHBondContact O-N 2.87Å; E151-R153 IonicContact OE2-NE 3.47Å; E151-R153 IonicContact OE2-NH2 3.88Å; E151-R153 PolarHBondContact OE2-NH2 2.96Å; R153-R163 VanDerWaalsContact NH2-NH2 3.13Å
154	D	94.1	Very high	89.2	Confident	10 Å²	10	44.3 Å²	44.3	5%	0.053	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	113.1	174.9	179.8	-16.6	0	0	0	109.2	L156 S157 Q160 L164 L179 S180	D154-L156 PolarHBondContact O-N 3.19Å; D154-L156 WeakPolarHBondContact OD1-CA 3.19Å; D154-L156 PolarHBondContact OD1-N 2.92Å; D154-S157 PolarHBondContact O-N 3.43Å; D154-S157 PolarHBondContact OD1-N 2.91Å; D154-S157 VanDerWaalsContact OD1-N 3.08Å; D154-Q160 PolarHBondContact O-NE2 2.95Å; D154-Q160 PolarHBondContact O-OE1 2.91Å; D154-L164 HydrophobicContact CB-CD1 3.86Å; D154-L179 HydrophobicContact CB-CD1 4.14Å; D154-S180 VanDerWaalsContact CG-OG 3.24Å; D154-S180 PolarHBondContact OD1-OG 3.45Å; D154-S180 VanDerWaalsContact OD1-OG 3.06Å; D154-S180 WeakPolarHBondContact OD2-CB 3.44Å; D154-S180 PolarHBondContact OD2-N 2.87Å; D154-S180 PolarHBondContact OD2-OG 2.85Å
155	L	92.1	Very high	88.9	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-10.3	-177.4	-65.4	178.1	0	0	0	113	Y144 E146 G197 N200 R201	Y144-L155 HydrophobicContact CD1-CB 4.17Å; Y144-L155 HydrophobicContact CD1-CD1 3.92Å; Y144-L155 HydrophobicContact CD2-CD1 3.83Å; Y144-L155 HydrophobicContact CE1-CD1 3.81Å; Y144-L155 HydrophobicContact CE2-CD1 3.74Å; Y144-L155 HydrophobicContact CG-CB 4.22Å; Y144-L155 HydrophobicContact CG-CD1 3.91Å; Y144-L155 WeakPolarHBondContact O-CB 3.28Å; Y144-L155 PolarHBondContact O-N 2.84Å; E146-L155 HydrophobicContact CB-CD1 4.11Å; E146-L155 HydrophobicContact CB-CD2 3.98Å; E146-L155 HydrophobicContact CB-CG 4.02Å; L155-G197 WeakPolarHBondContact O-CA 3.45Å; L155-N200 PolarHBondContact O-ND2 3.48Å; L155-R201 HydrophobicContact CD1-CB 4.37Å; L155-R201 HydrophobicContact CD2-CB 4.07Å
156	L	93	Very high	88.8	Confident	13 Å²	13	47.7 Å²	47.7	7%	0.068	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.2	-11.6	-179.7	-48.2	178.3	0	0	0	112.8	Y144 D154 F182 V193	Y144-L156 HydrophobicContact CD1-CD2 4.39Å; D154-L156 PolarHBondContact O-N 3.19Å; D154-L156 WeakPolarHBondContact OD1-CA 3.19Å; D154-L156 PolarHBondContact OD1-N 2.92Å; L156-F182 HydrophobicContact CB-CD2 4.04Å; L156-F182 HydrophobicContact CB-CE2 3.52Å; L156-F182 HydrophobicContact CB-CZ 4.37Å; L156-F182 HydrophobicContact CD1-CD2 3.71Å; L156-F182 HydrophobicContact CD1-CE2 4.1Å; L156-F182 HydrophobicContact CG-CE2 4.44Å; L156-V193 HydrophobicContact CD1-CG1 3.51Å; L156-V193 HydrophobicContact CD2-CG1 3.68Å; L156-V193 VanDerWaalsContact CD2-O 3.31Å; L156-V193 WeakPolarHBondContact CD2-O 3.41Å; L156-V193 HydrophobicContact CG-CG1 4.24Å
157	S	90.4	Very high	88.7	Confident	29 Å²	29	49.9 Å²	49.9	20%	0.203	24%	0.236	C	C	.	.	S	Bend	trans	-61.8	145.1	171.4	175.2	0	0	0	0	112	D154 D159 Q160	D154-S157 PolarHBondContact O-N 3.43Å; D154-S157 PolarHBondContact OD1-N 2.91Å; D154-S157 VanDerWaalsContact OD1-N 3.08Å; S157-D159 VanDerWaalsContact C-N 3.26Å; S157-D159 WeakPolarHBondContact CB-O 3.48Å; S157-D159 PolarHBondContact OG-N 3.24Å; S157-D159 PolarHBondContact OG-O 3.05Å; S157-Q160 PolarHBondContact O-NE2 2.71Å
158	K	86.6	Confident	88.5	Confident	218 Å²	218	54 Å²	54	95%	0.948	26%	0.256	S	S	*	.	S	Bend	trans	-68.7	-28.7	168.2	-64.2	-175.1	-179.4	-177.6	0	112.3
159	D	86.5	Confident	88.4	Confident	73 Å²	73	59.9 Å²	59.9	39%	0.39	28%	0.278	S	S	.	.			trans	-99.2	105	174.9	179.2	5.8	0	0	0	109.4	S157 T161 K162	S157-D159 VanDerWaalsContact C-N 3.26Å; S157-D159 WeakPolarHBondContact CB-O 3.48Å; S157-D159 PolarHBondContact OG-N 3.24Å; S157-D159 PolarHBondContact OG-O 3.05Å; D159-T161 VanDerWaalsContact C-N 3.33Å; D159-T161 WeakPolarHBondContact OD1-CA 3.17Å; D159-T161 WeakPolarHBondContact OD1-CB 3.23Å; D159-T161 PolarHBondContact OD1-N 2.75Å; D159-T161 PolarHBondContact OD1-OG1 3.04Å; D159-K162 PolarHBondContact OD1-N 2.83Å; D159-K162 VanDerWaalsContact OD1-N 3.15Å
160	Q	82.9	Confident	88.4	Confident	52 Å²	52	64.2 Å²	64.2	24%	0.243	31%	0.31	C	S	.	.	S	Bend	trans	-86.5	-2.9	175.4	-65.5	-63.6	-50.7	0	0	112.7	D154 S157 R163 N200	D154-Q160 PolarHBondContact O-NE2 2.95Å; D154-Q160 PolarHBondContact O-OE1 2.91Å; S157-Q160 PolarHBondContact O-NE2 2.71Å; Q160-R163 PolarHBondContact O-NH1 3.13Å; Q160-N200 HydrophobicContact CG-CB 4.33Å; Q160-N200 PolarHBondContact NE2-ND2 2.75Å
161	T	82.8	Confident	87.7	Confident	111 Å²	111	67 Å²	67	68%	0.681	33%	0.327	S	S	*	.	S	Bend	trans	-90.5	-25.6	176.7	74.2	0	0	0	0	112.6	D159 R163	D159-T161 VanDerWaalsContact C-N 3.33Å; D159-T161 WeakPolarHBondContact OD1-CA 3.17Å; D159-T161 WeakPolarHBondContact OD1-CB 3.23Å; D159-T161 PolarHBondContact OD1-N 2.75Å; D159-T161 PolarHBondContact OD1-OG1 3.04Å; T161-R163 PolarHBondContact O-NH1 2.99Å
162	K	86.8	Confident	87	Confident	82 Å²	82	67.2 Å²	67.2	36%	0.357	33%	0.333	S	S	.	.			trans	-55.5	142.8	171.1	-167.7	178.2	-179.4	-168.8	0	111	D159 L164 D178	D159-K162 PolarHBondContact OD1-N 2.83Å; D159-K162 VanDerWaalsContact OD1-N 3.15Å; K162-L164 HydrophobicContact CD-CD2 3.79Å; K162-L164 HydrophobicContact CG-CD2 4.09Å; K162-D178 IonicContact NZ-OD2 3.92Å; K162-D178 PolarHBondContact NZ-OD2 3.24Å
163	R	88.4	Confident	86.6	Confident	87 Å²	87	68.2 Å²	68.2	33%	0.328	34%	0.343	S	S	.	.			trans	-111.3	143	165.5	-56.9	-53.7	176.3	-110.4	-11.3	109.3	E151 I152 R153 Q160 T161	E151-R163 HydrophobicContact CB-CG 4.4Å; E151-R163 IonicContact OE1-NE 3.89Å; E151-R163 WeakPolarHBondContact OE2-CD 3.35Å; E151-R163 IonicContact OE2-CZ 3.8Å; E151-R163 IonicContact OE2-NE 2.9Å; E151-R163 PolarHBondContact OE2-NE 2.93Å; E151-R163 IonicContact OE2-NH2 2.63Å; I152-R163 WeakPolarHBondContact O-CA 3.4Å; R153-R163 VanDerWaalsContact NH2-NH2 3.13Å; Q160-R163 PolarHBondContact O-NH1 3.13Å; T161-R163 PolarHBondContact O-NH1 2.99Å
164	L	92.3	Very high	86.4	Confident	16 Å²	16	66.7 Å²	66.7	8%	0.084	34%	0.339	C	S	.	.	B	Isolated β-bridge	trans	-105.6	145.5	-179.7	-57.1	-170.7	0	0	0	111.4	I152 D154 K162 V176 D178 L179	I152-L164 HydrophobicContact CB-CB 4.28Å; I152-L164 HydrophobicContact CG2-CB 4.12Å; I152-L164 PolarHBondContact O-N 3.02Å; D154-L164 HydrophobicContact CB-CD1 3.86Å; K162-L164 HydrophobicContact CD-CD2 3.79Å; K162-L164 HydrophobicContact CG-CD2 4.09Å; L164-V176 HydrophobicContact CB-CG1 3.5Å; L164-V176 HydrophobicContact CD1-CG1 3.6Å; L164-V176 HydrophobicContact CG-CG1 4.21Å; L164-D178 HydrophobicContact CD2-CB 4.28Å; L164-L179 HydrophobicContact CD1-CB 4.07Å; L164-L179 HydrophobicContact CD1-CD1 4.11Å
165	E	90.1	Very high	86.2	Confident	77 Å²	77	69.2 Å²	69.2	36%	0.36	35%	0.348	S	S	.	.			trans	-94.9	147.9	179.2	-66.5	166.8	168.3	0	0	110.4	K167 K177	E165-K167 IonicContact OE2-NZ 2.89Å; E165-K177 PolarHBondContact O-N 2.86Å
166	L	91	Very high	86.3	Confident	5 Å²	5	69.9 Å²	69.9	3%	0.026	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	130.3	167.9	-72.6	-175.5	0	0	0	109.5	I152 V174 V176 K296 R299 L300	I152-L166 HydrophobicContact CD1-CD1 4.21Å; I152-L166 HydrophobicContact CD1-CD2 3.37Å; I152-L166 HydrophobicContact CD1-CG 3.54Å; L166-V174 HydrophobicContact CD2-CG1 4.39Å; L166-V176 HydrophobicContact CD2-CG2 3.78Å; L166-K296 HydrophobicContact CD1-CB 3.96Å; L166-K296 HydrophobicContact CD1-CD 3.73Å; L166-K296 HydrophobicContact CD1-CG 4.41Å; L166-K296 HydrophobicContact CG-CD 4.15Å; L166-R299 HydrophobicContact CD1-CB 3.71Å; L166-R299 HydrophobicContact CD1-CG 4.49Å; L166-L300 HydrophobicContact CD1-CG 4.31Å; L166-L300 HydrophobicContact CD2-CD1 4.11Å; L166-L300 HydrophobicContact CD2-CD2 3.67Å; L166-L300 HydrophobicContact CD2-CG 3.77Å
167	K	90.2	Very high	86.2	Confident	52 Å²	52	73 Å²	73	23%	0.226	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	158.5	170.8	-63.5	-163.8	178.2	-72.8	0	110	E165 Y175 K177 E609	E165-K167 IonicContact OE2-NZ 2.89Å; K167-Y175 HydrophobicContact CB-CE1 3.9Å; K167-Y175 HydrophobicContact CB-CE2 4.35Å; K167-Y175 PolarHBondContact N-O 2.72Å; K167-Y175 WeakPolarHBondContact O-CD1 3.33Å; K167-Y175 PolarHBondContact O-N 3.34Å; K167-Y175 VanDerWaalsContact O-O 3.06Å; K167-K177 HydrophobicContact CD-CB 4.4Å; K167-K177 HydrophobicContact CD-CD 4.01Å; K167-K177 HydrophobicContact CG-CB 4.42Å; K167-E609 IonicContact NZ-OE1 3.22Å; K167-E609 PolarHBondContact NZ-OE1 2.89Å
168	E	86.9	Confident	86.2	Confident	89 Å²	89	76.2 Å²	76.2	42%	0.416	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	134.8	-175.9	-172.2	172.3	175.6	0	0	107.2	G173 V174 R293 R299	E168-G173 WeakPolarHBondContact CA-O 3.35Å; E168-V174 HydrophobicContact CB-CG2 4.43Å; E168-V174 HydrophobicContact CG-CG2 4.01Å; E168-R293 IonicContact OE2-NH2 3.73Å; E168-R299 IonicContact OE2-NH2 2.85Å
169	R	83.9	Confident	86.5	Confident	133 Å²	133	67.9 Å²	67.9	50%	0.502	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	151.2	169.8	-70	169	177.2	-152	-1.5	110.1	D171 G173 Y175	R169-D171 WeakPolarHBondContact CB-OD1 3.31Å; R169-D171 PolarHBondContact O-N 3.32Å; R169-G173 PolarHBondContact N-O 2.82Å; R169-G173 VanDerWaalsContact O-CA 3.31Å; R169-G173 WeakPolarHBondContact O-CA 3.35Å; R169-G173 PolarHBondContact O-N 2.69Å; R169-Y175 HydrophobicContact CB-CE1 4.5Å; R169-Y175 HydrophobicContact CG-CE1 3.87Å; R169-Y175 PolarHBondContact NE-OH 2.92Å
170	P	79.3	Confident	86.8	Confident	146 Å²	146	65.9 Å²	65.9	95%	0.948	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-22.5	-179.2	-22.5	34.5	0	0	0	115.1
171	D	73.1	Confident	87.2	Confident	100 Å²	100	66.1 Å²	66.1	54%	0.535	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-58.4	179.7	45.6	12.9	0	0	0	111.9	R169	R169-D171 WeakPolarHBondContact CB-OD1 3.31Å; R169-D171 PolarHBondContact O-N 3.32Å
172	T	74.5	Confident	87.8	Confident	74 Å²	74	65.2 Å²	65.2	45%	0.454	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-19.4	-175	-37.5	0	0	0	0	113.8
173	G	82.2	Confident	88.1	Confident	22 Å²	22	63.4 Å²	63.4	23%	0.227	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	77.6	-146.9	-168.8	0	0	0	0	0	112.8	E168 R169	E168-G173 WeakPolarHBondContact CA-O 3.35Å; R169-G173 PolarHBondContact N-O 2.82Å; R169-G173 VanDerWaalsContact O-CA 3.31Å; R169-G173 WeakPolarHBondContact O-CA 3.35Å; R169-G173 PolarHBondContact O-N 2.69Å
174	V	88.3	Confident	88.3	Confident	11 Å²	11	59.3 Å²	59.3	7%	0.067	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	127	-178.9	-177.8	0	0	0	0	110.8	L166 E168 R299	L166-V174 HydrophobicContact CD2-CG1 4.39Å; E168-V174 HydrophobicContact CB-CG2 4.43Å; E168-V174 HydrophobicContact CG-CG2 4.01Å; V174-R299 HydrophobicContact CG1-CB 4.41Å
175	Y	89.9	Confident	88.1	Confident	64 Å²	64	61.8 Å²	61.8	25%	0.251	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	159	178.5	71.6	-79.5	0	0	0	112.4	K167 R169	K167-Y175 HydrophobicContact CB-CE1 3.9Å; K167-Y175 HydrophobicContact CB-CE2 4.35Å; K167-Y175 PolarHBondContact N-O 2.72Å; K167-Y175 WeakPolarHBondContact O-CD1 3.33Å; K167-Y175 PolarHBondContact O-N 3.34Å; K167-Y175 VanDerWaalsContact O-O 3.06Å; R169-Y175 HydrophobicContact CB-CE1 4.5Å; R169-Y175 HydrophobicContact CG-CE1 3.87Å; R169-Y175 PolarHBondContact NE-OH 2.92Å
176	V	92.6	Very high	88.1	Confident	14 Å²	14	60.1 Å²	60.1	9%	0.085	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	122	174.7	-173.3	0	0	0	0	108.5	L145 I152 L164 L166 L179 L300	L145-V176 HydrophobicContact CD2-CG2 3.96Å; I152-V176 HydrophobicContact CD1-CG2 4.23Å; I152-V176 HydrophobicContact CG2-CG1 3.97Å; L164-V176 HydrophobicContact CB-CG1 3.5Å; L164-V176 HydrophobicContact CD1-CG1 3.6Å; L164-V176 HydrophobicContact CG-CG1 4.21Å; L166-V176 HydrophobicContact CD2-CG2 3.78Å; V176-L179 HydrophobicContact CB-CB 3.89Å; V176-L179 HydrophobicContact CB-CD2 4.1Å; V176-L179 HydrophobicContact CG1-CB 3.98Å; V176-L179 HydrophobicContact CG2-CD2 4.35Å; V176-L300 HydrophobicContact CG2-CD1 4.37Å; V176-L300 HydrophobicContact CG2-CD2 3.75Å
177	K	91	Very high	88.1	Confident	79 Å²	79	61.6 Å²	61.6	34%	0.343	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	139.7	178.1	-177.3	-170.2	161.1	-156.6	0	110.3	E165 K167 L179	E165-K177 PolarHBondContact O-N 2.86Å; K167-K177 HydrophobicContact CD-CB 4.4Å; K167-K177 HydrophobicContact CD-CD 4.01Å; K167-K177 HydrophobicContact CG-CB 4.42Å; K177-L179 PolarHBondContact O-N 2.93Å
178	D	90.7	Very high	88.2	Confident	96 Å²	96	67.3 Å²	67.3	51%	0.513	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.4	19.8	-179.8	-48	-20.5	0	0	0	115.3	K162 L164 S180	K162-D178 IonicContact NZ-OD2 3.92Å; K162-D178 PolarHBondContact NZ-OD2 3.24Å; L164-D178 HydrophobicContact CD2-CB 4.28Å; D178-S180 PolarHBondContact O-N 2.94Å
179	L	92.6	Very high	88.5	Confident	42 Å²	42	66.7 Å²	66.7	22%	0.22	35%	0.35	C	S	.	.			trans	-66.8	124.4	173.3	177.9	65.8	0	0	0	109.9	L145 D154 L164 V176 K177	L145-L179 HydrophobicContact CB-CD1 4.04Å; L145-L179 HydrophobicContact CD2-CD1 4.25Å; L145-L179 HydrophobicContact CD2-CD2 3.77Å; D154-L179 HydrophobicContact CB-CD1 4.14Å; L164-L179 HydrophobicContact CD1-CB 4.07Å; L164-L179 HydrophobicContact CD1-CD1 4.11Å; V176-L179 HydrophobicContact CB-CB 3.89Å; V176-L179 HydrophobicContact CB-CD2 4.1Å; V176-L179 HydrophobicContact CG1-CB 3.98Å; V176-L179 HydrophobicContact CG2-CD2 4.35Å; K177-L179 PolarHBondContact O-N 2.93Å
180	S	93.4	Very high	89	Confident	31 Å²	31	60.4 Å²	60.4	22%	0.217	33%	0.326	C	S	.	.			trans	-68.6	146.9	178.3	69.3	0	0	0	0	111.5	S143 D154 D178	S143-S180 WeakPolarHBondContact CB-O 3.39Å; S143-S180 PolarHBondContact OG-O 3.4Å; D154-S180 VanDerWaalsContact CG-OG 3.24Å; D154-S180 PolarHBondContact OD1-OG 3.45Å; D154-S180 VanDerWaalsContact OD1-OG 3.06Å; D154-S180 WeakPolarHBondContact OD2-CB 3.44Å; D154-S180 PolarHBondContact OD2-N 2.87Å; D154-S180 PolarHBondContact OD2-OG 2.85Å; D178-S180 PolarHBondContact O-N 2.94Å
181	S	92.2	Very high	89.6	Confident	57 Å²	57	56.9 Å²	56.9	40%	0.399	30%	0.297	S	S	.	.			trans	-139.3	129.8	177.7	-151	0	0	0	0	110	R141 A142 S143	R141-S181 WeakPolarHBondContact CD-OG 3.39Å; A142-S181 WeakPolarHBondContact O-CA 3.49Å; S143-S181 WeakPolarHBondContact OG-CA 3.26Å; S143-S181 VanDerWaalsContact OG-CB 3.23Å; S143-S181 WeakPolarHBondContact OG-CB 3.18Å; S143-S181 PolarHBondContact OG-OG 3.3Å
182	F	93.8	Very high	90.6	Very high	93 Å²	93	57.8 Å²	57.8	41%	0.408	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	124.2	-174.9	-72.9	-101.1	0	0	0	109.2	R141 A142 L156 V193	R141-F182 CarbonylContact C-O 3.58Å; R141-F182 VanDerWaalsContact CA-O 3.27Å; R141-F182 WeakPolarHBondContact CA-O 3.23Å; A142-F182 PolarHBondContact N-O 3.09Å; A142-F182 PolarHBondContact O-N 2.98Å; L156-F182 HydrophobicContact CB-CD2 4.04Å; L156-F182 HydrophobicContact CB-CE2 3.52Å; L156-F182 HydrophobicContact CB-CZ 4.37Å; L156-F182 HydrophobicContact CD1-CD2 3.71Å; L156-F182 HydrophobicContact CD1-CE2 4.1Å; L156-F182 HydrophobicContact CG-CE2 4.44Å; F182-V193 HydrophobicContact CB-CG2 3.98Å; F182-V193 HydrophobicContact CG-CG2 4.4Å
183	V	93.4	Very high	91.5	Very high	43 Å²	43	55 Å²	55	26%	0.261	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	126.5	172.9	178.4	0	0	0	0	108.7	L139 V140 K473	L139-V183 HydrophobicContact CD1-CG1 3.61Å; L139-V183 HydrophobicContact CD1-CG2 4.22Å; V140-V183 WeakPolarHBondContact O-CA 3.36Å; V183-K473 HydrophobicContact CG1-CB 4.1Å; V183-K473 HydrophobicContact CG1-CG 4.34Å
184	T	92.6	Very high	92	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.006	27%	0.271	C	S	.	.			trans	-121.5	127	-174.2	53.7	0	0	0	0	110.5	F127 V140 A142 E189 I190 V193	F127-T184 WeakPolarHBondContact CZ-O 3.48Å; V140-T184 PolarHBondContact O-N 3.02Å; V140-T184 PolarHBondContact O-OG1 3.3Å; A142-T184 HydrophobicContact CB-CG2 4.27Å; T184-E189 HydrophobicContact CG2-CB 4.43Å; T184-I190 HydrophobicContact CG2-CB 3.85Å; T184-I190 HydrophobicContact CG2-CG1 4.21Å; T184-V193 HydrophobicContact CG2-CG2 4.04Å
185	K	88.5	Confident	92.2	Very high	68 Å²	68	56.1 Å²	56.1	30%	0.296	28%	0.281	S	S	.	.			trans	-102.9	-15	-172.8	-52.9	169.9	-178.3	-158.5	0	113.8	F127 E189 S472 L475	F127-K185 WeakPolarHBondContact CE1-O 3.47Å; K185-E189 WeakPolarHBondContact CB-OE2 3.36Å; K185-E189 WeakPolarHBondContact CG-OE2 3.38Å; K185-E189 PolarHBondContact N-OE2 3.32Å; K185-S472 WeakPolarHBondContact CD-O 3.45Å; K185-S472 WeakPolarHBondContact CE-O 3.16Å; K185-S472 PolarHBondContact NZ-O 2.86Å; K185-S472 PolarHBondContact NZ-OG 2.9Å; K185-L475 HydrophobicContact CB-CD2 4.15Å; K185-L475 WeakPolarHBondContact O-CD2 3.27Å
186	S	89.5	Confident	92.3	Very high	43 Å²	43	55.3 Å²	55.3	30%	0.301	28%	0.283	S	S	.	.	S	Bend	trans	-150.2	162.4	-178.7	68.8	0	0	0	0	111.6	K188 E189 I190	S186-K188 PolarHBondContact O-N 2.94Å; S186-E189 PolarHBondContact O-N 2.88Å; S186-E189 PolarHBondContact OG-N 2.87Å; S186-I190 PolarHBondContact O-N 3.43Å
187	V	91.7	Very high	92.2	Very high	36 Å²	36	54.6 Å²	54.6	22%	0.218	28%	0.279	C	S	.	.	H	α-helix	trans	-50.9	-42.7	173.6	-176.6	0	0	0	0	111.2	F123 F127 E189 I190 E191	F123-V187 HydrophobicContact CB-CG1 4.2Å; F127-V187 HydrophobicContact CB-CG2 3.75Å; F127-V187 HydrophobicContact CD2-CB 4.49Å; F127-V187 HydrophobicContact CD2-CG2 3.83Å; F127-V187 HydrophobicContact CG-CG2 4.07Å; V187-E189 VanDerWaalsContact C-N 3.34Å; V187-E189 PolarHBondContact O-N 3Å; V187-I190 WeakPolarHBondContact O-CG2 3.36Å; V187-I190 PolarHBondContact O-N 2.95Å; V187-E191 HydrophobicContact CG1-CG 4.26Å; V187-E191 WeakPolarHBondContact O-CB 3.38Å; V187-E191 VanDerWaalsContact O-CG 3.31Å; V187-E191 WeakPolarHBondContact O-CG 3.44Å; V187-E191 PolarHBondContact O-N 3.32Å
188	K	91.7	Very high	92	Very high	171 Å²	171	51.8 Å²	51.8	74%	0.743	27%	0.267	S	S	*	.	H	α-helix	trans	-63.7	-35	179.6	-65.3	-177	179.4	179	0	113.4	S186 H192	S186-K188 PolarHBondContact O-N 2.94Å; K188-H192 WeakPolarHBondContact O-CB 3.44Å; K188-H192 PolarHBondContact O-N 3.06Å
189	E	93.4	Very high	91.8	Very high	76 Å²	76	53.3 Å²	53.3	36%	0.355	27%	0.271	S	S	.	.	H	α-helix	trans	-71.7	-43.8	178.1	-73.1	177.5	-159.5	0	0	111.5	T184 K185 S186 V187 H192 V193	T184-E189 HydrophobicContact CG2-CB 4.43Å; K185-E189 WeakPolarHBondContact CB-OE2 3.36Å; K185-E189 WeakPolarHBondContact CG-OE2 3.38Å; K185-E189 PolarHBondContact N-OE2 3.32Å; S186-E189 PolarHBondContact O-N 2.88Å; S186-E189 PolarHBondContact OG-N 2.87Å; V187-E189 VanDerWaalsContact C-N 3.34Å; V187-E189 PolarHBondContact O-N 3Å; E189-H192 WeakPolarHBondContact O-CB 2.97Å; E189-H192 PolarHBondContact O-N 3.07Å; E189-V193 WeakPolarHBondContact O-CG2 3.49Å; E189-V193 PolarHBondContact O-N 3.26Å
190	I	94	Very high	91.6	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-71.5	-33.4	178.4	-165.2	163.3	0	0	0	112.3	F123 F127 A142 T184 S186 V187 H192 V193 M194 F219 I221	F123-I190 HydrophobicContact CB-CG2 3.72Å; F123-I190 HydrophobicContact CD1-CD1 3.65Å; F123-I190 HydrophobicContact CD1-CG1 3.94Å; F123-I190 HydrophobicContact CD1-CG2 3.92Å; F123-I190 HydrophobicContact CD2-CG1 4.45Å; F123-I190 HydrophobicContact CD2-CG2 3.6Å; F123-I190 HydrophobicContact CE1-CD1 3.62Å; F123-I190 HydrophobicContact CE1-CG1 3.69Å; F123-I190 HydrophobicContact CE1-CG2 4.41Å; F123-I190 HydrophobicContact CE2-CG1 4.22Å; F123-I190 HydrophobicContact CE2-CG2 4.12Å; F123-I190 HydrophobicContact CG-CD1 4.36Å; F123-I190 HydrophobicContact CG-CG1 4.32Å; F123-I190 HydrophobicContact CG-CG2 3.48Å; F123-I190 VanDerWaalsContact CG-CG2 3.48Å; F123-I190 HydrophobicContact CZ-CD1 4.28Å; F123-I190 HydrophobicContact CZ-CG1 3.83Å; F123-I190 HydrophobicContact CZ-CG2 4.48Å; F127-I190 HydrophobicContact CD2-CG2 4.39Å; F127-I190 HydrophobicContact CE2-CB 4.27Å; F127-I190 HydrophobicContact CE2-CG2 3.67Å; A142-I190 HydrophobicContact CB-CD1 4.03Å; A142-I190 HydrophobicContact CB-CG1 4.04Å; T184-I190 HydrophobicContact CG2-CB 3.85Å; T184-I190 HydrophobicContact CG2-CG1 4.21Å; S186-I190 PolarHBondContact O-N 3.43Å; V187-I190 WeakPolarHBondContact O-CG2 3.36Å; V187-I190 PolarHBondContact O-N 2.95Å; I190-H192 VanDerWaalsContact C-N 3.34Å; I190-V193 PolarHBondContact O-N 2.86Å; I190-M194 PolarHBondContact O-N 2.9Å; I190-F219 HydrophobicContact CD1-CE1 4.18Å; I190-F219 HydrophobicContact CD1-CZ 4.46Å; I190-F219 HydrophobicContact CG1-CE1 4.16Å; I190-F219 HydrophobicContact CG1-CZ 3.96Å; I190-I221 HydrophobicContact CD1-CD1 4.16Å; I190-I221 HydrophobicContact CD1-CG1 4.35Å; I190-I221 HydrophobicContact CD1-CG2 4.35Å
191	E	92.8	Very high	91.1	Very high	73 Å²	73	52.8 Å²	52.8	34%	0.341	27%	0.265	S	S	.	.	H	α-helix	trans	-62.6	-40	168.3	-76.4	-179.1	165.4	0	0	111.5	F123 V187 M194 N195	F123-E191 HydrophobicContact CD2-CG 3.91Å; F123-E191 HydrophobicContact CE2-CG 4.25Å; V187-E191 HydrophobicContact CG1-CG 4.26Å; V187-E191 WeakPolarHBondContact O-CB 3.38Å; V187-E191 VanDerWaalsContact O-CG 3.31Å; V187-E191 WeakPolarHBondContact O-CG 3.44Å; V187-E191 PolarHBondContact O-N 3.32Å; E191-M194 PolarHBondContact O-N 3.26Å; E191-N195 WeakPolarHBondContact O-CB 3.34Å; E191-N195 PolarHBondContact O-N 2.95Å; E191-N195 PolarHBondContact O-ND2 3.49Å; E191-N195 VanDerWaalsContact O-ND2 3.11Å; E191-N195 PolarHBondContact O-OD1 2.85Å
192	H	93.2	Very high	90	Very high	119 Å²	119	52.9 Å²	52.9	55%	0.551	27%	0.265	S	S	*	.	H	α-helix	trans	-62.9	-42.7	174.4	-173.8	75.6	0	0	0	111.9	K188 E189 I190 M194 N195 V196	K188-H192 WeakPolarHBondContact O-CB 3.44Å; K188-H192 PolarHBondContact O-N 3.06Å; E189-H192 WeakPolarHBondContact O-CB 2.97Å; E189-H192 PolarHBondContact O-N 3.07Å; I190-H192 VanDerWaalsContact C-N 3.34Å; H192-M194 PolarHBondContact O-N 3.16Å; H192-N195 WeakPolarHBondContact O-CB 3.23Å; H192-N195 PolarHBondContact O-N 2.91Å; H192-V196 WeakPolarHBondContact O-CG2 3.44Å; H192-V196 PolarHBondContact O-N 3.42Å
193	V	94.2	Very high	88.7	Confident	15 Å²	15	52.1 Å²	52.1	9%	0.091	27%	0.268	C	S	.	.	H	α-helix	trans	-58	-46.3	173.1	171.6	0	0	0	0	111.3	A142 L156 F182 T184 E189 I190 N195 V196 G197 F219	A142-V193 HydrophobicContact CB-CG1 4.07Å; L156-V193 HydrophobicContact CD1-CG1 3.51Å; L156-V193 HydrophobicContact CD2-CG1 3.68Å; L156-V193 VanDerWaalsContact CD2-O 3.31Å; L156-V193 WeakPolarHBondContact CD2-O 3.41Å; L156-V193 HydrophobicContact CG-CG1 4.24Å; F182-V193 HydrophobicContact CB-CG2 3.98Å; F182-V193 HydrophobicContact CG-CG2 4.4Å; T184-V193 HydrophobicContact CG2-CG2 4.04Å; E189-V193 WeakPolarHBondContact O-CG2 3.49Å; E189-V193 PolarHBondContact O-N 3.26Å; I190-V193 PolarHBondContact O-N 2.86Å; V193-N195 PolarHBondContact O-N 3.05Å; V193-V196 PolarHBondContact O-N 3.49Å; V193-G197 PolarHBondContact O-N 3.24Å; V193-G197 VanDerWaalsContact O-N 3.11Å; V193-F219 HydrophobicContact CG1-CE2 4.36Å; V193-F219 HydrophobicContact CG1-CZ 4.36Å
194	M	92.3	Very high	87	Confident	3 Å²	3	51.4 Å²	51.4	2%	0.015	27%	0.27	C	S	.	.	H	α-helix	trans	-61.2	-42.2	175.2	-172	-176.2	-174.8	0	0	112.2	E107 I119 F123 I190 E191 H192 G197 N198 F219	E107-M194 HydrophobicContact CB-CE 3.75Å; E107-M194 HydrophobicContact CG-CE 3.59Å; I119-M194 HydrophobicContact CB-CE 4.14Å; I119-M194 HydrophobicContact CB-SD 4.49Å; I119-M194 HydrophobicContact CD1-CE 3.98Å; I119-M194 HydrophobicContact CG2-CE 3.77Å; I119-M194 HydrophobicContact CG2-SD 3.63Å; F123-M194 HydrophobicContact CE2-CB 4.31Å; F123-M194 HydrophobicContact CE2-SD 3.94Å; F123-M194 HydrophobicContact CZ-CB 4.38Å; F123-M194 HydrophobicContact CZ-SD 4.14Å; I190-M194 PolarHBondContact O-N 2.9Å; E191-M194 PolarHBondContact O-N 3.26Å; H192-M194 PolarHBondContact O-N 3.16Å; M194-G197 PolarHBondContact O-N 3.01Å; M194-N198 WeakPolarHBondContact O-CB 3.27Å; M194-N198 PolarHBondContact O-N 3.19Å; M194-F219 HydrophobicContact CB-CE2 3.94Å; M194-F219 HydrophobicContact CB-CZ 4.43Å; M194-F219 HydrophobicContact CG-CE2 4.3Å
195	N	91.6	Very high	85.3	Confident	54 Å²	54	52.8 Å²	52.8	29%	0.289	28%	0.281	S	S	.	.	H	α-helix	trans	-63.4	-43.4	179.2	-67.7	-27	0	0	0	112.1	R110 E191 H192 V193 N198 Q199	R110-N195 WeakPolarHBondContact CD-OD1 3.36Å; R110-N195 PolarHBondContact NH1-OD1 3.47Å; E191-N195 WeakPolarHBondContact O-CB 3.34Å; E191-N195 PolarHBondContact O-N 2.95Å; E191-N195 PolarHBondContact O-ND2 3.49Å; E191-N195 VanDerWaalsContact O-ND2 3.11Å; E191-N195 PolarHBondContact O-OD1 2.85Å; H192-N195 WeakPolarHBondContact O-CB 3.23Å; H192-N195 PolarHBondContact O-N 2.91Å; V193-N195 PolarHBondContact O-N 3.05Å; N195-N198 PolarHBondContact O-N 3.14Å; N195-Q199 WeakPolarHBondContact O-CB 3Å; N195-Q199 PolarHBondContact O-N 2.79Å
196	V	92.2	Very high	83.5	Confident	46 Å²	46	55 Å²	55	28%	0.279	30%	0.3	S	S	.	.	H	α-helix	trans	-61.8	-47.2	175.9	170.4	0	0	0	0	110.7	H192 V193 N198 Q199 N200	H192-V196 WeakPolarHBondContact O-CG2 3.44Å; H192-V196 PolarHBondContact O-N 3.42Å; V193-V196 PolarHBondContact O-N 3.49Å; V196-N198 PolarHBondContact O-N 3.42Å; V196-Q199 WeakPolarHBondContact O-CB 3.33Å; V196-Q199 PolarHBondContact O-N 3.37Å; V196-N200 PolarHBondContact O-N 2.82Å
197	G	90.9	Very high	81.6	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-65.3	-39.2	178.7	0	0	0	0	0	113.7	L155 V193 M194 Q199 N200 R201	L155-G197 WeakPolarHBondContact O-CA 3.45Å; V193-G197 PolarHBondContact O-N 3.24Å; V193-G197 VanDerWaalsContact O-N 3.11Å; M194-G197 PolarHBondContact O-N 3.01Å; G197-Q199 VanDerWaalsContact C-N 3.33Å; G197-Q199 PolarHBondContact O-N 3.47Å; G197-N200 PolarHBondContact O-N 3.44Å; G197-R201 WeakPolarHBondContact O-CB 3.35Å; G197-R201 PolarHBondContact O-N 2.93Å
198	N	87.5	Confident	79.2	Confident	20 Å²	20	62.3 Å²	62.3	11%	0.107	33%	0.333	C	S	.	.	H	α-helix	trans	-66.4	-34.3	173.9	-80.8	-1.7	0	0	0	112.5	E107 Y144 M194 N195 V196 S202	E107-N198 PolarHBondContact OE1-ND2 3.34Å; E107-N198 PolarHBondContact OE2-ND2 3.39Å; Y144-N198 WeakPolarHBondContact CE1-OD1 3.47Å; Y144-N198 PolarHBondContact OH-OD1 2.97Å; M194-N198 WeakPolarHBondContact O-CB 3.27Å; M194-N198 PolarHBondContact O-N 3.19Å; N195-N198 PolarHBondContact O-N 3.14Å; V196-N198 PolarHBondContact O-N 3.42Å; N198-S202 WeakPolarHBondContact O-CB 3.39Å; N198-S202 PolarHBondContact O-N 3.14Å; N198-S202 PolarHBondContact O-OG 2.9Å
199	Q	87	Confident	77	Confident	127 Å²	127	59.2 Å²	59.2	59%	0.593	33%	0.325	S	S	*	.	H	α-helix	trans	-63.9	-49.2	172.2	-177	175.2	-3.4	0	0	110.5	N195 V196 G197 R201 S202 V203	N195-Q199 WeakPolarHBondContact O-CB 3Å; N195-Q199 PolarHBondContact O-N 2.79Å; V196-Q199 WeakPolarHBondContact O-CB 3.33Å; V196-Q199 PolarHBondContact O-N 3.37Å; G197-Q199 VanDerWaalsContact C-N 3.33Å; G197-Q199 PolarHBondContact O-N 3.47Å; Q199-R201 VanDerWaalsContact C-N 3.34Å; Q199-R201 PolarHBondContact O-N 2.63Å; Q199-S202 PolarHBondContact O-N 2.97Å; Q199-S202 VanDerWaalsContact O-N 3.08Å; Q199-S202 PolarHBondContact O-OG 2.76Å; Q199-V203 PolarHBondContact O-N 2.9Å
200	N	87.1	Confident	75.4	Confident	44 Å²	44	62.2 Å²	62.2	24%	0.235	34%	0.339	C	S	.	.	H	α-helix	trans	-60.2	-42.1	177.4	-72.7	-21.3	0	0	0	112.3	L155 Q160 V196 G197 S202 V203 G204	L155-N200 PolarHBondContact O-ND2 3.48Å; Q160-N200 HydrophobicContact CG-CB 4.33Å; Q160-N200 PolarHBondContact NE2-ND2 2.75Å; V196-N200 PolarHBondContact O-N 2.82Å; G197-N200 PolarHBondContact O-N 3.44Å; N200-S202 VanDerWaalsContact C-N 3.32Å; N200-S202 PolarHBondContact O-N 3.38Å; N200-V203 PolarHBondContact O-N 2.87Å; N200-G204 PolarHBondContact O-N 2.87Å
201	R	83.5	Confident	73.9	Confident	19 Å²	19	62.4 Å²	62.4	7%	0.072	34%	0.34	C	S	.	.	H	α-helix	trans	-57.8	-41.5	172.1	-165	173.9	-172.6	-151.4	-3.6	112.4	E146 L155 G197 Q199 G204 A205 S212 S215 D245	E146-R201 WeakPolarHBondContact OE1-CD 3.5Å; E146-R201 VanDerWaalsContact OE1-CG 3.28Å; E146-R201 WeakPolarHBondContact OE1-CG 3.45Å; E146-R201 IonicContact OE1-CZ 3.72Å; E146-R201 IonicContact OE1-NE 2.81Å; E146-R201 PolarHBondContact OE1-NE 3.29Å; E146-R201 IonicContact OE1-NH2 3.43Å; L155-R201 HydrophobicContact CD1-CB 4.37Å; L155-R201 HydrophobicContact CD2-CB 4.07Å; G197-R201 WeakPolarHBondContact O-CB 3.35Å; G197-R201 PolarHBondContact O-N 2.93Å; Q199-R201 VanDerWaalsContact C-N 3.34Å; Q199-R201 PolarHBondContact O-N 2.63Å; R201-G204 PolarHBondContact O-N 2.88Å; R201-A205 PolarHBondContact O-N 2.84Å; R201-S212 PolarHBondContact NH2-O 2.8Å; R201-S215 PolarHBondContact NH2-O 2.81Å; R201-S215 VanDerWaalsContact NH2-O 3.13Å; R201-S215 PolarHBondContact NH2-OG 2.86Å; R201-D245 IonicContact NH1-OD2 2.76Å
202	S	69.4	Low	72.6	Confident	58 Å²	58	61.8 Å²	61.8	41%	0.406	34%	0.343	S	S	.	.	H	α-helix	trans	-69.5	-32.5	178.2	74.3	0	0	0	0	114	N198 Q199 N200 G204 A205 T206	N198-S202 WeakPolarHBondContact O-CB 3.39Å; N198-S202 PolarHBondContact O-N 3.14Å; N198-S202 PolarHBondContact O-OG 2.9Å; Q199-S202 PolarHBondContact O-N 2.97Å; Q199-S202 VanDerWaalsContact O-N 3.08Å; Q199-S202 PolarHBondContact O-OG 2.76Å; N200-S202 VanDerWaalsContact C-N 3.32Å; N200-S202 PolarHBondContact O-N 3.38Å; S202-G204 VanDerWaalsContact C-N 3.3Å; S202-G204 PolarHBondContact O-N 3.29Å; S202-A205 CarbonylContact O-C 3.26Å; S202-A205 WeakPolarHBondContact O-CA 3.38Å; S202-A205 WeakPolarHBondContact O-CB 3.4Å; S202-A205 PolarHBondContact O-N 3.49Å; S202-T206 PolarHBondContact O-N 2.86Å; S202-T206 PolarHBondContact O-OG1 2.81Å
203	V	65.8	Low	71.5	Confident	78 Å²	78	57 Å²	57	47%	0.473	32%	0.323	S	S	.	.	H	α-helix	trans	-65.3	-36.4	175.1	172.1	0	0	0	0	110.7	Q199 N200 T206	Q199-V203 PolarHBondContact O-N 2.9Å; N200-V203 PolarHBondContact O-N 2.87Å; V203-T206 WeakPolarHBondContact CA-OG1 3.3Å; V203-T206 PolarHBondContact O-N 3.17Å; V203-T206 PolarHBondContact O-OG1 2.95Å
204	G	58	Low	70.6	Confident	28 Å²	28	58.1 Å²	58.1	29%	0.289	33%	0.326	S	S	.	.	H	α-helix	trans	-58.2	-47.1	166.9	0	0	0	0	0	112.4	N200 R201 S202 T206 N207 M208	N200-G204 PolarHBondContact O-N 2.87Å; R201-G204 PolarHBondContact O-N 2.88Å; S202-G204 VanDerWaalsContact C-N 3.3Å; S202-G204 PolarHBondContact O-N 3.29Å; G204-T206 VanDerWaalsContact C-N 3.34Å; G204-T206 PolarHBondContact O-N 2.93Å; G204-N207 PolarHBondContact O-N 2.81Å; G204-M208 PolarHBondContact O-N 2.75Å
205	A	57.1	Low	70.2	Confident	30 Å²	30	58 Å²	58	25%	0.248	33%	0.325	C	S	.	.	H	α-helix	trans	-66	-27.3	179.8	0	0	0	0	0	114.8	R201 S202 N207 M208 H211	R201-A205 PolarHBondContact O-N 2.84Å; S202-A205 CarbonylContact O-C 3.26Å; S202-A205 WeakPolarHBondContact O-CA 3.38Å; S202-A205 WeakPolarHBondContact O-CB 3.4Å; S202-A205 PolarHBondContact O-N 3.49Å; A205-N207 VanDerWaalsContact C-N 3.34Å; A205-M208 CarbonylContact C-O 3.53Å; A205-M208 CarbonylContact O-C 3.58Å; A205-H211 HydrophobicContact CB-CB 3.73Å
206	T	50.1	Low	70.2	Confident	113 Å²	113	55.7 Å²	55.7	69%	0.693	31%	0.312	S	S	*	.	H	α-helix	trans	-72.8	-24.8	176.4	43.4	0	0	0	0	113.7	S202 V203 G204	S202-T206 PolarHBondContact O-N 2.86Å; S202-T206 PolarHBondContact O-OG1 2.81Å; V203-T206 WeakPolarHBondContact CA-OG1 3.3Å; V203-T206 PolarHBondContact O-N 3.17Å; V203-T206 PolarHBondContact O-OG1 2.95Å; G204-T206 VanDerWaalsContact C-N 3.34Å; G204-T206 PolarHBondContact O-N 2.93Å
207	N	49.1	Very low	70.2	Confident	142 Å²	142	53.6 Å²	53.6	76%	0.759	30%	0.3	S	S	*	.	H	α-helix	trans	-86.1	-23	176.6	-79.4	-11.6	0	0	0	113.1	G204 A205	G204-N207 PolarHBondContact O-N 2.81Å; A205-N207 VanDerWaalsContact C-N 3.34Å
208	M	42.6	Very low	70.4	Confident	92 Å²	92	53.9 Å²	53.9	45%	0.453	30%	0.302	S	S	.	.	S	Bend	trans	-144.9	121.6	175.5	-70.3	-174	173.9	0	0	111.2	G204 A205 E210	G204-M208 PolarHBondContact O-N 2.75Å; A205-M208 CarbonylContact C-O 3.53Å; A205-M208 CarbonylContact O-C 3.58Å; M208-E210 PolarHBondContact O-N 3.26Å
209	N	46.1	Very low	70.8	Confident	106 Å²	106	53 Å²	53	57%	0.567	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-40.9	132.7	-175.4	-68.7	17.6	0	0	0	115	H211 R261	N209-H211 PolarHBondContact O-N 3.36Å; N209-R261 VanDerWaalsContact CG-NH2 3.32Å; N209-R261 PolarHBondContact ND2-NH2 2.8Å; N209-R261 VanDerWaalsContact ND2-NH2 3.17Å
210	E	59.4	Low	71.2	Confident	139 Å²	139	47.6 Å²	47.6	65%	0.65	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	38.2	162.1	-148.1	166.6	-151.3	0	0	115.3	M208 S212 S213	M208-E210 PolarHBondContact O-N 3.26Å; E210-S212 VanDerWaalsContact C-N 3.27Å; E210-S212 PolarHBondContact O-N 3.32Å; E210-S213 PolarHBondContact O-N 2.82Å; E210-S213 PolarHBondContact O-OG 2.81Å
211	H	61.6	Low	71.7	Confident	5 Å²	5	45.5 Å²	45.5	2%	0.023	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-57.3	-29.4	-178.1	-167.2	71.8	0	0	0	115.5	E146 Y148 A205 N209 S213 R214 S215	E146-H211 IonicContact OE1-CD2 2.72Å; E146-H211 IonicContact OE1-NE2 3.4Å; E146-H211 IonicContact OE2-NE2 2.73Å; Y148-H211 AromaticContact CD1-CE1 3.65Å; Y148-H211 AromaticContact CD2-CE1 3.19Å; Y148-H211 WeakPolarHBondContact CD2-CE1 3.47Å; Y148-H211 AromaticContact CD2-ND1 3.77Å; Y148-H211 AromaticContact CE1-CE1 3.69Å; Y148-H211 AromaticContact CE2-CE1 3.25Å; Y148-H211 WeakPolarHBondContact CE2-CE1 3.44Å; Y148-H211 AromaticContact CE2-ND1 3.44Å; Y148-H211 WeakPolarHBondContact CE2-ND1 3.43Å; Y148-H211 AromaticContact CG-CE1 3.38Å; Y148-H211 AromaticContact CZ-CE1 3.48Å; Y148-H211 VanDerWaalsContact CZ-CE1 3.48Å; Y148-H211 AromaticContact CZ-ND1 3.74Å; A205-H211 HydrophobicContact CB-CB 3.73Å; N209-H211 PolarHBondContact O-N 3.36Å; H211-S213 VanDerWaalsContact C-N 3.26Å; H211-S213 PolarHBondContact O-N 2.88Å; H211-R214 CarbonylContact O-C 3.58Å; H211-R214 WeakPolarHBondContact O-CA 3.41Å; H211-R214 WeakPolarHBondContact O-CB 3.42Å; H211-R214 PolarHBondContact O-N 3.27Å; H211-S215 PolarHBondContact O-N 2.78Å; H211-S215 PolarHBondContact O-OG 2.89Å
212	S	66	Low	72.2	Confident	60 Å²	60	45.2 Å²	45.2	42%	0.42	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-68.5	-20.2	-175.4	56.3	0	0	0	0	114.7	R201 E210 R214	R201-S212 PolarHBondContact NH2-O 2.8Å; E210-S212 VanDerWaalsContact C-N 3.27Å; E210-S212 PolarHBondContact O-N 3.32Å; S212-R214 VanDerWaalsContact C-N 3.3Å
213	S	69.5	Low	73.3	Confident	17 Å²	17	42.6 Å²	42.6	12%	0.119	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-83.2	-9.5	169.9	56.8	0	0	0	0	113.1	T98 E210 H211 A247 G248	T98-S213 WeakPolarHBondContact OG1-CB 3.3Å; E210-S213 PolarHBondContact O-N 2.82Å; E210-S213 PolarHBondContact O-OG 2.81Å; H211-S213 VanDerWaalsContact C-N 3.26Å; H211-S213 PolarHBondContact O-N 2.88Å; S213-A247 CarbonylContact O-C 3.58Å; S213-A247 WeakPolarHBondContact O-CA 3.33Å; S213-A247 WeakPolarHBondContact O-CB 3.4Å; S213-G248 PolarHBondContact O-N 3.25Å
214	R	75	Confident	74.5	Confident	39 Å²	39	38.9 Å²	38.9	15%	0.147	22%	0.221	C	C	.	.	S	Bend	trans	-118	7.3	-164.9	-70.4	-166.4	177.6	178.8	-18.3	114.3	Y148 H211 S212 E264 I268	Y148-R214 WeakPolarHBondContact CD2-O 3.37Å; H211-R214 CarbonylContact O-C 3.58Å; H211-R214 WeakPolarHBondContact O-CA 3.41Å; H211-R214 WeakPolarHBondContact O-CB 3.42Å; H211-R214 PolarHBondContact O-N 3.27Å; S212-R214 VanDerWaalsContact C-N 3.3Å; R214-E264 VanDerWaalsContact CD-CD 3.48Å; R214-E264 WeakPolarHBondContact CD-OE1 3.49Å; R214-E264 IonicContact CZ-OE2 3.84Å; R214-E264 IonicContact NE-OE1 2.6Å; R214-E264 VanDerWaalsContact NH1-CD 3.32Å; R214-E264 IonicContact NH1-OE1 3.26Å; R214-E264 PolarHBondContact NH1-OE1 3.46Å; R214-E264 IonicContact NH1-OE2 3.91Å; R214-E264 PolarHBondContact NH1-OE2 3.07Å; R214-I268 HydrophobicContact CB-CD1 3.48Å; R214-I268 VanDerWaalsContact CB-CD1 3.48Å; R214-I268 HydrophobicContact CG-CD1 3.76Å; R214-I268 VanDerWaalsContact O-CD1 3.25Å; R214-I268 WeakPolarHBondContact O-CD1 3.43Å; R214-I268 VanDerWaalsContact O-CG1 3.28Å; R214-I268 WeakPolarHBondContact O-CG1 3.43Å
215	S	85.6	Confident	76	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.007	21%	0.208	C	C	.	.	S	Bend	trans	-140.2	148.9	178.6	64.2	0	0	0	0	110.6	E146 I147 R201 H211	E146-S215 VanDerWaalsContact OE1-CB 3.22Å; E146-S215 WeakPolarHBondContact OE1-CB 3.41Å; E146-S215 PolarHBondContact OE1-OG 3.44Å; I147-S215 WeakPolarHBondContact O-CA 3.44Å; R201-S215 PolarHBondContact NH2-O 2.81Å; R201-S215 VanDerWaalsContact NH2-O 3.13Å; R201-S215 PolarHBondContact NH2-OG 2.86Å; H211-S215 PolarHBondContact O-N 2.78Å; H211-S215 PolarHBondContact O-OG 2.89Å
216	H	90.2	Very high	77.4	Confident	5 Å²	5	36.5 Å²	36.5	2%	0.023	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	121.9	173.9	-48.6	-75.8	0	0	0	108.7	E146 I147 D245 L246 A247 S271 L297	E146-H216 CarbonylContact C-O 3.6Å; E146-H216 WeakPolarHBondContact CA-O 3.15Å; I147-H216 HydrophobicContact CB-CB 4.25Å; I147-H216 PolarHBondContact N-O 2.93Å; I147-H216 PolarHBondContact O-N 3.21Å; H216-D245 WeakPolarHBondContact CA-O 3.43Å; H216-L246 HydrophobicContact CB-CD2 4.32Å; H216-L246 WeakPolarHBondContact ND1-CA 3.38Å; H216-L246 WeakPolarHBondContact ND1-CD2 3.31Å; H216-A247 VanDerWaalsContact CE1-CB 3.49Å; H216-A247 WeakPolarHBondContact CE1-CB 3.27Å; H216-A247 PolarHBondContact CE1-N 2.94Å; H216-A247 PolarHBondContact ND1-N 3.43Å; H216-S271 PolarHBondContact NE2-OG 3.44Å; H216-L297 HydrophobicContact CB-CD1 4.29Å
217	A	92.6	Very high	79.1	Confident	3 Å²	3	33.9 Å²	33.9	3%	0.025	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	129.1	177.2	0	0	0	0	0	110	Y144 V244 D245	Y144-A217 HydrophobicContact CE2-CB 4Å; A217-V244 WeakPolarHBondContact O-CA 3.31Å; A217-D245 PolarHBondContact N-O 2.67Å; A217-D245 PolarHBondContact O-N 3.44Å
218	I	95.1	Very high	80.7	Confident	6 Å²	6	31.9 Å²	31.9	3%	0.031	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	106.6	-177.7	-53.1	-174.3	0	0	0	108.9	L145 I147 V220 V244 L297 L300	L145-I218 HydrophobicContact CD1-CB 3.88Å; L145-I218 HydrophobicContact CD1-CD1 4.2Å; L145-I218 HydrophobicContact CD1-CG1 4.14Å; L145-I218 HydrophobicContact CG-CB 4.04Å; L145-I218 PolarHBondContact N-O 2.86Å; L145-I218 PolarHBondContact O-N 2.78Å; I147-I218 HydrophobicContact CD1-CD1 4.05Å; I218-V220 HydrophobicContact CG2-CG2 3.82Å; I218-V244 HydrophobicContact CD1-CG2 4.45Å; I218-V244 HydrophobicContact CG1-CG1 4.16Å; I218-V244 HydrophobicContact CG1-CG2 4.17Å; I218-V244 HydrophobicContact CG2-CG2 4.1Å; I218-L297 HydrophobicContact CD1-CD1 4.29Å; I218-L300 HydrophobicContact CD1-CD1 4.42Å
219	F	96.1	Very high	82.4	Confident	1 Å²	1	28.6 Å²	28.6	0%	0.004	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	118.7	171.4	-162.9	-81.9	0	0	0	108.7	F123 A142 Y144 I190 V193 M194 I221 L243	F123-F219 HydrophobicContact CE1-CD1 4.25Å; F123-F219 AromaticContact CE1-CE1 3.59Å; F123-F219 HydrophobicContact CE1-CE1 3.59Å; F123-F219 HydrophobicContact CE1-CZ 4.09Å; F123-F219 HydrophobicContact CZ-CD1 4.41Å; F123-F219 AromaticContact CZ-CE1 3.71Å; F123-F219 HydrophobicContact CZ-CE1 3.71Å; F123-F219 HydrophobicContact CZ-CE2 4.48Å; F123-F219 AromaticContact CZ-CZ 3.76Å; F123-F219 HydrophobicContact CZ-CZ 3.76Å; A142-F219 HydrophobicContact CB-CE1 4.04Å; A142-F219 HydrophobicContact CB-CZ 3.88Å; Y144-F219 AromaticContact CD1-CD2 3.7Å; Y144-F219 HydrophobicContact CD1-CD2 3.7Å; Y144-F219 HydrophobicContact CD1-CE2 4.05Å; Y144-F219 HydrophobicContact CD2-CB 3.9Å; Y144-F219 AromaticContact CD2-CD2 3.69Å; Y144-F219 HydrophobicContact CD2-CD2 3.69Å; Y144-F219 HydrophobicContact CD2-CG 4.25Å; Y144-F219 HydrophobicContact CE1-CD2 4.18Å; Y144-F219 HydrophobicContact CE2-CB 4.13Å; Y144-F219 HydrophobicContact CE2-CD2 4.14Å; Y144-F219 AromaticContact CG-CD2 3.46Å; Y144-F219 HydrophobicContact CG-CD2 3.46Å; Y144-F219 VanDerWaalsContact CG-CD2 3.46Å; Y144-F219 HydrophobicContact CG-CE2 4.08Å; Y144-F219 HydrophobicContact CG-CG 4.38Å; I190-F219 HydrophobicContact CD1-CE1 4.18Å; I190-F219 HydrophobicContact CD1-CZ 4.46Å; I190-F219 HydrophobicContact CG1-CE1 4.16Å; I190-F219 HydrophobicContact CG1-CZ 3.96Å; V193-F219 HydrophobicContact CG1-CE2 4.36Å; V193-F219 HydrophobicContact CG1-CZ 4.36Å; M194-F219 HydrophobicContact CB-CE2 3.94Å; M194-F219 HydrophobicContact CB-CZ 4.43Å; M194-F219 HydrophobicContact CG-CE2 4.3Å; F219-I221 HydrophobicContact CD1-CG1 3.92Å; F219-I221 HydrophobicContact CE1-CD1 4.39Å; F219-I221 HydrophobicContact CE1-CG1 3.85Å; F219-L243 HydrophobicContact CB-CB 4.26Å; F219-L243 HydrophobicContact CD1-CD1 4.35Å; F219-L243 PolarHBondContact N-O 2.75Å; F219-L243 WeakPolarHBondContact O-CB 3.4Å; F219-L243 PolarHBondContact O-N 3.19Å
220	V	96.1	Very high	83.9	Confident	13 Å²	13	32.8 Å²	32.8	8%	0.079	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	115.9	-176.3	-176.6	0	0	0	0	108.8	A142 S143 I218 K240 L241	A142-V220 WeakPolarHBondContact CA-O 3.25Å; S143-V220 PolarHBondContact N-O 3.48Å; S143-V220 PolarHBondContact O-N 2.83Å; I218-V220 HydrophobicContact CG2-CG2 3.82Å; V220-K240 HydrophobicContact CG1-CD 4.31Å; V220-K240 HydrophobicContact CG1-CG 3.84Å; V220-L241 WeakPolarHBondContact CA-O 3.36Å
221	I	96.2	Very high	85	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	125	167.3	-42.9	-178.1	0	0	0	107.3	F123 I126 V140 R141 I190 F219 I223 L241 L243	F123-I221 HydrophobicContact CD1-CD1 3.78Å; F123-I221 HydrophobicContact CE1-CD1 3.7Å; F123-I221 HydrophobicContact CE1-CG1 4.48Å; I126-I221 HydrophobicContact CD1-CD1 3.79Å; I126-I221 HydrophobicContact CD1-CG2 4.26Å; V140-I221 HydrophobicContact CG1-CG2 3.69Å; R141-I221 WeakPolarHBondContact O-CA 3.37Å; I190-I221 HydrophobicContact CD1-CD1 4.16Å; I190-I221 HydrophobicContact CD1-CG1 4.35Å; I190-I221 HydrophobicContact CD1-CG2 4.35Å; F219-I221 HydrophobicContact CD1-CG1 3.92Å; F219-I221 HydrophobicContact CE1-CD1 4.39Å; F219-I221 HydrophobicContact CE1-CG1 3.85Å; I221-I223 HydrophobicContact CG2-CG1 4.16Å; I221-L241 HydrophobicContact CB-CB 4.32Å; I221-L241 HydrophobicContact CD1-CD2 4.26Å; I221-L241 PolarHBondContact N-O 2.84Å; I221-L241 PolarHBondContact O-N 3.32Å; I221-L243 HydrophobicContact CD1-CD1 3.88Å; I221-L243 HydrophobicContact CG1-CD1 4.14Å
222	T	94.3	Very high	85.7	Confident	13 Å²	13	33.4 Å²	33.4	8%	0.08	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	128.8	168.1	-38	0	0	0	0	109.1	R141 V238 G239 K240	R141-T222 PolarHBondContact N-O 3.48Å; R141-T222 PolarHBondContact O-N 2.87Å; T222-V238 HydrophobicContact CG2-CG1 3.82Å; T222-G239 CarbonylContact C-O 3.58Å; T222-G239 WeakPolarHBondContact CA-O 3.46Å; T222-K240 HydrophobicContact CG2-CB 4.4Å
223	I	93.2	Very high	86.3	Confident	3 Å²	3	36.8 Å²	36.8	2%	0.015	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	116.3	-177.7	-50.8	177.3	0	0	0	106.4	V84 L85 I126 Y138 V140 I221 G239	V84-I223 HydrophobicContact CG1-CD1 4.11Å; L85-I223 HydrophobicContact CD2-CD1 3.87Å; L85-I223 HydrophobicContact CG-CD1 4.29Å; I126-I223 HydrophobicContact CD1-CD1 3.82Å; I126-I223 HydrophobicContact CG1-CD1 3.85Å; I126-I223 HydrophobicContact CG2-CD1 3.88Å; Y138-I223 HydrophobicContact CD1-CG2 3.74Å; Y138-I223 HydrophobicContact CE1-CG2 4.12Å; V140-I223 HydrophobicContact CG2-CG2 4.47Å; I221-I223 HydrophobicContact CG2-CG1 4.16Å; I223-G239 PolarHBondContact N-O 3.35Å; I223-G239 PolarHBondContact O-N 2.68Å
224	E	91.6	Very high	86.7	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	133	166.8	-62.1	-177.1	-170.2	0	0	108.4	Y138 L139 R141 R237 V238 L354 L355	Y138-E224 CarbonylContact C-O 3.58Å; Y138-E224 VanDerWaalsContact CA-O 3.31Å; Y138-E224 WeakPolarHBondContact CA-O 3.37Å; L139-E224 HydrophobicContact CB-CB 4.34Å; L139-E224 PolarHBondContact N-O 2.92Å; L139-E224 PolarHBondContact O-N 2.84Å; R141-E224 IonicContact CZ-OE1 3.13Å; R141-E224 VanDerWaalsContact NH1-CD 3.25Å; R141-E224 IonicContact NH1-OE1 2.74Å; R141-E224 PolarHBondContact NH1-OE1 2.93Å; R141-E224 IonicContact NH2-OE1 2.72Å; R141-E224 PolarHBondContact NH2-OE1 2.94Å; E224-R237 WeakPolarHBondContact CA-O 3.5Å; E224-V238 HydrophobicContact CG-CB 4.48Å; E224-V238 HydrophobicContact CG-CG1 4.07Å; E224-V238 HydrophobicContact CG-CG2 4.05Å; E224-L354 PolarHBondContact OE1-N 3.11Å; E224-L354 PolarHBondContact OE2-N 3.48Å; E224-L355 HydrophobicContact CB-CB 4.01Å; E224-L355 HydrophobicContact CB-CD1 3.83Å; E224-L355 WeakPolarHBondContact OE2-CB 3.34Å; E224-L355 PolarHBondContact OE2-N 3.04Å
225	C	89.2	Confident	87.1	Confident	3 Å²	3	40.4 Å²	40.4	2%	0.02	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	130.3	176.2	179.7	0	0	0	0	108.7	Q137 Y138 I236 R237	Q137-C225 CarbonylContact O-C 3.59Å; Q137-C225 WeakPolarHBondContact O-CA 3.18Å; Y138-C225 HydrophobicContact CD1-CB 3.88Å; Y138-C225 HydrophobicContact CE1-CB 3.59Å; C225-I236 CarbonylContact O-C 3.59Å; C225-I236 WeakPolarHBondContact O-CA 3.46Å; C225-R237 PolarHBondContact N-O 3.17Å; C225-R237 PolarHBondContact O-N 3.44Å
226	S	86.6	Confident	87.1	Confident	6 Å²	6	40.8 Å²	40.8	4%	0.042	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	127.6	174	157.6	0	0	0	0	108.7	Q136 Q137 N234 H235 Q359	Q136-S226 WeakPolarHBondContact CA-O 3.36Å; Q137-S226 PolarHBondContact N-O 2.81Å; Q137-S226 PolarHBondContact O-N 2.85Å; S226-N234 PolarHBondContact OG-ND2 3.43Å; S226-N234 PolarHBondContact OG-OD1 3.07Å; S226-H235 WeakPolarHBondContact CA-O 3.32Å; S226-Q359 PolarHBondContact OG-NE2 2.87Å
227	E	85.2	Confident	87.1	Confident	58 Å²	58	41.7 Å²	41.7	27%	0.271	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	134.3	-175.7	-180	170.4	-139.4	0	0	109.1	Q136 G229 H235 R237	Q136-E227 HydrophobicContact CG-CB 4.15Å; Q136-E227 HydrophobicContact CG-CG 4.06Å; Q136-E227 VanDerWaalsContact NE2-CD 3.31Å; Q136-E227 PolarHBondContact NE2-OE1 3.07Å; E227-G229 PolarHBondContact O-N 2.82Å; E227-H235 PolarHBondContact N-O 3Å; E227-H235 PolarHBondContact O-N 2.87Å; E227-R237 IonicContact OE2-CZ 3.49Å; E227-R237 IonicContact OE2-NH1 3.97Å; E227-R237 PolarHBondContact OE2-NH1 3.16Å; E227-R237 IonicContact OE2-NH2 3.72Å; E227-R237 PolarHBondContact OE2-NH2 3.34Å
228	V	81.8	Confident	87.1	Confident	100 Å²	100	42.9 Å²	42.9	61%	0.606	24%	0.243	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	117.2	171.6	-176.1	0	0	0	0	107.9	E233	V228-E233 WeakPolarHBondContact CA-O 3.5Å
229	G	79.1	Confident	86.9	Confident	22 Å²	22	42.6 Å²	42.6	23%	0.227	24%	0.241	C	C	.	.			trans	-71.5	172.9	179.8	0	0	0	0	0	112.9	E227 D231 G232 E233	E227-G229 PolarHBondContact O-N 2.82Å; G229-D231 WeakPolarHBondContact CA-OD1 3.47Å; G229-D231 PolarHBondContact O-N 3.28Å; G229-G232 PolarHBondContact O-N 3.39Å; G229-E233 PolarHBondContact N-O 3.31Å
230	L	78.4	Confident	86.8	Confident	195 Å²	195	45.7 Å²	45.7	100%	1.021	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-14.4	174.2	-61.4	178.7	0	0	0	113.1	G232	L230-G232 VanDerWaalsContact C-N 3.33Å
231	D	81.4	Confident	86.8	Confident	99 Å²	99	45.1 Å²	45.1	53%	0.529	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-9.6	170.8	48.1	16.3	0	0	0	113.2	G229 E233 H235	G229-D231 WeakPolarHBondContact CA-OD1 3.47Å; G229-D231 PolarHBondContact O-N 3.28Å; D231-E233 PolarHBondContact O-N 3Å; D231-E233 PolarHBondContact OD1-N 3.47Å; D231-H235 IonicContact OD1-CD2 2.72Å; D231-H235 IonicContact OD1-NE2 3.4Å; D231-H235 PolarHBondContact OD1-NE2 2.89Å; D231-H235 IonicContact OD2-CD2 3.24Å; D231-H235 IonicContact OD2-CE1 2.9Å; D231-H235 PolarHBondContact OD2-CE1 3.23Å; D231-H235 IonicContact OD2-NE2 3.88Å; D231-H235 PolarHBondContact OD2-NE2 3.26Å
232	G	76.4	Confident	86.8	Confident	57 Å²	57	45.8 Å²	45.8	59%	0.588	26%	0.255	S	S	*	.	S	Bend	trans	78.3	1.8	-172.3	0	0	0	0	0	114	G229 L230	G229-G232 PolarHBondContact O-N 3.39Å; L230-G232 VanDerWaalsContact C-N 3.33Å
233	E	78.1	Confident	86.9	Confident	132 Å²	132	45.3 Å²	45.3	62%	0.617	25%	0.251	S	S	*	.			trans	-85.2	150.6	175.1	-62.5	-161.7	167	0	0	110.9	V228 G229 D231 H235	V228-E233 WeakPolarHBondContact CA-O 3.5Å; G229-E233 PolarHBondContact N-O 3.31Å; D231-E233 PolarHBondContact O-N 3Å; D231-E233 PolarHBondContact OD1-N 3.47Å; E233-H235 PolarHBondContact O-CD2 2.98Å; E233-H235 PolarHBondContact O-N 2.95Å
234	N	78.3	Confident	87.1	Confident	69 Å²	69	45.1 Å²	45.1	37%	0.369	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	102.4	179.2	-177.8	10.1	0	0	0	110	S226 Q359	S226-N234 PolarHBondContact OG-ND2 3.43Å; S226-N234 PolarHBondContact OG-OD1 3.07Å; N234-Q359 PolarHBondContact ND2-OE1 3.04Å
235	H	83.2	Confident	87.2	Confident	62 Å²	62	45.6 Å²	45.6	29%	0.287	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	124.6	178.5	-69.2	-83.7	0	0	0	110	S226 E227 D231 E233	S226-H235 WeakPolarHBondContact CA-O 3.32Å; E227-H235 PolarHBondContact N-O 3Å; E227-H235 PolarHBondContact O-N 2.87Å; D231-H235 IonicContact OD1-CD2 2.72Å; D231-H235 IonicContact OD1-NE2 3.4Å; D231-H235 PolarHBondContact OD1-NE2 2.89Å; D231-H235 IonicContact OD2-CD2 3.24Å; D231-H235 IonicContact OD2-CE1 2.9Å; D231-H235 PolarHBondContact OD2-CE1 3.23Å; D231-H235 IonicContact OD2-NE2 3.88Å; D231-H235 PolarHBondContact OD2-NE2 3.26Å; E233-H235 PolarHBondContact O-CD2 2.98Å; E233-H235 PolarHBondContact O-N 2.95Å
236	I	86.5	Confident	87.3	Confident	9 Å²	9	45.5 Å²	45.5	5%	0.046	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	120.9	178.9	-51.5	177.7	0	0	0	109.7	C225 A353 R356	C225-I236 CarbonylContact O-C 3.59Å; C225-I236 WeakPolarHBondContact O-CA 3.46Å; I236-A353 HydrophobicContact CB-CB 4.35Å; I236-A353 HydrophobicContact CD1-CB 4.39Å; I236-A353 HydrophobicContact CG2-CB 3.53Å; I236-R356 HydrophobicContact CD1-CB 3.65Å; I236-R356 HydrophobicContact CD1-CG 4.16Å
237	R	90.3	Very high	87.4	Confident	25 Å²	25	45.2 Å²	45.2	9%	0.094	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	135.6	-179.3	-63.2	-172.5	-63.7	-92.1	1.8	110.4	E224 C225 E227 V346 N347 E348	E224-R237 WeakPolarHBondContact CA-O 3.5Å; C225-R237 PolarHBondContact N-O 3.17Å; C225-R237 PolarHBondContact O-N 3.44Å; E227-R237 IonicContact OE2-CZ 3.49Å; E227-R237 IonicContact OE2-NH1 3.97Å; E227-R237 PolarHBondContact OE2-NH1 3.16Å; E227-R237 IonicContact OE2-NH2 3.72Å; E227-R237 PolarHBondContact OE2-NH2 3.34Å; R237-V346 HydrophobicContact CG-CG1 4.18Å; R237-N347 WeakPolarHBondContact CA-O 3.24Å; R237-E348 HydrophobicContact CG-CG 3.82Å
238	V	91.3	Very high	87.3	Confident	28 Å²	28	42.5 Å²	42.5	17%	0.17	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	106.2	-177.3	-172.1	0	0	0	0	111	T222 E224 N347 A353	T222-V238 HydrophobicContact CG2-CG1 3.82Å; E224-V238 HydrophobicContact CG-CB 4.48Å; E224-V238 HydrophobicContact CG-CG1 4.07Å; E224-V238 HydrophobicContact CG-CG2 4.05Å; V238-N347 PolarHBondContact N-O 2.99Å; V238-N347 WeakPolarHBondContact O-CB 3.41Å; V238-N347 PolarHBondContact O-ND2 3.2Å; V238-A353 HydrophobicContact CG2-CB 4.37Å
239	G	91.9	Very high	87.4	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	127.6	174.7	0	0	0	0	0	112	V84 F88 T222 I223	V84-G239 VanDerWaalsContact CG1-C 3.48Å; F88-G239 WeakPolarHBondContact O-CA 3.48Å; T222-G239 CarbonylContact C-O 3.58Å; T222-G239 WeakPolarHBondContact CA-O 3.46Å; I223-G239 PolarHBondContact N-O 3.35Å; I223-G239 PolarHBondContact O-N 2.68Å
240	K	93.6	Very high	87.1	Confident	66 Å²	66	39.2 Å²	39.2	29%	0.287	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	117.6	174.9	-172.1	-177.5	179.4	-174.3	0	110.4	N89 G90 V220 T222 N242	N89-K240 CarbonylContact C-O 3.55Å; N89-K240 WeakPolarHBondContact CA-O 3.4Å; N89-K240 WeakPolarHBondContact OD1-CB 3.45Å; G90-K240 PolarHBondContact N-O 3.35Å; G90-K240 VanDerWaalsContact O-O 3.13Å; V220-K240 HydrophobicContact CG1-CD 4.31Å; V220-K240 HydrophobicContact CG1-CG 3.84Å; T222-K240 HydrophobicContact CG2-CB 4.4Å; K240-N242 WeakPolarHBondContact CE-OD1 3.46Å
241	L	96.6	Very high	86.4	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	111.4	173.1	179.2	58.8	0	0	0	110.1	L80 V81 V84 G90 I92 I126 V220 I221 L243	L80-L241 HydrophobicContact CD2-CD1 3.9Å; V81-L241 HydrophobicContact CG2-CD2 4.05Å; V84-L241 HydrophobicContact CB-CB 4.47Å; V84-L241 HydrophobicContact CG1-CB 4.03Å; V84-L241 HydrophobicContact CG2-CB 4.09Å; V84-L241 HydrophobicContact CG2-CD1 4.25Å; G90-L241 CarbonylContact O-C 3.48Å; G90-L241 VanDerWaalsContact O-CA 3.3Å; G90-L241 WeakPolarHBondContact O-CA 3.33Å; I92-L241 HydrophobicContact CG1-CD1 4.47Å; I126-L241 HydrophobicContact CD1-CD2 4.46Å; V220-L241 WeakPolarHBondContact CA-O 3.36Å; I221-L241 HydrophobicContact CB-CB 4.32Å; I221-L241 HydrophobicContact CD1-CD2 4.26Å; I221-L241 PolarHBondContact N-O 2.84Å; I221-L241 PolarHBondContact O-N 3.32Å; L241-L243 HydrophobicContact CD1-CD2 4.48Å; L241-L243 HydrophobicContact CD2-CD1 4.09Å; L241-L243 HydrophobicContact CD2-CD2 4.36Å; L241-L243 HydrophobicContact CD2-CG 4.29Å; L241-L243 HydrophobicContact CG-CD1 4.21Å; L241-L243 HydrophobicContact CG-CD2 4.35Å; L241-L243 HydrophobicContact CG-CG 4.02Å
242	N	96.6	Very high	85.4	Confident	15 Å²	15	29 Å²	29	8%	0.08	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	123.1	171	-51.7	-56	0	0	0	109.7	G90 T91 I92 K240 V244	G90-N242 PolarHBondContact O-N 3.32Å; T91-N242 CarbonylContact C-O 3.16Å; T91-N242 WeakPolarHBondContact CA-O 3.44Å; T91-N242 HydrophobicContact CG2-CB 4.14Å; T91-N242 PolarHBondContact OG1-ND2 2.88Å; I92-N242 PolarHBondContact N-O 3.39Å; K240-N242 WeakPolarHBondContact CE-OD1 3.46Å; N242-V244 HydrophobicContact CB-CG2 4.38Å
243	L	96.5	Very high	84.6	Confident	2 Å²	2	30.8 Å²	30.8	1%	0.01	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	106.7	177.3	-65.7	152.7	0	0	0	107.7	I92 M106 V118 I119 F219 I221 L241	I92-L243 HydrophobicContact CB-CD2 4.25Å; I92-L243 HydrophobicContact CD1-CD2 4.03Å; I92-L243 HydrophobicContact CG1-CD2 4.42Å; M106-L243 HydrophobicContact CE-CB 3.88Å; M106-L243 HydrophobicContact CE-CD2 4.24Å; V118-L243 HydrophobicContact CG1-CD2 4.34Å; V118-L243 HydrophobicContact CG2-CD2 4.27Å; I119-L243 HydrophobicContact CD1-CB 4.37Å; I119-L243 HydrophobicContact CG1-CB 3.98Å; I119-L243 HydrophobicContact CG1-CD1 4.11Å; I119-L243 HydrophobicContact CG1-CD2 4.28Å; I119-L243 HydrophobicContact CG1-CG 4.33Å; I119-L243 HydrophobicContact CG2-CD1 4.41Å; F219-L243 HydrophobicContact CB-CB 4.26Å; F219-L243 HydrophobicContact CD1-CD1 4.35Å; F219-L243 PolarHBondContact N-O 2.75Å; F219-L243 WeakPolarHBondContact O-CB 3.4Å; F219-L243 PolarHBondContact O-N 3.19Å; I221-L243 HydrophobicContact CD1-CD1 3.88Å; I221-L243 HydrophobicContact CG1-CD1 4.14Å; L241-L243 HydrophobicContact CD1-CD2 4.48Å; L241-L243 HydrophobicContact CD2-CD1 4.09Å; L241-L243 HydrophobicContact CD2-CD2 4.36Å; L241-L243 HydrophobicContact CD2-CG 4.29Å; L241-L243 HydrophobicContact CG-CD1 4.21Å; L241-L243 HydrophobicContact CG-CD2 4.35Å; L241-L243 HydrophobicContact CG-CG 4.02Å
244	V	95.9	Very high	83.7	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	119.4	-167	-177.6	0	0	0	0	110.9	T91 I92 F93 A94 A217 I218 N242 L246 L301	T91-V244 HydrophobicContact CG2-CG2 4.32Å; I92-V244 PolarHBondContact O-N 3.26Å; F93-V244 WeakPolarHBondContact CA-O 3.25Å; F93-V244 HydrophobicContact CB-CB 3.7Å; F93-V244 HydrophobicContact CB-CG1 4.08Å; F93-V244 HydrophobicContact CB-CG2 4.35Å; A94-V244 PolarHBondContact N-O 3.34Å; A217-V244 WeakPolarHBondContact O-CA 3.31Å; I218-V244 HydrophobicContact CD1-CG2 4.45Å; I218-V244 HydrophobicContact CG1-CG1 4.16Å; I218-V244 HydrophobicContact CG1-CG2 4.17Å; I218-V244 HydrophobicContact CG2-CG2 4.1Å; N242-V244 HydrophobicContact CB-CG2 4.38Å; V244-L246 HydrophobicContact CG1-CD2 3.43Å; V244-L246 VanDerWaalsContact CG1-CD2 3.43Å; V244-L246 HydrophobicContact CG1-CG 3.88Å; V244-L301 HydrophobicContact CG2-CD2 4.05Å
245	D	93.9	Very high	82.8	Confident	9 Å²	9	27.9 Å²	27.9	5%	0.048	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	101.9	167.6	-168.7	33	0	0	0	107.8	K102 T103 M106 R201 H216 A217	K102-D245 VanDerWaalsContact C-OD1 3.28Å; K102-D245 VanDerWaalsContact CB-OD1 3.23Å; K102-D245 WeakPolarHBondContact CB-OD1 3.47Å; T103-D245 WeakPolarHBondContact CA-OD2 3.19Å; T103-D245 VanDerWaalsContact CB-OD2 3.3Å; T103-D245 WeakPolarHBondContact CB-OD2 3.5Å; T103-D245 WeakPolarHBondContact CG2-OD2 3.35Å; T103-D245 PolarHBondContact N-OD1 3.32Å; T103-D245 VanDerWaalsContact N-OD1 3.09Å; T103-D245 PolarHBondContact OG1-OD2 3.18Å; M106-D245 HydrophobicContact CB-CB 4.3Å; M106-D245 HydrophobicContact CG-CB 4Å; R201-D245 IonicContact NH1-OD2 2.76Å; H216-D245 WeakPolarHBondContact CA-O 3.43Å; A217-D245 PolarHBondContact N-O 2.67Å; A217-D245 PolarHBondContact O-N 3.44Å
246	L	92.5	Very high	81.7	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.005	17%	0.171	C	C	.	.	P	Polyproline II helix	trans	-75.1	163.6	-178.3	-61.7	175.3	0	0	0	111.6	F93 A94 Y95 K102 H216 V244 L272 L275 L297	F93-L246 HydrophobicContact CD2-CD1 3.91Å; A94-L246 VanDerWaalsContact O-CB 3.3Å; A94-L246 WeakPolarHBondContact O-CB 3.47Å; A94-L246 WeakPolarHBondContact O-CG 3.26Å; A94-L246 PolarHBondContact O-N 3.27Å; Y95-L246 HydrophobicContact CD2-CD1 3.8Å; Y95-L246 HydrophobicContact CG-CD1 4.47Å; K102-L246 WeakPolarHBondContact CE-O 3.21Å; H216-L246 HydrophobicContact CB-CD2 4.32Å; H216-L246 WeakPolarHBondContact ND1-CA 3.38Å; H216-L246 WeakPolarHBondContact ND1-CD2 3.31Å; V244-L246 HydrophobicContact CG1-CD2 3.43Å; V244-L246 VanDerWaalsContact CG1-CD2 3.43Å; V244-L246 HydrophobicContact CG1-CG 3.88Å; L246-L272 HydrophobicContact CB-CD2 4.46Å; L246-L272 HydrophobicContact CD1-CD2 4.39Å; L246-L275 HydrophobicContact CD1-CD2 3.93Å; L246-L297 HydrophobicContact CD2-CD1 3.82Å; L246-L297 HydrophobicContact CD2-CD2 3.84Å; L246-L297 HydrophobicContact CD2-CG 4.46Å
247	A	88.1	Confident	80.4	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-64.8	171.7	168.9	0	0	0	0	0	112.8	K102 S213 H216 I268 L272	K102-A247 WeakPolarHBondContact CE-O 3.38Å; K102-A247 PolarHBondContact NZ-O 3.38Å; S213-A247 CarbonylContact O-C 3.58Å; S213-A247 WeakPolarHBondContact O-CA 3.33Å; S213-A247 WeakPolarHBondContact O-CB 3.4Å; H216-A247 VanDerWaalsContact CE1-CB 3.49Å; H216-A247 WeakPolarHBondContact CE1-CB 3.27Å; H216-A247 PolarHBondContact CE1-N 2.94Å; H216-A247 PolarHBondContact ND1-N 3.43Å; A247-I268 HydrophobicContact CB-CG2 3.66Å; A247-L272 HydrophobicContact CB-CD1 4.49Å
248	G	83.6	Confident	79.1	Confident	2 Å²	2	35.5 Å²	35.5	2%	0.021	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-61.2	132.6	170.6	0	0	0	0	0	113.2	T98 S213 E250 L272	T98-G248 VanDerWaalsContact OG1-CA 3.28Å; T98-G248 WeakPolarHBondContact OG1-CA 3.45Å; S213-G248 PolarHBondContact O-N 3.25Å; G248-E250 VanDerWaalsContact C-N 3.31Å; G248-E250 VanDerWaalsContact C-OE2 3.29Å; G248-E250 WeakPolarHBondContact CA-OE2 3.33Å; G248-L272 WeakPolarHBondContact O-CD1 3.39Å
249	S	82.4	Confident	78.1	Confident	17 Å²	17	36.7 Å²	36.7	12%	0.119	23%	0.227	C	C	.	.			trans	-85.5	4.3	175.6	71.6	0	0	0	0	114.6	Y95 G96 Q97	Y95-S249 WeakPolarHBondContact OH-CB 3.39Å; G96-S249 PolarHBondContact O-N 3.44Å; Q97-S249 PolarHBondContact N-OG 2.78Å; Q97-S249 VanDerWaalsContact N-OG 3.16Å
250	E	74.4	Confident	77	Confident	36 Å²	36	43.7 Å²	43.7	17%	0.168	26%	0.26	C	S	.	.			trans	-68.1	144.6	-175.4	56.3	-82.4	-169.7	0	0	114.5	Q97 T98 G248	Q97-E250 WeakPolarHBondContact CA-OE2 3.34Å; Q97-E250 HydrophobicContact CG-CB 4.24Å; T98-E250 WeakPolarHBondContact CB-OE1 3.34Å; T98-E250 PolarHBondContact N-OE2 3.22Å; T98-E250 VanDerWaalsContact OG1-CD 3.31Å; T98-E250 PolarHBondContact OG1-OE1 2.9Å; T98-E250 PolarHBondContact OG1-OE2 2.85Å; G248-E250 VanDerWaalsContact C-N 3.31Å; G248-E250 VanDerWaalsContact C-OE2 3.29Å; G248-E250 WeakPolarHBondContact CA-OE2 3.33Å
251	R	63.5	Low	75.7	Confident	31 Å²	31	45.8 Å²	45.8	12%	0.117	27%	0.266	C	S	.	.			trans	-70.7	137.7	174.5	-58.7	-171.8	-175.8	-130.9	-6.2	111.3	A253 K254 E561 E565 E568	R251-A253 PolarHBondContact O-N 3.17Å; R251-K254 PolarHBondContact O-N 2.95Å; R251-K254 VanDerWaalsContact O-N 3.15Å; R251-E561 IonicContact NH2-OE1 3.36Å; R251-E561 PolarHBondContact NH2-OE1 2.81Å; R251-E565 IonicContact CZ-OE1 2.66Å; R251-E565 IonicContact NH2-OE1 3.49Å; R251-E565 PolarHBondContact NH2-OE1 3.05Å; R251-E568 IonicContact NH1-OE1 3Å; R251-E568 PolarHBondContact NH1-OE1 3.13Å; R251-E568 IonicContact NH1-OE2 2.61Å; R251-E568 PolarHBondContact NH1-OE2 3.32Å
252	Q	59.9	Low	74.3	Confident	48 Å²	48	48.4 Å²	48.4	22%	0.224	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-52.5	-32.6	-176.9	-71.1	-177.2	15.4	0	0	114.3	K254 T255 A265 T266	Q252-K254 PolarHBondContact O-N 3.01Å; Q252-T255 WeakPolarHBondContact O-CB 3.15Å; Q252-T255 PolarHBondContact O-N 2.9Å; Q252-T255 PolarHBondContact O-OG1 2.85Å; Q252-A265 HydrophobicContact CG-CB 3.86Å; Q252-A265 PolarHBondContact NE2-O 3.07Å; Q252-T266 PolarHBondContact NE2-OG1 2.86Å
253	A	59.5	Low	73.1	Confident	94 Å²	94	53.2 Å²	53.2	78%	0.777	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-51.5	-27.7	-179.9	0	0	0	0	0	113.9	R251	R251-A253 PolarHBondContact O-N 3.17Å
254	K	58.5	Low	71.8	Confident	74 Å²	74	53.4 Å²	53.4	32%	0.322	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-81.8	-15.6	176.6	-68.6	179.6	178.8	155.7	0	114.2	R251 Q252 E325 E326	R251-K254 PolarHBondContact O-N 2.95Å; R251-K254 VanDerWaalsContact O-N 3.15Å; Q252-K254 PolarHBondContact O-N 3.01Å; K254-E325 IonicContact NZ-OE2 3.38Å; K254-E325 PolarHBondContact NZ-OE2 2.88Å; K254-E326 IonicContact NZ-OE1 2.58Å; K254-E326 PolarHBondContact NZ-OE1 3.34Å
255	T	59.5	Low	70.4	Confident	66 Å²	66	53.8 Å²	53.8	41%	0.405	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-23.1	-171.1	70.7	0	0	0	0	114.3	Q252 A257	Q252-T255 WeakPolarHBondContact O-CB 3.15Å; Q252-T255 PolarHBondContact O-N 2.9Å; Q252-T255 PolarHBondContact O-OG1 2.85Å; T255-A257 PolarHBondContact O-N 3.43Å; T255-A257 VanDerWaalsContact O-N 3.16Å; T255-A257 PolarHBondContact OG1-N 3.32Å
256	G	60.1	Low	69.4	Low	67 Å²	67	55.7 Å²	55.7	69%	0.691	32%	0.316	S	S	*	.			trans	59	22.2	-176.8	0	0	0	0	0	114.5
257	A	59.9	Low	68.5	Low	18 Å²	18	59.6 Å²	59.6	15%	0.149	33%	0.333	C	S	.	.			trans	-69.9	135.8	-174.2	0	0	0	0	0	112.4	T255 R261	T255-A257 PolarHBondContact O-N 3.43Å; T255-A257 VanDerWaalsContact O-N 3.16Å; T255-A257 PolarHBondContact OG1-N 3.32Å; A257-R261 HydrophobicContact CB-CB 3.89Å
258	Q	62.3	Low	67.8	Low	171 Å²	171	60 Å²	60	80%	0.799	34%	0.335	S	S	*	.			trans	-121.5	158.1	175.5	-66.9	-176.3	-12.8	0	0	111.2
259	G	70.4	Confident	67.4	Low	53 Å²	53	61.7 Å²	61.7	55%	0.546	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.7	-135.6	174.3	0	0	0	0	0	113.5	R261 L262 K263	G259-R261 PolarHBondContact O-N 2.92Å; G259-L262 WeakPolarHBondContact O-CB 3.41Å; G259-L262 PolarHBondContact O-N 2.95Å; G259-K263 PolarHBondContact O-N 3.38Å
260	E	69.2	Low	67.3	Low	147 Å²	147	65.4 Å²	65.4	69%	0.687	36%	0.362	S	S	*	.	H	α-helix	trans	-57.1	-33.6	-179.2	-62.8	-172.9	147.9	0	0	113	L262 K263 E264	E260-L262 VanDerWaalsContact C-N 3.25Å; E260-L262 PolarHBondContact O-N 2.66Å; E260-K263 PolarHBondContact O-N 2.67Å; E260-E264 WeakPolarHBondContact O-CB 3.18Å; E260-E264 PolarHBondContact O-N 3.19Å
261	R	66.3	Low	67.8	Low	111 Å²	111	63.7 Å²	63.7	42%	0.419	35%	0.354	S	S	.	.	H	α-helix	trans	-65.1	-28.5	177.4	-65.7	-178.8	175.7	-179.2	-0.3	113	N209 A257 G259 A265	N209-R261 VanDerWaalsContact CG-NH2 3.32Å; N209-R261 PolarHBondContact ND2-NH2 2.8Å; N209-R261 VanDerWaalsContact ND2-NH2 3.17Å; A257-R261 HydrophobicContact CB-CB 3.89Å; G259-R261 PolarHBondContact O-N 2.92Å; R261-A265 VanDerWaalsContact O-CB 3.29Å; R261-A265 WeakPolarHBondContact O-CB 3.28Å; R261-A265 PolarHBondContact O-N 3.24Å
262	L	68.1	Low	68.9	Low	55 Å²	55	62.8 Å²	62.8	29%	0.288	35%	0.351	S	S	.	.	H	α-helix	trans	-69.9	-48.1	173.8	-173.6	68.7	0	0	0	109.6	G259 E260 E264 A265 T266	G259-L262 WeakPolarHBondContact O-CB 3.41Å; G259-L262 PolarHBondContact O-N 2.95Å; E260-L262 VanDerWaalsContact C-N 3.25Å; E260-L262 PolarHBondContact O-N 2.66Å; L262-E264 VanDerWaalsContact C-N 3.32Å; L262-E264 PolarHBondContact O-N 2.75Å; L262-A265 PolarHBondContact O-N 3.08Å; L262-A265 VanDerWaalsContact O-N 3.17Å; L262-T266 PolarHBondContact O-N 3.31Å; L262-T266 PolarHBondContact O-OG1 2.67Å
263	K	70.9	Confident	70.1	Confident	116 Å²	116	63.7 Å²	63.7	50%	0.504	36%	0.363	S	S	.	.	H	α-helix	trans	-61.7	-38.9	177.9	-59.8	-166	174.9	-164.7	0	112.6	G259 E260 T266 K267 E579	G259-K263 PolarHBondContact O-N 3.38Å; E260-K263 PolarHBondContact O-N 2.67Å; K263-T266 PolarHBondContact O-N 3.29Å; K263-K267 PolarHBondContact O-N 3.06Å; K263-E579 WeakPolarHBondContact CE-OE1 3.29Å; K263-E579 IonicContact NZ-OE1 2.78Å; K263-E579 PolarHBondContact NZ-OE1 3.15Å; K263-E579 IonicContact NZ-OE2 2.63Å
264	E	68.2	Low	71.5	Confident	5 Å²	5	59.4 Å²	59.4	2%	0.023	33%	0.327	C	S	.	.	H	α-helix	trans	-59.7	-53.3	171.3	-177	-168.1	-176.2	0	0	111.3	Y148 Q149 R214 E260 L262 T266 K267 I268	Y148-E264 HydrophobicContact CE2-CG 3.77Å; Y148-E264 WeakPolarHBondContact CE2-OE1 3.19Å; Y148-E264 VanDerWaalsContact OH-CD 3.27Å; Y148-E264 PolarHBondContact OH-OE1 2.76Å; Y148-E264 VanDerWaalsContact OH-OE1 3.06Å; Q149-E264 HydrophobicContact CG-CG 4.42Å; R214-E264 VanDerWaalsContact CD-CD 3.48Å; R214-E264 WeakPolarHBondContact CD-OE1 3.49Å; R214-E264 IonicContact CZ-OE2 3.84Å; R214-E264 IonicContact NE-OE1 2.6Å; R214-E264 VanDerWaalsContact NH1-CD 3.32Å; R214-E264 IonicContact NH1-OE1 3.26Å; R214-E264 PolarHBondContact NH1-OE1 3.46Å; R214-E264 IonicContact NH1-OE2 3.91Å; R214-E264 PolarHBondContact NH1-OE2 3.07Å; E260-E264 WeakPolarHBondContact O-CB 3.18Å; E260-E264 PolarHBondContact O-N 3.19Å; L262-E264 VanDerWaalsContact C-N 3.32Å; L262-E264 PolarHBondContact O-N 2.75Å; E264-T266 VanDerWaalsContact C-N 3.27Å; E264-T266 PolarHBondContact O-N 3.1Å; E264-K267 PolarHBondContact O-N 2.81Å; E264-I268 HydrophobicContact CG-CD1 3.96Å; E264-I268 WeakPolarHBondContact O-CD1 3.45Å; E264-I268 WeakPolarHBondContact O-CG1 3.34Å; E264-I268 PolarHBondContact O-N 2.95Å
265	A	68.2	Low	73.1	Confident	9 Å²	9	55.9 Å²	55.9	7%	0.074	31%	0.312	C	S	.	.	H	α-helix	trans	-62.4	-30.8	178.2	0	0	0	0	0	113.2	Q252 R261 L262 I268 N269	Q252-A265 HydrophobicContact CG-CB 3.86Å; Q252-A265 PolarHBondContact NE2-O 3.07Å; R261-A265 VanDerWaalsContact O-CB 3.29Å; R261-A265 WeakPolarHBondContact O-CB 3.28Å; R261-A265 PolarHBondContact O-N 3.24Å; L262-A265 PolarHBondContact O-N 3.08Å; L262-A265 VanDerWaalsContact O-N 3.17Å; A265-I268 PolarHBondContact O-N 3.46Å; A265-N269 WeakPolarHBondContact O-CB 3.47Å; A265-N269 PolarHBondContact O-N 3.2Å; A265-N269 PolarHBondContact O-OD1 3.43Å
266	T	72.2	Confident	74.5	Confident	49 Å²	49	53.4 Å²	53.4	30%	0.301	30%	0.3	S	S	.	.	H	α-helix	trans	-68.1	-41.6	175.7	-58.3	0	0	0	0	111.3	Q252 L262 K263 E264 L270 T572	Q252-T266 PolarHBondContact NE2-OG1 2.86Å; L262-T266 PolarHBondContact O-N 3.31Å; L262-T266 PolarHBondContact O-OG1 2.67Å; K263-T266 PolarHBondContact O-N 3.29Å; E264-T266 VanDerWaalsContact C-N 3.27Å; E264-T266 PolarHBondContact O-N 3.1Å; T266-L270 WeakPolarHBondContact O-CB 3.49Å; T266-L270 PolarHBondContact O-N 3.4Å; T266-T572 HydrophobicContact CG2-CG2 4.34Å
267	K	74.5	Confident	75.8	Confident	82 Å²	82	54.4 Å²	54.4	36%	0.357	29%	0.289	S	S	.	.	H	α-helix	trans	-68.4	-36.1	175	-70.8	-177.9	164.2	-162.7	0	113.1	Q149 K263 E264 L270 S271	Q149-K267 HydrophobicContact CB-CD 3.58Å; Q149-K267 HydrophobicContact CG-CD 4.07Å; Q149-K267 WeakPolarHBondContact O-CD 3.32Å; Q149-K267 PolarHBondContact O-NZ 3.06Å; K263-K267 PolarHBondContact O-N 3.06Å; E264-K267 PolarHBondContact O-N 2.81Å; K267-L270 WeakPolarHBondContact O-CB 3.45Å; K267-L270 PolarHBondContact O-N 3Å; K267-S271 PolarHBondContact O-N 3.12Å; K267-S271 VanDerWaalsContact O-N 3.15Å
268	I	73.2	Confident	77.4	Confident	10 Å²	10	53.5 Å²	53.5	5%	0.051	28%	0.282	C	S	.	.	H	α-helix	trans	-63.1	-50.5	175.7	-67.4	156.5	0	0	0	109.9	R214 A247 E264 A265 L270 S271 L272	R214-I268 HydrophobicContact CB-CD1 3.48Å; R214-I268 VanDerWaalsContact CB-CD1 3.48Å; R214-I268 HydrophobicContact CG-CD1 3.76Å; R214-I268 VanDerWaalsContact O-CD1 3.25Å; R214-I268 WeakPolarHBondContact O-CD1 3.43Å; R214-I268 VanDerWaalsContact O-CG1 3.28Å; R214-I268 WeakPolarHBondContact O-CG1 3.43Å; A247-I268 HydrophobicContact CB-CG2 3.66Å; E264-I268 HydrophobicContact CG-CD1 3.96Å; E264-I268 WeakPolarHBondContact O-CD1 3.45Å; E264-I268 WeakPolarHBondContact O-CG1 3.34Å; E264-I268 PolarHBondContact O-N 2.95Å; A265-I268 PolarHBondContact O-N 3.46Å; I268-L270 VanDerWaalsContact C-N 3.32Å; I268-L270 PolarHBondContact O-N 3.41Å; I268-S271 PolarHBondContact O-N 3.41Å; I268-S271 PolarHBondContact O-OG 3.09Å; I268-L272 PolarHBondContact O-N 2.98Å
269	N	73.6	Confident	78.8	Confident	37 Å²	37	45.4 Å²	45.4	20%	0.198	24%	0.244	C	C	.	.	H	α-helix	trans	-63.4	-39.4	178.4	-72.3	17.8	0	0	0	111.1	A265 S271 L272 S273	A265-N269 WeakPolarHBondContact O-CB 3.47Å; A265-N269 PolarHBondContact O-N 3.2Å; A265-N269 PolarHBondContact O-OD1 3.43Å; N269-S271 VanDerWaalsContact C-N 3.34Å; N269-S271 PolarHBondContact O-N 2.91Å; N269-L272 PolarHBondContact O-N 2.79Å; N269-S273 VanDerWaalsContact O-CB 3.3Å; N269-S273 WeakPolarHBondContact O-CB 3.4Å; N269-S273 PolarHBondContact O-N 2.62Å; N269-S273 PolarHBondContact O-OG 3.47Å; N269-S273 VanDerWaalsContact O-OG 3.09Å
270	L	81.3	Confident	79.6	Confident	94 Å²	94	44.6 Å²	44.6	49%	0.492	23%	0.23	S	C	.	.	H	α-helix	trans	-52.8	-48.7	173.6	-177.4	67.1	0	0	0	112.2	T266 K267 I268 L272 S273 A274	T266-L270 WeakPolarHBondContact O-CB 3.49Å; T266-L270 PolarHBondContact O-N 3.4Å; K267-L270 WeakPolarHBondContact O-CB 3.45Å; K267-L270 PolarHBondContact O-N 3Å; I268-L270 VanDerWaalsContact C-N 3.32Å; I268-L270 PolarHBondContact O-N 3.41Å; L270-L272 PolarHBondContact O-N 3.47Å; L270-S273 PolarHBondContact O-N 2.85Å; L270-A274 WeakPolarHBondContact O-CB 3.4Å; L270-A274 PolarHBondContact O-N 3.31Å
271	S	85.5	Confident	80.7	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.007	20%	0.202	C	C	.	.	H	α-helix	trans	-66.1	-33.9	-179.9	67.9	0	0	0	0	113.9	E150 H216 K267 I268 N269 L275	E150-S271 WeakPolarHBondContact OE1-CB 3.45Å; H216-S271 PolarHBondContact NE2-OG 3.44Å; K267-S271 PolarHBondContact O-N 3.12Å; K267-S271 VanDerWaalsContact O-N 3.15Å; I268-S271 PolarHBondContact O-N 3.41Å; I268-S271 PolarHBondContact O-OG 3.09Å; N269-S271 VanDerWaalsContact C-N 3.34Å; N269-S271 PolarHBondContact O-N 2.91Å; S271-L275 PolarHBondContact O-N 2.68Å
272	L	85.7	Confident	81.9	Confident	11 Å²	11	34.9 Å²	34.9	6%	0.058	19%	0.192	C	C	.	.	H	α-helix	trans	-79.8	-33.5	175.9	-69.8	179.3	0	0	0	112.5	Y95 L246 A247 G248 I268 N269 L270 L275 G276	Y95-L272 HydrophobicContact CE2-CD2 4.19Å; L246-L272 HydrophobicContact CB-CD2 4.46Å; L246-L272 HydrophobicContact CD1-CD2 4.39Å; A247-L272 HydrophobicContact CB-CD1 4.49Å; G248-L272 WeakPolarHBondContact O-CD1 3.39Å; I268-L272 PolarHBondContact O-N 2.98Å; N269-L272 PolarHBondContact O-N 2.79Å; L270-L272 PolarHBondContact O-N 3.47Å; L272-L275 WeakPolarHBondContact O-CB 3.34Å; L272-L275 PolarHBondContact O-N 3.06Å; L272-G276 PolarHBondContact O-N 2.81Å
273	S	84.6	Confident	82.9	Confident	68 Å²	68	34.5 Å²	34.5	48%	0.476	19%	0.192	S	C	.	.	H	α-helix	trans	-67.8	-37	171	-67	0	0	0	0	111.6	N269 L270 G276 N277	N269-S273 VanDerWaalsContact O-CB 3.3Å; N269-S273 WeakPolarHBondContact O-CB 3.4Å; N269-S273 PolarHBondContact O-N 2.62Å; N269-S273 PolarHBondContact O-OG 3.47Å; N269-S273 VanDerWaalsContact O-OG 3.09Å; L270-S273 PolarHBondContact O-N 2.85Å; S273-G276 CarbonylContact O-C 3.54Å; S273-G276 WeakPolarHBondContact O-CA 3.49Å; S273-G276 PolarHBondContact O-N 2.88Å; S273-N277 VanDerWaalsContact O-CG 3.25Å; S273-N277 PolarHBondContact O-N 3.37Å; S273-N277 PolarHBondContact O-OD1 3.37Å
274	A	89.4	Confident	83.5	Confident	3 Å²	3	32 Å²	32	3%	0.025	19%	0.185	C	C	.	.	H	α-helix	trans	-60.9	-46.4	171	0	0	0	0	0	111.3	L270 G276 N277 V278 D294 T298	L270-A274 WeakPolarHBondContact O-CB 3.4Å; L270-A274 PolarHBondContact O-N 3.31Å; A274-G276 PolarHBondContact O-N 2.84Å; A274-N277 PolarHBondContact O-N 3.21Å; A274-V278 WeakPolarHBondContact O-CG2 3.47Å; A274-V278 PolarHBondContact O-N 3.23Å; A274-D294 HydrophobicContact CB-CB 3.74Å; A274-T298 HydrophobicContact CB-CG2 4.11Å
275	L	91.4	Very high	84.1	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-58.2	-40.2	170.2	-156.2	77.1	0	0	0	110.6	L246 S271 L272 N277 V278 I279 L297 T298 L301 L305 Y333	L246-L275 HydrophobicContact CD1-CD2 3.93Å; S271-L275 PolarHBondContact O-N 2.68Å; L272-L275 WeakPolarHBondContact O-CB 3.34Å; L272-L275 PolarHBondContact O-N 3.06Å; L275-N277 PolarHBondContact O-N 3.45Å; L275-V278 PolarHBondContact O-N 3.38Å; L275-I279 WeakPolarHBondContact O-CG1 3.28Å; L275-I279 PolarHBondContact O-N 3.06Å; L275-L297 HydrophobicContact CD1-CD2 4.38Å; L275-T298 HydrophobicContact CB-CG2 4.2Å; L275-T298 HydrophobicContact CD1-CG2 3.87Å; L275-L301 HydrophobicContact CD1-CD1 4.2Å; L275-L305 HydrophobicContact CD1-CD1 3.68Å; L275-L305 HydrophobicContact CG-CD1 4.5Å; L275-Y333 HydrophobicContact CD2-CE1 4.45Å; L275-Y333 VanDerWaalsContact CG-OH 3.22Å; L275-Y333 WeakPolarHBondContact CG-OH 3.41Å; L275-Y333 PolarHBondContact O-OH 3.48Å
276	G	88.6	Confident	84.8	Confident	14 Å²	14	43.7 Å²	43.7	14%	0.144	26%	0.256	C	S	.	.	H	α-helix	trans	-47.7	-54.6	170.5	0	0	0	0	0	113.5	L272 S273 A274 S280 Y333	L272-G276 PolarHBondContact O-N 2.81Å; S273-G276 CarbonylContact O-C 3.54Å; S273-G276 WeakPolarHBondContact O-CA 3.49Å; S273-G276 PolarHBondContact O-N 2.88Å; A274-G276 PolarHBondContact O-N 2.84Å; G276-S280 WeakPolarHBondContact O-CB 3.41Å; G276-S280 PolarHBondContact O-N 2.86Å; G276-S280 VanDerWaalsContact O-N 3.11Å; G276-S280 PolarHBondContact O-OG 2.92Å; G276-Y333 PolarHBondContact N-OH 2.9Å
277	N	89	Confident	85.2	Confident	87 Å²	87	43.9 Å²	43.9	47%	0.465	26%	0.26	S	S	.	.	H	α-helix	trans	-69.6	-43.7	-178	-65.1	-16	0	0	0	111.7	S273 A274 L275 I279 S280 A281 P291	S273-N277 VanDerWaalsContact O-CG 3.25Å; S273-N277 PolarHBondContact O-N 3.37Å; S273-N277 PolarHBondContact O-OD1 3.37Å; A274-N277 PolarHBondContact O-N 3.21Å; L275-N277 PolarHBondContact O-N 3.45Å; N277-I279 PolarHBondContact O-N 3.04Å; N277-S280 PolarHBondContact O-N 2.66Å; N277-A281 WeakPolarHBondContact O-CB 3.49Å; N277-A281 PolarHBondContact O-N 3.46Å; N277-P291 HydrophobicContact CB-CG 4.03Å
278	V	92.4	Very high	85.6	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-57.9	-49	176.2	166.1	0	0	0	0	111.4	A274 L275 S280 A281 L282 I290 P291 Y292 T298 L305	A274-V278 WeakPolarHBondContact O-CG2 3.47Å; A274-V278 PolarHBondContact O-N 3.23Å; L275-V278 PolarHBondContact O-N 3.38Å; V278-S280 VanDerWaalsContact C-N 3.33Å; V278-S280 PolarHBondContact O-N 3.06Å; V278-A281 PolarHBondContact O-N 3.02Å; V278-L282 HydrophobicContact CG1-CD1 3.8Å; V278-L282 WeakPolarHBondContact O-CB 3.21Å; V278-L282 WeakPolarHBondContact O-CD1 3.42Å; V278-L282 VanDerWaalsContact O-CG 3.25Å; V278-L282 WeakPolarHBondContact O-CG 3.48Å; V278-L282 PolarHBondContact O-N 3.41Å; V278-I290 HydrophobicContact CB-CG2 4.35Å; V278-I290 HydrophobicContact CG1-CG2 3.91Å; V278-I290 HydrophobicContact CG2-CG2 4.26Å; V278-P291 HydrophobicContact CG2-CG 4.04Å; V278-P291 WeakPolarHBondContact CG2-O 3.48Å; V278-Y292 HydrophobicContact CG1-CD1 3.87Å; V278-Y292 HydrophobicContact CG1-CE1 3.63Å; V278-Y292 HydrophobicContact CG2-CD1 4.16Å; V278-T298 HydrophobicContact CB-CG2 4.34Å; V278-T298 HydrophobicContact CG2-CG2 3.77Å; V278-L305 HydrophobicContact CG1-CB 4.33Å; V278-L305 HydrophobicContact CG1-CD1 4.1Å
279	I	91.3	Very high	86.4	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-63.3	-40.2	177.5	-69.5	-155.3	0	0	0	111.3	L275 N277 L282 V283 L305 Y333 R336 A337 I340	L275-I279 WeakPolarHBondContact O-CG1 3.28Å; L275-I279 PolarHBondContact O-N 3.06Å; N277-I279 PolarHBondContact O-N 3.04Å; I279-L282 PolarHBondContact O-N 3.01Å; I279-V283 WeakPolarHBondContact O-CG1 3.48Å; I279-V283 WeakPolarHBondContact O-CG2 3.25Å; I279-V283 PolarHBondContact O-N 2.98Å; I279-L305 HydrophobicContact CD1-CD2 4.39Å; I279-L305 HydrophobicContact CG1-CD1 4.49Å; I279-Y333 HydrophobicContact CB-CE2 3.74Å; I279-Y333 HydrophobicContact CD1-CE1 4.05Å; I279-Y333 HydrophobicContact CD1-CE2 4.01Å; I279-Y333 VanDerWaalsContact CD1-OH 3.24Å; I279-Y333 WeakPolarHBondContact CD1-OH 3.4Å; I279-Y333 HydrophobicContact CG1-CE2 4.11Å; I279-Y333 WeakPolarHBondContact CG1-OH 3.23Å; I279-Y333 HydrophobicContact CG2-CD2 4.47Å; I279-Y333 HydrophobicContact CG2-CE2 3.93Å; I279-R336 HydrophobicContact CG2-CB 3.87Å; I279-A337 HydrophobicContact CD1-CB 3.72Å; I279-A337 HydrophobicContact CG2-CB 4.29Å; I279-I340 HydrophobicContact CB-CD1 4.14Å; I279-I340 HydrophobicContact CD1-CD1 3.81Å; I279-I340 HydrophobicContact CG1-CD1 3.68Å; I279-I340 HydrophobicContact CG2-CD1 4.04Å
280	S	88.6	Confident	87.2	Confident	37 Å²	37	53 Å²	53	26%	0.259	31%	0.313	S	S	.	.	H	α-helix	trans	-67.7	-42.8	-179.3	-56.2	0	0	0	0	112	G276 N277 V278 L282 V283 D284	G276-S280 WeakPolarHBondContact O-CB 3.41Å; G276-S280 PolarHBondContact O-N 2.86Å; G276-S280 VanDerWaalsContact O-N 3.11Å; G276-S280 PolarHBondContact O-OG 2.92Å; N277-S280 PolarHBondContact O-N 2.66Å; V278-S280 VanDerWaalsContact C-N 3.33Å; V278-S280 PolarHBondContact O-N 3.06Å; S280-L282 VanDerWaalsContact C-N 3.34Å; S280-L282 PolarHBondContact O-N 3.27Å; S280-V283 WeakPolarHBondContact O-CG2 3.35Å; S280-V283 PolarHBondContact O-N 3.34Å; S280-D284 PolarHBondContact O-N 3.2Å; S280-D284 VanDerWaalsContact O-N 3.12Å
281	A	91.2	Very high	87.7	Confident	11 Å²	11	49.5 Å²	49.5	9%	0.091	30%	0.296	C	S	.	.	H	α-helix	trans	-66.3	-32.1	175.4	0	0	0	0	0	112.9	N277 V278 V283 I290	N277-A281 WeakPolarHBondContact O-CB 3.49Å; N277-A281 PolarHBondContact O-N 3.46Å; V278-A281 PolarHBondContact O-N 3.02Å; A281-V283 VanDerWaalsContact C-N 3.28Å; A281-V283 PolarHBondContact O-N 3.3Å; A281-I290 HydrophobicContact CB-CD1 3.75Å
282	L	91	Very high	88	Confident	42 Å²	42	51.1 Å²	51.1	22%	0.22	30%	0.302	C	S	.	.	H	α-helix	trans	-71.5	-19.3	177	-78.4	167.6	0	0	0	114	V278 I279 S280 I290 L305 I340	V278-L282 HydrophobicContact CG1-CD1 3.8Å; V278-L282 WeakPolarHBondContact O-CB 3.21Å; V278-L282 WeakPolarHBondContact O-CD1 3.42Å; V278-L282 VanDerWaalsContact O-CG 3.25Å; V278-L282 WeakPolarHBondContact O-CG 3.48Å; V278-L282 PolarHBondContact O-N 3.41Å; I279-L282 PolarHBondContact O-N 3.01Å; S280-L282 VanDerWaalsContact C-N 3.34Å; S280-L282 PolarHBondContact O-N 3.27Å; L282-I290 HydrophobicContact CD1-CG2 4.5Å; L282-I290 HydrophobicContact CD2-CD1 4Å; L282-I290 HydrophobicContact CD2-CG1 3.98Å; L282-I290 HydrophobicContact CD2-CG2 4.32Å; L282-I290 HydrophobicContact CG-CD1 4.17Å; L282-I290 HydrophobicContact CG-CG1 4.41Å; L282-I290 HydrophobicContact CG-CG2 4.03Å; L282-L305 HydrophobicContact CD1-CB 3.87Å; L282-L305 WeakPolarHBondContact CD1-O 3.42Å; L282-I340 HydrophobicContact CB-CG1 4.08Å; L282-I340 HydrophobicContact CB-CG2 4.49Å; L282-I340 HydrophobicContact CD1-CD1 4.19Å; L282-I340 HydrophobicContact CD1-CG1 4.43Å; L282-I340 HydrophobicContact CD1-CG2 4.1Å
283	V	89.6	Confident	88.3	Confident	47 Å²	47	58.5 Å²	58.5	29%	0.285	33%	0.329	S	S	.	.	H	α-helix	trans	-113.8	-12.5	-175.1	-54.7	0	0	0	0	114.3	I279 S280 A281 G285 R336 N339 I340	I279-V283 WeakPolarHBondContact O-CG1 3.48Å; I279-V283 WeakPolarHBondContact O-CG2 3.25Å; I279-V283 PolarHBondContact O-N 2.98Å; S280-V283 WeakPolarHBondContact O-CG2 3.35Å; S280-V283 PolarHBondContact O-N 3.34Å; A281-V283 VanDerWaalsContact C-N 3.28Å; A281-V283 PolarHBondContact O-N 3.3Å; V283-G285 VanDerWaalsContact C-N 3.26Å; V283-G285 PolarHBondContact O-N 2.98Å; V283-R336 WeakPolarHBondContact CG1-O 3.49Å; V283-R336 HydrophobicContact CG2-CB 4.34Å; V283-N339 HydrophobicContact CB-CB 4.31Å; V283-N339 HydrophobicContact CG1-CB 3.9Å; V283-I340 HydrophobicContact CG1-CG1 3.73Å
284	D	84.8	Confident	88.5	Confident	65 Å²	65	59.2 Å²	59.2	35%	0.348	33%	0.327	S	S	.	.	S	Bend	trans	-70.2	-20.8	179.9	70.7	18.8	0	0	0	113.9	S280 K286 S287	S280-D284 PolarHBondContact O-N 3.2Å; S280-D284 VanDerWaalsContact O-N 3.12Å; D284-K286 PolarHBondContact O-N 2.96Å; D284-K286 PolarHBondContact OD1-N 3.07Å; D284-S287 WeakPolarHBondContact OD1-CB 3.32Å; D284-S287 PolarHBondContact OD1-N 3.1Å; D284-S287 WeakPolarHBondContact OD2-CB 3.37Å; D284-S287 PolarHBondContact OD2-OG 2.94Å
285	G	79.1	Confident	88.6	Confident	80 Å²	80	59.2 Å²	59.2	83%	0.825	33%	0.327	S	S	*	.	S	Bend	trans	67.2	9.7	-177.6	0	0	0	0	0	115.1	V283	V283-G285 VanDerWaalsContact C-N 3.26Å; V283-G285 PolarHBondContact O-N 2.98Å
286	K	84.3	Confident	88.6	Confident	179 Å²	179	61.6 Å²	61.6	78%	0.778	34%	0.338	S	S	*	.			trans	-120.4	-34	-174.2	-64.5	170.2	-171.6	173.1	0	112.2	D284 T288	D284-K286 PolarHBondContact O-N 2.96Å; D284-K286 PolarHBondContact OD1-N 3.07Å; K286-T288 PolarHBondContact O-N 3.09Å
287	S	79.2	Confident	88.7	Confident	53 Å²	53	61 Å²	61	37%	0.371	33%	0.331	S	S	.	.			trans	-70.8	115	-178.8	-73.1	0	0	0	0	110.8	D284	D284-S287 WeakPolarHBondContact OD1-CB 3.32Å; D284-S287 PolarHBondContact OD1-N 3.1Å; D284-S287 WeakPolarHBondContact OD2-CB 3.37Å; D284-S287 PolarHBondContact OD2-OG 2.94Å
288	T	83.9	Confident	88.9	Confident	149 Å²	149	56.8 Å²	56.8	91%	0.914	31%	0.309	S	S	*	.	S	Bend	trans	-81.7	-30	175.4	-55.1	0	0	0	0	111.9	K286	K286-T288 PolarHBondContact O-N 3.09Å
289	H	89.4	Confident	88.9	Confident	142 Å²	142	58.3 Å²	58.3	66%	0.657	31%	0.314	S	S	*	.	S	Bend	trans	-107.9	130	176.5	179.3	-92.3	0	0	0	109.7
290	I	91	Very high	89	Confident	30 Å²	30	59.7 Å²	59.7	15%	0.154	32%	0.322	C	S	.	.			trans	-104.7	126.2	177.4	-51.7	-58.7	0	0	0	108.4	V278 A281 L282 Y292	V278-I290 HydrophobicContact CB-CG2 4.35Å; V278-I290 HydrophobicContact CG1-CG2 3.91Å; V278-I290 HydrophobicContact CG2-CG2 4.26Å; A281-I290 HydrophobicContact CB-CD1 3.75Å; L282-I290 HydrophobicContact CD1-CG2 4.5Å; L282-I290 HydrophobicContact CD2-CD1 4Å; L282-I290 HydrophobicContact CD2-CG1 3.98Å; L282-I290 HydrophobicContact CD2-CG2 4.32Å; L282-I290 HydrophobicContact CG-CD1 4.17Å; L282-I290 HydrophobicContact CG-CG1 4.41Å; L282-I290 HydrophobicContact CG-CG2 4.03Å; I290-Y292 HydrophobicContact CB-CD2 3.98Å; I290-Y292 HydrophobicContact CB-CE2 3.51Å; I290-Y292 HydrophobicContact CG1-CE2 4.29Å; I290-Y292 HydrophobicContact CG2-CD1 4.23Å; I290-Y292 HydrophobicContact CG2-CD2 3.99Å; I290-Y292 HydrophobicContact CG2-CE1 3.8Å; I290-Y292 HydrophobicContact CG2-CE2 3.55Å; I290-Y292 HydrophobicContact CG2-CG 4.31Å; I290-Y292 VanDerWaalsContact CG2-CZ 3.43Å; I290-Y292 PolarHBondContact O-N 3.48Å
291	P	91.9	Very high	89.1	Confident	20 Å²	20	58.1 Å²	58.1	13%	0.13	31%	0.31	C	S	.	.			trans	-79.1	55.3	-170	32.7	-37	0	0	0	113.4	N277 V278 R293 D294	N277-P291 HydrophobicContact CB-CG 4.03Å; V278-P291 HydrophobicContact CG2-CG 4.04Å; V278-P291 WeakPolarHBondContact CG2-O 3.48Å; P291-R293 PolarHBondContact O-N 2.83Å; P291-D294 WeakPolarHBondContact CB-OD1 3.46Å; P291-D294 PolarHBondContact O-N 2.91Å
292	Y	92.4	Very high	89.2	Confident	35 Å²	35	60.1 Å²	60.1	14%	0.137	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-63.8	-25.1	178.7	-60.7	-72	0	0	0	113.1	V278 I290 T298 R299 Q302 L305	V278-Y292 HydrophobicContact CG1-CD1 3.87Å; V278-Y292 HydrophobicContact CG1-CE1 3.63Å; V278-Y292 HydrophobicContact CG2-CD1 4.16Å; I290-Y292 HydrophobicContact CB-CD2 3.98Å; I290-Y292 HydrophobicContact CB-CE2 3.51Å; I290-Y292 HydrophobicContact CG1-CE2 4.29Å; I290-Y292 HydrophobicContact CG2-CD1 4.23Å; I290-Y292 HydrophobicContact CG2-CD2 3.99Å; I290-Y292 HydrophobicContact CG2-CE1 3.8Å; I290-Y292 HydrophobicContact CG2-CE2 3.55Å; I290-Y292 HydrophobicContact CG2-CG 4.31Å; I290-Y292 VanDerWaalsContact CG2-CZ 3.43Å; I290-Y292 PolarHBondContact O-N 3.48Å; Y292-T298 CarbonylContact O-C 3.57Å; Y292-T298 VanDerWaalsContact O-CB 3.28Å; Y292-T298 WeakPolarHBondContact O-CB 3.32Å; Y292-T298 PolarHBondContact O-OG1 2.79Å; Y292-R299 WeakPolarHBondContact O-CG 3.33Å; Y292-R299 PolarHBondContact O-N 3.01Å; Y292-R299 VanDerWaalsContact O-N 3.08Å; Y292-Q302 HydrophobicContact CD1-CB 3.97Å; Y292-Q302 HydrophobicContact CD1-CG 3.92Å; Y292-Q302 HydrophobicContact CD2-CG 3.83Å; Y292-Q302 HydrophobicContact CE1-CB 4.35Å; Y292-Q302 HydrophobicContact CE1-CG 4.11Å; Y292-Q302 HydrophobicContact CE2-CG 4Å; Y292-Q302 HydrophobicContact CG-CB 4.17Å; Y292-Q302 HydrophobicContact CG-CG 3.78Å; Y292-L305 HydrophobicContact CE1-CB 4.5Å; Y292-L305 PolarHBondContact OH-O 3.39Å
293	R	91	Very high	89.1	Confident	166 Å²	166	61 Å²	61	63%	0.626	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-76	-18.6	-175.3	-70.4	-173.1	171.4	-156.4	-4.5	114.2	E168 P291 S295	E168-R293 IonicContact OE2-NH2 3.73Å; P291-R293 PolarHBondContact O-N 2.83Å; R293-S295 PolarHBondContact O-N 3.43Å
294	D	88.9	Confident	89.2	Confident	82 Å²	82	58.9 Å²	58.9	44%	0.439	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-59.2	-20.4	-176.5	-66.7	24.5	0	0	0	114.3	A274 P291	A274-D294 HydrophobicContact CB-CB 3.74Å; P291-D294 WeakPolarHBondContact CB-OD1 3.46Å; P291-D294 PolarHBondContact O-N 2.91Å
295	S	90.7	Very high	89.5	Confident	3 Å²	3	55.9 Å²	55.9	2%	0.021	29%	0.294	C	S	.	.			trans	-148.4	154.8	170.6	73.7	0	0	0	0	112.8	E150 R293 L297 T298 R299	E150-S295 VanDerWaalsContact OE2-CA 3.24Å; E150-S295 WeakPolarHBondContact OE2-CA 3.39Å; E150-S295 WeakPolarHBondContact OE2-CB 3.46Å; R293-S295 PolarHBondContact O-N 3.43Å; S295-L297 PolarHBondContact O-N 2.86Å; S295-T298 PolarHBondContact N-OG1 2.85Å; S295-T298 PolarHBondContact O-N 2.83Å; S295-T298 PolarHBondContact O-OG1 2.85Å; S295-T298 PolarHBondContact OG-N 2.83Å; S295-T298 PolarHBondContact OG-OG1 2.74Å; S295-R299 WeakPolarHBondContact O-CG 3.28Å; S295-R299 PolarHBondContact O-N 3.15Å
296	K	91.2	Very high	89.9	Confident	52 Å²	52	53.2 Å²	53.2	23%	0.226	27%	0.266	C	S	.	.	H	α-helix	trans	-61	-31.2	172.1	-55.9	-70.8	178.6	163.3	0	111.2	I147 E150 I152 L166 L300	I147-K296 HydrophobicContact CG2-CB 4.43Å; E150-K296 WeakPolarHBondContact O-CG 3.31Å; E150-K296 WeakPolarHBondContact OE2-CG 3.16Å; E150-K296 PolarHBondContact OE2-N 3Å; I152-K296 HydrophobicContact CD1-CB 4.48Å; L166-K296 HydrophobicContact CD1-CB 3.96Å; L166-K296 HydrophobicContact CD1-CD 3.73Å; L166-K296 HydrophobicContact CD1-CG 4.41Å; L166-K296 HydrophobicContact CG-CD 4.15Å; K296-L300 WeakPolarHBondContact O-CG 3.28Å; K296-L300 PolarHBondContact O-N 3.01Å; K296-L300 VanDerWaalsContact O-N 3.1Å
297	L	92.1	Very high	90.2	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.5	-52.1	174.4	177.2	67.1	0	0	0	111.6	I147 H216 I218 L246 L275 S295 R299 L300 L301	I147-L297 HydrophobicContact CD1-CB 3.98Å; I147-L297 HydrophobicContact CD1-CD1 3.99Å; H216-L297 HydrophobicContact CB-CD1 4.29Å; I218-L297 HydrophobicContact CD1-CD1 4.29Å; L246-L297 HydrophobicContact CD2-CD1 3.82Å; L246-L297 HydrophobicContact CD2-CD2 3.84Å; L246-L297 HydrophobicContact CD2-CG 4.46Å; L275-L297 HydrophobicContact CD1-CD2 4.38Å; S295-L297 PolarHBondContact O-N 2.86Å; L297-R299 VanDerWaalsContact C-N 3.32Å; L297-R299 PolarHBondContact O-N 2.92Å; L297-L300 PolarHBondContact O-N 2.7Å; L297-L301 HydrophobicContact CD1-CD1 3.75Å; L297-L301 HydrophobicContact CD1-CG 4.28Å; L297-L301 HydrophobicContact CG-CD1 4.19Å; L297-L301 WeakPolarHBondContact O-CG 3.45Å; L297-L301 PolarHBondContact O-N 3.08Å
298	T	92.8	Very high	90.7	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-66.3	-32.4	-180	44.9	0	0	0	0	112.6	A274 L275 V278 Y292 S295 L301 Q302	A274-T298 HydrophobicContact CB-CG2 4.11Å; L275-T298 HydrophobicContact CB-CG2 4.2Å; L275-T298 HydrophobicContact CD1-CG2 3.87Å; V278-T298 HydrophobicContact CB-CG2 4.34Å; V278-T298 HydrophobicContact CG2-CG2 3.77Å; Y292-T298 CarbonylContact O-C 3.57Å; Y292-T298 VanDerWaalsContact O-CB 3.28Å; Y292-T298 WeakPolarHBondContact O-CB 3.32Å; Y292-T298 PolarHBondContact O-OG1 2.79Å; S295-T298 PolarHBondContact N-OG1 2.85Å; S295-T298 PolarHBondContact O-N 2.83Å; S295-T298 PolarHBondContact O-OG1 2.85Å; S295-T298 PolarHBondContact OG-N 2.83Å; S295-T298 PolarHBondContact OG-OG1 2.74Å; T298-L301 CarbonylContact O-C 3.59Å; T298-L301 PolarHBondContact O-N 3.33Å; T298-Q302 PolarHBondContact O-N 3.17Å
299	R	92.4	Very high	91.2	Very high	32 Å²	32	36.6 Å²	36.6	12%	0.121	18%	0.181	C	C	.	.	H	α-helix	trans	-64.1	-43.1	170.9	-69.3	-173.4	70.6	-179.7	-0.8	112.2	L166 E168 V174 Y292 S295 L297 L301 Q302	L166-R299 HydrophobicContact CD1-CB 3.71Å; L166-R299 HydrophobicContact CD1-CG 4.49Å; E168-R299 IonicContact OE2-NH2 2.85Å; V174-R299 HydrophobicContact CG1-CB 4.41Å; Y292-R299 WeakPolarHBondContact O-CG 3.33Å; Y292-R299 PolarHBondContact O-N 3.01Å; Y292-R299 VanDerWaalsContact O-N 3.08Å; S295-R299 WeakPolarHBondContact O-CG 3.28Å; S295-R299 PolarHBondContact O-N 3.15Å; L297-R299 VanDerWaalsContact C-N 3.32Å; L297-R299 PolarHBondContact O-N 2.92Å; R299-L301 VanDerWaalsContact C-N 3.34Å; R299-Q302 WeakPolarHBondContact O-CB 3.45Å; R299-Q302 PolarHBondContact O-N 2.88Å
300	L	92.6	Very high	91.4	Very high	29 Å²	29	31.5 Å²	31.5	15%	0.152	16%	0.157	C	C	.	.	H	α-helix	trans	-70.8	-28.1	177.8	-79.5	168.5	0	0	0	113.6	L145 I147 I152 L166 V176 I218 K296 L297	L145-L300 HydrophobicContact CD1-CD1 4.4Å; I147-L300 HydrophobicContact CD1-CD1 3.82Å; I147-L300 HydrophobicContact CG1-CD1 4.49Å; I152-L300 HydrophobicContact CD1-CD1 4Å; L166-L300 HydrophobicContact CD1-CG 4.31Å; L166-L300 HydrophobicContact CD2-CD1 4.11Å; L166-L300 HydrophobicContact CD2-CD2 3.67Å; L166-L300 HydrophobicContact CD2-CG 3.77Å; V176-L300 HydrophobicContact CG2-CD1 4.37Å; V176-L300 HydrophobicContact CG2-CD2 3.75Å; I218-L300 HydrophobicContact CD1-CD1 4.42Å; K296-L300 WeakPolarHBondContact O-CG 3.28Å; K296-L300 PolarHBondContact O-N 3.01Å; K296-L300 VanDerWaalsContact O-N 3.1Å; L297-L300 PolarHBondContact O-N 2.7Å
301	L	92.5	Very high	91.7	Very high	4 Å²	4	30.1 Å²	30.1	2%	0.021	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.2	9.3	178.4	-60.6	-177.7	0	0	0	113.8	T91 V244 L275 L297 T298 R299 D303 S304 L305	T91-L301 HydrophobicContact CG2-CD2 4.26Å; V244-L301 HydrophobicContact CG2-CD2 4.05Å; L275-L301 HydrophobicContact CD1-CD1 4.2Å; L297-L301 HydrophobicContact CD1-CD1 3.75Å; L297-L301 HydrophobicContact CD1-CG 4.28Å; L297-L301 HydrophobicContact CG-CD1 4.19Å; L297-L301 WeakPolarHBondContact O-CG 3.45Å; L297-L301 PolarHBondContact O-N 3.08Å; T298-L301 CarbonylContact O-C 3.59Å; T298-L301 PolarHBondContact O-N 3.33Å; R299-L301 VanDerWaalsContact C-N 3.34Å; L301-D303 VanDerWaalsContact C-N 3.33Å; L301-D303 PolarHBondContact O-N 3.47Å; L301-S304 WeakPolarHBondContact O-CA 3.23Å; L301-S304 VanDerWaalsContact O-CB 3.28Å; L301-S304 WeakPolarHBondContact O-CB 3.26Å; L301-S304 PolarHBondContact O-N 2.87Å; L301-L305 HydrophobicContact CB-CD1 4.4Å; L301-L305 PolarHBondContact O-N 3.07Å; L301-L305 VanDerWaalsContact O-N 3.09Å
302	Q	92.1	Very high	91.9	Very high	52 Å²	52	29.2 Å²	29.2	24%	0.243	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-44	179.9	-179	172.7	-47.1	0	0	112.6	Y292 T298 R299 S304	Y292-Q302 HydrophobicContact CD1-CB 3.97Å; Y292-Q302 HydrophobicContact CD1-CG 3.92Å; Y292-Q302 HydrophobicContact CD2-CG 3.83Å; Y292-Q302 HydrophobicContact CE1-CB 4.35Å; Y292-Q302 HydrophobicContact CE1-CG 4.11Å; Y292-Q302 HydrophobicContact CE2-CG 4Å; Y292-Q302 HydrophobicContact CG-CB 4.17Å; Y292-Q302 HydrophobicContact CG-CG 3.78Å; T298-Q302 PolarHBondContact O-N 3.17Å; R299-Q302 WeakPolarHBondContact O-CB 3.45Å; R299-Q302 PolarHBondContact O-N 2.88Å; Q302-S304 VanDerWaalsContact C-N 3.25Å; Q302-S304 PolarHBondContact O-N 3.18Å
303	D	89.9	Confident	92.1	Very high	61 Å²	61	27.5 Å²	27.5	33%	0.326	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-24.5	174.8	-78.2	-49.3	0	0	0	113.7	L301 G307 N308 A309	L301-D303 VanDerWaalsContact C-N 3.33Å; L301-D303 PolarHBondContact O-N 3.47Å; D303-G307 CarbonylContact O-C 3.54Å; D303-G307 VanDerWaalsContact O-CA 3.3Å; D303-G307 WeakPolarHBondContact O-CA 3.38Å; D303-N308 CarbonylContact O-C 3.58Å; D303-N308 PolarHBondContact O-N 3.1Å; D303-A309 WeakPolarHBondContact O-CB 3.44Å; D303-A309 PolarHBondContact O-N 3.36Å
304	S	91.9	Very high	92.4	Very high	2 Å²	2	19.6 Å²	19.6	1%	0.014	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-25.4	-177.8	-50.8	0	0	0	0	113	T91 L301 Q302 T311 N342	T91-S304 WeakPolarHBondContact CB-OG 3.09Å; T91-S304 PolarHBondContact OG1-OG 3.3Å; L301-S304 WeakPolarHBondContact O-CA 3.23Å; L301-S304 VanDerWaalsContact O-CB 3.28Å; L301-S304 WeakPolarHBondContact O-CB 3.26Å; L301-S304 PolarHBondContact O-N 2.87Å; Q302-S304 VanDerWaalsContact C-N 3.25Å; Q302-S304 PolarHBondContact O-N 3.18Å; S304-T311 WeakPolarHBondContact O-CB 3.39Å; S304-T311 PolarHBondContact O-OG1 2.86Å; S304-N342 PolarHBondContact O-ND2 3.4Å
305	L	91.2	Very high	92.8	Very high	2 Å²	2	15.7 Å²	15.7	1%	0.01	9%	0.087	C	C	.	.	S	Bend	trans	-118.7	90.2	-174.2	-61.2	176.3	0	0	0	109	F93 L275 V278 I279 L282 Y292 L301 I340	F93-L305 HydrophobicContact CE1-CD2 4.25Å; F93-L305 HydrophobicContact CZ-CD2 4.39Å; L275-L305 HydrophobicContact CD1-CD1 3.68Å; L275-L305 HydrophobicContact CG-CD1 4.5Å; V278-L305 HydrophobicContact CG1-CB 4.33Å; V278-L305 HydrophobicContact CG1-CD1 4.1Å; I279-L305 HydrophobicContact CD1-CD2 4.39Å; I279-L305 HydrophobicContact CG1-CD1 4.49Å; L282-L305 HydrophobicContact CD1-CB 3.87Å; L282-L305 WeakPolarHBondContact CD1-O 3.42Å; Y292-L305 HydrophobicContact CE1-CB 4.5Å; Y292-L305 PolarHBondContact OH-O 3.39Å; L301-L305 HydrophobicContact CB-CD1 4.4Å; L301-L305 PolarHBondContact O-N 3.07Å; L301-L305 VanDerWaalsContact O-N 3.09Å; L305-I340 HydrophobicContact CD2-CD1 4.15Å
306	G	86.8	Confident	93.1	Very high	24 Å²	24	15.6 Å²	15.6	25%	0.247	9%	0.086	C	C	.	.	S	Bend	trans	89.4	-6	-177.8	0	0	0	0	0	115.5	N342	G306-N342 WeakPolarHBondContact CA-OD1 3.28Å; G306-N342 PolarHBondContact N-OD1 2.99Å
307	G	89.5	Confident	93.3	Very high	20 Å²	20	13.2 Å²	13.2	21%	0.206	8%	0.075	C	C	.	.	S	Bend	trans	-100.6	-150.1	-175.2	0	0	0	0	0	115.9	D303 A309 K343	D303-G307 CarbonylContact O-C 3.54Å; D303-G307 VanDerWaalsContact O-CA 3.3Å; D303-G307 WeakPolarHBondContact O-CA 3.38Å; G307-A309 PolarHBondContact O-N 3.07Å; G307-K343 PolarHBondContact O-N 2.88Å
308	N	91.3	Very high	93.3	Very high	13 Å²	13	13.2 Å²	13.2	7%	0.07	8%	0.075	C	C	.	.	S	Bend	trans	-90.4	72.4	178.3	176.9	29.6	0	0	0	111.6	N89 D303 R345 N347	N89-N308 VanDerWaalsContact CB-O 3.28Å; N89-N308 WeakPolarHBondContact CB-O 3.4Å; N89-N308 PolarHBondContact ND2-O 2.88Å; D303-N308 CarbonylContact O-C 3.58Å; D303-N308 PolarHBondContact O-N 3.1Å; N308-R345 VanDerWaalsContact CG-CG 3.49Å; N308-R345 WeakPolarHBondContact ND2-CG 3.46Å; N308-R345 PolarHBondContact ND2-NE 3.3Å; N308-R345 WeakPolarHBondContact OD1-CG 3.48Å; N308-R345 PolarHBondContact OD1-N 3.47Å; N308-R345 PolarHBondContact OD1-O 3.47Å; N308-N347 PolarHBondContact ND2-OD1 3.22Å
309	A	92.9	Very high	93.4	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	8%	0.077	C	C	.	.	S	Bend	trans	-156.9	154.6	166.2	0	0	0	0	0	111.7	N89 D303 G307 N342	N89-A309 HydrophobicContact CB-CB 3.76Å; N89-A309 CarbonylContact O-C 3.56Å; N89-A309 WeakPolarHBondContact O-CA 3.33Å; D303-A309 WeakPolarHBondContact O-CB 3.44Å; D303-A309 PolarHBondContact O-N 3.36Å; G307-A309 PolarHBondContact O-N 3.07Å; A309-N342 VanDerWaalsContact O-CB 3.27Å; A309-N342 WeakPolarHBondContact O-CB 3.34Å; A309-N342 PolarHBondContact O-ND2 3.21Å
310	K	95.2	Very high	93.4	Very high	34 Å²	34	11.9 Å²	11.9	15%	0.148	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	141.6	157.5	-60.3	-167.5	-176.7	-175.3	0	108.1	E8 L80 S83 N89 G90 T91 P344	E8-K310 WeakPolarHBondContact OE2-CD 3.3Å; E8-K310 WeakPolarHBondContact OE2-CE 3.4Å; E8-K310 WeakPolarHBondContact OE2-CG 3.47Å; E8-K310 IonicContact OE2-NZ 2.76Å; L80-K310 HydrophobicContact CD1-CB 3.45Å; L80-K310 VanDerWaalsContact CD1-CB 3.45Å; S83-K310 WeakPolarHBondContact OG-CD 3.28Å; S83-K310 PolarHBondContact OG-NZ 3.39Å; N89-K310 PolarHBondContact O-N 3.41Å; G90-K310 CarbonylContact C-O 3.58Å; G90-K310 VanDerWaalsContact CA-O 3.31Å; G90-K310 WeakPolarHBondContact CA-O 3.42Å; T91-K310 PolarHBondContact N-O 3.4Å; K310-P344 HydrophobicContact CG-CB 3.67Å; K310-P344 HydrophobicContact CG-CG 3.92Å
311	T	96.5	Very high	93.4	Very high	2 Å²	2	11.3 Å²	11.3	1%	0.012	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	138	-173.6	-61.7	0	0	0	0	111.9	V10 R11 T91 F93 S304 N342	V10-T311 HydrophobicContact CG1-CG2 4.06Å; R11-T311 PolarHBondContact N-O 3.11Å; T91-T311 HydrophobicContact CG2-CG2 4.32Å; T91-T311 CarbonylContact O-C 3.39Å; T91-T311 WeakPolarHBondContact O-CA 3.32Å; F93-T311 HydrophobicContact CD1-CG2 3.93Å; F93-T311 HydrophobicContact CE1-CG2 3.65Å; S304-T311 WeakPolarHBondContact O-CB 3.39Å; S304-T311 PolarHBondContact O-OG1 2.86Å; T311-N342 PolarHBondContact OG1-ND2 2.87Å
312	V	96.7	Very high	93.2	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	121.5	176.4	173.3	0	0	0	0	108.8	R11 T76 F77 L80 T91 I92 F93 V314	R11-V312 HydrophobicContact CB-CG2 4.17Å; R11-V312 CarbonylContact O-C 3.54Å; R11-V312 VanDerWaalsContact O-CA 3.28Å; R11-V312 WeakPolarHBondContact O-CA 3.47Å; T76-V312 HydrophobicContact CG2-CG1 3.68Å; T76-V312 HydrophobicContact CG2-CG2 4.41Å; F77-V312 HydrophobicContact CD1-CG1 4.07Å; F77-V312 HydrophobicContact CE1-CG1 3.81Å; L80-V312 HydrophobicContact CD1-CG2 4.22Å; T91-V312 PolarHBondContact O-N 3.24Å; I92-V312 WeakPolarHBondContact CA-O 3.39Å; I92-V312 HydrophobicContact CG1-CB 4.48Å; F93-V312 PolarHBondContact N-O 2.89Å; V312-V314 HydrophobicContact CG1-CG2 4.34Å
313	M	96.6	Very high	93	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	131.5	167.7	179.5	176.1	-179.5	0	0	109.8	R11 V12 V13 F93 Y95 A315 Y333 A334 A337	R11-M313 PolarHBondContact O-N 2.89Å; V12-M313 HydrophobicContact CG1-CB 4.31Å; V12-M313 HydrophobicContact CG1-CG 4.41Å; V12-M313 HydrophobicContact CG1-SD 4.3Å; V12-M313 HydrophobicContact CG2-CB 4.11Å; V13-M313 PolarHBondContact N-O 2.63Å; F93-M313 HydrophobicContact CD2-CG 4.16Å; F93-M313 HydrophobicContact CE1-CB 3.88Å; F93-M313 HydrophobicContact CE1-CG 4.39Å; F93-M313 HydrophobicContact CE2-CB 3.88Å; F93-M313 HydrophobicContact CE2-CE 4.28Å; F93-M313 HydrophobicContact CE2-CG 3.45Å; F93-M313 VanDerWaalsContact CE2-CG 3.45Å; F93-M313 HydrophobicContact CE2-SD 3.86Å; F93-M313 HydrophobicContact CZ-CB 3.52Å; F93-M313 HydrophobicContact CZ-CG 3.6Å; F93-M313 HydrophobicContact CZ-SD 3.91Å; Y95-M313 HydrophobicContact CD1-CE 3.68Å; Y95-M313 HydrophobicContact CG-CE 3.79Å; M313-A315 HydrophobicContact CE-CB 4.44Å; M313-Y333 HydrophobicContact CE-CD1 3.7Å; M313-Y333 HydrophobicContact CE-CE1 4.11Å; M313-A334 HydrophobicContact CE-CB 3.96Å; M313-A334 HydrophobicContact SD-CB 4.26Å; M313-A337 HydrophobicContact SD-CB 3.5Å; M313-A337 WeakPolarHBondContact SD-CB 3.46Å
314	V	97	Very high	93	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	106.1	170.2	-173.8	0	0	0	0	108.6	V13 F77 I92 F93 A94 Y95 T105 V312 N316	V13-V314 HydrophobicContact CG2-CB 4.4Å; V13-V314 HydrophobicContact CG2-CG1 4.33Å; V13-V314 HydrophobicContact CG2-CG2 4.04Å; V13-V314 WeakPolarHBondContact O-CA 3.26Å; F77-V314 HydrophobicContact CE1-CG2 3.53Å; F77-V314 HydrophobicContact CZ-CG2 3.54Å; I92-V314 HydrophobicContact CG2-CG2 4.2Å; F93-V314 PolarHBondContact O-N 3.06Å; A94-V314 WeakPolarHBondContact CA-O 3.28Å; Y95-V314 PolarHBondContact N-O 3.46Å; T105-V314 HydrophobicContact CG2-CG1 4.08Å; V312-V314 HydrophobicContact CG1-CG2 4.34Å; V314-N316 PolarHBondContact O-N 3.35Å
315	A	96.9	Very high	92.8	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	102.5	176	0	0	0	0	0	109.9	V13 V14 R15 M313 T330 A334	V13-A315 PolarHBondContact O-N 3.47Å; V14-A315 CarbonylContact C-O 3.57Å; V14-A315 WeakPolarHBondContact CA-O 3.48Å; V14-A315 HydrophobicContact CG2-CB 4.15Å; R15-A315 PolarHBondContact N-O 2.85Å; M313-A315 HydrophobicContact CE-CB 4.44Å; A315-T330 HydrophobicContact CB-CG2 4.07Å; A315-A334 HydrophobicContact CB-CB 3.78Å
316	N	96.3	Very high	92.6	Very high	1 Å²	1	18 Å²	18	1%	0.005	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	123.5	178.2	-70.4	107.4	0	0	0	110.7	R15 Y95 T100 K102 T105 V314	R15-N316 WeakPolarHBondContact O-CA 3.29Å; Y95-N316 PolarHBondContact O-N 3.39Å; T100-N316 WeakPolarHBondContact CB-O 3.49Å; T100-N316 VanDerWaalsContact OG1-CB 3.3Å; T100-N316 WeakPolarHBondContact OG1-CB 3.4Å; T100-N316 PolarHBondContact OG1-O 3.05Å; K102-N316 WeakPolarHBondContact CA-OD1 3.46Å; K102-N316 HydrophobicContact CG-CB 4.12Å; T105-N316 PolarHBondContact OG1-ND2 3.42Å; T105-N316 VanDerWaalsContact OG1-ND2 3.08Å; V314-N316 PolarHBondContact O-N 3.35Å
317	V	95.6	Very high	92.9	Very high	1 Å²	1	17 Å²	17	1%	0.006	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	154.6	-178.1	-62.2	0	0	0	0	112.5	V14 R15 C16 R17 T327 T330 L331	V14-V317 HydrophobicContact CG1-CG1 4.44Å; V14-V317 HydrophobicContact CG1-CG2 3.77Å; R15-V317 PolarHBondContact O-N 2.87Å; C16-V317 HydrophobicContact CB-CG2 3.88Å; R17-V317 PolarHBondContact N-O 3.16Å; V317-T327 HydrophobicContact CB-CG2 3.97Å; V317-T327 HydrophobicContact CG1-CG2 4.03Å; V317-T330 HydrophobicContact CG1-CG2 3.68Å; V317-L331 HydrophobicContact CG1-CD2 4.35Å; V317-L331 HydrophobicContact CG1-CG 4.36Å
318	G	93.4	Very high	92.9	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.08	C	C	.	.			trans	-100	146.3	174.7	0	0	0	0	0	111.6	V32 T327	V32-G318 WeakPolarHBondContact CG2-O 3.21Å; G318-T327 PolarHBondContact O-OG1 2.87Å
319	P	94	Very high	92.8	Very high	4 Å²	4	17.8 Å²	17.8	3%	0.026	9%	0.085	C	C	.	.			trans	-81.2	-12.6	-176.6	31.6	-35.7	0	0	0	114.5	R17 M19 K30 V31	R17-P319 WeakPolarHBondContact O-CD 3.44Å; R17-P319 WeakPolarHBondContact O-CG 3.48Å; M19-P319 HydrophobicContact CB-CG 3.82Å; M19-P319 HydrophobicContact CG-CG 4.45Å; K30-P319 CarbonylContact C-O 3.56Å; K30-P319 WeakPolarHBondContact CA-O 3.37Å; K30-P319 HydrophobicContact CG-CB 4.31Å; V31-P319 PolarHBondContact N-O 3.01Å
320	A	93	Very high	92.8	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.086	C	C	.	.	B	Isolated β-bridge	trans	-83	139.9	-166.4	0	0	0	0	0	114	M19 E23 Y28 D29 Y322 N323	M19-A320 HydrophobicContact CE-CB 3.73Å; E23-A320 HydrophobicContact CB-CB 4.14Å; E23-A320 HydrophobicContact CG-CB 3.78Å; Y28-A320 HydrophobicContact CD2-CB 4.34Å; D29-A320 CarbonylContact O-C 3.6Å; D29-A320 WeakPolarHBondContact O-CA 3.32Å; A320-Y322 PolarHBondContact O-N 2.89Å; A320-N323 PolarHBondContact O-N 3.26Å
321	S	91.7	Very high	92.8	Very high	17 Å²	17	16.2 Å²	16.2	12%	0.119	8%	0.078	C	C	.	.	G	3₁₀ helix	trans	-52.8	-36.8	179.1	58.7	0	0	0	0	114.2	D29 N323 V324	D29-S321 PolarHBondContact N-OG 3.5Å; D29-S321 PolarHBondContact O-N 3.36Å; S321-N323 PolarHBondContact O-N 3.04Å; S321-V324 WeakPolarHBondContact O-CB 3.48Å; S321-V324 VanDerWaalsContact O-CG1 3.32Å; S321-V324 WeakPolarHBondContact O-CG1 3.43Å; S321-V324 PolarHBondContact O-N 2.91Å
322	Y	88.8	Confident	92.5	Very high	123 Å²	123	17.1 Å²	17.1	48%	0.482	8%	0.082	S	C	.	.	G	3₁₀ helix	trans	-57.3	-29.6	176.1	-179.7	-102.2	0	0	0	114.2	Y28 A320	Y28-Y322 HydrophobicContact CD2-CG 4.47Å; Y28-Y322 HydrophobicContact CE1-CD2 4.21Å; Y28-Y322 HydrophobicContact CE1-CG 4.27Å; Y28-Y322 HydrophobicContact CE2-CD1 4.3Å; Y28-Y322 HydrophobicContact CE2-CD2 4.39Å; Y28-Y322 AromaticContact CE2-CG 3.83Å; Y28-Y322 HydrophobicContact CE2-CG 3.83Å; Y28-Y322 AromaticContact CZ-CD2 3.82Å; Y28-Y322 AromaticContact CZ-CG 3.73Å; A320-Y322 PolarHBondContact O-N 2.89Å
323	N	88.1	Confident	92.2	Very high	13 Å²	13	17.7 Å²	17.7	7%	0.07	8%	0.084	C	C	.	.	G	3₁₀ helix	trans	-104.4	17.4	-177.7	-67.7	-46.1	0	0	0	112.9	Q97 A320 S321 E325 E326 T327	Q97-N323 PolarHBondContact NE2-OD1 3.28Å; Q97-N323 PolarHBondContact OE1-OD1 3.41Å; A320-N323 PolarHBondContact O-N 3.26Å; S321-N323 PolarHBondContact O-N 3.04Å; N323-E325 VanDerWaalsContact C-N 3.35Å; N323-E325 PolarHBondContact O-N 3.12Å; N323-E326 PolarHBondContact O-N 3.47Å; N323-T327 WeakPolarHBondContact O-CB 3.21Å; N323-T327 PolarHBondContact O-N 2.98Å; N323-T327 PolarHBondContact O-OG1 3.43Å
324	V	90.2	Very high	92.1	Very high	20 Å²	20	17.7 Å²	17.7	12%	0.121	8%	0.084	C	C	.	.	H	α-helix	trans	-60.1	-40.5	-175.3	70.1	0	0	0	0	113	V31 V43 P46 S321 T327 L328	V31-V324 HydrophobicContact CG2-CB 4.26Å; V31-V324 HydrophobicContact CG2-CG2 4.17Å; V43-V324 HydrophobicContact CG1-CG2 3.62Å; P46-V324 HydrophobicContact CG-CB 4.41Å; P46-V324 HydrophobicContact CG-CG1 3.95Å; S321-V324 WeakPolarHBondContact O-CB 3.48Å; S321-V324 VanDerWaalsContact O-CG1 3.32Å; S321-V324 WeakPolarHBondContact O-CG1 3.43Å; S321-V324 PolarHBondContact O-N 2.91Å; V324-T327 PolarHBondContact O-N 3.08Å; V324-L328 HydrophobicContact CG2-CD1 4.35Å; V324-L328 HydrophobicContact CG2-CG 4.49Å; V324-L328 WeakPolarHBondContact O-CB 3.47Å; V324-L328 WeakPolarHBondContact O-CG 3.36Å; V324-L328 PolarHBondContact O-N 3.35Å
325	E	86.5	Confident	91.9	Very high	104 Å²	104	19.7 Å²	19.7	49%	0.486	10%	0.095	S	C	.	.	H	α-helix	trans	-62.8	-47.3	179.3	-61.9	175.1	164.3	0	0	112.2	K254 N323 T327 L328 T329	K254-E325 IonicContact NZ-OE2 3.38Å; K254-E325 PolarHBondContact NZ-OE2 2.88Å; N323-E325 VanDerWaalsContact C-N 3.35Å; N323-E325 PolarHBondContact O-N 3.12Å; E325-T327 VanDerWaalsContact C-N 3.31Å; E325-T327 PolarHBondContact O-N 3.22Å; E325-L328 PolarHBondContact O-N 3.5Å; E325-T329 PolarHBondContact O-N 2.92Å; E325-T329 PolarHBondContact O-OG1 2.92Å
326	E	88.1	Confident	91.6	Very high	3 Å²	3	23.2 Å²	23.2	1%	0.014	11%	0.108	C	C	.	.	H	α-helix	trans	-68	-35.3	179.8	-54.1	-63.2	163.8	0	0	111	Q97 K254 N323 T330	Q97-E326 HydrophobicContact CB-CB 4.19Å; Q97-E326 HydrophobicContact CG-CB 4.49Å; K254-E326 IonicContact NZ-OE1 2.58Å; K254-E326 PolarHBondContact NZ-OE1 3.34Å; N323-E326 PolarHBondContact O-N 3.47Å; E326-T330 VanDerWaalsContact O-CB 3.26Å; E326-T330 WeakPolarHBondContact O-CB 3.31Å; E326-T330 PolarHBondContact O-N 3.34Å; E326-T330 PolarHBondContact O-OG1 3.15Å
327	T	92.1	Very high	91.5	Very high	2 Å²	2	23.1 Å²	23.1	1%	0.012	11%	0.108	C	C	.	.	H	α-helix	trans	-65.1	-44.5	173.3	-65.1	0	0	0	0	111	V32 V43 V317 G318 N323 V324 E325 T330 L331	V32-T327 HydrophobicContact CG2-CG2 3.9Å; V43-T327 HydrophobicContact CG2-CG2 4.21Å; V317-T327 HydrophobicContact CB-CG2 3.97Å; V317-T327 HydrophobicContact CG1-CG2 4.03Å; G318-T327 PolarHBondContact O-OG1 2.87Å; N323-T327 WeakPolarHBondContact O-CB 3.21Å; N323-T327 PolarHBondContact O-N 2.98Å; N323-T327 PolarHBondContact O-OG1 3.43Å; V324-T327 PolarHBondContact O-N 3.08Å; E325-T327 VanDerWaalsContact C-N 3.31Å; E325-T327 PolarHBondContact O-N 3.22Å; T327-T330 PolarHBondContact O-N 2.95Å; T327-L331 HydrophobicContact CG2-CD1 3.91Å; T327-L331 HydrophobicContact CG2-CG 4.45Å; T327-L331 WeakPolarHBondContact O-CB 3.36Å; T327-L331 VanDerWaalsContact O-CG 3.26Å; T327-L331 WeakPolarHBondContact O-CG 3.21Å; T327-L331 PolarHBondContact O-N 2.97Å
328	L	90.9	Very high	91.4	Very high	21 Å²	21	25.5 Å²	25.5	11%	0.11	12%	0.118	C	C	.	.	H	α-helix	trans	-64.4	-44.5	175.7	-74.6	175.9	0	0	0	112	V43 K55 F57 V324 E325 T330 L331 R332	V43-L328 HydrophobicContact CB-CD2 3.89Å; V43-L328 HydrophobicContact CG1-CD2 3.86Å; V43-L328 HydrophobicContact CG1-CG 4.16Å; V43-L328 HydrophobicContact CG2-CD2 4.21Å; K55-L328 HydrophobicContact CB-CD2 4.23Å; K55-L328 HydrophobicContact CD-CD1 4.13Å; K55-L328 HydrophobicContact CD-CD2 3.64Å; F57-L328 HydrophobicContact CE2-CD2 4.11Å; F57-L328 HydrophobicContact CZ-CD2 4.38Å; V324-L328 HydrophobicContact CG2-CD1 4.35Å; V324-L328 HydrophobicContact CG2-CG 4.49Å; V324-L328 WeakPolarHBondContact O-CB 3.47Å; V324-L328 WeakPolarHBondContact O-CG 3.36Å; V324-L328 PolarHBondContact O-N 3.35Å; E325-L328 PolarHBondContact O-N 3.5Å; L328-T330 VanDerWaalsContact C-N 3.3Å; L328-T330 PolarHBondContact O-N 2.62Å; L328-L331 PolarHBondContact O-N 2.78Å; L328-R332 WeakPolarHBondContact O-CB 3.35Å; L328-R332 VanDerWaalsContact O-CG 3.3Å; L328-R332 WeakPolarHBondContact O-CG 3.5Å; L328-R332 PolarHBondContact O-N 2.64Å
329	T	88.9	Confident	91.3	Very high	28 Å²	28	29.5 Å²	29.5	17%	0.172	14%	0.139	C	C	.	.	H	α-helix	trans	-57.4	-46	174.4	-52.3	0	0	0	0	110.5	E325 L331 R332 Y333 E561	E325-T329 PolarHBondContact O-N 2.92Å; E325-T329 PolarHBondContact O-OG1 2.92Å; T329-L331 PolarHBondContact O-N 2.79Å; T329-R332 PolarHBondContact O-N 3.45Å; T329-Y333 VanDerWaalsContact O-CB 3.29Å; T329-Y333 WeakPolarHBondContact O-CB 3.39Å; T329-Y333 PolarHBondContact O-N 2.93Å; T329-E561 PolarHBondContact OG1-OE1 3.41Å
330	T	92.7	Very high	91.3	Very high	2 Å²	2	29.3 Å²	29.3	1%	0.012	14%	0.138	C	C	.	.	H	α-helix	trans	-61.2	-44.7	177.2	-61.9	0	0	0	0	112.5	Y95 A315 V317 E326 T327 L328 Y333 A334	Y95-T330 HydrophobicContact CD1-CG2 4.05Å; Y95-T330 HydrophobicContact CE1-CG2 4.18Å; A315-T330 HydrophobicContact CB-CG2 4.07Å; V317-T330 HydrophobicContact CG1-CG2 3.68Å; E326-T330 VanDerWaalsContact O-CB 3.26Å; E326-T330 WeakPolarHBondContact O-CB 3.31Å; E326-T330 PolarHBondContact O-N 3.34Å; E326-T330 PolarHBondContact O-OG1 3.15Å; T327-T330 PolarHBondContact O-N 2.95Å; L328-T330 VanDerWaalsContact C-N 3.3Å; L328-T330 PolarHBondContact O-N 2.62Å; T330-Y333 PolarHBondContact O-N 2.86Å; T330-A334 VanDerWaalsContact O-CB 3.29Å; T330-A334 WeakPolarHBondContact O-CB 3.43Å; T330-A334 PolarHBondContact O-N 2.81Å
331	L	94.2	Very high	91.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-71.8	-39.1	179.9	-68.6	171.1	0	0	0	112.7	V14 V41 V43 F57 F59 V317 T327 L328 T329 Y333 A334 N335	V14-L331 HydrophobicContact CB-CD2 4.48Å; V14-L331 HydrophobicContact CG1-CD2 3.91Å; V14-L331 HydrophobicContact CG2-CD2 3.7Å; V41-L331 HydrophobicContact CB-CD2 4.47Å; V41-L331 HydrophobicContact CG1-CD1 4.03Å; V41-L331 HydrophobicContact CG1-CD2 4.32Å; V43-L331 HydrophobicContact CG2-CD1 3.38Å; F57-L331 HydrophobicContact CD2-CB 4Å; F57-L331 HydrophobicContact CD2-CD1 3.94Å; F57-L331 HydrophobicContact CE1-CB 4.46Å; F57-L331 HydrophobicContact CE2-CB 3.95Å; F57-L331 HydrophobicContact CE2-CD1 4.04Å; F57-L331 HydrophobicContact CG-CB 4.28Å; F57-L331 HydrophobicContact CZ-CB 4.19Å; F59-L331 HydrophobicContact CE2-CD2 3.86Å; F59-L331 HydrophobicContact CZ-CD2 3.88Å; V317-L331 HydrophobicContact CG1-CD2 4.35Å; V317-L331 HydrophobicContact CG1-CG 4.36Å; T327-L331 HydrophobicContact CG2-CD1 3.91Å; T327-L331 HydrophobicContact CG2-CG 4.45Å; T327-L331 WeakPolarHBondContact O-CB 3.36Å; T327-L331 VanDerWaalsContact O-CG 3.26Å; T327-L331 WeakPolarHBondContact O-CG 3.21Å; T327-L331 PolarHBondContact O-N 2.97Å; L328-L331 PolarHBondContact O-N 2.78Å; T329-L331 PolarHBondContact O-N 2.79Å; L331-Y333 VanDerWaalsContact C-N 3.31Å; L331-Y333 PolarHBondContact O-N 3.5Å; L331-A334 PolarHBondContact O-N 3.43Å; L331-N335 WeakPolarHBondContact O-CB 3.19Å; L331-N335 PolarHBondContact O-N 3.08Å
332	R	91.3	Very high	91.3	Very high	21 Å²	21	33.8 Å²	33.8	8%	0.079	16%	0.155	C	C	.	.	H	α-helix	trans	-57.6	-46.7	171.5	-76.8	174.7	177.6	166.7	6.9	110.7	F57 L328 T329 N335 R336 D557 E561	F57-R332 HydrophobicContact CE1-CG 4.43Å; F57-R332 HydrophobicContact CZ-CG 4.44Å; L328-R332 WeakPolarHBondContact O-CB 3.35Å; L328-R332 VanDerWaalsContact O-CG 3.3Å; L328-R332 WeakPolarHBondContact O-CG 3.5Å; L328-R332 PolarHBondContact O-N 2.64Å; T329-R332 PolarHBondContact O-N 3.45Å; R332-N335 PolarHBondContact O-N 3Å; R332-R336 WeakPolarHBondContact O-CG 3.32Å; R332-R336 PolarHBondContact O-N 2.75Å; R332-D557 IonicContact NH2-OD2 3.37Å; R332-D557 PolarHBondContact NH2-OD2 3.31Å; R332-E561 IonicContact CZ-OE2 2.68Å; R332-E561 IonicContact NE-OE2 3.46Å; R332-E561 IonicContact NH1-OE2 2.67Å; R332-E561 PolarHBondContact NH1-OE2 2.97Å
333	Y	89.9	Confident	91.4	Very high	11 Å²	11	35.3 Å²	35.3	4%	0.043	16%	0.164	C	C	.	.	H	α-helix	trans	-64.9	-46.6	-179.7	-170.9	-118.8	0	0	0	112.3	Y95 L275 G276 I279 M313 T329 T330 L331 N335 R336 A337	Y95-Y333 AromaticContact CD1-CD1 3.9Å; Y95-Y333 HydrophobicContact CD1-CD1 3.9Å; Y95-Y333 HydrophobicContact CD1-CE1 4.45Å; Y95-Y333 HydrophobicContact CD2-CD1 4.15Å; Y95-Y333 AromaticContact CD2-CE1 3.91Å; Y95-Y333 HydrophobicContact CD2-CE1 3.91Å; Y95-Y333 AromaticContact CE1-CD1 3.52Å; Y95-Y333 HydrophobicContact CE1-CD1 3.52Å; Y95-Y333 HydrophobicContact CE1-CE1 4.24Å; Y95-Y333 HydrophobicContact CE1-CG 4.33Å; Y95-Y333 AromaticContact CE2-CD1 3.76Å; Y95-Y333 HydrophobicContact CE2-CD1 3.76Å; Y95-Y333 AromaticContact CE2-CE1 3.62Å; Y95-Y333 HydrophobicContact CE2-CE1 3.62Å; Y95-Y333 HydrophobicContact CG-CD1 4.22Å; Y95-Y333 HydrophobicContact CG-CE1 4.33Å; Y95-Y333 AromaticContact CZ-CD1 3.44Å; Y95-Y333 VanDerWaalsContact CZ-CD1 3.44Å; Y95-Y333 AromaticContact CZ-CE1 3.81Å; L275-Y333 HydrophobicContact CD2-CE1 4.45Å; L275-Y333 VanDerWaalsContact CG-OH 3.22Å; L275-Y333 WeakPolarHBondContact CG-OH 3.41Å; L275-Y333 PolarHBondContact O-OH 3.48Å; G276-Y333 PolarHBondContact N-OH 2.9Å; I279-Y333 HydrophobicContact CB-CE2 3.74Å; I279-Y333 HydrophobicContact CD1-CE1 4.05Å; I279-Y333 HydrophobicContact CD1-CE2 4.01Å; I279-Y333 VanDerWaalsContact CD1-OH 3.24Å; I279-Y333 WeakPolarHBondContact CD1-OH 3.4Å; I279-Y333 HydrophobicContact CG1-CE2 4.11Å; I279-Y333 WeakPolarHBondContact CG1-OH 3.23Å; I279-Y333 HydrophobicContact CG2-CD2 4.47Å; I279-Y333 HydrophobicContact CG2-CE2 3.93Å; M313-Y333 HydrophobicContact CE-CD1 3.7Å; M313-Y333 HydrophobicContact CE-CE1 4.11Å; T329-Y333 VanDerWaalsContact O-CB 3.29Å; T329-Y333 WeakPolarHBondContact O-CB 3.39Å; T329-Y333 PolarHBondContact O-N 2.93Å; T330-Y333 PolarHBondContact O-N 2.86Å; L331-Y333 VanDerWaalsContact C-N 3.31Å; L331-Y333 PolarHBondContact O-N 3.5Å; Y333-N335 VanDerWaalsContact C-N 3.31Å; Y333-N335 PolarHBondContact O-N 3.31Å; Y333-R336 PolarHBondContact O-N 2.79Å; Y333-A337 PolarHBondContact O-N 2.93Å
334	A	94.3	Very high	91.6	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-58.8	-40.2	172.5	0	0	0	0	0	112.6	V12 F59 M313 A315 T330 L331 R336 A337 K338	V12-A334 HydrophobicContact CG1-CB 3.76Å; F59-A334 HydrophobicContact CE1-CB 3.68Å; F59-A334 HydrophobicContact CZ-CB 4.17Å; M313-A334 HydrophobicContact CE-CB 3.96Å; M313-A334 HydrophobicContact SD-CB 4.26Å; A315-A334 HydrophobicContact CB-CB 3.78Å; T330-A334 VanDerWaalsContact O-CB 3.29Å; T330-A334 WeakPolarHBondContact O-CB 3.43Å; T330-A334 PolarHBondContact O-N 2.81Å; L331-A334 PolarHBondContact O-N 3.43Å; A334-R336 VanDerWaalsContact C-N 3.32Å; A334-R336 PolarHBondContact O-N 2.82Å; A334-A337 PolarHBondContact O-N 3.06Å; A334-K338 PolarHBondContact O-N 3.44Å
335	N	92.8	Very high	91.6	Very high	43 Å²	43	41.8 Å²	41.8	23%	0.23	19%	0.189	C	C	.	.	H	α-helix	trans	-69.1	-28.2	179	-173	55.1	0	0	0	112.9	F57 F59 L331 R332 Y333 K338 N339	F57-N335 HydrophobicContact CD1-CB 4.09Å; F59-N335 HydrophobicContact CE1-CB 4.35Å; F59-N335 HydrophobicContact CZ-CB 4.49Å; L331-N335 WeakPolarHBondContact O-CB 3.19Å; L331-N335 PolarHBondContact O-N 3.08Å; R332-N335 PolarHBondContact O-N 3Å; Y333-N335 VanDerWaalsContact C-N 3.31Å; Y333-N335 PolarHBondContact O-N 3.31Å; N335-K338 VanDerWaalsContact OD1-CE 3.3Å; N335-K338 WeakPolarHBondContact OD1-CE 3.25Å; N335-K338 PolarHBondContact OD1-NZ 3.01Å; N335-N339 PolarHBondContact O-ND2 3.49Å
336	R	91.8	Very high	91.8	Very high	73 Å²	73	38.9 Å²	38.9	28%	0.275	18%	0.178	S	C	.	.	H	α-helix	trans	-70.6	-51.4	167	-66.5	174.7	-164.7	155.4	8.4	110.1	I279 V283 R332 Y333 A334 K338 N339	I279-R336 HydrophobicContact CG2-CB 3.87Å; V283-R336 WeakPolarHBondContact CG1-O 3.49Å; V283-R336 HydrophobicContact CG2-CB 4.34Å; R332-R336 WeakPolarHBondContact O-CG 3.32Å; R332-R336 PolarHBondContact O-N 2.75Å; Y333-R336 PolarHBondContact O-N 2.79Å; A334-R336 VanDerWaalsContact C-N 3.32Å; A334-R336 PolarHBondContact O-N 2.82Å; R336-K338 VanDerWaalsContact C-N 3.27Å; R336-K338 PolarHBondContact O-N 2.9Å; R336-K338 VanDerWaalsContact O-N 3.11Å; R336-N339 WeakPolarHBondContact O-CB 3.45Å; R336-N339 PolarHBondContact O-N 2.88Å
337	A	93.6	Very high	91.7	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-52.3	-37.6	-174.7	0	0	0	0	0	114.5	V12 I279 M313 Y333 A334 N339 I340	V12-A337 HydrophobicContact CG2-CB 4.09Å; I279-A337 HydrophobicContact CD1-CB 3.72Å; I279-A337 HydrophobicContact CG2-CB 4.29Å; M313-A337 HydrophobicContact SD-CB 3.5Å; M313-A337 WeakPolarHBondContact SD-CB 3.46Å; Y333-A337 PolarHBondContact O-N 2.93Å; A334-A337 PolarHBondContact O-N 3.06Å; A337-N339 PolarHBondContact O-N 3.46Å; A337-I340 HydrophobicContact CB-CD1 4.5Å; A337-I340 WeakPolarHBondContact O-CB 3.44Å; A337-I340 VanDerWaalsContact O-CG1 3.32Å; A337-I340 WeakPolarHBondContact O-CG1 3.35Å; A337-I340 PolarHBondContact O-N 2.92Å
338	K	92.8	Very high	91.1	Very high	51 Å²	51	45.1 Å²	45.1	22%	0.222	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-17.2	-179.6	84.6	-167.3	-169.6	-170.7	0	114.8	V12 T58 A334 N335 R336	V12-K338 HydrophobicContact CB-CB 4.06Å; V12-K338 HydrophobicContact CG2-CB 3.57Å; T58-K338 PolarHBondContact O-NZ 2.83Å; A334-K338 PolarHBondContact O-N 3.44Å; N335-K338 VanDerWaalsContact OD1-CE 3.3Å; N335-K338 WeakPolarHBondContact OD1-CE 3.25Å; N335-K338 PolarHBondContact OD1-NZ 3.01Å; R336-K338 VanDerWaalsContact C-N 3.27Å; R336-K338 PolarHBondContact O-N 2.9Å; R336-K338 VanDerWaalsContact O-N 3.11Å
339	N	92.6	Very high	90	Very high	83 Å²	83	48.3 Å²	48.3	44%	0.444	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-12	179.6	-59.8	-46.5	0	0	0	113	V283 N335 R336 A337 K341	V283-N339 HydrophobicContact CB-CB 4.31Å; V283-N339 HydrophobicContact CG1-CB 3.9Å; N335-N339 PolarHBondContact O-ND2 3.49Å; R336-N339 WeakPolarHBondContact O-CB 3.45Å; R336-N339 PolarHBondContact O-N 2.88Å; A337-N339 PolarHBondContact O-N 3.46Å; N339-K341 PolarHBondContact O-N 3.37Å
340	I	92.4	Very high	88.6	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.236	C	C	.	.			trans	-61.7	134.4	176.4	-60.8	171.6	0	0	0	109.5	S9 V10 I279 L282 V283 L305 A337	S9-I340 WeakPolarHBondContact CA-O 3.5Å; V10-I340 HydrophobicContact CB-CB 4.3Å; V10-I340 HydrophobicContact CG2-CB 3.73Å; V10-I340 HydrophobicContact CG2-CG2 3.76Å; V10-I340 PolarHBondContact N-O 3.2Å; I279-I340 HydrophobicContact CB-CD1 4.14Å; I279-I340 HydrophobicContact CD1-CD1 3.81Å; I279-I340 HydrophobicContact CG1-CD1 3.68Å; I279-I340 HydrophobicContact CG2-CD1 4.04Å; L282-I340 HydrophobicContact CB-CG1 4.08Å; L282-I340 HydrophobicContact CB-CG2 4.49Å; L282-I340 HydrophobicContact CD1-CD1 4.19Å; L282-I340 HydrophobicContact CD1-CG1 4.43Å; L282-I340 HydrophobicContact CD1-CG2 4.1Å; V283-I340 HydrophobicContact CG1-CG1 3.73Å; L305-I340 HydrophobicContact CD2-CD1 4.15Å; A337-I340 HydrophobicContact CB-CD1 4.5Å; A337-I340 WeakPolarHBondContact O-CB 3.44Å; A337-I340 VanDerWaalsContact O-CG1 3.32Å; A337-I340 WeakPolarHBondContact O-CG1 3.35Å; A337-I340 PolarHBondContact O-N 2.92Å
341	K	91.7	Very high	86.9	Confident	109 Å²	109	57.8 Å²	57.8	47%	0.474	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	107.9	-178.1	-59.5	-57.6	177.2	-180	0	110.9	S9 N339	S9-K341 PolarHBondContact OG-NZ 3.06Å; N339-K341 PolarHBondContact O-N 3.37Å
342	N	92.9	Very high	85.3	Confident	2 Å²	2	62.5 Å²	62.5	1%	0.011	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	162.8	175.1	-69.8	12.5	0	0	0	111.1	S7 E8 S304 G306 A309 T311 P344	S7-N342 WeakPolarHBondContact CA-O 3.31Å; E8-N342 PolarHBondContact N-O 3.37Å; E8-N342 PolarHBondContact O-N 2.81Å; S304-N342 PolarHBondContact O-ND2 3.4Å; G306-N342 WeakPolarHBondContact CA-OD1 3.28Å; G306-N342 PolarHBondContact N-OD1 2.99Å; A309-N342 VanDerWaalsContact O-CB 3.27Å; A309-N342 WeakPolarHBondContact O-CB 3.34Å; A309-N342 PolarHBondContact O-ND2 3.21Å; T311-N342 PolarHBondContact OG1-ND2 2.87Å; N342-P344 VanDerWaalsContact C-CD 3.43Å
343	K	92	Very high	84.3	Confident	156 Å²	156	61.6 Å²	61.6	68%	0.678	29%	0.292	S	S	*	.			trans	-127	64.9	178	-66.9	172.1	-178.7	163.1	0	110.5	G307 R345	G307-K343 PolarHBondContact O-N 2.88Å; K343-R345 PolarHBondContact O-N 3.43Å
344	P	91.6	Very high	83.7	Confident	26 Å²	26	63.8 Å²	63.8	17%	0.169	30%	0.304	C	S	.	.			trans	-61.7	131.5	-179.7	27	-35.1	0	0	0	111.6	E8 F88 K310 N342	E8-P344 HydrophobicContact CB-CG 4Å; F88-P344 HydrophobicContact CD1-CB 3.89Å; F88-P344 HydrophobicContact CE1-CB 4.23Å; K310-P344 HydrophobicContact CG-CB 3.67Å; K310-P344 HydrophobicContact CG-CG 3.92Å; N342-P344 VanDerWaalsContact C-CD 3.43Å
345	R	90.5	Very high	82.8	Confident	143 Å²	143	63.8 Å²	63.8	54%	0.54	30%	0.304	S	S	.	.			trans	-121.8	158.3	167.5	58.2	168.9	-167.9	-110.3	9.2	109.9	F88 N308 K343	F88-R345 VanDerWaalsContact CD1-O 3.23Å; F88-R345 WeakPolarHBondContact CD1-O 3.43Å; N308-R345 VanDerWaalsContact CG-CG 3.49Å; N308-R345 WeakPolarHBondContact ND2-CG 3.46Å; N308-R345 PolarHBondContact ND2-NE 3.3Å; N308-R345 WeakPolarHBondContact OD1-CG 3.48Å; N308-R345 PolarHBondContact OD1-N 3.47Å; N308-R345 PolarHBondContact OD1-O 3.47Å; K343-R345 PolarHBondContact O-N 3.43Å
346	V	90.1	Very high	82.1	Confident	43 Å²	43	66.5 Å²	66.5	26%	0.261	31%	0.311	S	S	.	.	B	Isolated β-bridge	trans	-69.3	137.3	163.2	-172.3	0	0	0	0	107.5	Q86 F88 R237 E348	Q86-V346 WeakPolarHBondContact O-CG1 3.46Å; F88-V346 HydrophobicContact CD2-CG2 4.13Å; F88-V346 HydrophobicContact CE1-CG2 4.06Å; F88-V346 HydrophobicContact CE2-CG2 3.58Å; F88-V346 HydrophobicContact CZ-CG2 3.54Å; R237-V346 HydrophobicContact CG-CG1 4.18Å; V346-E348 HydrophobicContact CG1-CG 3.94Å; V346-E348 WeakPolarHBondContact CG1-OE1 3.44Å
347	N	87.6	Confident	81.5	Confident	24 Å²	24	69 Å²	69	13%	0.128	33%	0.326	C	S	.	.			trans	-96.3	92.8	175.3	-46.8	-60	0	0	0	109.4	G87 N89 R237 V238 N308	G87-N347 PolarHBondContact O-N 2.95Å; G87-N347 PolarHBondContact O-ND2 3.32Å; N89-N347 PolarHBondContact ND2-ND2 2.98Å; N89-N347 PolarHBondContact OD1-ND2 2.95Å; R237-N347 WeakPolarHBondContact CA-O 3.24Å; V238-N347 PolarHBondContact N-O 2.99Å; V238-N347 WeakPolarHBondContact O-CB 3.41Å; V238-N347 PolarHBondContact O-ND2 3.2Å; N308-N347 PolarHBondContact ND2-OD1 3.22Å
348	E	79.2	Confident	80.8	Confident	112 Å²	112	70.5 Å²	70.5	52%	0.523	33%	0.333	S	S	.	.			trans	-102	72.5	173.7	-75.2	154.6	-170.4	0	0	108.8	R237 V346	R237-E348 HydrophobicContact CG-CG 3.82Å; V346-E348 HydrophobicContact CG1-CG 3.94Å; V346-E348 WeakPolarHBondContact CG1-OE1 3.44Å
349	D	67.8	Low	80	Confident	88 Å²	88	69.9 Å²	69.9	47%	0.471	33%	0.331	S	S	.	.			trans	-113.2	101.2	177.6	-112.3	-54.4	0	0	0	110.5	K351	D349-K351 PolarHBondContact O-N 2.79Å; D349-K351 VanDerWaalsContact O-N 3.1Å
350	P	57.9	Low	79.6	Confident	60 Å²	60	70.8 Å²	70.8	39%	0.39	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	10	-171.4	33.5	-38.1	0	0	0	113.8	R356	P350-R356 WeakPolarHBondContact O-CD 3.46Å; P350-R356 PolarHBondContact O-NH1 3.11Å
351	K	58.6	Low	79.1	Confident	168 Å²	168	73.1 Å²	73.1	73%	0.73	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-37	-174.4	-66.3	-177.6	-178.5	173.6	0	113.7	D349	D349-K351 PolarHBondContact O-N 2.79Å; D349-K351 VanDerWaalsContact O-N 3.1Å
352	D	60	Low	78.5	Confident	100 Å²	100	68.5 Å²	68.5	54%	0.535	32%	0.323	S	S	.	.	S	Bend	trans	-106.2	1.8	-171.9	-67.7	-2.9	0	0	0	113.1	L354	D352-L354 PolarHBondContact O-N 3.21Å
353	A	69.2	Low	78.1	Confident	2 Å²	2	71.1 Å²	71.1	2%	0.017	35%	0.346	C	S	.	.			trans	-74.1	114.9	-178.3	0	0	0	0	0	111.5	I236 V238 L355 R356 E357	I236-A353 HydrophobicContact CB-CB 4.35Å; I236-A353 HydrophobicContact CD1-CB 4.39Å; I236-A353 HydrophobicContact CG2-CB 3.53Å; V238-A353 HydrophobicContact CG2-CB 4.37Å; A353-L355 PolarHBondContact O-N 2.96Å; A353-R356 HydrophobicContact CB-CB 4.39Å; A353-R356 WeakPolarHBondContact O-CA 3.37Å; A353-R356 WeakPolarHBondContact O-CB 3.39Å; A353-R356 PolarHBondContact O-N 2.84Å; A353-E357 PolarHBondContact O-N 2.91Å
354	L	77.5	Confident	77.8	Confident	56 Å²	56	70.9 Å²	70.9	29%	0.293	34%	0.34	S	S	.	.	H	α-helix	trans	-60.9	-28.7	177.6	-177.4	64.8	0	0	0	112.2	L139 E224 D352 R356 E357 F358	L139-L354 HydrophobicContact CD2-CB 4.22Å; L139-L354 HydrophobicContact CD2-CD2 4.2Å; L139-L354 HydrophobicContact CD2-CG 4.17Å; E224-L354 PolarHBondContact OE1-N 3.11Å; E224-L354 PolarHBondContact OE2-N 3.48Å; D352-L354 PolarHBondContact O-N 3.21Å; L354-R356 VanDerWaalsContact C-N 3.27Å; L354-R356 PolarHBondContact O-N 3.02Å; L354-E357 WeakPolarHBondContact CD1-OE2 3.26Å; L354-E357 PolarHBondContact O-N 2.96Å; L354-F358 HydrophobicContact CD1-CD2 4.47Å; L354-F358 HydrophobicContact CD1-CE2 4.14Å; L354-F358 HydrophobicContact CD2-CE2 3.84Å; L354-F358 HydrophobicContact CG-CD2 3.9Å; L354-F358 HydrophobicContact CG-CE2 3.63Å; L354-F358 VanDerWaalsContact O-CD2 3.25Å; L354-F358 WeakPolarHBondContact O-CD2 3.48Å; L354-F358 PolarHBondContact O-N 2.76Å
355	L	76	Confident	77.3	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-59.4	-38.7	172.5	-166.9	166	0	0	0	110.9	L139 E224 A353 F358 Q359 L474	L139-L355 HydrophobicContact CB-CB 4.31Å; L139-L355 HydrophobicContact CB-CD1 4.02Å; L139-L355 HydrophobicContact CB-CG 4.25Å; L139-L355 HydrophobicContact CD2-CB 4.13Å; E224-L355 HydrophobicContact CB-CB 4.01Å; E224-L355 HydrophobicContact CB-CD1 3.83Å; E224-L355 WeakPolarHBondContact OE2-CB 3.34Å; E224-L355 PolarHBondContact OE2-N 3.04Å; A353-L355 PolarHBondContact O-N 2.96Å; L355-F358 PolarHBondContact O-N 3.24Å; L355-Q359 HydrophobicContact CD2-CG 3.91Å; L355-Q359 VanDerWaalsContact CD2-NE2 3.31Å; L355-Q359 WeakPolarHBondContact O-CB 3.33Å; L355-Q359 WeakPolarHBondContact O-CG 3.43Å; L355-Q359 PolarHBondContact O-N 3.11Å; L355-L474 HydrophobicContact CG-CD2 4.24Å
356	R	77.6	Confident	76.8	Confident	100 Å²	100	67.8 Å²	67.8	38%	0.377	33%	0.329	S	S	.	.	H	α-helix	trans	-64.1	-48.4	174.3	-171.1	-177.9	165.6	155.6	6.8	111.4	I236 P350 A353 L354 F358 Q359 E360	I236-R356 HydrophobicContact CD1-CB 3.65Å; I236-R356 HydrophobicContact CD1-CG 4.16Å; P350-R356 WeakPolarHBondContact O-CD 3.46Å; P350-R356 PolarHBondContact O-NH1 3.11Å; A353-R356 HydrophobicContact CB-CB 4.39Å; A353-R356 WeakPolarHBondContact O-CA 3.37Å; A353-R356 WeakPolarHBondContact O-CB 3.39Å; A353-R356 PolarHBondContact O-N 2.84Å; L354-R356 VanDerWaalsContact C-N 3.27Å; L354-R356 PolarHBondContact O-N 3.02Å; R356-F358 VanDerWaalsContact C-N 3.26Å; R356-F358 PolarHBondContact O-N 3.43Å; R356-Q359 PolarHBondContact O-N 3.03Å; R356-Q359 VanDerWaalsContact O-N 3.13Å; R356-E360 HydrophobicContact CG-CG 4.33Å; R356-E360 IonicContact CZ-OE1 2.74Å; R356-E360 VanDerWaalsContact CZ-OE1 3.29Å; R356-E360 IonicContact NE-OE1 2.74Å; R356-E360 PolarHBondContact NE-OE1 3.39Å; R356-E360 IonicContact NH2-OE1 3.21Å; R356-E360 PolarHBondContact NH2-OE1 2.87Å; R356-E360 WeakPolarHBondContact O-CB 3.4Å; R356-E360 WeakPolarHBondContact O-CG 3.43Å; R356-E360 PolarHBondContact O-N 2.85Å
357	E	80.4	Confident	76.5	Confident	126 Å²	126	67.2 Å²	67.2	59%	0.589	33%	0.328	S	S	*	.	H	α-helix	trans	-59.1	-39.4	176.6	-62.1	-169.6	150.6	0	0	111.3	A353 L354 E361	A353-E357 PolarHBondContact O-N 2.91Å; L354-E357 WeakPolarHBondContact CD1-OE2 3.26Å; L354-E357 PolarHBondContact O-N 2.96Å; E357-E361 VanDerWaalsContact O-CB 3.28Å; E357-E361 WeakPolarHBondContact O-CB 3.49Å; E357-E361 PolarHBondContact O-N 3.44Å
358	F	78.3	Confident	76.2	Confident	32 Å²	32	69.9 Å²	69.9	14%	0.14	34%	0.34	C	S	.	.	H	α-helix	trans	-65	-44.7	173	-81.2	-55.1	0	0	0	112.6	L139 L354 L355 R356 I362 M470 K473	L139-F358 HydrophobicContact CD1-CE2 4.4Å; L139-F358 HydrophobicContact CD2-CD2 3.81Å; L139-F358 HydrophobicContact CD2-CE2 3.99Å; L354-F358 HydrophobicContact CD1-CD2 4.47Å; L354-F358 HydrophobicContact CD1-CE2 4.14Å; L354-F358 HydrophobicContact CD2-CE2 3.84Å; L354-F358 HydrophobicContact CG-CD2 3.9Å; L354-F358 HydrophobicContact CG-CE2 3.63Å; L354-F358 VanDerWaalsContact O-CD2 3.25Å; L354-F358 WeakPolarHBondContact O-CD2 3.48Å; L354-F358 PolarHBondContact O-N 2.76Å; L355-F358 PolarHBondContact O-N 3.24Å; R356-F358 VanDerWaalsContact C-N 3.26Å; R356-F358 PolarHBondContact O-N 3.43Å; F358-I362 VanDerWaalsContact O-CB 3.23Å; F358-I362 WeakPolarHBondContact O-CB 3.39Å; F358-I362 WeakPolarHBondContact O-CD1 3.38Å; F358-I362 WeakPolarHBondContact O-CG1 3.31Å; F358-I362 PolarHBondContact O-N 3.26Å; F358-M470 HydrophobicContact CD1-CB 4.43Å; F358-M470 HydrophobicContact CD1-CG 4.37Å; F358-M470 HydrophobicContact CD1-SD 4.31Å; F358-M470 HydrophobicContact CE1-CG 4.4Å; F358-K473 HydrophobicContact CZ-CD 4.32Å
359	Q	76.4	Confident	76.1	Confident	38 Å²	38	67.2 Å²	67.2	18%	0.178	33%	0.329	C	S	.	.	H	α-helix	trans	-62.8	-44.6	176.6	-78.9	177.1	-16.1	0	0	111.6	S226 N234 L355 R356 I362 A363	S226-Q359 PolarHBondContact OG-NE2 2.87Å; N234-Q359 PolarHBondContact ND2-OE1 3.04Å; L355-Q359 HydrophobicContact CD2-CG 3.91Å; L355-Q359 VanDerWaalsContact CD2-NE2 3.31Å; L355-Q359 WeakPolarHBondContact O-CB 3.33Å; L355-Q359 WeakPolarHBondContact O-CG 3.43Å; L355-Q359 PolarHBondContact O-N 3.11Å; R356-Q359 PolarHBondContact O-N 3.03Å; R356-Q359 VanDerWaalsContact O-N 3.13Å; Q359-I362 PolarHBondContact O-N 3.05Å; Q359-A363 VanDerWaalsContact O-CB 3.28Å; Q359-A363 WeakPolarHBondContact O-CB 3.24Å; Q359-A363 PolarHBondContact O-N 3.39Å
360	E	83.4	Confident	76.5	Confident	102 Å²	102	68.2 Å²	68.2	48%	0.477	33%	0.331	S	S	.	.	H	α-helix	trans	-66.3	-43.9	178.5	-72.2	-175.9	-178.7	0	0	112.1	R356 A363 R364	R356-E360 HydrophobicContact CG-CG 4.33Å; R356-E360 IonicContact CZ-OE1 2.74Å; R356-E360 VanDerWaalsContact CZ-OE1 3.29Å; R356-E360 IonicContact NE-OE1 2.74Å; R356-E360 PolarHBondContact NE-OE1 3.39Å; R356-E360 IonicContact NH2-OE1 3.21Å; R356-E360 PolarHBondContact NH2-OE1 2.87Å; R356-E360 WeakPolarHBondContact O-CB 3.4Å; R356-E360 WeakPolarHBondContact O-CG 3.43Å; R356-E360 PolarHBondContact O-N 2.85Å; E360-A363 PolarHBondContact O-N 2.9Å; E360-R364 WeakPolarHBondContact O-CB 3.22Å; E360-R364 PolarHBondContact O-N 3.24Å
361	E	81.6	Confident	77.3	Confident	48 Å²	48	73 Å²	73	22%	0.224	35%	0.345	C	S	.	.	H	α-helix	trans	-70.1	-36.1	176.2	178.5	71.3	175.5	0	0	111.8	E357 R364 L365 K466 M470	E357-E361 VanDerWaalsContact O-CB 3.28Å; E357-E361 WeakPolarHBondContact O-CB 3.49Å; E357-E361 PolarHBondContact O-N 3.44Å; E361-R364 WeakPolarHBondContact OE2-CD 3.48Å; E361-R364 IonicContact OE2-CZ 2.7Å; E361-R364 IonicContact OE2-NH1 2.92Å; E361-R364 PolarHBondContact OE2-NH1 2.8Å; E361-L365 HydrophobicContact CG-CD1 3.84Å; E361-L365 HydrophobicContact CG-CG 4.45Å; E361-L365 WeakPolarHBondContact O-CB 3.42Å; E361-L365 WeakPolarHBondContact O-CD1 3.44Å; E361-L365 WeakPolarHBondContact O-CG 3.5Å; E361-L365 PolarHBondContact O-N 2.78Å; E361-K466 IonicContact OE1-NZ 3.2Å; E361-K466 PolarHBondContact OE1-NZ 3.09Å; E361-M470 HydrophobicContact CG-CE 4.28Å; E361-M470 HydrophobicContact CG-SD 4.2Å
362	I	80.1	Confident	77.8	Confident	12 Å²	12	69.9 Å²	69.9	6%	0.062	33%	0.329	C	S	.	.	H	α-helix	trans	-62.1	-48.9	171.2	-72.9	164.3	0	0	0	110.2	F358 Q359 R364 L365 K366 M470 E471 L474	F358-I362 VanDerWaalsContact O-CB 3.23Å; F358-I362 WeakPolarHBondContact O-CB 3.39Å; F358-I362 WeakPolarHBondContact O-CD1 3.38Å; F358-I362 WeakPolarHBondContact O-CG1 3.31Å; F358-I362 PolarHBondContact O-N 3.26Å; Q359-I362 PolarHBondContact O-N 3.05Å; I362-R364 PolarHBondContact O-N 2.92Å; I362-L365 PolarHBondContact O-N 2.97Å; I362-K366 HydrophobicContact CG2-CD 4.13Å; I362-K366 HydrophobicContact CG2-CG 4.43Å; I362-K366 WeakPolarHBondContact O-CB 3.32Å; I362-K366 WeakPolarHBondContact O-CG 3.45Å; I362-K366 PolarHBondContact O-N 2.74Å; I362-M470 HydrophobicContact CD1-CB 3.9Å; I362-M470 HydrophobicContact CG1-CB 3.87Å; I362-M470 HydrophobicContact CG1-CE 3.96Å; I362-E471 HydrophobicContact CD1-CG 4.06Å; I362-E471 HydrophobicContact CG2-CG 4.22Å; I362-L474 HydrophobicContact CD1-CD1 3.64Å
363	A	83.5	Confident	78	Confident	58 Å²	58	68.1 Å²	68.1	48%	0.479	33%	0.325	S	S	.	.	H	α-helix	trans	-61.1	-43.9	178.3	0	0	0	0	0	111.7	Q359 E360 L365 K366 A367	Q359-A363 VanDerWaalsContact O-CB 3.28Å; Q359-A363 WeakPolarHBondContact O-CB 3.24Å; Q359-A363 PolarHBondContact O-N 3.39Å; E360-A363 PolarHBondContact O-N 2.9Å; A363-L365 PolarHBondContact O-N 3.2Å; A363-K366 PolarHBondContact O-N 3.21Å; A363-A367 WeakPolarHBondContact O-CB 3.32Å; A363-A367 PolarHBondContact O-N 3.46Å
364	R	85.6	Confident	77.5	Confident	150 Å²	150	71.5 Å²	71.5	57%	0.566	34%	0.342	S	S	*	.	H	α-helix	trans	-60.3	-41.7	176	-177.1	-171.5	-177.5	-155.6	7.9	112.5	E360 E361 I362 Q368	E360-R364 WeakPolarHBondContact O-CB 3.22Å; E360-R364 PolarHBondContact O-N 3.24Å; E361-R364 WeakPolarHBondContact OE2-CD 3.48Å; E361-R364 IonicContact OE2-CZ 2.7Å; E361-R364 IonicContact OE2-NH1 2.92Å; E361-R364 PolarHBondContact OE2-NH1 2.8Å; I362-R364 PolarHBondContact O-N 2.92Å; R364-Q368 WeakPolarHBondContact O-CG 3.5Å; R364-Q368 PolarHBondContact O-N 3.42Å
365	L	82.2	Confident	76.5	Confident	6 Å²	6	71 Å²	71	3%	0.031	35%	0.349	C	S	.	.	H	α-helix	trans	-75.4	-37.5	179.3	-68.8	165.9	0	0	0	111.8	E361 I362 A363 Q368 L369 L463 K466 I467 M470	E361-L365 HydrophobicContact CG-CD1 3.84Å; E361-L365 HydrophobicContact CG-CG 4.45Å; E361-L365 WeakPolarHBondContact O-CB 3.42Å; E361-L365 WeakPolarHBondContact O-CD1 3.44Å; E361-L365 WeakPolarHBondContact O-CG 3.5Å; E361-L365 PolarHBondContact O-N 2.78Å; I362-L365 PolarHBondContact O-N 2.97Å; A363-L365 PolarHBondContact O-N 3.2Å; L365-Q368 WeakPolarHBondContact O-CA 3.37Å; L365-Q368 WeakPolarHBondContact O-CB 3.47Å; L365-Q368 PolarHBondContact O-N 3.2Å; L365-L369 PolarHBondContact O-N 2.74Å; L365-L463 HydrophobicContact CB-CD2 3.96Å; L365-L463 HydrophobicContact CD2-CD1 3.83Å; L365-L463 HydrophobicContact CD2-CD2 4.04Å; L365-L463 HydrophobicContact CD2-CG 3.91Å; L365-L463 VanDerWaalsContact O-CD2 3.31Å; L365-L463 WeakPolarHBondContact O-CD2 3.38Å; L365-K466 HydrophobicContact CD1-CD 3.82Å; L365-K466 HydrophobicContact CD1-CG 4.35Å; L365-I467 HydrophobicContact CB-CD1 3.82Å; L365-I467 HydrophobicContact CB-CG1 3.66Å; L365-I467 HydrophobicContact CD1-CG1 4.42Å; L365-M470 HydrophobicContact CD1-CE 3.29Å
366	K	80.9	Confident	75.5	Confident	99 Å²	99	73.7 Å²	73.7	43%	0.43	36%	0.36	S	S	.	.	H	α-helix	trans	-56.8	-49.3	169.3	-76.1	-176.7	177.6	-174.3	0	110.8	I362 A363 Q368 L369 E370 I467 E471	I362-K366 HydrophobicContact CG2-CD 4.13Å; I362-K366 HydrophobicContact CG2-CG 4.43Å; I362-K366 WeakPolarHBondContact O-CB 3.32Å; I362-K366 WeakPolarHBondContact O-CG 3.45Å; I362-K366 PolarHBondContact O-N 2.74Å; A363-K366 PolarHBondContact O-N 3.21Å; K366-Q368 PolarHBondContact O-N 3.06Å; K366-L369 WeakPolarHBondContact O-CB 3.47Å; K366-L369 PolarHBondContact O-N 2.89Å; K366-E370 WeakPolarHBondContact O-CB 3.37Å; K366-E370 PolarHBondContact O-N 3.14Å; K366-I467 HydrophobicContact CG-CD1 4.11Å; K366-I467 HydrophobicContact CG-CG2 4.4Å; K366-E471 WeakPolarHBondContact CE-OE1 3.4Å; K366-E471 IonicContact NZ-OE1 3.62Å; K366-E471 PolarHBondContact NZ-OE1 3.07Å
367	A	83.8	Confident	74.5	Confident	31 Å²	31	77.3 Å²	77.3	26%	0.256	37%	0.374	S	S	.	.	H	α-helix	trans	-61.8	-23.8	173.9	0	0	0	0	0	114	A363 K371	A363-A367 WeakPolarHBondContact O-CB 3.32Å; A363-A367 PolarHBondContact O-N 3.46Å; A367-K371 WeakPolarHBondContact O-CB 3.31Å; A367-K371 WeakPolarHBondContact O-CD 3.45Å; A367-K371 WeakPolarHBondContact O-CG 3.44Å; A367-K371 PolarHBondContact O-N 2.76Å
368	Q	80.2	Confident	73.2	Confident	80 Å²	80	78.1 Å²	78.1	37%	0.374	38%	0.375	S	S	.	.	H	α-helix	trans	-77.4	-36.4	171.4	-76.1	179.1	15.7	0	0	112.9	R364 L365 K366 R372 L463	R364-Q368 WeakPolarHBondContact O-CG 3.5Å; R364-Q368 PolarHBondContact O-N 3.42Å; L365-Q368 WeakPolarHBondContact O-CA 3.37Å; L365-Q368 WeakPolarHBondContact O-CB 3.47Å; L365-Q368 PolarHBondContact O-N 3.2Å; K366-Q368 PolarHBondContact O-N 3.06Å; Q368-R372 WeakPolarHBondContact O-CG 3.43Å; Q368-R372 PolarHBondContact O-N 2.83Å; Q368-L463 HydrophobicContact CB-CD2 4.37Å
369	L	76.3	Confident	72	Confident	55 Å²	55	86 Å²	86	29%	0.288	40%	0.404	S	S	.	.	H	α-helix	trans	-64	-46.5	168.7	-71.1	-177.3	0	0	0	110.8	L365 K366 R372 S373 L463 I467	L365-L369 PolarHBondContact O-N 2.74Å; K366-L369 WeakPolarHBondContact O-CB 3.47Å; K366-L369 PolarHBondContact O-N 2.89Å; L369-R372 CarbonylContact O-C 3.55Å; L369-R372 WeakPolarHBondContact O-CA 3.34Å; L369-R372 WeakPolarHBondContact O-CB 3.34Å; L369-R372 PolarHBondContact O-N 3.39Å; L369-S373 PolarHBondContact O-N 2.99Å; L369-L463 HydrophobicContact CD1-CD2 4.4Å; L369-L463 HydrophobicContact CD2-CB 4.17Å; L369-L463 HydrophobicContact CD2-CD2 3.68Å; L369-L463 HydrophobicContact CG-CD2 3.58Å; L369-I467 HydrophobicContact CD1-CD1 3.54Å; L369-I467 HydrophobicContact CG-CD1 4.06Å
370	E	76.7	Confident	70.9	Confident	110 Å²	110	91.4 Å²	91.4	51%	0.514	42%	0.423	S	S	.	.	H	α-helix	trans	-64.4	-42.5	-177.5	-160.9	-161.1	158.3	0	0	112	K366 R372 S373 I374	K366-E370 WeakPolarHBondContact O-CB 3.37Å; K366-E370 PolarHBondContact O-N 3.14Å; E370-R372 PolarHBondContact O-N 3.27Å; E370-S373 WeakPolarHBondContact CA-OG 3.39Å; E370-S373 PolarHBondContact O-N 3.04Å; E370-S373 VanDerWaalsContact O-N 3.12Å; E370-S373 PolarHBondContact O-OG 3.42Å; E370-I374 HydrophobicContact CG-CD1 3.78Å; E370-I374 HydrophobicContact CG-CG1 4.35Å; E370-I374 WeakPolarHBondContact O-CB 3.38Å; E370-I374 WeakPolarHBondContact O-CG1 3.47Å; E370-I374 PolarHBondContact O-N 3.46Å; E370-I374 WeakPolarHBondContact OE1-CD1 3.33Å
371	K	75.9	Confident	69.5	Low	159 Å²	159	90.9 Å²	90.9	69%	0.691	42%	0.42	S	S	*	.	H	α-helix	trans	-62.2	-29.6	172.9	-76	171.1	-175.7	177	0	112.7	A367 G375	A367-K371 WeakPolarHBondContact O-CB 3.31Å; A367-K371 WeakPolarHBondContact O-CD 3.45Å; A367-K371 WeakPolarHBondContact O-CG 3.44Å; A367-K371 PolarHBondContact O-N 2.76Å; K371-G375 PolarHBondContact O-N 2.82Å; K371-G375 VanDerWaalsContact O-N 3.13Å
372	R	68.5	Low	68.1	Low	104 Å²	104	96.7 Å²	96.7	39%	0.392	44%	0.444	S	S	.	.	H	α-helix	trans	-74.2	-36.4	173	-74.2	175.9	165.4	-150.3	-3.2	112.3	Q368 L369 E370 R376	Q368-R372 WeakPolarHBondContact O-CG 3.43Å; Q368-R372 PolarHBondContact O-N 2.83Å; L369-R372 CarbonylContact O-C 3.55Å; L369-R372 WeakPolarHBondContact O-CA 3.34Å; L369-R372 WeakPolarHBondContact O-CB 3.34Å; L369-R372 PolarHBondContact O-N 3.39Å; E370-R372 PolarHBondContact O-N 3.27Å; R372-R376 WeakPolarHBondContact O-CG 3.36Å
373	S	63.9	Low	66.9	Low	63 Å²	63	106.3 Å²	106.3	44%	0.441	48%	0.48	S	S	.	.	H	α-helix	trans	-73.3	-46.5	174.7	63.3	0	0	0	0	112.6	L369 E370 G375 R376 R377	L369-S373 PolarHBondContact O-N 2.99Å; E370-S373 WeakPolarHBondContact CA-OG 3.39Å; E370-S373 PolarHBondContact O-N 3.04Å; E370-S373 VanDerWaalsContact O-N 3.12Å; E370-S373 PolarHBondContact O-OG 3.42Å; S373-G375 VanDerWaalsContact C-N 3.31Å; S373-G375 PolarHBondContact O-N 3.24Å; S373-R376 WeakPolarHBondContact O-CA 3.34Å; S373-R376 WeakPolarHBondContact O-CB 3.35Å; S373-R376 PolarHBondContact O-N 2.74Å; S373-R377 PolarHBondContact O-N 2.76Å; S373-R377 VanDerWaalsContact O-N 3.09Å
374	I	58.3	Low	65.4	Low	73 Å²	73	112.8 Å²	112.8	37%	0.374	49%	0.492	S	S	.	.	H	α-helix	trans	-62	-38.9	177.6	-65.8	170	0	0	0	111.2	E370 R376 R377 K378	E370-I374 HydrophobicContact CG-CD1 3.78Å; E370-I374 HydrophobicContact CG-CG1 4.35Å; E370-I374 WeakPolarHBondContact O-CB 3.38Å; E370-I374 WeakPolarHBondContact O-CG1 3.47Å; E370-I374 PolarHBondContact O-N 3.46Å; E370-I374 WeakPolarHBondContact OE1-CD1 3.33Å; I374-R376 PolarHBondContact O-N 3.03Å; I374-R377 PolarHBondContact O-N 3.48Å; I374-K378 PolarHBondContact O-N 2.99Å; I374-K378 VanDerWaalsContact O-N 3.08Å
375	G	56.7	Low	63.9	Low	44 Å²	44	113.1 Å²	113.1	45%	0.454	50%	0.5	S	S	.	.	H	α-helix	trans	-59.3	-26	173.7	0	0	0	0	0	113.6	K371 S373 R379	K371-G375 PolarHBondContact O-N 2.82Å; K371-G375 VanDerWaalsContact O-N 3.13Å; S373-G375 VanDerWaalsContact C-N 3.31Å; S373-G375 PolarHBondContact O-N 3.24Å; G375-R379 WeakPolarHBondContact O-CB 3.41Å
376	R	55.5	Low	62.2	Low	57 Å²	57	116.3 Å²	116.3	22%	0.215	53%	0.534	C	S	.	.	H	α-helix	trans	-82.4	-42.6	173.6	-69	168	158.4	-136.8	-18	111.8	R372 S373 I374 R379 R380 W414 E456	R372-R376 WeakPolarHBondContact O-CG 3.36Å; S373-R376 WeakPolarHBondContact O-CA 3.34Å; S373-R376 WeakPolarHBondContact O-CB 3.35Å; S373-R376 PolarHBondContact O-N 2.74Å; I374-R376 PolarHBondContact O-N 3.03Å; R376-R379 PolarHBondContact O-N 2.99Å; R376-R380 PolarHBondContact O-N 3.44Å; R376-R380 VanDerWaalsContact O-N 3.16Å; R376-W414 VanDerWaalsContact CZ-CH2 3.49Å; R376-W414 VanDerWaalsContact NH1-CZ2 3.3Å; R376-E456 IonicContact CZ-OE1 3.24Å; R376-E456 IonicContact CZ-OE2 3.19Å; R376-E456 IonicContact NE-OE1 2.85Å; R376-E456 PolarHBondContact NE-OE1 2.66Å; R376-E456 IonicContact NE-OE2 2.74Å; R376-E456 IonicContact NH2-OE1 2.74Å; R376-E456 PolarHBondContact NH2-OE1 3.23Å; R376-E456 IonicContact NH2-OE2 2.64Å; R376-E456 PolarHBondContact NH2-OE2 3.45Å
377	R	56.4	Low	60.3	Low	177 Å²	177	114.8 Å²	114.8	67%	0.668	55%	0.546	S	S	*	.	H	α-helix	trans	-59.6	-50.3	178	-172	167.9	168.4	160.9	-5	112.1	S373 I374 R379 R380 E381	S373-R377 PolarHBondContact O-N 2.76Å; S373-R377 VanDerWaalsContact O-N 3.09Å; I374-R377 PolarHBondContact O-N 3.48Å; R377-R379 PolarHBondContact O-N 3.37Å; R377-R379 VanDerWaalsContact O-N 3.15Å; R377-R380 WeakPolarHBondContact O-CA 3.5Å; R377-R380 WeakPolarHBondContact O-CB 3.34Å; R377-R380 PolarHBondContact O-N 3.23Å; R377-E381 IonicContact NE-OE1 2.79Å; R377-E381 PolarHBondContact O-N 3.43Å; R377-E381 VanDerWaalsContact O-N 3.11Å
378	K	52.6	Low	58.1	Low	142 Å²	142	116.9 Å²	116.9	62%	0.617	57%	0.572	S	S	*	*	H	α-helix	trans	-62.4	-24.1	176.3	-74.6	-173.1	173.4	-179.9	0	114.4	I374 K382	I374-K378 PolarHBondContact O-N 2.99Å; I374-K378 VanDerWaalsContact O-N 3.08Å; K378-K382 PolarHBondContact O-N 3.33Å
379	R	54.2	Low	56.1	Low	199 Å²	199	119.2 Å²	119.2	75%	0.751	60%	0.597	S	S	*	*	H	α-helix	trans	-83	-17.3	176.5	-153.1	174.4	-173.3	-175.8	1.7	112.6	G375 R376 R377	G375-R379 WeakPolarHBondContact O-CB 3.41Å; R376-R379 PolarHBondContact O-N 2.99Å; R377-R379 PolarHBondContact O-N 3.37Å; R377-R379 VanDerWaalsContact O-N 3.15Å
380	R	52.5	Low	54.3	Low	151 Å²	151	120.2 Å²	120.2	57%	0.57	62%	0.62	S	S	*	*	H	α-helix	trans	-85.8	-40.8	174.8	-168.7	170.6	158.2	174.2	-7.7	110.8	R376 R377 R383 R384	R376-R380 PolarHBondContact O-N 3.44Å; R376-R380 VanDerWaalsContact O-N 3.16Å; R377-R380 WeakPolarHBondContact O-CA 3.5Å; R377-R380 WeakPolarHBondContact O-CB 3.34Å; R377-R380 PolarHBondContact O-N 3.23Å; R380-R383 PolarHBondContact O-N 2.97Å; R380-R384 PolarHBondContact O-N 3.47Å
381	E	54.3	Low	52.4	Low	90 Å²	90	119.1 Å²	119.1	42%	0.421	64%	0.639	S	S	.	*	H	α-helix	trans	-61.8	-55	172.3	-75.2	157.9	171.4	0	0	112.1	R377 R383 R384 E385	R377-E381 IonicContact NE-OE1 2.79Å; R377-E381 PolarHBondContact O-N 3.43Å; R377-E381 VanDerWaalsContact O-N 3.11Å; E381-R383 PolarHBondContact O-N 3.47Å; E381-R384 PolarHBondContact O-N 2.99Å; E381-E385 PolarHBondContact O-N 3.5Å
382	K	52.7	Low	50.4	Low	170 Å²	170	115.8 Å²	115.8	74%	0.739	65%	0.649	S	S	*	*	H	α-helix	trans	-59.9	-13.2	176.9	-84.8	-168.4	170.6	-172.9	0	115.4	K378	K378-K382 PolarHBondContact O-N 3.33Å
383	R	53.9	Low	48.9	Very low	215 Å²	215	114.8 Å²	114.8	81%	0.811	67%	0.671	S	S	*	*	H	α-helix	trans	-92.8	-21.4	172.5	-88.8	-177	146	-166	-10.3	113.5	R380 E381	R380-R383 PolarHBondContact O-N 2.97Å; E381-R383 PolarHBondContact O-N 3.47Å
384	R	52.4	Low	47.5	Very low	194 Å²	194	121 Å²	121	73%	0.732	69%	0.693	S	S	*	*	H	α-helix	trans	-83.1	-40.1	172.3	-80	-177.8	157.6	-178.1	-9.1	111.7	R380 E381 G386 G387	R380-R384 PolarHBondContact O-N 3.47Å; E381-R384 PolarHBondContact O-N 2.99Å; R384-G386 PolarHBondContact O-N 3.24Å; R384-G387 PolarHBondContact O-N 3.21Å
385	E	53.7	Low	46.6	Very low	157 Å²	157	127.1 Å²	127.1	73%	0.734	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	-15.6	178.1	-64.7	178.1	139.5	0	0	114	E381 G387	E381-E385 PolarHBondContact O-N 3.5Å; E385-G387 VanDerWaalsContact C-N 3.29Å; E385-G387 PolarHBondContact O-N 2.85Å
386	G	47.1	Very low	45.5	Very low	72 Å²	72	134 Å²	134	74%	0.742	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	0.6	177.7	0	0	0	0	0	115.5	R384	R384-G386 PolarHBondContact O-N 3.24Å
387	G	40.5	Very low	44.5	Very low	67 Å²	67	140 Å²	140	69%	0.691	77%	0.771	S	S	*	*	S	Bend	trans	-122.7	64.7	-177.7	0	0	0	0	0	112.5	R384 E385	R384-G387 PolarHBondContact O-N 3.21Å; E385-G387 VanDerWaalsContact C-N 3.29Å; E385-G387 PolarHBondContact O-N 2.85Å
388	G	37.4	Very low	43.4	Very low	76 Å²	76	140.5 Å²	140.5	78%	0.784	78%	0.781	S	S	*	*			trans	-82.4	123	-176.3	0	0	0	0	0	114.2
389	S	38.3	Very low	42.3	Very low	129 Å²	129	143.8 Å²	143.8	90%	0.902	80%	0.798	S	S	*	*				179.1	120.5	127.2	-173.6	0	0	0	0	112.3
390	G	39.4	Very low	41.2	Very low	75 Å²	75	137.4 Å²	137.4	77%	0.773	80%	0.795	S	S	*	*			trans	116.8	103.6	149.7	0	0	0	0	0	118.6
391	G	36.9	Very low	40.1	Very low	88 Å²	88	139.6 Å²	139.6	91%	0.907	81%	0.811	S	S	*	*			trans	76.2	138.6	160.8	0	0	0	0	0	115.9
392	G	33.7	Very low	39	Very low	89 Å²	89	145.1 Å²	145.1	92%	0.918	84%	0.837	S	S	*	*			cis	124.2	90.8	6.2	0	0	0	0	0	110.5
393	G	36.5	Very low	37.9	Very low	82 Å²	82	139.5 Å²	139.5	85%	0.845	83%	0.827	S	S	*	*			trans	174.8	124.4	179.7	0	0	0	0	0	110.4
394	E	33.5	Very low	36.8	Very low	195 Å²	195	139.1 Å²	139.1	91%	0.911	84%	0.835	S	S	*	*			trans	-102.1	117.8	176.6	-58.6	166.8	144.5	0	0	107.7
395	E	40.3	Very low	36	Very low	201 Å²	201	138.4 Å²	138.4	94%	0.939	84%	0.84	S	S	*	*			trans	-140.3	138.7	163.1	-68.1	-169.8	156.1	0	0	109.5
396	E	32.8	Very low	35.5	Very low	188 Å²	188	138.1 Å²	138.1	88%	0.879	84%	0.838	S	S	*	*			trans	-91.3	146.3	-178.8	-54.4	172.2	135.8	0	0	109.7
397	E	35.3	Very low	35.3	Very low	183 Å²	183	137.4 Å²	137.4	86%	0.855	83%	0.831	S	S	*	*			trans	-167.5	105.1	159.7	-108.5	160.3	-148.2	0	0	107.8
398	E	34.1	Very low	35.3	Very low	188 Å²	188	140.9 Å²	140.9	88%	0.879	83%	0.834	S	S	*	*				78.5	115.7	97.1	-73.8	-157.7	154.8	0	0	114.9	G400	E398-G400 PolarHBondContact O-N 2.91Å; E398-G400 VanDerWaalsContact O-N 3.14Å
399	E	29.2	Very low	36.1	Very low	211 Å²	211	143.7 Å²	143.7	99%	0.986	83%	0.831	S	S	*	*			trans	-77.7	91.2	177.6	-64.5	-177.3	150.2	0	0	110.4
400	G	31.6	Very low	36.9	Very low	65 Å²	65	142.4 Å²	142.4	67%	0.67	81%	0.809	S	S	*	*			trans	-93.1	144.1	175.7	0	0	0	0	0	113.9	E398 E402	E398-G400 PolarHBondContact O-N 2.91Å; E398-G400 VanDerWaalsContact O-N 3.14Å; G400-E402 PolarHBondContact O-N 2.85Å
401	E	29.6	Very low	37.9	Very low	197 Å²	197	142.4 Å²	142.4	92%	0.921	79%	0.791	S	S	*	*			trans	-64.1	117.1	-172.9	-61.4	173.6	126.9	0	0	113.7	G403	E401-G403 PolarHBondContact O-N 3.24Å
402	E	30.1	Very low	39.2	Very low	206 Å²	206	142.4 Å²	142.4	96%	0.963	77%	0.771	S	S	*	*			trans	-74	82.5	173.7	-71	-171.1	157.4	0	0	111.8	G400	G400-E402 PolarHBondContact O-N 2.85Å
403	G	29.2	Very low	40.8	Very low	52 Å²	52	141.4 Å²	141.4	54%	0.536	74%	0.739	S	S	.	*			trans	-107.6	111.6	177.8	0	0	0	0	0	114.9	E401 E405	E401-G403 PolarHBondContact O-N 3.24Å; G403-E405 PolarHBondContact O-N 2.89Å
404	E	32.2	Very low	42.4	Very low	206 Å²	206	138.8 Å²	138.8	96%	0.963	70%	0.704	S	S	*	*	S	Bend	trans	61.8	3.8	149.9	-52.9	-159.4	147.1	0	0	122.3
405	E	34.9	Very low	44.2	Very low	180 Å²	180	136.9 Å²	136.9	84%	0.841	69%	0.689	S	S	*	*			trans	-95.6	4.4	179.7	-68.8	-162.8	158.7	0	0	117.2	G403 G407	G403-E405 PolarHBondContact O-N 2.89Å; E405-G407 PolarHBondContact O-N 3.31Å
406	E	43.1	Very low	45.9	Very low	150 Å²	150	131.8 Å²	131.8	70%	0.701	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	3.5	-174.8	-102.4	-145.7	-176.8	0	0	117	K410	E406-K410 PolarHBondContact O-NZ 3.49Å; E406-K410 IonicContact OE2-NZ 2.61Å; E406-K410 PolarHBondContact OE2-NZ 3.49Å
407	G	43.4	Very low	47.9	Very low	57 Å²	57	125.6 Å²	125.6	59%	0.588	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	-58	-172.9	0	0	0	0	0	114.9	E405	E405-G407 PolarHBondContact O-N 3.31Å
408	D	40.3	Very low	49.7	Very low	140 Å²	140	120.6 Å²	120.6	75%	0.749	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	-36.1	-165.6	-76.5	-33.2	0	0	0	113.3	K410 D411 D412	D408-K410 PolarHBondContact O-N 2.97Å; D408-D411 PolarHBondContact O-N 2.83Å; D408-D411 VanDerWaalsContact O-N 3.11Å; D408-D412 PolarHBondContact O-N 3Å
409	D	53.2	Low	51.9	Low	136 Å²	136	117.4 Å²	117.4	73%	0.727	60%	0.598	S	S	*	*	H	α-helix	trans	-51.1	-30.4	178.5	-111.5	8.2	0	0	0	114	Y413	D409-Y413 PolarHBondContact O-N 2.93Å
410	K	56.6	Low	54.4	Low	102 Å²	102	112 Å²	112	44%	0.443	57%	0.571	S	S	.	*	H	α-helix	trans	-74.5	-38.1	-175.6	-67.7	-177	178.6	95.2	0	112	E406 D408	E406-K410 PolarHBondContact O-NZ 3.49Å; E406-K410 IonicContact OE2-NZ 2.61Å; E406-K410 PolarHBondContact OE2-NZ 3.49Å; D408-K410 PolarHBondContact O-N 2.97Å
411	D	58.9	Low	56.6	Low	75 Å²	75	109.8 Å²	109.8	40%	0.401	54%	0.544	S	S	.	.	H	α-helix	trans	-78.8	-37.3	-178.3	-105	-18.1	0	0	0	112.1	D408 Y413 W414 R415 K457	D408-D411 PolarHBondContact O-N 2.83Å; D408-D411 VanDerWaalsContact O-N 3.11Å; D411-Y413 VanDerWaalsContact C-N 3.35Å; D411-Y413 PolarHBondContact O-N 3.36Å; D411-W414 WeakPolarHBondContact O-CB 3.35Å; D411-W414 PolarHBondContact O-N 3.2Å; D411-W414 VanDerWaalsContact O-N 3.09Å; D411-R415 WeakPolarHBondContact O-CG 3.49Å; D411-R415 PolarHBondContact O-N 3.35Å; D411-K457 IonicContact OD1-NZ 2.74Å; D411-K457 PolarHBondContact OD1-NZ 2.97Å
412	D	64.8	Low	59	Low	88 Å²	88	104.7 Å²	104.7	47%	0.471	52%	0.52	S	S	.	.	H	α-helix	trans	-66.9	-35.1	176.9	-77.3	-4.2	0	0	0	112.4	D408 W414 R415 E416	D408-D412 PolarHBondContact O-N 3Å; D412-W414 VanDerWaalsContact C-N 3.29Å; D412-W414 PolarHBondContact O-N 2.96Å; D412-R415 PolarHBondContact O-N 3.22Å; D412-R415 IonicContact OD1-CZ 3.58Å; D412-R415 IonicContact OD1-NE 2.8Å; D412-R415 PolarHBondContact OD1-NE 3.04Å; D412-R415 IonicContact OD1-NH2 3.72Å; D412-E416 PolarHBondContact O-N 2.67Å
413	Y	68.2	Low	61.5	Low	67 Å²	67	99.6 Å²	99.6	26%	0.263	50%	0.498	S	S	.	.	H	α-helix	trans	-59.3	-36.8	169.7	179	-94.3	0	0	0	113.2	D409 D411 Q417	D409-Y413 PolarHBondContact O-N 2.93Å; D411-Y413 VanDerWaalsContact C-N 3.35Å; D411-Y413 PolarHBondContact O-N 3.36Å; Y413-Q417 HydrophobicContact CD1-CG 4.4Å; Y413-Q417 HydrophobicContact CE1-CG 3.9Å; Y413-Q417 HydrophobicContact CE2-CG 4.13Å; Y413-Q417 VanDerWaalsContact O-CG 3.32Å; Y413-Q417 WeakPolarHBondContact O-CG 3.11Å; Y413-Q417 PolarHBondContact O-N 3.05Å; Y413-Q417 PolarHBondContact OH-NE2 2.98Å; Y413-Q417 VanDerWaalsContact OH-NE2 3.12Å
414	W	68.9	Low	63.9	Low	27 Å²	27	101.1 Å²	101.1	10%	0.102	49%	0.491	C	S	.	.	H	α-helix	trans	-70.3	-40.6	175.7	-69.9	113.9	0	0	0	111.7	R376 D411 D412 Q417 Q418 L453 E456 K457	R376-W414 VanDerWaalsContact CZ-CH2 3.49Å; R376-W414 VanDerWaalsContact NH1-CZ2 3.3Å; D411-W414 WeakPolarHBondContact O-CB 3.35Å; D411-W414 PolarHBondContact O-N 3.2Å; D411-W414 VanDerWaalsContact O-N 3.09Å; D412-W414 VanDerWaalsContact C-N 3.29Å; D412-W414 PolarHBondContact O-N 2.96Å; W414-Q417 PolarHBondContact O-N 3.02Å; W414-Q418 WeakPolarHBondContact O-CG 3.46Å; W414-Q418 PolarHBondContact O-N 3.32Å; W414-L453 HydrophobicContact CE3-CD1 3.91Å; W414-L453 HydrophobicContact CE3-CG 3.99Å; W414-L453 HydrophobicContact CZ3-CD1 3.51Å; W414-L453 HydrophobicContact CZ3-CG 3.75Å; W414-L453 WeakPolarHBondContact CZ3-O 3.36Å; W414-E456 HydrophobicContact CH2-CB 4.03Å; W414-E456 HydrophobicContact CH2-CG 4.11Å; W414-K457 HydrophobicContact CB-CD 4.29Å; W414-K457 HydrophobicContact CD2-CB 4.19Å; W414-K457 HydrophobicContact CD2-CD 3.98Å; W414-K457 HydrophobicContact CD2-CG 4.31Å; W414-K457 HydrophobicContact CE3-CB 4.08Å; W414-K457 HydrophobicContact CE3-CD 4.43Å; W414-K457 HydrophobicContact CG-CD 3.92Å; W414-K457 HydrophobicContact CH2-CB 3.69Å; W414-K457 HydrophobicContact CZ2-CB 3.87Å; W414-K457 HydrophobicContact CZ2-CG 4.33Å; W414-K457 HydrophobicContact CZ3-CB 3.81Å
415	R	70.7	Confident	66.1	Low	155 Å²	155	94.1 Å²	94.1	59%	0.585	46%	0.458	S	S	*	.	H	α-helix	trans	-59.1	-51.4	174.5	-62.6	-179.2	-144.3	-103.8	-0.5	110.6	D411 D412 Q417 Q418 E419	D411-R415 WeakPolarHBondContact O-CG 3.49Å; D411-R415 PolarHBondContact O-N 3.35Å; D412-R415 PolarHBondContact O-N 3.22Å; D412-R415 IonicContact OD1-CZ 3.58Å; D412-R415 IonicContact OD1-NE 2.8Å; D412-R415 PolarHBondContact OD1-NE 3.04Å; D412-R415 IonicContact OD1-NH2 3.72Å; R415-Q417 VanDerWaalsContact C-N 3.31Å; R415-Q417 PolarHBondContact O-N 3.5Å; R415-Q418 PolarHBondContact O-N 2.73Å; R415-E419 WeakPolarHBondContact O-CB 3.29Å; R415-E419 PolarHBondContact O-N 3.43Å
416	E	76.7	Confident	68.3	Low	95 Å²	95	92.9 Å²	92.9	44%	0.444	45%	0.445	S	S	.	.	H	α-helix	trans	-54.8	-44.3	178.6	-81.2	-161.4	176.1	0	0	112.6	D412 E419 K420	D412-E416 PolarHBondContact O-N 2.67Å; E416-E419 PolarHBondContact O-N 2.79Å; E416-K420 VanDerWaalsContact O-CB 3.3Å; E416-K420 WeakPolarHBondContact O-CB 3.32Å; E416-K420 WeakPolarHBondContact O-CD 3.17Å; E416-K420 WeakPolarHBondContact O-CG 3.17Å; E416-K420 PolarHBondContact O-N 2.75Å; E416-K420 IonicContact OE2-NZ 2.67Å; E416-K420 PolarHBondContact OE2-NZ 2.86Å
417	Q	73.9	Confident	70.1	Confident	58 Å²	58	88.3 Å²	88.3	27%	0.271	43%	0.433	S	S	.	.	H	α-helix	trans	-73.1	-33.6	-177.2	-68.9	-69.3	-0.9	0	0	112.2	Y413 W414 R415 L421 L453	Y413-Q417 HydrophobicContact CD1-CG 4.4Å; Y413-Q417 HydrophobicContact CE1-CG 3.9Å; Y413-Q417 HydrophobicContact CE2-CG 4.13Å; Y413-Q417 VanDerWaalsContact O-CG 3.32Å; Y413-Q417 WeakPolarHBondContact O-CG 3.11Å; Y413-Q417 PolarHBondContact O-N 3.05Å; Y413-Q417 PolarHBondContact OH-NE2 2.98Å; Y413-Q417 VanDerWaalsContact OH-NE2 3.12Å; W414-Q417 PolarHBondContact O-N 3.02Å; R415-Q417 VanDerWaalsContact C-N 3.31Å; R415-Q417 PolarHBondContact O-N 3.5Å; Q417-L421 WeakPolarHBondContact O-CB 3.33Å; Q417-L421 WeakPolarHBondContact O-CG 3.33Å; Q417-L421 PolarHBondContact O-N 3.03Å; Q417-L421 VanDerWaalsContact O-N 3.14Å; Q417-L453 HydrophobicContact CB-CD2 4Å
418	Q	75.1	Confident	71.8	Confident	78 Å²	78	86.6 Å²	86.6	36%	0.364	41%	0.41	S	S	.	.	H	α-helix	trans	-65.8	-48.4	170.9	-74.9	-179.8	-26.3	0	0	110.7	W414 R415 K420 L421 E422 L453	W414-Q418 WeakPolarHBondContact O-CG 3.46Å; W414-Q418 PolarHBondContact O-N 3.32Å; R415-Q418 PolarHBondContact O-N 2.73Å; Q418-K420 PolarHBondContact O-N 2.8Å; Q418-L421 PolarHBondContact O-N 3.41Å; Q418-E422 PolarHBondContact O-N 3.23Å; Q418-L453 HydrophobicContact CG-CD2 4.09Å
419	E	79.8	Confident	73.5	Confident	121 Å²	121	83.7 Å²	83.7	57%	0.565	40%	0.398	S	S	*	.	H	α-helix	trans	-60.7	-44.6	178.4	-175.3	173.5	-156	0	0	112	R415 E416 L421 E422 I423	R415-E419 WeakPolarHBondContact O-CB 3.29Å; R415-E419 PolarHBondContact O-N 3.43Å; E416-E419 PolarHBondContact O-N 2.79Å; E419-L421 PolarHBondContact O-N 2.74Å; E419-E422 PolarHBondContact O-N 3.17Å; E419-E422 VanDerWaalsContact O-N 3.16Å; E419-I423 HydrophobicContact CG-CD1 3.84Å; E419-I423 HydrophobicContact CG-CG1 4.38Å; E419-I423 VanDerWaalsContact O-CG1 3.31Å; E419-I423 WeakPolarHBondContact O-CG1 3.47Å; E419-I423 PolarHBondContact O-N 3.44Å
420	K	81.6	Confident	74.7	Confident	97 Å²	97	83.6 Å²	83.6	42%	0.422	39%	0.393	S	S	.	.	H	α-helix	trans	-58.6	-45.1	174.7	-75.4	161.6	-172.2	168	0	111.8	E416 Q418 E422 I423 E424	E416-K420 VanDerWaalsContact O-CB 3.3Å; E416-K420 WeakPolarHBondContact O-CB 3.32Å; E416-K420 WeakPolarHBondContact O-CD 3.17Å; E416-K420 WeakPolarHBondContact O-CG 3.17Å; E416-K420 PolarHBondContact O-N 2.75Å; E416-K420 IonicContact OE2-NZ 2.67Å; E416-K420 PolarHBondContact OE2-NZ 2.86Å; Q418-K420 PolarHBondContact O-N 2.8Å; K420-E422 VanDerWaalsContact C-N 3.35Å; K420-I423 PolarHBondContact O-N 3.03Å; K420-E424 WeakPolarHBondContact O-CB 3.31Å; K420-E424 VanDerWaalsContact O-CG 3.28Å; K420-E424 WeakPolarHBondContact O-CG 3.29Å; K420-E424 PolarHBondContact O-N 2.82Å
421	L	77.6	Confident	75.6	Confident	19 Å²	19	81.6 Å²	81.6	10%	0.099	39%	0.387	C	S	.	.	H	α-helix	trans	-67.1	-33.3	176.2	-74.5	170.9	0	0	0	112.8	Q417 Q418 E419 K425 K446 K449 M450 L453	Q417-L421 WeakPolarHBondContact O-CB 3.33Å; Q417-L421 WeakPolarHBondContact O-CG 3.33Å; Q417-L421 PolarHBondContact O-N 3.03Å; Q417-L421 VanDerWaalsContact O-N 3.14Å; Q418-L421 PolarHBondContact O-N 3.41Å; E419-L421 PolarHBondContact O-N 2.74Å; L421-K425 VanDerWaalsContact O-CB 3.3Å; L421-K425 WeakPolarHBondContact O-CB 3.33Å; L421-K425 PolarHBondContact O-N 3.29Å; L421-K446 HydrophobicContact CD2-CD 4.16Å; L421-K449 HydrophobicContact CD2-CB 4.29Å; L421-M450 HydrophobicContact CB-CE 4.4Å; L421-M450 HydrophobicContact CD1-CB 4.49Å; L421-L453 HydrophobicContact CD1-CD2 3.95Å
422	E	78.9	Confident	76	Confident	90 Å²	90	86.6 Å²	86.6	42%	0.421	41%	0.408	S	S	.	.	H	α-helix	trans	-70.7	-43.9	174.7	-77.3	-165.7	-170.8	0	0	112.7	Q418 E419 K420 E424 K425 R426 M450	Q418-E422 PolarHBondContact O-N 3.23Å; E419-E422 PolarHBondContact O-N 3.17Å; E419-E422 VanDerWaalsContact O-N 3.16Å; K420-E422 VanDerWaalsContact C-N 3.35Å; E422-E424 VanDerWaalsContact C-N 3.34Å; E422-K425 PolarHBondContact O-N 2.74Å; E422-K425 VanDerWaalsContact O-N 3.16Å; E422-R426 WeakPolarHBondContact O-CG 3.48Å; E422-R426 PolarHBondContact O-N 3.25Å; E422-R426 IonicContact OE2-NH2 3.91Å; E422-M450 HydrophobicContact CG-CE 3.83Å
423	I	82.8	Confident	76.2	Confident	98 Å²	98	87.2 Å²	87.2	50%	0.503	42%	0.419	S	S	.	.	H	α-helix	trans	-59.6	-46.8	174.7	-69	167	0	0	0	109.7	E419 K420 K425 R426 A427	E419-I423 HydrophobicContact CG-CD1 3.84Å; E419-I423 HydrophobicContact CG-CG1 4.38Å; E419-I423 VanDerWaalsContact O-CG1 3.31Å; E419-I423 WeakPolarHBondContact O-CG1 3.47Å; E419-I423 PolarHBondContact O-N 3.44Å; K420-I423 PolarHBondContact O-N 3.03Å; I423-K425 VanDerWaalsContact C-N 3.34Å; I423-K425 PolarHBondContact O-N 3.22Å; I423-R426 PolarHBondContact O-N 2.79Å; I423-A427 PolarHBondContact O-N 2.84Å
424	E	80.2	Confident	76	Confident	85 Å²	85	86.2 Å²	86.2	40%	0.397	42%	0.418	S	S	.	.	H	α-helix	trans	-61.8	-39.6	174.5	-71.1	-178.6	117.9	0	0	112.3	K420 E422 A427 I428 K446	K420-E424 WeakPolarHBondContact O-CB 3.31Å; K420-E424 VanDerWaalsContact O-CG 3.28Å; K420-E424 WeakPolarHBondContact O-CG 3.29Å; K420-E424 PolarHBondContact O-N 2.82Å; E422-E424 VanDerWaalsContact C-N 3.34Å; E424-A427 PolarHBondContact O-N 2.86Å; E424-I428 VanDerWaalsContact O-CD1 3.32Å; E424-I428 WeakPolarHBondContact O-CD1 3.46Å; E424-I428 VanDerWaalsContact O-CG1 3.28Å; E424-I428 WeakPolarHBondContact O-CG1 3.23Å; E424-I428 PolarHBondContact O-N 3.41Å; E424-I428 VanDerWaalsContact O-N 3.12Å; E424-K446 HydrophobicContact CB-CD 4.41Å; E424-K446 IonicContact OE1-NZ 2.59Å; E424-K446 PolarHBondContact OE1-NZ 3.02Å; E424-K446 IonicContact OE2-NZ 3.91Å; E424-K446 PolarHBondContact OE2-NZ 3.29Å
425	K	78.1	Confident	76.1	Confident	59 Å²	59	89.2 Å²	89.2	26%	0.257	44%	0.439	S	S	.	.	H	α-helix	trans	-63.7	-41.9	175.8	-168.5	176.6	-172.8	172.9	0	111	L421 E422 I423 I428 V429 L443 E447	L421-K425 VanDerWaalsContact O-CB 3.3Å; L421-K425 WeakPolarHBondContact O-CB 3.33Å; L421-K425 PolarHBondContact O-N 3.29Å; E422-K425 PolarHBondContact O-N 2.74Å; E422-K425 VanDerWaalsContact O-N 3.16Å; I423-K425 VanDerWaalsContact C-N 3.34Å; I423-K425 PolarHBondContact O-N 3.22Å; K425-I428 PolarHBondContact O-N 3.44Å; K425-V429 WeakPolarHBondContact O-CG2 3.44Å; K425-V429 PolarHBondContact O-N 2.98Å; K425-V429 VanDerWaalsContact O-N 3.13Å; K425-L443 HydrophobicContact CG-CD2 3.78Å; K425-E447 IonicContact NZ-OE1 2.76Å; K425-E447 PolarHBondContact NZ-OE1 3.21Å
426	R	81.2	Confident	76.2	Confident	153 Å²	153	85.4 Å²	85.4	58%	0.577	44%	0.44	S	S	*	.	H	α-helix	trans	-63.9	-47.2	175.3	-70.4	-178.5	-162.7	-176.7	9.3	111.7	E422 I423 I428 V429 E430	E422-R426 WeakPolarHBondContact O-CG 3.48Å; E422-R426 PolarHBondContact O-N 3.25Å; E422-R426 IonicContact OE2-NH2 3.91Å; I423-R426 PolarHBondContact O-N 2.79Å; R426-I428 VanDerWaalsContact C-N 3.29Å; R426-I428 PolarHBondContact O-N 3.09Å; R426-V429 CarbonylContact O-C 3.36Å; R426-V429 WeakPolarHBondContact O-CA 3.39Å; R426-V429 WeakPolarHBondContact O-CB 3.43Å; R426-V429 PolarHBondContact O-N 2.76Å; R426-E430 PolarHBondContact O-N 3.18Å
427	A	82.3	Confident	75.9	Confident	55 Å²	55	88.5 Å²	88.5	46%	0.455	46%	0.455	S	S	.	.	H	α-helix	trans	-56.2	-41.7	177	0	0	0	0	0	112.5	I423 E424 V429 E430 D431	I423-A427 PolarHBondContact O-N 2.84Å; E424-A427 PolarHBondContact O-N 2.86Å; A427-V429 VanDerWaalsContact C-N 3.33Å; A427-V429 PolarHBondContact O-N 3.39Å; A427-E430 PolarHBondContact O-N 3.44Å; A427-D431 WeakPolarHBondContact O-CB 3.34Å; A427-D431 PolarHBondContact O-N 2.9Å
428	I	78	Confident	76	Confident	20 Å²	20	90 Å²	90	10%	0.103	46%	0.462	C	S	.	.	H	α-helix	trans	-67.1	-32.9	175.2	-63.8	157.2	0	0	0	111.9	E424 K425 R426 L434 K439 L442 L443 K446	E424-I428 VanDerWaalsContact O-CD1 3.32Å; E424-I428 WeakPolarHBondContact O-CD1 3.46Å; E424-I428 VanDerWaalsContact O-CG1 3.28Å; E424-I428 WeakPolarHBondContact O-CG1 3.23Å; E424-I428 PolarHBondContact O-N 3.41Å; E424-I428 VanDerWaalsContact O-N 3.12Å; K425-I428 PolarHBondContact O-N 3.44Å; R426-I428 VanDerWaalsContact C-N 3.29Å; R426-I428 PolarHBondContact O-N 3.09Å; I428-L434 HydrophobicContact CG2-CD1 4.35Å; I428-K439 HydrophobicContact CG2-CG 4.1Å; I428-K439 WeakPolarHBondContact O-CE 3.48Å; I428-K439 PolarHBondContact O-NZ 3.4Å; I428-L442 HydrophobicContact CD1-CB 4.06Å; I428-L442 HydrophobicContact CG2-CB 4.04Å; I428-L443 HydrophobicContact CB-CD2 4.14Å; I428-L443 HydrophobicContact CG2-CD2 3.84Å; I428-L443 HydrophobicContact CG2-CG 3.8Å; I428-K446 HydrophobicContact CD1-CG 3.79Å
429	V	77.1	Confident	76	Confident	80 Å²	80	88.2 Å²	88.2	49%	0.485	45%	0.453	S	S	.	.	H	α-helix	trans	-72.6	-36	175.2	172.6	0	0	0	0	112.1	K425 R426 A427 K439 L443	K425-V429 WeakPolarHBondContact O-CG2 3.44Å; K425-V429 PolarHBondContact O-N 2.98Å; K425-V429 VanDerWaalsContact O-N 3.13Å; R426-V429 CarbonylContact O-C 3.36Å; R426-V429 WeakPolarHBondContact O-CA 3.39Å; R426-V429 WeakPolarHBondContact O-CB 3.43Å; R426-V429 PolarHBondContact O-N 2.76Å; A427-V429 VanDerWaalsContact C-N 3.33Å; A427-V429 PolarHBondContact O-N 3.39Å; V429-K439 WeakPolarHBondContact O-CE 3.38Å; V429-K439 PolarHBondContact O-NZ 3.33Å; V429-L443 HydrophobicContact CG2-CD1 4.31Å; V429-L443 HydrophobicContact CG2-CD2 3.85Å
430	E	77.1	Confident	75.8	Confident	134 Å²	134	89.3 Å²	89.3	63%	0.626	46%	0.46	S	S	*	.	H	α-helix	trans	-83.4	-23.7	-178.5	-70.4	169.2	-168.7	0	0	113.2	R426 A427 H432	R426-E430 PolarHBondContact O-N 3.18Å; A427-E430 PolarHBondContact O-N 3.44Å; E430-H432 PolarHBondContact O-CD2 2.79Å; E430-H432 VanDerWaalsContact O-CD2 3.26Å; E430-H432 PolarHBondContact O-N 2.69Å; E430-H432 VanDerWaalsContact O-N 3.12Å
431	D	74.9	Confident	75.8	Confident	59 Å²	59	92 Å²	92	32%	0.316	47%	0.467	S	S	.	.			trans	-68.4	111	175.4	-171.8	-7.5	0	0	0	111.5	A427 S433 L434 K439	A427-D431 WeakPolarHBondContact O-CB 3.34Å; A427-D431 PolarHBondContact O-N 2.9Å; D431-S433 WeakPolarHBondContact OD1-CA 3.49Å; D431-S433 VanDerWaalsContact OD1-CB 3.31Å; D431-S433 WeakPolarHBondContact OD1-CB 3.3Å; D431-S433 PolarHBondContact OD1-N 3.22Å; D431-S433 PolarHBondContact OD1-OG 3.15Å; D431-S433 PolarHBondContact OD2-OG 3.2Å; D431-L434 HydrophobicContact CB-CD1 4.01Å; D431-L434 HydrophobicContact CB-CG 4.43Å; D431-L434 WeakPolarHBondContact OD2-CG 3.43Å; D431-K439 PolarHBondContact O-NZ 3.34Å
432	H	68.3	Low	75.8	Confident	180 Å²	180	93.6 Å²	93.6	83%	0.833	48%	0.475	S	S	*	.	S	Bend	trans	-87.8	-4.6	177.6	-69.1	-69.2	0	0	0	114	E430	E430-H432 PolarHBondContact O-CD2 2.79Å; E430-H432 VanDerWaalsContact O-CD2 3.26Å; E430-H432 PolarHBondContact O-N 2.69Å; E430-H432 VanDerWaalsContact O-N 3.12Å
433	S	69.7	Low	75.9	Confident	101 Å²	101	91.2 Å²	91.2	71%	0.706	47%	0.466	S	S	*	.	S	Bend	trans	-85.2	-21.5	179.4	74.1	0	0	0	0	113.7	D431	D431-S433 WeakPolarHBondContact OD1-CA 3.49Å; D431-S433 VanDerWaalsContact OD1-CB 3.31Å; D431-S433 WeakPolarHBondContact OD1-CB 3.3Å; D431-S433 PolarHBondContact OD1-N 3.22Å; D431-S433 PolarHBondContact OD1-OG 3.15Å; D431-S433 PolarHBondContact OD2-OG 3.2Å
434	L	62.7	Low	76	Confident	46 Å²	46	94.1 Å²	94.1	24%	0.241	47%	0.474	C	S	.	.	S	Bend	trans	-72.3	134.3	-179.4	-71.4	167.9	0	0	0	112.7	I428 D431 A436 K439 L442	I428-L434 HydrophobicContact CG2-CD1 4.35Å; D431-L434 HydrophobicContact CB-CD1 4.01Å; D431-L434 HydrophobicContact CB-CG 4.43Å; D431-L434 WeakPolarHBondContact OD2-CG 3.43Å; L434-A436 PolarHBondContact O-N 2.51Å; L434-K439 HydrophobicContact CB-CB 4.24Å; L434-L442 HydrophobicContact CD1-CD1 4.17Å; L434-L442 HydrophobicContact CD2-CD1 4.38Å
435	V	71.1	Confident	76.1	Confident	91 Å²	91	94 Å²	94	55%	0.552	47%	0.474	S	S	*	.			trans	-59	136.8	168.7	-179.5	0	0	0	0	109.4	E437 E438 K439	V435-E437 HydrophobicContact CG1-CB 4.48Å; V435-E437 PolarHBondContact O-N 2.84Å; V435-E437 VanDerWaalsContact O-N 3.08Å; V435-E438 PolarHBondContact O-N 2.9Å; V435-K439 PolarHBondContact O-N 2.99Å
436	A	72.4	Confident	76.2	Confident	74 Å²	74	92.6 Å²	92.6	61%	0.612	47%	0.468	S	S	*	.	H	α-helix	trans	-54.4	-34	-174.2	0	0	0	0	0	113.9	L434 M440	L434-A436 PolarHBondContact O-N 2.51Å; A436-M440 PolarHBondContact O-N 2.98Å
437	E	72.1	Confident	76.1	Confident	161 Å²	161	90.4 Å²	90.4	75%	0.752	46%	0.464	S	S	*	.	H	α-helix	trans	-67.3	-44.4	175	-62.6	-169.6	159	0	0	112.9	V435 M440 R441	V435-E437 HydrophobicContact CG1-CB 4.48Å; V435-E437 PolarHBondContact O-N 2.84Å; V435-E437 VanDerWaalsContact O-N 3.08Å; E437-M440 PolarHBondContact O-N 3.48Å; E437-R441 WeakPolarHBondContact O-CB 3.47Å; E437-R441 PolarHBondContact O-N 2.93Å
438	E	74.7	Confident	76.2	Confident	88 Å²	88	94.3 Å²	94.3	41%	0.411	47%	0.471	S	S	.	.	H	α-helix	trans	-67.4	-40.9	176.7	-68.3	-153.9	118	0	0	111.5	V435 M440 R441 L442	V435-E438 PolarHBondContact O-N 2.9Å; E438-M440 PolarHBondContact O-N 3.22Å; E438-R441 WeakPolarHBondContact O-CB 3.18Å; E438-R441 PolarHBondContact O-N 3.39Å; E438-R441 VanDerWaalsContact O-N 3.1Å; E438-R441 IonicContact OE1-NH1 3.87Å; E438-L442 WeakPolarHBondContact O-CB 3.45Å; E438-L442 WeakPolarHBondContact O-CG 3.49Å; E438-L442 PolarHBondContact O-N 3.49Å
439	K	74.9	Confident	76.3	Confident	42 Å²	42	97.7 Å²	97.7	18%	0.183	49%	0.485	C	S	.	.	H	α-helix	trans	-56.8	-47.8	173.6	-171	167	-177.7	135.1	0	111.4	I428 V429 D431 L434 V435 R441 L442 L443	I428-K439 HydrophobicContact CG2-CG 4.1Å; I428-K439 WeakPolarHBondContact O-CE 3.48Å; I428-K439 PolarHBondContact O-NZ 3.4Å; V429-K439 WeakPolarHBondContact O-CE 3.38Å; V429-K439 PolarHBondContact O-NZ 3.33Å; D431-K439 PolarHBondContact O-NZ 3.34Å; L434-K439 HydrophobicContact CB-CB 4.24Å; V435-K439 PolarHBondContact O-N 2.99Å; K439-R441 PolarHBondContact O-N 3.11Å; K439-L442 PolarHBondContact O-N 2.97Å; K439-L443 HydrophobicContact CG-CD1 4.25Å; K439-L443 WeakPolarHBondContact O-CB 3.22Å; K439-L443 VanDerWaalsContact O-CG 3.24Å; K439-L443 WeakPolarHBondContact O-CG 3.28Å; K439-L443 PolarHBondContact O-N 2.89Å
440	M	75.7	Confident	76.2	Confident	143 Å²	143	96.2 Å²	96.2	70%	0.704	47%	0.473	S	S	*	.	H	α-helix	trans	-62.4	-39.9	172.7	-85.6	-130.1	-76.1	0	0	113.1	A436 E437 E438 K444	A436-M440 PolarHBondContact O-N 2.98Å; E437-M440 PolarHBondContact O-N 3.48Å; E438-M440 PolarHBondContact O-N 3.22Å; M440-K444 VanDerWaalsContact O-CB 3.29Å; M440-K444 WeakPolarHBondContact O-CB 3.44Å; M440-K444 PolarHBondContact O-N 3.13Å
441	R	81.9	Confident	76.5	Confident	155 Å²	155	93.3 Å²	93.3	59%	0.585	46%	0.46	S	S	*	.	H	α-helix	trans	-62.2	-46.5	177.9	-160.8	-176.3	90	-150.6	1.8	111.5	E437 E438 K439 K444 E445	E437-R441 WeakPolarHBondContact O-CB 3.47Å; E437-R441 PolarHBondContact O-N 2.93Å; E438-R441 WeakPolarHBondContact O-CB 3.18Å; E438-R441 PolarHBondContact O-N 3.39Å; E438-R441 VanDerWaalsContact O-N 3.1Å; E438-R441 IonicContact OE1-NH1 3.87Å; K439-R441 PolarHBondContact O-N 3.11Å; R441-K444 PolarHBondContact O-N 3.48Å; R441-E445 PolarHBondContact O-N 3.25Å
442	L	78.5	Confident	76.7	Confident	51 Å²	51	94.1 Å²	94.1	27%	0.267	46%	0.464	S	S	.	.	H	α-helix	trans	-66.3	-44.9	179.3	-70.2	170.3	0	0	0	111.8	I428 L434 E438 K439 K444 E445 K446	I428-L442 HydrophobicContact CD1-CB 4.06Å; I428-L442 HydrophobicContact CG2-CB 4.04Å; L434-L442 HydrophobicContact CD1-CD1 4.17Å; L434-L442 HydrophobicContact CD2-CD1 4.38Å; E438-L442 WeakPolarHBondContact O-CB 3.45Å; E438-L442 WeakPolarHBondContact O-CG 3.49Å; E438-L442 PolarHBondContact O-N 3.49Å; K439-L442 PolarHBondContact O-N 2.97Å; L442-K444 PolarHBondContact O-N 2.73Å; L442-E445 PolarHBondContact O-N 2.92Å; L442-K446 WeakPolarHBondContact O-CG 3.47Å; L442-K446 PolarHBondContact O-N 2.66Å
443	L	80.7	Confident	77.1	Confident	41 Å²	41	86.7 Å²	86.7	22%	0.215	43%	0.43	C	S	.	.	H	α-helix	trans	-59.9	-45	175.9	-71.4	171.5	0	0	0	111.7	K425 I428 V429 K439 E445 K446 E447	K425-L443 HydrophobicContact CG-CD2 3.78Å; I428-L443 HydrophobicContact CB-CD2 4.14Å; I428-L443 HydrophobicContact CG2-CD2 3.84Å; I428-L443 HydrophobicContact CG2-CG 3.8Å; V429-L443 HydrophobicContact CG2-CD1 4.31Å; V429-L443 HydrophobicContact CG2-CD2 3.85Å; K439-L443 HydrophobicContact CG-CD1 4.25Å; K439-L443 WeakPolarHBondContact O-CB 3.22Å; K439-L443 VanDerWaalsContact O-CG 3.24Å; K439-L443 WeakPolarHBondContact O-CG 3.28Å; K439-L443 PolarHBondContact O-N 2.89Å; L443-E445 VanDerWaalsContact C-N 3.3Å; L443-E445 PolarHBondContact O-N 3.47Å; L443-K446 PolarHBondContact O-N 3.09Å; L443-E447 VanDerWaalsContact O-CB 3.25Å; L443-E447 WeakPolarHBondContact O-CB 3.4Å; L443-E447 PolarHBondContact O-N 2.95Å
444	K	83.5	Confident	77.5	Confident	158 Å²	158	88.7 Å²	88.7	69%	0.687	42%	0.422	S	S	*	.	H	α-helix	trans	-63.4	-34.2	176.7	-171.6	173.2	-176.1	173.9	0	112.6	M440 R441 L442 K448	M440-K444 VanDerWaalsContact O-CB 3.29Å; M440-K444 WeakPolarHBondContact O-CB 3.44Å; M440-K444 PolarHBondContact O-N 3.13Å; R441-K444 PolarHBondContact O-N 3.48Å; L442-K444 PolarHBondContact O-N 2.73Å; K444-K448 VanDerWaalsContact O-CB 3.32Å; K444-K448 WeakPolarHBondContact O-CB 3.45Å; K444-K448 PolarHBondContact O-N 2.72Å
445	E	83.1	Confident	78.5	Confident	83 Å²	83	93.3 Å²	93.3	39%	0.388	44%	0.437	S	S	.	.	H	α-helix	trans	-70.6	-43.2	175.2	-163.6	-166.8	133.3	0	0	112.3	R441 L442 L443 K448 K449	R441-E445 PolarHBondContact O-N 3.25Å; L442-E445 PolarHBondContact O-N 2.92Å; L443-E445 VanDerWaalsContact C-N 3.3Å; L443-E445 PolarHBondContact O-N 3.47Å; E445-K448 PolarHBondContact O-N 2.85Å; E445-K449 WeakPolarHBondContact O-CG 3.47Å; E445-K449 PolarHBondContact O-N 3.02Å; E445-K449 WeakPolarHBondContact OE1-CE 3.36Å; E445-K449 IonicContact OE1-NZ 2.85Å; E445-K449 PolarHBondContact OE1-NZ 3.36Å
446	K	80.9	Confident	78.7	Confident	30 Å²	30	92.1 Å²	92.1	13%	0.13	43%	0.425	C	S	.	.	H	α-helix	trans	-66.4	-41	175.9	-66	-64.6	-173.1	178.6	0	111.9	L421 E424 I428 L442 L443 K449 M450	L421-K446 HydrophobicContact CD2-CD 4.16Å; E424-K446 HydrophobicContact CB-CD 4.41Å; E424-K446 IonicContact OE1-NZ 2.59Å; E424-K446 PolarHBondContact OE1-NZ 3.02Å; E424-K446 IonicContact OE2-NZ 3.91Å; E424-K446 PolarHBondContact OE2-NZ 3.29Å; I428-K446 HydrophobicContact CD1-CG 3.79Å; L442-K446 WeakPolarHBondContact O-CG 3.47Å; L442-K446 PolarHBondContact O-N 2.66Å; L443-K446 PolarHBondContact O-N 3.09Å; K446-K449 WeakPolarHBondContact O-CB 3.38Å; K446-K449 PolarHBondContact O-N 2.85Å; K446-M450 WeakPolarHBondContact O-CB 3.38Å; K446-M450 PolarHBondContact O-N 2.72Å
447	E	79.2	Confident	78.9	Confident	107 Å²	107	90.5 Å²	90.5	50%	0.5	40%	0.404	S	S	.	.	H	α-helix	trans	-64	-42.9	175.5	-174.3	157.9	-98.2	0	0	112	K425 L443 K449 M450 E451	K425-E447 IonicContact NZ-OE1 2.76Å; K425-E447 PolarHBondContact NZ-OE1 3.21Å; L443-E447 VanDerWaalsContact O-CB 3.25Å; L443-E447 WeakPolarHBondContact O-CB 3.4Å; L443-E447 PolarHBondContact O-N 2.95Å; E447-K449 VanDerWaalsContact C-N 3.35Å; E447-K449 PolarHBondContact O-N 3.44Å; E447-M450 PolarHBondContact O-N 3.46Å; E447-E451 WeakPolarHBondContact O-CB 3.3Å; E447-E451 PolarHBondContact O-N 3.4Å
448	K	84.5	Confident	79.4	Confident	136 Å²	136	86.4 Å²	86.4	59%	0.591	39%	0.387	S	S	*	.	H	α-helix	trans	-59.7	-43.8	171.3	-174.2	-176.7	174.7	-173.7	0	111.9	K444 E445 M450 E451 D452	K444-K448 VanDerWaalsContact O-CB 3.32Å; K444-K448 WeakPolarHBondContact O-CB 3.45Å; K444-K448 PolarHBondContact O-N 2.72Å; E445-K448 PolarHBondContact O-N 2.85Å; K448-M450 VanDerWaalsContact C-N 3.34Å; K448-M450 PolarHBondContact O-N 3.47Å; K448-E451 PolarHBondContact O-N 2.99Å; K448-D452 WeakPolarHBondContact O-CB 3.3Å; K448-D452 VanDerWaalsContact O-CG 3.28Å; K448-D452 PolarHBondContact O-N 3.48Å
449	K	78.4	Confident	79.7	Confident	91 Å²	91	84 Å²	84	40%	0.396	38%	0.382	S	S	.	.	H	α-helix	trans	-62.3	-38.6	176.7	-77.4	167.1	172.4	169.8	0	112.6	L421 E445 K446 E447 L453	L421-K449 HydrophobicContact CD2-CB 4.29Å; E445-K449 WeakPolarHBondContact O-CG 3.47Å; E445-K449 PolarHBondContact O-N 3.02Å; E445-K449 WeakPolarHBondContact OE1-CE 3.36Å; E445-K449 IonicContact OE1-NZ 2.85Å; E445-K449 PolarHBondContact OE1-NZ 3.36Å; K446-K449 WeakPolarHBondContact O-CB 3.38Å; K446-K449 PolarHBondContact O-N 2.85Å; E447-K449 VanDerWaalsContact C-N 3.35Å; E447-K449 PolarHBondContact O-N 3.44Å; K449-L453 VanDerWaalsContact O-CB 3.25Å; K449-L453 WeakPolarHBondContact O-CB 3.43Å; K449-L453 PolarHBondContact O-N 2.82Å
450	M	76.7	Confident	79.8	Confident	49 Å²	49	83.2 Å²	83.2	24%	0.241	38%	0.384	C	S	.	.	H	α-helix	trans	-66.6	-42.8	176.2	-175.9	-176.8	-78.3	0	0	111.8	L421 E422 K446 E447 K448 L453 R454	L421-M450 HydrophobicContact CB-CE 4.4Å; L421-M450 HydrophobicContact CD1-CB 4.49Å; E422-M450 HydrophobicContact CG-CE 3.83Å; K446-M450 WeakPolarHBondContact O-CB 3.38Å; K446-M450 PolarHBondContact O-N 2.72Å; E447-M450 PolarHBondContact O-N 3.46Å; K448-M450 VanDerWaalsContact C-N 3.34Å; K448-M450 PolarHBondContact O-N 3.47Å; M450-L453 PolarHBondContact O-N 3.36Å; M450-R454 WeakPolarHBondContact O-CB 3.23Å; M450-R454 PolarHBondContact O-N 2.84Å
451	E	81.8	Confident	80	Confident	74 Å²	74	81.5 Å²	81.5	35%	0.346	37%	0.374	S	S	.	.	H	α-helix	trans	-66.3	-43	174.8	176.2	63.9	-173	0	0	112.2	E447 K448 L453 R454 R455	E447-E451 WeakPolarHBondContact O-CB 3.3Å; E447-E451 PolarHBondContact O-N 3.4Å; K448-E451 PolarHBondContact O-N 2.99Å; E451-L453 VanDerWaalsContact C-N 3.35Å; E451-L453 PolarHBondContact O-N 2.91Å; E451-R454 PolarHBondContact O-N 2.74Å; E451-R455 VanDerWaalsContact O-CG 3.31Å; E451-R455 WeakPolarHBondContact O-CG 3.29Å; E451-R455 PolarHBondContact O-N 2.83Å; E451-R455 IonicContact OE1-CZ 3.63Å; E451-R455 IonicContact OE1-NE 3.29Å; E451-R455 PolarHBondContact OE1-NE 3.04Å; E451-R455 IonicContact OE1-NH2 3.75Å; E451-R455 PolarHBondContact OE1-NH2 2.88Å
452	D	80.3	Confident	80	Confident	75 Å²	75	81 Å²	81	40%	0.401	38%	0.38	S	S	.	.	H	α-helix	trans	-63.1	-40.6	175.4	-72.4	-25.7	0	0	0	111.1	K448 R455 E456	K448-D452 WeakPolarHBondContact O-CB 3.3Å; K448-D452 VanDerWaalsContact O-CG 3.28Å; K448-D452 PolarHBondContact O-N 3.48Å; D452-R455 PolarHBondContact O-N 3.08Å; D452-E456 PolarHBondContact O-N 2.9Å; D452-E456 VanDerWaalsContact O-N 3.07Å
453	L	76.4	Confident	79.9	Confident	24 Å²	24	79.9 Å²	79.9	13%	0.126	37%	0.374	C	S	.	.	H	α-helix	trans	-63.5	-43.6	175.2	-172.1	74.9	0	0	0	111.6	W414 Q417 Q418 L421 K449 M450 E451 E456 K457	W414-L453 HydrophobicContact CE3-CD1 3.91Å; W414-L453 HydrophobicContact CE3-CG 3.99Å; W414-L453 HydrophobicContact CZ3-CD1 3.51Å; W414-L453 HydrophobicContact CZ3-CG 3.75Å; W414-L453 WeakPolarHBondContact CZ3-O 3.36Å; Q417-L453 HydrophobicContact CB-CD2 4Å; Q418-L453 HydrophobicContact CG-CD2 4.09Å; L421-L453 HydrophobicContact CD1-CD2 3.95Å; K449-L453 VanDerWaalsContact O-CB 3.25Å; K449-L453 WeakPolarHBondContact O-CB 3.43Å; K449-L453 PolarHBondContact O-N 2.82Å; M450-L453 PolarHBondContact O-N 3.36Å; E451-L453 VanDerWaalsContact C-N 3.35Å; E451-L453 PolarHBondContact O-N 2.91Å; L453-E456 PolarHBondContact O-N 2.85Å; L453-K457 PolarHBondContact O-N 3.49Å
454	R	78.5	Confident	79.8	Confident	144 Å²	144	79.2 Å²	79.2	54%	0.543	38%	0.377	S	S	.	.	H	α-helix	trans	-61.5	-47.9	176.3	-176.6	-178.2	-179.5	168.5	5.9	111.7	M450 E451 E456 K457 D458	M450-R454 WeakPolarHBondContact O-CB 3.23Å; M450-R454 PolarHBondContact O-N 2.84Å; E451-R454 PolarHBondContact O-N 2.74Å; R454-E456 VanDerWaalsContact C-N 3.25Å; R454-E456 PolarHBondContact O-N 2.81Å; R454-K457 PolarHBondContact O-N 2.84Å; R454-K457 VanDerWaalsContact O-N 3.08Å; R454-D458 IonicContact NE-OD2 3.73Å; R454-D458 VanDerWaalsContact O-CG 3.29Å; R454-D458 PolarHBondContact O-N 3.2Å
455	R	82.4	Confident	79.8	Confident	143 Å²	143	74.3 Å²	74.3	54%	0.54	37%	0.367	S	S	.	.	H	α-helix	trans	-60.1	-34.7	176.4	-70.7	170.7	-174.5	-177.8	3	112.7	E451 D452 A459	E451-R455 VanDerWaalsContact O-CG 3.31Å; E451-R455 WeakPolarHBondContact O-CG 3.29Å; E451-R455 PolarHBondContact O-N 2.83Å; E451-R455 IonicContact OE1-CZ 3.63Å; E451-R455 IonicContact OE1-NE 3.29Å; E451-R455 PolarHBondContact OE1-NE 3.04Å; E451-R455 IonicContact OE1-NH2 3.75Å; E451-R455 PolarHBondContact OE1-NH2 2.88Å; D452-R455 PolarHBondContact O-N 3.08Å; R455-A459 WeakPolarHBondContact O-CB 3.4Å; R455-A459 PolarHBondContact O-N 2.79Å
456	E	77	Confident	79.6	Confident	65 Å²	65	74.7 Å²	74.7	30%	0.304	37%	0.367	S	S	.	.	H	α-helix	trans	-67.1	-42	174.5	-164.6	-171.9	172.8	0	0	111.4	R376 W414 D452 L453 R454 A460	R376-E456 IonicContact CZ-OE1 3.24Å; R376-E456 IonicContact CZ-OE2 3.19Å; R376-E456 IonicContact NE-OE1 2.85Å; R376-E456 PolarHBondContact NE-OE1 2.66Å; R376-E456 IonicContact NE-OE2 2.74Å; R376-E456 IonicContact NH2-OE1 2.74Å; R376-E456 PolarHBondContact NH2-OE1 3.23Å; R376-E456 IonicContact NH2-OE2 2.64Å; R376-E456 PolarHBondContact NH2-OE2 3.45Å; W414-E456 HydrophobicContact CH2-CB 4.03Å; W414-E456 HydrophobicContact CH2-CG 4.11Å; D452-E456 PolarHBondContact O-N 2.9Å; D452-E456 VanDerWaalsContact O-N 3.07Å; L453-E456 PolarHBondContact O-N 2.85Å; R454-E456 VanDerWaalsContact C-N 3.25Å; R454-E456 PolarHBondContact O-N 2.81Å; E456-A460 WeakPolarHBondContact O-CB 3.29Å; E456-A460 PolarHBondContact O-N 2.76Å
457	K	76.3	Confident	79.4	Confident	41 Å²	41	73.7 Å²	73.7	18%	0.178	36%	0.363	C	S	.	.	H	α-helix	trans	-63.3	-55.7	174.5	-178.6	163.2	175.8	155.5	0	111.2	D411 W414 L453 R454 A459 A460 E461	D411-K457 IonicContact OD1-NZ 2.74Å; D411-K457 PolarHBondContact OD1-NZ 2.97Å; W414-K457 HydrophobicContact CB-CD 4.29Å; W414-K457 HydrophobicContact CD2-CB 4.19Å; W414-K457 HydrophobicContact CD2-CD 3.98Å; W414-K457 HydrophobicContact CD2-CG 4.31Å; W414-K457 HydrophobicContact CE3-CB 4.08Å; W414-K457 HydrophobicContact CE3-CD 4.43Å; W414-K457 HydrophobicContact CG-CD 3.92Å; W414-K457 HydrophobicContact CH2-CB 3.69Å; W414-K457 HydrophobicContact CZ2-CB 3.87Å; W414-K457 HydrophobicContact CZ2-CG 4.33Å; W414-K457 HydrophobicContact CZ3-CB 3.81Å; L453-K457 PolarHBondContact O-N 3.49Å; R454-K457 PolarHBondContact O-N 2.84Å; R454-K457 VanDerWaalsContact O-N 3.08Å; K457-A459 PolarHBondContact O-N 3.44Å; K457-A460 WeakPolarHBondContact O-CA 3.48Å; K457-A460 WeakPolarHBondContact O-CB 3.4Å; K457-A460 PolarHBondContact O-N 2.67Å; K457-E461 WeakPolarHBondContact CE-OE1 3.47Å; K457-E461 HydrophobicContact CG-CG 4.35Å; K457-E461 IonicContact NZ-OE1 2.66Å; K457-E461 PolarHBondContact O-N 3.04Å
458	D	82	Confident	79.5	Confident	74 Å²	74	76.2 Å²	76.2	40%	0.396	37%	0.372	S	S	.	.	H	α-helix	trans	-54.6	-41.4	179.3	-63.1	-8.9	0	0	0	111.2	R454 M462	R454-D458 IonicContact NE-OD2 3.73Å; R454-D458 VanDerWaalsContact O-CG 3.29Å; R454-D458 PolarHBondContact O-N 3.2Å; D458-M462 VanDerWaalsContact O-CB 3.3Å; D458-M462 WeakPolarHBondContact O-CB 3.37Å; D458-M462 WeakPolarHBondContact O-CG 3.45Å; D458-M462 PolarHBondContact O-N 3.18Å
459	A	80.1	Confident	79.4	Confident	37 Å²	37	72.1 Å²	72.1	31%	0.306	36%	0.364	S	S	.	.	H	α-helix	trans	-71.6	-30.6	177.2	0	0	0	0	0	113.8	R455 K457 L463	R455-A459 WeakPolarHBondContact O-CB 3.4Å; R455-A459 PolarHBondContact O-N 2.79Å; K457-A459 PolarHBondContact O-N 3.44Å; A459-L463 WeakPolarHBondContact O-CB 3.39Å; A459-L463 PolarHBondContact O-N 3.21Å
460	A	77.3	Confident	79.4	Confident	27 Å²	27	68.5 Å²	68.5	22%	0.223	35%	0.349	C	S	.	.	H	α-helix	trans	-74	-43.2	174.3	0	0	0	0	0	111.4	E456 K457 L463 G464	E456-A460 WeakPolarHBondContact O-CB 3.29Å; E456-A460 PolarHBondContact O-N 2.76Å; K457-A460 WeakPolarHBondContact O-CA 3.48Å; K457-A460 WeakPolarHBondContact O-CB 3.4Å; K457-A460 PolarHBondContact O-N 2.67Å; A460-L463 PolarHBondContact O-N 3.18Å; A460-G464 PolarHBondContact O-N 2.93Å
461	E	80.4	Confident	79.5	Confident	107 Å²	107	69.8 Å²	69.8	50%	0.5	35%	0.354	S	S	.	.	H	α-helix	trans	-61	-46.2	174.3	-72.4	-176.3	-178.1	0	0	111.7	K457 L463 G464 A465	K457-E461 WeakPolarHBondContact CE-OE1 3.47Å; K457-E461 HydrophobicContact CG-CG 4.35Å; K457-E461 IonicContact NZ-OE1 2.66Å; K457-E461 PolarHBondContact O-N 3.04Å; E461-L463 PolarHBondContact O-N 3Å; E461-G464 PolarHBondContact O-N 2.56Å; E461-A465 VanDerWaalsContact O-CB 3.23Å; E461-A465 WeakPolarHBondContact O-CB 3.45Å; E461-A465 PolarHBondContact O-N 2.87Å
462	M	82.2	Confident	79.4	Confident	143 Å²	143	69 Å²	69	70%	0.704	36%	0.356	S	S	*	.	H	α-helix	trans	-57.9	-37.3	174.6	-79.4	-72.2	-71.5	0	0	112.6	D458 K466	D458-M462 VanDerWaalsContact O-CB 3.3Å; D458-M462 WeakPolarHBondContact O-CB 3.37Å; D458-M462 WeakPolarHBondContact O-CG 3.45Å; D458-M462 PolarHBondContact O-N 3.18Å; M462-K466 WeakPolarHBondContact O-CB 3.3Å; M462-K466 PolarHBondContact O-N 3.02Å
463	L	76.7	Confident	79.4	Confident	28 Å²	28	68.9 Å²	68.9	15%	0.147	35%	0.353	C	S	.	.	H	α-helix	trans	-78.5	-38	-179.1	-156.1	134.3	0	0	0	111.9	L365 Q368 L369 A459 A460 E461 K466 I467	L365-L463 HydrophobicContact CB-CD2 3.96Å; L365-L463 HydrophobicContact CD2-CD1 3.83Å; L365-L463 HydrophobicContact CD2-CD2 4.04Å; L365-L463 HydrophobicContact CD2-CG 3.91Å; L365-L463 VanDerWaalsContact O-CD2 3.31Å; L365-L463 WeakPolarHBondContact O-CD2 3.38Å; Q368-L463 HydrophobicContact CB-CD2 4.37Å; L369-L463 HydrophobicContact CD1-CD2 4.4Å; L369-L463 HydrophobicContact CD2-CB 4.17Å; L369-L463 HydrophobicContact CD2-CD2 3.68Å; L369-L463 HydrophobicContact CG-CD2 3.58Å; A459-L463 WeakPolarHBondContact O-CB 3.39Å; A459-L463 PolarHBondContact O-N 3.21Å; A460-L463 PolarHBondContact O-N 3.18Å; E461-L463 PolarHBondContact O-N 3Å; L463-K466 PolarHBondContact O-N 3.46Å; L463-I467 HydrophobicContact CD2-CD1 3.95Å; L463-I467 WeakPolarHBondContact O-CG1 3.39Å; L463-I467 PolarHBondContact O-N 2.91Å
464	G	78	Confident	79.4	Confident	27 Å²	27	68.7 Å²	68.7	28%	0.278	35%	0.352	S	S	.	.	H	α-helix	trans	-63.2	-41.9	169.6	0	0	0	0	0	112.6	A460 E461 I467 K468	A460-G464 PolarHBondContact O-N 2.93Å; E461-G464 PolarHBondContact O-N 2.56Å; G464-I467 PolarHBondContact O-N 3.4Å; G464-K468 WeakPolarHBondContact O-CB 3.38Å; G464-K468 PolarHBondContact O-N 3.12Å
465	A	83	Confident	79.4	Confident	56 Å²	56	63.3 Å²	63.3	46%	0.463	33%	0.333	S	S	.	.	H	α-helix	trans	-62.9	-40	172.7	0	0	0	0	0	111.8	E461 A469	E461-A465 VanDerWaalsContact O-CB 3.23Å; E461-A465 WeakPolarHBondContact O-CB 3.45Å; E461-A465 PolarHBondContact O-N 2.87Å; A465-A469 WeakPolarHBondContact O-CB 3.28Å; A465-A469 PolarHBondContact O-N 2.76Å
466	K	79.8	Confident	78.8	Confident	90 Å²	90	59.4 Å²	59.4	39%	0.391	33%	0.325	S	S	.	.	H	α-helix	trans	-62.8	-44.4	173.5	-170.6	-172.5	170.1	-166.3	0	111.7	E361 L365 M462 L463 A469 M470	E361-K466 IonicContact OE1-NZ 3.2Å; E361-K466 PolarHBondContact OE1-NZ 3.09Å; L365-K466 HydrophobicContact CD1-CD 3.82Å; L365-K466 HydrophobicContact CD1-CG 4.35Å; M462-K466 WeakPolarHBondContact O-CB 3.3Å; M462-K466 PolarHBondContact O-N 3.02Å; L463-K466 PolarHBondContact O-N 3.46Å; K466-A469 PolarHBondContact O-N 3.42Å; K466-M470 HydrophobicContact CD-CE 4.5Å; K466-M470 HydrophobicContact CG-CE 4.04Å; K466-M470 WeakPolarHBondContact O-CE 3.47Å; K466-M470 WeakPolarHBondContact O-CG 3.18Å; K466-M470 PolarHBondContact O-N 3.23Å; K466-M470 VanDerWaalsContact O-N 3.09Å
467	I	77.3	Confident	78.2	Confident	10 Å²	10	56.8 Å²	56.8	5%	0.051	32%	0.316	C	S	.	.	H	α-helix	trans	-60.4	-55.5	175.3	-69.6	162.9	0	0	0	110	L365 K366 L369 L463 G464 A469 M470 E471	L365-I467 HydrophobicContact CB-CD1 3.82Å; L365-I467 HydrophobicContact CB-CG1 3.66Å; L365-I467 HydrophobicContact CD1-CG1 4.42Å; K366-I467 HydrophobicContact CG-CD1 4.11Å; K366-I467 HydrophobicContact CG-CG2 4.4Å; L369-I467 HydrophobicContact CD1-CD1 3.54Å; L369-I467 HydrophobicContact CG-CD1 4.06Å; L463-I467 HydrophobicContact CD2-CD1 3.95Å; L463-I467 WeakPolarHBondContact O-CG1 3.39Å; L463-I467 PolarHBondContact O-N 2.91Å; G464-I467 PolarHBondContact O-N 3.4Å; I467-A469 PolarHBondContact O-N 3.03Å; I467-M470 PolarHBondContact O-N 3.02Å; I467-E471 HydrophobicContact CG2-CG 4.02Å; I467-E471 WeakPolarHBondContact O-CG 3.17Å; I467-E471 PolarHBondContact O-N 3.11Å
468	K	81.1	Confident	77.4	Confident	159 Å²	159	57 Å²	57	69%	0.691	33%	0.329	S	S	*	.	H	α-helix	trans	-56	-37.2	178.7	-169.7	171.3	-175	171	0	112	G464 S472	G464-K468 WeakPolarHBondContact O-CB 3.38Å; G464-K468 PolarHBondContact O-N 3.12Å; K468-S472 WeakPolarHBondContact O-CB 3.48Å; K468-S472 PolarHBondContact O-N 3.44Å; K468-S472 PolarHBondContact O-OG 3.21Å
469	A	81.9	Confident	76.2	Confident	50 Å²	50	61.3 Å²	61.3	41%	0.413	35%	0.345	S	S	.	.	H	α-helix	trans	-66.7	-36.9	175.5	0	0	0	0	0	113.3	A465 K466 I467 S472	A465-A469 WeakPolarHBondContact O-CB 3.28Å; A465-A469 PolarHBondContact O-N 2.76Å; K466-A469 PolarHBondContact O-N 3.42Å; I467-A469 PolarHBondContact O-N 3.03Å; A469-S472 PolarHBondContact O-OG 2.97Å
470	M	77.9	Confident	74.8	Confident	16 Å²	16	65.1 Å²	65.1	8%	0.079	36%	0.36	C	S	.	.	H	α-helix	trans	-80	-42.1	176.1	-63.8	-179.9	-61.6	0	0	112.5	F358 E361 I362 L365 K466 I467 S472 K473	F358-M470 HydrophobicContact CD1-CB 4.43Å; F358-M470 HydrophobicContact CD1-CG 4.37Å; F358-M470 HydrophobicContact CD1-SD 4.31Å; F358-M470 HydrophobicContact CE1-CG 4.4Å; E361-M470 HydrophobicContact CG-CE 4.28Å; E361-M470 HydrophobicContact CG-SD 4.2Å; I362-M470 HydrophobicContact CD1-CB 3.9Å; I362-M470 HydrophobicContact CG1-CB 3.87Å; I362-M470 HydrophobicContact CG1-CE 3.96Å; L365-M470 HydrophobicContact CD1-CE 3.29Å; K466-M470 HydrophobicContact CD-CE 4.5Å; K466-M470 HydrophobicContact CG-CE 4.04Å; K466-M470 WeakPolarHBondContact O-CE 3.47Å; K466-M470 WeakPolarHBondContact O-CG 3.18Å; K466-M470 PolarHBondContact O-N 3.23Å; K466-M470 VanDerWaalsContact O-N 3.09Å; I467-M470 PolarHBondContact O-N 3.02Å; M470-S472 PolarHBondContact O-N 3.18Å; M470-K473 WeakPolarHBondContact O-CA 3.24Å; M470-K473 VanDerWaalsContact O-CB 3.3Å; M470-K473 WeakPolarHBondContact O-CB 3.3Å; M470-K473 PolarHBondContact O-N 2.86Å
471	E	78.4	Confident	73.3	Confident	75 Å²	75	70.6 Å²	70.6	35%	0.35	38%	0.384	S	S	.	.	H	α-helix	trans	-58.1	-38.8	172.7	-70.4	-177.9	142.6	0	0	111.2	I362 K366 I467 K473 L474	I362-E471 HydrophobicContact CD1-CG 4.06Å; I362-E471 HydrophobicContact CG2-CG 4.22Å; K366-E471 WeakPolarHBondContact CE-OE1 3.4Å; K366-E471 IonicContact NZ-OE1 3.62Å; K366-E471 PolarHBondContact NZ-OE1 3.07Å; I467-E471 HydrophobicContact CG2-CG 4.02Å; I467-E471 WeakPolarHBondContact O-CG 3.17Å; I467-E471 PolarHBondContact O-N 3.11Å; E471-K473 PolarHBondContact O-N 3.08Å; E471-K473 VanDerWaalsContact O-N 3.07Å; E471-L474 PolarHBondContact O-N 3.43Å
472	S	79.9	Confident	72	Confident	57 Å²	57	69.8 Å²	69.8	40%	0.399	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-9.9	174.7	79.3	0	0	0	0	114.6	K185 K468 A469 M470	K185-S472 WeakPolarHBondContact CD-O 3.45Å; K185-S472 WeakPolarHBondContact CE-O 3.16Å; K185-S472 PolarHBondContact NZ-O 2.86Å; K185-S472 PolarHBondContact NZ-OG 2.9Å; K468-S472 WeakPolarHBondContact O-CB 3.48Å; K468-S472 PolarHBondContact O-N 3.44Å; K468-S472 PolarHBondContact O-OG 3.21Å; A469-S472 PolarHBondContact O-OG 2.97Å; M470-S472 PolarHBondContact O-N 3.18Å
473	K	80.2	Confident	71	Confident	74 Å²	74	67.5 Å²	67.5	32%	0.322	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-18.8	172.6	-65.6	175.8	-176.8	-179.5	0	112.6	V183 F358 M470 E471	V183-K473 HydrophobicContact CG1-CB 4.1Å; V183-K473 HydrophobicContact CG1-CG 4.34Å; F358-K473 HydrophobicContact CZ-CD 4.32Å; M470-K473 WeakPolarHBondContact O-CA 3.24Å; M470-K473 VanDerWaalsContact O-CB 3.3Å; M470-K473 WeakPolarHBondContact O-CB 3.3Å; M470-K473 PolarHBondContact O-N 2.86Å; E471-K473 PolarHBondContact O-N 3.08Å; E471-K473 VanDerWaalsContact O-N 3.07Å
474	L	78	Confident	69.8	Low	20 Å²	20	72.1 Å²	72.1	11%	0.105	40%	0.397	C	S	.	.	S	Bend	trans	-85.8	124.6	174.5	-62.9	177	0	0	0	108.9	L355 I362 E471	L355-L474 HydrophobicContact CG-CD2 4.24Å; I362-L474 HydrophobicContact CD1-CD1 3.64Å; E471-L474 PolarHBondContact O-N 3.43Å
475	L	77.2	Confident	69	Low	31 Å²	31	74.3 Å²	74.3	16%	0.162	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	108.9	177.5	-61.4	167	0	0	0	108.1	F127 I130 Y138 V140 K185	F127-L475 HydrophobicContact CD1-CD1 4.19Å; F127-L475 HydrophobicContact CE1-CD1 3.72Å; I130-L475 HydrophobicContact CD1-CD1 4.22Å; I130-L475 HydrophobicContact CG2-CB 3.62Å; I130-L475 HydrophobicContact CG2-CD1 4.16Å; I130-L475 HydrophobicContact CG2-CG 4.47Å; Y138-L475 PolarHBondContact N-O 2.84Å; Y138-L475 WeakPolarHBondContact O-CB 3.42Å; Y138-L475 PolarHBondContact O-N 3.24Å; V140-L475 HydrophobicContact CG2-CD1 4.26Å; K185-L475 HydrophobicContact CB-CD2 4.15Å; K185-L475 WeakPolarHBondContact O-CD2 3.27Å
476	V	71	Confident	68.1	Low	61 Å²	61	74.6 Å²	74.6	37%	0.37	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	121.1	173.3	-173.5	0	0	0	0	107.7	Q137	Q137-V476 HydrophobicContact CG-CG2 4.46Å
477	G	63.2	Low	67.6	Low	10 Å²	10	75.4 Å²	75.4	10%	0.103	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	155.4	177.1	0	0	0	0	0	112.9	I130 S133	I130-G477 VanDerWaalsContact O-CA 3.26Å; I130-G477 WeakPolarHBondContact O-CA 2.97Å; S133-G477 CarbonylContact O-C 3.56Å; S133-G477 WeakPolarHBondContact O-CA 3.5Å
478	G	60.8	Low	67.2	Low	45 Å²	45	79.9 Å²	79.9	46%	0.464	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.1	1.4	176.1	0	0	0	0	0	117.3	S131 S133 N480	S131-G478 PolarHBondContact O-N 2.87Å; S131-G478 VanDerWaalsContact O-N 3.14Å; S133-G478 PolarHBondContact O-N 3.42Å; G478-N480 PolarHBondContact O-N 3.1Å
479	K	55.2	Low	66.7	Low	164 Å²	164	77.7 Å²	77.7	71%	0.713	42%	0.417	S	S	*	.			trans	-80.3	2.8	-175.6	-73.4	-170.8	173.8	-176.7	0	117.2
480	N	52.3	Low	66.3	Low	118 Å²	118	80.4 Å²	80.4	63%	0.631	42%	0.42	S	S	*	.			trans	-124.6	95.3	-175.7	-70.9	-21.4	0	0	0	112.4	G478 V482	G478-N480 PolarHBondContact O-N 3.1Å; N480-V482 PolarHBondContact O-N 2.93Å
481	I	45.1	Very low	66.4	Low	142 Å²	142	83.8 Å²	83.8	73%	0.728	44%	0.437	S	S	*	.			trans	-81.2	100.8	173.8	-63.1	168.7	0	0	0	109.5
482	V	52.8	Low	66.4	Low	89 Å²	89	85.3 Å²	85.3	54%	0.539	45%	0.447	S	S	.	.			trans	-146.9	65.8	160.6	-165.1	0	0	0	0	107.7	N480 H484 T485 N486	N480-V482 PolarHBondContact O-N 2.93Å; V482-H484 PolarHBondContact O-N 3.46Å; V482-T485 VanDerWaalsContact CG1-OG1 3.28Å; V482-T485 WeakPolarHBondContact CG1-OG1 3.43Å; V482-T485 PolarHBondContact O-OG1 3.32Å; V482-N486 PolarHBondContact O-N 3.33Å; V482-N486 PolarHBondContact O-ND2 2.79Å
483	D	60.4	Low	66.3	Low	95 Å²	95	84 Å²	84	51%	0.508	43%	0.434	S	S	.	.	H	α-helix	trans	-63.6	-42.5	-157.1	-57.2	-34.7	0	0	0	113.2	T485 N486 E487	D483-T485 PolarHBondContact O-N 2.98Å; D483-N486 PolarHBondContact O-N 3.23Å; D483-E487 WeakPolarHBondContact O-CB 3.48Å; D483-E487 WeakPolarHBondContact O-CG 3.29Å; D483-E487 PolarHBondContact O-N 3.45Å
484	H	52.6	Low	66.4	Low	126 Å²	126	84.7 Å²	84.7	58%	0.583	44%	0.439	S	S	*	.	H	α-helix	trans	-68	-36.6	-171.4	-156.1	60.3	0	0	0	114.4	V482 E487 Q488	V482-H484 PolarHBondContact O-N 3.46Å; H484-E487 IonicContact ND1-OE2 3.79Å; H484-Q488 PolarHBondContact CD2-NE2 3.26Å; H484-Q488 PolarHBondContact NE2-NE2 2.99Å; H484-Q488 VanDerWaalsContact NE2-NE2 3.12Å; H484-Q488 WeakPolarHBondContact O-CG 3.36Å; H484-Q488 PolarHBondContact O-N 2.88Å
485	T	60.8	Low	66.7	Low	73 Å²	73	89.5 Å²	89.5	45%	0.448	46%	0.459	S	S	.	.	H	α-helix	trans	-73.5	-35.9	173.6	40.2	0	0	0	0	112	V482 D483 Q489	V482-T485 VanDerWaalsContact CG1-OG1 3.28Å; V482-T485 WeakPolarHBondContact CG1-OG1 3.43Å; V482-T485 PolarHBondContact O-OG1 3.32Å; D483-T485 PolarHBondContact O-N 2.98Å; T485-Q489 WeakPolarHBondContact O-CB 3.41Å; T485-Q489 WeakPolarHBondContact O-CG 3.24Å; T485-Q489 PolarHBondContact O-N 3.25Å
486	N	65	Low	66.9	Low	61 Å²	61	94.1 Å²	94.1	33%	0.326	47%	0.474	S	S	.	.	H	α-helix	trans	-66.9	-39.6	177.4	-73.4	-20	0	0	0	111.4	V482 D483 K490	V482-N486 PolarHBondContact O-N 3.33Å; V482-N486 PolarHBondContact O-ND2 2.79Å; D483-N486 PolarHBondContact O-N 3.23Å; N486-K490 WeakPolarHBondContact O-CB 3.05Å; N486-K490 PolarHBondContact O-N 3.39Å
487	E	68.4	Low	67.3	Low	107 Å²	107	94.1 Å²	94.1	50%	0.5	47%	0.47	S	S	.	.	H	α-helix	trans	-62.3	-49.9	174.4	-77	-180	159.9	0	0	112.3	D483 H484 Q489 K490 I491	D483-E487 WeakPolarHBondContact O-CB 3.48Å; D483-E487 WeakPolarHBondContact O-CG 3.29Å; D483-E487 PolarHBondContact O-N 3.45Å; H484-E487 IonicContact ND1-OE2 3.79Å; E487-Q489 VanDerWaalsContact C-N 3.32Å; E487-Q489 PolarHBondContact O-N 2.85Å; E487-K490 WeakPolarHBondContact O-CB 3.38Å; E487-K490 PolarHBondContact O-N 2.68Å; E487-I491 VanDerWaalsContact O-CG1 3.31Å; E487-I491 WeakPolarHBondContact O-CG1 2.76Å; E487-I491 PolarHBondContact O-N 3.48Å
488	Q	68.7	Low	68.4	Low	105 Å²	105	98.7 Å²	98.7	49%	0.491	49%	0.489	S	S	.	.	H	α-helix	trans	-60.8	-41.8	178.5	-70	-177.5	16	0	0	111.8	H484 I491 L492	H484-Q488 PolarHBondContact CD2-NE2 3.26Å; H484-Q488 PolarHBondContact NE2-NE2 2.99Å; H484-Q488 VanDerWaalsContact NE2-NE2 3.12Å; H484-Q488 WeakPolarHBondContact O-CG 3.36Å; H484-Q488 PolarHBondContact O-N 2.88Å; Q488-I491 PolarHBondContact O-N 2.72Å; Q488-L492 WeakPolarHBondContact O-CB 3.33Å; Q488-L492 WeakPolarHBondContact O-CG 3.4Å; Q488-L492 PolarHBondContact O-N 2.81Å
489	Q	71.2	Confident	69.5	Low	112 Å²	112	100.8 Å²	100.8	52%	0.523	49%	0.489	S	S	.	.	H	α-helix	trans	-64.8	-42.2	174.4	-73.2	-179.9	3.3	0	0	112.3	T485 E487 L492 E493	T485-Q489 WeakPolarHBondContact O-CB 3.41Å; T485-Q489 WeakPolarHBondContact O-CG 3.24Å; T485-Q489 PolarHBondContact O-N 3.25Å; E487-Q489 VanDerWaalsContact C-N 3.32Å; E487-Q489 PolarHBondContact O-N 2.85Å; Q489-L492 PolarHBondContact O-N 3.43Å; Q489-E493 VanDerWaalsContact O-CB 3.3Å; Q489-E493 WeakPolarHBondContact O-CB 3.24Å; Q489-E493 PolarHBondContact O-N 3.42Å
490	K	73.3	Confident	70.8	Confident	107 Å²	107	93.6 Å²	93.6	47%	0.465	46%	0.46	S	S	.	.	H	α-helix	trans	-61.1	-43.7	176.8	-177.2	180	179.6	-178.2	0	111.6	N486 E487 E493 Q494	N486-K490 WeakPolarHBondContact O-CB 3.05Å; N486-K490 PolarHBondContact O-N 3.39Å; E487-K490 WeakPolarHBondContact O-CB 3.38Å; E487-K490 PolarHBondContact O-N 2.68Å; K490-E493 PolarHBondContact O-N 3.25Å; K490-Q494 WeakPolarHBondContact O-CB 3.39Å; K490-Q494 VanDerWaalsContact O-CG 3.28Å; K490-Q494 WeakPolarHBondContact O-CG 3.48Å; K490-Q494 PolarHBondContact O-N 3.47Å
491	I	79.3	Confident	72.3	Confident	88 Å²	88	92.7 Å²	92.7	45%	0.451	45%	0.452	S	S	.	.	H	α-helix	trans	-64.4	-42.9	176.2	-66.8	163	0	0	0	111.1	E487 Q488 K495	E487-I491 VanDerWaalsContact O-CG1 3.31Å; E487-I491 WeakPolarHBondContact O-CG1 2.76Å; E487-I491 PolarHBondContact O-N 3.48Å; Q488-I491 PolarHBondContact O-N 2.72Å; I491-K495 WeakPolarHBondContact O-CG 3.47Å; I491-K495 PolarHBondContact O-N 3.26Å
492	L	79.3	Confident	74.2	Confident	106 Å²	106	91.6 Å²	91.6	56%	0.555	44%	0.444	S	S	*	.	H	α-helix	trans	-64.2	-40.2	176.4	-76	168.6	0	0	0	112.1	Q488 Q489 R496	Q488-L492 WeakPolarHBondContact O-CB 3.33Å; Q488-L492 WeakPolarHBondContact O-CG 3.4Å; Q488-L492 PolarHBondContact O-N 2.81Å; Q489-L492 PolarHBondContact O-N 3.43Å; L492-R496 WeakPolarHBondContact O-CG 3.26Å; L492-R496 PolarHBondContact O-N 2.75Å
493	E	77.5	Confident	75.7	Confident	29 Å²	29	92.7 Å²	92.7	14%	0.136	44%	0.441	C	S	.	.	H	α-helix	trans	-68.5	-44.4	178.1	-173.1	168.8	-155.4	0	0	111.9	R78 R132 Q489 K490 K495 R496 Q497	R78-E493 IonicContact CZ-OE1 2.84Å; R78-E493 VanDerWaalsContact CZ-OE1 3.26Å; R78-E493 IonicContact NH1-OE1 3.92Å; R78-E493 PolarHBondContact NH1-OE1 2.94Å; R78-E493 IonicContact NH2-OE1 3.56Å; R78-E493 PolarHBondContact NH2-OE1 3.46Å; R132-E493 IonicContact CZ-OE2 3.69Å; R132-E493 VanDerWaalsContact CZ-OE2 3.23Å; R132-E493 IonicContact NH1-OE2 2.91Å; R132-E493 PolarHBondContact NH1-OE2 3.07Å; R132-E493 IonicContact NH2-OE2 2.76Å; R132-E493 PolarHBondContact NH2-OE2 2.8Å; Q489-E493 VanDerWaalsContact O-CB 3.3Å; Q489-E493 WeakPolarHBondContact O-CB 3.24Å; Q489-E493 PolarHBondContact O-N 3.42Å; K490-E493 PolarHBondContact O-N 3.25Å; E493-K495 PolarHBondContact O-N 2.92Å; E493-R496 WeakPolarHBondContact O-CB 3.24Å; E493-R496 PolarHBondContact O-N 3.39Å; E493-R496 VanDerWaalsContact O-N 3.17Å; E493-Q497 WeakPolarHBondContact O-CG 3.47Å; E493-Q497 PolarHBondContact O-N 2.99Å
494	Q	81.6	Confident	76.8	Confident	89 Å²	89	92.7 Å²	92.7	42%	0.416	43%	0.434	S	S	.	.	H	α-helix	trans	-58.3	-46.4	173	-75.8	174.9	-33	0	0	111.6	K490 R496 Q497 E498	K490-Q494 WeakPolarHBondContact O-CB 3.39Å; K490-Q494 VanDerWaalsContact O-CG 3.28Å; K490-Q494 WeakPolarHBondContact O-CG 3.48Å; K490-Q494 PolarHBondContact O-N 3.47Å; Q494-R496 VanDerWaalsContact C-N 3.31Å; Q494-R496 PolarHBondContact O-N 3.28Å; Q494-Q497 WeakPolarHBondContact O-CB 3.42Å; Q494-Q497 PolarHBondContact O-N 2.99Å; Q494-Q497 VanDerWaalsContact O-N 3.15Å; Q494-E498 WeakPolarHBondContact O-CG 3.36Å; Q494-E498 PolarHBondContact O-N 3.2Å
495	K	84.1	Confident	78.3	Confident	122 Å²	122	92.8 Å²	92.8	53%	0.53	43%	0.429	S	S	.	.	H	α-helix	trans	-62.3	-35.7	175.7	-75.2	-174.1	176.5	-174	0	113.1	I491 E493 I499	I491-K495 WeakPolarHBondContact O-CG 3.47Å; I491-K495 PolarHBondContact O-N 3.26Å; E493-K495 PolarHBondContact O-N 2.92Å; K495-I499 WeakPolarHBondContact O-CB 3.21Å; K495-I499 WeakPolarHBondContact O-CD1 3.24Å; K495-I499 WeakPolarHBondContact O-CG1 3.24Å; K495-I499 PolarHBondContact O-N 3.32Å
496	R	83.2	Confident	79.5	Confident	128 Å²	128	95.7 Å²	95.7	48%	0.483	44%	0.438	S	S	.	.	H	α-helix	trans	-66.1	-41.9	173.4	-74.3	175.5	-176.4	-155.6	4.4	111.8	D74 L492 E493 Q494 I499 A500	D74-R496 IonicContact OD2-NH1 2.72Å; L492-R496 WeakPolarHBondContact O-CG 3.26Å; L492-R496 PolarHBondContact O-N 2.75Å; E493-R496 WeakPolarHBondContact O-CB 3.24Å; E493-R496 PolarHBondContact O-N 3.39Å; E493-R496 VanDerWaalsContact O-N 3.17Å; Q494-R496 VanDerWaalsContact C-N 3.31Å; Q494-R496 PolarHBondContact O-N 3.28Å; R496-I499 PolarHBondContact O-N 3.47Å; R496-A500 WeakPolarHBondContact O-CB 3.32Å; R496-A500 PolarHBondContact O-N 3.03Å
497	Q	79.3	Confident	80.4	Confident	61 Å²	61	93.5 Å²	93.5	29%	0.285	43%	0.425	S	S	.	.	H	α-helix	trans	-61.2	-49.1	175.1	-69.8	168.1	-0.1	0	0	111	E493 Q494 I499 A500 E501	E493-Q497 WeakPolarHBondContact O-CG 3.47Å; E493-Q497 PolarHBondContact O-N 2.99Å; Q494-Q497 WeakPolarHBondContact O-CB 3.42Å; Q494-Q497 PolarHBondContact O-N 2.99Å; Q494-Q497 VanDerWaalsContact O-N 3.15Å; Q497-I499 PolarHBondContact O-N 2.85Å; Q497-A500 PolarHBondContact O-N 3.19Å; Q497-A500 VanDerWaalsContact O-N 3.16Å; Q497-E501 WeakPolarHBondContact O-CG 3.49Å; Q497-E501 PolarHBondContact O-N 3.06Å
498	E	85.5	Confident	81.1	Confident	106 Å²	106	91.8 Å²	91.8	50%	0.495	42%	0.417	S	S	.	.	H	α-helix	trans	-56.3	-46	175.8	-72.6	173.7	178.3	0	0	112.3	Q494 E501 Q502	Q494-E498 WeakPolarHBondContact O-CG 3.36Å; Q494-E498 PolarHBondContact O-N 3.2Å; E498-E501 PolarHBondContact O-N 3.21Å; E498-Q502 WeakPolarHBondContact O-CB 3.46Å; E498-Q502 WeakPolarHBondContact O-CG 3.4Å; E498-Q502 PolarHBondContact O-N 3.38Å
499	I	85.1	Confident	81.9	Confident	88 Å²	88	91.7 Å²	91.7	45%	0.451	42%	0.419	S	S	.	.	H	α-helix	trans	-63.9	-41.6	177.2	-70	163.7	0	0	0	111.3	K495 R496 Q497 Q502 K503	K495-I499 WeakPolarHBondContact O-CB 3.21Å; K495-I499 WeakPolarHBondContact O-CD1 3.24Å; K495-I499 WeakPolarHBondContact O-CG1 3.24Å; K495-I499 PolarHBondContact O-N 3.32Å; R496-I499 PolarHBondContact O-N 3.47Å; Q497-I499 PolarHBondContact O-N 2.85Å; I499-Q502 PolarHBondContact O-N 3.47Å; I499-K503 HydrophobicContact CG2-CD 4.33Å; I499-K503 WeakPolarHBondContact O-CG 3.39Å; I499-K503 PolarHBondContact O-N 3.32Å
500	A	81.7	Confident	82.4	Confident	13 Å²	13	90.3 Å²	90.3	11%	0.107	41%	0.412	C	S	.	.	H	α-helix	trans	-66.5	-43.5	178.5	0	0	0	0	0	111.8	E75 R496 Q497 K503 R504	E75-A500 HydrophobicContact CB-CB 4.44Å; R496-A500 WeakPolarHBondContact O-CB 3.32Å; R496-A500 PolarHBondContact O-N 3.03Å; Q497-A500 PolarHBondContact O-N 3.19Å; Q497-A500 VanDerWaalsContact O-N 3.16Å; A500-K503 PolarHBondContact O-N 3.37Å; A500-R504 WeakPolarHBondContact O-CB 3.4Å; A500-R504 PolarHBondContact O-N 2.9Å
501	E	84.1	Confident	82.8	Confident	100 Å²	100	87.4 Å²	87.4	47%	0.467	40%	0.4	S	S	.	.	H	α-helix	trans	-62.9	-42.3	173.6	-73	-166.6	166.7	0	0	112.5	Q497 E498 R504 R505	Q497-E501 WeakPolarHBondContact O-CG 3.49Å; Q497-E501 PolarHBondContact O-N 3.06Å; E498-E501 PolarHBondContact O-N 3.21Å; E501-R504 PolarHBondContact O-N 3.06Å; E501-R505 WeakPolarHBondContact O-CB 3.41Å; E501-R505 WeakPolarHBondContact O-CG 3.25Å; E501-R505 PolarHBondContact O-N 3.46Å; E501-R505 IonicContact OE2-CZ 3.77Å; E501-R505 IonicContact OE2-NH1 2.65Å; E501-R505 PolarHBondContact OE2-NH1 2.87Å; E501-R505 IonicContact OE2-NH2 3.85Å; E501-R505 PolarHBondContact OE2-NH2 3.41Å
502	Q	85.3	Confident	83	Confident	119 Å²	119	87.6 Å²	87.6	56%	0.556	40%	0.399	S	S	*	.	H	α-helix	trans	-61	-49.8	176.7	-76.9	172.8	16.1	0	0	111.2	E498 I499 R504 R505 E506	E498-Q502 WeakPolarHBondContact O-CB 3.46Å; E498-Q502 WeakPolarHBondContact O-CG 3.4Å; E498-Q502 PolarHBondContact O-N 3.38Å; I499-Q502 PolarHBondContact O-N 3.47Å; Q502-R504 VanDerWaalsContact C-N 3.3Å; Q502-R504 PolarHBondContact O-N 2.87Å; Q502-R505 PolarHBondContact O-N 3.25Å; Q502-E506 WeakPolarHBondContact O-CB 3.37Å; Q502-E506 PolarHBondContact O-N 3.37Å
503	K	84.2	Confident	83	Confident	111 Å²	111	86.5 Å²	86.5	48%	0.483	39%	0.392	S	S	.	.	H	α-helix	trans	-57.6	-41.6	175.6	-75.7	177.5	177.6	-176.6	0	112.5	I499 A500 E506 R507	I499-K503 HydrophobicContact CG2-CD 4.33Å; I499-K503 WeakPolarHBondContact O-CG 3.39Å; I499-K503 PolarHBondContact O-N 3.32Å; A500-K503 PolarHBondContact O-N 3.37Å; K503-E506 PolarHBondContact O-N 2.91Å; K503-R507 WeakPolarHBondContact O-CB 3.23Å; K503-R507 PolarHBondContact O-N 3.48Å
504	R	82.9	Confident	83	Confident	95 Å²	95	87.7 Å²	87.7	36%	0.358	40%	0.398	S	S	.	.	H	α-helix	trans	-64.6	-47.8	177.2	-178.7	-179.8	166	-168.8	-7.8	111.5	A500 E501 Q502 E506 R507 E508	A500-R504 WeakPolarHBondContact O-CB 3.4Å; A500-R504 PolarHBondContact O-N 2.9Å; E501-R504 PolarHBondContact O-N 3.06Å; Q502-R504 VanDerWaalsContact C-N 3.3Å; Q502-R504 PolarHBondContact O-N 2.87Å; R504-E506 VanDerWaalsContact C-N 3.34Å; R504-E506 PolarHBondContact O-N 3.32Å; R504-R507 PolarHBondContact O-N 3.01Å; R504-E508 HydrophobicContact CG-CG 4.49Å; R504-E508 IonicContact CZ-OE1 2.67Å; R504-E508 VanDerWaalsContact CZ-OE1 3.24Å; R504-E508 IonicContact NE-OE1 2.76Å; R504-E508 PolarHBondContact NE-OE1 2.87Å; R504-E508 IonicContact NH2-OE1 2.56Å; R504-E508 PolarHBondContact NH2-OE1 3.17Å; R504-E508 WeakPolarHBondContact O-CB 3.29Å; R504-E508 WeakPolarHBondContact O-CG 3.41Å; R504-E508 PolarHBondContact O-N 3.34Å
505	R	84.3	Confident	82.6	Confident	129 Å²	129	86.2 Å²	86.2	49%	0.487	40%	0.398	S	S	.	.	H	α-helix	trans	-62	-41.2	176.3	-71	175.3	-170.3	126.6	10	111.7	E501 Q502 E508 I509	E501-R505 WeakPolarHBondContact O-CB 3.41Å; E501-R505 WeakPolarHBondContact O-CG 3.25Å; E501-R505 PolarHBondContact O-N 3.46Å; E501-R505 IonicContact OE2-CZ 3.77Å; E501-R505 IonicContact OE2-NH1 2.65Å; E501-R505 PolarHBondContact OE2-NH1 2.87Å; E501-R505 IonicContact OE2-NH2 3.85Å; E501-R505 PolarHBondContact OE2-NH2 3.41Å; Q502-R505 PolarHBondContact O-N 3.25Å; R505-E508 PolarHBondContact O-N 3.4Å; R505-I509 WeakPolarHBondContact O-CB 3.49Å; R505-I509 WeakPolarHBondContact O-CD1 3.23Å; R505-I509 WeakPolarHBondContact O-CG1 3.39Å; R505-I509 PolarHBondContact O-N 3.26Å
506	E	85.6	Confident	82.1	Confident	133 Å²	133	86.5 Å²	86.5	62%	0.621	40%	0.395	S	S	*	.	H	α-helix	trans	-59.9	-46.9	175.6	-172.6	-176.3	176.2	0	0	111	Q502 K503 R504 I509 Q510	Q502-E506 WeakPolarHBondContact O-CB 3.37Å; Q502-E506 PolarHBondContact O-N 3.37Å; K503-E506 PolarHBondContact O-N 2.91Å; R504-E506 VanDerWaalsContact C-N 3.34Å; R504-E506 PolarHBondContact O-N 3.32Å; E506-I509 PolarHBondContact O-N 2.9Å; E506-Q510 WeakPolarHBondContact O-CB 3.47Å; E506-Q510 PolarHBondContact O-N 2.67Å
507	R	84.1	Confident	81.6	Confident	16 Å²	16	84.3 Å²	84.3	6%	0.06	39%	0.393	C	S	.	.	H	α-helix	trans	-62.4	-47.2	174.6	-175.9	-176.5	-53.4	118.4	5.3	112.4	V36 K37 D60 E75 K503 R504 I509 Q510 Q511	V36-R507 PolarHBondContact O-NE 3.49Å; V36-R507 PolarHBondContact O-NH2 3.24Å; K37-R507 WeakPolarHBondContact O-CG 3.26Å; D60-R507 WeakPolarHBondContact O-CD 3.39Å; D60-R507 PolarHBondContact O-NH1 2.93Å; E75-R507 IonicContact OE1-CZ 2.71Å; E75-R507 IonicContact OE1-NH1 3.15Å; E75-R507 PolarHBondContact OE1-NH1 3.4Å; E75-R507 IonicContact OE1-NH2 2.92Å; E75-R507 PolarHBondContact OE1-NH2 3.07Å; K503-R507 WeakPolarHBondContact O-CB 3.23Å; K503-R507 PolarHBondContact O-N 3.48Å; R504-R507 PolarHBondContact O-N 3.01Å; R507-I509 VanDerWaalsContact C-N 3.3Å; R507-I509 PolarHBondContact O-N 3.02Å; R507-Q510 PolarHBondContact O-N 3.47Å; R507-Q511 HydrophobicContact CG-CG 4.33Å; R507-Q511 WeakPolarHBondContact O-CB 3.34Å; R507-Q511 WeakPolarHBondContact O-CG 3.37Å; R507-Q511 PolarHBondContact O-N 2.85Å
508	E	83.9	Confident	81.2	Confident	71 Å²	71	86.2 Å²	86.2	33%	0.332	40%	0.402	S	S	.	.	H	α-helix	trans	-61.3	-38.7	178.5	-74.5	175.4	-177.8	0	0	111.5	R504 R505 Q512	R504-E508 HydrophobicContact CG-CG 4.49Å; R504-E508 IonicContact CZ-OE1 2.67Å; R504-E508 VanDerWaalsContact CZ-OE1 3.24Å; R504-E508 IonicContact NE-OE1 2.76Å; R504-E508 PolarHBondContact NE-OE1 2.87Å; R504-E508 IonicContact NH2-OE1 2.56Å; R504-E508 PolarHBondContact NH2-OE1 3.17Å; R504-E508 WeakPolarHBondContact O-CB 3.29Å; R504-E508 WeakPolarHBondContact O-CG 3.41Å; R504-E508 PolarHBondContact O-N 3.34Å; R505-E508 PolarHBondContact O-N 3.4Å; E508-Q512 WeakPolarHBondContact O-CB 3.44Å; E508-Q512 VanDerWaalsContact O-CG 3.29Å; E508-Q512 WeakPolarHBondContact O-CG 3.19Å; E508-Q512 PolarHBondContact O-N 3.35Å; E508-Q512 VanDerWaalsContact O-N 3.1Å
509	I	84.4	Confident	80.4	Confident	103 Å²	103	86.6 Å²	86.6	53%	0.528	40%	0.404	S	S	.	.	H	α-helix	trans	-67.6	-46.4	173.7	-70.7	164.7	0	0	0	110.7	R505 E506 R507 Q512 M513	R505-I509 WeakPolarHBondContact O-CB 3.49Å; R505-I509 WeakPolarHBondContact O-CD1 3.23Å; R505-I509 WeakPolarHBondContact O-CG1 3.39Å; R505-I509 PolarHBondContact O-N 3.26Å; E506-I509 PolarHBondContact O-N 2.9Å; R507-I509 VanDerWaalsContact C-N 3.3Å; R507-I509 PolarHBondContact O-N 3.02Å; I509-Q512 CarbonylContact O-C 3.58Å; I509-Q512 PolarHBondContact O-N 3.35Å; I509-M513 HydrophobicContact CG2-CG 4.26Å; I509-M513 WeakPolarHBondContact O-CB 3.47Å; I509-M513 WeakPolarHBondContact O-CG 3.31Å; I509-M513 PolarHBondContact O-N 3.4Å
510	Q	82.4	Confident	79.4	Confident	82 Å²	82	86.1 Å²	86.1	38%	0.383	41%	0.405	S	S	.	.	H	α-helix	trans	-63.5	-43.3	-179.3	-176.7	60.9	30.5	0	0	111.7	L38 E506 R507 Q512 M513 E514	L38-Q510 HydrophobicContact CD2-CG 3.44Å; L38-Q510 VanDerWaalsContact CD2-CG 3.44Å; E506-Q510 WeakPolarHBondContact O-CB 3.47Å; E506-Q510 PolarHBondContact O-N 2.67Å; R507-Q510 PolarHBondContact O-N 3.47Å; Q510-Q512 VanDerWaalsContact C-N 3.34Å; Q510-Q512 PolarHBondContact O-N 2.88Å; Q510-M513 PolarHBondContact O-N 3.08Å; Q510-E514 PolarHBondContact NE2-OE1 2.92Å; Q510-E514 WeakPolarHBondContact O-CG 3.4Å; Q510-E514 PolarHBondContact O-N 2.96Å
511	Q	82.2	Confident	78.4	Confident	46 Å²	46	89 Å²	89	22%	0.215	42%	0.418	C	S	.	.	H	α-helix	trans	-61	-41.3	173.3	-73.2	178.6	-7.5	0	0	111.9	L38 T58 F59 R507 E514 S515	L38-Q511 WeakPolarHBondContact O-CG 3.38Å; L38-Q511 PolarHBondContact O-NE2 2.92Å; T58-Q511 HydrophobicContact CG2-CG 4.27Å; F59-Q511 PolarHBondContact O-NE2 3.48Å; R507-Q511 HydrophobicContact CG-CG 4.33Å; R507-Q511 WeakPolarHBondContact O-CB 3.34Å; R507-Q511 WeakPolarHBondContact O-CG 3.37Å; R507-Q511 PolarHBondContact O-N 2.85Å; Q511-E514 PolarHBondContact O-N 3.34Å; Q511-S515 PolarHBondContact O-N 3.47Å; Q511-S515 PolarHBondContact O-OG 3.16Å
512	Q	82	Confident	77.2	Confident	92 Å²	92	89.3 Å²	89.3	43%	0.43	42%	0.42	S	S	.	.	H	α-helix	trans	-68.3	-34.7	174.9	-79.1	-178.2	45.9	0	0	113.3	E508 I509 Q510 S515 R516	E508-Q512 WeakPolarHBondContact O-CB 3.44Å; E508-Q512 VanDerWaalsContact O-CG 3.29Å; E508-Q512 WeakPolarHBondContact O-CG 3.19Å; E508-Q512 PolarHBondContact O-N 3.35Å; E508-Q512 VanDerWaalsContact O-N 3.1Å; I509-Q512 CarbonylContact O-C 3.58Å; I509-Q512 PolarHBondContact O-N 3.35Å; Q510-Q512 VanDerWaalsContact C-N 3.34Å; Q510-Q512 PolarHBondContact O-N 2.88Å; Q512-S515 PolarHBondContact O-OG 2.85Å; Q512-S515 VanDerWaalsContact O-OG 3.07Å; Q512-R516 VanDerWaalsContact O-CB 3.28Å; Q512-R516 WeakPolarHBondContact O-CB 3.25Å; Q512-R516 VanDerWaalsContact O-CG 3.26Å; Q512-R516 WeakPolarHBondContact O-CG 3.48Å; Q512-R516 PolarHBondContact O-N 3.22Å; Q512-R516 VanDerWaalsContact OE1-NH1 3.09Å
513	M	80.2	Confident	76	Confident	84 Å²	84	90.2 Å²	90.2	41%	0.414	43%	0.428	S	S	.	.	H	α-helix	trans	-66.3	-46.6	174.5	-75.7	-60.8	-57.7	0	0	110	I509 Q510 S515 R516 D517	I509-M513 HydrophobicContact CG2-CG 4.26Å; I509-M513 WeakPolarHBondContact O-CB 3.47Å; I509-M513 WeakPolarHBondContact O-CG 3.31Å; I509-M513 PolarHBondContact O-N 3.4Å; Q510-M513 PolarHBondContact O-N 3.08Å; M513-S515 PolarHBondContact O-N 2.87Å; M513-R516 CarbonylContact O-C 3.55Å; M513-R516 PolarHBondContact O-N 3.21Å; M513-D517 WeakPolarHBondContact O-CB 3.25Å; M513-D517 VanDerWaalsContact O-CG 3.26Å; M513-D517 PolarHBondContact O-N 3.26Å
514	E	76.2	Confident	74.6	Confident	53 Å²	53	93.7 Å²	93.7	25%	0.248	44%	0.443	C	S	.	.	H	α-helix	trans	-61.4	-44.3	176.2	-73.7	179.2	178.6	0	0	112.4	L38 Q40 Q510 Q511 R516 D517 E518	L38-E514 WeakPolarHBondContact CD1-OE1 3.45Å; L38-E514 WeakPolarHBondContact CD2-OE1 3.46Å; Q40-E514 PolarHBondContact NE2-OE2 3.41Å; Q510-E514 PolarHBondContact NE2-OE1 2.92Å; Q510-E514 WeakPolarHBondContact O-CG 3.4Å; Q510-E514 PolarHBondContact O-N 2.96Å; Q511-E514 PolarHBondContact O-N 3.34Å; E514-R516 VanDerWaalsContact C-N 3.33Å; E514-R516 PolarHBondContact O-N 2.73Å; E514-D517 PolarHBondContact O-N 3.38Å; E514-E518 PolarHBondContact O-N 2.93Å
515	S	74.9	Confident	73.6	Confident	59 Å²	59	92.4 Å²	92.4	41%	0.413	44%	0.441	S	S	.	.	H	α-helix	trans	-63.7	-39.3	176.4	71.1	0	0	0	0	112.2	Q511 Q512 M513 E519	Q511-S515 PolarHBondContact O-N 3.47Å; Q511-S515 PolarHBondContact O-OG 3.16Å; Q512-S515 PolarHBondContact O-OG 2.85Å; Q512-S515 VanDerWaalsContact O-OG 3.07Å; M513-S515 PolarHBondContact O-N 2.87Å; S515-E519 WeakPolarHBondContact O-CG 3.42Å; S515-E519 PolarHBondContact O-N 3.26Å
516	R	73.6	Confident	72.6	Confident	128 Å²	128	93.2 Å²	93.2	48%	0.483	46%	0.46	S	S	.	.	H	α-helix	trans	-71.4	-35.8	176	-78.5	-178.3	174.3	114.5	3.8	112.9	Q512 M513 E514 E518 E519 T520	Q512-R516 VanDerWaalsContact O-CB 3.28Å; Q512-R516 WeakPolarHBondContact O-CB 3.25Å; Q512-R516 VanDerWaalsContact O-CG 3.26Å; Q512-R516 WeakPolarHBondContact O-CG 3.48Å; Q512-R516 PolarHBondContact O-N 3.22Å; Q512-R516 VanDerWaalsContact OE1-NH1 3.09Å; M513-R516 CarbonylContact O-C 3.55Å; M513-R516 PolarHBondContact O-N 3.21Å; E514-R516 VanDerWaalsContact C-N 3.33Å; E514-R516 PolarHBondContact O-N 2.73Å; R516-E518 VanDerWaalsContact C-N 3.32Å; R516-E519 PolarHBondContact O-N 3.4Å; R516-T520 VanDerWaalsContact O-CB 3.29Å; R516-T520 WeakPolarHBondContact O-CB 3.43Å; R516-T520 VanDerWaalsContact O-CG2 3.23Å; R516-T520 WeakPolarHBondContact O-CG2 3.25Å; R516-T520 PolarHBondContact O-N 2.72Å; R516-T520 PolarHBondContact O-OG1 3.24Å
517	D	72.9	Confident	71.8	Confident	82 Å²	82	90.6 Å²	90.6	44%	0.439	45%	0.445	S	S	.	.	H	α-helix	trans	-66.4	-38.8	176	-76.2	-9.7	0	0	0	109.8	M513 E514 T520 L521	M513-D517 WeakPolarHBondContact O-CB 3.25Å; M513-D517 VanDerWaalsContact O-CG 3.26Å; M513-D517 PolarHBondContact O-N 3.26Å; E514-D517 PolarHBondContact O-N 3.38Å; D517-T520 WeakPolarHBondContact CA-OG1 3.4Å; D517-T520 PolarHBondContact O-OG1 3.02Å; D517-L521 WeakPolarHBondContact O-CB 3.28Å; D517-L521 WeakPolarHBondContact O-CD1 3.43Å; D517-L521 WeakPolarHBondContact O-CG 3.44Å; D517-L521 PolarHBondContact O-N 3.31Å
518	E	68.9	Low	71.3	Confident	100 Å²	100	94.7 Å²	94.7	47%	0.467	48%	0.476	S	S	.	.	H	α-helix	trans	-62	-51.1	169.3	-72.9	-160.7	-158.7	0	0	112.6	E514 R516 T520 L521 E522 K547	E514-E518 PolarHBondContact O-N 2.93Å; R516-E518 VanDerWaalsContact C-N 3.32Å; E518-T520 PolarHBondContact O-N 2.96Å; E518-L521 PolarHBondContact O-N 3.01Å; E518-E522 WeakPolarHBondContact O-CG 3.13Å; E518-E522 PolarHBondContact O-N 2.81Å; E518-K547 VanDerWaalsContact OE2-CE 3.24Å; E518-K547 WeakPolarHBondContact OE2-CE 3.11Å; E518-K547 IonicContact OE2-NZ 3.89Å; E518-K547 PolarHBondContact OE2-NZ 2.96Å
519	E	69.2	Low	71.1	Confident	114 Å²	114	94.1 Å²	94.1	53%	0.533	48%	0.48	S	S	.	.	H	α-helix	trans	-61.2	-40.5	178.5	-74.7	176.8	-178.5	0	0	113.1	S515 R516 E522 L523	S515-E519 WeakPolarHBondContact O-CG 3.42Å; S515-E519 PolarHBondContact O-N 3.26Å; R516-E519 PolarHBondContact O-N 3.4Å; E519-E522 PolarHBondContact O-N 2.73Å; E519-L523 WeakPolarHBondContact O-CB 3.28Å; E519-L523 PolarHBondContact O-N 2.9Å
520	T	64.3	Low	71	Confident	79 Å²	79	95.6 Å²	95.6	49%	0.485	49%	0.488	S	S	.	.	H	α-helix	trans	-75.7	-37.2	-178.1	54.3	0	0	0	0	112.3	R516 D517 E518 E522 L523 K524	R516-T520 VanDerWaalsContact O-CB 3.29Å; R516-T520 WeakPolarHBondContact O-CB 3.43Å; R516-T520 VanDerWaalsContact O-CG2 3.23Å; R516-T520 WeakPolarHBondContact O-CG2 3.25Å; R516-T520 PolarHBondContact O-N 2.72Å; R516-T520 PolarHBondContact O-OG1 3.24Å; D517-T520 WeakPolarHBondContact CA-OG1 3.4Å; D517-T520 PolarHBondContact O-OG1 3.02Å; E518-T520 PolarHBondContact O-N 2.96Å; T520-E522 PolarHBondContact O-N 3.49Å; T520-L523 PolarHBondContact O-N 3.42Å; T520-K524 PolarHBondContact O-N 3.13Å
521	L	60.5	Low	70.9	Confident	73 Å²	73	97 Å²	97	38%	0.382	50%	0.495	S	S	.	.	H	α-helix	trans	-58.6	-32.2	166	-80.4	166.7	0	0	0	111.6	D517 E518 K540	D517-L521 WeakPolarHBondContact O-CB 3.28Å; D517-L521 WeakPolarHBondContact O-CD1 3.43Å; D517-L521 WeakPolarHBondContact O-CG 3.44Å; D517-L521 PolarHBondContact O-N 3.31Å; E518-L521 PolarHBondContact O-N 3.01Å; L521-K540 WeakPolarHBondContact O-CE 3.29Å; L521-K540 PolarHBondContact O-NZ 3.39Å
522	E	59.6	Low	70.8	Confident	106 Å²	106	99 Å²	99	50%	0.495	50%	0.504	S	S	.	.	H	α-helix	trans	-76.4	-35.7	175.6	-72.7	175.6	-168	0	0	112.2	E518 E519 T520 K547	E518-E522 WeakPolarHBondContact O-CG 3.13Å; E518-E522 PolarHBondContact O-N 2.81Å; E519-E522 PolarHBondContact O-N 2.73Å; T520-E522 PolarHBondContact O-N 3.49Å; E522-K547 IonicContact OE1-NZ 4Å; E522-K547 PolarHBondContact OE1-NZ 3.26Å
523	L	60	Low	70.6	Confident	138 Å²	138	97.1 Å²	97.1	72%	0.723	50%	0.495	S	S	*	.	H	α-helix	trans	-97	-34.4	-168.9	-81.1	158.3	0	0	0	117.8	E519 T520	E519-L523 WeakPolarHBondContact O-CB 3.28Å; E519-L523 PolarHBondContact O-N 2.9Å; T520-L523 PolarHBondContact O-N 3.42Å
524	K	55.1	Low	70.7	Confident	185 Å²	185	96.7 Å²	96.7	80%	0.804	50%	0.497	S	S	*	.			trans	-147	98.9	-170.2	-68.9	-178.2	-176.7	171.4	0	114.8	T520	T520-K524 PolarHBondContact O-N 3.13Å
525	E	60.4	Low	71	Confident	68 Å²	68	97.7 Å²	97.7	32%	0.318	51%	0.505	S	S	.	.			trans	-126	122	158.4	-79.2	176.1	-104.7	0	0	109.6	Y527 I536 K540	E525-Y527 HydrophobicContact CB-CE1 4.12Å; E525-I536 WeakPolarHBondContact OE2-CD1 3.18Å; E525-I536 VanDerWaalsContact OE2-CG2 3.24Å; E525-I536 WeakPolarHBondContact OE2-CG2 2.86Å; E525-K540 WeakPolarHBondContact OE1-CE 3.47Å; E525-K540 IonicContact OE1-NZ 3.84Å; E525-K540 PolarHBondContact OE1-NZ 3.22Å
526	T	63.4	Low	71.2	Confident	145 Å²	145	96.4 Å²	96.4	89%	0.89	49%	0.493	S	S	*	.			trans	-87.4	120.7	172.6	45.8	0	0	0	0	109.8
527	Y	70.5	Confident	71.5	Confident	78 Å²	78	95.5 Å²	95.5	31%	0.306	49%	0.492	S	S	.	.			trans	-86.9	132.6	-177	-48.6	-64.5	0	0	0	111.4	E525 E533 I536	E525-Y527 HydrophobicContact CB-CE1 4.12Å; Y527-E533 HydrophobicContact CD1-CB 3.89Å; Y527-E533 HydrophobicContact CD1-CG 4.29Å; Y527-E533 HydrophobicContact CD2-CB 3.84Å; Y527-E533 HydrophobicContact CD2-CG 3.61Å; Y527-E533 HydrophobicContact CE1-CB 4.37Å; Y527-E533 HydrophobicContact CE1-CG 4.38Å; Y527-E533 HydrophobicContact CE2-CB 4.35Å; Y527-E533 HydrophobicContact CE2-CG 3.74Å; Y527-E533 HydrophobicContact CG-CB 3.59Å; Y527-E533 HydrophobicContact CG-CG 3.91Å; Y527-I536 HydrophobicContact CD1-CD1 3.76Å; Y527-I536 HydrophobicContact CE1-CB 3.88Å; Y527-I536 HydrophobicContact CE1-CD1 3.81Å; Y527-I536 HydrophobicContact CE1-CG1 4.46Å; Y527-I536 HydrophobicContact CE1-CG2 3.74Å
528	S	72.5	Confident	72.1	Confident	102 Å²	102	94.5 Å²	94.5	71%	0.713	49%	0.489	S	S	*	.	S	Bend	trans	-93.5	-8.3	172.6	73.6	0	0	0	0	113.7	Q532	S528-Q532 PolarHBondContact OG-NE2 2.74Å; S528-Q532 PolarHBondContact OG-OE1 3.24Å
529	S	80.9	Confident	72.8	Confident	59 Å²	59	96.5 Å²	96.5	41%	0.413	50%	0.496	S	S	.	.	S	Bend	trans	-153.4	147.8	176.4	171.4	0	0	0	0	111.1	Q531 Q532 E533	S529-Q531 PolarHBondContact O-N 3.34Å; S529-Q531 PolarHBondContact OG-N 3.48Å; S529-Q532 WeakPolarHBondContact O-CB 3.43Å; S529-Q532 PolarHBondContact O-N 2.91Å; S529-Q532 VanDerWaalsContact O-N 3.09Å; S529-E533 PolarHBondContact O-N 3.08Å
530	L	80.3	Confident	73.2	Confident	134 Å²	134	93 Å²	93	70%	0.702	48%	0.479	S	S	*	.	H	α-helix	trans	-58.1	-31.5	175.7	-150.1	83.4	0	0	0	112.3	E533 V534	L530-E533 WeakPolarHBondContact O-CB 3.43Å; L530-E533 PolarHBondContact O-N 2.82Å; L530-V534 WeakPolarHBondContact O-CG2 3.43Å; L530-V534 PolarHBondContact O-N 2.84Å
531	Q	80.8	Confident	74	Confident	113 Å²	113	95 Å²	95	53%	0.528	49%	0.486	S	S	.	.	H	α-helix	trans	-68.5	-42.7	176.4	-176.7	57.9	43.4	0	0	111.4	S529 E533 V534 D535	S529-Q531 PolarHBondContact O-N 3.34Å; S529-Q531 PolarHBondContact OG-N 3.48Å; Q531-E533 VanDerWaalsContact C-N 3.31Å; Q531-E533 PolarHBondContact O-N 2.78Å; Q531-V534 PolarHBondContact O-N 2.87Å; Q531-D535 PolarHBondContact NE2-OD1 2.9Å; Q531-D535 PolarHBondContact NE2-OD2 2.84Å; Q531-D535 VanDerWaalsContact NE2-OD2 3.15Å; Q531-D535 PolarHBondContact O-N 3.4Å
532	Q	79.8	Confident	75.1	Confident	86 Å²	86	98.3 Å²	98.3	40%	0.402	50%	0.498	S	S	.	.	H	α-helix	trans	-63.2	-39.9	174.4	-68.2	-179.8	-6.3	0	0	111.2	S528 S529 V534 D535 I536	S528-Q532 PolarHBondContact OG-NE2 2.74Å; S528-Q532 PolarHBondContact OG-OE1 3.24Å; S529-Q532 WeakPolarHBondContact O-CB 3.43Å; S529-Q532 PolarHBondContact O-N 2.91Å; S529-Q532 VanDerWaalsContact O-N 3.09Å; Q532-V534 VanDerWaalsContact C-N 3.35Å; Q532-V534 PolarHBondContact O-N 3.47Å; Q532-D535 PolarHBondContact O-N 3.21Å; Q532-I536 HydrophobicContact CB-CD1 4.35Å; Q532-I536 VanDerWaalsContact O-CB 3.26Å; Q532-I536 WeakPolarHBondContact O-CB 3.45Å; Q532-I536 WeakPolarHBondContact O-CD1 3.33Å; Q532-I536 VanDerWaalsContact O-CG1 3.24Å; Q532-I536 WeakPolarHBondContact O-CG1 3.18Å; Q532-I536 PolarHBondContact O-N 3.2Å
533	E	78.6	Confident	76	Confident	53 Å²	53	99.2 Å²	99.2	25%	0.248	50%	0.5	C	S	.	.	H	α-helix	trans	-57.7	-45.8	174.4	-179	174.3	-175.5	0	0	111.8	Y527 S529 L530 Q531 K537	Y527-E533 HydrophobicContact CD1-CB 3.89Å; Y527-E533 HydrophobicContact CD1-CG 4.29Å; Y527-E533 HydrophobicContact CD2-CB 3.84Å; Y527-E533 HydrophobicContact CD2-CG 3.61Å; Y527-E533 HydrophobicContact CE1-CB 4.37Å; Y527-E533 HydrophobicContact CE1-CG 4.38Å; Y527-E533 HydrophobicContact CE2-CB 4.35Å; Y527-E533 HydrophobicContact CE2-CG 3.74Å; Y527-E533 HydrophobicContact CG-CB 3.59Å; Y527-E533 HydrophobicContact CG-CG 3.91Å; S529-E533 PolarHBondContact O-N 3.08Å; L530-E533 WeakPolarHBondContact O-CB 3.43Å; L530-E533 PolarHBondContact O-N 2.82Å; Q531-E533 VanDerWaalsContact C-N 3.31Å; Q531-E533 PolarHBondContact O-N 2.78Å; E533-K537 HydrophobicContact CG-CD 3.94Å; E533-K537 HydrophobicContact CG-CG 4.45Å; E533-K537 WeakPolarHBondContact O-CB 3.22Å; E533-K537 VanDerWaalsContact O-CG 3.24Å; E533-K537 WeakPolarHBondContact O-CG 3.42Å; E533-K537 PolarHBondContact O-N 2.92Å; E533-K537 VanDerWaalsContact OE1-CE 3.24Å; E533-K537 WeakPolarHBondContact OE1-CE 3.3Å; E533-K537 IonicContact OE1-NZ 3.77Å; E533-K537 PolarHBondContact OE1-NZ 2.77Å
534	V	82.8	Confident	77	Confident	75 Å²	75	96.8 Å²	96.8	46%	0.455	49%	0.487	S	S	.	.	H	α-helix	trans	-63.8	-46.4	176	171.3	0	0	0	0	111.5	L530 Q531 Q532 K537 T538	L530-V534 WeakPolarHBondContact O-CG2 3.43Å; L530-V534 PolarHBondContact O-N 2.84Å; Q531-V534 PolarHBondContact O-N 2.87Å; Q532-V534 VanDerWaalsContact C-N 3.35Å; Q532-V534 PolarHBondContact O-N 3.47Å; V534-K537 PolarHBondContact O-N 3.2Å; V534-T538 VanDerWaalsContact O-CB 3.24Å; V534-T538 WeakPolarHBondContact O-CB 3.32Å; V534-T538 PolarHBondContact O-N 3.12Å; V534-T538 PolarHBondContact O-OG1 3.49Å
535	D	82	Confident	78.4	Confident	75 Å²	75	94 Å²	94	40%	0.401	48%	0.476	S	S	.	.	H	α-helix	trans	-66	-41.7	-178.3	-70	-32.8	0	0	0	112.1	Q531 Q532 T538 K539	Q531-D535 PolarHBondContact NE2-OD1 2.9Å; Q531-D535 PolarHBondContact NE2-OD2 2.84Å; Q531-D535 VanDerWaalsContact NE2-OD2 3.15Å; Q531-D535 PolarHBondContact O-N 3.4Å; Q532-D535 PolarHBondContact O-N 3.21Å; D535-T538 PolarHBondContact O-N 3.2Å; D535-K539 WeakPolarHBondContact O-CG 3.4Å; D535-K539 PolarHBondContact O-N 3.47Å
536	I	79.1	Confident	79.3	Confident	32 Å²	32	93.1 Å²	93.1	16%	0.164	48%	0.477	C	S	.	.	H	α-helix	trans	-67.5	-49.6	175.9	-70	160.9	0	0	0	110.4	E525 Y527 Q532 T538 K539 K540	E525-I536 WeakPolarHBondContact OE2-CD1 3.18Å; E525-I536 VanDerWaalsContact OE2-CG2 3.24Å; E525-I536 WeakPolarHBondContact OE2-CG2 2.86Å; Y527-I536 HydrophobicContact CD1-CD1 3.76Å; Y527-I536 HydrophobicContact CE1-CB 3.88Å; Y527-I536 HydrophobicContact CE1-CD1 3.81Å; Y527-I536 HydrophobicContact CE1-CG1 4.46Å; Y527-I536 HydrophobicContact CE1-CG2 3.74Å; Q532-I536 HydrophobicContact CB-CD1 4.35Å; Q532-I536 VanDerWaalsContact O-CB 3.26Å; Q532-I536 WeakPolarHBondContact O-CB 3.45Å; Q532-I536 WeakPolarHBondContact O-CD1 3.33Å; Q532-I536 VanDerWaalsContact O-CG1 3.24Å; Q532-I536 WeakPolarHBondContact O-CG1 3.18Å; Q532-I536 PolarHBondContact O-N 3.2Å; I536-T538 PolarHBondContact O-N 2.94Å; I536-K539 WeakPolarHBondContact O-CB 3.21Å; I536-K539 PolarHBondContact O-N 2.95Å; I536-K540 HydrophobicContact CG2-CD 4.23Å; I536-K540 HydrophobicContact CG2-CG 4.37Å; I536-K540 WeakPolarHBondContact O-CG 3.26Å; I536-K540 PolarHBondContact O-N 3.45Å
537	K	81.1	Confident	80.1	Confident	108 Å²	108	90.2 Å²	90.2	47%	0.47	45%	0.452	S	S	.	.	H	α-helix	trans	-60.6	-35.4	176.9	-74.9	-179.2	-178.2	177.5	0	111.9	E533 V534 K540 L541	E533-K537 HydrophobicContact CG-CD 3.94Å; E533-K537 HydrophobicContact CG-CG 4.45Å; E533-K537 WeakPolarHBondContact O-CB 3.22Å; E533-K537 VanDerWaalsContact O-CG 3.24Å; E533-K537 WeakPolarHBondContact O-CG 3.42Å; E533-K537 PolarHBondContact O-N 2.92Å; E533-K537 VanDerWaalsContact OE1-CE 3.24Å; E533-K537 WeakPolarHBondContact OE1-CE 3.3Å; E533-K537 IonicContact OE1-NZ 3.77Å; E533-K537 PolarHBondContact OE1-NZ 2.77Å; V534-K537 PolarHBondContact O-N 3.2Å; K537-K540 PolarHBondContact O-N 3.42Å; K537-L541 VanDerWaalsContact O-CB 3.24Å; K537-L541 WeakPolarHBondContact O-CB 3.26Å; K537-L541 PolarHBondContact O-N 2.96Å
538	T	84.7	Confident	80.6	Confident	61 Å²	61	90.7 Å²	90.7	37%	0.374	46%	0.459	S	S	.	.	H	α-helix	trans	-65.8	-40.9	174	-59.3	0	0	0	0	111.6	V534 D535 I536 K542	V534-T538 VanDerWaalsContact O-CB 3.24Å; V534-T538 WeakPolarHBondContact O-CB 3.32Å; V534-T538 PolarHBondContact O-N 3.12Å; V534-T538 PolarHBondContact O-OG1 3.49Å; D535-T538 PolarHBondContact O-N 3.2Å; I536-T538 PolarHBondContact O-N 2.94Å; T538-K542 WeakPolarHBondContact O-CG 3.39Å; T538-K542 PolarHBondContact O-N 2.87Å
539	K	82.5	Confident	81.1	Confident	142 Å²	142	91.1 Å²	91.1	62%	0.617	45%	0.45	S	S	*	.	H	α-helix	trans	-64.8	-44.1	173	-72.6	169.5	-177.2	176	0	112	D535 I536 K542 K543	D535-K539 WeakPolarHBondContact O-CG 3.4Å; D535-K539 PolarHBondContact O-N 3.47Å; I536-K539 WeakPolarHBondContact O-CB 3.21Å; I536-K539 PolarHBondContact O-N 2.95Å; K539-K542 PolarHBondContact O-N 2.9Å; K539-K543 PolarHBondContact O-N 2.94Å
540	K	78.7	Confident	81	Confident	41 Å²	41	90.3 Å²	90.3	18%	0.178	45%	0.447	C	S	.	.	H	α-helix	trans	-61.7	-46.1	175.3	-68.6	-172.2	-173	-165.9	0	111.5	L521 E525 I536 K537 K542 K543 L544	L521-K540 WeakPolarHBondContact O-CE 3.29Å; L521-K540 PolarHBondContact O-NZ 3.39Å; E525-K540 WeakPolarHBondContact OE1-CE 3.47Å; E525-K540 IonicContact OE1-NZ 3.84Å; E525-K540 PolarHBondContact OE1-NZ 3.22Å; I536-K540 HydrophobicContact CG2-CD 4.23Å; I536-K540 HydrophobicContact CG2-CG 4.37Å; I536-K540 WeakPolarHBondContact O-CG 3.26Å; I536-K540 PolarHBondContact O-N 3.45Å; K537-K540 PolarHBondContact O-N 3.42Å; K540-K542 VanDerWaalsContact C-N 3.34Å; K540-K542 PolarHBondContact O-N 3.27Å; K540-K543 PolarHBondContact O-N 2.91Å; K540-L544 WeakPolarHBondContact O-CB 3.32Å; K540-L544 WeakPolarHBondContact O-CG 3.41Å; K540-L544 PolarHBondContact O-N 3Å
541	L	81.9	Confident	81.1	Confident	121 Å²	121	87.4 Å²	87.4	63%	0.634	44%	0.435	S	S	*	.	H	α-helix	trans	-60.3	-42.1	176.6	-175.9	64.7	0	0	0	111.6	K537 F545	K537-L541 VanDerWaalsContact O-CB 3.24Å; K537-L541 WeakPolarHBondContact O-CB 3.26Å; K537-L541 PolarHBondContact O-N 2.96Å; L541-F545 WeakPolarHBondContact O-CB 3.3Å; L541-F545 PolarHBondContact O-N 2.99Å
542	K	82.6	Confident	81.3	Confident	142 Å²	142	88.4 Å²	88.4	62%	0.617	44%	0.437	S	S	*	.	H	α-helix	trans	-61.4	-48.3	173.4	-75.6	177.2	179.3	-177	0	112	T538 K539 K540 F545 S546	T538-K542 WeakPolarHBondContact O-CG 3.39Å; T538-K542 PolarHBondContact O-N 2.87Å; K539-K542 PolarHBondContact O-N 2.9Å; K540-K542 VanDerWaalsContact C-N 3.34Å; K540-K542 PolarHBondContact O-N 3.27Å; K542-F545 PolarHBondContact O-N 3.15Å; K542-S546 PolarHBondContact O-N 3.42Å; K542-S546 PolarHBondContact O-OG 2.92Å
543	K	79.5	Confident	81.3	Confident	125 Å²	125	85.8 Å²	85.8	54%	0.543	43%	0.43	S	S	.	.	H	α-helix	trans	-58.4	-49	176.2	-75.6	-171.9	173.8	-168.4	0	112	K539 K540 F545 S546 K547	K539-K543 PolarHBondContact O-N 2.94Å; K540-K543 PolarHBondContact O-N 2.91Å; K543-F545 PolarHBondContact O-N 2.96Å; K543-S546 PolarHBondContact O-N 2.98Å; K543-K547 PolarHBondContact O-N 3.31Å
544	L	80.7	Confident	81.4	Confident	88 Å²	88	87 Å²	87	46%	0.461	44%	0.436	S	S	.	.	H	α-helix	trans	-64.9	-37.3	179	-71.4	171.1	0	0	0	112.3	K540 K547 L548	K540-L544 WeakPolarHBondContact O-CB 3.32Å; K540-L544 WeakPolarHBondContact O-CG 3.41Å; K540-L544 PolarHBondContact O-N 3Å; L544-K547 PolarHBondContact O-N 3.36Å; L544-L548 VanDerWaalsContact O-CB 3.3Å; L544-L548 WeakPolarHBondContact O-CB 3.32Å; L544-L548 PolarHBondContact O-N 2.94Å
545	F	83.1	Confident	81.4	Confident	127 Å²	127	87.5 Å²	87.5	56%	0.557	44%	0.435	S	S	*	.	H	α-helix	trans	-65.2	-42.1	174.1	-174.8	-91.3	0	0	0	111.5	L541 K542 K543 L548 Q549	L541-F545 WeakPolarHBondContact O-CB 3.3Å; L541-F545 PolarHBondContact O-N 2.99Å; K542-F545 PolarHBondContact O-N 3.15Å; K543-F545 PolarHBondContact O-N 2.96Å; F545-L548 PolarHBondContact O-N 3.39Å; F545-Q549 WeakPolarHBondContact O-CB 3.49Å; F545-Q549 PolarHBondContact O-N 3.34Å
546	S	80.2	Confident	81.6	Confident	48 Å²	48	88.6 Å²	88.6	34%	0.336	44%	0.438	S	S	.	.	H	α-helix	trans	-64.8	-42.4	173.3	-64.8	0	0	0	0	112.7	K542 K543 Q549 A550	K542-S546 PolarHBondContact O-N 3.42Å; K542-S546 PolarHBondContact O-OG 2.92Å; K543-S546 PolarHBondContact O-N 2.98Å; S546-Q549 PolarHBondContact O-N 2.85Å; S546-A550 WeakPolarHBondContact O-CB 3.43Å; S546-A550 PolarHBondContact O-N 2.87Å
547	K	79.2	Confident	81.6	Confident	84 Å²	84	88.3 Å²	88.3	37%	0.365	44%	0.436	S	S	.	.	H	α-helix	trans	-58	-47.4	171.5	-76.3	-171.8	174.8	-172.9	0	110.8	E518 E522 K543 L544 Q549 A550 V551	E518-K547 VanDerWaalsContact OE2-CE 3.24Å; E518-K547 WeakPolarHBondContact OE2-CE 3.11Å; E518-K547 IonicContact OE2-NZ 3.89Å; E518-K547 PolarHBondContact OE2-NZ 2.96Å; E522-K547 IonicContact OE1-NZ 4Å; E522-K547 PolarHBondContact OE1-NZ 3.26Å; K543-K547 PolarHBondContact O-N 3.31Å; L544-K547 PolarHBondContact O-N 3.36Å; K547-Q549 PolarHBondContact O-N 2.84Å; K547-A550 PolarHBondContact O-N 2.85Å; K547-V551 WeakPolarHBondContact O-CG2 3.32Å; K547-V551 PolarHBondContact O-N 3.32Å
548	L	82.7	Confident	81.5	Confident	89 Å²	89	85.1 Å²	85.1	47%	0.466	42%	0.424	S	S	.	.	H	α-helix	trans	-62.3	-40.2	177.8	-179.7	65.7	0	0	0	112.6	L544 F545 K552	L544-L548 VanDerWaalsContact O-CB 3.3Å; L544-L548 WeakPolarHBondContact O-CB 3.32Å; L544-L548 PolarHBondContact O-N 2.94Å; F545-L548 PolarHBondContact O-N 3.39Å; L548-K552 HydrophobicContact CG-CD 4.46Å; L548-K552 WeakPolarHBondContact O-CB 3.41Å; L548-K552 WeakPolarHBondContact O-CG 3.47Å; L548-K552 PolarHBondContact O-N 3.45Å
549	Q	82.9	Confident	81.4	Confident	110 Å²	110	87 Å²	87	51%	0.514	43%	0.429	S	S	.	.	H	α-helix	trans	-67.5	-39.9	177.5	-172.4	173.3	2.5	0	0	111.6	F545 S546 K547 K552 A553	F545-Q549 WeakPolarHBondContact O-CB 3.49Å; F545-Q549 PolarHBondContact O-N 3.34Å; S546-Q549 PolarHBondContact O-N 2.85Å; K547-Q549 PolarHBondContact O-N 2.84Å; Q549-K552 PolarHBondContact O-N 3.14Å; Q549-A553 PolarHBondContact O-N 3.01Å
550	A	78.8	Confident	81.4	Confident	43 Å²	43	85.4 Å²	85.4	36%	0.355	42%	0.424	S	S	.	.	H	α-helix	trans	-62.9	-48.1	174.3	0	0	0	0	0	111.9	M53 S546 K547 K552 A553 E554	M53-A550 HydrophobicContact CE-CB 4.16Å; S546-A550 WeakPolarHBondContact O-CB 3.43Å; S546-A550 PolarHBondContact O-N 2.87Å; K547-A550 PolarHBondContact O-N 2.85Å; A550-K552 VanDerWaalsContact C-N 3.32Å; A550-K552 PolarHBondContact O-N 3.24Å; A550-A553 PolarHBondContact O-N 3.3Å; A550-E554 PolarHBondContact O-N 3.35Å
551	V	81.5	Confident	81.3	Confident	73 Å²	73	84.5 Å²	84.5	44%	0.442	42%	0.42	S	S	.	.	H	α-helix	trans	-62.8	-37.1	177.1	172.6	0	0	0	0	111.7	K547 E554 I555	K547-V551 WeakPolarHBondContact O-CG2 3.32Å; K547-V551 PolarHBondContact O-N 3.32Å; V551-E554 PolarHBondContact O-N 2.85Å; V551-I555 HydrophobicContact CG1-CD1 3.92Å; V551-I555 VanDerWaalsContact O-CG1 3.28Å; V551-I555 WeakPolarHBondContact O-CG1 3.35Å; V551-I555 PolarHBondContact O-N 3.43Å
552	K	84.3	Confident	81.1	Confident	133 Å²	133	83.9 Å²	83.9	58%	0.578	41%	0.414	S	S	*	.	H	α-helix	trans	-65.9	-41.1	174.5	-79.6	-177.4	174.6	-168.3	0	113	L548 Q549 A550 I555 H556	L548-K552 HydrophobicContact CG-CD 4.46Å; L548-K552 WeakPolarHBondContact O-CB 3.41Å; L548-K552 WeakPolarHBondContact O-CG 3.47Å; L548-K552 PolarHBondContact O-N 3.45Å; Q549-K552 PolarHBondContact O-N 3.14Å; A550-K552 VanDerWaalsContact C-N 3.32Å; A550-K552 PolarHBondContact O-N 3.24Å; K552-I555 PolarHBondContact O-N 2.88Å; K552-H556 WeakPolarHBondContact O-CB 3.39Å; K552-H556 PolarHBondContact O-N 2.9Å
553	A	81.6	Confident	81.1	Confident	31 Å²	31	81.8 Å²	81.8	26%	0.256	41%	0.408	S	S	.	.	H	α-helix	trans	-64	-43	174.1	0	0	0	0	0	111	Q549 A550 I555 H556 D557	Q549-A553 PolarHBondContact O-N 3.01Å; A550-A553 PolarHBondContact O-N 3.3Å; A553-I555 PolarHBondContact O-N 3.27Å; A553-H556 PolarHBondContact O-N 2.83Å; A553-D557 VanDerWaalsContact O-CG 3.27Å; A553-D557 PolarHBondContact O-N 3.36Å
554	E	79	Confident	81.1	Confident	78 Å²	78	79.9 Å²	79.9	36%	0.364	40%	0.4	S	S	.	.	H	α-helix	trans	-60.9	-43	175.8	-174.8	175.1	-160.8	0	0	112.6	A550 V551 D557 L558	A550-E554 PolarHBondContact O-N 3.35Å; V551-E554 PolarHBondContact O-N 2.85Å; E554-D557 PolarHBondContact O-N 2.84Å; E554-L558 HydrophobicContact CG-CD1 4.09Å; E554-L558 WeakPolarHBondContact O-CB 3.41Å; E554-L558 VanDerWaalsContact O-CG 3.22Å; E554-L558 WeakPolarHBondContact O-CG 3.44Å; E554-L558 PolarHBondContact O-N 3.34Å
555	I	83.4	Confident	80.7	Confident	86 Å²	86	78.8 Å²	78.8	44%	0.441	39%	0.393	S	S	.	.	H	α-helix	trans	-61.5	-46.1	174.7	-70.4	164.3	0	0	0	110.9	V551 K552 A553 L558 Q559	V551-I555 HydrophobicContact CG1-CD1 3.92Å; V551-I555 VanDerWaalsContact O-CG1 3.28Å; V551-I555 WeakPolarHBondContact O-CG1 3.35Å; V551-I555 PolarHBondContact O-N 3.43Å; K552-I555 PolarHBondContact O-N 2.88Å; A553-I555 PolarHBondContact O-N 3.27Å; I555-L558 PolarHBondContact O-N 2.95Å; I555-Q559 WeakPolarHBondContact O-CG 3.49Å; I555-Q559 PolarHBondContact O-N 2.99Å
556	H	85.7	Confident	80.5	Confident	98 Å²	98	80.4 Å²	80.4	45%	0.454	40%	0.395	S	S	.	.	H	α-helix	trans	-60.3	-48.1	178.7	179.6	-84.5	0	0	0	111.7	K552 A553 L558 Q559 E560	K552-H556 WeakPolarHBondContact O-CB 3.39Å; K552-H556 PolarHBondContact O-N 2.9Å; A553-H556 PolarHBondContact O-N 2.83Å; H556-L558 VanDerWaalsContact C-N 3.31Å; H556-L558 PolarHBondContact O-N 3.42Å; H556-Q559 WeakPolarHBondContact O-CB 3.3Å; H556-Q559 PolarHBondContact O-N 3.34Å; H556-Q559 VanDerWaalsContact O-N 3.13Å; H556-E560 IonicContact CE1-OE1 3.32Å; H556-E560 PolarHBondContact CE1-OE1 3.42Å; H556-E560 VanDerWaalsContact CE1-OE1 3.26Å; H556-E560 IonicContact CE1-OE2 3.28Å; H556-E560 IonicContact ND1-OE2 3.49Å; H556-E560 PolarHBondContact O-N 3.22Å
557	D	79.3	Confident	80.6	Confident	26 Å²	26	83 Å²	83	14%	0.139	40%	0.401	C	S	.	.	H	α-helix	trans	-62.6	-37.3	177.6	-67.1	-8	0	0	0	113.1	K55 R332 A553 E554 Q559 E560 E561	K55-D557 WeakPolarHBondContact CE-OD2 3.48Å; K55-D557 IonicContact NZ-OD2 2.71Å; K55-D557 PolarHBondContact NZ-OD2 3.49Å; R332-D557 IonicContact NH2-OD2 3.37Å; R332-D557 PolarHBondContact NH2-OD2 3.31Å; A553-D557 VanDerWaalsContact O-CG 3.27Å; A553-D557 PolarHBondContact O-N 3.36Å; E554-D557 PolarHBondContact O-N 2.84Å; D557-Q559 VanDerWaalsContact C-N 3.3Å; D557-E560 PolarHBondContact O-N 2.96Å; D557-E561 WeakPolarHBondContact O-CB 3.16Å; D557-E561 PolarHBondContact O-N 3.24Å
558	L	78.8	Confident	80.4	Confident	41 Å²	41	81.9 Å²	81.9	22%	0.215	40%	0.398	C	S	.	.	H	α-helix	trans	-67.3	-36.2	176.4	-73.6	169.6	0	0	0	110.2	E554 I555 H556 H562	E554-L558 HydrophobicContact CG-CD1 4.09Å; E554-L558 WeakPolarHBondContact O-CB 3.41Å; E554-L558 VanDerWaalsContact O-CG 3.22Å; E554-L558 WeakPolarHBondContact O-CG 3.44Å; E554-L558 PolarHBondContact O-N 3.34Å; I555-L558 PolarHBondContact O-N 2.95Å; H556-L558 VanDerWaalsContact C-N 3.31Å; H556-L558 PolarHBondContact O-N 3.42Å; L558-H562 VanDerWaalsContact O-CB 3.32Å; L558-H562 WeakPolarHBondContact O-CB 3.43Å; L558-H562 PolarHBondContact O-CD2 3.07Å; L558-H562 VanDerWaalsContact O-CG 3.26Å; L558-H562 PolarHBondContact O-N 2.83Å
559	Q	83.4	Confident	80	Confident	101 Å²	101	83.5 Å²	83.5	47%	0.472	41%	0.406	S	S	.	.	H	α-helix	trans	-65.7	-45.5	172	-70.7	171.7	-49.4	0	0	111.6	I555 H556 D557 H562 I563	I555-Q559 WeakPolarHBondContact O-CG 3.49Å; I555-Q559 PolarHBondContact O-N 2.99Å; H556-Q559 WeakPolarHBondContact O-CB 3.3Å; H556-Q559 PolarHBondContact O-N 3.34Å; H556-Q559 VanDerWaalsContact O-N 3.13Å; D557-Q559 VanDerWaalsContact C-N 3.3Å; Q559-H562 PolarHBondContact O-N 2.84Å; Q559-I563 WeakPolarHBondContact O-CB 3.18Å; Q559-I563 WeakPolarHBondContact O-CD1 3.39Å; Q559-I563 WeakPolarHBondContact O-CG1 3.24Å; Q559-I563 PolarHBondContact O-N 3Å
560	E	82.9	Confident	79.9	Confident	109 Å²	109	81.8 Å²	81.8	51%	0.509	40%	0.398	S	S	.	.	H	α-helix	trans	-61.5	-43.3	174.4	-73	-168.7	146.4	0	0	112.2	H556 D557 I563 K564	H556-E560 IonicContact CE1-OE1 3.32Å; H556-E560 PolarHBondContact CE1-OE1 3.42Å; H556-E560 VanDerWaalsContact CE1-OE1 3.26Å; H556-E560 IonicContact CE1-OE2 3.28Å; H556-E560 IonicContact ND1-OE2 3.49Å; H556-E560 PolarHBondContact O-N 3.22Å; D557-E560 PolarHBondContact O-N 2.96Å; E560-I563 PolarHBondContact O-N 3.3Å; E560-K564 VanDerWaalsContact O-CB 3.31Å; E560-K564 WeakPolarHBondContact O-CB 3.35Å; E560-K564 PolarHBondContact O-N 3.49Å
561	E	75.3	Confident	80	Confident	22 Å²	22	85.8 Å²	85.8	10%	0.103	41%	0.41	C	S	.	.	H	α-helix	trans	-60.8	-46.3	176.3	-177.4	162.7	-140.4	0	0	111	R251 T329 R332 D557 K564 E565	R251-E561 IonicContact NH2-OE1 3.36Å; R251-E561 PolarHBondContact NH2-OE1 2.81Å; T329-E561 PolarHBondContact OG1-OE1 3.41Å; R332-E561 IonicContact CZ-OE2 2.68Å; R332-E561 IonicContact NE-OE2 3.46Å; R332-E561 IonicContact NH1-OE2 2.67Å; R332-E561 PolarHBondContact NH1-OE2 2.97Å; D557-E561 WeakPolarHBondContact O-CB 3.16Å; D557-E561 PolarHBondContact O-N 3.24Å; E561-K564 PolarHBondContact O-N 2.85Å; E561-E565 WeakPolarHBondContact CG-OE1 3.4Å; E561-E565 WeakPolarHBondContact O-CB 3.24Å; E561-E565 VanDerWaalsContact O-CG 3.29Å; E561-E565 WeakPolarHBondContact O-CG 3.46Å; E561-E565 PolarHBondContact O-N 2.7Å
562	H	78.4	Confident	79.7	Confident	108 Å²	108	84.5 Å²	84.5	50%	0.5	40%	0.402	S	S	.	.	H	α-helix	trans	-66.2	-37.5	175.2	-75.9	-45.9	0	0	0	113.8	L558 Q559 E565 R566	L558-H562 VanDerWaalsContact O-CB 3.32Å; L558-H562 WeakPolarHBondContact O-CB 3.43Å; L558-H562 PolarHBondContact O-CD2 3.07Å; L558-H562 VanDerWaalsContact O-CG 3.26Å; L558-H562 PolarHBondContact O-N 2.83Å; Q559-H562 PolarHBondContact O-N 2.84Å; H562-E565 IonicContact ND1-OE2 2.63Å; H562-R566 VanDerWaalsContact O-CB 3.25Å; H562-R566 WeakPolarHBondContact O-CB 3.33Å; H562-R566 PolarHBondContact O-N 3.47Å
563	I	83.5	Confident	79.5	Confident	97 Å²	97	83.4 Å²	83.4	50%	0.497	40%	0.399	S	S	.	.	H	α-helix	trans	-64.5	-45.1	175.2	-72.2	162.3	0	0	0	109.8	Q559 E560 R566 Q567	Q559-I563 WeakPolarHBondContact O-CB 3.18Å; Q559-I563 WeakPolarHBondContact O-CD1 3.39Å; Q559-I563 WeakPolarHBondContact O-CG1 3.24Å; Q559-I563 PolarHBondContact O-N 3Å; E560-I563 PolarHBondContact O-N 3.3Å; I563-R566 PolarHBondContact O-N 2.84Å; I563-Q567 WeakPolarHBondContact O-CG 3.38Å; I563-Q567 PolarHBondContact O-N 2.95Å
564	K	78.3	Confident	79.6	Confident	85 Å²	85	84.3 Å²	84.3	37%	0.37	40%	0.399	S	S	.	.	H	α-helix	trans	-65.1	-44.8	178.4	-174.6	179.7	177	-179.4	0	112	E560 E561 R566 Q567 E568	E560-K564 VanDerWaalsContact O-CB 3.31Å; E560-K564 WeakPolarHBondContact O-CB 3.35Å; E560-K564 PolarHBondContact O-N 3.49Å; E561-K564 PolarHBondContact O-N 2.85Å; K564-R566 VanDerWaalsContact C-N 3.34Å; K564-R566 PolarHBondContact O-N 3.32Å; K564-Q567 PolarHBondContact O-N 3.33Å; K564-E568 VanDerWaalsContact CE-OE1 3.3Å; K564-E568 WeakPolarHBondContact CE-OE1 3.39Å; K564-E568 WeakPolarHBondContact CG-OE1 3.42Å; K564-E568 WeakPolarHBondContact O-CG 3.32Å; K564-E568 PolarHBondContact O-N 3.36Å
565	E	72.9	Confident	79.6	Confident	66 Å²	66	86.2 Å²	86.2	31%	0.308	41%	0.408	S	S	.	.	H	α-helix	trans	-60.8	-42	173.8	-76.4	169.1	-173.4	0	0	112.1	R251 E561 H562 Q567 E568 L569	R251-E565 IonicContact CZ-OE1 2.66Å; R251-E565 IonicContact NH2-OE1 3.49Å; R251-E565 PolarHBondContact NH2-OE1 3.05Å; E561-E565 WeakPolarHBondContact CG-OE1 3.4Å; E561-E565 WeakPolarHBondContact O-CB 3.24Å; E561-E565 VanDerWaalsContact O-CG 3.29Å; E561-E565 WeakPolarHBondContact O-CG 3.46Å; E561-E565 PolarHBondContact O-N 2.7Å; H562-E565 IonicContact ND1-OE2 2.63Å; E565-Q567 PolarHBondContact O-N 3.49Å; E565-E568 PolarHBondContact O-N 3.26Å; E565-L569 WeakPolarHBondContact O-CB 3.5Å; E565-L569 VanDerWaalsContact O-CG 3.31Å; E565-L569 WeakPolarHBondContact O-CG 3.43Å; E565-L569 PolarHBondContact O-N 3.33Å
566	R	79.5	Confident	79.4	Confident	160 Å²	160	87.2 Å²	87.2	60%	0.604	41%	0.414	S	S	*	.	H	α-helix	trans	-61.3	-43.2	174.8	-179.5	177.4	171.6	-178.3	-2.7	111.7	H562 I563 K564 L569 E570	H562-R566 VanDerWaalsContact O-CB 3.25Å; H562-R566 WeakPolarHBondContact O-CB 3.33Å; H562-R566 PolarHBondContact O-N 3.47Å; I563-R566 PolarHBondContact O-N 2.84Å; K564-R566 VanDerWaalsContact C-N 3.34Å; K564-R566 PolarHBondContact O-N 3.32Å; R566-L569 PolarHBondContact O-N 3Å; R566-E570 VanDerWaalsContact O-CB 3.29Å; R566-E570 WeakPolarHBondContact O-CB 3.38Å; R566-E570 PolarHBondContact O-N 2.83Å
567	Q	81.3	Confident	79.4	Confident	102 Å²	102	84.8 Å²	84.8	48%	0.477	41%	0.406	S	S	.	.	H	α-helix	trans	-65.2	-41.2	175.8	-72.8	173.1	-6.3	0	0	112.4	I563 K564 E565 L569 E570 Q571	I563-Q567 WeakPolarHBondContact O-CG 3.38Å; I563-Q567 PolarHBondContact O-N 2.95Å; K564-Q567 PolarHBondContact O-N 3.33Å; E565-Q567 PolarHBondContact O-N 3.49Å; Q567-L569 VanDerWaalsContact C-N 3.34Å; Q567-E570 PolarHBondContact O-N 3.19Å; Q567-Q571 WeakPolarHBondContact O-CB 3.49Å; Q567-Q571 VanDerWaalsContact O-CG 3.28Å; Q567-Q571 WeakPolarHBondContact O-CG 3.28Å; Q567-Q571 PolarHBondContact O-N 2.97Å
568	E	75.1	Confident	79.5	Confident	62 Å²	62	89.3 Å²	89.3	29%	0.29	42%	0.421	S	S	.	.	H	α-helix	trans	-61.6	-41.2	174.7	-72.7	172.9	-154.9	0	0	111	R251 K564 E565 T572	R251-E568 IonicContact NH1-OE1 3Å; R251-E568 PolarHBondContact NH1-OE1 3.13Å; R251-E568 IonicContact NH1-OE2 2.61Å; R251-E568 PolarHBondContact NH1-OE2 3.32Å; K564-E568 VanDerWaalsContact CE-OE1 3.3Å; K564-E568 WeakPolarHBondContact CE-OE1 3.39Å; K564-E568 WeakPolarHBondContact CG-OE1 3.42Å; K564-E568 WeakPolarHBondContact O-CG 3.32Å; K564-E568 PolarHBondContact O-N 3.36Å; E565-E568 PolarHBondContact O-N 3.26Å; E568-T572 WeakPolarHBondContact O-CB 3.17Å; E568-T572 PolarHBondContact O-N 3.4Å; E568-T572 VanDerWaalsContact O-N 3.1Å; E568-T572 PolarHBondContact O-OG1 3.45Å
569	L	75	Confident	79.6	Confident	122 Å²	122	90.3 Å²	90.3	64%	0.639	43%	0.425	S	S	*	.	H	α-helix	trans	-68.7	-42.2	175.6	-72.3	170.9	0	0	0	112.8	E565 R566 Q567 T572 Q573	E565-L569 WeakPolarHBondContact O-CB 3.5Å; E565-L569 VanDerWaalsContact O-CG 3.31Å; E565-L569 WeakPolarHBondContact O-CG 3.43Å; E565-L569 PolarHBondContact O-N 3.33Å; R566-L569 PolarHBondContact O-N 3Å; Q567-L569 VanDerWaalsContact C-N 3.34Å; L569-T572 PolarHBondContact O-N 3.07Å; L569-Q573 WeakPolarHBondContact O-CB 3.22Å; L569-Q573 PolarHBondContact O-N 3.05Å
570	E	81	Confident	79.7	Confident	75 Å²	75	90 Å²	90	35%	0.35	43%	0.426	S	S	.	.	H	α-helix	trans	-63.7	-43.7	177.8	-171.1	179.6	139.5	0	0	111.3	R566 Q567 T572 Q573 N574	R566-E570 VanDerWaalsContact O-CB 3.29Å; R566-E570 WeakPolarHBondContact O-CB 3.38Å; R566-E570 PolarHBondContact O-N 2.83Å; Q567-E570 PolarHBondContact O-N 3.19Å; E570-T572 PolarHBondContact O-N 3.32Å; E570-Q573 PolarHBondContact O-N 3.17Å; E570-N574 WeakPolarHBondContact O-CB 3.36Å; E570-N574 PolarHBondContact O-N 3.43Å; E570-N574 PolarHBondContact O-ND2 2.8Å; E570-N574 PolarHBondContact O-OD1 3.18Å
571	Q	80	Confident	79.8	Confident	127 Å²	127	87.7 Å²	87.7	59%	0.593	41%	0.414	S	S	*	.	H	α-helix	trans	-59.5	-45.6	172	-72.8	172.1	13.5	0	0	111.6	Q567 Q573 N574 E575	Q567-Q571 WeakPolarHBondContact O-CB 3.49Å; Q567-Q571 VanDerWaalsContact O-CG 3.28Å; Q567-Q571 WeakPolarHBondContact O-CG 3.28Å; Q567-Q571 PolarHBondContact O-N 2.97Å; Q571-Q573 PolarHBondContact O-N 3.41Å; Q571-N574 PolarHBondContact O-N 2.82Å; Q571-E575 PolarHBondContact O-N 2.74Å
572	T	75	Confident	80.3	Confident	46 Å²	46	89.7 Å²	89.7	28%	0.282	43%	0.425	S	S	.	.	H	α-helix	trans	-62.9	-41	177.1	-54.6	0	0	0	0	111.6	T266 E568 L569 E570 E575 L576	T266-T572 HydrophobicContact CG2-CG2 4.34Å; E568-T572 WeakPolarHBondContact O-CB 3.17Å; E568-T572 PolarHBondContact O-N 3.4Å; E568-T572 VanDerWaalsContact O-N 3.1Å; E568-T572 PolarHBondContact O-OG1 3.45Å; L569-T572 PolarHBondContact O-N 3.07Å; E570-T572 PolarHBondContact O-N 3.32Å; T572-E575 PolarHBondContact O-N 2.91Å; T572-L576 HydrophobicContact CG2-CD1 4.06Å; T572-L576 HydrophobicContact CG2-CG 4.48Å; T572-L576 WeakPolarHBondContact O-CB 3.34Å; T572-L576 VanDerWaalsContact O-CG 3.26Å; T572-L576 WeakPolarHBondContact O-CG 3.38Å; T572-L576 PolarHBondContact O-N 2.93Å
573	Q	81	Confident	80.6	Confident	109 Å²	109	89.7 Å²	89.7	51%	0.509	42%	0.424	S	S	.	.	H	α-helix	trans	-61.9	-42.9	175.2	177	179.3	-31.9	0	0	111.2	L569 E570 Q571 L576 T577	L569-Q573 WeakPolarHBondContact O-CB 3.22Å; L569-Q573 PolarHBondContact O-N 3.05Å; E570-Q573 PolarHBondContact O-N 3.17Å; Q571-Q573 PolarHBondContact O-N 3.41Å; Q573-L576 PolarHBondContact O-N 3.19Å; Q573-T577 VanDerWaalsContact O-CB 3.23Å; Q573-T577 WeakPolarHBondContact O-CB 3.47Å; Q573-T577 PolarHBondContact O-N 3.21Å; Q573-T577 PolarHBondContact O-OG1 2.86Å
574	N	83	Confident	80.7	Confident	50 Å²	50	89.3 Å²	89.3	27%	0.267	42%	0.419	S	S	.	.	H	α-helix	trans	-68.9	-39.2	179.9	-67.2	-11.5	0	0	0	111.8	E570 Q571 T577 R578	E570-N574 WeakPolarHBondContact O-CB 3.36Å; E570-N574 PolarHBondContact O-N 3.43Å; E570-N574 PolarHBondContact O-ND2 2.8Å; E570-N574 PolarHBondContact O-OD1 3.18Å; Q571-N574 PolarHBondContact O-N 2.82Å; N574-T577 PolarHBondContact O-N 2.63Å; N574-R578 WeakPolarHBondContact O-CB 3.32Å; N574-R578 PolarHBondContact O-N 3.36Å
575	E	79.5	Confident	81	Confident	119 Å²	119	88 Å²	88	56%	0.556	42%	0.416	S	S	*	.	H	α-helix	trans	-63	-45	171.4	-73.3	-173	177.5	0	0	112.5	Q571 T572 T577 R578 E579	Q571-E575 PolarHBondContact O-N 2.74Å; T572-E575 PolarHBondContact O-N 2.91Å; E575-T577 VanDerWaalsContact C-N 3.34Å; E575-R578 PolarHBondContact O-N 2.89Å; E575-E579 PolarHBondContact O-N 2.63Å
576	L	79.5	Confident	81.6	Confident	107 Å²	107	88.9 Å²	88.9	56%	0.56	42%	0.422	S	S	*	.	H	α-helix	trans	-65.2	-38	176.5	-72.6	172.5	0	0	0	112	T572 Q573 E579 L580	T572-L576 HydrophobicContact CG2-CD1 4.06Å; T572-L576 HydrophobicContact CG2-CG 4.48Å; T572-L576 WeakPolarHBondContact O-CB 3.34Å; T572-L576 VanDerWaalsContact O-CG 3.26Å; T572-L576 WeakPolarHBondContact O-CG 3.38Å; T572-L576 PolarHBondContact O-N 2.93Å; Q573-L576 PolarHBondContact O-N 3.19Å; L576-E579 PolarHBondContact O-N 3.07Å; L576-L580 VanDerWaalsContact O-CB 3.25Å; L576-L580 WeakPolarHBondContact O-CB 2.94Å; L576-L580 PolarHBondContact O-N 2.95Å
577	T	85.2	Confident	81.8	Confident	46 Å²	46	83.9 Å²	83.9	28%	0.282	41%	0.407	S	S	.	.	H	α-helix	trans	-67.1	-41.1	176.3	-60.8	0	0	0	0	110.7	Q573 N574 E575 L580 K581	Q573-T577 VanDerWaalsContact O-CB 3.23Å; Q573-T577 WeakPolarHBondContact O-CB 3.47Å; Q573-T577 PolarHBondContact O-N 3.21Å; Q573-T577 PolarHBondContact O-OG1 2.86Å; N574-T577 PolarHBondContact O-N 2.63Å; E575-T577 VanDerWaalsContact C-N 3.34Å; T577-L580 PolarHBondContact O-N 3.16Å; T577-K581 HydrophobicContact CG2-CD 4.48Å; T577-K581 WeakPolarHBondContact O-CB 3.35Å; T577-K581 WeakPolarHBondContact O-CG 3.36Å; T577-K581 PolarHBondContact O-N 3.01Å
578	R	80.6	Confident	81.9	Confident	121 Å²	121	84.6 Å²	84.6	46%	0.457	41%	0.41	S	S	.	.	H	α-helix	trans	-63	-45	171.9	-178.6	175.7	-72.5	164.1	-1.5	112.2	N574 E575 L580 K581 L582 L692	N574-R578 WeakPolarHBondContact O-CB 3.32Å; N574-R578 PolarHBondContact O-N 3.36Å; E575-R578 PolarHBondContact O-N 2.89Å; R578-L580 VanDerWaalsContact C-N 3.29Å; R578-L580 PolarHBondContact O-N 3.43Å; R578-K581 PolarHBondContact O-N 3.2Å; R578-L582 WeakPolarHBondContact O-CB 3.39Å; R578-L582 PolarHBondContact O-N 3.43Å; R578-L692 HydrophobicContact CG-CB 4.2Å; R578-L692 HydrophobicContact CG-CD1 4.21Å; R578-L692 HydrophobicContact CG-CD2 4.32Å; R578-L692 HydrophobicContact CG-CG 4.49Å
579	E	81.8	Confident	82.3	Confident	63 Å²	63	87.1 Å²	87.1	29%	0.294	43%	0.426	S	S	.	.	H	α-helix	trans	-60.2	-39.3	172.7	-91.9	-152.5	-170.6	0	0	112	K263 E575 L576 K583	K263-E579 WeakPolarHBondContact CE-OE1 3.29Å; K263-E579 IonicContact NZ-OE1 2.78Å; K263-E579 PolarHBondContact NZ-OE1 3.15Å; K263-E579 IonicContact NZ-OE2 2.63Å; E575-E579 PolarHBondContact O-N 2.63Å; L576-E579 PolarHBondContact O-N 3.07Å; E579-K583 WeakPolarHBondContact O-CB 3.46Å; E579-K583 WeakPolarHBondContact O-CD 3.45Å; E579-K583 VanDerWaalsContact O-CG 3.23Å; E579-K583 WeakPolarHBondContact O-CG 3.28Å; E579-K583 PolarHBondContact O-N 3.47Å; E579-K583 IonicContact OE2-NZ 3.16Å; E579-K583 PolarHBondContact OE2-NZ 2.96Å
580	L	84	Confident	82.9	Confident	94 Å²	94	89.3 Å²	89.3	49%	0.492	43%	0.431	S	S	.	.	H	α-helix	trans	-69.5	-45.1	179.4	-176.3	149.9	0	0	0	111.3	L576 T577 R578 K583 H584	L576-L580 VanDerWaalsContact O-CB 3.25Å; L576-L580 WeakPolarHBondContact O-CB 2.94Å; L576-L580 PolarHBondContact O-N 2.95Å; T577-L580 PolarHBondContact O-N 3.16Å; R578-L580 VanDerWaalsContact C-N 3.29Å; R578-L580 PolarHBondContact O-N 3.43Å; L580-K583 PolarHBondContact O-N 3.1Å; L580-H584 VanDerWaalsContact CD2-CE1 3.46Å; L580-H584 WeakPolarHBondContact CD2-CE1 3.25Å; L580-H584 WeakPolarHBondContact CD2-ND1 3.33Å; L580-H584 PolarHBondContact O-N 3.17Å; L580-H584 PolarHBondContact O-ND1 3.03Å
581	K	85.2	Confident	82.9	Confident	60 Å²	60	88.8 Å²	88.8	26%	0.261	43%	0.429	S	S	.	.	H	α-helix	trans	-57.6	-46.5	172.6	-79.3	179.1	168.5	-179.2	0	111.2	T577 R578 K583 H584 L585 L692 Q693 D694	T577-K581 HydrophobicContact CG2-CD 4.48Å; T577-K581 WeakPolarHBondContact O-CB 3.35Å; T577-K581 WeakPolarHBondContact O-CG 3.36Å; T577-K581 PolarHBondContact O-N 3.01Å; R578-K581 PolarHBondContact O-N 3.2Å; K581-K583 PolarHBondContact O-N 3Å; K581-H584 PolarHBondContact O-N 2.79Å; K581-L585 WeakPolarHBondContact O-CB 3.19Å; K581-L585 PolarHBondContact O-N 3.2Å; K581-L692 HydrophobicContact CB-CD2 3.72Å; K581-Q693 PolarHBondContact NZ-O 3.02Å; K581-Q693 VanDerWaalsContact NZ-O 3.16Å; K581-D694 IonicContact NZ-OD1 2.98Å; K581-D694 PolarHBondContact NZ-OD1 3.11Å
582	L	85.6	Confident	83.3	Confident	64 Å²	64	86.6 Å²	86.6	34%	0.335	43%	0.426	S	S	.	.	H	α-helix	trans	-59.8	-44.8	176	179.9	62.4	0	0	0	111.9	R578 L585 I586 L692	R578-L582 WeakPolarHBondContact O-CB 3.39Å; R578-L582 PolarHBondContact O-N 3.43Å; L582-L585 PolarHBondContact O-N 3.35Å; L582-I586 HydrophobicContact CD1-CD1 4.3Å; L582-I586 HydrophobicContact CG-CD1 4.13Å; L582-I586 VanDerWaalsContact O-CG1 3.28Å; L582-I586 WeakPolarHBondContact O-CG1 3.45Å; L582-I586 PolarHBondContact O-N 2.66Å; L582-L692 HydrophobicContact CB-CD2 4.16Å
583	K	85.6	Confident	83.6	Confident	109 Å²	109	90.7 Å²	90.7	47%	0.474	45%	0.446	S	S	.	.	H	α-helix	trans	-63.7	-40	175.8	-71.7	162.3	-166	159.7	0	112	E579 L580 K581 I586 I587	E579-K583 WeakPolarHBondContact O-CB 3.46Å; E579-K583 WeakPolarHBondContact O-CD 3.45Å; E579-K583 VanDerWaalsContact O-CG 3.23Å; E579-K583 WeakPolarHBondContact O-CG 3.28Å; E579-K583 PolarHBondContact O-N 3.47Å; E579-K583 IonicContact OE2-NZ 3.16Å; E579-K583 PolarHBondContact OE2-NZ 2.96Å; L580-K583 PolarHBondContact O-N 3.1Å; K581-K583 PolarHBondContact O-N 3Å; K583-I586 PolarHBondContact O-N 3.36Å; K583-I587 WeakPolarHBondContact O-CD1 3.3Å; K583-I587 VanDerWaalsContact O-CG1 3.23Å; K583-I587 WeakPolarHBondContact O-CG1 3.31Å; K583-I587 PolarHBondContact O-N 3.45Å
584	H	84.6	Confident	83.6	Confident	88 Å²	88	92.1 Å²	92.1	41%	0.407	45%	0.452	S	S	.	.	H	α-helix	trans	-65.1	-45.6	175.5	-78.8	75	0	0	0	112	L580 K581 I586 I587 E588	L580-H584 VanDerWaalsContact CD2-CE1 3.46Å; L580-H584 WeakPolarHBondContact CD2-CE1 3.25Å; L580-H584 WeakPolarHBondContact CD2-ND1 3.33Å; L580-H584 PolarHBondContact O-N 3.17Å; L580-H584 PolarHBondContact O-ND1 3.03Å; K581-H584 PolarHBondContact O-N 2.79Å; H584-I586 VanDerWaalsContact C-N 3.27Å; H584-I586 PolarHBondContact O-N 3.48Å; H584-I587 PolarHBondContact O-N 3.28Å; H584-I587 VanDerWaalsContact O-N 3.1Å; H584-E588 WeakPolarHBondContact O-CB 3.07Å; H584-E588 WeakPolarHBondContact O-CG 3.35Å; H584-E588 PolarHBondContact O-N 3.38Å
585	L	84.9	Confident	83.6	Confident	57 Å²	57	93.6 Å²	93.6	30%	0.298	46%	0.458	S	S	.	.	H	α-helix	trans	-57.3	-39.5	173.3	-79.7	164.2	0	0	0	112.1	K581 L582 N589 L692	K581-L585 WeakPolarHBondContact O-CB 3.19Å; K581-L585 PolarHBondContact O-N 3.2Å; L582-L585 PolarHBondContact O-N 3.35Å; L585-N589 WeakPolarHBondContact O-CB 3.44Å; L585-N589 PolarHBondContact O-N 3.44Å; L585-N589 VanDerWaalsContact O-N 3.08Å; L585-N589 PolarHBondContact O-ND2 2.9Å; L585-L692 HydrophobicContact CD1-CD2 4.11Å
586	I	85.9	Confident	83.7	Confident	85 Å²	85	91 Å²	91	44%	0.436	45%	0.445	S	S	.	.	H	α-helix	trans	-65.9	-45.8	174.7	-68.7	163.7	0	0	0	110.9	L582 K583 H584 E588 F590	L582-I586 HydrophobicContact CD1-CD1 4.3Å; L582-I586 HydrophobicContact CG-CD1 4.13Å; L582-I586 VanDerWaalsContact O-CG1 3.28Å; L582-I586 WeakPolarHBondContact O-CG1 3.45Å; L582-I586 PolarHBondContact O-N 2.66Å; K583-I586 PolarHBondContact O-N 3.36Å; H584-I586 VanDerWaalsContact C-N 3.27Å; H584-I586 PolarHBondContact O-N 3.48Å; I586-E588 VanDerWaalsContact C-N 3.33Å; I586-E588 PolarHBondContact O-N 2.94Å; I586-F590 HydrophobicContact CG2-CD2 4.39Å; I586-F590 WeakPolarHBondContact O-CB 3.43Å; I586-F590 PolarHBondContact O-N 2.89Å
587	I	83.9	Confident	84	Confident	55 Å²	55	89 Å²	89	28%	0.282	44%	0.44	S	S	.	.	H	α-helix	trans	-60.6	-42.3	178.1	-70	162.1	0	0	0	111.1	K583 H584 I591 K596	K583-I587 WeakPolarHBondContact O-CD1 3.3Å; K583-I587 VanDerWaalsContact O-CG1 3.23Å; K583-I587 WeakPolarHBondContact O-CG1 3.31Å; K583-I587 PolarHBondContact O-N 3.45Å; H584-I587 PolarHBondContact O-N 3.28Å; H584-I587 VanDerWaalsContact O-N 3.1Å; I587-I591 HydrophobicContact CB-CD1 4.3Å; I587-I591 HydrophobicContact CG1-CD1 3.94Å; I587-I591 HydrophobicContact CG2-CD1 4.33Å; I587-I591 WeakPolarHBondContact O-CB 3.33Å; I587-I591 PolarHBondContact O-N 2.89Å; I587-K596 HydrophobicContact CG2-CD 3.95Å; I587-K596 HydrophobicContact CG2-CG 4.37Å
588	E	83.1	Confident	83.9	Confident	118 Å²	118	91.7 Å²	91.7	55%	0.551	45%	0.447	S	S	*	.	H	α-helix	trans	-76.8	-32.8	-175.2	-69.9	-178.4	164.2	0	0	113.7	H584 I586 K596	H584-E588 WeakPolarHBondContact O-CB 3.07Å; H584-E588 WeakPolarHBondContact O-CG 3.35Å; H584-E588 PolarHBondContact O-N 3.38Å; I586-E588 VanDerWaalsContact C-N 3.33Å; I586-E588 PolarHBondContact O-N 2.94Å; E588-K596 IonicContact OE1-NZ 2.69Å
589	N	83.8	Confident	84	Confident	115 Å²	115	89.6 Å²	89.6	62%	0.615	44%	0.444	S	S	*	.	H	α-helix	trans	-91.2	-27.2	-179.1	-69.6	-76	0	0	0	113.9	L585	L585-N589 WeakPolarHBondContact O-CB 3.44Å; L585-N589 PolarHBondContact O-N 3.44Å; L585-N589 VanDerWaalsContact O-N 3.08Å; L585-N589 PolarHBondContact O-ND2 2.9Å
590	F	87.5	Confident	84.1	Confident	168 Å²	168	92.3 Å²	92.3	74%	0.737	46%	0.458	S	S	*	.	H	α-helix	trans	-117.9	-11.8	-171.6	-62.7	-88.2	0	0	0	115.4	I586	I586-F590 HydrophobicContact CG2-CD2 4.39Å; I586-F590 WeakPolarHBondContact O-CB 3.43Å; I586-F590 PolarHBondContact O-N 2.89Å
591	I	82.2	Confident	84.1	Confident	63 Å²	63	94.4 Å²	94.4	32%	0.323	47%	0.47	S	S	.	.	S	Bend	trans	-107.1	120.5	177.3	-53.5	-176.6	0	0	0	109.8	I587 L593 E595	I587-I591 HydrophobicContact CB-CD1 4.3Å; I587-I591 HydrophobicContact CG1-CD1 3.94Å; I587-I591 HydrophobicContact CG2-CD1 4.33Å; I587-I591 WeakPolarHBondContact O-CB 3.33Å; I587-I591 PolarHBondContact O-N 2.89Å; I591-L593 PolarHBondContact O-N 2.95Å; I591-E595 HydrophobicContact CG2-CB 4.1Å
592	P	86.7	Confident	84.1	Confident	82 Å²	82	95 Å²	95	53%	0.532	47%	0.471	S	S	.	.			trans	-54.7	137.3	174.9	-26.6	35.2	0	0	0	112	E594 E595 K596	P592-E594 PolarHBondContact O-N 3.24Å; P592-E594 VanDerWaalsContact O-N 3.08Å; P592-E595 PolarHBondContact O-N 3.14Å; P592-K596 PolarHBondContact O-N 3.26Å
593	L	81.7	Confident	84.2	Confident	131 Å²	131	93.2 Å²	93.2	69%	0.686	47%	0.465	S	S	*	.	H	α-helix	trans	-52.9	-35.9	-178	-67	174.1	0	0	0	112.6	I591 E595 K596 S597	I591-L593 PolarHBondContact O-N 2.95Å; L593-E595 PolarHBondContact O-N 3.33Å; L593-K596 PolarHBondContact O-N 3.4Å; L593-S597 PolarHBondContact O-N 2.89Å; L593-S597 PolarHBondContact O-OG 3.22Å
594	E	82	Confident	84.3	Confident	140 Å²	140	91.3 Å²	91.3	65%	0.654	46%	0.457	S	S	*	.	H	α-helix	trans	-61.2	-42	176.2	-63.1	167.7	-161.7	0	0	113	P592 K598	P592-E594 PolarHBondContact O-N 3.24Å; P592-E594 VanDerWaalsContact O-N 3.08Å; E594-K598 WeakPolarHBondContact O-CG 3.36Å; E594-K598 PolarHBondContact O-N 2.87Å
595	E	82	Confident	84.3	Confident	81 Å²	81	91.1 Å²	91.1	38%	0.379	46%	0.456	S	S	.	.	H	α-helix	trans	-74.1	-38.5	176.6	-66.3	-55.5	137.7	0	0	111.2	I591 P592 L593 S597 K598 I599	I591-E595 HydrophobicContact CG2-CB 4.1Å; P592-E595 PolarHBondContact O-N 3.14Å; L593-E595 PolarHBondContact O-N 3.33Å; E595-S597 VanDerWaalsContact C-N 3.35Å; E595-S597 PolarHBondContact O-N 2.62Å; E595-K598 PolarHBondContact O-N 3.18Å; E595-K598 IonicContact OE1-NZ 2.75Å; E595-K598 PolarHBondContact OE1-NZ 2.91Å; E595-I599 WeakPolarHBondContact O-CG1 3.37Å; E595-I599 PolarHBondContact O-N 3.39Å
596	K	82.5	Confident	84	Confident	64 Å²	64	89.7 Å²	89.7	28%	0.278	45%	0.448	S	S	.	.	H	α-helix	trans	-54.8	-50.4	170.8	-173.8	177.6	-179.3	176.1	0	110.3	I587 E588 P592 L593 I599 M600	I587-K596 HydrophobicContact CG2-CD 3.95Å; I587-K596 HydrophobicContact CG2-CG 4.37Å; E588-K596 IonicContact OE1-NZ 2.69Å; P592-K596 PolarHBondContact O-N 3.26Å; L593-K596 PolarHBondContact O-N 3.4Å; K596-I599 PolarHBondContact O-N 3.11Å; K596-M600 HydrophobicContact CG-CG 4.49Å; K596-M600 WeakPolarHBondContact O-CB 3.44Å; K596-M600 VanDerWaalsContact O-CG 3.25Å; K596-M600 WeakPolarHBondContact O-CG 3.46Å; K596-M600 PolarHBondContact O-N 3.25Å
597	S	84.6	Confident	83.8	Confident	66 Å²	66	93.6 Å²	93.6	46%	0.462	46%	0.464	S	S	.	.	H	α-helix	trans	-63.9	-40.7	176.8	-66	0	0	0	0	113.4	L593 E595 I599 N601	L593-S597 PolarHBondContact O-N 2.89Å; L593-S597 PolarHBondContact O-OG 3.22Å; E595-S597 VanDerWaalsContact C-N 3.35Å; E595-S597 PolarHBondContact O-N 2.62Å; S597-I599 VanDerWaalsContact C-N 3.32Å; S597-I599 PolarHBondContact O-N 3.13Å; S597-N601 VanDerWaalsContact O-CB 3.26Å; S597-N601 WeakPolarHBondContact O-CB 3.34Å; S597-N601 PolarHBondContact O-N 3.15Å; S597-N601 PolarHBondContact O-ND2 2.58Å
598	K	83.4	Confident	83.1	Confident	101 Å²	101	98 Å²	98	44%	0.439	48%	0.484	S	S	.	.	H	α-helix	trans	-61.9	-38.2	175.7	-74.5	166.2	-160.3	169.8	0	112.5	E594 E595 R602	E594-K598 WeakPolarHBondContact O-CG 3.36Å; E594-K598 PolarHBondContact O-N 2.87Å; E595-K598 PolarHBondContact O-N 3.18Å; E595-K598 IonicContact OE1-NZ 2.75Å; E595-K598 PolarHBondContact OE1-NZ 2.91Å; K598-R602 WeakPolarHBondContact O-CD 3.49Å; K598-R602 VanDerWaalsContact O-CG 3.31Å; K598-R602 WeakPolarHBondContact O-CG 3.01Å
599	I	83.1	Confident	82.5	Confident	77 Å²	77	93.6 Å²	93.6	40%	0.395	46%	0.463	S	S	.	.	H	α-helix	trans	-73.1	-50.2	178.2	-66.9	169	0	0	0	109.9	E595 K596 S597 N601 R602 A603 L614	E595-I599 WeakPolarHBondContact O-CG1 3.37Å; E595-I599 PolarHBondContact O-N 3.39Å; K596-I599 PolarHBondContact O-N 3.11Å; S597-I599 VanDerWaalsContact C-N 3.32Å; S597-I599 PolarHBondContact O-N 3.13Å; I599-N601 PolarHBondContact O-N 3.03Å; I599-R602 CarbonylContact O-C 3.59Å; I599-R602 PolarHBondContact O-N 3.26Å; I599-A603 PolarHBondContact O-N 3.32Å; I599-L614 HydrophobicContact CG2-CD2 3.98Å
600	M	83.4	Confident	81.8	Confident	120 Å²	120	94.1 Å²	94.1	59%	0.591	47%	0.466	S	S	*	.	H	α-helix	trans	-59	-43	179.8	-68.6	-61.2	-65.2	0	0	112.4	K596 R602 A603	K596-M600 HydrophobicContact CG-CG 4.49Å; K596-M600 WeakPolarHBondContact O-CB 3.44Å; K596-M600 VanDerWaalsContact O-CG 3.25Å; K596-M600 WeakPolarHBondContact O-CG 3.46Å; K596-M600 PolarHBondContact O-N 3.25Å; M600-R602 PolarHBondContact O-N 3.46Å; M600-R602 VanDerWaalsContact O-N 3.17Å; M600-A603 PolarHBondContact O-N 2.98Å
601	N	84.8	Confident	81.3	Confident	138 Å²	138	90 Å²	90	74%	0.738	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-10.8	177.6	-68.5	-8.5	0	0	0	114	S597 I599	S597-N601 VanDerWaalsContact O-CB 3.26Å; S597-N601 WeakPolarHBondContact O-CB 3.34Å; S597-N601 PolarHBondContact O-N 3.15Å; S597-N601 PolarHBondContact O-ND2 2.58Å; I599-N601 PolarHBondContact O-N 3.03Å
602	R	85.7	Confident	81.2	Confident	72 Å²	72	95.2 Å²	95.2	27%	0.272	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	-13.2	176.3	-73.1	173.1	56.4	-137.2	-10.4	112.6	K598 I599 M600 L614 H615	K598-R602 WeakPolarHBondContact O-CD 3.49Å; K598-R602 VanDerWaalsContact O-CG 3.31Å; K598-R602 WeakPolarHBondContact O-CG 3.01Å; I599-R602 CarbonylContact O-C 3.59Å; I599-R602 PolarHBondContact O-N 3.26Å; M600-R602 PolarHBondContact O-N 3.46Å; M600-R602 VanDerWaalsContact O-N 3.17Å; R602-L614 HydrophobicContact CB-CD2 4.12Å; R602-L614 CarbonylContact O-C 3.2Å; R602-L614 WeakPolarHBondContact O-CA 3.48Å; R602-H615 HydrophobicContact CB-CB 4.49Å; R602-H615 VanDerWaalsContact CZ-O 3.27Å; R602-H615 PolarHBondContact NE-O 2.86Å; R602-H615 PolarHBondContact NH2-O 3.42Å; R602-H615 PolarHBondContact O-CD2 2.98Å; R602-H615 PolarHBondContact O-N 3.37Å
603	A	86.9	Confident	81	Confident	27 Å²	27	94.5 Å²	94.5	22%	0.223	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	122.2	179.6	0	0	0	0	0	109.4	I599 M600 W612 K613 L614	I599-A603 PolarHBondContact O-N 3.32Å; M600-A603 PolarHBondContact O-N 2.98Å; A603-W612 HydrophobicContact CB-CE3 3.9Å; A603-W612 HydrophobicContact CB-CZ3 4.24Å; A603-K613 WeakPolarHBondContact CA-O 2.94Å; A603-L614 HydrophobicContact CB-CD2 3.96Å
604	F	87.5	Confident	81	Confident	69 Å²	69	92.4 Å²	92.4	30%	0.303	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	147.7	168.2	68.7	-84.4	0	0	0	108.7	D606 W612 K613 H615	F604-D606 HydrophobicContact CE2-CB 4.49Å; F604-W612 WeakPolarHBondContact O-CA 3.29Å; F604-K613 HydrophobicContact CD1-CB 4.2Å; F604-K613 WeakPolarHBondContact CD1-O 3.45Å; F604-K613 HydrophobicContact CD2-CB 4.4Å; F604-K613 HydrophobicContact CE1-CB 3.6Å; F604-K613 HydrophobicContact CE2-CB 3.83Å; F604-K613 HydrophobicContact CE2-CD 4.25Å; F604-K613 HydrophobicContact CZ-CB 3.4Å; F604-K613 HydrophobicContact CZ-CD 4.06Å; F604-K613 HydrophobicContact CZ-CG 4.32Å; F604-K613 PolarHBondContact N-O 2.86Å; F604-K613 PolarHBondContact O-N 2.86Å; F604-H615 AromaticContact CD1-CD2 3.64Å; F604-H615 AromaticContact CD1-CE1 3.36Å; F604-H615 WeakPolarHBondContact CD1-CE1 3.38Å; F604-H615 AromaticContact CD1-CG 3.78Å; F604-H615 AromaticContact CD1-ND1 3.61Å; F604-H615 AromaticContact CD1-NE2 3.39Å; F604-H615 WeakPolarHBondContact CD1-NE2 3.23Å; F604-H615 AromaticContact CE1-CE1 3.56Å; F604-H615 AromaticContact CE1-CG 3.93Å; F604-H615 AromaticContact CE1-ND1 3.48Å; F604-H615 WeakPolarHBondContact CE1-ND1 3.3Å; F604-H615 AromaticContact CG-CE1 3.97Å; F604-H615 AromaticContact CG-NE2 3.87Å
605	F	84.4	Confident	80.9	Confident	85 Å²	85	90.3 Å²	90.3	37%	0.373	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	128.7	173.9	-168.1	-106.3	0	0	0	108.9	E607 D610 W612	F605-E607 HydrophobicContact CD1-CG 4.17Å; F605-D610 WeakPolarHBondContact CZ-OD1 3.3Å; F605-W612 HydrophobicContact CB-CD2 4.41Å; F605-W612 HydrophobicContact CB-CE3 4.28Å; F605-W612 HydrophobicContact CB-CH2 4.38Å; F605-W612 HydrophobicContact CB-CZ2 4.48Å; F605-W612 HydrophobicContact CB-CZ3 4.27Å; F605-W612 AromaticContact CD2-CD1 3.93Å; F605-W612 HydrophobicContact CD2-CD2 4.03Å; F605-W612 AromaticContact CD2-CE2 3.82Å; F605-W612 HydrophobicContact CD2-CG 4.13Å; F605-W612 HydrophobicContact CD2-CZ2 4.35Å; F605-W612 AromaticContact CD2-NE1 3.73Å
606	D	79.7	Confident	80.3	Confident	26 Å²	26	91.4 Å²	91.4	14%	0.139	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	105.4	173.8	-169.8	-42.1	0	0	0	109	F604 E608 E609 D610 H611 K613	F604-D606 HydrophobicContact CE2-CB 4.49Å; D606-E608 VanDerWaalsContact C-N 3.26Å; D606-E608 PolarHBondContact O-N 2.84Å; D606-E608 WeakPolarHBondContact OD1-CB 3.5Å; D606-E608 PolarHBondContact OD1-N 3.29Å; D606-E609 PolarHBondContact O-N 2.78Å; D606-E609 PolarHBondContact OD1-N 2.68Å; D606-E609 VanDerWaalsContact OD1-N 3.14Å; D606-D610 WeakPolarHBondContact O-CA 3.43Å; D606-D610 PolarHBondContact O-N 2.75Å; D606-H611 WeakPolarHBondContact CB-O 3.33Å; D606-H611 PolarHBondContact N-O 3.44Å; D606-H611 PolarHBondContact O-N 3.31Å; D606-K613 HydrophobicContact CB-CD 3.98Å; D606-K613 HydrophobicContact CB-CG 4.28Å; D606-K613 WeakPolarHBondContact OD2-CD 3.41Å; D606-K613 WeakPolarHBondContact OD2-CE 3.43Å; D606-K613 IonicContact OD2-NZ 2.99Å; D606-K613 PolarHBondContact OD2-NZ 3.47Å
607	E	80.2	Confident	79.6	Confident	167 Å²	167	95.1 Å²	95.1	78%	0.78	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-19.1	-179.4	-65.3	-174.6	175	0	0	113.7	F605	F605-E607 HydrophobicContact CD1-CG 4.17Å
608	E	69.9	Low	78.4	Confident	149 Å²	149	95.8 Å²	95.8	70%	0.696	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-39	177.6	-62.3	-170.1	174.5	0	0	111.5	D606	D606-E608 VanDerWaalsContact C-N 3.26Å; D606-E608 PolarHBondContact O-N 2.84Å; D606-E608 WeakPolarHBondContact OD1-CB 3.5Å; D606-E608 PolarHBondContact OD1-N 3.29Å
609	E	69.8	Low	77.2	Confident	24 Å²	24	103.2 Å²	103.2	11%	0.112	49%	0.494	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	3.3	-174.6	-60.2	-71	168.2	0	0	114	K167 D606 H611	K167-E609 IonicContact NZ-OE1 3.22Å; K167-E609 PolarHBondContact NZ-OE1 2.89Å; D606-E609 PolarHBondContact O-N 2.78Å; D606-E609 PolarHBondContact OD1-N 2.68Å; D606-E609 VanDerWaalsContact OD1-N 3.14Å; E609-H611 VanDerWaalsContact C-N 3.34Å; E609-H611 WeakPolarHBondContact CB-CE1 3.49Å; E609-H611 VanDerWaalsContact CB-ND1 3.34Å; E609-H611 WeakPolarHBondContact CB-ND1 3.31Å; E609-H611 PolarHBondContact O-N 3.49Å; E609-H611 PolarHBondContact O-ND1 3.26Å
610	D	70.1	Confident	75.6	Confident	127 Å²	127	104.5 Å²	104.5	68%	0.679	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	38.7	174.8	-158.4	46.6	0	0	0	114.6	F605 D606	F605-D610 WeakPolarHBondContact CZ-OD1 3.3Å; D606-D610 WeakPolarHBondContact O-CA 3.43Å; D606-D610 PolarHBondContact O-N 2.75Å
611	H	76.3	Confident	74.2	Confident	80 Å²	80	108.2 Å²	108.2	37%	0.37	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	156.9	179.1	67.6	-90.5	0	0	0	114.6	D606 E609 K613	D606-H611 WeakPolarHBondContact CB-O 3.33Å; D606-H611 PolarHBondContact N-O 3.44Å; D606-H611 PolarHBondContact O-N 3.31Å; E609-H611 VanDerWaalsContact C-N 3.34Å; E609-H611 WeakPolarHBondContact CB-CE1 3.49Å; E609-H611 VanDerWaalsContact CB-ND1 3.34Å; E609-H611 WeakPolarHBondContact CB-ND1 3.31Å; E609-H611 PolarHBondContact O-N 3.49Å; E609-H611 PolarHBondContact O-ND1 3.26Å; H611-K613 WeakPolarHBondContact CE1-CE 3.41Å; H611-K613 WeakPolarHBondContact NE2-CE 3.4Å; H611-K613 PolarHBondContact O-N 3.27Å
612	W	80.9	Confident	72.6	Confident	173 Å²	173	107.6 Å²	107.6	66%	0.655	51%	0.514	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.7	120.3	174.5	-69	91.4	0	0	0	111.2	A603 F604 F605	A603-W612 HydrophobicContact CB-CE3 3.9Å; A603-W612 HydrophobicContact CB-CZ3 4.24Å; F604-W612 WeakPolarHBondContact O-CA 3.29Å; F605-W612 HydrophobicContact CB-CD2 4.41Å; F605-W612 HydrophobicContact CB-CE3 4.28Å; F605-W612 HydrophobicContact CB-CH2 4.38Å; F605-W612 HydrophobicContact CB-CZ2 4.48Å; F605-W612 HydrophobicContact CB-CZ3 4.27Å; F605-W612 AromaticContact CD2-CD1 3.93Å; F605-W612 HydrophobicContact CD2-CD2 4.03Å; F605-W612 AromaticContact CD2-CE2 3.82Å; F605-W612 HydrophobicContact CD2-CG 4.13Å; F605-W612 HydrophobicContact CD2-CZ2 4.35Å; F605-W612 AromaticContact CD2-NE1 3.73Å
613	K	82.3	Confident	71	Confident	67 Å²	67	113.7 Å²	113.7	29%	0.291	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	150.6	171.3	-70.1	-177.1	-177.8	172	0	109.8	A603 F604 D606 H611	A603-K613 WeakPolarHBondContact CA-O 2.94Å; F604-K613 HydrophobicContact CD1-CB 4.2Å; F604-K613 WeakPolarHBondContact CD1-O 3.45Å; F604-K613 HydrophobicContact CD2-CB 4.4Å; F604-K613 HydrophobicContact CE1-CB 3.6Å; F604-K613 HydrophobicContact CE2-CB 3.83Å; F604-K613 HydrophobicContact CE2-CD 4.25Å; F604-K613 HydrophobicContact CZ-CB 3.4Å; F604-K613 HydrophobicContact CZ-CD 4.06Å; F604-K613 HydrophobicContact CZ-CG 4.32Å; F604-K613 PolarHBondContact N-O 2.86Å; F604-K613 PolarHBondContact O-N 2.86Å; D606-K613 HydrophobicContact CB-CD 3.98Å; D606-K613 HydrophobicContact CB-CG 4.28Å; D606-K613 WeakPolarHBondContact OD2-CD 3.41Å; D606-K613 WeakPolarHBondContact OD2-CE 3.43Å; D606-K613 IonicContact OD2-NZ 2.99Å; D606-K613 PolarHBondContact OD2-NZ 3.47Å; H611-K613 WeakPolarHBondContact CE1-CE 3.41Å; H611-K613 WeakPolarHBondContact NE2-CE 3.4Å; H611-K613 PolarHBondContact O-N 3.27Å
614	L	82.2	Confident	69.4	Low	88 Å²	88	120.5 Å²	120.5	46%	0.461	57%	0.573	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105	124.3	174.7	-71.8	169	0	0	0	110	I599 R602 A603	I599-L614 HydrophobicContact CG2-CD2 3.98Å; R602-L614 HydrophobicContact CB-CD2 4.12Å; R602-L614 CarbonylContact O-C 3.2Å; R602-L614 WeakPolarHBondContact O-CA 3.48Å; A603-L614 HydrophobicContact CB-CD2 3.96Å
615	H	78.4	Confident	67.7	Low	96 Å²	96	125.8 Å²	125.8	44%	0.444	60%	0.601	S	S	.	*			trans	-55.2	132.3	170.8	-73.1	-59.2	0	0	0	110.6	R602 F604	R602-H615 HydrophobicContact CB-CB 4.49Å; R602-H615 VanDerWaalsContact CZ-O 3.27Å; R602-H615 PolarHBondContact NE-O 2.86Å; R602-H615 PolarHBondContact NH2-O 3.42Å; R602-H615 PolarHBondContact O-CD2 2.98Å; R602-H615 PolarHBondContact O-N 3.37Å; F604-H615 AromaticContact CD1-CD2 3.64Å; F604-H615 AromaticContact CD1-CE1 3.36Å; F604-H615 WeakPolarHBondContact CD1-CE1 3.38Å; F604-H615 AromaticContact CD1-CG 3.78Å; F604-H615 AromaticContact CD1-ND1 3.61Å; F604-H615 AromaticContact CD1-NE2 3.39Å; F604-H615 WeakPolarHBondContact CD1-NE2 3.23Å; F604-H615 AromaticContact CE1-CE1 3.56Å; F604-H615 AromaticContact CE1-CG 3.93Å; F604-H615 AromaticContact CE1-ND1 3.48Å; F604-H615 WeakPolarHBondContact CE1-ND1 3.3Å; F604-H615 AromaticContact CG-CE1 3.97Å; F604-H615 AromaticContact CG-NE2 3.87Å
616	P	70.2	Confident	66.3	Low	103 Å²	103	129.9 Å²	129.9	67%	0.669	62%	0.623	S	S	*	*			trans	-55.4	143.2	175.6	-26.6	35.2	0	0	0	112.4	T618	P616-T618 PolarHBondContact O-N 3.37Å
617	I	67.3	Low	65.4	Low	142 Å²	142	138.3 Å²	138.3	73%	0.728	66%	0.659	S	S	*	*	S	Bend	trans	-65.7	-32.8	179	-59.8	176.8	0	0	0	111
618	T	60.7	Low	64.4	Low	80 Å²	80	138 Å²	138	49%	0.491	65%	0.65	S	S	.	*	S	Bend	trans	-97	129.5	-176	39.8	0	0	0	0	111.9	P616 L620	P616-T618 PolarHBondContact O-N 3.37Å; T618-L620 HydrophobicContact CG2-CD1 4.45Å; T618-L620 PolarHBondContact O-N 3.37Å
619	R	56.5	Low	64.1	Low	257 Å²	257	136.3 Å²	136.3	97%	0.97	65%	0.652	S	S	*	*	S	Bend	trans	-66.7	17.7	164.4	-69.4	-176	175.8	170.6	-2.3	114.1
620	L	51.3	Low	63.8	Low	104 Å²	104	139.7 Å²	139.7	55%	0.545	67%	0.674	S	S	.	*			trans	-95	106.3	175.9	-77.2	153.1	0	0	0	107.1	T618 N622	T618-L620 HydrophobicContact CG2-CD1 4.45Å; T618-L620 PolarHBondContact O-N 3.37Å; L620-N622 PolarHBondContact O-N 2.97Å; L620-N622 VanDerWaalsContact O-N 3.13Å
621	E	52.3	Low	63.6	Low	198 Å²	198	134.5 Å²	134.5	93%	0.925	65%	0.648	S	S	*	*	S	Bend	trans	-63.2	-13.4	175.3	-63.5	176.2	143.9	0	0	112.4
622	N	51.7	Low	63	Low	125 Å²	125	136.3 Å²	136.3	67%	0.668	68%	0.676	S	S	*	*	S	Bend	trans	-95.7	128.2	176	-70.2	-41.1	0	0	0	112	L620 Q624	L620-N622 PolarHBondContact O-N 2.97Å; L620-N622 VanDerWaalsContact O-N 3.13Å; N622-Q624 PolarHBondContact O-N 3.39Å
623	Q	52.7	Low	62.3	Low	200 Å²	200	131 Å²	131	94%	0.935	66%	0.663	S	S	*	*			trans	-69.1	38.1	-176.9	-62	178.8	-15.1	0	0	115.4	M625	Q623-M625 PolarHBondContact O-N 3.27Å
624	Q	53.5	Low	61.7	Low	170 Å²	170	130.8 Å²	130.8	79%	0.794	68%	0.68	S	S	*	*			trans	-91.2	92.5	174	-70.6	-170	-0.1	0	0	110.9	N622 M626	N622-Q624 PolarHBondContact O-N 3.39Å; Q624-M626 PolarHBondContact O-N 2.75Å
625	M	51.6	Low	61.1	Low	181 Å²	181	131.1 Å²	131.1	89%	0.892	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-55.4	125.2	165.8	-65	178.7	73.4	0	0	109.6	Q623 K627	Q623-M625 PolarHBondContact O-N 3.27Å; M625-K627 PolarHBondContact O-N 2.6Å
626	M	54.9	Low	60.5	Low	171 Å²	171	132.9 Å²	132.9	84%	0.842	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-57.9	122.9	175.8	-67.8	-169.9	-171.6	0	0	110	Q624 R628	Q624-M626 PolarHBondContact O-N 2.75Å; M626-R628 PolarHBondContact O-N 2.61Å
627	K	59.9	Low	60.4	Low	203 Å²	203	131.3 Å²	131.3	88%	0.883	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-64.4	127.2	175.5	-70.5	-178.5	178.8	176.8	0	109.3	M625	M625-K627 PolarHBondContact O-N 2.6Å
628	R	59.5	Low	60.5	Low	161 Å²	161	129.9 Å²	129.9	61%	0.608	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-56.1	130	176.2	-165.7	-174	-161.9	-176.3	10.1	109.4	M626 V630 N659	M626-R628 PolarHBondContact O-N 2.61Å; R628-V630 PolarHBondContact O-N 3Å; R628-N659 PolarHBondContact NH1-OD1 3.18Å; R628-N659 VanDerWaalsContact NH1-OD1 3.17Å
629	P	63.9	Low	61	Low	112 Å²	112	126.7 Å²	126.7	73%	0.727	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-60.6	138.2	178.9	23.9	-33.4	0	0	0	110.9
630	V	64.2	Low	62.1	Low	96 Å²	96	117.9 Å²	117.9	58%	0.582	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-80.1	144.2	178	-165.2	0	0	0	0	108.7	R628 G634 Y635	R628-V630 PolarHBondContact O-N 3Å; V630-G634 WeakPolarHBondContact CG1-O 3.13Å; V630-Y635 WeakPolarHBondContact CG1-O 3.16Å
631	S	65.7	Low	63.5	Low	18 Å²	18	119.5 Å²	119.5	13%	0.126	63%	0.625	C	S	.	*	P	Polyproline II helix	trans	-64.1	157.1	173.9	68.8	0	0	0	0	111.4	V633 G634 Y635 R637	S631-V633 PolarHBondContact O-N 3.43Å; S631-G634 PolarHBondContact O-N 2.58Å; S631-Y635 VanDerWaalsContact CB-O 3.31Å; S631-Y635 WeakPolarHBondContact CB-O 3.39Å; S631-Y635 PolarHBondContact N-O 3.22Å; S631-Y635 PolarHBondContact OG-N 2.93Å; S631-Y635 PolarHBondContact OG-O 2.81Å; S631-R637 PolarHBondContact OG-O 2.88Å
632	A	63.2	Low	64.9	Low	117 Å²	117	115.9 Å²	115.9	97%	0.967	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58	-7.5	176.8	0	0	0	0	0	114.8
633	V	65.6	Low	66.2	Low	61 Å²	61	110.5 Å²	110.5	37%	0.37	58%	0.581	S	S	.	*	T	Hydrogen-bonded Turn	trans	-108.4	16.2	177.8	-148.8	0	0	0	0	112	S631 Y635	S631-V633 PolarHBondContact O-N 3.43Å; V633-Y635 VanDerWaalsContact C-N 3.26Å; V633-Y635 HydrophobicContact CB-CD2 4.18Å; V633-Y635 HydrophobicContact CG1-CD2 4.42Å; V633-Y635 HydrophobicContact CG1-CE2 4.41Å; V633-Y635 VanDerWaalsContact O-CD2 3.29Å; V633-Y635 WeakPolarHBondContact O-CD2 3.46Å; V633-Y635 PolarHBondContact O-N 2.89Å
634	G	69.6	Low	67.4	Low	63 Å²	63	105.2 Å²	105.2	65%	0.649	55%	0.552	S	S	*	*	S	Bend	trans	79.1	-7.8	177.2	0	0	0	0	0	116	V630 S631	V630-G634 WeakPolarHBondContact CG1-O 3.13Å; S631-G634 PolarHBondContact O-N 2.58Å
635	Y	69.8	Low	68.8	Low	95 Å²	95	102.3 Å²	102.3	37%	0.373	54%	0.54	S	S	.	.	S	Bend	trans	-87.5	149.7	179.9	-66.1	-71.2	0	0	0	113.2	V630 S631 V633 R637 L639 A657	V630-Y635 WeakPolarHBondContact CG1-O 3.16Å; S631-Y635 VanDerWaalsContact CB-O 3.31Å; S631-Y635 WeakPolarHBondContact CB-O 3.39Å; S631-Y635 PolarHBondContact N-O 3.22Å; S631-Y635 PolarHBondContact OG-N 2.93Å; S631-Y635 PolarHBondContact OG-O 2.81Å; V633-Y635 VanDerWaalsContact C-N 3.26Å; V633-Y635 HydrophobicContact CB-CD2 4.18Å; V633-Y635 HydrophobicContact CG1-CD2 4.42Å; V633-Y635 HydrophobicContact CG1-CE2 4.41Å; V633-Y635 VanDerWaalsContact O-CD2 3.29Å; V633-Y635 WeakPolarHBondContact O-CD2 3.46Å; V633-Y635 PolarHBondContact O-N 2.89Å; Y635-R637 WeakPolarHBondContact CB-O 3.48Å; Y635-R637 PolarHBondContact O-N 3.34Å; Y635-L639 HydrophobicContact CD1-CD1 4.39Å; Y635-L639 HydrophobicContact CD2-CD1 3.94Å; Y635-L639 HydrophobicContact CE2-CD1 4.24Å; Y635-L639 HydrophobicContact CG-CD1 4.02Å; Y635-A657 HydrophobicContact CD1-CB 3.5Å; Y635-A657 HydrophobicContact CE1-CB 4.34Å; Y635-A657 HydrophobicContact CG-CB 3.94Å
636	K	65.8	Low	70.1	Confident	133 Å²	133	94.5 Å²	94.5	58%	0.578	50%	0.503	S	S	*	.	S	Bend	trans	-60.8	-10.9	176.8	-72.5	179.7	179.5	169.9	0	115
637	R	68.5	Low	71.2	Confident	71 Å²	71	89.5 Å²	89.5	27%	0.268	48%	0.479	S	S	.	.	S	Bend	trans	-142.7	150.7	172.3	76.5	-172.8	-162.4	-162.3	7.5	110	S631 Y635 L639 R656 A657 E658	S631-R637 PolarHBondContact OG-O 2.88Å; Y635-R637 WeakPolarHBondContact CB-O 3.48Å; Y635-R637 PolarHBondContact O-N 3.34Å; R637-L639 PolarHBondContact O-N 3.25Å; R637-R656 PolarHBondContact NH1-O 2.81Å; R637-R656 PolarHBondContact NH2-O 3.15Å; R637-A657 WeakPolarHBondContact CD-O 3.36Å; R637-A657 WeakPolarHBondContact CG-O 3.32Å; R637-E658 PolarHBondContact NH1-O 3.28Å
638	P	70.5	Confident	72	Confident	112 Å²	112	87.8 Å²	87.8	73%	0.727	48%	0.476	S	S	*	.			trans	-59.3	133	169.4	-20.9	33	0	0	0	111
639	L	71.1	Confident	72.9	Confident	13 Å²	13	86.6 Å²	86.6	7%	0.068	48%	0.48	C	S	.	.			trans	-116.4	127.9	174.5	-78.3	173.2	0	0	0	110.4	Y635 R637 A643 R644 A657	Y635-L639 HydrophobicContact CD1-CD1 4.39Å; Y635-L639 HydrophobicContact CD2-CD1 3.94Å; Y635-L639 HydrophobicContact CE2-CD1 4.24Å; Y635-L639 HydrophobicContact CG-CD1 4.02Å; R637-L639 PolarHBondContact O-N 3.25Å; L639-A643 HydrophobicContact CD2-CB 3.97Å; L639-R644 PolarHBondContact O-NH2 3.32Å; L639-A657 HydrophobicContact CD1-CB 3.92Å
640	S	78.7	Confident	73.3	Confident	72 Å²	72	88.6 Å²	88.6	50%	0.503	47%	0.473	S	S	.	.			trans	-59.5	154.5	171	69.2	0	0	0	0	110.8	H642 A643 R644	S640-H642 VanDerWaalsContact C-N 3.25Å; S640-H642 PolarHBondContact O-N 3.31Å; S640-A643 PolarHBondContact O-N 3.12Å; S640-A643 VanDerWaalsContact O-N 3.12Å; S640-A643 WeakPolarHBondContact OG-CB 3.38Å; S640-A643 PolarHBondContact OG-N 3.14Å; S640-A643 VanDerWaalsContact OG-N 3.13Å; S640-R644 PolarHBondContact O-N 3.27Å
641	Q	79.9	Confident	73.5	Confident	138 Å²	138	89.3 Å²	89.3	65%	0.645	48%	0.48	S	S	*	.	H	α-helix	trans	-59.9	-39	178.2	-173	173	-2.2	0	0	111.4	R644 M645	Q641-R644 WeakPolarHBondContact O-CB 3.41Å; Q641-R644 PolarHBondContact O-N 2.94Å; Q641-M645 HydrophobicContact CG-SD 4.47Å; Q641-M645 PolarHBondContact O-N 3.2Å
642	H	82.7	Confident	73.6	Confident	122 Å²	122	91.6 Å²	91.6	57%	0.565	49%	0.488	S	S	*	.	H	α-helix	trans	-58.6	-49.2	171.5	177.1	82.1	0	0	0	111.9	S640 R644 M645 S646	S640-H642 VanDerWaalsContact C-N 3.25Å; S640-H642 PolarHBondContact O-N 3.31Å; H642-R644 VanDerWaalsContact C-N 3.28Å; H642-R644 PolarHBondContact O-N 2.84Å; H642-M645 PolarHBondContact O-N 3.03Å; H642-S646 PolarHBondContact CE1-OG 3.4Å; H642-S646 VanDerWaalsContact CE1-OG 3.27Å; H642-S646 PolarHBondContact NE2-OG 2.88Å; H642-S646 VanDerWaalsContact NE2-OG 3.12Å; H642-S646 WeakPolarHBondContact O-CB 3.37Å; H642-S646 PolarHBondContact O-N 2.83Å; H642-S646 PolarHBondContact O-OG 2.82Å; H642-S646 VanDerWaalsContact O-OG 3.07Å
643	A	79.5	Confident	73.9	Confident	12 Å²	12	89.3 Å²	89.3	10%	0.099	47%	0.47	C	S	.	.	H	α-helix	trans	-61.4	-37.9	179.6	0	0	0	0	0	112	L639 S640 M647 Y655	L639-A643 HydrophobicContact CD2-CB 3.97Å; S640-A643 PolarHBondContact O-N 3.12Å; S640-A643 VanDerWaalsContact O-N 3.12Å; S640-A643 WeakPolarHBondContact OG-CB 3.38Å; S640-A643 PolarHBondContact OG-N 3.14Å; S640-A643 VanDerWaalsContact OG-N 3.13Å; A643-M647 VanDerWaalsContact O-CB 3.32Å; A643-M647 WeakPolarHBondContact O-CB 3.41Å; A643-M647 PolarHBondContact O-N 3.01Å; A643-Y655 HydrophobicContact CB-CD1 4.17Å
644	R	77.9	Confident	74.3	Confident	89 Å²	89	94.9 Å²	94.9	34%	0.336	48%	0.484	S	S	.	.	H	α-helix	trans	-61.4	-47.9	172.9	-107.7	178	-72.5	164.4	-3.2	112.8	L639 S640 Q641 H642 M647 M648	L639-R644 PolarHBondContact O-NH2 3.32Å; S640-R644 PolarHBondContact O-N 3.27Å; Q641-R644 WeakPolarHBondContact O-CB 3.41Å; Q641-R644 PolarHBondContact O-N 2.94Å; H642-R644 VanDerWaalsContact C-N 3.28Å; H642-R644 PolarHBondContact O-N 2.84Å; R644-M647 PolarHBondContact O-N 3.13Å; R644-M648 PolarHBondContact O-N 3.45Å
645	M	81.5	Confident	74.5	Confident	108 Å²	108	93.2 Å²	93.2	53%	0.532	46%	0.458	S	S	.	.	H	α-helix	trans	-65	-46.2	178.1	-75.9	177	149.3	0	0	111.7	Q641 H642 M647 M648 I649	Q641-M645 HydrophobicContact CG-SD 4.47Å; Q641-M645 PolarHBondContact O-N 3.2Å; H642-M645 PolarHBondContact O-N 3.03Å; M645-M647 VanDerWaalsContact C-N 3.26Å; M645-M647 PolarHBondContact O-N 2.87Å; M645-M648 WeakPolarHBondContact O-CB 3.46Å; M645-M648 PolarHBondContact O-N 3.25Å; M645-I649 WeakPolarHBondContact O-CG1 3.29Å; M645-I649 PolarHBondContact O-N 2.96Å; M645-I649 VanDerWaalsContact O-N 3.14Å
646	S	80.6	Confident	74.4	Confident	17 Å²	17	93.9 Å²	93.9	12%	0.119	46%	0.46	C	S	.	.	H	α-helix	trans	-60.9	-35.6	177.5	-60.9	0	0	0	0	111.8	H642 M648 I649 R650 Y655	H642-S646 PolarHBondContact CE1-OG 3.4Å; H642-S646 VanDerWaalsContact CE1-OG 3.27Å; H642-S646 PolarHBondContact NE2-OG 2.88Å; H642-S646 VanDerWaalsContact NE2-OG 3.12Å; H642-S646 WeakPolarHBondContact O-CB 3.37Å; H642-S646 PolarHBondContact O-N 2.83Å; H642-S646 PolarHBondContact O-OG 2.82Å; H642-S646 VanDerWaalsContact O-OG 3.07Å; S646-M648 VanDerWaalsContact C-N 3.3Å; S646-M648 PolarHBondContact O-N 3.47Å; S646-I649 PolarHBondContact O-N 2.81Å; S646-R650 CarbonylContact O-C 3.54Å; S646-R650 PolarHBondContact O-N 2.7Å; S646-Y655 VanDerWaalsContact CB-CZ 3.47Å
647	M	76.8	Confident	74.5	Confident	66 Å²	66	88 Å²	88	33%	0.325	44%	0.436	S	S	.	.	H	α-helix	trans	-65.1	-29.2	174.2	-147.9	172.8	165.4	0	0	113.6	A643 R644 M645 R656	A643-M647 VanDerWaalsContact O-CB 3.32Å; A643-M647 WeakPolarHBondContact O-CB 3.41Å; A643-M647 PolarHBondContact O-N 3.01Å; R644-M647 PolarHBondContact O-N 3.13Å; M645-M647 VanDerWaalsContact C-N 3.26Å; M645-M647 PolarHBondContact O-N 2.87Å; M647-R656 HydrophobicContact CE-CB 4.39Å; M647-R656 HydrophobicContact CE-CG 4.16Å
648	M	77.8	Confident	74.3	Confident	168 Å²	168	89.4 Å²	89.4	83%	0.828	45%	0.446	S	S	*	.	H	α-helix	trans	-78.1	-26.9	173.7	-67.7	174.9	167.8	0	0	113	R644 M645 S646	R644-M648 PolarHBondContact O-N 3.45Å; M645-M648 WeakPolarHBondContact O-CB 3.46Å; M645-M648 PolarHBondContact O-N 3.25Å; S646-M648 VanDerWaalsContact C-N 3.3Å; S646-M648 PolarHBondContact O-N 3.47Å
649	I	77.7	Confident	73.7	Confident	135 Å²	135	87.5 Å²	87.5	69%	0.692	43%	0.43	S	S	*	.	H	α-helix	trans	-91.2	-37.1	-177.9	-59.8	165.2	0	0	0	111.1	M645 S646	M645-I649 WeakPolarHBondContact O-CG1 3.29Å; M645-I649 PolarHBondContact O-N 2.96Å; M645-I649 VanDerWaalsContact O-N 3.14Å; S646-I649 PolarHBondContact O-N 2.81Å
650	R	71.6	Confident	72.9	Confident	155 Å²	155	93.6 Å²	93.6	59%	0.585	46%	0.461	S	S	*	.			trans	-145.6	126.3	176	-67	-174.8	-179.2	165.8	0.7	111.5	S646 E652	S646-R650 CarbonylContact O-C 3.54Å; S646-R650 PolarHBondContact O-N 2.7Å; R650-E652 HydrophobicContact CB-CG 4.06Å; R650-E652 WeakPolarHBondContact CD-OE1 3.35Å; R650-E652 IonicContact NH1-OE1 3.5Å; R650-E652 PolarHBondContact O-N 3.07Å
651	P	68.7	Low	71.8	Confident	111 Å²	111	96.8 Å²	96.8	72%	0.721	48%	0.477	S	S	*	.			trans	-76.4	43.4	175.7	33.4	-36.3	0	0	0	113
652	E	67.5	Low	70.6	Confident	65 Å²	65	96.2 Å²	96.2	30%	0.304	48%	0.478	S	S	.	.			trans	-64.6	134.5	175.1	-71.3	171	-158.7	0	0	110.5	R650 R654 Y655	R650-E652 HydrophobicContact CB-CG 4.06Å; R650-E652 WeakPolarHBondContact CD-OE1 3.35Å; R650-E652 IonicContact NH1-OE1 3.5Å; R650-E652 PolarHBondContact O-N 3.07Å; E652-R654 HydrophobicContact CB-CG 4.03Å; E652-R654 PolarHBondContact O-N 3.17Å; E652-R654 VanDerWaalsContact OE2-CD 3.3Å; E652-R654 WeakPolarHBondContact OE2-CD 3.47Å; E652-Y655 HydrophobicContact CB-CD2 3.89Å; E652-Y655 HydrophobicContact CB-CE2 3.95Å; E652-Y655 PolarHBondContact O-N 3.01Å; E652-Y655 WeakPolarHBondContact OE2-CE2 3.17Å
653	A	70.7	Confident	69	Low	70 Å²	70	93.8 Å²	93.8	58%	0.579	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-53.5	-31.4	-175.8	0	0	0	0	0	113.8	Y655 R656	A653-Y655 PolarHBondContact O-N 2.82Å; A653-Y655 VanDerWaalsContact O-N 3.17Å; A653-R656 PolarHBondContact O-N 3.48Å
654	R	72.6	Confident	67.6	Low	177 Å²	177	102.7 Å²	102.7	67%	0.668	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-56.4	-29.6	178.2	69.8	-175.5	-67.2	-173	0.4	114.4	E652	E652-R654 HydrophobicContact CB-CG 4.03Å; E652-R654 PolarHBondContact O-N 3.17Å; E652-R654 VanDerWaalsContact OE2-CD 3.3Å; E652-R654 WeakPolarHBondContact OE2-CD 3.47Å
655	Y	74.2	Confident	66.2	Low	28 Å²	28	104.5 Å²	104.5	11%	0.11	52%	0.524	C	S	.	.	G	3₁₀ helix	trans	-91.4	-14.6	-177.1	-55.1	-62.1	0	0	0	113.4	A643 S646 E652 A653 A657	A643-Y655 HydrophobicContact CB-CD1 4.17Å; S646-Y655 VanDerWaalsContact CB-CZ 3.47Å; E652-Y655 HydrophobicContact CB-CD2 3.89Å; E652-Y655 HydrophobicContact CB-CE2 3.95Å; E652-Y655 PolarHBondContact O-N 3.01Å; E652-Y655 WeakPolarHBondContact OE2-CE2 3.17Å; A653-Y655 PolarHBondContact O-N 2.82Å; A653-Y655 VanDerWaalsContact O-N 3.17Å; Y655-A657 PolarHBondContact O-N 2.75Å
656	R	68.6	Low	64.7	Low	110 Å²	110	107.1 Å²	107.1	42%	0.415	54%	0.54	S	S	.	.			trans	-59.3	133.3	-176.5	-69.1	-170.7	-179.2	-165.2	3.6	112.3	R637 M647 A653 E658	R637-R656 PolarHBondContact NH1-O 2.81Å; R637-R656 PolarHBondContact NH2-O 3.15Å; M647-R656 HydrophobicContact CE-CB 4.39Å; M647-R656 HydrophobicContact CE-CG 4.16Å; A653-R656 PolarHBondContact O-N 3.48Å; R656-E658 PolarHBondContact O-N 3.16Å; R656-E658 VanDerWaalsContact O-N 3.11Å
657	A	66.5	Low	63.2	Low	9 Å²	9	114.1 Å²	114.1	7%	0.074	57%	0.573	C	S	.	*	S	Bend	trans	-65.2	-10.3	-179.2	0	0	0	0	0	115.7	Y635 R637 L639 Y655	Y635-A657 HydrophobicContact CD1-CB 3.5Å; Y635-A657 HydrophobicContact CE1-CB 4.34Å; Y635-A657 HydrophobicContact CG-CB 3.94Å; R637-A657 WeakPolarHBondContact CD-O 3.36Å; R637-A657 WeakPolarHBondContact CG-O 3.32Å; L639-A657 HydrophobicContact CD1-CB 3.92Å; Y655-A657 PolarHBondContact O-N 2.75Å
658	E	65.8	Low	61.8	Low	100 Å²	100	114.7 Å²	114.7	47%	0.467	58%	0.582	S	S	.	*	S	Bend	trans	-83	161.9	-170.2	-69.4	163.4	158.1	0	0	111.7	R637 R656	R637-E658 PolarHBondContact NH1-O 3.28Å; R656-E658 PolarHBondContact O-N 3.16Å; R656-E658 VanDerWaalsContact O-N 3.11Å
659	N	56.9	Low	60.4	Low	73 Å²	73	112.5 Å²	112.5	39%	0.39	58%	0.583	S	S	.	*			trans	-72.5	134.9	172.8	-74.9	-13.9	0	0	0	108.1	R628 V661 L662	R628-N659 PolarHBondContact NH1-OD1 3.18Å; R628-N659 VanDerWaalsContact NH1-OD1 3.17Å; N659-V661 PolarHBondContact O-N 2.98Å; N659-V661 VanDerWaalsContact O-N 3.07Å; N659-L662 PolarHBondContact O-N 2.88Å
660	I	54.5	Low	58.8	Low	140 Å²	140	117.5 Å²	117.5	72%	0.718	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-58.1	-25.1	178.3	-63.1	169	0	0	0	111.8	L662	I660-L662 VanDerWaalsContact C-N 3.28Å; I660-L662 PolarHBondContact O-N 3.2Å
661	V	55.6	Low	57.4	Low	140 Å²	140	115.2 Å²	115.2	85%	0.848	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-74.3	-12.2	176.8	-163.7	0	0	0	0	113.4	N659	N659-V661 PolarHBondContact O-N 2.98Å; N659-V661 VanDerWaalsContact O-N 3.07Å
662	L	54.4	Low	56.3	Low	126 Å²	126	115.1 Å²	115.1	66%	0.66	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-113.8	29.5	179.8	-89.7	167.8	0	0	0	112.3	N659 I660	N659-L662 PolarHBondContact O-N 2.88Å; I660-L662 VanDerWaalsContact C-N 3.28Å; I660-L662 PolarHBondContact O-N 3.2Å
663	L	49	Very low	55.6	Low	70 Å²	70	123.4 Å²	123.4	37%	0.366	62%	0.622	S	S	.	*			trans	-76	121.7	156.9	-71.1	160.4	0	0	0	107.4	L665	L663-L665 HydrophobicContact CB-CG 3.87Å; L663-L665 HydrophobicContact CD1-CG 4.48Å; L663-L665 PolarHBondContact O-N 3.43Å
664	E	50.3	Low	54.6	Low	199 Å²	199	127 Å²	127	93%	0.93	63%	0.632	S	S	*	*			trans	-64.2	74	146.4	-72.9	177.4	167.4	0	0	106.9	D666	E664-D666 PolarHBondContact O-N 2.71Å
665	L	48	Very low	53.5	Low	127 Å²	127	127.1 Å²	127.1	67%	0.665	63%	0.633	S	S	*	*			trans	-63.7	110.7	153.3	-71.6	168.6	0	0	0	104.1	L663 M667	L663-L665 HydrophobicContact CB-CG 3.87Å; L663-L665 HydrophobicContact CD1-CG 4.48Å; L663-L665 PolarHBondContact O-N 3.43Å; L665-M667 PolarHBondContact O-N 3.38Å
666	D	50.8	Low	52.7	Low	163 Å²	163	134 Å²	134	87%	0.872	67%	0.667	S	S	*	*			trans	-51.4	93.7	155	-120.4	-17.1	0	0	0	105.3	E664 P668	E664-D666 PolarHBondContact O-N 2.71Å; D666-P668 WeakPolarHBondContact O-CD 3.13Å
667	M	49.8	Very low	52.2	Low	164 Å²	164	130.3 Å²	130.3	81%	0.808	66%	0.663	S	S	*	*			trans	-66.4	112.6	177.6	-78.1	-156.3	-51	0	0	104.6	L665 S669	L665-M667 PolarHBondContact O-N 3.38Å; M667-S669 PolarHBondContact O-N 3.32Å
668	P	46.6	Very low	51.7	Low	79 Å²	79	134.7 Å²	134.7	51%	0.513	69%	0.691	S	S	.	*			trans	-57	125	-178.1	22.6	-32.5	0	0	0	107.9	D666 R670 T671	D666-P668 WeakPolarHBondContact O-CD 3.13Å; P668-R670 PolarHBondContact O-N 3.21Å; P668-T671 HydrophobicContact CB-CG2 3.92Å; P668-T671 WeakPolarHBondContact CB-OG1 3.35Å; P668-T671 HydrophobicContact CG-CG2 4.34Å; P668-T671 WeakPolarHBondContact CG-OG1 3.11Å
669	S	49.5	Very low	51.4	Low	122 Å²	122	134.7 Å²	134.7	85%	0.853	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	83.6	176.8	42.9	0	0	0	0	109	M667	M667-S669 PolarHBondContact O-N 3.32Å
670	R	44.4	Very low	51.6	Low	239 Å²	239	135.7 Å²	135.7	90%	0.902	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	69.4	95.4	-165.1	-53.8	169.1	161.6	-160.5	-6.6	115.1	P668	P668-R670 PolarHBondContact O-N 3.21Å
671	T	40.5	Very low	52.3	Low	107 Å²	107	131.6 Å²	131.6	66%	0.656	70%	0.699	S	S	*	*			trans	-137.6	70.4	146.3	62	0	0	0	0	113.2	P668	P668-T671 HydrophobicContact CB-CG2 3.92Å; P668-T671 WeakPolarHBondContact CB-OG1 3.35Å; P668-T671 HydrophobicContact CG-CG2 4.34Å; P668-T671 WeakPolarHBondContact CG-OG1 3.11Å
672	T	45.6	Very low	53.2	Low	110 Å²	110	130.3 Å²	130.3	68%	0.675	69%	0.694	S	S	*	*			trans	-121.1	112	142.7	50.1	0	0	0	0	107.2	D674	T672-D674 PolarHBondContact O-N 2.82Å
673	R	53.8	Low	54.2	Low	239 Å²	239	133.2 Å²	133.2	90%	0.902	70%	0.701	S	S	*	*	S	Bend	trans	-55.1	126.7	137.6	-90.7	179.4	164.4	170.5	-6.1	105.1	Y675	R673-Y675 PolarHBondContact O-N 2.98Å; R673-Y675 VanDerWaalsContact O-N 3.16Å
674	D	50.4	Low	55.4	Low	145 Å²	145	133.9 Å²	133.9	78%	0.775	71%	0.708	S	S	*	*			trans	-1.8	99.2	173.8	-46.9	-50.4	0	0	0	113.1	T672 E676	T672-D674 PolarHBondContact O-N 2.82Å; D674-E676 PolarHBondContact O-N 2.85Å
675	Y	48.7	Very low	56.5	Low	179 Å²	179	127.6 Å²	127.6	70%	0.702	68%	0.678	S	S	*	*			trans	-69.4	84.4	163.2	177.4	-105	0	0	0	106.7	R673 G677 P678	R673-Y675 PolarHBondContact O-N 2.98Å; R673-Y675 VanDerWaalsContact O-N 3.16Å; Y675-G677 VanDerWaalsContact CE1-CA 3.42Å; Y675-G677 PolarHBondContact O-N 2.91Å; Y675-P678 WeakPolarHBondContact OH-CD 3.46Å
676	E	57.4	Low	57.8	Low	173 Å²	173	124.2 Å²	124.2	81%	0.808	67%	0.669	S	S	*	*			trans	-58.6	97.6	153.4	-68.4	-173.8	160.9	0	0	105.8	D674	D674-E676 PolarHBondContact O-N 2.85Å
677	G	57.8	Low	59	Low	33 Å²	33	119.2 Å²	119.2	34%	0.34	65%	0.65	S	S	.	*			trans	-50.5	142.2	165.7	0	0	0	0	0	108.3	Y675 A679	Y675-G677 VanDerWaalsContact CE1-CA 3.42Å; Y675-G677 PolarHBondContact O-N 2.91Å; G677-A679 PolarHBondContact O-N 2.81Å
678	P	56.3	Low	60	Low	101 Å²	101	114.6 Å²	114.6	66%	0.656	63%	0.628	S	S	*	*	S	Bend	trans	-49.8	116.7	-172.4	21.9	-34.1	0	0	0	108.4	Y675 I680	Y675-P678 WeakPolarHBondContact OH-CD 3.46Å; P678-I680 PolarHBondContact O-N 2.71Å
679	A	59.8	Low	61.4	Low	99 Å²	99	114 Å²	114	82%	0.818	62%	0.621	S	S	*	*			trans	-47.2	107	-166	0	0	0	0	0	109.1	G677 A681	G677-A679 PolarHBondContact O-N 2.81Å; A679-A681 PolarHBondContact O-N 3.4Å
680	I	61.1	Low	62.6	Low	94 Å²	94	110.9 Å²	110.9	48%	0.482	60%	0.603	S	S	.	*			trans	-58.3	114.9	-170.4	-61.6	175	0	0	0	104.9	P678 V684 Q685	P678-I680 PolarHBondContact O-N 2.71Å; I680-V684 HydrophobicContact CG2-CB 3.78Å; I680-V684 HydrophobicContact CG2-CG1 3.69Å; I680-Q685 HydrophobicContact CB-CB 4.37Å; I680-Q685 HydrophobicContact CG2-CB 3.91Å
681	A	69.5	Low	63.8	Low	54 Å²	54	102.3 Å²	102.3	45%	0.446	58%	0.583	S	S	.	*			trans	-49.6	131.5	-171.2	0	0	0	0	0	107.7	A679 K683 V684 Q685	A679-A681 PolarHBondContact O-N 3.4Å; A681-K683 CarbonylContact O-C 3.51Å; A681-K683 PolarHBondContact O-N 2.91Å; A681-V684 HydrophobicContact CB-CG2 4.22Å; A681-V684 WeakPolarHBondContact O-CA 3.35Å; A681-V684 WeakPolarHBondContact O-CB 2.96Å; A681-V684 PolarHBondContact O-N 2.88Å; A681-Q685 PolarHBondContact O-N 2.62Å
682	P	73.6	Confident	65.2	Low	114 Å²	114	97.6 Å²	97.6	74%	0.74	55%	0.554	S	S	*	*	H	α-helix	trans	-54.7	-25.7	-167.7	-32.3	36.2	0	0	0	114.3	A686	P682-A686 WeakPolarHBondContact O-CB 3.38Å; P682-A686 PolarHBondContact O-N 3.33Å
683	K	76.1	Confident	66.2	Low	186 Å²	186	98.4 Å²	98.4	81%	0.809	55%	0.55	S	S	*	*	H	α-helix	trans	-65.5	-41.4	169.2	-68.2	-174.7	174.6	-176.4	0	114.5	A681 A687	A681-K683 CarbonylContact O-C 3.51Å; A681-K683 PolarHBondContact O-N 2.91Å; K683-A687 WeakPolarHBondContact O-CB 3.45Å; K683-A687 PolarHBondContact O-N 3.36Å
684	V	73.3	Confident	66.5	Low	85 Å²	85	90 Å²	90	52%	0.515	52%	0.523	S	S	.	.	H	α-helix	trans	-71.5	-40.5	176	179.2	0	0	0	0	110.3	I680 A681 A687 L688	I680-V684 HydrophobicContact CG2-CB 3.78Å; I680-V684 HydrophobicContact CG2-CG1 3.69Å; A681-V684 HydrophobicContact CB-CG2 4.22Å; A681-V684 WeakPolarHBondContact O-CA 3.35Å; A681-V684 WeakPolarHBondContact O-CB 2.96Å; A681-V684 PolarHBondContact O-N 2.88Å; V684-A687 PolarHBondContact O-N 2.88Å; V684-L688 WeakPolarHBondContact O-CB 3.49Å; V684-L688 PolarHBondContact O-N 2.68Å
685	Q	74	Confident	66.8	Low	66 Å²	66	92.4 Å²	92.4	31%	0.308	53%	0.529	S	S	.	.	H	α-helix	trans	-63.8	-49.4	174.6	-175.2	58.5	40.8	0	0	110.5	I680 A681 A687 L688 D689	I680-Q685 HydrophobicContact CB-CB 4.37Å; I680-Q685 HydrophobicContact CG2-CB 3.91Å; A681-Q685 PolarHBondContact O-N 2.62Å; Q685-A687 VanDerWaalsContact C-N 3.31Å; Q685-A687 PolarHBondContact O-N 3.35Å; Q685-L688 WeakPolarHBondContact O-CB 3.46Å; Q685-L688 PolarHBondContact O-N 2.82Å; Q685-L688 VanDerWaalsContact O-N 3.13Å; Q685-D689 WeakPolarHBondContact CG-OD2 3.29Å; Q685-D689 VanDerWaalsContact NE2-CG 3.29Å; Q685-D689 PolarHBondContact NE2-OD1 2.62Å; Q685-D689 PolarHBondContact NE2-OD2 2.96Å; Q685-D689 WeakPolarHBondContact O-CB 3.4Å; Q685-D689 VanDerWaalsContact O-CG 3.26Å; Q685-D689 PolarHBondContact O-N 2.92Å
686	A	75.7	Confident	66.8	Low	56 Å²	56	91.4 Å²	91.4	46%	0.463	54%	0.536	S	S	.	.	H	α-helix	trans	-62.6	-33.6	175.7	0	0	0	0	0	113.4	P682 A690	P682-A686 WeakPolarHBondContact O-CB 3.38Å; P682-A686 PolarHBondContact O-N 3.33Å; A686-A690 WeakPolarHBondContact O-CB 3.5Å; A686-A690 PolarHBondContact O-N 3.4Å
687	A	75.4	Confident	66.2	Low	58 Å²	58	89.6 Å²	89.6	48%	0.479	53%	0.528	S	S	.	.	H	α-helix	trans	-71	-36.1	173.6	0	0	0	0	0	112.3	K683 V684 Q685 A691	K683-A687 WeakPolarHBondContact O-CB 3.45Å; K683-A687 PolarHBondContact O-N 3.36Å; V684-A687 PolarHBondContact O-N 2.88Å; Q685-A687 VanDerWaalsContact C-N 3.31Å; Q685-A687 PolarHBondContact O-N 3.35Å; A687-A691 VanDerWaalsContact O-CB 3.23Å; A687-A691 WeakPolarHBondContact O-CB 3.26Å; A687-A691 PolarHBondContact O-N 3.06Å
688	L	70.9	Confident	65.5	Low	67 Å²	67	95 Å²	95	35%	0.351	55%	0.547	S	S	.	.	H	α-helix	trans	-66.9	-47.3	173.5	-158.6	85	0	0	0	110.2	V684 Q685 A690 A691 L692	V684-L688 WeakPolarHBondContact O-CB 3.49Å; V684-L688 PolarHBondContact O-N 2.68Å; Q685-L688 WeakPolarHBondContact O-CB 3.46Å; Q685-L688 PolarHBondContact O-N 2.82Å; Q685-L688 VanDerWaalsContact O-N 3.13Å; L688-A690 PolarHBondContact O-N 3.33Å; L688-A691 CarbonylContact O-C 3.56Å; L688-A691 PolarHBondContact O-N 3.3Å; L688-L692 HydrophobicContact CD2-CD1 4.14Å; L688-L692 HydrophobicContact CG-CD1 3.95Å; L688-L692 VanDerWaalsContact O-CB 3.22Å; L688-L692 WeakPolarHBondContact O-CB 3.09Å; L688-L692 WeakPolarHBondContact O-CG 3.47Å; L688-L692 PolarHBondContact O-N 2.91Å
689	D	74.9	Confident	64.7	Low	66 Å²	66	98.4 Å²	98.4	35%	0.353	56%	0.555	S	S	.	*	H	α-helix	trans	-64.1	-38.6	178.6	-66.5	-31	0	0	0	111.7	Q685 L692 Q693	Q685-D689 WeakPolarHBondContact CG-OD2 3.29Å; Q685-D689 VanDerWaalsContact NE2-CG 3.29Å; Q685-D689 PolarHBondContact NE2-OD1 2.62Å; Q685-D689 PolarHBondContact NE2-OD2 2.96Å; Q685-D689 WeakPolarHBondContact O-CB 3.4Å; Q685-D689 VanDerWaalsContact O-CG 3.26Å; Q685-D689 PolarHBondContact O-N 2.92Å; D689-L692 CarbonylContact O-C 3.6Å; D689-L692 PolarHBondContact O-N 2.9Å; D689-Q693 WeakPolarHBondContact O-CG 3.43Å; D689-Q693 PolarHBondContact O-N 2.99Å
690	A	74.9	Confident	63.7	Low	58 Å²	58	99.2 Å²	99.2	48%	0.479	55%	0.549	S	S	.	.	H	α-helix	trans	-69.6	-37.3	173.6	0	0	0	0	0	112.9	A686 L688 L692 Q693	A686-A690 WeakPolarHBondContact O-CB 3.5Å; A686-A690 PolarHBondContact O-N 3.4Å; L688-A690 PolarHBondContact O-N 3.33Å; A690-L692 PolarHBondContact O-N 3.34Å; A690-Q693 PolarHBondContact O-N 3.18Å
691	A	70.3	Confident	62.6	Low	59 Å²	59	99.7 Å²	99.7	49%	0.488	55%	0.552	S	S	.	*	H	α-helix	trans	-71.9	-19.4	172.9	0	0	0	0	0	113.1	A687 L688	A687-A691 VanDerWaalsContact O-CB 3.23Å; A687-A691 WeakPolarHBondContact O-CB 3.26Å; A687-A691 PolarHBondContact O-N 3.06Å; L688-A691 CarbonylContact O-C 3.56Å; L688-A691 PolarHBondContact O-N 3.3Å
692	L	70	Confident	61.4	Low	7 Å²	7	100 Å²	100	4%	0.037	56%	0.555	C	S	.	*	T	Hydrogen-bonded Turn	trans	-102.1	7.1	176.2	-68.1	175.5	0	0	0	113.2	R578 K581 L582 L585 L688 D689 A690	R578-L692 HydrophobicContact CG-CB 4.2Å; R578-L692 HydrophobicContact CG-CD1 4.21Å; R578-L692 HydrophobicContact CG-CD2 4.32Å; R578-L692 HydrophobicContact CG-CG 4.49Å; K581-L692 HydrophobicContact CB-CD2 3.72Å; L582-L692 HydrophobicContact CB-CD2 4.16Å; L585-L692 HydrophobicContact CD1-CD2 4.11Å; L688-L692 HydrophobicContact CD2-CD1 4.14Å; L688-L692 HydrophobicContact CG-CD1 3.95Å; L688-L692 VanDerWaalsContact O-CB 3.22Å; L688-L692 WeakPolarHBondContact O-CB 3.09Å; L688-L692 WeakPolarHBondContact O-CG 3.47Å; L688-L692 PolarHBondContact O-N 2.91Å; D689-L692 CarbonylContact O-C 3.6Å; D689-L692 PolarHBondContact O-N 2.9Å; A690-L692 PolarHBondContact O-N 3.34Å
693	Q	66.9	Low	60.2	Low	128 Å²	128	98.6 Å²	98.6	60%	0.598	55%	0.548	S	S	*	.	S	Bend	trans	-75.2	146.4	166.1	-87.1	167.2	-6.7	0	0	109.5	K581 D689 A690	K581-Q693 PolarHBondContact NZ-O 3.02Å; K581-Q693 VanDerWaalsContact NZ-O 3.16Å; D689-Q693 WeakPolarHBondContact O-CG 3.43Å; D689-Q693 PolarHBondContact O-N 2.99Å; A690-Q693 PolarHBondContact O-N 3.18Å
694	D	59	Low	58.5	Low	61 Å²	61	93.1 Å²	93.1	33%	0.326	53%	0.533	S	S	.	.			trans	-86.3	132.6	170.4	-59.5	-62.1	0	0	0	107.9	K581 D696	K581-D694 IonicContact NZ-OD1 2.98Å; K581-D694 PolarHBondContact NZ-OD1 3.11Å; D694-D696 PolarHBondContact O-N 3.42Å; D694-D696 VanDerWaalsContact O-N 3.07Å
695	E	57.3	Low	56.9	Low	196 Å²	196	97.8 Å²	97.8	92%	0.916	55%	0.547	S	S	*	.	S	Bend	trans	-70.5	102.6	173.8	-70.4	-171.2	155.7	0	0	108.6	E697	E695-E697 PolarHBondContact O-N 3.3Å
696	D	47.7	Very low	55.4	Low	158 Å²	158	103.1 Å²	103.1	85%	0.845	57%	0.572	S	S	*	*			trans	30	69.1	167	-66	-28.1	0	0	0	116.3	D694 I698	D694-D696 PolarHBondContact O-N 3.42Å; D694-D696 VanDerWaalsContact O-N 3.07Å; D696-I698 PolarHBondContact O-N 3.06Å; D696-I698 VanDerWaalsContact O-N 3.15Å
697	E	46.5	Very low	53.7	Low	136 Å²	136	105 Å²	105	64%	0.636	58%	0.582	S	S	*	*			trans	-65.2	115.1	157.9	-109.5	-169.9	171.8	0	0	108.9	E695 Q699	E695-E697 PolarHBondContact O-N 3.3Å; E697-Q699 PolarHBondContact O-N 3.2Å
698	I	41.7	Very low	51.8	Low	145 Å²	145	108.1 Å²	108.1	74%	0.744	60%	0.595	S	S	*	*			trans	-60.6	110	-179.2	-60.3	169.9	0	0	0	108.3	D696 V700	D696-I698 PolarHBondContact O-N 3.06Å; D696-I698 VanDerWaalsContact O-N 3.15Å; I698-V700 HydrophobicContact CG2-CG2 4.01Å; I698-V700 PolarHBondContact O-N 3.35Å; I698-V700 VanDerWaalsContact C-N 3.27Å
699	Q	39.7	Very low	50.3	Low	174 Å²	174	109.5 Å²	109.5	81%	0.813	62%	0.616	S	S	*	*			trans	-63	90.4	167.1	-73.4	-175.2	-12.3	0	0	109.2	E697 D701	E697-Q699 PolarHBondContact O-N 3.2Å; Q699-D701 PolarHBondContact O-N 3.13Å
700	V	39.4	Very low	48.6	Very low	115 Å²	115	114 Å²	114	70%	0.697	64%	0.64	S	S	*	*			trans	-74.3	84.7	171.2	-176	0	0	0	0	107.6	I698 A702	I698-V700 HydrophobicContact CG2-CG2 4.01Å; I698-V700 PolarHBondContact O-N 3.35Å; I698-V700 VanDerWaalsContact C-N 3.27Å; V700-A702 PolarHBondContact O-N 3.1Å
701	D	37.4	Very low	46.6	Very low	104 Å²	104	121.1 Å²	121.1	56%	0.556	66%	0.66	S	S	*	*			trans	-64.8	95.4	177.9	-169.8	-9.9	0	0	0	110.3	Q699 S703 S704	Q699-D701 PolarHBondContact O-N 3.13Å; D701-S703 PolarHBondContact O-N 3.33Å; D701-S703 VanDerWaalsContact O-N 3.13Å; D701-S703 VanDerWaalsContact OD1-CB 3.25Å; D701-S703 WeakPolarHBondContact OD1-CB 3.15Å; D701-S703 PolarHBondContact OD1-N 2.85Å; D701-S703 PolarHBondContact OD1-OG 2.89Å; D701-S703 PolarHBondContact OD2-OG 2.91Å; D701-S704 WeakPolarHBondContact O-CB 3.34Å; D701-S704 PolarHBondContact O-OG 3.27Å; D701-S704 VanDerWaalsContact O-N 3.11Å; D701-S704 PolarHBondContact O-N 2.93Å
702	A	44	Very low	45	Very low	62 Å²	62	128.3 Å²	128.3	51%	0.512	68%	0.68	S	S	.	*	G	3₁₀ helix	trans	-65.3	-12.3	-176.4	0	0	0	0	0	113.3	V700 S704 F705	V700-A702 PolarHBondContact O-N 3.1Å; A702-S704 PolarHBondContact O-N 2.8Å; A702-S704 VanDerWaalsContact O-N 3.14Å; A702-F705 PolarHBondContact O-N 2.92Å
703	S	49.1	Very low	43.5	Very low	83 Å²	83	133.3 Å²	133.3	58%	0.58	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-58.4	-22.8	170	69.8	0	0	0	0	112.7	D701 F705	D701-S703 PolarHBondContact O-N 3.33Å; D701-S703 VanDerWaalsContact O-N 3.13Å; D701-S703 VanDerWaalsContact OD1-CB 3.25Å; D701-S703 WeakPolarHBondContact OD1-CB 3.15Å; D701-S703 PolarHBondContact OD1-N 2.85Å; D701-S703 PolarHBondContact OD1-OG 2.89Å; D701-S703 PolarHBondContact OD2-OG 2.91Å; S703-F705 PolarHBondContact O-N 3.44Å
704	S	39.6	Very low	42.2	Very low	72 Å²	72	136.9 Å²	136.9	50%	0.503	73%	0.73	S	S	.	*	G	3₁₀ helix	trans	-61.9	-26	177.9	-55.8	0	0	0	0	114.1	D701 A702 E706 S707	D701-S704 WeakPolarHBondContact O-CB 3.34Å; D701-S704 PolarHBondContact O-OG 3.27Å; D701-S704 VanDerWaalsContact O-N 3.11Å; D701-S704 PolarHBondContact O-N 2.93Å; A702-S704 PolarHBondContact O-N 2.8Å; A702-S704 VanDerWaalsContact O-N 3.14Å; S704-E706 VanDerWaalsContact C-N 3.34Å; S704-E706 PolarHBondContact O-N 3.16Å; S704-S707 PolarHBondContact O-N 3.5Å; S704-S707 PolarHBondContact O-OG 3.3Å
705	F	40.5	Very low	41.1	Very low	183 Å²	183	138.6 Å²	138.6	80%	0.803	75%	0.752	S	S	*	*	G	3₁₀ helix	trans	-74.6	-15.1	-166.3	-115.8	-88.5	0	0	0	115.3	A702 S703	A702-F705 PolarHBondContact O-N 2.92Å; S703-F705 PolarHBondContact O-N 3.44Å
706	E	42.1	Very low	40.1	Very low	177 Å²	177	140.7 Å²	140.7	83%	0.827	75%	0.752	S	S	*	*	G	3₁₀ helix	trans	-86.4	-7.7	178.3	-62.6	-155.1	131.8	0	0	114.1	S704	S704-E706 VanDerWaalsContact C-N 3.34Å; S704-E706 PolarHBondContact O-N 3.16Å
707	S	40.6	Very low	39.6	Very low	96 Å²	96	139.2 Å²	139.2	67%	0.671	75%	0.751	S	S	*	*	S	Bend	trans	-89.1	-10.6	-165.3	67.1	0	0	0	0	116.8	S704	S704-S707 PolarHBondContact O-N 3.5Å; S704-S707 PolarHBondContact O-OG 3.3Å
708	T	36.1	Very low	39.4	Very low	124 Å²	124	142.6 Å²	142.6	76%	0.761	76%	0.764	S	S	*	*	S	Bend	trans	-121	-6	-167.9	50.2	0	0	0	0	116.8	N710	T708-N710 PolarHBondContact O-N 3.15Å
709	A	38	Very low	39.2	Very low	96 Å²	96	141.8 Å²	141.8	79%	0.793	77%	0.77	S	S	*	*	S	Bend	trans	-80.1	-9.5	-170.5	0	0	0	0	0	116.3
710	N	38.9	Very low	39.4	Very low	161 Å²	161	137.3 Å²	137.3	86%	0.861	77%	0.772	S	S	*	*	S	Bend	trans	-133.1	61.1	-162.9	-145.2	-1.8	0	0	0	115.2	T708	T708-N710 PolarHBondContact O-N 3.15Å
711	K	34.8	Very low	39.3	Very low	206 Å²	206	143.5 Å²	143.5	90%	0.896	78%	0.782	S	S	*	*			trans	-154.3	57.3	174.4	-117.7	168.4	-168.7	171.7	0	115.6
712	K	36	Very low	39.5	Very low	210 Å²	210	148 Å²	148	91%	0.913	80%	0.797	S	S	*	*			trans	-141.8	99.8	165.4	-81.8	-174.1	178.6	172.5	0	113
713	S	38.7	Very low	39.4	Very low	112 Å²	112	150.6 Å²	150.6	78%	0.783	81%	0.811	S	S	*	*			trans	177	160.4	136.3	54.1	0	0	0	0	112.7
714	K	38.1	Very low	39.1	Very low	204 Å²	204	149.8 Å²	149.8	89%	0.887	82%	0.816	S	S	*	*			trans	71.6	75.5	170.5	-61.7	-178.3	-179.8	174.1	0	117.6
715	A	36.7	Very low	39.2	Very low	97 Å²	97	151.8 Å²	151.8	80%	0.802	83%	0.83	S	S	*	*			trans	-78.3	140.8	152.7	0	0	0	0	0	111.6
716	R	37.5	Very low	39.1	Very low	239 Å²	239	148.1 Å²	148.1	90%	0.902	83%	0.827	S	S	*	*			trans	-152.2	111.8	155.4	-96.2	-177.2	92.2	-179.8	10.2	108.2
717	P	37.1	Very low	39	Very low	128 Å²	128	145 Å²	145	83%	0.831	83%	0.825	S	S	*	*			trans	-86.9	146.8	176.1	33.4	-32.3	0	0	0	111.5
718	K	40.7	Very low	38.9	Very low	207 Å²	207	146 Å²	146	90%	0.9	83%	0.832	S	S	*	*			trans	-132.7	137.2	156.8	-89.8	-169.4	169.1	-174.6	0	109.3
719	S	38	Very low	39	Very low	127 Å²	127	145.9 Å²	145.9	89%	0.888	84%	0.836	S	S	*	*			trans	-77.7	138.5	-170.4	51.5	0	0	0	0	114.1
720	G	43.2	Very low	39.1	Very low	81 Å²	81	147 Å²	147	84%	0.835	84%	0.838	S	S	*	*			trans	-138.9	144.6	162.1	0	0	0	0	0	109.1
721	R	39.1	Very low	39	Very low	244 Å²	244	142.7 Å²	142.7	92%	0.921	83%	0.832	S	S	*	*			trans	-128.3	157.5	-159.9	-167.7	176.8	172.5	-168.9	-2.6	111.1
722	K	41.2	Very low	39.3	Very low	198 Å²	198	139.5 Å²	139.5	86%	0.861	83%	0.83	S	S	*	*			trans	94.3	150.6	177.4	-60.4	177.2	177.9	-176.3	0	115.5
723	S	42.2	Very low	39.5	Very low	117 Å²	117	135.7 Å²	135.7	82%	0.818	83%	0.826	S	S	*	*			cis	174.1	137.4	-41.5	47.1	0	0	0	0	110.2
724	G	41.4	Very low	39.8	Very low	66 Å²	66	135.5 Å²	135.5	68%	0.68	83%	0.832	S	S	*	*			trans	123.7	109.6	174	0	0	0	0	0	112.2
725	S	41.3	Very low	40	Very low	115 Å²	115	130.4 Å²	130.4	80%	0.804	82%	0.822	S	S	*	*				69.8	134.3	79.4	68.5	0	0	0	0	114.1
726	S	39.9	Very low	40.3	Very low	105 Å²	105	134.6 Å²	134.6	73%	0.734	83%	0.825	S	S	*	*			cis	179.9	170.1	-15.9	41.6	0	0	0	0	108.4
727	S	40.3	Very low	40.5	Very low	111 Å²	111	130.8 Å²	130.8	78%	0.776	82%	0.822	S	S	*	*			trans	73.5	135.7	177.6	76.1	0	0	0	0	116.7
728	S	37.6	Very low	40.5	Very low	117 Å²	117	134.9 Å²	134.9	82%	0.818	82%	0.822	S	S	*	*			cis	109	96	5.8	80.2	0	0	0	0	116.2
729	S	39.1	Very low	40.6	Very low	123 Å²	123	131.3 Å²	131.3	86%	0.86	82%	0.82	S	S	*	*			trans	-153.3	-171.6	158.5	62.6	0	0	0	0	110.5
730	S	38.2	Very low	40.5	Very low	118 Å²	118	133.6 Å²	133.6	83%	0.825	82%	0.817	S	S	*	*				-166.2	140.1	-125.5	51.4	0	0	0	0	115.8
731	G	37.4	Very low	40.3	Very low	71 Å²	71	135 Å²	135	73%	0.732	81%	0.813	S	S	*	*			trans	119.6	138.3	176	0	0	0	0	0	111.6
732	T	41.7	Very low	40.4	Very low	140 Å²	140	134.5 Å²	134.5	86%	0.859	81%	0.811	S	S	*	*			cis	-161.7	141	7.1	-16.9	0	0	0	0	109.1
733	P	40.1	Very low	40.4	Very low	129 Å²	129	128.6 Å²	128.6	84%	0.838	81%	0.807	S	S	*	*			trans	-108.8	150.9	169.4	36.9	-29	0	0	0	113
734	A	45	Very low	40.5	Very low	109 Å²	109	131.6 Å²	131.6	90%	0.901	81%	0.813	S	S	*	*			trans	-134.4	148.5	172.2	0	0	0	0	0	111
735	S	41.9	Very low	40.6	Very low	97 Å²	97	134.8 Å²	134.8	68%	0.678	82%	0.819	S	S	*	*			trans	-121.5	153.1	-162.7	53.4	0	0	0	0	114.2
736	Q	43.1	Very low	41	Very low	185 Å²	185	135 Å²	135	86%	0.864	82%	0.817	S	S	*	*			trans	-175.7	100.8	149.2	-101.4	152.2	65.7	0	0	108.2
737	L	41.7	Very low	41.1	Very low	158 Å²	158	143.4 Å²	143.4	83%	0.827	84%	0.841	S	S	*	*				91.2	121.3	86.2	-102.6	89.2	0	0	0	114
738	Y	36.8	Very low	41.1	Very low	215 Å²	215	145 Å²	145	84%	0.843	84%	0.844	S	S	*	*			trans	-83.1	-179.5	177.5	-69.7	-97.7	0	0	0	112.5
739	P	43.5	Very low	41.3	Very low	132 Å²	132	146.5 Å²	146.5	86%	0.857	85%	0.845	S	S	*	*				-142.8	157.8	90.8	37.3	-22.1	0	0	0	116.4
740	Q	36.5	Very low	41.4	Very low	175 Å²	175	147.8 Å²	147.8	82%	0.818	85%	0.845	S	S	*	*			trans	-106.2	168.5	168.8	-95.9	-169.3	-25.6	0	0	112.1
741	S	38.4	Very low	41.6	Very low	109 Å²	109	149.5 Å²	149.5	76%	0.762	85%	0.846	S	S	*	*			trans	83.3	139	161.8	82.3	0	0	0	0	116
742	R	41.9	Very low	41.9	Very low	234 Å²	234	154.4 Å²	154.4	88%	0.883	85%	0.853	S	S	*	*			cis	-154.5	150.6	36	-70.3	174.8	161	166	-8.5	111.1
743	G	39.7	Very low	41.9	Very low	75 Å²	75	155.4 Å²	155.4	77%	0.773	85%	0.852	S	S	*	*			trans	-81.1	163.2	165.5	0	0	0	0	0	113
744	L	45.7	Very low	42	Very low	180 Å²	180	157.3 Å²	157.3	94%	0.942	85%	0.853	S	S	*	*			trans	-137.2	148.4	160.8	-101.3	165.8	0	0	0	109.8
745	V	42.6	Very low	41.8	Very low	133 Å²	133	161 Å²	161	81%	0.806	85%	0.85	S	S	*	*			trans	-85.7	153.2	-162.6	166.7	0	0	0	0	111.2
746	P	49	Very low	41.8	Very low	118 Å²	118	166.3 Å²	166.3	77%	0.766	86%	0.864	S	S	*	*			trans	-87.5	173.1	-160.7	35.4	-38.2	0	0	0	115.3
747	K	42.1	Very low	41.6	Very low	282 Å²	282	164.6 Å²	164.6	100%	1.226	86%	0.864	S	S	*	*			trans	-129.5	0	149.3	-109.9	-168.6	176.8	-175.7	0	109

Retrieved 747 of 747 residues in 925.2 ms (Link to these results)

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