KIF17_MOUSE Loading...

Isoform 2 of Kinesin-like protein KIF17

Canonical isoform description: Together with RAB23 and IFT57, it is required for the localization of specific G protein-coupled receptors, such as dopamime receptor DRD1, to primary cilia to primary cilia (By similarity). In association with the Apba1-containing complex (LIN-10-LIN-2-LIN-7 complex), transports vesicles containing N-methyl-D-aspartate (NMDA) receptor subunit NR2B along microtubules.

AlphaFold DB (Q3V365), UniProt , Accession Q99PW8-2 (canonical: Q99PW8), Species MOUSE (Mus musculus, Mouse), Gene Kif17, Length 511 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	50.8	Low	88.2	Confident	210 Å²	210	49.7 Å²	49.7	100%	1.034	29%	0.285	S	S	*	.				0	138.5	0	-60.5	174.9	-174.9	0	0	109.3
2	A	65.3	Low	88.9	Confident	93 Å²	93	45.7 Å²	45.7	77%	0.769	26%	0.262	S	S	*	.			trans	-77.9	160.5	174.8	0	0	0	0	0	111.5
3	S	82.2	Confident	89.5	Confident	64 Å²	64	44.8 Å²	44.8	45%	0.448	25%	0.252	S	S	.	.			trans	-108.8	128.2	171.9	56.8	0	0	0	0	110.8	N337	S3-N337 CarbonylContact C-O 3.58Å; S3-N337 WeakPolarHBondContact CA-O 3.49Å; S3-N337 WeakPolarHBondContact CB-O 3.35Å
4	E	91.8	Very high	89.9	Confident	64 Å²	64	46.6 Å²	46.6	30%	0.299	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	149.3	176.1	-157.7	-179.8	172.7	0	0	110.2	K7 K336 N337 P339	E4-K7 WeakPolarHBondContact OE1-CE 3.14Å; E4-K7 IonicContact OE1-NZ 2.87Å; E4-K336 CarbonylContact O-C 3.58Å; E4-K336 WeakPolarHBondContact O-CA 3.29Å; E4-N337 PolarHBondContact N-O 3.38Å; E4-N337 PolarHBondContact O-N 2.81Å; E4-P339 HydrophobicContact CB-CG 4.17Å
5	S	94.1	Very high	90.1	Very high	35 Å²	35	45.9 Å²	45.9	25%	0.245	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	146.9	165.7	-105.7	0	0	0	0	110.2	K7 K333 I335 K336	S5-K7 PolarHBondContact O-N 3.38Å; S5-K333 VanDerWaalsContact CB-O 3.32Å; S5-K333 WeakPolarHBondContact CB-O 3.22Å; S5-K333 PolarHBondContact OG-O 2.96Å; S5-I335 WeakPolarHBondContact CA-O 3.36Å; S5-K336 PolarHBondContact OG-NZ 3.49Å
6	V	96.1	Very high	90.1	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-59.1	123.9	160	174.1	0	0	0	0	108	V8 T306 K333 I335	V6-V8 HydrophobicContact CG1-CG2 4.39Å; V6-T306 HydrophobicContact CG1-CG2 3.94Å; V6-T306 HydrophobicContact CG2-CG2 4.49Å; V6-K333 WeakPolarHBondContact O-CA 3.28Å; V6-I335 HydrophobicContact CB-CB 4.3Å; V6-I335 HydrophobicContact CG2-CB 3.71Å; V6-I335 HydrophobicContact CG2-CD1 4.47Å; V6-I335 HydrophobicContact CG2-CG2 3.75Å; V6-I335 PolarHBondContact N-O 3.04Å
7	K	97.3	Very high	90.1	Very high	68 Å²	68	52.9 Å²	52.9	30%	0.296	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	140.8	176.8	-63.9	-176.8	-175	175	0	109.4	E4 S5 I71 T306 L307 M308	E4-K7 WeakPolarHBondContact OE1-CE 3.14Å; E4-K7 IonicContact OE1-NZ 2.87Å; S5-K7 PolarHBondContact O-N 3.38Å; K7-I71 HydrophobicContact CD-CD1 4.11Å; K7-T306 PolarHBondContact N-O 3.49Å; K7-L307 HydrophobicContact CB-CD1 4.08Å; K7-L307 CarbonylContact O-C 3.59Å; K7-L307 WeakPolarHBondContact O-CA 3.18Å; K7-M308 PolarHBondContact O-N 3.36Å
8	V	98	Very high	89.9	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	126.3	-177.3	-175.9	0	0	0	0	109.6	V6 F54 D55 M308 A329 A332 K333	V6-V8 HydrophobicContact CG1-CG2 4.39Å; V8-F54 HydrophobicContact CB-CD1 4.32Å; V8-F54 HydrophobicContact CG1-CD1 3.86Å; V8-F54 HydrophobicContact CG1-CE1 4.19Å; V8-F54 WeakPolarHBondContact O-CB 3.39Å; V8-D55 PolarHBondContact N-OD2 3.24Å; V8-D55 PolarHBondContact O-N 3.27Å; V8-M308 WeakPolarHBondContact CA-O 3.43Å; V8-M308 HydrophobicContact CB-CB 4.45Å; V8-M308 HydrophobicContact CG1-CB 4.22Å; V8-M308 HydrophobicContact CG1-CG 4.33Å; V8-M308 HydrophobicContact CG1-SD 4.09Å; V8-M308 HydrophobicContact CG2-CB 4.07Å; V8-M308 HydrophobicContact CG2-SD 4.48Å; V8-A329 HydrophobicContact CG1-CB 3.71Å; V8-A332 HydrophobicContact CG2-CB 4Å; V8-K333 HydrophobicContact CB-CB 4.11Å; V8-K333 HydrophobicContact CG2-CB 3.61Å
9	V	98.1	Very high	90	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	150.8	172.3	-57.1	0	0	0	0	111.3	G56 Y58 I71 L307 M308 V309 A310	V9-G56 VanDerWaalsContact CA-O 3.23Å; V9-G56 WeakPolarHBondContact CA-O 3.25Å; V9-G56 WeakPolarHBondContact CB-O 3.34Å; V9-Y58 HydrophobicContact CB-CD2 4.29Å; V9-Y58 HydrophobicContact CB-CE2 3.85Å; V9-Y58 HydrophobicContact CG1-CE2 4.13Å; V9-Y58 HydrophobicContact CG2-CD2 4.45Å; V9-Y58 HydrophobicContact CG2-CE2 4.05Å; V9-I71 HydrophobicContact CG1-CB 4.27Å; V9-I71 HydrophobicContact CG1-CG1 3.87Å; V9-I71 HydrophobicContact CG1-CG2 3.9Å; V9-I71 HydrophobicContact CG2-CG2 4.29Å; V9-L307 HydrophobicContact CG1-CD1 4.28Å; V9-L307 HydrophobicContact CG2-CD1 4.25Å; V9-M308 PolarHBondContact N-O 3.48Å; V9-V309 HydrophobicContact CG2-CB 4.36Å; V9-V309 HydrophobicContact CG2-CG1 4.23Å; V9-V309 HydrophobicContact CG2-CG2 4Å; V9-A310 PolarHBondContact O-N 3.19Å
10	V	98.2	Very high	90.2	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	140.3	173.6	-69.5	0	0	0	0	111	C37 F54 G56 A57 Y58 A310 L312 L326	V10-C37 HydrophobicContact CG2-CB 3.95Å; V10-F54 HydrophobicContact CB-CD2 4.3Å; V10-F54 HydrophobicContact CB-CE2 4.45Å; V10-F54 HydrophobicContact CG1-CD1 4.31Å; V10-F54 HydrophobicContact CG1-CD2 3.57Å; V10-F54 HydrophobicContact CG1-CE1 4.19Å; V10-F54 HydrophobicContact CG1-CE2 3.41Å; V10-F54 VanDerWaalsContact CG1-CE2 3.41Å; V10-F54 HydrophobicContact CG1-CG 4.02Å; V10-F54 HydrophobicContact CG1-CZ 3.75Å; V10-F54 HydrophobicContact CG2-CD2 3.72Å; V10-F54 HydrophobicContact CG2-CE2 4.16Å; V10-F54 HydrophobicContact CG2-CG 4.41Å; V10-G56 PolarHBondContact N-O 3.42Å; V10-G56 VanDerWaalsContact N-O 3.13Å; V10-A57 HydrophobicContact CG2-CB 3.56Å; V10-Y58 WeakPolarHBondContact O-CD2 3.42Å; V10-Y58 PolarHBondContact O-N 3.22Å; V10-A310 CarbonylContact C-O 3.56Å; V10-A310 WeakPolarHBondContact CA-O 3.35Å; V10-A310 HydrophobicContact CG1-CB 3.98Å; V10-L312 HydrophobicContact CB-CD1 4.05Å; V10-L312 HydrophobicContact CG1-CD1 4.29Å; V10-L326 HydrophobicContact CG1-CD2 3.96Å
11	R	97.8	Very high	90.3	Very high	13 Å²	13	65.1 Å²	65.1	5%	0.049	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	111.3	172.7	-168.9	-174.2	-165.9	171.9	11	110.3	Y58 H62 T64 I67 T100 A310 C311 L312	R11-Y58 WeakPolarHBondContact CA-O 3.43Å; R11-H62 PolarHBondContact NH2-O 2.9Å; R11-T64 PolarHBondContact NH1-OG1 3.09Å; R11-T64 PolarHBondContact NH2-OG1 2.99Å; R11-I67 VanDerWaalsContact CD-CD1 3.49Å; R11-I67 HydrophobicContact CG-CD1 3.9Å; R11-I67 VanDerWaalsContact NE-CD1 3.33Å; R11-T100 WeakPolarHBondContact CD-OG1 3.5Å; R11-T100 PolarHBondContact NH1-OG1 3.2Å; R11-A310 PolarHBondContact N-O 2.98Å; R11-C311 CarbonylContact O-C 3.55Å; R11-C311 WeakPolarHBondContact O-CA 3.27Å; R11-L312 PolarHBondContact O-N 2.91Å
12	C	97.6	Very high	92.2	Very high	1 Å²	1	59.8 Å²	59.8	1%	0.007	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	121.6	169.7	-168.5	0	0	0	0	109.9	V28 Y58 Y59 L312	C12-V28 HydrophobicContact CB-CG1 4.2Å; C12-Y58 PolarHBondContact N-O 2.93Å; C12-Y59 HydrophobicContact CB-CD2 3.79Å; C12-Y59 HydrophobicContact CB-CE2 4.15Å; C12-Y59 CarbonylContact O-C 3.29Å; C12-L312 HydrophobicContact CB-CB 4.34Å
13	R	95.6	Very high	93.6	Very high	34 Å²	34	59.7 Å²	59.7	13%	0.128	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-81.2	162.9	176.8	64.6	146.3	173.9	74.5	3.6	112.2	N16 E19 G94 S95 L312 S313 P314	R13-N16 PolarHBondContact NH2-ND2 2.84Å; R13-E19 IonicContact CZ-OE1 3.98Å; R13-E19 IonicContact CZ-OE2 2.74Å; R13-E19 IonicContact NH1-OE1 3.64Å; R13-E19 IonicContact NH1-OE2 3.93Å; R13-E19 PolarHBondContact NH1-OE2 3.23Å; R13-E19 IonicContact NH2-OE1 3.22Å; R13-E19 PolarHBondContact NH2-OE1 3.26Å; R13-E19 IonicContact NH2-OE2 3.59Å; R13-E19 PolarHBondContact NH2-OE2 3.38Å; R13-G94 PolarHBondContact NE-O 2.95Å; R13-G94 PolarHBondContact NH2-O 3.21Å; R13-G94 VanDerWaalsContact NH2-O 3.13Å; R13-S95 WeakPolarHBondContact CG-O 3.49Å; R13-L312 PolarHBondContact N-O 2.85Å; R13-S313 PolarHBondContact NH2-OG 3.23Å; R13-P314 VanDerWaalsContact O-CD 3.28Å; R13-P314 WeakPolarHBondContact O-CD 3.29Å; R13-P314 WeakPolarHBondContact O-CG 3.44Å
14	P	95.1	Very high	94.1	Very high	70 Å²	70	57.5 Å²	57.5	46%	0.455	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-56.4	155.4	165.1	-21.6	30.8	0	0	0	112.7	I60	P14-I60 HydrophobicContact CB-CB 4.4Å; P14-I60 HydrophobicContact CG-CB 4.05Å
15	M	93.8	Very high	94.2	Very high	37 Å²	37	60.6 Å²	60.6	18%	0.182	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-53	139.4	168.6	-76.7	-74.8	-167.4	0	0	111.4	E19 R20 C24 Q25 P314 A315	M15-E19 HydrophobicContact SD-CB 3.7Å; M15-E19 HydrophobicContact SD-CG 4.42Å; M15-R20 HydrophobicContact CB-CG 4.38Å; M15-R20 PolarHBondContact O-NH1 3.17Å; M15-R20 PolarHBondContact O-NH2 3.25Å; M15-C24 HydrophobicContact CE-CB 4.3Å; M15-C24 WeakPolarHBondContact CE-O 3.46Å; M15-Q25 WeakPolarHBondContact CE-O 3.48Å; M15-P314 HydrophobicContact CE-CB 4.36Å; M15-P314 HydrophobicContact CE-CG 4.28Å; M15-P314 HydrophobicContact CG-CG 3.94Å; M15-P314 HydrophobicContact SD-CG 3.83Å; M15-A315 HydrophobicContact CE-CB 4.05Å; M15-A315 HydrophobicContact SD-CB 3.91Å
16	N	89.9	Confident	94.2	Very high	55 Å²	55	61.7 Å²	61.7	29%	0.294	30%	0.299	S	S	.	.			trans	-88.2	177.7	175.4	77.6	48	0	0	0	111.9	R13 R18 E19 R20	R13-N16 PolarHBondContact NH2-ND2 2.84Å; N16-R18 WeakPolarHBondContact OD1-CA 3.43Å; N16-R18 WeakPolarHBondContact OD1-CB 3.36Å; N16-R18 PolarHBondContact OD1-N 3.36Å; N16-E19 VanDerWaalsContact CG-CD 3.49Å; N16-E19 VanDerWaalsContact CG-OE2 3.27Å; N16-E19 PolarHBondContact N-OE2 2.82Å; N16-E19 PolarHBondContact ND2-OE1 2.93Å; N16-E19 VanDerWaalsContact ND2-OE1 3.14Å; N16-E19 PolarHBondContact ND2-OE2 3.42Å; N16-E19 VanDerWaalsContact ND2-OE2 3.15Å; N16-E19 PolarHBondContact OD1-N 2.87Å; N16-R20 PolarHBondContact O-N 3.19Å
17	K	89.3	Confident	94.2	Very high	155 Å²	155	62.2 Å²	62.2	67%	0.674	30%	0.301	S	S	*	.	H	α-helix	trans	-62.3	-51.1	-179.5	-69.7	-167.5	178.5	-173.7	0	112.3	E19 R20 E21	K17-E19 VanDerWaalsContact C-N 3.31Å; K17-E19 PolarHBondContact O-N 3.15Å; K17-R20 WeakPolarHBondContact O-CB 3.22Å; K17-R20 PolarHBondContact O-N 3.26Å; K17-R20 VanDerWaalsContact O-N 3.1Å; K17-E21 WeakPolarHBondContact CB-OE1 3.48Å; K17-E21 VanDerWaalsContact O-CG 3.27Å; K17-E21 WeakPolarHBondContact O-CG 3.28Å; K17-E21 PolarHBondContact O-N 2.97Å
18	R	87.5	Confident	94.2	Very high	177 Å²	177	59 Å²	59	67%	0.668	29%	0.287	S	S	*	.	H	α-helix	trans	-59.3	-37.4	178.8	-178	-179.7	174.9	-168	-1.9	113	N16 E21 L22	N16-R18 WeakPolarHBondContact OD1-CA 3.43Å; N16-R18 WeakPolarHBondContact OD1-CB 3.36Å; N16-R18 PolarHBondContact OD1-N 3.36Å; R18-E21 WeakPolarHBondContact CA-OE2 3.32Å; R18-E21 PolarHBondContact O-N 2.96Å; R18-L22 HydrophobicContact CG-CD1 3.96Å; R18-L22 HydrophobicContact CG-CG 4.47Å; R18-L22 WeakPolarHBondContact O-CB 3.24Å; R18-L22 VanDerWaalsContact O-CG 3.23Å; R18-L22 WeakPolarHBondContact O-CG 3.45Å; R18-L22 PolarHBondContact O-N 3.14Å
19	E	92	Very high	94.1	Very high	5 Å²	5	62.8 Å²	62.8	2%	0.023	31%	0.311	C	S	.	.	H	α-helix	trans	-67.9	-38	176.9	-70.3	160.6	172.5	0	0	111.6	R13 M15 N16 K17 S23 C24 S313 A315 N318	R13-E19 IonicContact CZ-OE1 3.98Å; R13-E19 IonicContact CZ-OE2 2.74Å; R13-E19 IonicContact NH1-OE1 3.64Å; R13-E19 IonicContact NH1-OE2 3.93Å; R13-E19 PolarHBondContact NH1-OE2 3.23Å; R13-E19 IonicContact NH2-OE1 3.22Å; R13-E19 PolarHBondContact NH2-OE1 3.26Å; R13-E19 IonicContact NH2-OE2 3.59Å; R13-E19 PolarHBondContact NH2-OE2 3.38Å; M15-E19 HydrophobicContact SD-CB 3.7Å; M15-E19 HydrophobicContact SD-CG 4.42Å; N16-E19 VanDerWaalsContact CG-CD 3.49Å; N16-E19 VanDerWaalsContact CG-OE2 3.27Å; N16-E19 PolarHBondContact N-OE2 2.82Å; N16-E19 PolarHBondContact ND2-OE1 2.93Å; N16-E19 VanDerWaalsContact ND2-OE1 3.14Å; N16-E19 PolarHBondContact ND2-OE2 3.42Å; N16-E19 VanDerWaalsContact ND2-OE2 3.15Å; N16-E19 PolarHBondContact OD1-N 2.87Å; K17-E19 VanDerWaalsContact C-N 3.31Å; K17-E19 PolarHBondContact O-N 3.15Å; E19-S23 PolarHBondContact O-N 3.02Å; E19-C24 HydrophobicContact CB-CB 4.23Å; E19-C24 VanDerWaalsContact O-CB 3.3Å; E19-C24 WeakPolarHBondContact O-CB 3.41Å; E19-C24 PolarHBondContact O-N 2.93Å; E19-S313 PolarHBondContact OE1-OG 3.34Å; E19-A315 HydrophobicContact CB-CB 4.29Å; E19-A315 HydrophobicContact CG-CB 3.78Å; E19-N318 PolarHBondContact OE1-ND2 3.42Å; E19-N318 VanDerWaalsContact OE1-ND2 3.15Å
20	R	92.8	Very high	94.1	Very high	145 Å²	145	64.2 Å²	64.2	55%	0.547	32%	0.319	S	S	.	.	H	α-helix	trans	-68.7	-40.6	170.7	-76	-174.2	-72.2	-85.9	-6.7	112.9	M15 N16 K17 L22 S23	M15-R20 HydrophobicContact CB-CG 4.38Å; M15-R20 PolarHBondContact O-NH1 3.17Å; M15-R20 PolarHBondContact O-NH2 3.25Å; N16-R20 PolarHBondContact O-N 3.19Å; K17-R20 WeakPolarHBondContact O-CB 3.22Å; K17-R20 PolarHBondContact O-N 3.26Å; K17-R20 VanDerWaalsContact O-N 3.1Å; R20-L22 PolarHBondContact O-N 2.9Å; R20-S23 PolarHBondContact O-N 3.39Å
21	E	93.1	Very high	94	Very high	142 Å²	142	66.7 Å²	66.7	66%	0.664	33%	0.333	S	S	*	.	H	α-helix	trans	-64.2	-27.8	177.1	-70.5	152.9	-162.6	0	0	112.5	K17 R18	K17-E21 WeakPolarHBondContact CB-OE1 3.48Å; K17-E21 VanDerWaalsContact O-CG 3.27Å; K17-E21 WeakPolarHBondContact O-CG 3.28Å; K17-E21 PolarHBondContact O-N 2.97Å; R18-E21 WeakPolarHBondContact CA-OE2 3.32Å; R18-E21 PolarHBondContact O-N 2.96Å
22	L	91.4	Very high	93.8	Very high	97 Å²	97	68 Å²	68	51%	0.508	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	3.9	173.1	-68.2	172.1	0	0	0	113.6	R18 R20 C24	R18-L22 HydrophobicContact CG-CD1 3.96Å; R18-L22 HydrophobicContact CG-CG 4.47Å; R18-L22 WeakPolarHBondContact O-CB 3.24Å; R18-L22 VanDerWaalsContact O-CG 3.23Å; R18-L22 WeakPolarHBondContact O-CG 3.45Å; R18-L22 PolarHBondContact O-N 3.14Å; R20-L22 PolarHBondContact O-N 2.9Å; L22-C24 PolarHBondContact O-N 3.3Å
23	S	93.5	Very high	93.5	Very high	92 Å²	92	72.9 Å²	72.9	64%	0.643	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	30.9	-176.5	-59.6	0	0	0	0	114.7	E19 R20 Q25	E19-S23 PolarHBondContact O-N 3.02Å; R20-S23 PolarHBondContact O-N 3.39Å; S23-Q25 PolarHBondContact O-NE2 2.91Å
24	C	92.9	Very high	93.5	Very high	18 Å²	18	78.8 Å²	78.8	12%	0.122	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-61.5	134.3	-179.4	-72.3	0	0	0	0	112.6	M15 E19 L22 A315 D316 N317	M15-C24 HydrophobicContact CE-CB 4.3Å; M15-C24 WeakPolarHBondContact CE-O 3.46Å; E19-C24 HydrophobicContact CB-CB 4.23Å; E19-C24 VanDerWaalsContact O-CB 3.3Å; E19-C24 WeakPolarHBondContact O-CB 3.41Å; E19-C24 PolarHBondContact O-N 2.93Å; L22-C24 PolarHBondContact O-N 3.3Å; C24-A315 HydrophobicContact CB-CB 3.94Å; C24-D316 WeakPolarHBondContact CB-OD1 3.35Å; C24-D316 PolarHBondContact SG-OD1 3.2Å; C24-N317 PolarHBondContact SG-ND2 2.81Å
25	Q	93.8	Very high	93.5	Very high	128 Å²	128	75.8 Å²	75.8	60%	0.598	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-82.7	152.1	174.6	-56.4	-52.2	-60.7	0	0	111.3	M15 S23 D316	M15-Q25 WeakPolarHBondContact CE-O 3.48Å; S23-Q25 PolarHBondContact O-NE2 2.91Å; Q25-D316 PolarHBondContact N-OD2 3.41Å; Q25-D316 PolarHBondContact O-N 3.03Å
26	S	95	Very high	93.6	Very high	59 Å²	59	75 Å²	75	41%	0.413	38%	0.384	S	S	.	.	B	Isolated β-bridge	trans	-81.9	116.9	174.9	-162.3	0	0	0	0	110	V28 P314	S26-V28 PolarHBondContact OG-O 3.4Å; S26-P314 CarbonylContact C-O 3.19Å; S26-P314 WeakPolarHBondContact CA-O 3.49Å
27	V	96.1	Very high	94	Very high	10 Å²	10	72.3 Å²	72.3	6%	0.061	37%	0.37	C	S	.	.			trans	-103	-4.4	177.5	-63	0	0	0	0	113.3	I39 Q40 P42 P314 D316 Y319	V27-I39 HydrophobicContact CG2-CG1 4.29Å; V27-I39 CarbonylContact O-C 3.55Å; V27-I39 VanDerWaalsContact O-CA 3.29Å; V27-I39 WeakPolarHBondContact O-CA 3.24Å; V27-Q40 PolarHBondContact O-N 2.99Å; V27-P42 HydrophobicContact CG1-CB 4.28Å; V27-P42 HydrophobicContact CG1-CG 4.47Å; V27-P314 WeakPolarHBondContact CG2-O 3.44Å; V27-P314 PolarHBondContact N-O 2.98Å; V27-D316 HydrophobicContact CG1-CB 3.8Å; V27-Y319 HydrophobicContact CG2-CD2 4.37Å
28	V	97	Very high	94.4	Very high	0 Å²	0	67 Å²	67	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	134.5	177	-177.4	0	0	0	0	110	C12 S26 V30 F38 I39 Y59 T322	C12-V28 HydrophobicContact CB-CG1 4.2Å; S26-V28 PolarHBondContact OG-O 3.4Å; V28-V30 HydrophobicContact CG1-CG2 4.4Å; V28-F38 WeakPolarHBondContact CA-O 3.47Å; V28-I39 HydrophobicContact CG2-CG1 4.24Å; V28-Y59 PolarHBondContact O-OH 3.46Å; V28-T322 HydrophobicContact CG2-CG2 3.74Å
29	T	96.1	Very high	94.9	Very high	80 Å²	80	58.6 Å²	58.6	49%	0.491	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	155	165.2	56.4	0	0	0	0	110.1	F38	T29-F38 PolarHBondContact N-O 3.11Å; T29-F38 PolarHBondContact O-N 3.45Å
30	V	96.8	Very high	95.1	Very high	30 Å²	30	60.8 Å²	60.8	18%	0.182	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	139.4	-171.9	165.8	0	0	0	0	109.8	V28 Q36 C37 A57 Y59	V28-V30 HydrophobicContact CG1-CG2 4.4Å; V30-Q36 WeakPolarHBondContact CA-O 3.3Å; V30-C37 HydrophobicContact CG2-CB 4.2Å; V30-A57 HydrophobicContact CG1-CB 3.73Å; V30-Y59 HydrophobicContact CB-CD2 3.85Å; V30-Y59 HydrophobicContact CB-CG 4.07Å; V30-Y59 HydrophobicContact CG2-CD2 3.76Å; V30-Y59 HydrophobicContact CG2-CG 4.43Å
31	D	96.1	Very high	95.1	Very high	52 Å²	52	55.4 Å²	55.4	28%	0.278	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	95.7	165.5	173.9	-15.1	0	0	0	107	A33 R34 G35 Q36 F38	D31-A33 VanDerWaalsContact C-N 3.3Å; D31-A33 PolarHBondContact O-N 3.37Å; D31-A33 PolarHBondContact OD1-N 2.94Å; D31-R34 PolarHBondContact O-N 3.33Å; D31-R34 PolarHBondContact OD1-N 2.85Å; D31-R34 WeakPolarHBondContact OD2-CD 3.41Å; D31-R34 WeakPolarHBondContact OD2-CG 3.5Å; D31-G35 PolarHBondContact O-N 2.9Å; D31-G35 VanDerWaalsContact O-N 3.16Å; D31-Q36 HydrophobicContact CB-CB 4.25Å; D31-Q36 PolarHBondContact N-O 2.91Å; D31-Q36 PolarHBondContact O-N 3.09Å; D31-F38 HydrophobicContact CB-CE2 4.34Å
32	S	93.9	Very high	95	Very high	42 Å²	42	52 Å²	52	29%	0.294	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-62.7	-37.7	-177.5	-50.2	0	0	0	0	112	R34 G35 A57 H62	S32-R34 PolarHBondContact O-N 3.4Å; S32-G35 PolarHBondContact O-N 2.87Å; S32-G35 VanDerWaalsContact O-N 3.1Å; S32-A57 WeakPolarHBondContact CA-O 3.43Å; S32-A57 VanDerWaalsContact CB-O 3.23Å; S32-A57 WeakPolarHBondContact CB-O 3.45Å; S32-A57 PolarHBondContact OG-O 3.33Å; S32-A57 VanDerWaalsContact OG-O 3.09Å; S32-H62 PolarHBondContact OG-CE1 3.41Å; S32-H62 PolarHBondContact OG-NE2 3.08Å
33	A	92.8	Very high	94.9	Very high	103 Å²	103	50.9 Å²	50.9	85%	0.851	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-65	-22.2	-177.3	0	0	0	0	0	112.9	D31	D31-A33 VanDerWaalsContact C-N 3.3Å; D31-A33 PolarHBondContact O-N 3.37Å; D31-A33 PolarHBondContact OD1-N 2.94Å
34	R	93.9	Very high	94.7	Very high	158 Å²	158	47.7 Å²	47.7	60%	0.596	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-109	0.8	175.9	-56.3	179.3	83.8	-166.6	5.7	113.7	D31 S32 Q36	D31-R34 PolarHBondContact O-N 3.33Å; D31-R34 PolarHBondContact OD1-N 2.85Å; D31-R34 WeakPolarHBondContact OD2-CD 3.41Å; D31-R34 WeakPolarHBondContact OD2-CG 3.5Å; S32-R34 PolarHBondContact O-N 3.4Å; R34-Q36 HydrophobicContact CB-CB 4.33Å; R34-Q36 HydrophobicContact CB-CG 3.85Å; R34-Q36 PolarHBondContact O-N 3.17Å
35	G	95.3	Very high	94.2	Very high	7 Å²	7	50.5 Å²	50.5	7%	0.072	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.7	27.3	-172.4	0	0	0	0	0	113.4	D31 S32 T53 F54	D31-G35 PolarHBondContact O-N 2.9Å; D31-G35 VanDerWaalsContact O-N 3.16Å; S32-G35 PolarHBondContact O-N 2.87Å; S32-G35 VanDerWaalsContact O-N 3.1Å; G35-T53 WeakPolarHBondContact O-CA 3.4Å; G35-F54 PolarHBondContact O-N 3.29Å
36	Q	97.4	Very high	93.9	Very high	19 Å²	19	52.4 Å²	52.4	9%	0.089	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	140.8	-171.9	-71.3	178	2.8	0	0	111.9	V30 D31 R34 F38 F52 T53	V30-Q36 WeakPolarHBondContact CA-O 3.3Å; D31-Q36 HydrophobicContact CB-CB 4.25Å; D31-Q36 PolarHBondContact N-O 2.91Å; D31-Q36 PolarHBondContact O-N 3.09Å; R34-Q36 HydrophobicContact CB-CB 4.33Å; R34-Q36 HydrophobicContact CB-CG 3.85Å; R34-Q36 PolarHBondContact O-N 3.17Å; Q36-F38 HydrophobicContact CB-CE2 3.82Å; Q36-F38 HydrophobicContact CB-CZ 4.09Å; Q36-F52 WeakPolarHBondContact CA-O 3.34Å; Q36-T53 HydrophobicContact CG-CG2 3.99Å
37	C	97.4	Very high	93.7	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	132.2	177.4	-179.7	0	0	0	0	109.3	V10 V30 Q51 F52 F54 L326	V10-C37 HydrophobicContact CG2-CB 3.95Å; V30-C37 HydrophobicContact CG2-CB 4.2Å; C37-Q51 CarbonylContact O-C 3.54Å; C37-F52 PolarHBondContact N-O 3.05Å; C37-F52 PolarHBondContact O-N 3.48Å; C37-F54 HydrophobicContact CB-CD2 4.42Å; C37-F54 HydrophobicContact CB-CE2 4.23Å; C37-L326 HydrophobicContact CB-CD2 4.39Å
38	F	97.4	Very high	93.6	Very high	44 Å²	44	58.4 Å²	58.4	19%	0.193	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	138.2	-174.5	-58.3	-93	0	0	0	108.8	V28 T29 D31 Q36 P49 Q51	V28-F38 WeakPolarHBondContact CA-O 3.47Å; T29-F38 PolarHBondContact N-O 3.11Å; T29-F38 PolarHBondContact O-N 3.45Å; D31-F38 HydrophobicContact CB-CE2 4.34Å; Q36-F38 HydrophobicContact CB-CE2 3.82Å; Q36-F38 HydrophobicContact CB-CZ 4.09Å; F38-P49 HydrophobicContact CB-CB 4.22Å; F38-Q51 HydrophobicContact CD1-CB 3.77Å; F38-Q51 HydrophobicContact CD1-CG 3.96Å; F38-Q51 HydrophobicContact CE1-CB 3.74Å; F38-Q51 HydrophobicContact CE1-CG 3.52Å; F38-Q51 HydrophobicContact CZ-CG 4.07Å
39	I	97.2	Very high	93.4	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	117.3	174.5	-164	-176.1	0	0	0	112	V27 V28 K50 F52 Y319 T322 L323 L326	V27-I39 HydrophobicContact CG2-CG1 4.29Å; V27-I39 CarbonylContact O-C 3.55Å; V27-I39 VanDerWaalsContact O-CA 3.29Å; V27-I39 WeakPolarHBondContact O-CA 3.24Å; V28-I39 HydrophobicContact CG2-CG1 4.24Å; I39-K50 HydrophobicContact CG2-CB 3.92Å; I39-K50 PolarHBondContact N-O 3.44Å; I39-K50 PolarHBondContact O-N 3.23Å; I39-F52 HydrophobicContact CG2-CE2 4.11Å; I39-Y319 HydrophobicContact CD1-CD2 3.5Å; I39-Y319 VanDerWaalsContact CD1-CD2 3.5Å; I39-Y319 HydrophobicContact CD1-CE2 3.71Å; I39-Y319 HydrophobicContact CD1-CG 4.44Å; I39-Y319 HydrophobicContact CG1-CD2 3.76Å; I39-Y319 HydrophobicContact CG1-CE2 3.75Å; I39-Y319 HydrophobicContact CG2-CE2 4.4Å; I39-T322 HydrophobicContact CD1-CG2 3.66Å; I39-L323 HydrophobicContact CD1-CB 4.2Å; I39-L323 HydrophobicContact CG2-CD1 4.07Å; I39-L326 HydrophobicContact CB-CD1 4.04Å; I39-L326 HydrophobicContact CD1-CD1 4.24Å; I39-L326 HydrophobicContact CG2-CD1 3.87Å
40	Q	96.2	Very high	93.5	Very high	50 Å²	50	60.5 Å²	60.5	23%	0.234	37%	0.367	C	S	.	.			trans	-78.9	141.6	178.3	-172.6	53.7	43.3	0	0	111	V27 P42 A44 A45 E47 Y319	V27-Q40 PolarHBondContact O-N 2.99Å; Q40-P42 WeakPolarHBondContact O-CD 3.3Å; Q40-A44 PolarHBondContact NE2-O 3.47Å; Q40-A44 VanDerWaalsContact NE2-O 3.15Å; Q40-A45 PolarHBondContact NE2-O 2.95Å; Q40-E47 PolarHBondContact NE2-O 2.65Å; Q40-E47 PolarHBondContact OE1-O 2.79Å; Q40-Y319 WeakPolarHBondContact O-CD2 3.29Å; Q40-Y319 WeakPolarHBondContact O-CE2 3.38Å
41	N	94.6	Very high	93.5	Very high	32 Å²	32	64 Å²	64	17%	0.171	38%	0.381	C	S	.	.			trans	-82.3	113	174.5	-173.3	-3.4	0	0	0	110.1	G43 A44 E47 Y319	N41-G43 PolarHBondContact O-N 2.91Å; N41-G43 PolarHBondContact OD1-N 3.47Å; N41-G43 VanDerWaalsContact OD1-N 3.13Å; N41-A44 HydrophobicContact CB-CB 4.26Å; N41-A44 WeakPolarHBondContact ND2-CB 3.39Å; N41-A44 CarbonylContact O-C 3.53Å; N41-A44 PolarHBondContact O-N 3.28Å; N41-A44 VanDerWaalsContact O-N 3.13Å; N41-A44 VanDerWaalsContact O-O 3.11Å; N41-E47 PolarHBondContact ND2-OE2 2.93Å; N41-Y319 HydrophobicContact CB-CE2 4.43Å
42	P	90.6	Very high	93.6	Very high	70 Å²	70	62.8 Å²	62.8	46%	0.455	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-21.7	179.3	28.4	-34.6	0	0	0	112.7	V27 Q40 D316 Y319	V27-P42 HydrophobicContact CG1-CB 4.28Å; V27-P42 HydrophobicContact CG1-CG 4.47Å; Q40-P42 WeakPolarHBondContact O-CD 3.3Å; P42-D316 HydrophobicContact CB-CB 4.24Å; P42-Y319 HydrophobicContact CG-CD2 4.49Å; P42-Y319 HydrophobicContact CG-CG 4.13Å
43	G	89.3	Confident	93.8	Very high	74 Å²	74	63.2 Å²	63.2	76%	0.763	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-3.6	174.1	0	0	0	0	0	114.6	N41	N41-G43 PolarHBondContact O-N 2.91Å; N41-G43 PolarHBondContact OD1-N 3.47Å; N41-G43 VanDerWaalsContact OD1-N 3.13Å
44	A	89.7	Confident	94	Very high	25 Å²	25	59 Å²	59	21%	0.207	34%	0.337	C	S	.	.			trans	-151.6	81.2	176.1	0	0	0	0	0	109.3	Q40 N41 D46 E47	Q40-A44 PolarHBondContact NE2-O 3.47Å; Q40-A44 VanDerWaalsContact NE2-O 3.15Å; N41-A44 HydrophobicContact CB-CB 4.26Å; N41-A44 WeakPolarHBondContact ND2-CB 3.39Å; N41-A44 CarbonylContact O-C 3.53Å; N41-A44 PolarHBondContact O-N 3.28Å; N41-A44 VanDerWaalsContact O-N 3.13Å; N41-A44 VanDerWaalsContact O-O 3.11Å; A44-D46 PolarHBondContact O-N 2.97Å; A44-E47 HydrophobicContact CB-CB 4.18Å; A44-E47 HydrophobicContact CB-CG 3.71Å; A44-E47 PolarHBondContact O-N 2.92Å
45	A	81.6	Confident	94.2	Very high	78 Å²	78	55.4 Å²	55.4	65%	0.645	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-27.3	-178.6	0	0	0	0	0	112.8	Q40	Q40-A45 PolarHBondContact NE2-O 2.95Å
46	D	87.3	Confident	94.3	Very high	167 Å²	167	55.6 Å²	55.6	89%	0.893	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-12.3	179	-44.7	-71.3	0	0	0	113.5	A44	A44-D46 PolarHBondContact O-N 2.97Å
47	E	92	Very high	94.2	Very high	86 Å²	86	54.8 Å²	54.8	40%	0.402	33%	0.328	S	S	.	.	S	Bend	trans	-71.9	136.2	169.1	-77.1	-174.8	164.4	0	0	109.8	Q40 N41 A44 K50	Q40-E47 PolarHBondContact NE2-O 2.65Å; Q40-E47 PolarHBondContact OE1-O 2.79Å; N41-E47 PolarHBondContact ND2-OE2 2.93Å; A44-E47 HydrophobicContact CB-CB 4.18Å; A44-E47 HydrophobicContact CB-CG 3.71Å; A44-E47 PolarHBondContact O-N 2.92Å; E47-K50 IonicContact OE2-NZ 3.18Å; E47-K50 PolarHBondContact OE2-NZ 2.79Å
48	P	92.3	Very high	94.2	Very high	109 Å²	109	55 Å²	55	71%	0.708	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-62.6	144.9	171.5	26.9	-34.1	0	0	0	111.1
49	P	94.2	Very high	94.1	Very high	57 Å²	57	55 Å²	55	37%	0.37	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-64.5	142.1	-175.9	25.3	-34.1	0	0	0	111.7	F38 Q51	F38-P49 HydrophobicContact CB-CB 4.22Å; P49-Q51 PolarHBondContact O-N 3.11Å; P49-Q51 VanDerWaalsContact O-N 3.14Å
50	K	96.8	Very high	94	Very high	68 Å²	68	58.8 Å²	58.8	30%	0.296	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	106.8	-176.8	-74.1	149	-170.5	150.1	0	109.3	I39 E47 F52 Y319	I39-K50 HydrophobicContact CG2-CB 3.92Å; I39-K50 PolarHBondContact N-O 3.44Å; I39-K50 PolarHBondContact O-N 3.23Å; E47-K50 IonicContact OE2-NZ 3.18Å; E47-K50 PolarHBondContact OE2-NZ 2.79Å; K50-F52 HydrophobicContact CB-CE2 4.2Å; K50-F52 WeakPolarHBondContact O-CD2 3.13Å; K50-Y319 PolarHBondContact NZ-OH 3.17Å
51	Q	97.3	Very high	93.8	Very high	104 Å²	104	61.3 Å²	61.3	49%	0.486	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	138.5	179.8	-178.4	-179.9	-18.5	0	0	112.2	C37 F38 P49	C37-Q51 CarbonylContact O-C 3.54Å; F38-Q51 HydrophobicContact CD1-CB 3.77Å; F38-Q51 HydrophobicContact CD1-CG 3.96Å; F38-Q51 HydrophobicContact CE1-CB 3.74Å; F38-Q51 HydrophobicContact CE1-CG 3.52Å; F38-Q51 HydrophobicContact CZ-CG 4.07Å; P49-Q51 PolarHBondContact O-N 3.11Å; P49-Q51 VanDerWaalsContact O-N 3.14Å
52	F	98.1	Very high	93.7	Very high	25 Å²	25	61.2 Å²	61.2	11%	0.11	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	162.4	168.8	-61.9	-91.3	0	0	0	109.7	Q36 C37 I39 K50 F54 L323 L326 R327 N330	Q36-F52 WeakPolarHBondContact CA-O 3.34Å; C37-F52 PolarHBondContact N-O 3.05Å; C37-F52 PolarHBondContact O-N 3.48Å; I39-F52 HydrophobicContact CG2-CE2 4.11Å; K50-F52 HydrophobicContact CB-CE2 4.2Å; K50-F52 WeakPolarHBondContact O-CD2 3.13Å; F52-F54 HydrophobicContact CB-CD2 4.33Å; F52-F54 HydrophobicContact CB-CE2 3.41Å; F52-F54 VanDerWaalsContact CB-CE2 3.41Å; F52-F54 HydrophobicContact CB-CZ 3.7Å; F52-F54 HydrophobicContact CG-CE2 4.38Å; F52-F54 HydrophobicContact CG-CZ 4.33Å; F52-L323 HydrophobicContact CE2-CD1 4.1Å; F52-L323 HydrophobicContact CZ-CD1 3.91Å; F52-L326 HydrophobicContact CB-CD2 4.5Å; F52-L326 HydrophobicContact CD1-CB 4.36Å; F52-L326 HydrophobicContact CD2-CB 3.96Å; F52-L326 HydrophobicContact CD2-CD1 3.97Å; F52-L326 HydrophobicContact CD2-CD2 4.21Å; F52-L326 HydrophobicContact CD2-CG 4.28Å; F52-L326 HydrophobicContact CE1-CB 4.21Å; F52-L326 HydrophobicContact CE2-CB 3.81Å; F52-L326 HydrophobicContact CE2-CD1 3.95Å; F52-L326 HydrophobicContact CE2-CG 4.4Å; F52-L326 HydrophobicContact CG-CB 4.24Å; F52-L326 HydrophobicContact CG-CD2 4.38Å; F52-L326 HydrophobicContact CZ-CB 3.93Å; F52-R327 HydrophobicContact CE1-CG 4.31Å; F52-R327 HydrophobicContact CZ-CG 4.22Å; F52-N330 HydrophobicContact CD1-CB 3.89Å; F52-N330 HydrophobicContact CE1-CB 4.36Å
53	T	98	Very high	93.8	Very high	51 Å²	51	62.1 Å²	62.1	31%	0.313	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	136.1	179	-48.7	0	0	0	0	110	G35 Q36 K333	G35-T53 WeakPolarHBondContact O-CA 3.4Å; Q36-T53 HydrophobicContact CG-CG2 3.99Å; T53-K333 PolarHBondContact O-NZ 3.28Å
54	F	97.9	Very high	94.1	Very high	16 Å²	16	58.6 Å²	58.6	7%	0.07	32%	0.318	C	S	.	.			trans	-136	172.2	-166.2	-64.9	-70.8	0	0	0	110.7	V8 V10 G35 C37 F52 G56 L326 A329 N330	V8-F54 HydrophobicContact CB-CD1 4.32Å; V8-F54 HydrophobicContact CG1-CD1 3.86Å; V8-F54 HydrophobicContact CG1-CE1 4.19Å; V8-F54 WeakPolarHBondContact O-CB 3.39Å; V10-F54 HydrophobicContact CB-CD2 4.3Å; V10-F54 HydrophobicContact CB-CE2 4.45Å; V10-F54 HydrophobicContact CG1-CD1 4.31Å; V10-F54 HydrophobicContact CG1-CD2 3.57Å; V10-F54 HydrophobicContact CG1-CE1 4.19Å; V10-F54 HydrophobicContact CG1-CE2 3.41Å; V10-F54 VanDerWaalsContact CG1-CE2 3.41Å; V10-F54 HydrophobicContact CG1-CG 4.02Å; V10-F54 HydrophobicContact CG1-CZ 3.75Å; V10-F54 HydrophobicContact CG2-CD2 3.72Å; V10-F54 HydrophobicContact CG2-CE2 4.16Å; V10-F54 HydrophobicContact CG2-CG 4.41Å; G35-F54 PolarHBondContact O-N 3.29Å; C37-F54 HydrophobicContact CB-CD2 4.42Å; C37-F54 HydrophobicContact CB-CE2 4.23Å; F52-F54 HydrophobicContact CB-CD2 4.33Å; F52-F54 HydrophobicContact CB-CE2 3.41Å; F52-F54 VanDerWaalsContact CB-CE2 3.41Å; F52-F54 HydrophobicContact CB-CZ 3.7Å; F52-F54 HydrophobicContact CG-CE2 4.38Å; F52-F54 HydrophobicContact CG-CZ 4.33Å; F54-G56 PolarHBondContact O-N 2.86Å; F54-L326 HydrophobicContact CE2-CD2 3.72Å; F54-L326 HydrophobicContact CZ-CD2 3.86Å; F54-A329 HydrophobicContact CD1-CB 4.48Å; F54-A329 HydrophobicContact CE1-CB 3.58Å; F54-A329 HydrophobicContact CZ-CB 4.04Å; F54-N330 HydrophobicContact CE1-CB 4.18Å; F54-N330 HydrophobicContact CZ-CB 4.38Å
55	D	97.3	Very high	94.3	Very high	82 Å²	82	60.7 Å²	60.7	44%	0.439	32%	0.323	S	S	.	.	S	Bend	trans	-70	-12.8	175.6	-53.9	-85.9	0	0	0	112.3	V8 I71	V8-D55 PolarHBondContact N-OD2 3.24Å; V8-D55 PolarHBondContact O-N 3.27Å; D55-I71 HydrophobicContact CB-CD1 4.48Å
56	G	96.8	Very high	94.9	Very high	11 Å²	11	60.4 Å²	60.4	11%	0.113	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.4	149.6	173.3	0	0	0	0	0	110.7	V9 V10 F54	V9-G56 VanDerWaalsContact CA-O 3.23Å; V9-G56 WeakPolarHBondContact CA-O 3.25Å; V9-G56 WeakPolarHBondContact CB-O 3.34Å; V10-G56 PolarHBondContact N-O 3.42Å; V10-G56 VanDerWaalsContact N-O 3.13Å; F54-G56 PolarHBondContact O-N 2.86Å
57	A	97.3	Very high	95.2	Very high	2 Å²	2	52.4 Å²	52.4	2%	0.017	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	127.7	179.2	0	0	0	0	0	110.1	V10 V30 S32	V10-A57 HydrophobicContact CG2-CB 3.56Å; V30-A57 HydrophobicContact CG1-CB 3.73Å; S32-A57 WeakPolarHBondContact CA-O 3.43Å; S32-A57 VanDerWaalsContact CB-O 3.23Å; S32-A57 WeakPolarHBondContact CB-O 3.45Å; S32-A57 PolarHBondContact OG-O 3.33Å; S32-A57 VanDerWaalsContact OG-O 3.09Å
58	Y	97.1	Very high	95.5	Very high	5 Å²	5	48.7 Å²	48.7	2%	0.02	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	132.8	-170.4	-56.4	-71.9	0	0	0	110.5	V9 V10 R11 C12 H62 I67 E70	V9-Y58 HydrophobicContact CB-CD2 4.29Å; V9-Y58 HydrophobicContact CB-CE2 3.85Å; V9-Y58 HydrophobicContact CG1-CE2 4.13Å; V9-Y58 HydrophobicContact CG2-CD2 4.45Å; V9-Y58 HydrophobicContact CG2-CE2 4.05Å; V10-Y58 WeakPolarHBondContact O-CD2 3.42Å; V10-Y58 PolarHBondContact O-N 3.22Å; R11-Y58 WeakPolarHBondContact CA-O 3.43Å; C12-Y58 PolarHBondContact N-O 2.93Å; Y58-H62 HydrophobicContact CD1-CB 4.25Å; Y58-H62 AromaticContact CD1-CD2 3.63Å; Y58-I67 HydrophobicContact CD1-CD1 4.43Å; Y58-I67 HydrophobicContact CD1-CG1 3.78Å; Y58-I67 HydrophobicContact CD2-CD1 3.92Å; Y58-I67 HydrophobicContact CD2-CG1 3.74Å; Y58-I67 HydrophobicContact CD2-CG2 4.23Å; Y58-I67 HydrophobicContact CE1-CG1 3.91Å; Y58-I67 HydrophobicContact CE2-CB 4.23Å; Y58-I67 HydrophobicContact CE2-CD1 4.48Å; Y58-I67 HydrophobicContact CE2-CG1 3.88Å; Y58-I67 HydrophobicContact CE2-CG2 3.84Å; Y58-I67 HydrophobicContact CG-CD1 3.88Å; Y58-I67 HydrophobicContact CG-CG1 3.67Å; Y58-E70 WeakPolarHBondContact CE1-OE2 3.46Å; Y58-E70 PolarHBondContact OH-OE2 3.4Å
59	Y	95.6	Very high	95.6	Very high	44 Å²	44	47.8 Å²	47.8	17%	0.173	24%	0.237	C	C	.	.			trans	-112.2	-167.7	-177.4	-159	-120.3	0	0	0	112	C12 V28 V30 E61 H62	C12-Y59 HydrophobicContact CB-CD2 3.79Å; C12-Y59 HydrophobicContact CB-CE2 4.15Å; C12-Y59 CarbonylContact O-C 3.29Å; V28-Y59 PolarHBondContact O-OH 3.46Å; V30-Y59 HydrophobicContact CB-CD2 3.85Å; V30-Y59 HydrophobicContact CB-CG 4.07Å; V30-Y59 HydrophobicContact CG2-CD2 3.76Å; V30-Y59 HydrophobicContact CG2-CG 4.43Å; Y59-E61 WeakPolarHBondContact CB-OE1 3.42Å; Y59-E61 WeakPolarHBondContact CD1-OE2 3.45Å; Y59-E61 PolarHBondContact O-N 2.87Å; Y59-E61 VanDerWaalsContact O-N 3.14Å; Y59-H62 PolarHBondContact N-ND1 2.89Å; Y59-H62 PolarHBondContact O-N 3.18Å
60	I	93.4	Very high	95.6	Very high	78 Å²	78	50.4 Å²	50.4	40%	0.4	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-24.9	-161.6	67.6	177.7	0	0	0	114.4	P14	P14-I60 HydrophobicContact CB-CB 4.4Å; P14-I60 HydrophobicContact CG-CB 4.05Å
61	E	91.8	Very high	95.4	Very high	103 Å²	103	48.3 Å²	48.3	48%	0.481	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-7	179.1	66.3	-66.4	148.6	0	0	114.7	Y59	Y59-E61 WeakPolarHBondContact CB-OE1 3.42Å; Y59-E61 WeakPolarHBondContact CD1-OE2 3.45Å; Y59-E61 PolarHBondContact O-N 2.87Å; Y59-E61 VanDerWaalsContact O-N 3.14Å
62	H	93.3	Very high	95.3	Very high	31 Å²	31	43.3 Å²	43.3	14%	0.144	21%	0.213	C	C	.	.			trans	-86	121.5	-174.1	-69.4	71.9	0	0	0	113.2	R11 S32 Y58 Y59	R11-H62 PolarHBondContact NH2-O 2.9Å; S32-H62 PolarHBondContact OG-CE1 3.41Å; S32-H62 PolarHBondContact OG-NE2 3.08Å; Y58-H62 HydrophobicContact CD1-CB 4.25Å; Y58-H62 AromaticContact CD1-CD2 3.63Å; Y59-H62 PolarHBondContact N-ND1 2.89Å; Y59-H62 PolarHBondContact O-N 3.18Å
63	F	93.8	Very high	95.3	Very high	88 Å²	88	47 Å²	47	39%	0.386	23%	0.227	S	C	.	.			trans	-73.9	152.2	178	-62.1	-66.5	0	0	0	112.2	E65 Q66 I67 C109 Q110	F63-E65 HydrophobicContact CB-CB 4.3Å; F63-E65 PolarHBondContact O-N 2.96Å; F63-Q66 PolarHBondContact O-N 3.18Å; F63-I67 PolarHBondContact O-N 3.25Å; F63-C109 HydrophobicContact CB-CB 4.19Å; F63-C109 HydrophobicContact CD1-CB 4.12Å; F63-C109 VanDerWaalsContact CD1-SG 3.56Å; F63-C109 HydrophobicContact CG-CB 4.1Å; F63-Q110 HydrophobicContact CD1-CG 4.36Å
64	T	93.9	Very high	95.2	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-65.6	-25.6	178.6	-45.9	0	0	0	0	111.8	R11 Y68 T100 C109 I113	R11-T64 PolarHBondContact NH1-OG1 3.09Å; R11-T64 PolarHBondContact NH2-OG1 2.99Å; T64-Y68 WeakPolarHBondContact O-CB 3.23Å; T64-Y68 PolarHBondContact O-N 3.47Å; T64-T100 HydrophobicContact CG2-CG2 4.28Å; T64-C109 PolarHBondContact N-O 2.81Å; T64-I113 HydrophobicContact CG2-CG1 4.35Å
65	E	94.7	Very high	95.1	Very high	70 Å²	70	47.6 Å²	47.6	33%	0.327	23%	0.233	S	C	.	.	H	α-helix	trans	-53.4	-50.6	168.9	-175.2	141.6	-107.3	0	0	114.3	F63 Y68 N69 C109 R116	F63-E65 HydrophobicContact CB-CB 4.3Å; F63-E65 PolarHBondContact O-N 2.96Å; E65-Y68 PolarHBondContact O-N 3.25Å; E65-N69 VanDerWaalsContact O-CG 3.24Å; E65-N69 PolarHBondContact O-N 3.49Å; E65-N69 PolarHBondContact O-OD1 2.93Å; E65-C109 HydrophobicContact CB-CB 4.35Å; E65-C109 PolarHBondContact N-O 2.83Å; E65-C109 VanDerWaalsContact N-O 3.16Å; E65-C109 WeakPolarHBondContact OE2-CA 3.3Å; E65-C109 VanDerWaalsContact OE2-CB 3.23Å; E65-C109 WeakPolarHBondContact OE2-CB 3.36Å; E65-R116 IonicContact OE1-CZ 3.31Å; E65-R116 IonicContact OE1-NH1 3.84Å; E65-R116 PolarHBondContact OE1-NH1 3.02Å; E65-R116 IonicContact OE1-NH2 2.68Å; E65-R116 PolarHBondContact OE1-NH2 2.87Å; E65-R116 IonicContact OE2-NH2 3.71Å
66	Q	93.9	Very high	95.1	Very high	71 Å²	71	43.7 Å²	43.7	33%	0.332	21%	0.212	S	C	.	.	H	α-helix	trans	-63.7	-47.6	-179	-64.3	167.1	-74.3	0	0	110.3	F63 Y68 N69 E70	F63-Q66 PolarHBondContact O-N 3.18Å; Q66-Y68 VanDerWaalsContact C-N 3.26Å; Q66-Y68 PolarHBondContact O-N 2.92Å; Q66-N69 PolarHBondContact O-N 3.07Å; Q66-E70 WeakPolarHBondContact O-CB 3.45Å; Q66-E70 WeakPolarHBondContact O-CG 3.23Å; Q66-E70 PolarHBondContact O-N 3.46Å
67	I	94.7	Very high	95	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-57.2	-40.8	175.6	-55.3	179	0	0	0	111.1	R11 Y58 F63 I71	R11-I67 VanDerWaalsContact CD-CD1 3.49Å; R11-I67 HydrophobicContact CG-CD1 3.9Å; R11-I67 VanDerWaalsContact NE-CD1 3.33Å; Y58-I67 HydrophobicContact CD1-CD1 4.43Å; Y58-I67 HydrophobicContact CD1-CG1 3.78Å; Y58-I67 HydrophobicContact CD2-CD1 3.92Å; Y58-I67 HydrophobicContact CD2-CG1 3.74Å; Y58-I67 HydrophobicContact CD2-CG2 4.23Å; Y58-I67 HydrophobicContact CE1-CG1 3.91Å; Y58-I67 HydrophobicContact CE2-CB 4.23Å; Y58-I67 HydrophobicContact CE2-CD1 4.48Å; Y58-I67 HydrophobicContact CE2-CG1 3.88Å; Y58-I67 HydrophobicContact CE2-CG2 3.84Å; Y58-I67 HydrophobicContact CG-CD1 3.88Å; Y58-I67 HydrophobicContact CG-CG1 3.67Å; F63-I67 PolarHBondContact O-N 3.25Å; I67-I71 HydrophobicContact CG2-CG2 4.42Å; I67-I71 WeakPolarHBondContact O-CG2 3.12Å; I67-I71 PolarHBondContact O-N 2.97Å
68	Y	97.1	Very high	94.9	Very high	7 Å²	7	46 Å²	46	3%	0.027	22%	0.219	C	C	.	.	I	π-helix	trans	-64.8	-52.1	178.2	-173.8	-91.7	0	0	0	111.2	T64 E65 Q66 E70 A72 Y73 V76 I113 R116 A117 H120	T64-Y68 WeakPolarHBondContact O-CB 3.23Å; T64-Y68 PolarHBondContact O-N 3.47Å; E65-Y68 PolarHBondContact O-N 3.25Å; Q66-Y68 VanDerWaalsContact C-N 3.26Å; Q66-Y68 PolarHBondContact O-N 2.92Å; Y68-E70 PolarHBondContact O-N 2.94Å; Y68-A72 HydrophobicContact CD2-CB 3.69Å; Y68-A72 HydrophobicContact CE2-CB 3.96Å; Y68-A72 HydrophobicContact CG-CB 4.24Å; Y68-A72 CarbonylContact O-C 3.57Å; Y68-A72 WeakPolarHBondContact O-CA 3.28Å; Y68-A72 WeakPolarHBondContact O-CB 3.26Å; Y68-A72 PolarHBondContact O-N 2.81Å; Y68-Y73 HydrophobicContact CE1-CD2 4.22Å; Y68-Y73 PolarHBondContact O-N 3.03Å; Y68-V76 HydrophobicContact CE2-CG2 4.37Å; Y68-I113 HydrophobicContact CD2-CB 4.36Å; Y68-I113 HydrophobicContact CD2-CG1 4.35Å; Y68-I113 HydrophobicContact CD2-CG2 4.13Å; Y68-I113 HydrophobicContact CE2-CG2 4.25Å; Y68-R116 HydrophobicContact CD1-CB 4.03Å; Y68-R116 HydrophobicContact CD2-CB 3.68Å; Y68-R116 HydrophobicContact CE1-CB 4.1Å; Y68-R116 HydrophobicContact CE2-CB 3.76Å; Y68-R116 HydrophobicContact CG-CB 3.84Å; Y68-R116 HydrophobicContact CG-CG 4.48Å; Y68-A117 HydrophobicContact CE2-CB 4.27Å; Y68-H120 AromaticContact CZ-ND1 3.95Å; Y68-H120 WeakPolarHBondContact OH-CB 3.49Å; Y68-H120 PolarHBondContact OH-ND1 2.61Å
69	N	95.4	Very high	94.8	Very high	90 Å²	90	45.8 Å²	45.8	48%	0.481	22%	0.218	S	C	.	.	I	π-helix	trans	-65.9	-37.9	-174.7	-63.9	-3.5	0	0	0	112.5	E65 Q66	E65-N69 VanDerWaalsContact O-CG 3.24Å; E65-N69 PolarHBondContact O-N 3.49Å; E65-N69 PolarHBondContact O-OD1 2.93Å; Q66-N69 PolarHBondContact O-N 3.07Å
70	E	92.8	Very high	94.7	Very high	113 Å²	113	44.3 Å²	44.3	53%	0.528	21%	0.214	S	C	.	.	I	π-helix	trans	-76.3	-41.9	-176	-71.7	170.9	-145.8	0	0	113.7	Y58 Q66 Y68	Y58-E70 WeakPolarHBondContact CE1-OE2 3.46Å; Y58-E70 PolarHBondContact OH-OE2 3.4Å; Q66-E70 WeakPolarHBondContact O-CB 3.45Å; Q66-E70 WeakPolarHBondContact O-CG 3.23Å; Q66-E70 PolarHBondContact O-N 3.46Å; Y68-E70 PolarHBondContact O-N 2.94Å
71	I	93.5	Very high	94.6	Very high	23 Å²	23	44.7 Å²	44.7	12%	0.118	21%	0.214	C	C	.	.	I	π-helix	trans	-128.6	-24.6	-170.2	-154.2	71	0	0	0	115.5	K7 V9 D55 I67 L307	K7-I71 HydrophobicContact CD-CD1 4.11Å; V9-I71 HydrophobicContact CG1-CB 4.27Å; V9-I71 HydrophobicContact CG1-CG1 3.87Å; V9-I71 HydrophobicContact CG1-CG2 3.9Å; V9-I71 HydrophobicContact CG2-CG2 4.29Å; D55-I71 HydrophobicContact CB-CD1 4.48Å; I67-I71 HydrophobicContact CG2-CG2 4.42Å; I67-I71 WeakPolarHBondContact O-CG2 3.12Å; I67-I71 PolarHBondContact O-N 2.97Å; I71-L307 HydrophobicContact CG1-CD1 3.88Å; I71-L307 HydrophobicContact CG2-CD1 4.08Å; I71-L307 HydrophobicContact CG2-CD2 3.87Å
72	A	95.9	Very high	94.6	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.191	C	C	.	.	I	π-helix	trans	-88	-36.2	179.3	0	0	0	0	0	112.6	Y68 L75 V76 I87 I113 L307	Y68-A72 HydrophobicContact CD2-CB 3.69Å; Y68-A72 HydrophobicContact CE2-CB 3.96Å; Y68-A72 HydrophobicContact CG-CB 4.24Å; Y68-A72 CarbonylContact O-C 3.57Å; Y68-A72 WeakPolarHBondContact O-CA 3.28Å; Y68-A72 WeakPolarHBondContact O-CB 3.26Å; Y68-A72 PolarHBondContact O-N 2.81Å; A72-L75 WeakPolarHBondContact O-CB 3.42Å; A72-L75 PolarHBondContact O-N 3.47Å; A72-V76 PolarHBondContact O-N 3.22Å; A72-I87 HydrophobicContact CB-CD1 3.94Å; A72-I113 HydrophobicContact CB-CG2 4.48Å; A72-L307 HydrophobicContact CB-CD2 4.18Å
73	Y	96.8	Very high	94.7	Very high	102 Å²	102	40.9 Å²	40.9	40%	0.4	20%	0.195	S	C	.	.	H	α-helix	trans	-53.9	-49.8	-177.4	-179.9	-85.1	0	0	0	112.8	Y68 L75 V76 E77 H120	Y68-Y73 HydrophobicContact CE1-CD2 4.22Å; Y68-Y73 PolarHBondContact O-N 3.03Å; Y73-L75 PolarHBondContact O-N 3.37Å; Y73-L75 VanDerWaalsContact O-N 3.15Å; Y73-V76 PolarHBondContact O-N 3Å; Y73-V76 VanDerWaalsContact O-N 3.14Å; Y73-E77 PolarHBondContact O-N 2.97Å; Y73-H120 AromaticContact CD2-CE1 3.2Å; Y73-H120 WeakPolarHBondContact CD2-CE1 3.47Å; Y73-H120 AromaticContact CD2-ND1 3.41Å; Y73-H120 WeakPolarHBondContact CD2-ND1 3.06Å; Y73-H120 AromaticContact CD2-NE2 3.87Å; Y73-H120 AromaticContact CE2-CD2 3.89Å; Y73-H120 AromaticContact CE2-CE1 3.22Å; Y73-H120 WeakPolarHBondContact CE2-CE1 3.26Å; Y73-H120 AromaticContact CE2-ND1 3.66Å; Y73-H120 AromaticContact CE2-NE2 3.37Å; Y73-H120 WeakPolarHBondContact CE2-NE2 3.45Å; Y73-H120 AromaticContact CG-CE1 3.72Å; Y73-H120 AromaticContact CZ-CE1 3.77Å; Y73-H120 AromaticContact CZ-NE2 3.71Å; Y73-H120 PolarHBondContact O-CE1 3.37Å
74	P	95.8	Very high	94.8	Very high	65 Å²	65	37.8 Å²	37.8	42%	0.422	18%	0.182	S	C	.	.	H	α-helix	trans	-68.4	-16	179.2	-19	33.5	0	0	0	114.7	G78	P74-G78 PolarHBondContact O-N 2.94Å
75	L	96.7	Very high	95	Very high	15 Å²	15	37.8 Å²	37.8	8%	0.079	18%	0.182	C	C	.	.	H	α-helix	trans	-81.8	-43.3	172.8	-176.7	160.5	0	0	0	110.3	A72 Y73 G78 V79 I87 L236 K305 L307	A72-L75 WeakPolarHBondContact O-CB 3.42Å; A72-L75 PolarHBondContact O-N 3.47Å; Y73-L75 PolarHBondContact O-N 3.37Å; Y73-L75 VanDerWaalsContact O-N 3.15Å; L75-G78 WeakPolarHBondContact O-CA 3.29Å; L75-G78 PolarHBondContact O-N 3.37Å; L75-V79 PolarHBondContact O-N 2.99Å; L75-I87 HydrophobicContact CD1-CG1 4.02Å; L75-I87 HydrophobicContact CD2-CD1 4.17Å; L75-I87 HydrophobicContact CD2-CG1 3.83Å; L75-L236 HydrophobicContact CD2-CD1 3.71Å; L75-K305 WeakPolarHBondContact CD1-O 3.36Å; L75-K305 HydrophobicContact CG-CB 4.23Å; L75-L307 HydrophobicContact CD1-CB 3.54Å
76	V	96.7	Very high	95.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-68.2	-41.3	178.4	177.8	0	0	0	0	111.4	Y68 A72 Y73 G78 V79 T80 I87 A117 H120 V121 L236	Y68-V76 HydrophobicContact CE2-CG2 4.37Å; A72-V76 PolarHBondContact O-N 3.22Å; Y73-V76 PolarHBondContact O-N 3Å; Y73-V76 VanDerWaalsContact O-N 3.14Å; V76-G78 PolarHBondContact O-N 2.7Å; V76-V79 WeakPolarHBondContact O-CA 3.25Å; V76-V79 WeakPolarHBondContact O-CB 3.48Å; V76-V79 PolarHBondContact O-N 2.75Å; V76-T80 PolarHBondContact O-N 2.96Å; V76-T80 PolarHBondContact O-OG1 3.07Å; V76-I87 HydrophobicContact CG2-CD1 4.32Å; V76-A117 HydrophobicContact CG1-CB 4.47Å; V76-A117 HydrophobicContact CG2-CB 4.16Å; V76-H120 HydrophobicContact CG1-CB 4.27Å; V76-H120 WeakPolarHBondContact CG1-ND1 3.45Å; V76-V121 HydrophobicContact CG1-CG2 3.86Å; V76-L236 HydrophobicContact CG1-CD2 4.38Å; V76-L236 HydrophobicContact CG2-CD2 3.99Å
77	E	95.3	Very high	95.4	Very high	60 Å²	60	31.1 Å²	31.1	28%	0.28	15%	0.151	S	C	.	.	H	α-helix	trans	-61	-34.6	172.1	-169.8	65	-91.6	0	0	111	Y73 V79 T80 E81 H120	Y73-E77 PolarHBondContact O-N 2.97Å; E77-V79 PolarHBondContact O-N 2.61Å; E77-T80 VanDerWaalsContact CA-OG1 3.22Å; E77-T80 WeakPolarHBondContact CA-OG1 3.46Å; E77-T80 PolarHBondContact O-N 2.93Å; E77-T80 PolarHBondContact O-OG1 2.94Å; E77-T80 PolarHBondContact OE1-OG1 3.3Å; E77-E81 WeakPolarHBondContact O-CG 3.48Å; E77-E81 PolarHBondContact O-N 3.44Å; E77-H120 IonicContact OE2-NE2 3.93Å; E77-H120 PolarHBondContact OE2-NE2 2.99Å
78	G	94.6	Very high	95.5	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.01	15%	0.151	C	C	.	.	H	α-helix	trans	-57.3	-30.4	169.6	0	0	0	0	0	113.9	P74 L75 V76 E81 G82 Y83	P74-G78 PolarHBondContact O-N 2.94Å; L75-G78 WeakPolarHBondContact O-CA 3.29Å; L75-G78 PolarHBondContact O-N 3.37Å; V76-G78 PolarHBondContact O-N 2.7Å; G78-E81 WeakPolarHBondContact CA-OE2 3.27Å; G78-G82 PolarHBondContact O-N 3.05Å; G78-Y83 WeakPolarHBondContact O-CA 3.37Å; G78-Y83 WeakPolarHBondContact O-CB 3.47Å; G78-Y83 VanDerWaalsContact O-CD2 3.26Å; G78-Y83 WeakPolarHBondContact O-CD2 3.35Å; G78-Y83 PolarHBondContact O-N 3.49Å
79	V	95.9	Very high	95.5	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-80.5	-34.2	178.9	-174.9	0	0	0	0	111.8	L75 V76 E77 E81 G82 I218 G234 L236	L75-V79 PolarHBondContact O-N 2.99Å; V76-V79 WeakPolarHBondContact O-CA 3.25Å; V76-V79 WeakPolarHBondContact O-CB 3.48Å; V76-V79 PolarHBondContact O-N 2.75Å; E77-V79 PolarHBondContact O-N 2.61Å; V79-E81 VanDerWaalsContact C-N 3.31Å; V79-G82 PolarHBondContact O-N 2.88Å; V79-G82 VanDerWaalsContact O-N 3.1Å; V79-I218 HydrophobicContact CG1-CD1 4.04Å; V79-G234 WeakPolarHBondContact O-CA 3.48Å; V79-L236 HydrophobicContact CB-CB 4.41Å; V79-L236 HydrophobicContact CG1-CB 4.03Å; V79-L236 HydrophobicContact CG2-CB 4.05Å; V79-L236 HydrophobicContact CG2-CD1 4.22Å
80	T	92.9	Very high	95.5	Very high	13 Å²	13	27 Å²	27	8%	0.08	13%	0.129	C	C	.	.	H	α-helix	trans	-69	-26.3	172	35.5	0	0	0	0	112.6	V76 E77 G82 V121 I218 I220	V76-T80 PolarHBondContact O-N 2.96Å; V76-T80 PolarHBondContact O-OG1 3.07Å; E77-T80 VanDerWaalsContact CA-OG1 3.22Å; E77-T80 WeakPolarHBondContact CA-OG1 3.46Å; E77-T80 PolarHBondContact O-N 2.93Å; E77-T80 PolarHBondContact O-OG1 2.94Å; E77-T80 PolarHBondContact OE1-OG1 3.3Å; T80-G82 VanDerWaalsContact C-N 3.33Å; T80-V121 HydrophobicContact CG2-CG2 4.36Å; T80-I218 HydrophobicContact CG2-CD1 4.09Å; T80-I220 VanDerWaalsContact O-CD1 3.26Å; T80-I220 WeakPolarHBondContact O-CD1 3.33Å
81	E	91.3	Very high	95.6	Very high	86 Å²	86	21.7 Å²	21.7	40%	0.402	10%	0.104	S	C	.	.	H	α-helix	trans	-68.4	-26.8	166.3	-69	176.4	141.6	0	0	114.1	E77 G78 V79 Y83 R232 K305	E77-E81 WeakPolarHBondContact O-CG 3.48Å; E77-E81 PolarHBondContact O-N 3.44Å; G78-E81 WeakPolarHBondContact CA-OE2 3.27Å; V79-E81 VanDerWaalsContact C-N 3.31Å; E81-Y83 HydrophobicContact CB-CD2 4.14Å; E81-Y83 HydrophobicContact CB-CE2 4.42Å; E81-Y83 WeakPolarHBondContact OE2-CD2 3.17Å; E81-Y83 WeakPolarHBondContact OE2-CE2 3.39Å; E81-R232 VanDerWaalsContact O-CD 3.31Å; E81-R232 WeakPolarHBondContact O-CD 3.39Å; E81-R232 PolarHBondContact O-NH1 2.83Å; E81-K305 IonicContact OE2-NZ 2.61Å; E81-K305 PolarHBondContact OE2-NZ 3.22Å
82	G	92.7	Very high	95.5	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	113	15.2	-176.3	0	0	0	0	0	116.7	G78 V79 T80 N342	G78-G82 PolarHBondContact O-N 3.05Å; V79-G82 PolarHBondContact O-N 2.88Å; V79-G82 VanDerWaalsContact O-N 3.1Å; T80-G82 VanDerWaalsContact C-N 3.33Å; G82-N342 PolarHBondContact O-N 2.92Å; G82-N342 PolarHBondContact O-ND2 3.12Å
83	Y	95	Very high	95.1	Very high	55 Å²	55	23 Å²	23	22%	0.216	11%	0.112	C	C	.	.	B	Isolated β-bridge	trans	-80.2	162.8	168.9	-67.1	-97.9	0	0	0	112.1	G78 E81 G234 K235 K305 P339 R340 I341	G78-Y83 WeakPolarHBondContact O-CA 3.37Å; G78-Y83 WeakPolarHBondContact O-CB 3.47Å; G78-Y83 VanDerWaalsContact O-CD2 3.26Å; G78-Y83 WeakPolarHBondContact O-CD2 3.35Å; G78-Y83 PolarHBondContact O-N 3.49Å; E81-Y83 HydrophobicContact CB-CD2 4.14Å; E81-Y83 HydrophobicContact CB-CE2 4.42Å; E81-Y83 WeakPolarHBondContact OE2-CD2 3.17Å; E81-Y83 WeakPolarHBondContact OE2-CE2 3.39Å; Y83-G234 WeakPolarHBondContact O-CA 3.5Å; Y83-K235 PolarHBondContact O-N 2.87Å; Y83-K305 HydrophobicContact CD1-CD 4.36Å; Y83-K305 HydrophobicContact CD1-CG 4.47Å; Y83-K305 HydrophobicContact CD2-CD 4.47Å; Y83-K305 VanDerWaalsContact CE2-NZ 3.33Å; Y83-K305 HydrophobicContact CG-CD 4.11Å; Y83-P339 HydrophobicContact CD1-CB 3.89Å; Y83-P339 HydrophobicContact CE1-CB 4.19Å; Y83-R340 VanDerWaalsContact CD1-O 3.26Å; Y83-R340 WeakPolarHBondContact CD1-O 3.4Å; Y83-R340 VanDerWaalsContact CE1-C 3.48Å; Y83-I341 HydrophobicContact CD2-CG1 3.91Å; Y83-I341 HydrophobicContact CE1-CG1 4.18Å; Y83-I341 HydrophobicContact CE2-CD1 4.16Å; Y83-I341 HydrophobicContact CE2-CG1 3.52Å; Y83-I341 HydrophobicContact CG-CG1 4.39Å
84	N	96	Very high	94.6	Very high	23 Å²	23	20.6 Å²	20.6	12%	0.123	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	138	158.9	-55.9	-46.2	0	0	0	109.7	K235 N303 T304 K305 N342	N84-K235 CarbonylContact C-O 3.53Å; N84-K235 WeakPolarHBondContact CA-O 3.48Å; N84-K235 WeakPolarHBondContact OD1-CB 3.46Å; N84-N303 WeakPolarHBondContact CB-O 3.34Å; N84-N303 PolarHBondContact ND2-ND2 2.98Å; N84-N303 PolarHBondContact ND2-O 3.42Å; N84-T304 HydrophobicContact CB-CG2 4.17Å; N84-T304 CarbonylContact O-C 3.48Å; N84-T304 WeakPolarHBondContact O-CA 3.44Å; N84-K305 PolarHBondContact O-N 3.49Å; N84-N342 VanDerWaalsContact CG-ND2 3.3Å; N84-N342 PolarHBondContact ND2-ND2 3.1Å; N84-N342 PolarHBondContact ND2-OD1 3.5Å; N84-N342 VanDerWaalsContact ND2-OD1 3.1Å; N84-N342 PolarHBondContact OD1-ND2 3.2Å
85	G	97.3	Very high	94.4	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	145.1	173.8	0	0	0	0	0	111.7	K235 L236 N237 K305	G85-K235 PolarHBondContact N-O 2.98Å; G85-K235 VanDerWaalsContact O-O 3.12Å; G85-L236 CarbonylContact O-C 3.59Å; G85-L236 WeakPolarHBondContact O-CA 3.36Å; G85-N237 PolarHBondContact O-N 2.85Å; G85-N237 PolarHBondContact O-ND2 3.49Å; G85-N237 VanDerWaalsContact O-ND2 3.11Å; G85-K305 CarbonylContact C-O 3.55Å; G85-K305 VanDerWaalsContact CA-O 3.28Å; G85-K305 WeakPolarHBondContact CA-O 3.37Å
86	T	98.2	Very high	94.1	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	125.8	171	-69	0	0	0	0	110.6	F88 N237 V239 L296 S299 T304 K305 T306 L307	T86-F88 HydrophobicContact CG2-CD1 4.35Å; T86-N237 WeakPolarHBondContact CA-O 3.44Å; T86-N237 HydrophobicContact CG2-CB 4.24Å; T86-N237 PolarHBondContact OG1-ND2 2.94Å; T86-V239 HydrophobicContact CG2-CG2 4.37Å; T86-L296 HydrophobicContact CG2-CD2 4.47Å; T86-S299 WeakPolarHBondContact CB-OG 3.42Å; T86-S299 PolarHBondContact OG1-OG 3.47Å; T86-T304 WeakPolarHBondContact OG1-CG2 3.47Å; T86-K305 PolarHBondContact N-O 3.01Å; T86-T306 HydrophobicContact CG2-CG2 4.35Å; T86-T306 CarbonylContact O-C 3.59Å; T86-T306 WeakPolarHBondContact O-CA 3.34Å; T86-L307 PolarHBondContact O-N 2.91Å
87	I	98.4	Very high	94	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	123.8	168.9	-50.6	176.8	0	0	0	108	A72 L75 V76 M101 I113 L236 N237 L238 V239 L307 V309	A72-I87 HydrophobicContact CB-CD1 3.94Å; L75-I87 HydrophobicContact CD1-CG1 4.02Å; L75-I87 HydrophobicContact CD2-CD1 4.17Å; L75-I87 HydrophobicContact CD2-CG1 3.83Å; V76-I87 HydrophobicContact CG2-CD1 4.32Å; I87-M101 HydrophobicContact CG2-CE 4.43Å; I87-M101 HydrophobicContact CG2-SD 4.41Å; I87-I113 HydrophobicContact CD1-CG2 3.58Å; I87-I113 HydrophobicContact CG2-CD1 4.17Å; I87-I113 HydrophobicContact CG2-CG2 4.3Å; I87-L236 HydrophobicContact CG1-CD1 4.48Å; I87-N237 PolarHBondContact N-O 2.68Å; I87-L238 HydrophobicContact CB-CD2 4.25Å; I87-L238 HydrophobicContact CD1-CD2 4.17Å; I87-L238 HydrophobicContact CG1-CD2 4.47Å; I87-V239 PolarHBondContact O-N 3.09Å; I87-L307 WeakPolarHBondContact CA-O 3.38Å; I87-L307 HydrophobicContact CD1-CD2 4.39Å; I87-L307 HydrophobicContact CG1-CB 4.3Å; I87-L307 HydrophobicContact CG1-CD2 4.26Å; I87-L307 HydrophobicContact CG2-CB 4.4Å; I87-L307 HydrophobicContact CG2-CD2 3.94Å; I87-L307 HydrophobicContact CG2-CG 4.2Å; I87-V309 HydrophobicContact CG2-CG2 4.21Å
88	F	97.4	Very high	93.9	Very high	2 Å²	2	16.9 Å²	16.9	1%	0.009	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	131	178.3	72.9	-86.9	0	0	0	113.4	T86 V239 L241 L300 T306 L307 M308 V309	T86-F88 HydrophobicContact CG2-CD1 4.35Å; F88-V239 WeakPolarHBondContact CA-O 3.31Å; F88-V239 HydrophobicContact CB-CB 3.68Å; F88-V239 HydrophobicContact CB-CG1 4.16Å; F88-V239 HydrophobicContact CB-CG2 4.32Å; F88-L241 HydrophobicContact CD2-CD1 3.83Å; F88-L241 HydrophobicContact CE2-CD1 4.48Å; F88-L300 HydrophobicContact CE1-CD2 4.21Å; F88-L300 HydrophobicContact CZ-CD2 4.37Å; F88-T306 HydrophobicContact CD1-CG2 4.05Å; F88-T306 HydrophobicContact CE1-CG2 3.78Å; F88-L307 WeakPolarHBondContact CD1-O 3.45Å; F88-L307 PolarHBondContact N-O 3Å; F88-M308 HydrophobicContact CD1-CB 4.42Å; F88-M308 HydrophobicContact CD2-CG 4.22Å; F88-M308 HydrophobicContact CE1-CB 3.78Å; F88-M308 HydrophobicContact CE1-CG 4.26Å; F88-M308 HydrophobicContact CE2-CB 4.01Å; F88-M308 HydrophobicContact CE2-CE 4.45Å; F88-M308 HydrophobicContact CE2-CG 3.55Å; F88-M308 HydrophobicContact CE2-SD 4.07Å; F88-M308 HydrophobicContact CZ-CB 3.55Å; F88-M308 HydrophobicContact CZ-CG 3.58Å; F88-M308 HydrophobicContact CZ-SD 4.02Å; F88-V309 PolarHBondContact O-N 3.42Å
89	A	96.9	Very high	93.8	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	132.7	172.9	0	0	0	0	0	111.2	K97 M101 V239 L241 V309	A89-K97 HydrophobicContact CB-CB 3.81Å; A89-K97 HydrophobicContact CB-CG 4.18Å; A89-M101 HydrophobicContact CB-CG 3.64Å; A89-M101 HydrophobicContact CB-SD 3.89Å; A89-V239 PolarHBondContact N-O 3.04Å; A89-L241 VanDerWaalsContact O-CB 3.32Å; A89-L241 WeakPolarHBondContact O-CB 3.44Å; A89-L241 WeakPolarHBondContact O-CG 3.21Å; A89-L241 PolarHBondContact O-N 2.69Å; A89-V309 CarbonylContact C-O 3.26Å; A89-V309 WeakPolarHBondContact CA-O 3.45Å
90	Y	96.3	Very high	93.8	Very high	10 Å²	10	20.3 Å²	20.3	4%	0.039	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	154.9	-176.9	178	-92.5	0	0	0	111.5	L241 L267 M308 V309 C311 T325 Y328	Y90-L241 HydrophobicContact CD2-CD1 3.86Å; Y90-L267 HydrophobicContact CD2-CD2 4.41Å; Y90-L267 HydrophobicContact CE2-CD2 4.16Å; Y90-M308 HydrophobicContact CD1-CE 3.39Å; Y90-M308 HydrophobicContact CE1-CE 4.29Å; Y90-M308 HydrophobicContact CG-CE 3.72Å; Y90-V309 PolarHBondContact N-O 3.3Å; Y90-C311 PolarHBondContact O-N 3.43Å; Y90-T325 HydrophobicContact CD1-CG2 3.99Å; Y90-T325 HydrophobicContact CE1-CG2 4.12Å; Y90-Y328 AromaticContact CD1-CD1 4Å; Y90-Y328 HydrophobicContact CD1-CD1 4Å; Y90-Y328 HydrophobicContact CD1-CE1 4.35Å; Y90-Y328 HydrophobicContact CD1-CG 4.42Å; Y90-Y328 HydrophobicContact CD2-CE1 4.25Å; Y90-Y328 AromaticContact CE1-CD1 3.65Å; Y90-Y328 HydrophobicContact CE1-CD1 3.65Å; Y90-Y328 HydrophobicContact CE1-CD2 4.13Å; Y90-Y328 HydrophobicContact CE1-CE1 4.1Å; Y90-Y328 AromaticContact CE1-CG 3.64Å; Y90-Y328 HydrophobicContact CE1-CG 3.64Å; Y90-Y328 HydrophobicContact CE2-CD1 4.35Å; Y90-Y328 AromaticContact CE2-CE1 3.97Å; Y90-Y328 HydrophobicContact CE2-CE1 3.97Å; Y90-Y328 HydrophobicContact CE2-CE2 4.2Å; Y90-Y328 AromaticContact CE2-CZ 3.9Å; Y90-Y328 HydrophobicContact CG-CE1 4.43Å; Y90-Y328 AromaticContact CZ-CD1 3.84Å; Y90-Y328 AromaticContact CZ-CD2 3.76Å; Y90-Y328 AromaticContact CZ-CE1 3.9Å; Y90-Y328 AromaticContact CZ-CE2 3.84Å; Y90-Y328 AromaticContact CZ-CG 3.75Å; Y90-Y328 AromaticContact CZ-CZ 3.91Å; Y90-Y328 VanDerWaalsContact OH-CD2 3.29Å; Y90-Y328 WeakPolarHBondContact OH-CD2 3.43Å; Y90-Y328 WeakPolarHBondContact OH-CE2 3.49Å
91	G	94.3	Very high	93.9	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.114	C	C	.	.	S	Bend	trans	130.6	-179.4	-178.9	0	0	0	0	0	112.5	K97 S244	G91-K97 PolarHBondContact O-NZ 3.28Å; G91-S244 PolarHBondContact O-N 2.88Å; G91-S244 PolarHBondContact O-OG 3Å
92	Q	90.3	Very high	93.9	Very high	16 Å²	16	18.3 Å²	18.3	8%	0.075	11%	0.107	C	C	.	.	S	Bend	trans	-65.3	166.9	-175.1	67.6	170.5	95.3	0	0	113.8	S95 K97 S244 E245 N318 E321	Q92-S95 VanDerWaalsContact O-CB 3.3Å; Q92-S95 WeakPolarHBondContact O-CB 3.47Å; Q92-S95 PolarHBondContact O-N 3.32Å; Q92-S95 PolarHBondContact O-OG 3.04Å; Q92-K97 PolarHBondContact O-NZ 2.96Å; Q92-K97 VanDerWaalsContact O-NZ 3.07Å; Q92-S244 PolarHBondContact N-OG 2.83Å; Q92-E245 WeakPolarHBondContact CA-OE2 3.43Å; Q92-E245 HydrophobicContact CB-CB 4.28Å; Q92-N318 PolarHBondContact NE2-OD1 3.26Å; Q92-N318 VanDerWaalsContact OE1-CB 3.28Å; Q92-N318 VanDerWaalsContact OE1-CG 3.31Å; Q92-N318 PolarHBondContact OE1-OD1 3.19Å; Q92-E321 HydrophobicContact CB-CB 4.32Å
93	T	87.6	Confident	93.9	Very high	36 Å²	36	18.9 Å²	18.9	22%	0.221	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	138.2	166.5	-67.3	0	0	0	0	111.4	S95 S208 G243 E245	T93-S95 PolarHBondContact O-N 3.23Å; T93-S208 WeakPolarHBondContact OG1-CB 3.4Å; T93-G243 WeakPolarHBondContact OG1-CA 3.33Å; T93-E245 WeakPolarHBondContact CB-OE1 3.49Å; T93-E245 PolarHBondContact N-OE2 3.48Å; T93-E245 VanDerWaalsContact OG1-CD 3.25Å; T93-E245 PolarHBondContact OG1-OE1 2.86Å; T93-E245 PolarHBondContact OG1-OE2 3.19Å
94	G	86.8	Confident	93.5	Very high	51 Å²	51	20.1 Å²	20.1	53%	0.526	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.9	12.6	-177.1	0	0	0	0	0	115	R13	R13-G94 PolarHBondContact NE-O 2.95Å; R13-G94 PolarHBondContact NH2-O 3.21Å; R13-G94 VanDerWaalsContact NH2-O 3.13Å
95	S	91.3	Very high	93	Very high	2 Å²	2	24.3 Å²	24.3	1%	0.014	15%	0.151	C	C	.	.	S	Bend	trans	-79.5	-17.5	174.6	59.4	0	0	0	0	114.6	R13 Q92 T93 C311	R13-S95 WeakPolarHBondContact CG-O 3.49Å; Q92-S95 VanDerWaalsContact O-CB 3.3Å; Q92-S95 WeakPolarHBondContact O-CB 3.47Å; Q92-S95 PolarHBondContact O-N 3.32Å; Q92-S95 PolarHBondContact O-OG 3.04Å; T93-S95 PolarHBondContact O-N 3.23Å; S95-C311 WeakPolarHBondContact CB-O 3.37Å; S95-C311 WeakPolarHBondContact OG-CB 3.37Å
96	G	92.2	Very high	92.3	Very high	18 Å²	18	30.3 Å²	30.3	19%	0.186	18%	0.184	C	C	.	.	S	Bend	trans	110.3	18.5	-179.8	0	0	0	0	0	116.1	F99 T100	G96-F99 PolarHBondContact O-N 2.92Å; G96-T100 PolarHBondContact O-N 2.82Å; G96-T100 PolarHBondContact O-OG1 3.25Å
97	K	94	Very high	91.9	Very high	13 Å²	13	33.3 Å²	33.3	6%	0.057	20%	0.203	C	C	.	.	H	α-helix	trans	-54.3	-65.2	175.6	-59.4	-167.4	-62.9	-80.5	0	112.9	A89 G91 Q92 F99 T100 M101 D240 L241 A242 C311	A89-K97 HydrophobicContact CB-CB 3.81Å; A89-K97 HydrophobicContact CB-CG 4.18Å; G91-K97 PolarHBondContact O-NZ 3.28Å; Q92-K97 PolarHBondContact O-NZ 2.96Å; Q92-K97 VanDerWaalsContact O-NZ 3.07Å; K97-F99 PolarHBondContact O-N 3.49Å; K97-T100 WeakPolarHBondContact O-CA 3.42Å; K97-T100 PolarHBondContact O-N 2.67Å; K97-M101 PolarHBondContact O-N 2.95Å; K97-D240 VanDerWaalsContact CB-OD1 3.28Å; K97-D240 WeakPolarHBondContact CB-OD1 3.17Å; K97-L241 WeakPolarHBondContact CE-O 3.22Å; K97-A242 WeakPolarHBondContact CE-O 3.39Å; K97-A242 PolarHBondContact NZ-O 3.34Å; K97-A242 VanDerWaalsContact NZ-O 3.08Å; K97-C311 HydrophobicContact CG-CB 4.09Å
98	S	91.8	Very high	91.4	Very high	28 Å²	28	37 Å²	37	20%	0.196	23%	0.227	C	C	.	.	H	α-helix	trans	-63.1	-29.1	178.6	-35	0	0	0	0	112.7	T100 M101 Q102 G103 D240	S98-T100 VanDerWaalsContact C-N 3.29Å; S98-T100 PolarHBondContact O-N 3.48Å; S98-M101 PolarHBondContact O-N 2.93Å; S98-Q102 WeakPolarHBondContact O-CA 3.44Å; S98-Q102 WeakPolarHBondContact O-CB 3.21Å; S98-Q102 PolarHBondContact O-N 3.43Å; S98-G103 PolarHBondContact O-N 3.04Å; S98-D240 WeakPolarHBondContact CA-OD1 3.39Å; S98-D240 WeakPolarHBondContact CB-OD2 3.48Å; S98-D240 PolarHBondContact N-OD1 2.92Å; S98-D240 VanDerWaalsContact N-OD1 3.08Å; S98-D240 VanDerWaalsContact OG-CG 3.31Å; S98-D240 PolarHBondContact OG-OD1 3.49Å; S98-D240 PolarHBondContact OG-OD2 2.93Å
99	F	93.2	Very high	91	Very high	74 Å²	74	38.2 Å²	38.2	33%	0.325	24%	0.235	S	C	.	.	H	α-helix	trans	-67.8	-25.7	171.3	-178.6	-90.1	0	0	0	113	G96 K97 G103 L104 Q110	G96-F99 PolarHBondContact O-N 2.92Å; K97-F99 PolarHBondContact O-N 3.49Å; F99-G103 WeakPolarHBondContact O-CA 3.26Å; F99-G103 PolarHBondContact O-N 2.94Å; F99-L104 HydrophobicContact CD2-CG 4.39Å; F99-L104 HydrophobicContact CE2-CD1 3.93Å; F99-L104 HydrophobicContact CE2-CG 3.87Å; F99-Q110 HydrophobicContact CZ-CB 4.41Å; F99-Q110 HydrophobicContact CZ-CG 4.44Å
100	T	95.8	Very high	90.6	Very high	0 Å²	0	40 Å²	40	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-89.2	-34.5	175.2	-52.1	0	0	0	0	111.3	R11 T64 G96 K97 S98 G112 I113 V309	R11-T100 WeakPolarHBondContact CD-OG1 3.5Å; R11-T100 PolarHBondContact NH1-OG1 3.2Å; T64-T100 HydrophobicContact CG2-CG2 4.28Å; G96-T100 PolarHBondContact O-N 2.82Å; G96-T100 PolarHBondContact O-OG1 3.25Å; K97-T100 WeakPolarHBondContact O-CA 3.42Å; K97-T100 PolarHBondContact O-N 2.67Å; S98-T100 VanDerWaalsContact C-N 3.29Å; S98-T100 PolarHBondContact O-N 3.48Å; T100-G112 WeakPolarHBondContact O-CA 3.26Å; T100-I113 HydrophobicContact CG2-CD1 3.87Å; T100-I113 HydrophobicContact CG2-CG1 4.4Å; T100-I113 WeakPolarHBondContact O-CG1 3.21Å; T100-I113 PolarHBondContact O-N 3.19Å; T100-V309 HydrophobicContact CG2-CG1 3.97Å
101	M	95.5	Very high	90.5	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.01	25%	0.249	C	C	.	.	H	α-helix	trans	-76.2	-53.7	177.4	-61.2	-53.7	-66.1	0	0	112.8	I87 A89 K97 S98 G112 I113 I114 L238 D240	I87-M101 HydrophobicContact CG2-CE 4.43Å; I87-M101 HydrophobicContact CG2-SD 4.41Å; A89-M101 HydrophobicContact CB-CG 3.64Å; A89-M101 HydrophobicContact CB-SD 3.89Å; K97-M101 PolarHBondContact O-N 2.95Å; S98-M101 PolarHBondContact O-N 2.93Å; M101-G112 CarbonylContact O-C 3.58Å; M101-G112 WeakPolarHBondContact O-CA 3.48Å; M101-I113 PolarHBondContact O-N 3.32Å; M101-I113 VanDerWaalsContact O-N 3.16Å; M101-I113 HydrophobicContact SD-CD1 4.46Å; M101-I114 HydrophobicContact CB-CD1 3.87Å; M101-I114 HydrophobicContact CB-CG1 4.3Å; M101-I114 HydrophobicContact CE-CD1 4.33Å; M101-I114 HydrophobicContact CE-CG1 4.15Å; M101-I114 VanDerWaalsContact O-CB 3.26Å; M101-I114 WeakPolarHBondContact O-CB 3.27Å; M101-I114 VanDerWaalsContact O-CG1 3.23Å; M101-I114 WeakPolarHBondContact O-CG1 3.49Å; M101-I114 PolarHBondContact O-N 3.21Å; M101-L238 HydrophobicContact CE-CB 4.02Å; M101-L238 HydrophobicContact CE-CD2 4.16Å; M101-D240 HydrophobicContact CB-CB 4.38Å; M101-D240 HydrophobicContact CG-CB 4.16Å
102	Q	91.9	Very high	90.6	Very high	54 Å²	54	41.4 Å²	41.4	25%	0.252	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-43.1	179.5	-179	177.8	42.9	0	0	112.7	S98 G112 M189 W193	S98-Q102 WeakPolarHBondContact O-CA 3.44Å; S98-Q102 WeakPolarHBondContact O-CB 3.21Å; S98-Q102 PolarHBondContact O-N 3.43Å; Q102-G112 VanDerWaalsContact O-CA 3.3Å; Q102-G112 WeakPolarHBondContact O-CA 3.49Å; Q102-G112 PolarHBondContact O-N 3.15Å; Q102-M189 HydrophobicContact CB-CE 3.75Å; Q102-M189 HydrophobicContact CG-CE 3.62Å; Q102-W193 VanDerWaalsContact OE1-CH2 3.26Å
103	G	91.3	Very high	90.9	Very high	12 Å²	12	40.7 Å²	40.7	12%	0.124	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	68.7	-157.2	-178.5	0	0	0	0	0	114.4	S98 F99 Q110	S98-G103 PolarHBondContact O-N 3.04Å; F99-G103 WeakPolarHBondContact O-CA 3.26Å; F99-G103 PolarHBondContact O-N 2.94Å; G103-Q110 VanDerWaalsContact CA-O 3.29Å; G103-Q110 WeakPolarHBondContact CA-O 3.35Å
104	L	87.8	Confident	91.3	Very high	82 Å²	82	39.3 Å²	39.3	43%	0.429	24%	0.237	S	C	.	.			trans	-110.7	143.7	174.9	-62.1	176.8	0	0	0	109.7	F99 D106 Q110 R111	F99-L104 HydrophobicContact CD2-CG 4.39Å; F99-L104 HydrophobicContact CE2-CD1 3.93Å; F99-L104 HydrophobicContact CE2-CG 3.87Å; L104-D106 PolarHBondContact O-N 2.78Å; L104-Q110 HydrophobicContact CB-CB 4.3Å; L104-Q110 PolarHBondContact N-O 3.02Å; L104-Q110 CarbonylContact O-C 3.46Å; L104-R111 VanDerWaalsContact O-CA 3.26Å; L104-R111 WeakPolarHBondContact O-CA 3.49Å; L104-R111 WeakPolarHBondContact O-CG 3.22Å; L104-R111 PolarHBondContact O-N 3.36Å
105	P	84.2	Confident	91.7	Very high	110 Å²	110	37.3 Å²	37.3	71%	0.714	22%	0.215	S	C	*	.	S	Bend	trans	-62.1	-33.2	173.1	-22.9	34.2	0	0	0	113.2
106	D	84.1	Confident	91.9	Very high	127 Å²	127	38.3 Å²	38.3	68%	0.679	22%	0.218	S	C	*	.	S	Bend	trans	-138.9	132.9	-175.3	-176.2	47.2	0	0	0	109	L104	L104-D106 PolarHBondContact O-N 2.78Å
107	P	88.9	Confident	92.2	Very high	62 Å²	62	37.5 Å²	37.5	40%	0.403	21%	0.209	S	C	.	.	S	Bend	cis	-68.8	151.4	-5.7	30.8	-36	0	0	0	112.7	C109 Q110	P107-C109 VanDerWaalsContact C-N 3.25Å; P107-C109 PolarHBondContact O-N 3.18Å; P107-C109 VanDerWaalsContact O-N 3.1Å; P107-Q110 HydrophobicContact CG-CB 4.39Å; P107-Q110 HydrophobicContact CG-CG 3.92Å; P107-Q110 PolarHBondContact O-N 3.22Å
108	P	88.5	Confident	92.3	Very high	79 Å²	79	36.9 Å²	36.9	51%	0.513	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-53.7	-34.4	-176.2	-30.3	36.3	0	0	0	115.3	Q110 R111 R116	P108-Q110 PolarHBondContact O-N 2.88Å; P108-Q110 VanDerWaalsContact O-N 3.09Å; P108-R111 WeakPolarHBondContact O-CB 3.44Å; P108-R111 PolarHBondContact O-N 3.44Å; P108-R116 PolarHBondContact O-NH2 3.1Å
109	C	88.1	Confident	92.4	Very high	27 Å²	27	38.8 Å²	38.8	18%	0.182	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-61	-17.7	176.3	61.7	0	0	0	0	114.1	F63 T64 E65 P107	F63-C109 HydrophobicContact CB-CB 4.19Å; F63-C109 HydrophobicContact CD1-CB 4.12Å; F63-C109 VanDerWaalsContact CD1-SG 3.56Å; F63-C109 HydrophobicContact CG-CB 4.1Å; T64-C109 PolarHBondContact N-O 2.81Å; E65-C109 HydrophobicContact CB-CB 4.35Å; E65-C109 PolarHBondContact N-O 2.83Å; E65-C109 VanDerWaalsContact N-O 3.16Å; E65-C109 WeakPolarHBondContact OE2-CA 3.3Å; E65-C109 VanDerWaalsContact OE2-CB 3.23Å; E65-C109 WeakPolarHBondContact OE2-CB 3.36Å; P107-C109 VanDerWaalsContact C-N 3.25Å; P107-C109 PolarHBondContact O-N 3.18Å; P107-C109 VanDerWaalsContact O-N 3.1Å
110	Q	88.7	Confident	92.5	Very high	36 Å²	36	35.6 Å²	35.6	17%	0.168	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-98.3	1.7	175.1	-61.8	-69.9	16	0	0	114	F63 F99 G103 L104 P107 P108 G112	F63-Q110 HydrophobicContact CD1-CG 4.36Å; F99-Q110 HydrophobicContact CZ-CB 4.41Å; F99-Q110 HydrophobicContact CZ-CG 4.44Å; G103-Q110 VanDerWaalsContact CA-O 3.29Å; G103-Q110 WeakPolarHBondContact CA-O 3.35Å; L104-Q110 HydrophobicContact CB-CB 4.3Å; L104-Q110 PolarHBondContact N-O 3.02Å; L104-Q110 CarbonylContact O-C 3.46Å; P107-Q110 HydrophobicContact CG-CB 4.39Å; P107-Q110 HydrophobicContact CG-CG 3.92Å; P107-Q110 PolarHBondContact O-N 3.22Å; P108-Q110 PolarHBondContact O-N 2.88Å; P108-Q110 VanDerWaalsContact O-N 3.09Å; Q110-G112 PolarHBondContact O-N 3.39Å
111	R	94.3	Very high	92.5	Very high	41 Å²	41	35.6 Å²	35.6	16%	0.155	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-60.7	135.7	168.6	-74.5	175.8	73.2	-142	14.3	110	L104 P108 P115 R116 E119 E186	L104-R111 VanDerWaalsContact O-CA 3.26Å; L104-R111 WeakPolarHBondContact O-CA 3.49Å; L104-R111 WeakPolarHBondContact O-CG 3.22Å; L104-R111 PolarHBondContact O-N 3.36Å; P108-R111 WeakPolarHBondContact O-CB 3.44Å; P108-R111 PolarHBondContact O-N 3.44Å; R111-P115 HydrophobicContact CB-CG 4.14Å; R111-R116 WeakPolarHBondContact O-CD 3.46Å; R111-R116 PolarHBondContact O-NE 3.22Å; R111-E119 IonicContact CZ-OE1 3.26Å; R111-E119 IonicContact CZ-OE2 3.56Å; R111-E119 IonicContact NH1-OE1 2.68Å; R111-E119 PolarHBondContact NH1-OE1 3.43Å; R111-E119 IonicContact NH1-OE2 3.36Å; R111-E119 PolarHBondContact NH1-OE2 3.03Å; R111-E119 VanDerWaalsContact NH2-CD 3.29Å; R111-E119 IonicContact NH2-OE1 3.4Å; R111-E119 PolarHBondContact NH2-OE1 2.81Å; R111-E119 IonicContact NH2-OE2 2.69Å; R111-E119 PolarHBondContact NH2-OE2 3.19Å; R111-E186 IonicContact CZ-OE1 3.49Å; R111-E186 IonicContact NH2-OE1 3.22Å; R111-E186 PolarHBondContact NH2-OE1 3.14Å
112	G	95.7	Very high	92.4	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.2	C	C	.	.			trans	-70.5	175.5	-171.9	0	0	0	0	0	114.9	T100 M101 Q102 Q110 I114 P115 R116	T100-G112 WeakPolarHBondContact O-CA 3.26Å; M101-G112 CarbonylContact O-C 3.58Å; M101-G112 WeakPolarHBondContact O-CA 3.48Å; Q102-G112 VanDerWaalsContact O-CA 3.3Å; Q102-G112 WeakPolarHBondContact O-CA 3.49Å; Q102-G112 PolarHBondContact O-N 3.15Å; Q110-G112 PolarHBondContact O-N 3.39Å; G112-I114 PolarHBondContact O-N 3.32Å; G112-P115 WeakPolarHBondContact O-CD 3.43Å; G112-P115 WeakPolarHBondContact O-CG 3.19Å; G112-R116 WeakPolarHBondContact O-CB 3.43Å; G112-R116 WeakPolarHBondContact O-CG 3.43Å; G112-R116 PolarHBondContact O-N 2.92Å
113	I	97.1	Very high	92.5	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-58.8	-35	174.3	-66	174.7	0	0	0	111.7	T64 Y68 A72 I87 T100 M101 A117 L238 V309	T64-I113 HydrophobicContact CG2-CG1 4.35Å; Y68-I113 HydrophobicContact CD2-CB 4.36Å; Y68-I113 HydrophobicContact CD2-CG1 4.35Å; Y68-I113 HydrophobicContact CD2-CG2 4.13Å; Y68-I113 HydrophobicContact CE2-CG2 4.25Å; A72-I113 HydrophobicContact CB-CG2 4.48Å; I87-I113 HydrophobicContact CD1-CG2 3.58Å; I87-I113 HydrophobicContact CG2-CD1 4.17Å; I87-I113 HydrophobicContact CG2-CG2 4.3Å; T100-I113 HydrophobicContact CG2-CD1 3.87Å; T100-I113 HydrophobicContact CG2-CG1 4.4Å; T100-I113 WeakPolarHBondContact O-CG1 3.21Å; T100-I113 PolarHBondContact O-N 3.19Å; M101-I113 PolarHBondContact O-N 3.32Å; M101-I113 VanDerWaalsContact O-N 3.16Å; M101-I113 HydrophobicContact SD-CD1 4.46Å; I113-A117 WeakPolarHBondContact O-CB 3.2Å; I113-A117 PolarHBondContact O-N 2.85Å; I113-L238 HydrophobicContact CG2-CD2 4.07Å; I113-V309 HydrophobicContact CD1-CG2 4.19Å
114	I	96.1	Very high	92.4	Very high	7 Å²	7	39.8 Å²	39.8	4%	0.036	22%	0.217	C	C	.	.	H	α-helix	trans	-65.3	-59.2	-178.4	-63.3	172.3	0	0	0	112.4	M101 G112 R116 A117 F118 M189 L238	M101-I114 HydrophobicContact CB-CD1 3.87Å; M101-I114 HydrophobicContact CB-CG1 4.3Å; M101-I114 HydrophobicContact CE-CD1 4.33Å; M101-I114 HydrophobicContact CE-CG1 4.15Å; M101-I114 VanDerWaalsContact O-CB 3.26Å; M101-I114 WeakPolarHBondContact O-CB 3.27Å; M101-I114 VanDerWaalsContact O-CG1 3.23Å; M101-I114 WeakPolarHBondContact O-CG1 3.49Å; M101-I114 PolarHBondContact O-N 3.21Å; G112-I114 PolarHBondContact O-N 3.32Å; I114-R116 VanDerWaalsContact C-N 3.28Å; I114-R116 PolarHBondContact O-N 2.85Å; I114-A117 PolarHBondContact O-N 3.45Å; I114-A117 VanDerWaalsContact O-N 3.15Å; I114-F118 HydrophobicContact CG2-CD1 4.47Å; I114-F118 HydrophobicContact CG2-CE1 3.66Å; I114-F118 HydrophobicContact CG2-CE2 3.77Å; I114-F118 HydrophobicContact CG2-CZ 3.26Å; I114-F118 WeakPolarHBondContact O-CD1 3.36Å; I114-F118 WeakPolarHBondContact O-CG 3.44Å; I114-F118 PolarHBondContact O-N 3.14Å; I114-M189 HydrophobicContact CB-CE 3.91Å; I114-M189 HydrophobicContact CB-SD 4.3Å; I114-M189 HydrophobicContact CD1-CE 3.66Å; I114-M189 HydrophobicContact CG1-CE 4.37Å; I114-M189 HydrophobicContact CG2-CE 3.64Å; I114-M189 HydrophobicContact CG2-SD 3.52Å; I114-M189 VanDerWaalsContact CG2-SD 3.52Å; I114-L238 HydrophobicContact CB-CD1 4.43Å; I114-L238 HydrophobicContact CD1-CB 4.29Å; I114-L238 HydrophobicContact CG1-CB 3.9Å; I114-L238 HydrophobicContact CG1-CD1 4.08Å; I114-L238 HydrophobicContact CG1-CD2 4.3Å; I114-L238 HydrophobicContact CG1-CG 4.3Å; I114-L238 HydrophobicContact CG2-CD1 4.22Å
115	P	95.5	Very high	92.5	Very high	10 Å²	10	37.4 Å²	37.4	7%	0.065	21%	0.206	C	C	.	.	H	α-helix	trans	-60.9	-36.5	178.3	21.8	-32.8	0	0	0	112.6	R111 G112 A117 F118 E119	R111-P115 HydrophobicContact CB-CG 4.14Å; G112-P115 WeakPolarHBondContact O-CD 3.43Å; G112-P115 WeakPolarHBondContact O-CG 3.19Å; P115-A117 PolarHBondContact O-N 2.86Å; P115-F118 WeakPolarHBondContact O-CB 3.41Å; P115-F118 PolarHBondContact O-N 2.84Å; P115-F118 VanDerWaalsContact O-N 3.13Å; P115-E119 PolarHBondContact O-N 2.73Å; P115-E119 VanDerWaalsContact O-N 3.07Å
116	R	96.3	Very high	92.7	Very high	23 Å²	23	39.6 Å²	39.6	9%	0.087	21%	0.207	C	C	.	.	H	α-helix	trans	-65.1	-37.3	175.2	-70	175	175.2	-84.4	-10.8	112.8	E65 Y68 P108 R111 G112 I114 F118 E119 H120	E65-R116 IonicContact OE1-CZ 3.31Å; E65-R116 IonicContact OE1-NH1 3.84Å; E65-R116 PolarHBondContact OE1-NH1 3.02Å; E65-R116 IonicContact OE1-NH2 2.68Å; E65-R116 PolarHBondContact OE1-NH2 2.87Å; E65-R116 IonicContact OE2-NH2 3.71Å; Y68-R116 HydrophobicContact CD1-CB 4.03Å; Y68-R116 HydrophobicContact CD2-CB 3.68Å; Y68-R116 HydrophobicContact CE1-CB 4.1Å; Y68-R116 HydrophobicContact CE2-CB 3.76Å; Y68-R116 HydrophobicContact CG-CB 3.84Å; Y68-R116 HydrophobicContact CG-CG 4.48Å; P108-R116 PolarHBondContact O-NH2 3.1Å; R111-R116 WeakPolarHBondContact O-CD 3.46Å; R111-R116 PolarHBondContact O-NE 3.22Å; G112-R116 WeakPolarHBondContact O-CB 3.43Å; G112-R116 WeakPolarHBondContact O-CG 3.43Å; G112-R116 PolarHBondContact O-N 2.92Å; I114-R116 VanDerWaalsContact C-N 3.28Å; I114-R116 PolarHBondContact O-N 2.85Å; R116-F118 VanDerWaalsContact C-N 3.33Å; R116-E119 PolarHBondContact O-N 3.11Å; R116-H120 WeakPolarHBondContact O-CB 3.22Å; R116-H120 PolarHBondContact O-N 3.35Å
117	A	97.1	Very high	92.8	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-68	-29.6	172	0	0	0	0	0	113	Y68 V76 I113 I114 P115 V121 L236 L238	Y68-A117 HydrophobicContact CE2-CB 4.27Å; V76-A117 HydrophobicContact CG1-CB 4.47Å; V76-A117 HydrophobicContact CG2-CB 4.16Å; I113-A117 WeakPolarHBondContact O-CB 3.2Å; I113-A117 PolarHBondContact O-N 2.85Å; I114-A117 PolarHBondContact O-N 3.45Å; I114-A117 VanDerWaalsContact O-N 3.15Å; P115-A117 PolarHBondContact O-N 2.86Å; A117-V121 VanDerWaalsContact O-CB 3.29Å; A117-V121 WeakPolarHBondContact O-CB 3.38Å; A117-V121 WeakPolarHBondContact O-CG2 3.35Å; A117-V121 PolarHBondContact O-N 3.42Å; A117-V121 VanDerWaalsContact O-N 3.08Å; A117-L236 HydrophobicContact CB-CD2 3.92Å; A117-L238 HydrophobicContact CB-CD1 4.32Å
118	F	95.8	Very high	92.6	Very high	1 Å²	1	36.9 Å²	36.9	0%	0.004	20%	0.201	C	C	.	.	H	α-helix	trans	-66.5	-44.9	171.2	-58.1	-21.9	0	0	0	111.3	I114 P115 R116 F122 V182 C185 E186 M189 F214 I216	I114-F118 HydrophobicContact CG2-CD1 4.47Å; I114-F118 HydrophobicContact CG2-CE1 3.66Å; I114-F118 HydrophobicContact CG2-CE2 3.77Å; I114-F118 HydrophobicContact CG2-CZ 3.26Å; I114-F118 WeakPolarHBondContact O-CD1 3.36Å; I114-F118 WeakPolarHBondContact O-CG 3.44Å; I114-F118 PolarHBondContact O-N 3.14Å; P115-F118 WeakPolarHBondContact O-CB 3.41Å; P115-F118 PolarHBondContact O-N 2.84Å; P115-F118 VanDerWaalsContact O-N 3.13Å; R116-F118 VanDerWaalsContact C-N 3.33Å; F118-F122 WeakPolarHBondContact O-CD2 3.37Å; F118-F122 PolarHBondContact O-N 3.27Å; F118-F122 VanDerWaalsContact O-N 3.08Å; F118-V182 HydrophobicContact CB-CG1 4.09Å; F118-C185 HydrophobicContact CB-CB 4.16Å; F118-C185 HydrophobicContact CD1-CB 3.89Å; F118-C185 HydrophobicContact CD2-CB 3.5Å; F118-C185 VanDerWaalsContact CD2-CB 3.5Å; F118-C185 HydrophobicContact CE1-CB 4.09Å; F118-C185 HydrophobicContact CE2-CB 3.71Å; F118-C185 HydrophobicContact CG-CB 3.59Å; F118-C185 HydrophobicContact CZ-CB 4Å; F118-E186 HydrophobicContact CD2-CG 4Å; F118-E186 HydrophobicContact CE2-CG 4.39Å; F118-M189 HydrophobicContact CE2-CB 4.08Å; F118-M189 HydrophobicContact CE2-SD 4Å; F118-M189 HydrophobicContact CZ-CB 4.2Å; F118-M189 HydrophobicContact CZ-SD 4.26Å; F118-F214 HydrophobicContact CE1-CD1 4.03Å; F118-F214 AromaticContact CE1-CE1 3.46Å; F118-F214 HydrophobicContact CE1-CE1 3.46Å; F118-F214 VanDerWaalsContact CE1-CE1 3.46Å; F118-F214 AromaticContact CE1-CZ 3.85Å; F118-F214 HydrophobicContact CE1-CZ 3.85Å; F118-F214 HydrophobicContact CZ-CD1 4.23Å; F118-F214 AromaticContact CZ-CE1 3.65Å; F118-F214 HydrophobicContact CZ-CE1 3.65Å; F118-F214 HydrophobicContact CZ-CE2 4.1Å; F118-F214 AromaticContact CZ-CZ 3.56Å; F118-F214 HydrophobicContact CZ-CZ 3.56Å; F118-I216 HydrophobicContact CD1-CD1 3.72Å; F118-I216 HydrophobicContact CE1-CD1 3.89Å; F118-I216 HydrophobicContact CE1-CG1 4.4Å
119	E	95.1	Very high	92.2	Very high	67 Å²	67	41 Å²	41	31%	0.313	21%	0.213	S	C	.	.	H	α-helix	trans	-62.2	-54.8	179.5	-71.7	170.1	149.5	0	0	111.2	R111 P115 R116 V121 F122 E123 V182	R111-E119 IonicContact CZ-OE1 3.26Å; R111-E119 IonicContact CZ-OE2 3.56Å; R111-E119 IonicContact NH1-OE1 2.68Å; R111-E119 PolarHBondContact NH1-OE1 3.43Å; R111-E119 IonicContact NH1-OE2 3.36Å; R111-E119 PolarHBondContact NH1-OE2 3.03Å; R111-E119 VanDerWaalsContact NH2-CD 3.29Å; R111-E119 IonicContact NH2-OE1 3.4Å; R111-E119 PolarHBondContact NH2-OE1 2.81Å; R111-E119 IonicContact NH2-OE2 2.69Å; R111-E119 PolarHBondContact NH2-OE2 3.19Å; P115-E119 PolarHBondContact O-N 2.73Å; P115-E119 VanDerWaalsContact O-N 3.07Å; R116-E119 PolarHBondContact O-N 3.11Å; E119-V121 PolarHBondContact O-N 3.31Å; E119-F122 PolarHBondContact O-N 3.04Å; E119-F122 VanDerWaalsContact O-N 3.14Å; E119-E123 WeakPolarHBondContact O-CB 3.26Å; E119-E123 PolarHBondContact O-N 2.87Å; E119-V182 HydrophobicContact CG-CG1 3.76Å; E119-V182 HydrophobicContact CG-CG2 4.08Å
120	H	95.7	Very high	91.9	Very high	7 Å²	7	46.2 Å²	46.2	3%	0.032	24%	0.239	C	C	.	.	H	α-helix	trans	-54.6	-49.4	176.6	-177.2	-179.4	0	0	0	112.2	Y68 Y73 V76 E77 R116 F122 E123 S124	Y68-H120 AromaticContact CZ-ND1 3.95Å; Y68-H120 WeakPolarHBondContact OH-CB 3.49Å; Y68-H120 PolarHBondContact OH-ND1 2.61Å; Y73-H120 AromaticContact CD2-CE1 3.2Å; Y73-H120 WeakPolarHBondContact CD2-CE1 3.47Å; Y73-H120 AromaticContact CD2-ND1 3.41Å; Y73-H120 WeakPolarHBondContact CD2-ND1 3.06Å; Y73-H120 AromaticContact CD2-NE2 3.87Å; Y73-H120 AromaticContact CE2-CD2 3.89Å; Y73-H120 AromaticContact CE2-CE1 3.22Å; Y73-H120 WeakPolarHBondContact CE2-CE1 3.26Å; Y73-H120 AromaticContact CE2-ND1 3.66Å; Y73-H120 AromaticContact CE2-NE2 3.37Å; Y73-H120 WeakPolarHBondContact CE2-NE2 3.45Å; Y73-H120 AromaticContact CG-CE1 3.72Å; Y73-H120 AromaticContact CZ-CE1 3.77Å; Y73-H120 AromaticContact CZ-NE2 3.71Å; Y73-H120 PolarHBondContact O-CE1 3.37Å; V76-H120 HydrophobicContact CG1-CB 4.27Å; V76-H120 WeakPolarHBondContact CG1-ND1 3.45Å; E77-H120 IonicContact OE2-NE2 3.93Å; E77-H120 PolarHBondContact OE2-NE2 2.99Å; R116-H120 WeakPolarHBondContact O-CB 3.22Å; R116-H120 PolarHBondContact O-N 3.35Å; H120-F122 VanDerWaalsContact C-N 3.32Å; H120-F122 PolarHBondContact O-N 2.95Å; H120-E123 PolarHBondContact O-N 2.86Å; H120-E123 VanDerWaalsContact O-N 3.15Å; H120-S124 PolarHBondContact CD2-OG 3.42Å; H120-S124 PolarHBondContact O-N 2.84Å; H120-S124 PolarHBondContact O-OG 2.96Å
121	V	95.1	Very high	91.8	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.006	24%	0.243	C	C	.	.	H	α-helix	trans	-59.4	-41.7	178.6	165.1	0	0	0	0	111.9	V76 T80 A117 E119 V125 I218	V76-V121 HydrophobicContact CG1-CG2 3.86Å; T80-V121 HydrophobicContact CG2-CG2 4.36Å; A117-V121 VanDerWaalsContact O-CB 3.29Å; A117-V121 WeakPolarHBondContact O-CB 3.38Å; A117-V121 WeakPolarHBondContact O-CG2 3.35Å; A117-V121 PolarHBondContact O-N 3.42Å; A117-V121 VanDerWaalsContact O-N 3.08Å; E119-V121 PolarHBondContact O-N 3.31Å; V121-V125 WeakPolarHBondContact O-CB 3.06Å; V121-V125 WeakPolarHBondContact O-CG2 3.35Å; V121-V125 PolarHBondContact O-N 3.15Å; V121-V125 VanDerWaalsContact O-N 3.16Å; V121-I218 HydrophobicContact CG1-CD1 3.66Å; V121-I218 HydrophobicContact CG1-CG1 4.42Å; V121-I218 HydrophobicContact CG2-CD1 4.07Å
122	F	94.2	Very high	91.6	Very high	9 Å²	9	51.2 Å²	51.2	4%	0.039	27%	0.265	C	S	.	.	H	α-helix	trans	-77.7	-22.1	178.3	-82.6	-69.8	0	0	0	114	F118 E119 H120 Q126 V135 V179 H180 N181 V182	F118-F122 WeakPolarHBondContact O-CD2 3.37Å; F118-F122 PolarHBondContact O-N 3.27Å; F118-F122 VanDerWaalsContact O-N 3.08Å; E119-F122 PolarHBondContact O-N 3.04Å; E119-F122 VanDerWaalsContact O-N 3.14Å; H120-F122 VanDerWaalsContact C-N 3.32Å; H120-F122 PolarHBondContact O-N 2.95Å; F122-Q126 WeakPolarHBondContact O-CB 3.32Å; F122-Q126 VanDerWaalsContact O-CG 3.26Å; F122-Q126 WeakPolarHBondContact O-CG 3.39Å; F122-Q126 PolarHBondContact O-N 3.33Å; F122-Q126 PolarHBondContact O-NE2 2.87Å; F122-V135 HydrophobicContact CE1-CG2 4.3Å; F122-V135 HydrophobicContact CZ-CB 4.22Å; F122-V135 HydrophobicContact CZ-CG1 4.29Å; F122-V135 HydrophobicContact CZ-CG2 4.32Å; F122-V179 HydrophobicContact CZ-CB 4.41Å; F122-V179 HydrophobicContact CZ-CG2 4.28Å; F122-H180 VanDerWaalsContact CE1-C 3.4Å; F122-N181 VanDerWaalsContact CE2-C 3.44Å; F122-V182 HydrophobicContact CB-CG2 3.82Å; F122-V182 HydrophobicContact CD2-CG2 3.97Å; F122-V182 HydrophobicContact CG-CG2 4.22Å
123	E	93.4	Very high	91.4	Very high	123 Å²	123	53.5 Å²	53.5	58%	0.575	28%	0.275	S	S	*	.	H	α-helix	trans	-70.3	-53.2	171.9	-173.2	167.7	-152.2	0	0	110.5	E119 H120 V125 Q126 C127	E119-E123 WeakPolarHBondContact O-CB 3.26Å; E119-E123 PolarHBondContact O-N 2.87Å; H120-E123 PolarHBondContact O-N 2.86Å; H120-E123 VanDerWaalsContact O-N 3.15Å; E123-V125 VanDerWaalsContact C-N 3.25Å; E123-V125 PolarHBondContact O-N 2.84Å; E123-Q126 PolarHBondContact O-N 3.14Å; E123-C127 PolarHBondContact O-N 3.39Å
124	S	89.8	Confident	91.1	Very high	23 Å²	23	56.7 Å²	56.7	16%	0.161	29%	0.292	C	S	.	.	H	α-helix	trans	-59	-36.1	175.6	-49	0	0	0	0	112.3	H120 Q126 A128	H120-S124 PolarHBondContact CD2-OG 3.42Å; H120-S124 PolarHBondContact O-N 2.84Å; H120-S124 PolarHBondContact O-OG 2.96Å; S124-Q126 VanDerWaalsContact C-N 3.33Å; S124-Q126 PolarHBondContact O-N 3.16Å; S124-A128 VanDerWaalsContact O-CB 3.22Å; S124-A128 WeakPolarHBondContact O-CB 2.95Å; S124-A128 PolarHBondContact O-N 3.21Å
125	V	88.2	Confident	91.1	Very high	33 Å²	33	56.6 Å²	56.6	20%	0.2	29%	0.291	C	S	.	.	H	α-helix	trans	-66.8	-29.5	174	166.2	0	0	0	0	113	V121 E123 F133 V135	V121-V125 WeakPolarHBondContact O-CB 3.06Å; V121-V125 WeakPolarHBondContact O-CG2 3.35Å; V121-V125 PolarHBondContact O-N 3.15Å; V121-V125 VanDerWaalsContact O-N 3.16Å; E123-V125 VanDerWaalsContact C-N 3.25Å; E123-V125 PolarHBondContact O-N 2.84Å; V125-F133 HydrophobicContact CB-CD2 4.23Å; V125-F133 HydrophobicContact CB-CG 4.32Å; V125-F133 HydrophobicContact CG1-CB 3.99Å; V125-F133 HydrophobicContact CG1-CD2 3.91Å; V125-F133 HydrophobicContact CG1-CG 4.07Å; V125-F133 HydrophobicContact CG2-CB 3.94Å; V125-F133 HydrophobicContact CG2-CD1 3.77Å; V125-F133 HydrophobicContact CG2-CD2 4.05Å; V125-F133 HydrophobicContact CG2-CE1 4.21Å; V125-F133 HydrophobicContact CG2-CE2 4.48Å; V125-F133 HydrophobicContact CG2-CG 3.66Å; V125-V135 HydrophobicContact CG2-CG2 4.47Å
126	Q	88.3	Confident	91.1	Very high	155 Å²	155	58.7 Å²	58.7	72%	0.724	30%	0.298	S	S	*	.	H	α-helix	trans	-85.1	-30.9	178.3	-79.7	169	79.1	0	0	112.9	F122 E123 S124	F122-Q126 WeakPolarHBondContact O-CB 3.32Å; F122-Q126 VanDerWaalsContact O-CG 3.26Å; F122-Q126 WeakPolarHBondContact O-CG 3.39Å; F122-Q126 PolarHBondContact O-N 3.33Å; F122-Q126 PolarHBondContact O-NE2 2.87Å; E123-Q126 PolarHBondContact O-N 3.14Å; S124-Q126 VanDerWaalsContact C-N 3.33Å; S124-Q126 PolarHBondContact O-N 3.16Å
127	C	87.9	Confident	91.1	Very high	98 Å²	98	57.6 Å²	57.6	66%	0.662	29%	0.294	S	S	*	.	H	α-helix	trans	-83.9	-13.7	178.8	-65.3	0	0	0	0	114.1	E123 E129	E123-C127 PolarHBondContact O-N 3.39Å; C127-E129 PolarHBondContact O-N 2.82Å
128	A	84.4	Confident	91.1	Very high	35 Å²	35	57.7 Å²	57.7	29%	0.289	30%	0.295	S	S	.	.			trans	-84.2	99.8	-175	0	0	0	0	0	113.3	S124 F133	S124-A128 VanDerWaalsContact O-CB 3.22Å; S124-A128 WeakPolarHBondContact O-CB 2.95Å; S124-A128 PolarHBondContact O-N 3.21Å; A128-F133 HydrophobicContact CB-CE2 3.59Å; A128-F133 HydrophobicContact CB-CZ 3.67Å
129	E	79.7	Confident	91.1	Very high	164 Å²	164	57.9 Å²	57.9	77%	0.766	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	155.2	171.4	-62.1	-173.4	178	0	0	112.6	C127 T131	C127-E129 PolarHBondContact O-N 2.82Å; E129-T131 PolarHBondContact O-N 2.8Å; E129-T131 PolarHBondContact O-OG1 2.67Å; E129-T131 VanDerWaalsContact O-OG1 3.05Å
130	N	81.9	Confident	91.2	Very high	137 Å²	137	54.9 Å²	54.9	73%	0.733	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	13.6	178	-60.5	-43.9	0	0	0	116.5
131	T	86.8	Confident	91	Very high	40 Å²	40	55.6 Å²	55.6	25%	0.245	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	134.7	-176.2	-50.6	0	0	0	0	110.5	E129 F133 I220 Y221 A222	E129-T131 PolarHBondContact O-N 2.8Å; E129-T131 PolarHBondContact O-OG1 2.67Å; E129-T131 VanDerWaalsContact O-OG1 3.05Å; T131-F133 HydrophobicContact CG2-CD2 4.17Å; T131-F133 HydrophobicContact CG2-CE1 4.08Å; T131-F133 HydrophobicContact CG2-CE2 3.46Å; T131-F133 VanDerWaalsContact CG2-CE2 3.46Å; T131-F133 HydrophobicContact CG2-CZ 3.42Å; T131-F133 VanDerWaalsContact CG2-CZ 3.42Å; T131-I220 HydrophobicContact CG2-CG2 3.58Å; T131-Y221 CarbonylContact C-O 3.59Å; T131-Y221 WeakPolarHBondContact CA-O 3.29Å; T131-A222 HydrophobicContact CG2-CB 4.14Å
132	K	88.9	Confident	90.9	Very high	142 Å²	142	55.7 Å²	55.7	62%	0.617	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.6	137.9	176.2	-60.3	174.8	-170.8	163.4	0	109.2	Y221	K132-Y221 HydrophobicContact CB-CD1 4.19Å; K132-Y221 HydrophobicContact CD-CD1 3.92Å; K132-Y221 HydrophobicContact CD-CE1 4.2Å; K132-Y221 HydrophobicContact CG-CD1 4.29Å; K132-Y221 PolarHBondContact N-O 3.46Å; K132-Y221 PolarHBondContact O-N 3.32Å
133	F	91.8	Very high	90.6	Very high	49 Å²	49	58.1 Å²	58.1	22%	0.215	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	137.9	-178.2	-59.7	-99.2	0	0	0	111.2	V125 A128 T131 I218 E219 I220	V125-F133 HydrophobicContact CB-CD2 4.23Å; V125-F133 HydrophobicContact CB-CG 4.32Å; V125-F133 HydrophobicContact CG1-CB 3.99Å; V125-F133 HydrophobicContact CG1-CD2 3.91Å; V125-F133 HydrophobicContact CG1-CG 4.07Å; V125-F133 HydrophobicContact CG2-CB 3.94Å; V125-F133 HydrophobicContact CG2-CD1 3.77Å; V125-F133 HydrophobicContact CG2-CD2 4.05Å; V125-F133 HydrophobicContact CG2-CE1 4.21Å; V125-F133 HydrophobicContact CG2-CE2 4.48Å; V125-F133 HydrophobicContact CG2-CG 3.66Å; A128-F133 HydrophobicContact CB-CE2 3.59Å; A128-F133 HydrophobicContact CB-CZ 3.67Å; T131-F133 HydrophobicContact CG2-CD2 4.17Å; T131-F133 HydrophobicContact CG2-CE1 4.08Å; T131-F133 HydrophobicContact CG2-CE2 3.46Å; T131-F133 VanDerWaalsContact CG2-CE2 3.46Å; T131-F133 HydrophobicContact CG2-CZ 3.42Å; T131-F133 VanDerWaalsContact CG2-CZ 3.42Å; F133-I218 HydrophobicContact CD1-CG2 3.85Å; F133-E219 CarbonylContact C-O 3.56Å; F133-E219 WeakPolarHBondContact CA-O 3.5Å; F133-I220 HydrophobicContact CD1-CB 4.34Å; F133-I220 HydrophobicContact CD1-CG1 3.9Å; F133-I220 HydrophobicContact CD1-CG2 4.11Å; F133-I220 HydrophobicContact CE1-CB 4.36Å; F133-I220 HydrophobicContact CE1-CG1 3.97Å; F133-I220 HydrophobicContact CE1-CG2 3.72Å; F133-I220 HydrophobicContact CZ-CG2 4.3Å
134	L	92.3	Very high	90.1	Very high	67 Å²	67	54.4 Å²	54.4	35%	0.351	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	104.4	166.8	174.7	58	0	0	0	108.9	R136 T178 E219	L134-R136 HydrophobicContact CD1-CG 4.34Å; L134-R136 HydrophobicContact CG-CG 4.26Å; L134-T178 HydrophobicContact CD1-CG2 3.6Å; L134-E219 HydrophobicContact CB-CB 4.28Å; L134-E219 PolarHBondContact N-O 2.96Å; L134-E219 PolarHBondContact O-N 2.84Å
135	V	95.4	Very high	90	Very high	5 Å²	5	54.7 Å²	54.7	3%	0.03	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	129.1	178.4	-168.5	0	0	0	0	109.6	F122 V125 V179 I216 N217 I218	F122-V135 HydrophobicContact CE1-CG2 4.3Å; F122-V135 HydrophobicContact CZ-CB 4.22Å; F122-V135 HydrophobicContact CZ-CG1 4.29Å; F122-V135 HydrophobicContact CZ-CG2 4.32Å; V125-V135 HydrophobicContact CG2-CG2 4.47Å; V135-V179 HydrophobicContact CB-CG2 3.98Å; V135-V179 HydrophobicContact CG1-CG2 3.65Å; V135-V179 WeakPolarHBondContact O-CG2 3.34Å; V135-V179 PolarHBondContact O-N 3.04Å; V135-I216 HydrophobicContact CG1-CG2 3.48Å; V135-I216 VanDerWaalsContact CG1-CG2 3.48Å; V135-N217 WeakPolarHBondContact CA-O 3.5Å; V135-I218 HydrophobicContact CG2-CG2 4.45Å
136	R	95.5	Very high	90.2	Very high	53 Å²	53	54.5 Å²	54.5	20%	0.2	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	131.3	176.1	-57.8	-177.3	-58.2	-119	-7.8	110.4	L134 M176 H177 N217 E219	L134-R136 HydrophobicContact CD1-CG 4.34Å; L134-R136 HydrophobicContact CG-CG 4.26Å; R136-M176 HydrophobicContact CB-CE 3.82Å; R136-H177 CarbonylContact C-O 3.56Å; R136-H177 WeakPolarHBondContact CA-O 3.38Å; R136-N217 PolarHBondContact N-O 2.98Å; R136-N217 PolarHBondContact O-N 2.93Å; R136-E219 IonicContact CZ-OE1 3.5Å; R136-E219 IonicContact CZ-OE2 2.77Å; R136-E219 VanDerWaalsContact NH1-CD 3.28Å; R136-E219 IonicContact NH1-OE1 3.3Å; R136-E219 PolarHBondContact NH1-OE1 2.74Å; R136-E219 IonicContact NH1-OE2 2.7Å; R136-E219 PolarHBondContact NH1-OE2 3.2Å; R136-E219 IonicContact NH2-OE1 2.62Å; R136-E219 PolarHBondContact NH2-OE1 2.89Å; R136-E219 IonicContact NH2-OE2 2.69Å; R136-E219 PolarHBondContact NH2-OE2 2.85Å
137	A	96.8	Very high	90.4	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	147.1	176.4	0	0	0	0	0	111.7	H177 V179 V188 F214 T215	A137-H177 PolarHBondContact N-O 2.91Å; A137-H177 PolarHBondContact O-N 2.8Å; A137-V179 HydrophobicContact CB-CG1 4.3Å; A137-V179 HydrophobicContact CB-CG2 4.38Å; A137-V188 HydrophobicContact CB-CG1 4.09Å; A137-F214 HydrophobicContact CB-CE1 4Å; A137-F214 HydrophobicContact CB-CZ 3.8Å; A137-T215 CarbonylContact C-O 3.57Å; A137-T215 WeakPolarHBondContact CA-O 3.35Å
138	S	96.4	Very high	90.7	Very high	3 Å²	3	43.5 Å²	43.5	2%	0.021	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	154.7	159.9	58.1	0	0	0	0	109.9	S175 M176 T215	S138-S175 WeakPolarHBondContact CB-O 3.34Å; S138-M176 VanDerWaalsContact CB-SD 3.6Å; S138-T215 PolarHBondContact N-O 3.13Å; S138-T215 PolarHBondContact O-N 2.85Å
139	Y	96.6	Very high	91.2	Very high	4 Å²	4	42.2 Å²	42.2	2%	0.016	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	118.6	-179.8	-169.4	-164.7	0	0	0	109.2	L150 F214	Y139-L150 HydrophobicContact CD1-CB 4.33Å; Y139-L150 HydrophobicContact CD1-CD1 4Å; Y139-L150 HydrophobicContact CD2-CD1 3.91Å; Y139-L150 HydrophobicContact CE1-CD1 3.96Å; Y139-L150 HydrophobicContact CE2-CD1 3.91Å; Y139-L150 HydrophobicContact CG-CB 4.37Å; Y139-L150 HydrophobicContact CG-CD1 3.95Å; Y139-L150 WeakPolarHBondContact O-CB 3.15Å; Y139-L150 PolarHBondContact O-N 3.07Å; Y139-F214 AromaticContact CD1-CD2 3.72Å; Y139-F214 HydrophobicContact CD1-CD2 3.72Å; Y139-F214 HydrophobicContact CD1-CE2 4.23Å; Y139-F214 HydrophobicContact CD2-CB 3.74Å; Y139-F214 AromaticContact CD2-CD2 3.84Å; Y139-F214 HydrophobicContact CD2-CD2 3.84Å; Y139-F214 HydrophobicContact CD2-CG 4.24Å; Y139-F214 HydrophobicContact CE1-CD2 4.25Å; Y139-F214 HydrophobicContact CE2-CB 4.01Å; Y139-F214 HydrophobicContact CE2-CD2 4.32Å; Y139-F214 HydrophobicContact CG-CB 4.3Å; Y139-F214 AromaticContact CG-CD2 3.52Å; Y139-F214 HydrophobicContact CG-CD2 3.52Å; Y139-F214 HydrophobicContact CG-CE2 4.27Å; Y139-F214 HydrophobicContact CG-CG 4.3Å
140	L	95.3	Very high	91.8	Very high	5 Å²	5	34.5 Å²	34.5	3%	0.026	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	162.3	-179.2	67.1	79.7	0	0	0	111.3	I142 V147 H148 V171 L174 S212 I213 L295	L140-I142 HydrophobicContact CD1-CG1 3.92Å; L140-V147 HydrophobicContact CD1-CG1 4.41Å; L140-V147 HydrophobicContact CD2-CG1 4.31Å; L140-H148 VanDerWaalsContact CA-O 3.3Å; L140-H148 WeakPolarHBondContact CA-O 3.39Å; L140-H148 WeakPolarHBondContact CB-O 3.49Å; L140-V171 HydrophobicContact CD2-CG2 3.78Å; L140-L174 HydrophobicContact CB-CD1 4.02Å; L140-L174 HydrophobicContact CD2-CD2 4.1Å; L140-S212 WeakPolarHBondContact O-CA 3.47Å; L140-I213 HydrophobicContact CD1-CB 3.84Å; L140-I213 HydrophobicContact CD1-CD1 4.2Å; L140-I213 HydrophobicContact CD1-CG1 4.03Å; L140-I213 HydrophobicContact CG-CB 4.05Å; L140-I213 PolarHBondContact N-O 3.09Å; L140-I213 VanDerWaalsContact N-O 3.08Å; L140-I213 PolarHBondContact O-N 3.19Å; L140-L295 HydrophobicContact CD1-CD1 4.47Å; L140-L295 HydrophobicContact CD2-CD1 4.36Å
141	E	93.1	Very high	92.4	Very high	22 Å²	22	29 Å²	29	10%	0.103	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	153.2	159.3	71.7	173.1	173.4	0	0	113.2	V147 H148 L150 R196 S210 H211	E141-V147 WeakPolarHBondContact O-CA 3.4Å; E141-H148 HydrophobicContact CG-CB 4.23Å; E141-H148 PolarHBondContact N-O 2.83Å; E141-H148 PolarHBondContact O-N 3.27Å; E141-L150 HydrophobicContact CB-CD1 4.23Å; E141-L150 HydrophobicContact CB-CD2 4.32Å; E141-L150 HydrophobicContact CB-CG 4.37Å; E141-L150 HydrophobicContact CG-CD2 3.9Å; E141-L150 HydrophobicContact CG-CG 4.39Å; E141-R196 WeakPolarHBondContact OE2-CG 3.25Å; E141-R196 IonicContact OE2-NE 2.72Å; E141-S210 WeakPolarHBondContact OE2-CB 3.42Å; E141-S210 PolarHBondContact OE2-OG 3.14Å; E141-H211 CarbonylContact C-O 3.57Å; E141-H211 WeakPolarHBondContact CA-O 3.42Å
142	I	92.2	Very high	92.5	Very high	2 Å²	2	28 Å²	28	1%	0.01	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	108.8	168.5	-47	177.3	0	0	0	106.3	L140 D146 V147 S210 H211 I213 K291 L292 L295	L140-I142 HydrophobicContact CD1-CG1 3.92Å; I142-D146 WeakPolarHBondContact CA-O 3.23Å; I142-V147 HydrophobicContact CG1-CG2 4.49Å; I142-S210 WeakPolarHBondContact O-CA 3.34Å; I142-H211 HydrophobicContact CB-CB 4.32Å; I142-H211 PolarHBondContact N-O 3.25Å; I142-H211 PolarHBondContact O-N 2.68Å; I142-I213 HydrophobicContact CD1-CD1 4.29Å; I142-K291 HydrophobicContact CD1-CB 4.46Å; I142-K291 HydrophobicContact CG2-CB 3.97Å; I142-L292 HydrophobicContact CD1-CB 3.99Å; I142-L292 HydrophobicContact CD1-CD1 3.95Å; I142-L295 HydrophobicContact CD1-CD1 3.74Å; I142-L295 HydrophobicContact CG1-CD1 4.31Å
143	Y	87.1	Confident	92.4	Very high	61 Å²	61	27 Å²	27	24%	0.239	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	134.9	178.4	175.1	-112.5	0	0	0	108.2	E145 D146 R209 E259	Y143-E145 PolarHBondContact O-N 3.19Å; Y143-E145 VanDerWaalsContact O-N 3.09Å; Y143-D146 PolarHBondContact N-O 3.35Å; Y143-D146 WeakPolarHBondContact O-CA 3.35Å; Y143-D146 WeakPolarHBondContact O-CB 3.34Å; Y143-D146 PolarHBondContact O-N 3.2Å; Y143-R209 WeakPolarHBondContact CD2-O 3.16Å; Y143-E259 HydrophobicContact CE2-CG 4.08Å; Y143-E259 PolarHBondContact OH-OE1 3.22Å
144	N	83.5	Confident	92.1	Very high	44 Å²	44	28.6 Å²	28.6	24%	0.235	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.5	23.9	176.5	-176.9	69.4	0	0	0	114.3	D146 K262	N144-D146 PolarHBondContact ND2-OD2 3.34Å; N144-D146 PolarHBondContact O-N 3.1Å; N144-K262 HydrophobicContact CB-CD 4.4Å; N144-K262 PolarHBondContact ND2-NZ 2.89Å; N144-K262 WeakPolarHBondContact O-CD 3.46Å; N144-K262 WeakPolarHBondContact O-CE 3.39Å; N144-K262 PolarHBondContact O-NZ 2.79Å; N144-K262 WeakPolarHBondContact OD1-CD 3.45Å; N144-K262 PolarHBondContact OD1-NZ 3.39Å
145	E	89	Confident	91.8	Very high	30 Å²	30	27.7 Å²	27.7	14%	0.14	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	14.9	-168.8	-76.8	-69.8	108.8	0	0	115.2	Y143 L265 S266 S290 K291	Y143-E145 PolarHBondContact O-N 3.19Å; Y143-E145 VanDerWaalsContact O-N 3.09Å; E145-L265 HydrophobicContact CG-CD2 4.45Å; E145-S266 WeakPolarHBondContact OE1-CB 3.32Å; E145-S290 WeakPolarHBondContact OE2-CA 3.45Å; E145-K291 WeakPolarHBondContact O-CE 3.45Å; E145-K291 VanDerWaalsContact O-CG 3.24Å; E145-K291 WeakPolarHBondContact O-CG 3.07Å; E145-K291 PolarHBondContact OE1-N 3.33Å; E145-K291 WeakPolarHBondContact OE2-CG 3.07Å; E145-K291 PolarHBondContact OE2-N 2.96Å
146	D	90.6	Very high	91.1	Very high	29 Å²	29	34.9 Å²	34.9	16%	0.155	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	145.8	165.6	-59.3	-66.8	0	0	0	109	I142 Y143 N144 R158	I142-D146 WeakPolarHBondContact CA-O 3.23Å; Y143-D146 PolarHBondContact N-O 3.35Å; Y143-D146 WeakPolarHBondContact O-CA 3.35Å; Y143-D146 WeakPolarHBondContact O-CB 3.34Å; Y143-D146 PolarHBondContact O-N 3.2Å; N144-D146 PolarHBondContact ND2-OD2 3.34Å; N144-D146 PolarHBondContact O-N 3.1Å; D146-R158 HydrophobicContact CB-CG 4.15Å; D146-R158 VanDerWaalsContact CG-CZ 3.43Å; D146-R158 VanDerWaalsContact CG-NH1 3.27Å; D146-R158 VanDerWaalsContact OD1-CD 3.29Å; D146-R158 WeakPolarHBondContact OD1-CD 3.44Å; D146-R158 IonicContact OD1-CZ 3.64Å; D146-R158 IonicContact OD1-NE 3.72Å; D146-R158 PolarHBondContact OD1-NE 3.16Å; D146-R158 IonicContact OD1-NH1 3.58Å; D146-R158 PolarHBondContact OD1-NH1 3.4Å; D146-R158 IonicContact OD2-CZ 3.19Å; D146-R158 VanDerWaalsContact OD2-CZ 3.22Å; D146-R158 IonicContact OD2-NE 3.34Å; D146-R158 IonicContact OD2-NH1 3.44Å; D146-R158 PolarHBondContact OD2-NH1 3.27Å; D146-R158 IonicContact OD2-NH2 2.8Å
147	V	93.6	Very high	90.8	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.006	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	130.6	177.7	-178	0	0	0	0	109	L140 E141 I142 R158 L159 L161 V171 K291	L140-V147 HydrophobicContact CD1-CG1 4.41Å; L140-V147 HydrophobicContact CD2-CG1 4.31Å; E141-V147 WeakPolarHBondContact O-CA 3.4Å; I142-V147 HydrophobicContact CG1-CG2 4.49Å; V147-R158 WeakPolarHBondContact O-CA 3.39Å; V147-L159 PolarHBondContact O-N 3.29Å; V147-L161 HydrophobicContact CG2-CD2 4.38Å; V147-V171 HydrophobicContact CG1-CG1 4.23Å; V147-V171 HydrophobicContact CG1-CG2 4.36Å; V147-K291 HydrophobicContact CG2-CB 4.11Å; V147-K291 HydrophobicContact CG2-CG 4.13Å
148	H	93.1	Very high	90.6	Very high	20 Å²	20	45.3 Å²	45.3	9%	0.093	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	145.2	-179.8	-51.6	96.6	0	0	0	110.7	L140 E141	L140-H148 VanDerWaalsContact CA-O 3.3Å; L140-H148 WeakPolarHBondContact CA-O 3.39Å; L140-H148 WeakPolarHBondContact CB-O 3.49Å; E141-H148 HydrophobicContact CG-CB 4.23Å; E141-H148 PolarHBondContact N-O 2.83Å; E141-H148 PolarHBondContact O-N 3.27Å
149	D	95.3	Very high	90.5	Very high	8 Å²	8	46.2 Å²	46.2	4%	0.043	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	121.7	174.5	-174	-12.4	0	0	0	109.9	L151 G152 L159 L174 S175	D149-L151 VanDerWaalsContact C-N 3.28Å; D149-L151 WeakPolarHBondContact OD1-CA 3.19Å; D149-L151 PolarHBondContact OD1-N 2.85Å; D149-G152 PolarHBondContact OD1-N 3.5Å; D149-L159 HydrophobicContact CB-CD1 3.89Å; D149-L174 HydrophobicContact CB-CD1 4.02Å; D149-S175 PolarHBondContact OD1-OG 3.05Å; D149-S175 WeakPolarHBondContact OD2-CB 3.42Å; D149-S175 PolarHBondContact OD2-N 3.03Å; D149-S175 PolarHBondContact OD2-OG 2.79Å
150	L	93.7	Very high	90.3	Very high	3 Å²	3	51.2 Å²	51.2	2%	0.016	26%	0.264	C	S	.	.	S	Bend	trans	-81.5	-8.6	179.6	-62.6	175.6	0	0	0	112.7	Y139 E141 G192 N195 R196	Y139-L150 HydrophobicContact CD1-CB 4.33Å; Y139-L150 HydrophobicContact CD1-CD1 4Å; Y139-L150 HydrophobicContact CD2-CD1 3.91Å; Y139-L150 HydrophobicContact CE1-CD1 3.96Å; Y139-L150 HydrophobicContact CE2-CD1 3.91Å; Y139-L150 HydrophobicContact CG-CB 4.37Å; Y139-L150 HydrophobicContact CG-CD1 3.95Å; Y139-L150 WeakPolarHBondContact O-CB 3.15Å; Y139-L150 PolarHBondContact O-N 3.07Å; E141-L150 HydrophobicContact CB-CD1 4.23Å; E141-L150 HydrophobicContact CB-CD2 4.32Å; E141-L150 HydrophobicContact CB-CG 4.37Å; E141-L150 HydrophobicContact CG-CD2 3.9Å; E141-L150 HydrophobicContact CG-CG 4.39Å; L150-G192 WeakPolarHBondContact O-CA 3.42Å; L150-N195 PolarHBondContact O-ND2 2.86Å; L150-R196 HydrophobicContact CD1-CB 4.21Å; L150-R196 HydrophobicContact CD1-CG 4.35Å; L150-R196 HydrophobicContact CD2-CB 3.96Å; L150-R196 HydrophobicContact CD2-CG 4.34Å
151	L	94.3	Very high	90.3	Very high	20 Å²	20	51.9 Å²	51.9	11%	0.105	27%	0.268	C	S	.	.	S	Bend	trans	-118.7	-3	-178.7	-47.9	174.9	0	0	0	112.9	D149 H177 V188	D149-L151 VanDerWaalsContact C-N 3.28Å; D149-L151 WeakPolarHBondContact OD1-CA 3.19Å; D149-L151 PolarHBondContact OD1-N 2.85Å; L151-H177 VanDerWaalsContact CB-NE2 3.28Å; L151-H177 WeakPolarHBondContact CB-NE2 3.49Å; L151-H177 PolarHBondContact O-NE2 2.83Å; L151-V188 HydrophobicContact CD1-CG1 3.45Å; L151-V188 VanDerWaalsContact CD1-CG1 3.45Å; L151-V188 HydrophobicContact CD2-CG1 3.8Å; L151-V188 VanDerWaalsContact CD2-O 3.28Å; L151-V188 WeakPolarHBondContact CD2-O 3.37Å; L151-V188 HydrophobicContact CG-CG1 4.28Å
152	G	88.9	Confident	90.2	Very high	20 Å²	20	55.2 Å²	55.2	21%	0.206	28%	0.282	C	S	.	.	S	Bend	trans	-73.6	163.5	178.3	0	0	0	0	0	113.1	D149 D154	D149-G152 PolarHBondContact OD1-N 3.5Å; G152-D154 VanDerWaalsContact C-N 3.32Å; G152-D154 PolarHBondContact O-N 3.33Å
153	A	85.4	Confident	89.9	Confident	122 Å²	122	59 Å²	59	100%	1.008	30%	0.3	S	S	*	.	S	Bend	trans	-69.1	-27.6	179.1	0	0	0	0	0	113.6
154	D	87.3	Confident	89.6	Confident	82 Å²	82	59.6 Å²	59.6	44%	0.439	30%	0.304	S	S	.	.			trans	-123.3	102.4	167.7	179.1	14	0	0	0	109.9	G152 K156 Q157	G152-D154 VanDerWaalsContact C-N 3.32Å; G152-D154 PolarHBondContact O-N 3.33Å; D154-K156 PolarHBondContact O-N 3.45Å; D154-K156 WeakPolarHBondContact OD1-CB 3.43Å; D154-K156 PolarHBondContact OD1-N 2.83Å; D154-Q157 HydrophobicContact CB-CB 4.23Å; D154-Q157 WeakPolarHBondContact O-CB 3.36Å; D154-Q157 PolarHBondContact O-N 2.86Å; D154-Q157 VanDerWaalsContact O-N 3.16Å
155	T	84.1	Confident	89.1	Confident	48 Å²	48	63.9 Å²	63.9	29%	0.294	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-7.4	178.7	56.1	0	0	0	0	113.4	N195	T155-N195 HydrophobicContact CG2-CB 4.03Å
156	K	82.6	Confident	88.3	Confident	156 Å²	156	70.3 Å²	70.3	68%	0.678	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-8.2	173.6	-56.9	173.9	-176.3	172.4	0	112.2	D154 R158	D154-K156 PolarHBondContact O-N 3.45Å; D154-K156 WeakPolarHBondContact OD1-CB 3.43Å; D154-K156 PolarHBondContact OD1-N 2.83Å; K156-R158 PolarHBondContact O-N 3.1Å
157	Q	88.5	Confident	87.3	Confident	114 Å²	114	76.5 Å²	76.5	53%	0.533	39%	0.39	S	S	.	.			trans	-68.3	124.7	177.6	-171.7	176.6	11.8	0	0	110.3	D154 L159	D154-Q157 HydrophobicContact CB-CB 4.23Å; D154-Q157 WeakPolarHBondContact O-CB 3.36Å; D154-Q157 PolarHBondContact O-N 2.86Å; D154-Q157 VanDerWaalsContact O-N 3.16Å; Q157-L159 HydrophobicContact CG-CD2 4.23Å
158	R	92	Very high	86.7	Confident	157 Å²	157	77.5 Å²	77.5	59%	0.592	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.9	129.3	173.3	-62.6	-178.5	-177.8	-173.9	13.4	110.3	D146 V147 K156	D146-R158 HydrophobicContact CB-CG 4.15Å; D146-R158 VanDerWaalsContact CG-CZ 3.43Å; D146-R158 VanDerWaalsContact CG-NH1 3.27Å; D146-R158 VanDerWaalsContact OD1-CD 3.29Å; D146-R158 WeakPolarHBondContact OD1-CD 3.44Å; D146-R158 IonicContact OD1-CZ 3.64Å; D146-R158 IonicContact OD1-NE 3.72Å; D146-R158 PolarHBondContact OD1-NE 3.16Å; D146-R158 IonicContact OD1-NH1 3.58Å; D146-R158 PolarHBondContact OD1-NH1 3.4Å; D146-R158 IonicContact OD2-CZ 3.19Å; D146-R158 VanDerWaalsContact OD2-CZ 3.22Å; D146-R158 IonicContact OD2-NE 3.34Å; D146-R158 IonicContact OD2-NH1 3.44Å; D146-R158 PolarHBondContact OD2-NH1 3.27Å; D146-R158 IonicContact OD2-NH2 2.8Å; V147-R158 WeakPolarHBondContact O-CA 3.39Å; K156-R158 PolarHBondContact O-N 3.1Å
159	L	94.1	Very high	86.5	Confident	22 Å²	22	77 Å²	77	12%	0.115	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	150.8	179.3	-58.3	-173.9	0	0	0	112.4	V147 D149 Q157 V171 L174	V147-L159 PolarHBondContact O-N 3.29Å; D149-L159 HydrophobicContact CB-CD1 3.89Å; Q157-L159 HydrophobicContact CG-CD2 4.23Å; L159-V171 HydrophobicContact CB-CG1 3.48Å; L159-V171 VanDerWaalsContact CB-CG1 3.48Å; L159-V171 HydrophobicContact CD1-CG1 3.69Å; L159-V171 HydrophobicContact CG-CG1 4.26Å; L159-L174 HydrophobicContact CD1-CB 4.21Å; L159-L174 HydrophobicContact CD1-CD1 4.45Å
160	E	93.6	Very high	86.3	Confident	110 Å²	110	81.1 Å²	81.1	51%	0.514	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	140.1	-176.8	-62	-176.9	131.8	0	0	112.1	K172	E160-K172 PolarHBondContact O-N 2.83Å; E160-K172 IonicContact OE2-NZ 3.59Å
161	L	93.6	Very high	86.3	Confident	19 Å²	19	81.7 Å²	81.7	10%	0.099	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	123.6	167.4	-62.9	-172.1	0	0	0	110.9	V147 V169 V171 K291 R294 L295	V147-L161 HydrophobicContact CG2-CD2 4.38Å; L161-V169 HydrophobicContact CB-CG1 4.5Å; L161-V171 HydrophobicContact CD2-CG2 3.81Å; L161-K291 HydrophobicContact CD1-CB 4.01Å; L161-K291 HydrophobicContact CD1-CD 3.88Å; L161-K291 HydrophobicContact CD1-CG 4.48Å; L161-K291 HydrophobicContact CG-CD 4.34Å; L161-R294 HydrophobicContact CD1-CB 3.84Å; L161-L295 HydrophobicContact CD1-CG 4.2Å; L161-L295 HydrophobicContact CD2-CD1 3.98Å; L161-L295 HydrophobicContact CD2-CD2 3.71Å; L161-L295 HydrophobicContact CD2-CG 3.79Å
162	K	91.2	Very high	86.2	Confident	92 Å²	92	85.9 Å²	85.9	40%	0.4	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	161.9	172	-69.7	-161	169.3	-158.5	0	110.9	V169 Y170 K172	K162-V169 WeakPolarHBondContact O-CA 3.46Å; K162-Y170 HydrophobicContact CB-CD1 4.13Å; K162-Y170 HydrophobicContact CB-CE1 3.5Å; K162-Y170 VanDerWaalsContact CB-CE1 3.5Å; K162-Y170 HydrophobicContact CB-CE2 4.37Å; K162-Y170 PolarHBondContact N-O 2.89Å; K162-Y170 WeakPolarHBondContact O-CD1 3.41Å; K162-Y170 PolarHBondContact O-N 3.29Å; K162-K172 HydrophobicContact CD-CB 4.23Å; K162-K172 HydrophobicContact CD-CG 4.38Å; K162-K172 HydrophobicContact CG-CB 4.26Å
163	E	87.2	Confident	86.2	Confident	81 Å²	81	88 Å²	88	38%	0.379	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	133.5	-179.5	-61.4	178.3	-173.5	0	0	107.3	G168 V169 R288 R294	E163-G168 WeakPolarHBondContact CA-O 3.41Å; E163-V169 HydrophobicContact CG-CG2 4.26Å; E163-R288 IonicContact OE1-CZ 2.71Å; E163-R288 IonicContact OE1-NE 3.41Å; E163-R288 PolarHBondContact OE1-NE 2.84Å; E163-R288 IonicContact OE1-NH2 2.68Å; E163-R288 IonicContact OE2-CZ 3.81Å; E163-R288 IonicContact OE2-NE 2.75Å; E163-R288 IonicContact OE2-NH2 3.51Å; E163-R288 PolarHBondContact OE2-NH2 3.23Å; E163-R294 IonicContact OE1-CZ 3.26Å; E163-R294 IonicContact OE1-NE 2.69Å; E163-R294 PolarHBondContact OE1-NE 2.84Å; E163-R294 IonicContact OE1-NH2 3.41Å; E163-R294 PolarHBondContact OE1-NH2 2.91Å
164	H	79.7	Confident	86.6	Confident	74 Å²	74	83.7 Å²	83.7	34%	0.343	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	135.6	176.7	-169.2	-97.1	0	0	0	109	E166 K167 G168 Y170	H164-E166 IonicContact CE1-OE2 2.71Å; H164-E166 PolarHBondContact CE1-OE2 2.93Å; H164-E166 VanDerWaalsContact CE1-OE2 3.32Å; H164-E166 PolarHBondContact ND1-N 3.21Å; H164-E166 IonicContact ND1-OE2 2.9Å; H164-E166 PolarHBondContact O-N 3.21Å; H164-E166 VanDerWaalsContact O-N 3.1Å; H164-K167 HydrophobicContact CB-CB 4.07Å; H164-K167 PolarHBondContact O-N 3.45Å; H164-G168 PolarHBondContact N-O 3.22Å; H164-G168 PolarHBondContact O-N 3.34Å; H164-Y170 HydrophobicContact CB-CD1 4.31Å; H164-Y170 HydrophobicContact CB-CE1 4Å
165	P	74.2	Confident	86.9	Confident	133 Å²	133	81.1 Å²	81.1	86%	0.864	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-39.5	-175.1	-28.7	35.7	0	0	0	114.1
166	E	70.6	Confident	87.4	Confident	165 Å²	165	82.5 Å²	82.5	77%	0.771	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-27.4	-177.4	-55.2	170.6	149.1	0	0	114.2	H164	H164-E166 IonicContact CE1-OE2 2.71Å; H164-E166 PolarHBondContact CE1-OE2 2.93Å; H164-E166 VanDerWaalsContact CE1-OE2 3.32Å; H164-E166 PolarHBondContact ND1-N 3.21Å; H164-E166 IonicContact ND1-OE2 2.9Å; H164-E166 PolarHBondContact O-N 3.21Å; H164-E166 VanDerWaalsContact O-N 3.1Å
167	K	69.6	Low	88	Confident	159 Å²	159	78.2 Å²	78.2	69%	0.691	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.8	3.2	-168.9	-56.6	-175.7	178.9	-177.9	0	113.7	H164	H164-K167 HydrophobicContact CB-CB 4.07Å; H164-K167 PolarHBondContact O-N 3.45Å
168	G	81.9	Confident	88.3	Confident	22 Å²	22	75.9 Å²	75.9	23%	0.227	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	64.9	-143.6	-178.5	0	0	0	0	0	112.5	E163 H164	E163-G168 WeakPolarHBondContact CA-O 3.41Å; H164-G168 PolarHBondContact N-O 3.22Å; H164-G168 PolarHBondContact O-N 3.34Å
169	V	88.6	Confident	88.5	Confident	9 Å²	9	68.6 Å²	68.6	6%	0.055	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	128.3	177.8	-170.7	0	0	0	0	110	L161 K162 E163 R294	L161-V169 HydrophobicContact CB-CG1 4.5Å; K162-V169 WeakPolarHBondContact O-CA 3.46Å; E163-V169 HydrophobicContact CG-CG2 4.26Å; V169-R294 WeakPolarHBondContact CB-O 3.23Å; V169-R294 HydrophobicContact CG1-CB 4.16Å; V169-R294 VanDerWaalsContact CG2-O 3.31Å; V169-R294 WeakPolarHBondContact CG2-O 3.44Å
170	Y	90.6	Very high	88.4	Confident	95 Å²	95	73.8 Å²	73.8	37%	0.373	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	158.7	179.9	77.5	-77.3	0	0	0	112.7	K162 H164	K162-Y170 HydrophobicContact CB-CD1 4.13Å; K162-Y170 HydrophobicContact CB-CE1 3.5Å; K162-Y170 VanDerWaalsContact CB-CE1 3.5Å; K162-Y170 HydrophobicContact CB-CE2 4.37Å; K162-Y170 PolarHBondContact N-O 2.89Å; K162-Y170 WeakPolarHBondContact O-CD1 3.41Å; K162-Y170 PolarHBondContact O-N 3.29Å; H164-Y170 HydrophobicContact CB-CD1 4.31Å; H164-Y170 HydrophobicContact CB-CE1 4Å
171	V	93.9	Very high	88.3	Confident	15 Å²	15	71.5 Å²	71.5	9%	0.091	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	122.3	176.9	-173	0	0	0	0	109.3	L140 V147 L159 L161 G173 L174 L295	L140-V171 HydrophobicContact CD2-CG2 3.78Å; V147-V171 HydrophobicContact CG1-CG1 4.23Å; V147-V171 HydrophobicContact CG1-CG2 4.36Å; L159-V171 HydrophobicContact CB-CG1 3.48Å; L159-V171 VanDerWaalsContact CB-CG1 3.48Å; L159-V171 HydrophobicContact CD1-CG1 3.69Å; L159-V171 HydrophobicContact CG-CG1 4.26Å; L161-V171 HydrophobicContact CD2-CG2 3.81Å; V171-G173 PolarHBondContact O-N 3.04Å; V171-L174 HydrophobicContact CB-CB 3.83Å; V171-L174 HydrophobicContact CB-CD2 4.18Å; V171-L174 HydrophobicContact CG1-CB 3.9Å; V171-L174 HydrophobicContact CG2-CD2 4.32Å; V171-L295 HydrophobicContact CG2-CD2 3.87Å
172	K	92.4	Very high	88.4	Confident	108 Å²	108	72.1 Å²	72.1	47%	0.47	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	116.3	176.8	-177.3	-137.9	179.2	-172.4	0	109.8	E160 K162	E160-K172 PolarHBondContact O-N 2.83Å; E160-K172 IonicContact OE2-NZ 3.59Å; K162-K172 HydrophobicContact CD-CB 4.23Å; K162-K172 HydrophobicContact CD-CG 4.38Å; K162-K172 HydrophobicContact CG-CB 4.26Å
173	G	89	Confident	88.5	Confident	64 Å²	64	69.7 Å²	69.7	66%	0.66	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	91	7.7	175.6	0	0	0	0	0	115.3	V171	V171-G173 PolarHBondContact O-N 3.04Å
174	L	94	Very high	88.9	Confident	32 Å²	32	68.3 Å²	68.3	17%	0.168	37%	0.369	C	S	.	.			trans	-64.2	131	170.7	179.9	68.2	0	0	0	110.2	L140 D149 L159 V171	L140-L174 HydrophobicContact CB-CD1 4.02Å; L140-L174 HydrophobicContact CD2-CD2 4.1Å; D149-L174 HydrophobicContact CB-CD1 4.02Å; L159-L174 HydrophobicContact CD1-CB 4.21Å; L159-L174 HydrophobicContact CD1-CD1 4.45Å; V171-L174 HydrophobicContact CB-CB 3.83Å; V171-L174 HydrophobicContact CB-CD2 4.18Å; V171-L174 HydrophobicContact CG1-CB 3.9Å; V171-L174 HydrophobicContact CG2-CD2 4.32Å
175	S	94	Very high	89.6	Confident	29 Å²	29	64.9 Å²	64.9	20%	0.203	35%	0.353	C	S	.	.			trans	-72.4	138.8	178.5	64.2	0	0	0	0	112	S138 D149 H177	S138-S175 WeakPolarHBondContact CB-O 3.34Å; D149-S175 PolarHBondContact OD1-OG 3.05Å; D149-S175 WeakPolarHBondContact OD2-CB 3.42Å; D149-S175 PolarHBondContact OD2-N 3.03Å; D149-S175 PolarHBondContact OD2-OG 2.79Å; S175-H177 WeakPolarHBondContact CB-NE2 3.43Å; S175-H177 PolarHBondContact OG-NE2 3.39Å
176	M	93.6	Very high	90.5	Very high	76 Å²	76	62 Å²	62	37%	0.374	33%	0.328	S	S	.	.			trans	-119.3	115.1	177.8	-64.6	-63.6	-52.4	0	0	108.2	R136 S138 N217	R136-M176 HydrophobicContact CB-CE 3.82Å; S138-M176 VanDerWaalsContact CB-SD 3.6Å; M176-N217 HydrophobicContact CE-CB 4.1Å
177	H	95.6	Very high	91.6	Very high	66 Å²	66	60.6 Å²	60.6	31%	0.306	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	117.2	-174.1	-63.7	-102.5	0	0	0	109.5	R136 A137 L151 S175 V188	R136-H177 CarbonylContact C-O 3.56Å; R136-H177 WeakPolarHBondContact CA-O 3.38Å; A137-H177 PolarHBondContact N-O 2.91Å; A137-H177 PolarHBondContact O-N 2.8Å; L151-H177 VanDerWaalsContact CB-NE2 3.28Å; L151-H177 WeakPolarHBondContact CB-NE2 3.49Å; L151-H177 PolarHBondContact O-NE2 2.83Å; S175-H177 WeakPolarHBondContact CB-NE2 3.43Å; S175-H177 PolarHBondContact OG-NE2 3.39Å; H177-V188 HydrophobicContact CB-CG2 4.48Å
178	T	95.5	Very high	92.8	Very high	66 Å²	66	54.1 Å²	54.1	41%	0.405	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	135.4	174.9	-54.9	0	0	0	0	110.4	L134	L134-T178 HydrophobicContact CD1-CG2 3.6Å
179	V	95	Very high	93.3	Very high	4 Å²	4	53.6 Å²	53.6	2%	0.024	28%	0.281	C	S	.	.			trans	-132.5	132.2	-176	-73.5	0	0	0	0	109.9	F122 V135 A137 Q184 C185 V188	F122-V179 HydrophobicContact CZ-CB 4.41Å; F122-V179 HydrophobicContact CZ-CG2 4.28Å; V135-V179 HydrophobicContact CB-CG2 3.98Å; V135-V179 HydrophobicContact CG1-CG2 3.65Å; V135-V179 WeakPolarHBondContact O-CG2 3.34Å; V135-V179 PolarHBondContact O-N 3.04Å; A137-V179 HydrophobicContact CB-CG1 4.3Å; A137-V179 HydrophobicContact CB-CG2 4.38Å; V179-Q184 HydrophobicContact CB-CB 4.3Å; V179-Q184 HydrophobicContact CG1-CB 4.14Å; V179-C185 VanDerWaalsContact CG2-SG 3.59Å; V179-V188 HydrophobicContact CG1-CG2 4.14Å
180	H	91.7	Very high	93.4	Very high	130 Å²	130	57.8 Å²	57.8	60%	0.602	30%	0.3	S	S	*	.			trans	-115.9	-2.1	-171	-58.2	-79.6	0	0	0	113.7	F122 Q184	F122-H180 VanDerWaalsContact CE1-C 3.4Å; H180-Q184 PolarHBondContact CD2-OE1 3.36Å
181	N	93	Very high	93.4	Very high	63 Å²	63	56.4 Å²	56.4	34%	0.337	30%	0.301	S	S	.	.	S	Bend	trans	-167.2	163.5	175	45.7	77.9	0	0	0	111.2	F122 A183 Q184 C185	F122-N181 VanDerWaalsContact CE2-C 3.44Å; N181-A183 VanDerWaalsContact C-N 3.27Å; N181-A183 PolarHBondContact O-N 3.39Å; N181-Q184 WeakPolarHBondContact O-CB 3.45Å; N181-Q184 PolarHBondContact O-N 3Å; N181-Q184 WeakPolarHBondContact OD1-CG 3.44Å; N181-Q184 PolarHBondContact OD1-N 3.22Å; N181-Q184 VanDerWaalsContact OD1-N 3.13Å; N181-C185 PolarHBondContact O-N 2.87Å
182	V	94.8	Very high	93.3	Very high	31 Å²	31	55.7 Å²	55.7	19%	0.188	30%	0.297	C	S	.	.	H	α-helix	trans	-47.3	-47.7	176.4	-176.6	0	0	0	0	112	F118 E119 F122 Q184 C185 E186	F118-V182 HydrophobicContact CB-CG1 4.09Å; E119-V182 HydrophobicContact CG-CG1 3.76Å; E119-V182 HydrophobicContact CG-CG2 4.08Å; F122-V182 HydrophobicContact CB-CG2 3.82Å; F122-V182 HydrophobicContact CD2-CG2 3.97Å; F122-V182 HydrophobicContact CG-CG2 4.22Å; V182-Q184 PolarHBondContact O-N 2.92Å; V182-C185 CarbonylContact O-C 3.53Å; V182-C185 WeakPolarHBondContact O-CA 3.29Å; V182-C185 WeakPolarHBondContact O-CB 3.27Å; V182-C185 PolarHBondContact O-N 2.95Å; V182-E186 HydrophobicContact CG1-CG 4.29Å; V182-E186 PolarHBondContact O-N 3.24Å
183	A	94.4	Very high	92.9	Very high	42 Å²	42	53.8 Å²	53.8	35%	0.347	29%	0.287	S	S	.	.	H	α-helix	trans	-65.6	-24	-177.7	0	0	0	0	0	113.6	N181 R187	N181-A183 VanDerWaalsContact C-N 3.27Å; N181-A183 PolarHBondContact O-N 3.39Å; A183-R187 WeakPolarHBondContact O-CG 3.42Å; A183-R187 VanDerWaalsContact O-CZ 3.26Å; A183-R187 PolarHBondContact O-N 3.49Å; A183-R187 PolarHBondContact O-NH1 2.95Å
184	Q	94.8	Very high	92.8	Very high	52 Å²	52	55.7 Å²	55.7	24%	0.243	28%	0.277	C	S	.	.	H	α-helix	trans	-74.3	-42.2	168.7	-74.4	177.4	6.1	0	0	111.4	V179 H180 N181 V182 R187 V188	V179-Q184 HydrophobicContact CB-CB 4.3Å; V179-Q184 HydrophobicContact CG1-CB 4.14Å; H180-Q184 PolarHBondContact CD2-OE1 3.36Å; N181-Q184 WeakPolarHBondContact O-CB 3.45Å; N181-Q184 PolarHBondContact O-N 3Å; N181-Q184 WeakPolarHBondContact OD1-CG 3.44Å; N181-Q184 PolarHBondContact OD1-N 3.22Å; N181-Q184 VanDerWaalsContact OD1-N 3.13Å; V182-Q184 PolarHBondContact O-N 2.92Å; Q184-R187 VanDerWaalsContact CG-NH2 3.29Å; Q184-R187 PolarHBondContact O-N 3.21Å; Q184-V188 WeakPolarHBondContact O-CG2 3.38Å; Q184-V188 PolarHBondContact O-N 2.94Å
185	C	93.9	Very high	92.4	Very high	1 Å²	1	56.7 Å²	56.7	1%	0.007	28%	0.282	C	S	.	.	H	α-helix	trans	-60.4	-44	172.7	-77.6	0	0	0	0	112.7	F118 V179 N181 V182 R187 V188 M189	F118-C185 HydrophobicContact CB-CB 4.16Å; F118-C185 HydrophobicContact CD1-CB 3.89Å; F118-C185 HydrophobicContact CD2-CB 3.5Å; F118-C185 VanDerWaalsContact CD2-CB 3.5Å; F118-C185 HydrophobicContact CE1-CB 4.09Å; F118-C185 HydrophobicContact CE2-CB 3.71Å; F118-C185 HydrophobicContact CG-CB 3.59Å; F118-C185 HydrophobicContact CZ-CB 4Å; V179-C185 VanDerWaalsContact CG2-SG 3.59Å; N181-C185 PolarHBondContact O-N 2.87Å; V182-C185 CarbonylContact O-C 3.53Å; V182-C185 WeakPolarHBondContact O-CA 3.29Å; V182-C185 WeakPolarHBondContact O-CB 3.27Å; V182-C185 PolarHBondContact O-N 2.95Å; C185-R187 PolarHBondContact O-N 2.68Å; C185-V188 PolarHBondContact O-N 3.48Å; C185-M189 WeakPolarHBondContact O-CB 3.2Å; C185-M189 PolarHBondContact O-N 3.17Å
186	E	92.9	Very high	91.8	Very high	73 Å²	73	55.3 Å²	55.3	34%	0.341	27%	0.273	S	S	.	.	H	α-helix	trans	-62.8	-40.1	177	-70.8	-175.9	144.4	0	0	111.5	R111 F118 V182 M189 E190	R111-E186 IonicContact CZ-OE1 3.49Å; R111-E186 IonicContact NH2-OE1 3.22Å; R111-E186 PolarHBondContact NH2-OE1 3.14Å; F118-E186 HydrophobicContact CD2-CG 4Å; F118-E186 HydrophobicContact CE2-CG 4.39Å; V182-E186 HydrophobicContact CG1-CG 4.29Å; V182-E186 PolarHBondContact O-N 3.24Å; E186-M189 PolarHBondContact O-N 2.94Å; E186-E190 VanDerWaalsContact O-CB 3.32Å; E186-E190 WeakPolarHBondContact O-CB 3.44Å; E186-E190 PolarHBondContact O-N 3.35Å
187	R	94.2	Very high	90.3	Very high	136 Å²	136	53.3 Å²	53.3	51%	0.513	27%	0.268	S	S	.	.	H	α-helix	trans	-64.8	-39.3	172.8	-76.8	-170.2	-62	-84.7	11.5	113.3	A183 Q184 C185 T191	A183-R187 WeakPolarHBondContact O-CG 3.42Å; A183-R187 VanDerWaalsContact O-CZ 3.26Å; A183-R187 PolarHBondContact O-N 3.49Å; A183-R187 PolarHBondContact O-NH1 2.95Å; Q184-R187 VanDerWaalsContact CG-NH2 3.29Å; Q184-R187 PolarHBondContact O-N 3.21Å; C185-R187 PolarHBondContact O-N 2.68Å; R187-T191 WeakPolarHBondContact O-CB 3.49Å; R187-T191 PolarHBondContact O-N 3.43Å; R187-T191 PolarHBondContact O-OG1 2.71Å
188	V	94.6	Very high	88.6	Confident	22 Å²	22	54.1 Å²	54.1	13%	0.133	28%	0.277	C	S	.	.	H	α-helix	trans	-64.8	-45.2	175.4	168.8	0	0	0	0	110.4	A137 L151 H177 V179 Q184 C185 T191 G192 F214	A137-V188 HydrophobicContact CB-CG1 4.09Å; L151-V188 HydrophobicContact CD1-CG1 3.45Å; L151-V188 VanDerWaalsContact CD1-CG1 3.45Å; L151-V188 HydrophobicContact CD2-CG1 3.8Å; L151-V188 VanDerWaalsContact CD2-O 3.28Å; L151-V188 WeakPolarHBondContact CD2-O 3.37Å; L151-V188 HydrophobicContact CG-CG1 4.28Å; H177-V188 HydrophobicContact CB-CG2 4.48Å; V179-V188 HydrophobicContact CG1-CG2 4.14Å; Q184-V188 WeakPolarHBondContact O-CG2 3.38Å; Q184-V188 PolarHBondContact O-N 2.94Å; C185-V188 PolarHBondContact O-N 3.48Å; V188-T191 PolarHBondContact O-N 2.93Å; V188-G192 PolarHBondContact O-N 2.78Å; V188-F214 HydrophobicContact CG1-CE2 4.11Å; V188-F214 HydrophobicContact CG1-CZ 4.2Å
189	M	92	Very high	86.6	Confident	12 Å²	12	52.9 Å²	52.9	6%	0.059	28%	0.278	C	S	.	.	H	α-helix	trans	-61.2	-46.4	175.7	-172.1	-169.9	-175.1	0	0	112	Q102 I114 F118 C185 E186 T191 G192 W193 F214	Q102-M189 HydrophobicContact CB-CE 3.75Å; Q102-M189 HydrophobicContact CG-CE 3.62Å; I114-M189 HydrophobicContact CB-CE 3.91Å; I114-M189 HydrophobicContact CB-SD 4.3Å; I114-M189 HydrophobicContact CD1-CE 3.66Å; I114-M189 HydrophobicContact CG1-CE 4.37Å; I114-M189 HydrophobicContact CG2-CE 3.64Å; I114-M189 HydrophobicContact CG2-SD 3.52Å; I114-M189 VanDerWaalsContact CG2-SD 3.52Å; F118-M189 HydrophobicContact CE2-CB 4.08Å; F118-M189 HydrophobicContact CE2-SD 4Å; F118-M189 HydrophobicContact CZ-CB 4.2Å; F118-M189 HydrophobicContact CZ-SD 4.26Å; C185-M189 WeakPolarHBondContact O-CB 3.2Å; C185-M189 PolarHBondContact O-N 3.17Å; E186-M189 PolarHBondContact O-N 2.94Å; M189-T191 VanDerWaalsContact C-N 3.35Å; M189-T191 PolarHBondContact O-N 3.43Å; M189-G192 PolarHBondContact O-N 2.75Å; M189-W193 VanDerWaalsContact O-CB 3.27Å; M189-W193 WeakPolarHBondContact O-CB 3.4Å; M189-W193 PolarHBondContact O-N 3.36Å; M189-F214 HydrophobicContact CB-CD2 4.46Å; M189-F214 HydrophobicContact CB-CE2 3.9Å; M189-F214 HydrophobicContact CG-CD2 4.44Å; M189-F214 HydrophobicContact CG-CE2 4.36Å
190	E	90.8	Very high	84.6	Confident	96 Å²	96	54.3 Å²	54.3	45%	0.449	28%	0.283	S	S	.	.	H	α-helix	trans	-65.2	-37.8	179.3	-160.8	-146.1	-171.7	0	0	111.9	E186 W193 K194	E186-E190 VanDerWaalsContact O-CB 3.32Å; E186-E190 WeakPolarHBondContact O-CB 3.44Å; E186-E190 PolarHBondContact O-N 3.35Å; E190-W193 PolarHBondContact O-N 3.07Å; E190-K194 HydrophobicContact CG-CD 4.46Å; E190-K194 WeakPolarHBondContact O-CB 3.38Å; E190-K194 VanDerWaalsContact O-CG 3.29Å; E190-K194 WeakPolarHBondContact O-CG 3.36Å; E190-K194 PolarHBondContact O-N 3.5Å; E190-K194 WeakPolarHBondContact OE1-CE 3.37Å; E190-K194 IonicContact OE1-NZ 3.24Å; E190-K194 PolarHBondContact OE1-NZ 3.08Å; E190-K194 IonicContact OE2-NZ 3.39Å; E190-K194 PolarHBondContact OE2-NZ 3.08Å
191	T	92.1	Very high	82.1	Confident	66 Å²	66	53.4 Å²	53.4	41%	0.405	29%	0.287	S	S	.	.	H	α-helix	trans	-62.2	-51.5	175	-59.2	0	0	0	0	110.9	R187 V188 M189 W193 K194 N195	R187-T191 WeakPolarHBondContact O-CB 3.49Å; R187-T191 PolarHBondContact O-N 3.43Å; R187-T191 PolarHBondContact O-OG1 2.71Å; V188-T191 PolarHBondContact O-N 2.93Å; M189-T191 VanDerWaalsContact C-N 3.35Å; M189-T191 PolarHBondContact O-N 3.43Å; T191-W193 VanDerWaalsContact C-N 3.31Å; T191-W193 PolarHBondContact O-N 3.49Å; T191-K194 PolarHBondContact O-N 3.15Å; T191-N195 PolarHBondContact O-N 2.72Å
192	G	90.6	Very high	79.6	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-66.1	-32.6	177.4	0	0	0	0	0	113.2	L150 V188 M189 N195 R196	L150-G192 WeakPolarHBondContact O-CA 3.42Å; V188-G192 PolarHBondContact O-N 2.78Å; M189-G192 PolarHBondContact O-N 2.75Å; G192-N195 PolarHBondContact O-N 2.99Å; G192-R196 WeakPolarHBondContact O-CB 3.5Å; G192-R196 PolarHBondContact O-N 3.01Å
193	W	85.3	Confident	76.9	Confident	68 Å²	68	61 Å²	61	26%	0.258	32%	0.323	S	S	.	.	H	α-helix	trans	-64.9	-43	173.1	-174.5	-91.9	0	0	0	112.1	Q102 M189 E190 T191 N195 R196 A197	Q102-W193 VanDerWaalsContact OE1-CH2 3.26Å; M189-W193 VanDerWaalsContact O-CB 3.27Å; M189-W193 WeakPolarHBondContact O-CB 3.4Å; M189-W193 PolarHBondContact O-N 3.36Å; E190-W193 PolarHBondContact O-N 3.07Å; T191-W193 VanDerWaalsContact C-N 3.31Å; T191-W193 PolarHBondContact O-N 3.49Å; W193-N195 VanDerWaalsContact C-N 3.35Å; W193-R196 PolarHBondContact O-N 3.29Å; W193-A197 VanDerWaalsContact O-CB 3.29Å; W193-A197 WeakPolarHBondContact O-CB 3.23Å; W193-A197 PolarHBondContact O-N 2.7Å
194	K	85.9	Confident	74.4	Confident	104 Å²	104	60.6 Å²	60.6	45%	0.452	32%	0.315	S	S	.	.	H	α-helix	trans	-60.7	-43.1	173.1	-75.6	164.8	178.9	168.2	0	111.4	E190 T191 A197 V198	E190-K194 HydrophobicContact CG-CD 4.46Å; E190-K194 WeakPolarHBondContact O-CB 3.38Å; E190-K194 VanDerWaalsContact O-CG 3.29Å; E190-K194 WeakPolarHBondContact O-CG 3.36Å; E190-K194 PolarHBondContact O-N 3.5Å; E190-K194 WeakPolarHBondContact OE1-CE 3.37Å; E190-K194 IonicContact OE1-NZ 3.24Å; E190-K194 PolarHBondContact OE1-NZ 3.08Å; E190-K194 IonicContact OE2-NZ 3.39Å; E190-K194 PolarHBondContact OE2-NZ 3.08Å; T191-K194 PolarHBondContact O-N 3.15Å; K194-A197 WeakPolarHBondContact O-CB 3.35Å; K194-A197 PolarHBondContact O-N 2.78Å; K194-V198 WeakPolarHBondContact O-CG2 3.48Å; K194-V198 PolarHBondContact O-N 3.13Å
195	N	86.2	Confident	72.1	Confident	53 Å²	53	67.4 Å²	67.4	28%	0.283	34%	0.344	S	S	.	.	H	α-helix	trans	-65.5	-45.3	178.3	-72	-18.9	0	0	0	112.2	L150 T155 T191 G192 W193 A197 V198 G199	L150-N195 PolarHBondContact O-ND2 2.86Å; T155-N195 HydrophobicContact CG2-CB 4.03Å; T191-N195 PolarHBondContact O-N 2.72Å; G192-N195 PolarHBondContact O-N 2.99Å; W193-N195 VanDerWaalsContact C-N 3.35Å; N195-A197 PolarHBondContact O-N 2.66Å; N195-V198 PolarHBondContact O-N 3.38Å; N195-G199 PolarHBondContact O-N 3.44Å
196	R	81.4	Confident	70.2	Confident	1 Å²	1	70.2 Å²	70.2	0%	0.004	36%	0.359	C	S	.	.	H	α-helix	trans	-56.1	-40.3	170.7	-156.6	-174.7	172.6	-158.4	-6	111	E141 L150 G192 W193 G199 Y200 S207 S210 S212 D240	E141-R196 WeakPolarHBondContact OE2-CG 3.25Å; E141-R196 IonicContact OE2-NE 2.72Å; L150-R196 HydrophobicContact CD1-CB 4.21Å; L150-R196 HydrophobicContact CD1-CG 4.35Å; L150-R196 HydrophobicContact CD2-CB 3.96Å; L150-R196 HydrophobicContact CD2-CG 4.34Å; G192-R196 WeakPolarHBondContact O-CB 3.5Å; G192-R196 PolarHBondContact O-N 3.01Å; W193-R196 PolarHBondContact O-N 3.29Å; R196-G199 PolarHBondContact O-N 3.05Å; R196-Y200 WeakPolarHBondContact CD-OH 3.43Å; R196-Y200 WeakPolarHBondContact CG-OH 3.35Å; R196-Y200 PolarHBondContact NE-OH 3.02Å; R196-S207 PolarHBondContact NH2-O 3.45Å; R196-S210 PolarHBondContact NE-OG 3.47Å; R196-S210 VanDerWaalsContact NE-OG 3.1Å; R196-S210 PolarHBondContact NH2-O 2.94Å; R196-S210 PolarHBondContact NH2-OG 3.46Å; R196-S212 PolarHBondContact NH1-OG 3.09Å; R196-D240 IonicContact NH1-OD2 3.62Å; R196-D240 PolarHBondContact NH1-OD2 3.13Å
197	A	62	Low	68.7	Low	33 Å²	33	68.4 Å²	68.4	27%	0.273	35%	0.354	S	S	.	.	H	α-helix	trans	-70.3	-30	179.2	0	0	0	0	0	114.9	W193 K194 N195 G199 Y200	W193-A197 VanDerWaalsContact O-CB 3.29Å; W193-A197 WeakPolarHBondContact O-CB 3.23Å; W193-A197 PolarHBondContact O-N 2.7Å; K194-A197 WeakPolarHBondContact O-CB 3.35Å; K194-A197 PolarHBondContact O-N 2.78Å; N195-A197 PolarHBondContact O-N 2.66Å; A197-G199 VanDerWaalsContact C-N 3.29Å; A197-Y200 HydrophobicContact CB-CD2 4.24Å; A197-Y200 HydrophobicContact CB-CE2 4.45Å; A197-Y200 WeakPolarHBondContact O-CB 3.39Å; A197-Y200 PolarHBondContact O-N 2.98Å
198	V	58.6	Low	67.5	Low	83 Å²	83	62.5 Å²	62.5	50%	0.503	33%	0.334	S	S	.	.	H	α-helix	trans	-70.1	-27.9	172.7	171.7	0	0	0	0	111.5	K194 N195 Y200 T201	K194-V198 WeakPolarHBondContact O-CG2 3.48Å; K194-V198 PolarHBondContact O-N 3.13Å; N195-V198 PolarHBondContact O-N 3.38Å; V198-Y200 VanDerWaalsContact C-N 3.31Å; V198-Y200 PolarHBondContact O-N 3.07Å; V198-T201 PolarHBondContact O-N 3Å; V198-T201 PolarHBondContact O-OG1 3.05Å; V198-T201 VanDerWaalsContact O-OG1 3.11Å
199	G	54.2	Low	66.5	Low	40 Å²	40	64 Å²	64	41%	0.412	34%	0.337	S	S	.	.	H	α-helix	trans	-59	-41.5	167.4	0	0	0	0	0	112.5	N195 R196 A197 T201 L202	N195-G199 PolarHBondContact O-N 3.44Å; R196-G199 PolarHBondContact O-N 3.05Å; A197-G199 VanDerWaalsContact C-N 3.29Å; G199-T201 PolarHBondContact O-N 2.73Å; G199-L202 PolarHBondContact O-N 3.19Å
200	Y	52.7	Low	66.2	Low	35 Å²	35	63.5 Å²	63.5	14%	0.137	34%	0.335	C	S	.	.	H	α-helix	trans	-67.1	-31.7	-178.2	-53.9	-35.2	0	0	0	114.1	R196 A197 V198 N204 D206 S207	R196-Y200 WeakPolarHBondContact CD-OH 3.43Å; R196-Y200 WeakPolarHBondContact CG-OH 3.35Å; R196-Y200 PolarHBondContact NE-OH 3.02Å; A197-Y200 HydrophobicContact CB-CD2 4.24Å; A197-Y200 HydrophobicContact CB-CE2 4.45Å; A197-Y200 WeakPolarHBondContact O-CB 3.39Å; A197-Y200 PolarHBondContact O-N 2.98Å; V198-Y200 VanDerWaalsContact C-N 3.31Å; V198-Y200 PolarHBondContact O-N 3.07Å; Y200-N204 CarbonylContact C-O 3.56Å; Y200-N204 WeakPolarHBondContact CA-O 3.48Å; Y200-N204 VanDerWaalsContact CB-O 3.3Å; Y200-N204 WeakPolarHBondContact CB-O 3.29Å; Y200-N204 CarbonylContact O-C 3.01Å; Y200-N204 WeakPolarHBondContact O-CA 3.47Å; Y200-N204 PolarHBondContact O-N 2.79Å; Y200-N204 VanDerWaalsContact O-N 3.17Å; Y200-D206 WeakPolarHBondContact CE1-O 3.49Å; Y200-S207 VanDerWaalsContact CZ-CA 3.46Å; Y200-S207 VanDerWaalsContact OH-CA 3.25Å; Y200-S207 WeakPolarHBondContact OH-CA 3.32Å; Y200-S207 WeakPolarHBondContact OH-CB 3.47Å
201	T	40.6	Very low	66.3	Low	111 Å²	111	59.1 Å²	59.1	68%	0.681	31%	0.314	S	S	*	.	H	α-helix	trans	-77	-24.9	-177.9	56.7	0	0	0	0	113.1	V198 G199	V198-T201 PolarHBondContact O-N 3Å; V198-T201 PolarHBondContact O-OG1 3.05Å; V198-T201 VanDerWaalsContact O-OG1 3.11Å; G199-T201 PolarHBondContact O-N 2.73Å
202	L	39.5	Very low	66.4	Low	125 Å²	125	56.1 Å²	56.1	65%	0.654	30%	0.296	S	S	*	.	H	α-helix	trans	-79.6	-25.5	178.9	-87.8	161	0	0	0	114.1	G199	G199-L202 PolarHBondContact O-N 3.19Å
203	M	37.6	Very low	66.6	Low	127 Å²	127	56.4 Å²	56.4	63%	0.626	30%	0.297	S	S	*	.	S	Bend	trans	-135.7	-53.9	179.5	-76	-169.9	166.5	0	0	115.7
204	N	42.2	Very low	67.2	Low	34 Å²	34	53.1 Å²	53.1	18%	0.182	29%	0.285	C	S	.	.			trans	-156.2	143.7	174.8	-81	-67.3	0	0	0	114.4	Y200 D206 R209 R256	Y200-N204 CarbonylContact C-O 3.56Å; Y200-N204 WeakPolarHBondContact CA-O 3.48Å; Y200-N204 VanDerWaalsContact CB-O 3.3Å; Y200-N204 WeakPolarHBondContact CB-O 3.29Å; Y200-N204 CarbonylContact O-C 3.01Å; Y200-N204 WeakPolarHBondContact O-CA 3.47Å; Y200-N204 PolarHBondContact O-N 2.79Å; Y200-N204 VanDerWaalsContact O-N 3.17Å; N204-D206 VanDerWaalsContact C-N 3.32Å; N204-D206 PolarHBondContact O-N 2.88Å; N204-R209 PolarHBondContact ND2-NH1 2.91Å; N204-R256 PolarHBondContact ND2-NE 3.03Å; N204-R256 VanDerWaalsContact ND2-NE 3.18Å; N204-R256 VanDerWaalsContact OD1-CZ 3.29Å; N204-R256 PolarHBondContact OD1-NE 3.04Å; N204-R256 PolarHBondContact OD1-NH2 2.73Å
205	K	46.2	Very low	67.7	Low	195 Å²	195	48.6 Å²	48.6	85%	0.848	27%	0.266	S	S	*	.	S	Bend	trans	-78.4	25.5	-158.1	-143.8	-179.6	-172.1	-179.7	0	117.3
206	D	55.1	Low	68.2	Low	61 Å²	61	46.2 Å²	46.2	33%	0.326	25%	0.253	S	S	.	.			trans	-142.1	130.1	-165.8	-170.2	3.2	0	0	0	115.7	Y200 N204 S208	Y200-D206 WeakPolarHBondContact CE1-O 3.49Å; N204-D206 VanDerWaalsContact C-N 3.32Å; N204-D206 PolarHBondContact O-N 2.88Å; D206-S208 PolarHBondContact O-N 2.93Å; D206-S208 PolarHBondContact OD1-N 2.97Å; D206-S208 PolarHBondContact OD1-OG 2.78Å; D206-S208 VanDerWaalsContact OD2-CB 3.3Å; D206-S208 WeakPolarHBondContact OD2-CB 3.43Å; D206-S208 PolarHBondContact OD2-OG 2.84Å
207	S	62	Low	68.9	Low	34 Å²	34	48.1 Å²	48.1	24%	0.238	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-63.9	-10	171.7	45.2	0	0	0	0	116	R196 Y200 R209	R196-S207 PolarHBondContact NH2-O 3.45Å; Y200-S207 VanDerWaalsContact CZ-CA 3.46Å; Y200-S207 VanDerWaalsContact OH-CA 3.25Å; Y200-S207 WeakPolarHBondContact OH-CA 3.32Å; Y200-S207 WeakPolarHBondContact OH-CB 3.47Å; S207-R209 PolarHBondContact O-N 2.92Å
208	S	67.1	Low	70.4	Confident	13 Å²	13	46.6 Å²	46.6	9%	0.091	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-58.1	-9.7	172.7	56.1	0	0	0	0	115.5	T93 D206 A242 G243	T93-S208 WeakPolarHBondContact OG1-CB 3.4Å; D206-S208 PolarHBondContact O-N 2.93Å; D206-S208 PolarHBondContact OD1-N 2.97Å; D206-S208 PolarHBondContact OD1-OG 2.78Å; D206-S208 VanDerWaalsContact OD2-CB 3.3Å; D206-S208 WeakPolarHBondContact OD2-CB 3.43Å; D206-S208 PolarHBondContact OD2-OG 2.84Å; S208-A242 CarbonylContact O-C 3.51Å; S208-A242 VanDerWaalsContact O-CA 3.29Å; S208-A242 WeakPolarHBondContact O-CA 3.46Å; S208-A242 VanDerWaalsContact O-CB 3.24Å; S208-A242 WeakPolarHBondContact O-CB 3.26Å; S208-G243 PolarHBondContact O-N 2.82Å
209	R	75.4	Confident	72	Confident	53 Å²	53	46 Å²	46	20%	0.2	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-114.4	-10.3	-157.6	-56.8	-155.6	-177.9	-173.7	-6.3	116.9	Y143 N204 S207 E259 I263	Y143-R209 WeakPolarHBondContact CD2-O 3.16Å; N204-R209 PolarHBondContact ND2-NH1 2.91Å; S207-R209 PolarHBondContact O-N 2.92Å; R209-E259 WeakPolarHBondContact CD-OE1 3.47Å; R209-E259 IonicContact CZ-OE1 3.41Å; R209-E259 IonicContact CZ-OE2 3.99Å; R209-E259 IonicContact NE-OE1 3.46Å; R209-E259 IonicContact NH1-OE1 2.77Å; R209-E259 PolarHBondContact NH1-OE1 3.17Å; R209-E259 IonicContact NH1-OE2 2.79Å; R209-E259 PolarHBondContact NH1-OE2 2.92Å; R209-I263 HydrophobicContact CB-CD1 3.75Å; R209-I263 HydrophobicContact CG-CD1 4.07Å; R209-I263 WeakPolarHBondContact O-CD1 3.36Å; R209-I263 WeakPolarHBondContact O-CG1 3.36Å
210	S	85.8	Confident	73.8	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.007	23%	0.225	C	C	.	.			trans	-126.3	148.4	169.5	68.3	0	0	0	0	110	E141 I142 R196	E141-S210 WeakPolarHBondContact OE2-CB 3.42Å; E141-S210 PolarHBondContact OE2-OG 3.14Å; I142-S210 WeakPolarHBondContact O-CA 3.34Å; R196-S210 PolarHBondContact NE-OG 3.47Å; R196-S210 VanDerWaalsContact NE-OG 3.1Å; R196-S210 PolarHBondContact NH2-O 2.94Å; R196-S210 PolarHBondContact NH2-OG 3.46Å
211	H	91.8	Very high	75.6	Confident	4 Å²	4	46.3 Å²	46.3	2%	0.019	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	132.7	166.8	-48.4	-82.3	0	0	0	107.8	E141 I142 D240 L241 A242 S266 L292	E141-H211 CarbonylContact C-O 3.57Å; E141-H211 WeakPolarHBondContact CA-O 3.42Å; I142-H211 HydrophobicContact CB-CB 4.32Å; I142-H211 PolarHBondContact N-O 3.25Å; I142-H211 PolarHBondContact O-N 2.68Å; H211-D240 WeakPolarHBondContact CA-O 3.35Å; H211-L241 HydrophobicContact CB-CD2 4.2Å; H211-L241 WeakPolarHBondContact ND1-CA 3.45Å; H211-L241 WeakPolarHBondContact ND1-CD2 3.35Å; H211-A242 WeakPolarHBondContact CE1-CB 3.44Å; H211-A242 PolarHBondContact CE1-N 3.31Å; H211-A242 PolarHBondContact ND1-N 3.04Å; H211-S266 PolarHBondContact NE2-OG 2.75Å; H211-L292 HydrophobicContact CB-CD1 4.22Å
212	S	93.4	Very high	77.8	Confident	3 Å²	3	42 Å²	42	2%	0.021	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	132.6	175.1	69.3	0	0	0	0	111.2	L140 R196 V239 D240	L140-S212 WeakPolarHBondContact O-CA 3.47Å; R196-S212 PolarHBondContact NH1-OG 3.09Å; S212-V239 WeakPolarHBondContact O-CA 3.37Å; S212-D240 PolarHBondContact N-O 3.32Å; S212-D240 PolarHBondContact O-N 2.89Å
213	I	96.3	Very high	79.8	Confident	6 Å²	6	38.9 Å²	38.9	3%	0.031	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	105.2	-179.7	-55.7	-178	0	0	0	107.8	L140 I142 N237 V239 L295 L296	L140-I213 HydrophobicContact CD1-CB 3.84Å; L140-I213 HydrophobicContact CD1-CD1 4.2Å; L140-I213 HydrophobicContact CD1-CG1 4.03Å; L140-I213 HydrophobicContact CG-CB 4.05Å; L140-I213 PolarHBondContact N-O 3.09Å; L140-I213 VanDerWaalsContact N-O 3.08Å; L140-I213 PolarHBondContact O-N 3.19Å; I142-I213 HydrophobicContact CD1-CD1 4.29Å; I213-N237 HydrophobicContact CG2-CB 4.38Å; I213-V239 HydrophobicContact CG1-CG1 4.1Å; I213-V239 HydrophobicContact CG1-CG2 4.1Å; I213-V239 HydrophobicContact CG2-CG2 4.17Å; I213-L295 HydrophobicContact CD1-CB 4.3Å; I213-L295 HydrophobicContact CD1-CD1 4.35Å; I213-L296 HydrophobicContact CD1-CD2 4.38Å
214	F	97.1	Very high	81.8	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	128.4	167.1	-166.3	-75.1	0	0	0	107.9	F118 A137 Y139 V188 M189 I216 L238	F118-F214 HydrophobicContact CE1-CD1 4.03Å; F118-F214 AromaticContact CE1-CE1 3.46Å; F118-F214 HydrophobicContact CE1-CE1 3.46Å; F118-F214 VanDerWaalsContact CE1-CE1 3.46Å; F118-F214 AromaticContact CE1-CZ 3.85Å; F118-F214 HydrophobicContact CE1-CZ 3.85Å; F118-F214 HydrophobicContact CZ-CD1 4.23Å; F118-F214 AromaticContact CZ-CE1 3.65Å; F118-F214 HydrophobicContact CZ-CE1 3.65Å; F118-F214 HydrophobicContact CZ-CE2 4.1Å; F118-F214 AromaticContact CZ-CZ 3.56Å; F118-F214 HydrophobicContact CZ-CZ 3.56Å; A137-F214 HydrophobicContact CB-CE1 4Å; A137-F214 HydrophobicContact CB-CZ 3.8Å; Y139-F214 AromaticContact CD1-CD2 3.72Å; Y139-F214 HydrophobicContact CD1-CD2 3.72Å; Y139-F214 HydrophobicContact CD1-CE2 4.23Å; Y139-F214 HydrophobicContact CD2-CB 3.74Å; Y139-F214 AromaticContact CD2-CD2 3.84Å; Y139-F214 HydrophobicContact CD2-CD2 3.84Å; Y139-F214 HydrophobicContact CD2-CG 4.24Å; Y139-F214 HydrophobicContact CE1-CD2 4.25Å; Y139-F214 HydrophobicContact CE2-CB 4.01Å; Y139-F214 HydrophobicContact CE2-CD2 4.32Å; Y139-F214 HydrophobicContact CG-CB 4.3Å; Y139-F214 AromaticContact CG-CD2 3.52Å; Y139-F214 HydrophobicContact CG-CD2 3.52Å; Y139-F214 HydrophobicContact CG-CE2 4.27Å; Y139-F214 HydrophobicContact CG-CG 4.3Å; V188-F214 HydrophobicContact CG1-CE2 4.11Å; V188-F214 HydrophobicContact CG1-CZ 4.2Å; M189-F214 HydrophobicContact CB-CD2 4.46Å; M189-F214 HydrophobicContact CB-CE2 3.9Å; M189-F214 HydrophobicContact CG-CD2 4.44Å; M189-F214 HydrophobicContact CG-CE2 4.36Å; F214-I216 HydrophobicContact CD1-CG1 4.23Å; F214-I216 HydrophobicContact CE1-CG1 3.95Å; F214-L238 HydrophobicContact CB-CB 4.33Å; F214-L238 HydrophobicContact CD1-CD1 4.49Å; F214-L238 PolarHBondContact N-O 2.96Å; F214-L238 PolarHBondContact O-N 3.23Å
215	T	97.1	Very high	83.4	Confident	9 Å²	9	43.5 Å²	43.5	6%	0.055	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	128.4	-177.9	-44.9	0	0	0	0	110.2	A137 S138 N217 K235 L236	A137-T215 CarbonylContact C-O 3.57Å; A137-T215 WeakPolarHBondContact CA-O 3.35Å; S138-T215 PolarHBondContact N-O 3.13Å; S138-T215 PolarHBondContact O-N 2.85Å; T215-N217 WeakPolarHBondContact CG2-OD1 3.41Å; T215-K235 HydrophobicContact CG2-CD 4.36Å; T215-K235 HydrophobicContact CG2-CG 3.8Å; T215-L236 CarbonylContact C-O 3.56Å; T215-L236 WeakPolarHBondContact CA-O 3.39Å
216	I	96.8	Very high	84.8	Confident	2 Å²	2	44.6 Å²	44.6	1%	0.01	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	119.5	166.9	-48.7	177	0	0	0	107.6	F118 V135 F214 I218 K235 L236 L238	F118-I216 HydrophobicContact CD1-CD1 3.72Å; F118-I216 HydrophobicContact CE1-CD1 3.89Å; F118-I216 HydrophobicContact CE1-CG1 4.4Å; V135-I216 HydrophobicContact CG1-CG2 3.48Å; V135-I216 VanDerWaalsContact CG1-CG2 3.48Å; F214-I216 HydrophobicContact CD1-CG1 4.23Å; F214-I216 HydrophobicContact CE1-CG1 3.95Å; I216-I218 HydrophobicContact CG2-CG1 4.01Å; I216-K235 CarbonylContact O-C 3.38Å; I216-K235 WeakPolarHBondContact O-CA 3.48Å; I216-L236 HydrophobicContact CB-CB 4.33Å; I216-L236 HydrophobicContact CD1-CD2 4.25Å; I216-L236 PolarHBondContact N-O 3.47Å; I216-L236 PolarHBondContact O-N 2.85Å; I216-L238 HydrophobicContact CD1-CD1 4.33Å
217	N	95.2	Very high	85.7	Confident	41 Å²	41	44.5 Å²	44.5	22%	0.219	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	128.9	166.3	-73.2	60.9	0	0	0	108.3	V135 R136 M176 T215	V135-N217 WeakPolarHBondContact CA-O 3.5Å; R136-N217 PolarHBondContact N-O 2.98Å; R136-N217 PolarHBondContact O-N 2.93Å; M176-N217 HydrophobicContact CE-CB 4.1Å; T215-N217 WeakPolarHBondContact CG2-OD1 3.41Å
218	I	94.6	Very high	86.4	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	111	175.9	-48.6	-178.7	0	0	0	107.4	V79 T80 V121 F133 V135 I216 I220 A233 G234	V79-I218 HydrophobicContact CG1-CD1 4.04Å; T80-I218 HydrophobicContact CG2-CD1 4.09Å; V121-I218 HydrophobicContact CG1-CD1 3.66Å; V121-I218 HydrophobicContact CG1-CG1 4.42Å; V121-I218 HydrophobicContact CG2-CD1 4.07Å; F133-I218 HydrophobicContact CD1-CG2 3.85Å; V135-I218 HydrophobicContact CG2-CG2 4.45Å; I216-I218 HydrophobicContact CG2-CG1 4.01Å; I218-I220 HydrophobicContact CG2-CD1 4.41Å; I218-I220 HydrophobicContact CG2-CG1 3.72Å; I218-A233 CarbonylContact O-C 3.59Å; I218-A233 WeakPolarHBondContact O-CA 3.28Å; I218-G234 PolarHBondContact N-O 2.89Å; I218-G234 PolarHBondContact O-N 3.32Å
219	E	92.3	Very high	87.1	Confident	71 Å²	71	49.7 Å²	49.7	33%	0.332	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	127	165.8	-74.4	168.9	175.9	0	0	108.2	F133 L134 R136	F133-E219 CarbonylContact C-O 3.56Å; F133-E219 WeakPolarHBondContact CA-O 3.5Å; L134-E219 HydrophobicContact CB-CB 4.28Å; L134-E219 PolarHBondContact N-O 2.96Å; L134-E219 PolarHBondContact O-N 2.84Å; R136-E219 IonicContact CZ-OE1 3.5Å; R136-E219 IonicContact CZ-OE2 2.77Å; R136-E219 VanDerWaalsContact NH1-CD 3.28Å; R136-E219 IonicContact NH1-OE1 3.3Å; R136-E219 PolarHBondContact NH1-OE1 2.74Å; R136-E219 IonicContact NH1-OE2 2.7Å; R136-E219 PolarHBondContact NH1-OE2 3.2Å; R136-E219 IonicContact NH2-OE1 2.62Å; R136-E219 PolarHBondContact NH2-OE1 2.89Å; R136-E219 IonicContact NH2-OE2 2.69Å; R136-E219 PolarHBondContact NH2-OE2 2.85Å
220	I	91.3	Very high	87.6	Confident	8 Å²	8	49.3 Å²	49.3	4%	0.041	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	118.6	-170	-51.2	157.7	0	0	0	107.6	T80 T131 F133 I218 L231 R232	T80-I220 VanDerWaalsContact O-CD1 3.26Å; T80-I220 WeakPolarHBondContact O-CD1 3.33Å; T131-I220 HydrophobicContact CG2-CG2 3.58Å; F133-I220 HydrophobicContact CD1-CB 4.34Å; F133-I220 HydrophobicContact CD1-CG1 3.9Å; F133-I220 HydrophobicContact CD1-CG2 4.11Å; F133-I220 HydrophobicContact CE1-CB 4.36Å; F133-I220 HydrophobicContact CE1-CG1 3.97Å; F133-I220 HydrophobicContact CE1-CG2 3.72Å; F133-I220 HydrophobicContact CZ-CG2 4.3Å; I218-I220 HydrophobicContact CG2-CD1 4.41Å; I218-I220 HydrophobicContact CG2-CG1 3.72Å; I220-L231 WeakPolarHBondContact O-CA 3.28Å; I220-R232 HydrophobicContact CB-CB 4.19Å; I220-R232 HydrophobicContact CD1-CB 4.16Å; I220-R232 PolarHBondContact N-O 2.92Å; I220-R232 PolarHBondContact O-N 3.16Å
221	Y	89.8	Confident	87.7	Confident	73 Å²	73	53 Å²	53	29%	0.286	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	106.7	178.2	172.8	-88.5	0	0	0	108.6	T131 K132 V223 D229 H230	T131-Y221 CarbonylContact C-O 3.59Å; T131-Y221 WeakPolarHBondContact CA-O 3.29Å; K132-Y221 HydrophobicContact CB-CD1 4.19Å; K132-Y221 HydrophobicContact CD-CD1 3.92Å; K132-Y221 HydrophobicContact CD-CE1 4.2Å; K132-Y221 HydrophobicContact CG-CD1 4.29Å; K132-Y221 PolarHBondContact N-O 3.46Å; K132-Y221 PolarHBondContact O-N 3.32Å; Y221-V223 HydrophobicContact CE1-CG2 3.89Å; Y221-D229 HydrophobicContact CE2-CB 3.87Å; Y221-D229 WeakPolarHBondContact CE2-OD2 3.38Å; Y221-D229 VanDerWaalsContact CZ-OD2 3.27Å; Y221-D229 PolarHBondContact OH-OD1 2.99Å; Y221-D229 VanDerWaalsContact OH-OD1 3.07Å; Y221-D229 PolarHBondContact OH-OD2 3.16Å; Y221-H230 WeakPolarHBondContact CA-O 3.35Å
222	A	86.9	Confident	87.7	Confident	21 Å²	21	56.5 Å²	56.5	17%	0.174	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	153.8	175.4	0	0	0	0	0	110	T131 H230	T131-A222 HydrophobicContact CG2-CB 4.14Å; A222-H230 HydrophobicContact CB-CB 4.49Å; A222-H230 PolarHBondContact N-O 2.99Å; A222-H230 PolarHBondContact O-N 2.89Å
223	V	82.1	Confident	87.6	Confident	59 Å²	59	58.3 Å²	58.3	36%	0.358	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	129.1	169.8	-175.5	0	0	0	0	107.8	Y221 K228	Y221-V223 HydrophobicContact CE1-CG2 3.89Å; V223-K228 WeakPolarHBondContact CA-O 3.5Å
224	D	79.6	Confident	87.5	Confident	50 Å²	50	58.1 Å²	58.1	27%	0.267	29%	0.294	S	S	.	.			trans	-76.9	170.7	178.4	85.2	-13.3	0	0	0	112.8	R226 G227 K228	D224-R226 PolarHBondContact O-N 2.85Å; D224-R226 VanDerWaalsContact OD1-C 3.29Å; D224-R226 VanDerWaalsContact OD1-CA 3.26Å; D224-R226 WeakPolarHBondContact OD1-CA 3.45Å; D224-R226 VanDerWaalsContact OD1-CB 3.28Å; D224-R226 WeakPolarHBondContact OD1-CB 3.42Å; D224-R226 PolarHBondContact OD1-N 3.11Å; D224-G227 PolarHBondContact O-N 3.1Å; D224-G227 PolarHBondContact OD1-N 3.29Å; D224-G227 VanDerWaalsContact OD1-N 3.09Å; D224-K228 PolarHBondContact N-O 2.84Å; D224-K228 WeakPolarHBondContact OD1-CB 3.23Å; D224-K228 PolarHBondContact OD1-N 2.9Å
225	E	76.1	Confident	87.4	Confident	208 Å²	208	61 Å²	61	97%	0.972	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-9.9	176.6	-59.2	179.3	151.6	0	0	113.9
226	R	75.1	Confident	87.4	Confident	219 Å²	219	60.6 Å²	60.6	83%	0.826	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	4	-179.1	-49.5	176.4	177.9	-161.3	-2.7	111.8	D224	D224-R226 PolarHBondContact O-N 2.85Å; D224-R226 VanDerWaalsContact OD1-C 3.29Å; D224-R226 VanDerWaalsContact OD1-CA 3.26Å; D224-R226 WeakPolarHBondContact OD1-CA 3.45Å; D224-R226 VanDerWaalsContact OD1-CB 3.28Å; D224-R226 WeakPolarHBondContact OD1-CB 3.42Å; D224-R226 PolarHBondContact OD1-N 3.11Å
227	G	73.5	Confident	87.5	Confident	58 Å²	58	60.8 Å²	60.8	60%	0.598	31%	0.305	S	S	*	.	S	Bend	trans	76.6	21.2	-178.8	0	0	0	0	0	113.9	D224	D224-G227 PolarHBondContact O-N 3.1Å; D224-G227 PolarHBondContact OD1-N 3.29Å; D224-G227 VanDerWaalsContact OD1-N 3.09Å
228	K	77.5	Confident	87.6	Confident	75 Å²	75	58.9 Å²	58.9	33%	0.326	30%	0.295	S	S	.	.			trans	-97.8	128.7	178.8	-167.4	-161.9	160.3	-169.7	0	111.6	V223 D224 D347 L350	V223-K228 WeakPolarHBondContact CA-O 3.5Å; D224-K228 PolarHBondContact N-O 2.84Å; D224-K228 WeakPolarHBondContact OD1-CB 3.23Å; D224-K228 PolarHBondContact OD1-N 2.9Å; K228-D347 IonicContact NZ-OD1 2.7Å; K228-D347 PolarHBondContact NZ-OD1 3.26Å; K228-L350 VanDerWaalsContact NZ-CD1 3.29Å
229	D	82	Confident	87.7	Confident	82 Å²	82	58.8 Å²	58.8	44%	0.439	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	137.1	171.9	-66.4	11.1	0	0	0	112.5	Y221	Y221-D229 HydrophobicContact CE2-CB 3.87Å; Y221-D229 WeakPolarHBondContact CE2-OD2 3.38Å; Y221-D229 VanDerWaalsContact CZ-OD2 3.27Å; Y221-D229 PolarHBondContact OH-OD1 2.99Å; Y221-D229 VanDerWaalsContact OH-OD1 3.07Å; Y221-D229 PolarHBondContact OH-OD2 3.16Å
230	H	84.8	Confident	87.9	Confident	45 Å²	45	55.7 Å²	55.7	21%	0.208	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	117.9	174.3	-78.3	-52.8	0	0	0	110.6	Y221 A222 D347	Y221-H230 WeakPolarHBondContact CA-O 3.35Å; A222-H230 HydrophobicContact CB-CB 4.49Å; A222-H230 PolarHBondContact N-O 2.99Å; A222-H230 PolarHBondContact O-N 2.89Å; H230-D347 IonicContact CE1-OD1 2.83Å; H230-D347 IonicContact CE1-OD2 3.93Å; H230-D347 IonicContact CG-OD2 3.7Å; H230-D347 IonicContact ND1-OD1 3.87Å; H230-D347 IonicContact ND1-OD2 3.18Å; H230-D347 PolarHBondContact ND1-OD2 3.27Å
231	L	87.8	Confident	87.9	Confident	78 Å²	78	55.4 Å²	55.4	41%	0.408	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	125.5	178.4	-175.3	66.7	0	0	0	111	I220 E343 D344	I220-L231 WeakPolarHBondContact O-CA 3.28Å; L231-E343 VanDerWaalsContact O-CA 3.27Å; L231-E343 WeakPolarHBondContact O-CA 3.19Å; L231-E343 WeakPolarHBondContact O-CB 3.4Å; L231-D344 PolarHBondContact O-N 3.46Å; L231-D344 VanDerWaalsContact O-N 3.14Å
232	R	91.6	Very high	87.9	Confident	77 Å²	77	51.9 Å²	51.9	29%	0.291	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	160.2	172.7	-50.1	-179.5	-168.3	167.5	9.5	111.5	E81 I220 I341 N342 E343	E81-R232 VanDerWaalsContact O-CD 3.31Å; E81-R232 WeakPolarHBondContact O-CD 3.39Å; E81-R232 PolarHBondContact O-NH1 2.83Å; I220-R232 HydrophobicContact CB-CB 4.19Å; I220-R232 HydrophobicContact CD1-CB 4.16Å; I220-R232 PolarHBondContact N-O 2.92Å; I220-R232 PolarHBondContact O-N 3.16Å; R232-I341 HydrophobicContact CG-CG2 4.25Å; R232-N342 CarbonylContact C-O 3.59Å; R232-N342 WeakPolarHBondContact CA-O 3.3Å; R232-N342 WeakPolarHBondContact CB-O 3.37Å; R232-E343 HydrophobicContact CG-CB 4.11Å
233	A	91.6	Very high	88	Confident	41 Å²	41	51 Å²	51	34%	0.339	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	108.4	-179.9	0	0	0	0	0	112	I218 N342	I218-A233 CarbonylContact O-C 3.59Å; I218-A233 WeakPolarHBondContact O-CA 3.28Å; A233-N342 HydrophobicContact CB-CB 4.4Å; A233-N342 PolarHBondContact N-O 2.86Å; A233-N342 WeakPolarHBondContact O-CB 3.36Å; A233-N342 PolarHBondContact O-ND2 3.12Å
234	G	94.1	Very high	88.2	Confident	2 Å²	2	49 Å²	49	2%	0.021	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	145.3	167.5	0	0	0	0	0	112	V79 Y83 I218	V79-G234 WeakPolarHBondContact O-CA 3.48Å; Y83-G234 WeakPolarHBondContact O-CA 3.5Å; I218-G234 PolarHBondContact N-O 2.89Å; I218-G234 PolarHBondContact O-N 3.32Å
235	K	95.6	Very high	88.1	Confident	61 Å²	61	48 Å²	48	27%	0.265	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	111.3	170.7	-172.4	-164.3	-178.2	-157.1	0	110.5	Y83 N84 G85 T215 I216 N237	Y83-K235 PolarHBondContact O-N 2.87Å; N84-K235 CarbonylContact C-O 3.53Å; N84-K235 WeakPolarHBondContact CA-O 3.48Å; N84-K235 WeakPolarHBondContact OD1-CB 3.46Å; G85-K235 PolarHBondContact N-O 2.98Å; G85-K235 VanDerWaalsContact O-O 3.12Å; T215-K235 HydrophobicContact CG2-CD 4.36Å; T215-K235 HydrophobicContact CG2-CG 3.8Å; I216-K235 CarbonylContact O-C 3.38Å; I216-K235 WeakPolarHBondContact O-CA 3.48Å; K235-N237 WeakPolarHBondContact CE-OD1 3.45Å; K235-N237 PolarHBondContact NZ-OD1 3.04Å; K235-N237 VanDerWaalsContact NZ-OD1 3.1Å
236	L	97.8	Very high	87.7	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	115.8	173.8	-179.4	59.2	0	0	0	110.2	L75 V76 V79 G85 I87 A117 T215 I216 L238	L75-L236 HydrophobicContact CD2-CD1 3.71Å; V76-L236 HydrophobicContact CG1-CD2 4.38Å; V76-L236 HydrophobicContact CG2-CD2 3.99Å; V79-L236 HydrophobicContact CB-CB 4.41Å; V79-L236 HydrophobicContact CG1-CB 4.03Å; V79-L236 HydrophobicContact CG2-CB 4.05Å; V79-L236 HydrophobicContact CG2-CD1 4.22Å; G85-L236 CarbonylContact O-C 3.59Å; G85-L236 WeakPolarHBondContact O-CA 3.36Å; I87-L236 HydrophobicContact CG1-CD1 4.48Å; A117-L236 HydrophobicContact CB-CD2 3.92Å; T215-L236 CarbonylContact C-O 3.56Å; T215-L236 WeakPolarHBondContact CA-O 3.39Å; I216-L236 HydrophobicContact CB-CB 4.33Å; I216-L236 HydrophobicContact CD1-CD2 4.25Å; I216-L236 PolarHBondContact N-O 3.47Å; I216-L236 PolarHBondContact O-N 2.85Å; L236-L238 HydrophobicContact CD1-CD2 4.4Å; L236-L238 HydrophobicContact CD2-CD1 4.02Å; L236-L238 HydrophobicContact CD2-CD2 4.21Å; L236-L238 HydrophobicContact CD2-CG 4.17Å; L236-L238 HydrophobicContact CG-CD1 4.25Å; L236-L238 HydrophobicContact CG-CD2 4.25Å; L236-L238 HydrophobicContact CG-CG 3.98Å
237	N	97.9	Very high	87.1	Confident	6 Å²	6	37.9 Å²	37.9	3%	0.032	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	125.1	170.7	-42.3	-92.5	0	0	0	109.2	G85 T86 I87 I213 K235 V239	G85-N237 PolarHBondContact O-N 2.85Å; G85-N237 PolarHBondContact O-ND2 3.49Å; G85-N237 VanDerWaalsContact O-ND2 3.11Å; T86-N237 WeakPolarHBondContact CA-O 3.44Å; T86-N237 HydrophobicContact CG2-CB 4.24Å; T86-N237 PolarHBondContact OG1-ND2 2.94Å; I87-N237 PolarHBondContact N-O 2.68Å; I213-N237 HydrophobicContact CG2-CB 4.38Å; K235-N237 WeakPolarHBondContact CE-OD1 3.45Å; K235-N237 PolarHBondContact NZ-OD1 3.04Å; K235-N237 VanDerWaalsContact NZ-OD1 3.1Å; N237-V239 HydrophobicContact CB-CG2 4.35Å
238	L	97.8	Very high	86.4	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	109.2	179.1	-66.4	158.4	0	0	0	108.1	I87 M101 I113 I114 A117 F214 I216 L236	I87-L238 HydrophobicContact CB-CD2 4.25Å; I87-L238 HydrophobicContact CD1-CD2 4.17Å; I87-L238 HydrophobicContact CG1-CD2 4.47Å; M101-L238 HydrophobicContact CE-CB 4.02Å; M101-L238 HydrophobicContact CE-CD2 4.16Å; I113-L238 HydrophobicContact CG2-CD2 4.07Å; I114-L238 HydrophobicContact CB-CD1 4.43Å; I114-L238 HydrophobicContact CD1-CB 4.29Å; I114-L238 HydrophobicContact CG1-CB 3.9Å; I114-L238 HydrophobicContact CG1-CD1 4.08Å; I114-L238 HydrophobicContact CG1-CD2 4.3Å; I114-L238 HydrophobicContact CG1-CG 4.3Å; I114-L238 HydrophobicContact CG2-CD1 4.22Å; A117-L238 HydrophobicContact CB-CD1 4.32Å; F214-L238 HydrophobicContact CB-CB 4.33Å; F214-L238 HydrophobicContact CD1-CD1 4.49Å; F214-L238 PolarHBondContact N-O 2.96Å; F214-L238 PolarHBondContact O-N 3.23Å; I216-L238 HydrophobicContact CD1-CD1 4.33Å; L236-L238 HydrophobicContact CD1-CD2 4.4Å; L236-L238 HydrophobicContact CD2-CD1 4.02Å; L236-L238 HydrophobicContact CD2-CD2 4.21Å; L236-L238 HydrophobicContact CD2-CG 4.17Å; L236-L238 HydrophobicContact CG-CD1 4.25Å; L236-L238 HydrophobicContact CG-CD2 4.25Å; L236-L238 HydrophobicContact CG-CG 3.98Å
239	V	97.3	Very high	85.5	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	121.7	-164.1	-174.2	0	0	0	0	111.7	T86 I87 F88 A89 S212 I213 N237 L241 L296	T86-V239 HydrophobicContact CG2-CG2 4.37Å; I87-V239 PolarHBondContact O-N 3.09Å; F88-V239 WeakPolarHBondContact CA-O 3.31Å; F88-V239 HydrophobicContact CB-CB 3.68Å; F88-V239 HydrophobicContact CB-CG1 4.16Å; F88-V239 HydrophobicContact CB-CG2 4.32Å; A89-V239 PolarHBondContact N-O 3.04Å; S212-V239 WeakPolarHBondContact O-CA 3.37Å; I213-V239 HydrophobicContact CG1-CG1 4.1Å; I213-V239 HydrophobicContact CG1-CG2 4.1Å; I213-V239 HydrophobicContact CG2-CG2 4.17Å; N237-V239 HydrophobicContact CB-CG2 4.35Å; V239-L241 HydrophobicContact CG1-CD2 3.45Å; V239-L241 VanDerWaalsContact CG1-CD2 3.45Å; V239-L241 HydrophobicContact CG1-CG 3.96Å; V239-L296 HydrophobicContact CG2-CD2 4.16Å
240	D	94.9	Very high	84.4	Confident	6 Å²	6	40.5 Å²	40.5	3%	0.032	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	106.3	168.6	-175.7	42.2	0	0	0	108.2	K97 S98 M101 R196 H211 S212	K97-D240 VanDerWaalsContact CB-OD1 3.28Å; K97-D240 WeakPolarHBondContact CB-OD1 3.17Å; S98-D240 WeakPolarHBondContact CA-OD1 3.39Å; S98-D240 WeakPolarHBondContact CB-OD2 3.48Å; S98-D240 PolarHBondContact N-OD1 2.92Å; S98-D240 VanDerWaalsContact N-OD1 3.08Å; S98-D240 VanDerWaalsContact OG-CG 3.31Å; S98-D240 PolarHBondContact OG-OD1 3.49Å; S98-D240 PolarHBondContact OG-OD2 2.93Å; M101-D240 HydrophobicContact CB-CB 4.38Å; M101-D240 HydrophobicContact CG-CB 4.16Å; R196-D240 IonicContact NH1-OD2 3.62Å; R196-D240 PolarHBondContact NH1-OD2 3.13Å; H211-D240 WeakPolarHBondContact CA-O 3.35Å; S212-D240 PolarHBondContact N-O 3.32Å; S212-D240 PolarHBondContact O-N 2.89Å
241	L	93.2	Very high	83.2	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.005	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-80.3	166.8	-176.4	-61.6	177.4	0	0	0	112.2	F88 A89 Y90 K97 H211 V239 L267 L270 L292	F88-L241 HydrophobicContact CD2-CD1 3.83Å; F88-L241 HydrophobicContact CE2-CD1 4.48Å; A89-L241 VanDerWaalsContact O-CB 3.32Å; A89-L241 WeakPolarHBondContact O-CB 3.44Å; A89-L241 WeakPolarHBondContact O-CG 3.21Å; A89-L241 PolarHBondContact O-N 2.69Å; Y90-L241 HydrophobicContact CD2-CD1 3.86Å; K97-L241 WeakPolarHBondContact CE-O 3.22Å; H211-L241 HydrophobicContact CB-CD2 4.2Å; H211-L241 WeakPolarHBondContact ND1-CA 3.45Å; H211-L241 WeakPolarHBondContact ND1-CD2 3.35Å; V239-L241 HydrophobicContact CG1-CD2 3.45Å; V239-L241 VanDerWaalsContact CG1-CD2 3.45Å; V239-L241 HydrophobicContact CG1-CG 3.96Å; L241-L267 HydrophobicContact CD1-CD2 4.3Å; L241-L270 HydrophobicContact CD1-CD2 4.06Å; L241-L292 HydrophobicContact CD2-CD1 3.76Å; L241-L292 HydrophobicContact CD2-CD2 4.04Å
242	A	89.8	Confident	81.9	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-66.4	172.8	169.6	0	0	0	0	0	113.2	K97 S208 H211 I263 L267	K97-A242 WeakPolarHBondContact CE-O 3.39Å; K97-A242 PolarHBondContact NZ-O 3.34Å; K97-A242 VanDerWaalsContact NZ-O 3.08Å; S208-A242 CarbonylContact O-C 3.51Å; S208-A242 VanDerWaalsContact O-CA 3.29Å; S208-A242 WeakPolarHBondContact O-CA 3.46Å; S208-A242 VanDerWaalsContact O-CB 3.24Å; S208-A242 WeakPolarHBondContact O-CB 3.26Å; H211-A242 WeakPolarHBondContact CE1-CB 3.44Å; H211-A242 PolarHBondContact CE1-N 3.31Å; H211-A242 PolarHBondContact ND1-N 3.04Å; A242-I263 HydrophobicContact CB-CG2 3.65Å; A242-L267 HydrophobicContact CB-CD1 4.41Å
243	G	87.8	Confident	80.7	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.01	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-63.1	133	170.1	0	0	0	0	0	112.9	T93 S208 E245 L267	T93-G243 WeakPolarHBondContact OG1-CA 3.33Å; S208-G243 PolarHBondContact O-N 2.82Å; G243-E245 VanDerWaalsContact C-OE2 3.23Å; G243-E245 WeakPolarHBondContact CA-OE2 3.34Å; G243-L267 WeakPolarHBondContact O-CD1 3.47Å
244	S	86.3	Confident	80.1	Confident	17 Å²	17	40.9 Å²	40.9	12%	0.119	25%	0.246	C	C	.	.			trans	-90	2.4	177.9	69.6	0	0	0	0	114.8	G91 Q92	G91-S244 PolarHBondContact O-N 2.88Å; G91-S244 PolarHBondContact O-OG 3Å; Q92-S244 PolarHBondContact N-OG 2.83Å
245	E	78.4	Confident	78.7	Confident	31 Å²	31	47.4 Å²	47.4	15%	0.145	28%	0.275	C	S	.	.			trans	-74.4	160.3	-172.5	65.4	-80.2	-176.5	0	0	114.9	Q92 T93 G243 T250 N264 E321	Q92-E245 WeakPolarHBondContact CA-OE2 3.43Å; Q92-E245 HydrophobicContact CB-CB 4.28Å; T93-E245 WeakPolarHBondContact CB-OE1 3.49Å; T93-E245 PolarHBondContact N-OE2 3.48Å; T93-E245 VanDerWaalsContact OG1-CD 3.25Å; T93-E245 PolarHBondContact OG1-OE1 2.86Å; T93-E245 PolarHBondContact OG1-OE2 3.19Å; G243-E245 VanDerWaalsContact C-OE2 3.23Å; G243-E245 WeakPolarHBondContact CA-OE2 3.34Å; E245-T250 HydrophobicContact CG-CG2 4.31Å; E245-N264 PolarHBondContact O-ND2 3.13Å; E245-E321 HydrophobicContact CB-CG 4.3Å
246	R	66.9	Low	77.3	Confident	147 Å²	147	50 Å²	50	56%	0.555	28%	0.283	S	S	*	.			trans	-77.2	137.1	179.3	-60.9	178	-173.3	-165.2	1.7	111.5	S248 K249 E321	R246-S248 PolarHBondContact O-N 3.1Å; R246-K249 PolarHBondContact O-N 2.87Å; R246-E321 WeakPolarHBondContact CG-OE1 3.32Å; R246-E321 PolarHBondContact N-OE1 2.85Å
247	Q	61.7	Low	75.9	Confident	67 Å²	67	53.9 Å²	53.9	31%	0.313	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-52.7	-30.7	178.7	-60.4	-177.5	-10.2	0	0	113.9	K249 T250 A260 T261	Q247-K249 PolarHBondContact O-N 2.85Å; Q247-T250 PolarHBondContact O-N 3.26Å; Q247-T250 PolarHBondContact O-OG1 2.97Å; Q247-A260 HydrophobicContact CG-CB 4.18Å; Q247-A260 PolarHBondContact NE2-O 3.03Å; Q247-T261 VanDerWaalsContact NE2-N 3.18Å; Q247-T261 PolarHBondContact NE2-OG1 3.12Å
248	S	58.8	Low	74.6	Confident	106 Å²	106	60.4 Å²	60.4	74%	0.741	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-59.1	-25.8	176.9	51.3	0	0	0	0	113.6	R246	R246-S248 PolarHBondContact O-N 3.1Å
249	K	58.9	Low	73.2	Confident	99 Å²	99	61.2 Å²	61.2	43%	0.43	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-84.9	-12.1	175	-67.4	-168.1	177.9	-173.7	0	114	R246 Q247 N317 E321	R246-K249 PolarHBondContact O-N 2.87Å; Q247-K249 PolarHBondContact O-N 2.85Å; K249-N317 PolarHBondContact NZ-O 3Å; K249-E321 HydrophobicContact CD-CG 4.38Å
250	T	59.4	Low	71.8	Confident	65 Å²	65	61.9 Å²	61.9	40%	0.399	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-16.4	-173.4	72	0	0	0	0	114.4	E245 Q247 A252	E245-T250 HydrophobicContact CG-CG2 4.31Å; Q247-T250 PolarHBondContact O-N 3.26Å; Q247-T250 PolarHBondContact O-OG1 2.97Å; T250-A252 PolarHBondContact O-N 3.23Å
251	G	60.1	Low	70.7	Confident	66 Å²	66	64.8 Å²	64.8	68%	0.68	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	62	19.6	-179.1	0	0	0	0	0	114.3
252	A	61	Low	69.8	Low	19 Å²	19	68.3 Å²	68.3	16%	0.157	38%	0.375	C	S	.	.			trans	-71	128.7	-173.6	0	0	0	0	0	112.7	T250 R256	T250-A252 PolarHBondContact O-N 3.23Å; A252-R256 HydrophobicContact CB-CB 3.81Å
253	T	66.3	Low	68.9	Low	106 Å²	106	69 Å²	69	65%	0.65	38%	0.378	S	S	*	.			trans	-121.5	160.3	176.7	57.3	0	0	0	0	111.6	E255 R256	T253-E255 PolarHBondContact O-N 3.23Å; T253-R256 WeakPolarHBondContact O-CB 3.37Å; T253-R256 PolarHBondContact O-N 2.97Å
254	G	77.3	Confident	68.3	Low	58 Å²	58	70.7 Å²	70.7	60%	0.598	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.9	-130.8	176.7	0	0	0	0	0	113.1	R256 L257	G254-R256 VanDerWaalsContact C-N 3.29Å; G254-R256 PolarHBondContact O-N 3.36Å; G254-L257 WeakPolarHBondContact O-CB 3.45Å; G254-L257 PolarHBondContact O-N 2.96Å; G254-L257 VanDerWaalsContact O-N 3.13Å
255	E	65.9	Low	68.2	Low	138 Å²	138	74 Å²	74	65%	0.645	40%	0.403	S	S	*	.	H	α-helix	trans	-64.9	-32.2	-178	-57.2	-163.2	123.9	0	0	113	T253 L257 K258 E259	T253-E255 PolarHBondContact O-N 3.23Å; E255-L257 PolarHBondContact O-N 3.23Å; E255-L257 VanDerWaalsContact O-N 3.16Å; E255-K258 WeakPolarHBondContact O-CB 3.46Å; E255-K258 PolarHBondContact O-N 2.62Å; E255-E259 WeakPolarHBondContact O-CB 3.32Å; E255-E259 PolarHBondContact O-N 3.47Å
256	R	65	Low	68.7	Low	115 Å²	115	72.7 Å²	72.7	43%	0.434	40%	0.397	S	S	.	.	H	α-helix	trans	-58.4	-28.3	174.2	-65.1	176	167.8	154.5	-1.1	112.7	N204 A252 T253 G254 E259 A260	N204-R256 PolarHBondContact ND2-NE 3.03Å; N204-R256 VanDerWaalsContact ND2-NE 3.18Å; N204-R256 VanDerWaalsContact OD1-CZ 3.29Å; N204-R256 PolarHBondContact OD1-NE 3.04Å; N204-R256 PolarHBondContact OD1-NH2 2.73Å; A252-R256 HydrophobicContact CB-CB 3.81Å; T253-R256 WeakPolarHBondContact O-CB 3.37Å; T253-R256 PolarHBondContact O-N 2.97Å; G254-R256 VanDerWaalsContact C-N 3.29Å; G254-R256 PolarHBondContact O-N 3.36Å; R256-E259 WeakPolarHBondContact CA-OE2 3.27Å; R256-A260 VanDerWaalsContact O-CB 3.23Å; R256-A260 WeakPolarHBondContact O-CB 3.21Å; R256-A260 PolarHBondContact O-N 2.87Å
257	L	68.7	Low	69.7	Low	83 Å²	83	66.1 Å²	66.1	44%	0.435	37%	0.373	S	S	.	.	H	α-helix	trans	-76.3	-39.1	176.9	-173.1	153.1	0	0	0	111.2	G254 E255 T261	G254-L257 WeakPolarHBondContact O-CB 3.45Å; G254-L257 PolarHBondContact O-N 2.96Å; G254-L257 VanDerWaalsContact O-N 3.13Å; E255-L257 PolarHBondContact O-N 3.23Å; E255-L257 VanDerWaalsContact O-N 3.16Å; L257-T261 WeakPolarHBondContact O-CB 3.16Å; L257-T261 PolarHBondContact O-N 3.32Å; L257-T261 PolarHBondContact O-OG1 3.14Å
258	K	71.3	Confident	71.1	Confident	142 Å²	142	66 Å²	66	62%	0.617	38%	0.38	S	S	*	.	H	α-helix	trans	-63.3	-44.5	173.4	-60.5	178.5	-178.2	173.1	0	110.9	E255 T261 K262	E255-K258 WeakPolarHBondContact O-CB 3.46Å; E255-K258 PolarHBondContact O-N 2.62Å; K258-T261 WeakPolarHBondContact O-CB 3.39Å; K258-T261 PolarHBondContact O-N 2.99Å; K258-K262 PolarHBondContact O-N 3.06Å
259	E	68	Low	72.7	Confident	18 Å²	18	61 Å²	61	8%	0.084	35%	0.345	C	S	.	.	H	α-helix	trans	-57.2	-56.4	174.6	-175.8	-168.3	170.6	0	0	111.3	Y143 R209 E255 R256 T261 K262 I263	Y143-E259 HydrophobicContact CE2-CG 4.08Å; Y143-E259 PolarHBondContact OH-OE1 3.22Å; R209-E259 WeakPolarHBondContact CD-OE1 3.47Å; R209-E259 IonicContact CZ-OE1 3.41Å; R209-E259 IonicContact CZ-OE2 3.99Å; R209-E259 IonicContact NE-OE1 3.46Å; R209-E259 IonicContact NH1-OE1 2.77Å; R209-E259 PolarHBondContact NH1-OE1 3.17Å; R209-E259 IonicContact NH1-OE2 2.79Å; R209-E259 PolarHBondContact NH1-OE2 2.92Å; E255-E259 WeakPolarHBondContact O-CB 3.32Å; E255-E259 PolarHBondContact O-N 3.47Å; R256-E259 WeakPolarHBondContact CA-OE2 3.27Å; E259-T261 PolarHBondContact O-N 3.26Å; E259-T261 VanDerWaalsContact O-N 3.14Å; E259-K262 PolarHBondContact O-N 2.84Å; E259-I263 HydrophobicContact CG-CD1 4.07Å; E259-I263 WeakPolarHBondContact O-CG1 3.48Å; E259-I263 PolarHBondContact O-N 3.28Å
260	A	67.3	Low	74.4	Confident	15 Å²	15	56.3 Å²	56.3	12%	0.124	33%	0.325	C	S	.	.	H	α-helix	trans	-61.8	-20.9	177.1	0	0	0	0	0	113.9	Q247 R256 N264	Q247-A260 HydrophobicContact CG-CB 4.18Å; Q247-A260 PolarHBondContact NE2-O 3.03Å; R256-A260 VanDerWaalsContact O-CB 3.23Å; R256-A260 WeakPolarHBondContact O-CB 3.21Å; R256-A260 PolarHBondContact O-N 2.87Å; A260-N264 WeakPolarHBondContact O-CB 3.23Å; A260-N264 PolarHBondContact O-N 3.28Å
261	T	73.1	Confident	75.9	Confident	67 Å²	67	53.6 Å²	53.6	41%	0.411	31%	0.31	S	S	.	.	H	α-helix	trans	-76.3	-38.3	174.4	-58.7	0	0	0	0	111.7	Q247 L257 K258 E259 L265	Q247-T261 VanDerWaalsContact NE2-N 3.18Å; Q247-T261 PolarHBondContact NE2-OG1 3.12Å; L257-T261 WeakPolarHBondContact O-CB 3.16Å; L257-T261 PolarHBondContact O-N 3.32Å; L257-T261 PolarHBondContact O-OG1 3.14Å; K258-T261 WeakPolarHBondContact O-CB 3.39Å; K258-T261 PolarHBondContact O-N 2.99Å; E259-T261 PolarHBondContact O-N 3.26Å; E259-T261 VanDerWaalsContact O-N 3.14Å; T261-L265 WeakPolarHBondContact O-CB 3.49Å; T261-L265 PolarHBondContact O-N 3.01Å
262	K	73.9	Confident	77.5	Confident	74 Å²	74	54.6 Å²	54.6	32%	0.322	30%	0.299	S	S	.	.	H	α-helix	trans	-75.6	-34.8	175.4	-76.7	172.3	151	-156.1	0	113.2	N144 K258 E259 L265 S266	N144-K262 HydrophobicContact CB-CD 4.4Å; N144-K262 PolarHBondContact ND2-NZ 2.89Å; N144-K262 WeakPolarHBondContact O-CD 3.46Å; N144-K262 WeakPolarHBondContact O-CE 3.39Å; N144-K262 PolarHBondContact O-NZ 2.79Å; N144-K262 WeakPolarHBondContact OD1-CD 3.45Å; N144-K262 PolarHBondContact OD1-NZ 3.39Å; K258-K262 PolarHBondContact O-N 3.06Å; E259-K262 PolarHBondContact O-N 2.84Å; K262-L265 WeakPolarHBondContact O-CB 3.21Å; K262-L265 PolarHBondContact O-N 3.28Å; K262-S266 PolarHBondContact O-N 2.87Å
263	I	70.9	Confident	79.1	Confident	15 Å²	15	53.8 Å²	53.8	8%	0.077	29%	0.292	C	S	.	.	H	α-helix	trans	-57.7	-53.8	171.4	-66.4	161.4	0	0	0	109.3	R209 A242 E259 L265 S266 L267	R209-I263 HydrophobicContact CB-CD1 3.75Å; R209-I263 HydrophobicContact CG-CD1 4.07Å; R209-I263 WeakPolarHBondContact O-CD1 3.36Å; R209-I263 WeakPolarHBondContact O-CG1 3.36Å; A242-I263 HydrophobicContact CB-CG2 3.65Å; E259-I263 HydrophobicContact CG-CD1 4.07Å; E259-I263 WeakPolarHBondContact O-CG1 3.48Å; E259-I263 PolarHBondContact O-N 3.28Å; I263-L265 VanDerWaalsContact C-N 3.32Å; I263-L265 PolarHBondContact O-N 3.11Å; I263-S266 PolarHBondContact O-N 3.03Å; I263-S266 PolarHBondContact O-OG 3.11Å; I263-L267 PolarHBondContact O-N 2.85Å
264	N	75.5	Confident	80.4	Confident	36 Å²	36	48.7 Å²	48.7	19%	0.193	26%	0.261	C	S	.	.	H	α-helix	trans	-70.7	-25.3	-178.6	-71.4	20.7	0	0	0	113	E245 A260 S268	E245-N264 PolarHBondContact O-ND2 3.13Å; A260-N264 WeakPolarHBondContact O-CB 3.23Å; A260-N264 PolarHBondContact O-N 3.28Å; N264-S268 WeakPolarHBondContact O-CB 3.29Å; N264-S268 PolarHBondContact O-N 3.25Å; N264-S268 PolarHBondContact O-OG 3.34Å
265	L	84.4	Confident	81.1	Confident	88 Å²	88	47.2 Å²	47.2	46%	0.461	24%	0.241	S	C	.	.	H	α-helix	trans	-57.7	-52.2	170.2	176.3	66	0	0	0	111.1	E145 T261 K262 I263 L267 S268 A269	E145-L265 HydrophobicContact CG-CD2 4.45Å; T261-L265 WeakPolarHBondContact O-CB 3.49Å; T261-L265 PolarHBondContact O-N 3.01Å; K262-L265 WeakPolarHBondContact O-CB 3.21Å; K262-L265 PolarHBondContact O-N 3.28Å; I263-L265 VanDerWaalsContact C-N 3.32Å; I263-L265 PolarHBondContact O-N 3.11Å; L265-L267 PolarHBondContact O-N 3.39Å; L265-S268 PolarHBondContact O-N 2.96Å; L265-A269 WeakPolarHBondContact O-CB 3.48Å; L265-A269 PolarHBondContact O-N 3.25Å
266	S	87.9	Confident	82.4	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.014	22%	0.215	C	C	.	.	H	α-helix	trans	-62.4	-38.4	-177.6	65	0	0	0	0	113.5	E145 H211 K262 I263 L270	E145-S266 WeakPolarHBondContact OE1-CB 3.32Å; H211-S266 PolarHBondContact NE2-OG 2.75Å; K262-S266 PolarHBondContact O-N 2.87Å; I263-S266 PolarHBondContact O-N 3.03Å; I263-S266 PolarHBondContact O-OG 3.11Å; S266-L270 PolarHBondContact O-N 2.88Å; S266-L270 VanDerWaalsContact O-N 3.11Å
267	L	89.3	Confident	83.7	Confident	10 Å²	10	37.6 Å²	37.6	5%	0.052	20%	0.204	C	C	.	.	H	α-helix	trans	-76.7	-29.2	175.2	-68.2	-179.1	0	0	0	113.4	Y90 L241 A242 G243 I263 L265 L270 G271 L292	Y90-L267 HydrophobicContact CD2-CD2 4.41Å; Y90-L267 HydrophobicContact CE2-CD2 4.16Å; L241-L267 HydrophobicContact CD1-CD2 4.3Å; A242-L267 HydrophobicContact CB-CD1 4.41Å; G243-L267 WeakPolarHBondContact O-CD1 3.47Å; I263-L267 PolarHBondContact O-N 2.85Å; L265-L267 PolarHBondContact O-N 3.39Å; L267-L270 HydrophobicContact CD2-CD2 4.29Å; L267-L270 PolarHBondContact O-N 3.2Å; L267-G271 PolarHBondContact O-N 2.85Å; L267-L292 HydrophobicContact CD2-CD2 4.12Å
268	S	90	Very high	84.7	Confident	64 Å²	64	35.7 Å²	35.7	45%	0.448	20%	0.196	S	C	.	.	H	α-helix	trans	-69.2	-43	172.4	-59.3	0	0	0	0	110.9	N264 L265 L270 G271 N272	N264-S268 WeakPolarHBondContact O-CB 3.29Å; N264-S268 PolarHBondContact O-N 3.25Å; N264-S268 PolarHBondContact O-OG 3.34Å; L265-S268 PolarHBondContact O-N 2.96Å; S268-L270 VanDerWaalsContact C-N 3.32Å; S268-L270 PolarHBondContact O-N 3.38Å; S268-G271 CarbonylContact O-C 3.48Å; S268-G271 WeakPolarHBondContact O-CA 3.24Å; S268-G271 PolarHBondContact O-N 3.14Å; S268-G271 VanDerWaalsContact O-N 3.08Å; S268-N272 VanDerWaalsContact O-CG 3.26Å; S268-N272 PolarHBondContact O-N 2.93Å; S268-N272 PolarHBondContact O-OD1 3.06Å
269	A	93.1	Very high	85.4	Confident	2 Å²	2	33.6 Å²	33.6	2%	0.017	19%	0.191	C	C	.	.	H	α-helix	trans	-56.7	-45.3	171.4	0	0	0	0	0	111.3	L265 G271 N272 V273 D289 T293	L265-A269 WeakPolarHBondContact O-CB 3.48Å; L265-A269 PolarHBondContact O-N 3.25Å; A269-G271 VanDerWaalsContact C-N 3.31Å; A269-G271 PolarHBondContact O-N 2.87Å; A269-N272 WeakPolarHBondContact O-CB 3.44Å; A269-N272 PolarHBondContact O-N 3.02Å; A269-V273 WeakPolarHBondContact O-CG2 3.31Å; A269-V273 PolarHBondContact O-N 3.14Å; A269-D289 HydrophobicContact CB-CB 3.75Å; A269-T293 HydrophobicContact CB-CG2 3.99Å
270	L	93.8	Very high	85.7	Confident	0 Å²	0	36 Å²	36	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-59.4	-41.5	174.2	-162.5	72	0	0	0	111.6	L241 S266 L267 S268 V273 I274 L292 T293 L296 L300 Y328	L241-L270 HydrophobicContact CD1-CD2 4.06Å; S266-L270 PolarHBondContact O-N 2.88Å; S266-L270 VanDerWaalsContact O-N 3.11Å; L267-L270 HydrophobicContact CD2-CD2 4.29Å; L267-L270 PolarHBondContact O-N 3.2Å; S268-L270 VanDerWaalsContact C-N 3.32Å; S268-L270 PolarHBondContact O-N 3.38Å; L270-V273 PolarHBondContact O-N 2.83Å; L270-I274 WeakPolarHBondContact O-CG1 3.41Å; L270-I274 PolarHBondContact O-N 2.88Å; L270-L292 HydrophobicContact CD2-CD2 4.21Å; L270-T293 VanDerWaalsContact CA-CG2 3.48Å; L270-T293 HydrophobicContact CB-CG2 4.04Å; L270-T293 HydrophobicContact CD1-CG2 3.85Å; L270-L296 HydrophobicContact CD1-CD1 4.2Å; L270-L300 HydrophobicContact CD1-CD1 3.62Å; L270-Y328 VanDerWaalsContact CB-OH 3.32Å; L270-Y328 WeakPolarHBondContact CB-OH 3.45Å; L270-Y328 WeakPolarHBondContact CD2-OH 3.39Å; L270-Y328 WeakPolarHBondContact CG-OH 3.28Å; L270-Y328 PolarHBondContact O-OH 3.45Å
271	G	92.3	Very high	86.2	Confident	8 Å²	8	46 Å²	46	8%	0.082	26%	0.256	C	S	.	.	H	α-helix	trans	-65.2	-35.6	174.4	0	0	0	0	0	114.4	L267 S268 A269 S275 Y328	L267-G271 PolarHBondContact O-N 2.85Å; S268-G271 CarbonylContact O-C 3.48Å; S268-G271 WeakPolarHBondContact O-CA 3.24Å; S268-G271 PolarHBondContact O-N 3.14Å; S268-G271 VanDerWaalsContact O-N 3.08Å; A269-G271 VanDerWaalsContact C-N 3.31Å; A269-G271 PolarHBondContact O-N 2.87Å; G271-S275 WeakPolarHBondContact O-CB 3.44Å; G271-S275 PolarHBondContact O-N 2.88Å; G271-S275 PolarHBondContact O-OG 3.1Å; G271-Y328 VanDerWaalsContact CA-CE2 3.47Å; G271-Y328 PolarHBondContact N-OH 3.22Å; G271-Y328 VanDerWaalsContact N-OH 3.13Å
272	N	93.3	Very high	86.4	Confident	87 Å²	87	45.6 Å²	45.6	47%	0.465	26%	0.255	S	S	.	.	H	α-helix	trans	-68.2	-45	175	-66.8	-11.3	0	0	0	110.8	S268 A269 S275 A276 P286	S268-N272 VanDerWaalsContact O-CG 3.26Å; S268-N272 PolarHBondContact O-N 2.93Å; S268-N272 PolarHBondContact O-OD1 3.06Å; A269-N272 WeakPolarHBondContact O-CB 3.44Å; A269-N272 PolarHBondContact O-N 3.02Å; N272-S275 PolarHBondContact O-N 2.96Å; N272-A276 WeakPolarHBondContact O-CB 3.34Å; N272-A276 PolarHBondContact O-N 2.85Å; N272-P286 HydrophobicContact CB-CG 4.06Å
273	V	94.9	Very high	86.8	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.006	29%	0.285	C	S	.	.	H	α-helix	trans	-56.8	-50.2	173.7	164.5	0	0	0	0	111.1	A269 L270 S275 A276 L277 I285 P286 Y287 T293 L300	A269-V273 WeakPolarHBondContact O-CG2 3.31Å; A269-V273 PolarHBondContact O-N 3.14Å; L270-V273 PolarHBondContact O-N 2.83Å; V273-S275 VanDerWaalsContact C-N 3.34Å; V273-S275 PolarHBondContact O-N 2.78Å; V273-A276 PolarHBondContact O-N 2.95Å; V273-L277 HydrophobicContact CG1-CD1 3.76Å; V273-L277 WeakPolarHBondContact O-CB 3.44Å; V273-L277 VanDerWaalsContact O-CG 3.31Å; V273-L277 WeakPolarHBondContact O-CG 3.27Å; V273-L277 PolarHBondContact O-N 3.45Å; V273-I285 HydrophobicContact CB-CG2 4.27Å; V273-I285 HydrophobicContact CG1-CG2 3.88Å; V273-I285 HydrophobicContact CG2-CG2 4.17Å; V273-P286 HydrophobicContact CG2-CG 4.06Å; V273-Y287 HydrophobicContact CG1-CD1 3.81Å; V273-Y287 HydrophobicContact CG1-CE1 3.56Å; V273-Y287 HydrophobicContact CG2-CD1 4.05Å; V273-T293 HydrophobicContact CB-CG2 4.39Å; V273-T293 HydrophobicContact CG2-CG2 3.8Å; V273-L300 HydrophobicContact CG1-CD1 4.39Å
274	I	93.1	Very high	87.7	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-64.3	-36.7	179.4	-69.9	-169.9	0	0	0	112.2	L270 V278 L300 Y328 R331 A332 I335	L270-I274 WeakPolarHBondContact O-CG1 3.41Å; L270-I274 PolarHBondContact O-N 2.88Å; I274-V278 WeakPolarHBondContact O-CG2 3.44Å; I274-V278 PolarHBondContact O-N 3.27Å; I274-L300 HydrophobicContact CD1-CD1 4.44Å; I274-L300 HydrophobicContact CG1-CD1 4.27Å; I274-Y328 HydrophobicContact CD1-CD1 4.4Å; I274-Y328 HydrophobicContact CD1-CE1 3.58Å; I274-R331 HydrophobicContact CG2-CB 3.97Å; I274-A332 HydrophobicContact CD1-CB 4.14Å; I274-A332 HydrophobicContact CG2-CB 4.38Å; I274-I335 HydrophobicContact CB-CD1 4.23Å; I274-I335 HydrophobicContact CD1-CD1 4.04Å; I274-I335 HydrophobicContact CG1-CD1 3.7Å; I274-I335 HydrophobicContact CG2-CD1 4.05Å
275	S	91.9	Very high	88.6	Confident	26 Å²	26	58.2 Å²	58.2	18%	0.182	31%	0.31	C	S	.	.	H	α-helix	trans	-67.2	-50	176.2	-52.2	0	0	0	0	111	G271 N272 V273 L277 V278 D279 R331	G271-S275 WeakPolarHBondContact O-CB 3.44Å; G271-S275 PolarHBondContact O-N 2.88Å; G271-S275 PolarHBondContact O-OG 3.1Å; N272-S275 PolarHBondContact O-N 2.96Å; V273-S275 VanDerWaalsContact C-N 3.34Å; V273-S275 PolarHBondContact O-N 2.78Å; S275-L277 VanDerWaalsContact C-N 3.28Å; S275-L277 PolarHBondContact O-N 2.88Å; S275-V278 PolarHBondContact O-N 3.49Å; S275-D279 WeakPolarHBondContact O-CB 3.36Å; S275-D279 VanDerWaalsContact O-CG 3.3Å; S275-D279 PolarHBondContact O-N 2.95Å; S275-R331 PolarHBondContact OG-NH1 2.96Å
276	A	93.1	Very high	89.1	Confident	10 Å²	10	55 Å²	55	8%	0.083	30%	0.295	C	S	.	.	H	α-helix	trans	-59.7	-35.1	179.4	0	0	0	0	0	113.4	N272 V273 C282 I285	N272-A276 WeakPolarHBondContact O-CB 3.34Å; N272-A276 PolarHBondContact O-N 2.85Å; V273-A276 PolarHBondContact O-N 2.95Å; A276-C282 HydrophobicContact CB-CB 3.81Å; A276-I285 HydrophobicContact CB-CD1 3.68Å
277	L	91.6	Very high	89.4	Confident	41 Å²	41	56.6 Å²	56.6	22%	0.215	30%	0.301	C	S	.	.	H	α-helix	trans	-69.1	-29.5	175.5	-78.9	167.4	0	0	0	113.7	V273 S275 I285 L300 I335	V273-L277 HydrophobicContact CG1-CD1 3.76Å; V273-L277 WeakPolarHBondContact O-CB 3.44Å; V273-L277 VanDerWaalsContact O-CG 3.31Å; V273-L277 WeakPolarHBondContact O-CG 3.27Å; V273-L277 PolarHBondContact O-N 3.45Å; S275-L277 VanDerWaalsContact C-N 3.28Å; S275-L277 PolarHBondContact O-N 2.88Å; L277-I285 HydrophobicContact CD1-CG2 4.49Å; L277-I285 HydrophobicContact CD2-CD1 4.12Å; L277-I285 HydrophobicContact CD2-CG1 4.04Å; L277-I285 HydrophobicContact CD2-CG2 4.4Å; L277-I285 HydrophobicContact CG-CD1 4.2Å; L277-I285 HydrophobicContact CG-CG1 4.38Å; L277-I285 HydrophobicContact CG-CG2 4.04Å; L277-L300 HydrophobicContact CD1-CB 3.96Å; L277-L300 WeakPolarHBondContact CD1-O 3.34Å; L277-I335 HydrophobicContact CB-CG1 4.17Å; L277-I335 HydrophobicContact CB-CG2 4.49Å; L277-I335 HydrophobicContact CD1-CD1 4.34Å; L277-I335 HydrophobicContact CD1-CG1 4.42Å; L277-I335 HydrophobicContact CD1-CG2 4.04Å
278	V	90.3	Very high	89.6	Confident	44 Å²	44	64.1 Å²	64.1	27%	0.267	33%	0.329	S	S	.	.	H	α-helix	trans	-95.3	-34.1	-175.4	174.1	0	0	0	0	111.8	I274 S275 G280 R331 N334 I335	I274-V278 WeakPolarHBondContact O-CG2 3.44Å; I274-V278 PolarHBondContact O-N 3.27Å; S275-V278 PolarHBondContact O-N 3.49Å; V278-G280 PolarHBondContact O-N 2.92Å; V278-R331 VanDerWaalsContact CG2-O 3.32Å; V278-R331 WeakPolarHBondContact CG2-O 3.36Å; V278-N334 HydrophobicContact CG1-CB 3.91Å; V278-N334 HydrophobicContact CG2-CB 4.07Å; V278-I335 HydrophobicContact CG2-CG1 3.87Å
279	D	85.9	Confident	89.7	Confident	97 Å²	97	65.1 Å²	65.1	52%	0.519	33%	0.329	S	S	.	.	H	α-helix	trans	-68.1	-19.6	180	-71.5	-29.3	0	0	0	113.1	S275 R281	S275-D279 WeakPolarHBondContact O-CB 3.36Å; S275-D279 VanDerWaalsContact O-CG 3.3Å; S275-D279 PolarHBondContact O-N 2.95Å; D279-R281 WeakPolarHBondContact O-CG 3.45Å; D279-R281 PolarHBondContact O-N 2.93Å
280	G	74.4	Confident	89.8	Confident	69 Å²	69	65.1 Å²	65.1	71%	0.711	33%	0.329	S	S	*	.	S	Bend	trans	67.8	-16.2	173.8	0	0	0	0	0	116.3	V278	V278-G280 PolarHBondContact O-N 2.92Å
281	R	78.8	Confident	89.8	Confident	226 Å²	226	68.5 Å²	68.5	85%	0.853	34%	0.344	S	S	*	.			trans	-82.9	-17.9	-179.3	-61.2	171	-139.7	-164.1	4.1	113.1	D279 K283	D279-R281 WeakPolarHBondContact O-CG 3.45Å; D279-R281 PolarHBondContact O-N 2.93Å; R281-K283 PolarHBondContact O-N 3Å
282	C	77.3	Confident	89.9	Confident	58 Å²	58	68.1 Å²	68.1	39%	0.392	34%	0.34	S	S	.	.			trans	-79.2	104.4	-175.5	-66	0	0	0	0	111.4	A276 H284 I285	A276-C282 HydrophobicContact CB-CB 3.81Å; C282-H284 PolarHBondContact O-N 2.8Å; C282-I285 HydrophobicContact CB-CD1 4.22Å
283	K	81.9	Confident	90	Very high	220 Å²	220	64 Å²	64	96%	0.957	32%	0.318	S	S	*	.	S	Bend	trans	-63.4	-18.4	173.7	-67.7	-172.4	178.1	-176.6	0	114.3	R281	R281-K283 PolarHBondContact O-N 3Å
284	H	90.1	Very high	90	Very high	139 Å²	139	66 Å²	66	64%	0.644	33%	0.326	S	S	*	.	S	Bend	trans	-134.5	132.9	179.5	177	-88	0	0	0	109.2	C282	C282-H284 PolarHBondContact O-N 2.8Å
285	I	93.3	Very high	90.1	Very high	30 Å²	30	67.1 Å²	67.1	15%	0.154	33%	0.331	C	S	.	.			trans	-103.6	128.3	179	-52.2	-58.1	0	0	0	108.4	V273 A276 L277 C282 Y287	V273-I285 HydrophobicContact CB-CG2 4.27Å; V273-I285 HydrophobicContact CG1-CG2 3.88Å; V273-I285 HydrophobicContact CG2-CG2 4.17Å; A276-I285 HydrophobicContact CB-CD1 3.68Å; L277-I285 HydrophobicContact CD1-CG2 4.49Å; L277-I285 HydrophobicContact CD2-CD1 4.12Å; L277-I285 HydrophobicContact CD2-CG1 4.04Å; L277-I285 HydrophobicContact CD2-CG2 4.4Å; L277-I285 HydrophobicContact CG-CD1 4.2Å; L277-I285 HydrophobicContact CG-CG1 4.38Å; L277-I285 HydrophobicContact CG-CG2 4.04Å; C282-I285 HydrophobicContact CB-CD1 4.22Å; I285-Y287 HydrophobicContact CB-CD2 3.98Å; I285-Y287 HydrophobicContact CB-CE2 3.53Å; I285-Y287 HydrophobicContact CG1-CE2 4.29Å; I285-Y287 HydrophobicContact CG2-CD1 4.22Å; I285-Y287 HydrophobicContact CG2-CD2 4Å; I285-Y287 HydrophobicContact CG2-CE1 3.79Å; I285-Y287 HydrophobicContact CG2-CE2 3.59Å; I285-Y287 HydrophobicContact CG2-CG 4.3Å; I285-Y287 VanDerWaalsContact CG2-CZ 3.45Å; I285-Y287 PolarHBondContact O-N 3.4Å
286	P	94.4	Very high	90.2	Very high	22 Å²	22	66.1 Å²	66.1	14%	0.143	32%	0.324	C	S	.	.			trans	-79.6	51.3	-169.1	32.9	-37.3	0	0	0	114	N272 V273 R288 D289	N272-P286 HydrophobicContact CB-CG 4.06Å; V273-P286 HydrophobicContact CG2-CG 4.06Å; P286-R288 PolarHBondContact O-N 3.41Å; P286-R288 VanDerWaalsContact O-N 3.14Å; P286-D289 PolarHBondContact O-N 2.82Å
287	Y	94.8	Very high	90.2	Very high	34 Å²	34	68.2 Å²	68.2	13%	0.133	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-60.4	-26.2	179.8	-60.4	-71.4	0	0	0	113.3	V273 I285 D289 T293 R294 Q297 L300	V273-Y287 HydrophobicContact CG1-CD1 3.81Å; V273-Y287 HydrophobicContact CG1-CE1 3.56Å; V273-Y287 HydrophobicContact CG2-CD1 4.05Å; I285-Y287 HydrophobicContact CB-CD2 3.98Å; I285-Y287 HydrophobicContact CB-CE2 3.53Å; I285-Y287 HydrophobicContact CG1-CE2 4.29Å; I285-Y287 HydrophobicContact CG2-CD1 4.22Å; I285-Y287 HydrophobicContact CG2-CD2 4Å; I285-Y287 HydrophobicContact CG2-CE1 3.79Å; I285-Y287 HydrophobicContact CG2-CE2 3.59Å; I285-Y287 HydrophobicContact CG2-CG 4.3Å; I285-Y287 VanDerWaalsContact CG2-CZ 3.45Å; I285-Y287 PolarHBondContact O-N 3.4Å; Y287-D289 VanDerWaalsContact C-N 3.31Å; Y287-D289 PolarHBondContact O-N 2.95Å; Y287-T293 CarbonylContact O-C 3.6Å; Y287-T293 VanDerWaalsContact O-C 3.29Å; Y287-T293 VanDerWaalsContact O-CB 3.22Å; Y287-T293 WeakPolarHBondContact O-CB 3.26Å; Y287-T293 PolarHBondContact O-OG1 3.42Å; Y287-R294 WeakPolarHBondContact O-CG 3.39Å; Y287-R294 PolarHBondContact O-N 2.87Å; Y287-R294 VanDerWaalsContact O-N 3.12Å; Y287-Q297 HydrophobicContact CD1-CB 3.95Å; Y287-Q297 HydrophobicContact CD1-CG 3.83Å; Y287-Q297 HydrophobicContact CD2-CG 3.75Å; Y287-Q297 HydrophobicContact CE1-CB 4.37Å; Y287-Q297 HydrophobicContact CE1-CG 4.04Å; Y287-Q297 HydrophobicContact CE2-CG 3.93Å; Y287-Q297 HydrophobicContact CG-CB 4.12Å; Y287-Q297 HydrophobicContact CG-CG 3.69Å; Y287-L300 PolarHBondContact OH-O 3.42Å
288	R	93.9	Very high	90.2	Very high	168 Å²	168	68.8 Å²	68.8	63%	0.634	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-80	-6.6	-175.5	-72.2	-178.3	170.3	166.1	-1.9	114.8	E163 P286 S290 R294	E163-R288 IonicContact OE1-CZ 2.71Å; E163-R288 IonicContact OE1-NE 3.41Å; E163-R288 PolarHBondContact OE1-NE 2.84Å; E163-R288 IonicContact OE1-NH2 2.68Å; E163-R288 IonicContact OE2-CZ 3.81Å; E163-R288 IonicContact OE2-NE 2.75Å; E163-R288 IonicContact OE2-NH2 3.51Å; E163-R288 PolarHBondContact OE2-NH2 3.23Å; P286-R288 PolarHBondContact O-N 3.41Å; P286-R288 VanDerWaalsContact O-N 3.14Å; R288-S290 PolarHBondContact O-N 2.85Å; R288-R294 HydrophobicContact CG-CG 4.24Å
289	D	92.7	Very high	90.4	Very high	85 Å²	85	66.9 Å²	66.9	46%	0.455	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-68.2	-18.1	-178	-70.4	21.9	0	0	0	114	A269 P286 Y287	A269-D289 HydrophobicContact CB-CB 3.75Å; P286-D289 PolarHBondContact O-N 2.82Å; Y287-D289 VanDerWaalsContact C-N 3.31Å; Y287-D289 PolarHBondContact O-N 2.95Å
290	S	94.6	Very high	90.8	Very high	2 Å²	2	62.5 Å²	62.5	1%	0.014	30%	0.3	C	S	.	.	S	Bend	trans	-149.4	160.1	172.4	73.1	0	0	0	0	113.1	E145 R288 L292 T293 R294	E145-S290 WeakPolarHBondContact OE2-CA 3.45Å; R288-S290 PolarHBondContact O-N 2.85Å; S290-L292 PolarHBondContact O-N 3.47Å; S290-T293 PolarHBondContact N-OG1 3.49Å; S290-T293 PolarHBondContact O-N 3.32Å; S290-T293 PolarHBondContact O-OG1 2.96Å; S290-T293 VanDerWaalsContact O-OG1 3.07Å; S290-T293 PolarHBondContact OG-N 2.92Å; S290-T293 PolarHBondContact OG-OG1 3.46Å; S290-R294 WeakPolarHBondContact O-CG 3.4Å; S290-R294 PolarHBondContact O-N 3.46Å
291	K	94.1	Very high	91.5	Very high	71 Å²	71	60.6 Å²	60.6	31%	0.309	28%	0.281	S	S	.	.	H	α-helix	trans	-59.8	-38.9	171.4	-54.5	-53.1	179.5	177.1	0	111.3	I142 E145 V147 L161 R294 L295	I142-K291 HydrophobicContact CD1-CB 4.46Å; I142-K291 HydrophobicContact CG2-CB 3.97Å; E145-K291 WeakPolarHBondContact O-CE 3.45Å; E145-K291 VanDerWaalsContact O-CG 3.24Å; E145-K291 WeakPolarHBondContact O-CG 3.07Å; E145-K291 PolarHBondContact OE1-N 3.33Å; E145-K291 WeakPolarHBondContact OE2-CG 3.07Å; E145-K291 PolarHBondContact OE2-N 2.96Å; V147-K291 HydrophobicContact CG2-CB 4.11Å; V147-K291 HydrophobicContact CG2-CG 4.13Å; L161-K291 HydrophobicContact CD1-CB 4.01Å; L161-K291 HydrophobicContact CD1-CD 3.88Å; L161-K291 HydrophobicContact CD1-CG 4.48Å; L161-K291 HydrophobicContact CG-CD 4.34Å; K291-R294 PolarHBondContact O-N 2.96Å; K291-L295 PolarHBondContact O-N 3.46Å
292	L	94.6	Very high	92.1	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-60.6	-50.2	179.6	179.3	66.6	0	0	0	111.5	I142 H211 L241 L267 L270 S290 R294 L295 L296	I142-L292 HydrophobicContact CD1-CB 3.99Å; I142-L292 HydrophobicContact CD1-CD1 3.95Å; H211-L292 HydrophobicContact CB-CD1 4.22Å; L241-L292 HydrophobicContact CD2-CD1 3.76Å; L241-L292 HydrophobicContact CD2-CD2 4.04Å; L267-L292 HydrophobicContact CD2-CD2 4.12Å; L270-L292 HydrophobicContact CD2-CD2 4.21Å; S290-L292 PolarHBondContact O-N 3.47Å; L292-R294 VanDerWaalsContact C-N 3.32Å; L292-R294 PolarHBondContact O-N 3.22Å; L292-L295 PolarHBondContact O-N 2.9Å; L292-L296 HydrophobicContact CD1-CD1 3.7Å; L292-L296 HydrophobicContact CD1-CG 4.23Å; L292-L296 HydrophobicContact CG-CD1 4.13Å; L292-L296 WeakPolarHBondContact O-CB 3.47Å; L292-L296 WeakPolarHBondContact O-CG 3.18Å; L292-L296 PolarHBondContact O-N 3.34Å
293	T	95.1	Very high	92.8	Very high	2 Å²	2	49 Å²	49	1%	0.012	24%	0.236	C	C	.	.	H	α-helix	trans	-68.1	-28.5	179.9	46.1	0	0	0	0	113.4	A269 L270 V273 Y287 S290 Q297	A269-T293 HydrophobicContact CB-CG2 3.99Å; L270-T293 VanDerWaalsContact CA-CG2 3.48Å; L270-T293 HydrophobicContact CB-CG2 4.04Å; L270-T293 HydrophobicContact CD1-CG2 3.85Å; V273-T293 HydrophobicContact CB-CG2 4.39Å; V273-T293 HydrophobicContact CG2-CG2 3.8Å; Y287-T293 CarbonylContact O-C 3.6Å; Y287-T293 VanDerWaalsContact O-C 3.29Å; Y287-T293 VanDerWaalsContact O-CB 3.22Å; Y287-T293 WeakPolarHBondContact O-CB 3.26Å; Y287-T293 PolarHBondContact O-OG1 3.42Å; S290-T293 PolarHBondContact N-OG1 3.49Å; S290-T293 PolarHBondContact O-N 3.32Å; S290-T293 PolarHBondContact O-OG1 2.96Å; S290-T293 VanDerWaalsContact O-OG1 3.07Å; S290-T293 PolarHBondContact OG-N 2.92Å; S290-T293 PolarHBondContact OG-OG1 3.46Å; T293-Q297 PolarHBondContact O-N 2.77Å; T293-Q297 VanDerWaalsContact O-N 3.14Å
294	R	94.6	Very high	93.4	Very high	43 Å²	43	38.7 Å²	38.7	16%	0.162	19%	0.192	C	C	.	.	H	α-helix	trans	-69.7	-45.1	170.8	-68	-177.8	70.4	-156.6	-4.7	111.6	L161 E163 V169 Y287 R288 S290 K291 L292 L296 Q297	L161-R294 HydrophobicContact CD1-CB 3.84Å; E163-R294 IonicContact OE1-CZ 3.26Å; E163-R294 IonicContact OE1-NE 2.69Å; E163-R294 PolarHBondContact OE1-NE 2.84Å; E163-R294 IonicContact OE1-NH2 3.41Å; E163-R294 PolarHBondContact OE1-NH2 2.91Å; V169-R294 WeakPolarHBondContact CB-O 3.23Å; V169-R294 HydrophobicContact CG1-CB 4.16Å; V169-R294 VanDerWaalsContact CG2-O 3.31Å; V169-R294 WeakPolarHBondContact CG2-O 3.44Å; Y287-R294 WeakPolarHBondContact O-CG 3.39Å; Y287-R294 PolarHBondContact O-N 2.87Å; Y287-R294 VanDerWaalsContact O-N 3.12Å; R288-R294 HydrophobicContact CG-CG 4.24Å; S290-R294 WeakPolarHBondContact O-CG 3.4Å; S290-R294 PolarHBondContact O-N 3.46Å; K291-R294 PolarHBondContact O-N 2.96Å; L292-R294 VanDerWaalsContact C-N 3.32Å; L292-R294 PolarHBondContact O-N 3.22Å; R294-L296 VanDerWaalsContact C-N 3.33Å; R294-L296 PolarHBondContact O-N 3.3Å; R294-Q297 VanDerWaalsContact O-CB 3.27Å; R294-Q297 WeakPolarHBondContact O-CB 3.29Å; R294-Q297 PolarHBondContact O-N 3.28Å
295	L	94.5	Very high	93.7	Very high	23 Å²	23	33.6 Å²	33.6	12%	0.12	17%	0.167	C	C	.	.	H	α-helix	trans	-68.8	-29.5	179	-78.3	169	0	0	0	113.4	L140 I142 L161 V171 I213 K291 L292	L140-L295 HydrophobicContact CD1-CD1 4.47Å; L140-L295 HydrophobicContact CD2-CD1 4.36Å; I142-L295 HydrophobicContact CD1-CD1 3.74Å; I142-L295 HydrophobicContact CG1-CD1 4.31Å; L161-L295 HydrophobicContact CD1-CG 4.2Å; L161-L295 HydrophobicContact CD2-CD1 3.98Å; L161-L295 HydrophobicContact CD2-CD2 3.71Å; L161-L295 HydrophobicContact CD2-CG 3.79Å; V171-L295 HydrophobicContact CG2-CD2 3.87Å; I213-L295 HydrophobicContact CD1-CB 4.3Å; I213-L295 HydrophobicContact CD1-CD1 4.35Å; K291-L295 PolarHBondContact O-N 3.46Å; L292-L295 PolarHBondContact O-N 2.9Å
296	L	94.8	Very high	93.9	Very high	4 Å²	4	32.4 Å²	32.4	2%	0.021	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	8.7	176.4	-60.3	-178.3	0	0	0	113.8	T86 I213 V239 L270 L292 R294 D298 S299 L300	T86-L296 HydrophobicContact CG2-CD2 4.47Å; I213-L296 HydrophobicContact CD1-CD2 4.38Å; V239-L296 HydrophobicContact CG2-CD2 4.16Å; L270-L296 HydrophobicContact CD1-CD1 4.2Å; L292-L296 HydrophobicContact CD1-CD1 3.7Å; L292-L296 HydrophobicContact CD1-CG 4.23Å; L292-L296 HydrophobicContact CG-CD1 4.13Å; L292-L296 WeakPolarHBondContact O-CB 3.47Å; L292-L296 WeakPolarHBondContact O-CG 3.18Å; L292-L296 PolarHBondContact O-N 3.34Å; R294-L296 VanDerWaalsContact C-N 3.33Å; R294-L296 PolarHBondContact O-N 3.3Å; L296-D298 PolarHBondContact O-N 3.44Å; L296-S299 WeakPolarHBondContact O-CA 3.4Å; L296-S299 WeakPolarHBondContact O-CB 3.34Å; L296-S299 PolarHBondContact O-N 2.71Å; L296-L300 PolarHBondContact O-N 2.92Å
297	Q	93.7	Very high	94.1	Very high	54 Å²	54	31.5 Å²	31.5	25%	0.252	16%	0.155	S	C	.	.	G	3₁₀ helix	trans	-55.2	-48.6	-178.1	179	174.7	-58.1	0	0	112.1	Y287 T293 R294 S299 L300	Y287-Q297 HydrophobicContact CD1-CB 3.95Å; Y287-Q297 HydrophobicContact CD1-CG 3.83Å; Y287-Q297 HydrophobicContact CD2-CG 3.75Å; Y287-Q297 HydrophobicContact CE1-CB 4.37Å; Y287-Q297 HydrophobicContact CE1-CG 4.04Å; Y287-Q297 HydrophobicContact CE2-CG 3.93Å; Y287-Q297 HydrophobicContact CG-CB 4.12Å; Y287-Q297 HydrophobicContact CG-CG 3.69Å; T293-Q297 PolarHBondContact O-N 2.77Å; T293-Q297 VanDerWaalsContact O-N 3.14Å; R294-Q297 VanDerWaalsContact O-CB 3.27Å; R294-Q297 WeakPolarHBondContact O-CB 3.29Å; R294-Q297 PolarHBondContact O-N 3.28Å; Q297-S299 PolarHBondContact O-N 2.83Å; Q297-L300 PolarHBondContact O-N 3.15Å
298	D	91.4	Very high	94.3	Very high	54 Å²	54	29.9 Å²	29.9	29%	0.289	15%	0.149	S	C	.	.	G	3₁₀ helix	trans	-69.8	-17.5	178.6	-62.1	-49.1	0	0	0	113.1	L296 G302 N303 T304	L296-D298 PolarHBondContact O-N 3.44Å; D298-G302 CarbonylContact O-C 3.59Å; D298-G302 VanDerWaalsContact O-C 3.26Å; D298-G302 VanDerWaalsContact O-CA 3.28Å; D298-G302 WeakPolarHBondContact O-CA 3.49Å; D298-N303 PolarHBondContact O-N 2.97Å; D298-T304 VanDerWaalsContact C-OG1 3.28Å; D298-T304 VanDerWaalsContact O-CB 3.29Å; D298-T304 WeakPolarHBondContact O-CB 3.3Å; D298-T304 PolarHBondContact O-OG1 2.81Å
299	S	94.3	Very high	94.5	Very high	4 Å²	4	21.9 Å²	21.9	3%	0.028	12%	0.119	C	C	.	.	G	3₁₀ helix	trans	-85.5	-20.1	-179.8	-58.4	0	0	0	0	113.9	T86 L296 Q297 T306 N337	T86-S299 WeakPolarHBondContact CB-OG 3.42Å; T86-S299 PolarHBondContact OG1-OG 3.47Å; L296-S299 WeakPolarHBondContact O-CA 3.4Å; L296-S299 WeakPolarHBondContact O-CB 3.34Å; L296-S299 PolarHBondContact O-N 2.71Å; Q297-S299 PolarHBondContact O-N 2.83Å; S299-T306 WeakPolarHBondContact O-CB 3.32Å; S299-T306 WeakPolarHBondContact O-CG2 3.34Å; S299-T306 PolarHBondContact O-OG1 3.39Å; S299-N337 PolarHBondContact O-ND2 2.95Å
300	L	93.4	Very high	94.7	Very high	4 Å²	4	17.8 Å²	17.8	2%	0.021	10%	0.097	C	C	.	.	S	Bend	trans	-126.2	95.2	-176.6	-60.9	175	0	0	0	109	F88 L270 V273 I274 L277 Y287 L296 Q297 I335	F88-L300 HydrophobicContact CE1-CD2 4.21Å; F88-L300 HydrophobicContact CZ-CD2 4.37Å; L270-L300 HydrophobicContact CD1-CD1 3.62Å; V273-L300 HydrophobicContact CG1-CD1 4.39Å; I274-L300 HydrophobicContact CD1-CD1 4.44Å; I274-L300 HydrophobicContact CG1-CD1 4.27Å; L277-L300 HydrophobicContact CD1-CB 3.96Å; L277-L300 WeakPolarHBondContact CD1-O 3.34Å; Y287-L300 PolarHBondContact OH-O 3.42Å; L296-L300 PolarHBondContact O-N 2.92Å; Q297-L300 PolarHBondContact O-N 3.15Å; L300-I335 HydrophobicContact CD2-CD1 4.02Å
301	G	89.1	Confident	94.9	Very high	29 Å²	29	17.8 Å²	17.8	30%	0.299	10%	0.097	S	C	.	.	S	Bend	trans	90.4	-1.7	-175.3	0	0	0	0	0	115.2	N337	G301-N337 WeakPolarHBondContact CA-OD1 3.31Å; G301-N337 PolarHBondContact N-OD1 2.9Å
302	G	91.3	Very high	95	Very high	18 Å²	18	14.4 Å²	14.4	19%	0.186	8%	0.082	C	C	.	.	S	Bend	trans	-107.5	-156.7	-175.8	0	0	0	0	0	115.5	D298 T304 K338	D298-G302 CarbonylContact O-C 3.59Å; D298-G302 VanDerWaalsContact O-C 3.26Å; D298-G302 VanDerWaalsContact O-CA 3.28Å; D298-G302 WeakPolarHBondContact O-CA 3.49Å; G302-T304 PolarHBondContact O-N 3.47Å; G302-K338 PolarHBondContact O-N 3.4Å
303	N	92.5	Very high	95.1	Very high	24 Å²	24	14.4 Å²	14.4	13%	0.128	8%	0.082	C	C	.	.	S	Bend	trans	-86.6	75	178	173.4	27.9	0	0	0	111.2	N84 D298 P339 R340 N342	N84-N303 WeakPolarHBondContact CB-O 3.34Å; N84-N303 PolarHBondContact ND2-ND2 2.98Å; N84-N303 PolarHBondContact ND2-O 3.42Å; D298-N303 PolarHBondContact O-N 2.97Å; N303-P339 WeakPolarHBondContact OD1-CA 3.33Å; N303-R340 PolarHBondContact ND2-NE 2.72Å; N303-R340 VanDerWaalsContact OD1-CG 3.25Å; N303-R340 WeakPolarHBondContact OD1-CG 3.4Å; N303-R340 PolarHBondContact OD1-N 2.68Å; N303-R340 PolarHBondContact OD1-O 3.31Å; N303-N342 PolarHBondContact ND2-OD1 3.3Å
304	T	94.8	Very high	95.1	Very high	3 Å²	3	14.4 Å²	14.4	2%	0.018	8%	0.082	C	C	.	.	S	Bend	trans	-156	139.6	176.1	-55.7	0	0	0	0	111.5	N84 T86 D298 G302 T306 N337	N84-T304 HydrophobicContact CB-CG2 4.17Å; N84-T304 CarbonylContact O-C 3.48Å; N84-T304 WeakPolarHBondContact O-CA 3.44Å; T86-T304 WeakPolarHBondContact OG1-CG2 3.47Å; D298-T304 VanDerWaalsContact C-OG1 3.28Å; D298-T304 VanDerWaalsContact O-CB 3.29Å; D298-T304 WeakPolarHBondContact O-CB 3.3Å; D298-T304 PolarHBondContact O-OG1 2.81Å; G302-T304 PolarHBondContact O-N 3.47Å; T304-T306 WeakPolarHBondContact CG2-OG1 3.47Å; T304-N337 WeakPolarHBondContact O-CB 3.39Å; T304-N337 PolarHBondContact O-ND2 3.4Å
305	K	96.8	Very high	95.1	Very high	31 Å²	31	12.4 Å²	12.4	14%	0.135	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	112.6	162	-68.7	177.2	175	172.2	0	108	L75 E81 Y83 N84 G85 T86 P339	L75-K305 WeakPolarHBondContact CD1-O 3.36Å; L75-K305 HydrophobicContact CG-CB 4.23Å; E81-K305 IonicContact OE2-NZ 2.61Å; E81-K305 PolarHBondContact OE2-NZ 3.22Å; Y83-K305 HydrophobicContact CD1-CD 4.36Å; Y83-K305 HydrophobicContact CD1-CG 4.47Å; Y83-K305 HydrophobicContact CD2-CD 4.47Å; Y83-K305 VanDerWaalsContact CE2-NZ 3.33Å; Y83-K305 HydrophobicContact CG-CD 4.11Å; N84-K305 PolarHBondContact O-N 3.49Å; G85-K305 CarbonylContact C-O 3.55Å; G85-K305 VanDerWaalsContact CA-O 3.28Å; G85-K305 WeakPolarHBondContact CA-O 3.37Å; T86-K305 PolarHBondContact N-O 3.01Å; K305-P339 HydrophobicContact CG-CB 3.78Å; K305-P339 HydrophobicContact CG-CG 4.12Å
306	T	97.6	Very high	95.1	Very high	6 Å²	6	13.3 Å²	13.3	4%	0.037	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	134.7	-169.4	-57.4	0	0	0	0	113	V6 K7 T86 F88 S299 T304 N337	V6-T306 HydrophobicContact CG1-CG2 3.94Å; V6-T306 HydrophobicContact CG2-CG2 4.49Å; K7-T306 PolarHBondContact N-O 3.49Å; T86-T306 HydrophobicContact CG2-CG2 4.35Å; T86-T306 CarbonylContact O-C 3.59Å; T86-T306 WeakPolarHBondContact O-CA 3.34Å; F88-T306 HydrophobicContact CD1-CG2 4.05Å; F88-T306 HydrophobicContact CE1-CG2 3.78Å; S299-T306 WeakPolarHBondContact O-CB 3.32Å; S299-T306 WeakPolarHBondContact O-CG2 3.34Å; S299-T306 PolarHBondContact O-OG1 3.39Å; T304-T306 WeakPolarHBondContact CG2-OG1 3.47Å; T306-N337 PolarHBondContact OG1-ND2 2.89Å; T306-N337 VanDerWaalsContact OG1-ND2 3.14Å
307	L	98.2	Very high	95	Very high	2 Å²	2	16.2 Å²	16.2	1%	0.01	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	124.6	175.1	173	63.7	0	0	0	110.5	K7 V9 I71 A72 L75 T86 I87 F88 V309	K7-L307 HydrophobicContact CB-CD1 4.08Å; K7-L307 CarbonylContact O-C 3.59Å; K7-L307 WeakPolarHBondContact O-CA 3.18Å; V9-L307 HydrophobicContact CG1-CD1 4.28Å; V9-L307 HydrophobicContact CG2-CD1 4.25Å; I71-L307 HydrophobicContact CG1-CD1 3.88Å; I71-L307 HydrophobicContact CG2-CD1 4.08Å; I71-L307 HydrophobicContact CG2-CD2 3.87Å; A72-L307 HydrophobicContact CB-CD2 4.18Å; L75-L307 HydrophobicContact CD1-CB 3.54Å; T86-L307 PolarHBondContact O-N 2.91Å; I87-L307 WeakPolarHBondContact CA-O 3.38Å; I87-L307 HydrophobicContact CD1-CD2 4.39Å; I87-L307 HydrophobicContact CG1-CB 4.3Å; I87-L307 HydrophobicContact CG1-CD2 4.26Å; I87-L307 HydrophobicContact CG2-CB 4.4Å; I87-L307 HydrophobicContact CG2-CD2 3.94Å; I87-L307 HydrophobicContact CG2-CG 4.2Å; F88-L307 WeakPolarHBondContact CD1-O 3.45Å; F88-L307 PolarHBondContact N-O 3Å; L307-V309 HydrophobicContact CD2-CG2 4.43Å; L307-V309 HydrophobicContact CG-CG2 4.29Å
308	M	98	Very high	94.9	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	130.4	168.2	-179.6	-177.4	176.9	0	0	110.2	K7 V8 V9 F88 Y90 A310 Y328 A329 A332	K7-M308 PolarHBondContact O-N 3.36Å; V8-M308 WeakPolarHBondContact CA-O 3.43Å; V8-M308 HydrophobicContact CB-CB 4.45Å; V8-M308 HydrophobicContact CG1-CB 4.22Å; V8-M308 HydrophobicContact CG1-CG 4.33Å; V8-M308 HydrophobicContact CG1-SD 4.09Å; V8-M308 HydrophobicContact CG2-CB 4.07Å; V8-M308 HydrophobicContact CG2-SD 4.48Å; V9-M308 PolarHBondContact N-O 3.48Å; F88-M308 HydrophobicContact CD1-CB 4.42Å; F88-M308 HydrophobicContact CD2-CG 4.22Å; F88-M308 HydrophobicContact CE1-CB 3.78Å; F88-M308 HydrophobicContact CE1-CG 4.26Å; F88-M308 HydrophobicContact CE2-CB 4.01Å; F88-M308 HydrophobicContact CE2-CE 4.45Å; F88-M308 HydrophobicContact CE2-CG 3.55Å; F88-M308 HydrophobicContact CE2-SD 4.07Å; F88-M308 HydrophobicContact CZ-CB 3.55Å; F88-M308 HydrophobicContact CZ-CG 3.58Å; F88-M308 HydrophobicContact CZ-SD 4.02Å; Y90-M308 HydrophobicContact CD1-CE 3.39Å; Y90-M308 HydrophobicContact CE1-CE 4.29Å; Y90-M308 HydrophobicContact CG-CE 3.72Å; M308-A310 HydrophobicContact CE-CB 4.09Å; M308-Y328 HydrophobicContact CE-CD1 3.71Å; M308-Y328 HydrophobicContact CE-CE1 4.24Å; M308-Y328 HydrophobicContact SD-CD1 4.48Å; M308-A329 HydrophobicContact CE-CB 4.07Å; M308-A329 HydrophobicContact SD-CB 4.31Å; M308-A332 HydrophobicContact SD-CB 3.61Å
309	V	98.1	Very high	95.1	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	104.5	170.4	-174.1	0	0	0	0	109.1	V9 I87 F88 A89 Y90 T100 I113 L307 C311	V9-V309 HydrophobicContact CG2-CB 4.36Å; V9-V309 HydrophobicContact CG2-CG1 4.23Å; V9-V309 HydrophobicContact CG2-CG2 4Å; I87-V309 HydrophobicContact CG2-CG2 4.21Å; F88-V309 PolarHBondContact O-N 3.42Å; A89-V309 CarbonylContact C-O 3.26Å; A89-V309 WeakPolarHBondContact CA-O 3.45Å; Y90-V309 PolarHBondContact N-O 3.3Å; T100-V309 HydrophobicContact CG2-CG1 3.97Å; I113-V309 HydrophobicContact CD1-CG2 4.19Å; L307-V309 HydrophobicContact CD2-CG2 4.43Å; L307-V309 HydrophobicContact CG-CG2 4.29Å; V309-C311 PolarHBondContact O-N 3.48Å
310	A	98	Very high	95.1	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	102.3	-179.9	0	0	0	0	0	110.6	V9 V10 R11 M308 T325 A329	V9-A310 PolarHBondContact O-N 3.19Å; V10-A310 CarbonylContact C-O 3.56Å; V10-A310 WeakPolarHBondContact CA-O 3.35Å; V10-A310 HydrophobicContact CG1-CB 3.98Å; R11-A310 PolarHBondContact N-O 2.98Å; M308-A310 HydrophobicContact CE-CB 4.09Å; A310-T325 HydrophobicContact CB-CG2 4.09Å; A310-A329 HydrophobicContact CB-CB 3.85Å
311	C	97.4	Very high	95	Very high	1 Å²	1	16.6 Å²	16.6	1%	0.007	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	131.4	-178.8	-61.4	0	0	0	0	111.3	R11 Y90 S95 K97 V309	R11-C311 CarbonylContact O-C 3.55Å; R11-C311 WeakPolarHBondContact O-CA 3.27Å; Y90-C311 PolarHBondContact O-N 3.43Å; S95-C311 WeakPolarHBondContact CB-O 3.37Å; S95-C311 WeakPolarHBondContact OG-CB 3.37Å; K97-C311 HydrophobicContact CG-CB 4.09Å; V309-C311 PolarHBondContact O-N 3.48Å
312	L	97.4	Very high	95.4	Very high	1 Å²	1	15.2 Å²	15.2	1%	0.005	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	145.4	-170.7	-53.3	179	0	0	0	111.7	V10 R11 C12 R13 T322 T325 L326	V10-L312 HydrophobicContact CB-CD1 4.05Å; V10-L312 HydrophobicContact CG1-CD1 4.29Å; R11-L312 PolarHBondContact O-N 2.91Å; C12-L312 HydrophobicContact CB-CB 4.34Å; R13-L312 PolarHBondContact N-O 2.85Å; L312-T322 HydrophobicContact CB-CG2 4.11Å; L312-T322 HydrophobicContact CD1-CG2 4.46Å; L312-T322 HydrophobicContact CD2-CG2 4.01Å; L312-T322 HydrophobicContact CG-CG2 4.41Å; L312-T325 HydrophobicContact CD2-CG2 3.59Å; L312-L326 HydrophobicContact CD1-CD2 3.9Å; L312-L326 HydrophobicContact CD1-CG 4.29Å; L312-L326 HydrophobicContact CD2-CD2 4.47Å; L312-L326 HydrophobicContact CD2-CG 4.24Å
313	S	95.3	Very high	95.6	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.077	C	C	.	.			trans	-92	138.6	161.7	-178.9	0	0	0	0	109.8	R13 E19 A315 N318 T322	R13-S313 PolarHBondContact NH2-OG 3.23Å; E19-S313 PolarHBondContact OE1-OG 3.34Å; S313-A315 VanDerWaalsContact C-N 3.27Å; S313-A315 PolarHBondContact O-N 2.7Å; S313-A315 PolarHBondContact OG-N 2.88Å; S313-N318 PolarHBondContact OG-ND2 2.69Å; S313-N318 VanDerWaalsContact OG-ND2 3.16Å; S313-T322 PolarHBondContact O-OG1 2.85Å; S313-T322 VanDerWaalsContact O-OG1 3.1Å
314	P	95.9	Very high	95.7	Very high	2 Å²	2	15.4 Å²	15.4	1%	0.013	8%	0.083	C	C	.	.			trans	-72.5	-15.7	174.1	28.7	-34.4	0	0	0	113.7	R13 M15 S26 V27	R13-P314 VanDerWaalsContact O-CD 3.28Å; R13-P314 WeakPolarHBondContact O-CD 3.29Å; R13-P314 WeakPolarHBondContact O-CG 3.44Å; M15-P314 HydrophobicContact CE-CB 4.36Å; M15-P314 HydrophobicContact CE-CG 4.28Å; M15-P314 HydrophobicContact CG-CG 3.94Å; M15-P314 HydrophobicContact SD-CG 3.83Å; S26-P314 CarbonylContact C-O 3.19Å; S26-P314 WeakPolarHBondContact CA-O 3.49Å; V27-P314 WeakPolarHBondContact CG2-O 3.44Å; V27-P314 PolarHBondContact N-O 2.98Å
315	A	95.4	Very high	95.8	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.083	C	C	.	.	B	Isolated β-bridge	trans	-77.7	139.8	-166	0	0	0	0	0	115.3	M15 E19 C24 S313 N317 N318	M15-A315 HydrophobicContact CE-CB 4.05Å; M15-A315 HydrophobicContact SD-CB 3.91Å; E19-A315 HydrophobicContact CB-CB 4.29Å; E19-A315 HydrophobicContact CG-CB 3.78Å; C24-A315 HydrophobicContact CB-CB 3.94Å; S313-A315 VanDerWaalsContact C-N 3.27Å; S313-A315 PolarHBondContact O-N 2.7Å; S313-A315 PolarHBondContact OG-N 2.88Å; A315-N317 VanDerWaalsContact C-N 3.34Å; A315-N317 WeakPolarHBondContact CB-OD1 3.37Å; A315-N317 PolarHBondContact O-N 3.49Å; A315-N318 WeakPolarHBondContact O-CA 3.46Å; A315-N318 WeakPolarHBondContact O-CB 3.39Å; A315-N318 PolarHBondContact O-N 2.9Å
316	D	94.7	Very high	95.8	Very high	42 Å²	42	13.9 Å²	13.9	23%	0.225	8%	0.076	C	C	.	.	G	3₁₀ helix	trans	-45.8	-46.6	171.8	51.1	18.8	0	0	0	114.9	C24 Q25 V27 P42 N318 Y319	C24-D316 WeakPolarHBondContact CB-OD1 3.35Å; C24-D316 PolarHBondContact SG-OD1 3.2Å; Q25-D316 PolarHBondContact N-OD2 3.41Å; Q25-D316 PolarHBondContact O-N 3.03Å; V27-D316 HydrophobicContact CG1-CB 3.8Å; P42-D316 HydrophobicContact CB-CB 4.24Å; D316-N318 PolarHBondContact O-N 3.13Å; D316-Y319 VanDerWaalsContact O-CB 3.24Å; D316-Y319 WeakPolarHBondContact O-CB 3.35Å; D316-Y319 PolarHBondContact O-N 2.82Å
317	N	91.8	Very high	95.8	Very high	65 Å²	65	20.3 Å²	20.3	35%	0.348	10%	0.1	S	C	.	.	G	3₁₀ helix	trans	-63.6	-12.6	179.6	68.2	12.3	0	0	0	114	C24 K249 A315	C24-N317 PolarHBondContact SG-ND2 2.81Å; K249-N317 PolarHBondContact NZ-O 3Å; A315-N317 VanDerWaalsContact C-N 3.34Å; A315-N317 WeakPolarHBondContact CB-OD1 3.37Å; A315-N317 PolarHBondContact O-N 3.49Å
318	N	92.5	Very high	95.6	Very high	19 Å²	19	20.6 Å²	20.6	10%	0.102	10%	0.101	C	C	.	.	G	3₁₀ helix	trans	-106.8	1.8	177.4	-72	-48.5	0	0	0	113.1	E19 Q92 S313 A315 D316 D320 E321 T322	E19-N318 PolarHBondContact OE1-ND2 3.42Å; E19-N318 VanDerWaalsContact OE1-ND2 3.15Å; Q92-N318 PolarHBondContact NE2-OD1 3.26Å; Q92-N318 VanDerWaalsContact OE1-CB 3.28Å; Q92-N318 VanDerWaalsContact OE1-CG 3.31Å; Q92-N318 PolarHBondContact OE1-OD1 3.19Å; S313-N318 PolarHBondContact OG-ND2 2.69Å; S313-N318 VanDerWaalsContact OG-ND2 3.16Å; A315-N318 WeakPolarHBondContact O-CA 3.46Å; A315-N318 WeakPolarHBondContact O-CB 3.39Å; A315-N318 PolarHBondContact O-N 2.9Å; D316-N318 PolarHBondContact O-N 3.13Å; N318-D320 VanDerWaalsContact C-N 3.34Å; N318-D320 PolarHBondContact O-N 3.12Å; N318-D320 VanDerWaalsContact O-N 3.15Å; N318-E321 PolarHBondContact O-N 3.1Å; N318-T322 PolarHBondContact O-N 2.81Å; N318-T322 PolarHBondContact O-OG1 3.38Å
319	Y	94.9	Very high	95.5	Very high	18 Å²	18	20.6 Å²	20.6	7%	0.071	10%	0.101	C	C	.	.	H	α-helix	trans	-43.4	-52.2	-177.1	175.4	-103.4	0	0	0	113.9	V27 I39 Q40 N41 P42 K50 D316 E321 T322 L323	V27-Y319 HydrophobicContact CG2-CD2 4.37Å; I39-Y319 HydrophobicContact CD1-CD2 3.5Å; I39-Y319 VanDerWaalsContact CD1-CD2 3.5Å; I39-Y319 HydrophobicContact CD1-CE2 3.71Å; I39-Y319 HydrophobicContact CD1-CG 4.44Å; I39-Y319 HydrophobicContact CG1-CD2 3.76Å; I39-Y319 HydrophobicContact CG1-CE2 3.75Å; I39-Y319 HydrophobicContact CG2-CE2 4.4Å; Q40-Y319 WeakPolarHBondContact O-CD2 3.29Å; Q40-Y319 WeakPolarHBondContact O-CE2 3.38Å; N41-Y319 HydrophobicContact CB-CE2 4.43Å; P42-Y319 HydrophobicContact CG-CD2 4.49Å; P42-Y319 HydrophobicContact CG-CG 4.13Å; K50-Y319 PolarHBondContact NZ-OH 3.17Å; D316-Y319 VanDerWaalsContact O-CB 3.24Å; D316-Y319 WeakPolarHBondContact O-CB 3.35Å; D316-Y319 PolarHBondContact O-N 2.82Å; Y319-E321 VanDerWaalsContact C-N 3.34Å; Y319-E321 PolarHBondContact O-N 3.45Å; Y319-T322 PolarHBondContact O-N 3.47Å; Y319-L323 HydrophobicContact CE1-CD2 3.94Å; Y319-L323 WeakPolarHBondContact O-CB 3.35Å; Y319-L323 PolarHBondContact O-N 3Å
320	D	93.4	Very high	95.4	Very high	85 Å²	85	23.2 Å²	23.2	46%	0.455	12%	0.115	S	C	.	.	H	α-helix	trans	-61	-39.7	-178.5	-63.9	-58.5	0	0	0	113.7	N318 S324	N318-D320 VanDerWaalsContact C-N 3.34Å; N318-D320 PolarHBondContact O-N 3.12Å; N318-D320 VanDerWaalsContact O-N 3.15Å; D320-S324 WeakPolarHBondContact O-CB 3.19Å; D320-S324 PolarHBondContact O-N 3.45Å
321	E	92.8	Very high	95.3	Very high	2 Å²	2	27.3 Å²	27.3	1%	0.009	13%	0.13	C	C	.	.	H	α-helix	trans	-79.4	-36.9	-175.6	-53.3	-66.2	-170.3	0	0	110.1	Q92 E245 R246 K249 N318 Y319 S324 T325	Q92-E321 HydrophobicContact CB-CB 4.32Å; E245-E321 HydrophobicContact CB-CG 4.3Å; R246-E321 WeakPolarHBondContact CG-OE1 3.32Å; R246-E321 PolarHBondContact N-OE1 2.85Å; K249-E321 HydrophobicContact CD-CG 4.38Å; N318-E321 PolarHBondContact O-N 3.1Å; Y319-E321 VanDerWaalsContact C-N 3.34Å; Y319-E321 PolarHBondContact O-N 3.45Å; E321-S324 WeakPolarHBondContact O-CB 3.34Å; E321-S324 PolarHBondContact O-N 2.86Å; E321-T325 WeakPolarHBondContact O-CB 3.41Å; E321-T325 PolarHBondContact O-N 3.31Å; E321-T325 PolarHBondContact O-OG1 2.89Å
322	T	96	Very high	95.2	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-64.1	-45.8	170.3	-61.1	0	0	0	0	111.1	V28 I39 L312 S313 N318 Y319 T325 L326	V28-T322 HydrophobicContact CG2-CG2 3.74Å; I39-T322 HydrophobicContact CD1-CG2 3.66Å; L312-T322 HydrophobicContact CB-CG2 4.11Å; L312-T322 HydrophobicContact CD1-CG2 4.46Å; L312-T322 HydrophobicContact CD2-CG2 4.01Å; L312-T322 HydrophobicContact CG-CG2 4.41Å; S313-T322 PolarHBondContact O-OG1 2.85Å; S313-T322 VanDerWaalsContact O-OG1 3.1Å; N318-T322 PolarHBondContact O-N 2.81Å; N318-T322 PolarHBondContact O-OG1 3.38Å; Y319-T322 PolarHBondContact O-N 3.47Å; T322-T325 WeakPolarHBondContact O-CB 3.47Å; T322-T325 PolarHBondContact O-N 2.94Å; T322-L326 HydrophobicContact CG2-CD1 4.23Å; T322-L326 WeakPolarHBondContact O-CG 3.45Å; T322-L326 PolarHBondContact O-N 3.27Å
323	L	96.3	Very high	95.1	Very high	10 Å²	10	29.7 Å²	29.7	5%	0.052	14%	0.14	C	C	.	.	H	α-helix	trans	-65.3	-38.2	175.2	180	61	0	0	0	112.1	I39 F52 Y319 T325 L326 R327	I39-L323 HydrophobicContact CD1-CB 4.2Å; I39-L323 HydrophobicContact CG2-CD1 4.07Å; F52-L323 HydrophobicContact CE2-CD1 4.1Å; F52-L323 HydrophobicContact CZ-CD1 3.91Å; Y319-L323 HydrophobicContact CE1-CD2 3.94Å; Y319-L323 WeakPolarHBondContact O-CB 3.35Å; Y319-L323 PolarHBondContact O-N 3Å; L323-T325 VanDerWaalsContact C-N 3.35Å; L323-L326 PolarHBondContact O-N 2.89Å; L323-R327 HydrophobicContact CD1-CG 4.36Å; L323-R327 WeakPolarHBondContact O-CB 3.47Å; L323-R327 VanDerWaalsContact O-CG 3.27Å; L323-R327 WeakPolarHBondContact O-CG 3.31Å; L323-R327 PolarHBondContact O-N 3.24Å
324	S	94.8	Very high	95	Very high	37 Å²	37	33.3 Å²	33.3	26%	0.259	16%	0.16	S	C	.	.	H	α-helix	trans	-59.5	-47.5	171.5	-171.2	0	0	0	0	110.5	D320 E321 L326 R327 Y328	D320-S324 WeakPolarHBondContact O-CB 3.19Å; D320-S324 PolarHBondContact O-N 3.45Å; E321-S324 WeakPolarHBondContact O-CB 3.34Å; E321-S324 PolarHBondContact O-N 2.86Å; S324-L326 PolarHBondContact O-N 2.99Å; S324-R327 PolarHBondContact O-N 3.23Å; S324-Y328 WeakPolarHBondContact O-CB 3.42Å; S324-Y328 PolarHBondContact O-N 3.08Å
325	T	96.4	Very high	95	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.006	16%	0.159	C	C	.	.	H	α-helix	trans	-61.5	-44.6	178.4	-56.8	0	0	0	0	111.9	Y90 A310 L312 E321 T322 L323 Y328 A329	Y90-T325 HydrophobicContact CD1-CG2 3.99Å; Y90-T325 HydrophobicContact CE1-CG2 4.12Å; A310-T325 HydrophobicContact CB-CG2 4.09Å; L312-T325 HydrophobicContact CD2-CG2 3.59Å; E321-T325 WeakPolarHBondContact O-CB 3.41Å; E321-T325 PolarHBondContact O-N 3.31Å; E321-T325 PolarHBondContact O-OG1 2.89Å; T322-T325 WeakPolarHBondContact O-CB 3.47Å; T322-T325 PolarHBondContact O-N 2.94Å; L323-T325 VanDerWaalsContact C-N 3.35Å; T325-Y328 WeakPolarHBondContact O-CB 3.33Å; T325-Y328 PolarHBondContact O-N 2.66Å; T325-A329 WeakPolarHBondContact O-CB 3.47Å; T325-A329 PolarHBondContact O-N 3.47Å
326	L	97.5	Very high	94.9	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-62.8	-44	175.5	-73.7	165.3	0	0	0	112.6	V10 C37 I39 F52 F54 L312 T322 L323 S324 Y328 A329 N330	V10-L326 HydrophobicContact CG1-CD2 3.96Å; C37-L326 HydrophobicContact CB-CD2 4.39Å; I39-L326 HydrophobicContact CB-CD1 4.04Å; I39-L326 HydrophobicContact CD1-CD1 4.24Å; I39-L326 HydrophobicContact CG2-CD1 3.87Å; F52-L326 HydrophobicContact CB-CD2 4.5Å; F52-L326 HydrophobicContact CD1-CB 4.36Å; F52-L326 HydrophobicContact CD2-CB 3.96Å; F52-L326 HydrophobicContact CD2-CD1 3.97Å; F52-L326 HydrophobicContact CD2-CD2 4.21Å; F52-L326 HydrophobicContact CD2-CG 4.28Å; F52-L326 HydrophobicContact CE1-CB 4.21Å; F52-L326 HydrophobicContact CE2-CB 3.81Å; F52-L326 HydrophobicContact CE2-CD1 3.95Å; F52-L326 HydrophobicContact CE2-CG 4.4Å; F52-L326 HydrophobicContact CG-CB 4.24Å; F52-L326 HydrophobicContact CG-CD2 4.38Å; F52-L326 HydrophobicContact CZ-CB 3.93Å; F54-L326 HydrophobicContact CE2-CD2 3.72Å; F54-L326 HydrophobicContact CZ-CD2 3.86Å; L312-L326 HydrophobicContact CD1-CD2 3.9Å; L312-L326 HydrophobicContact CD1-CG 4.29Å; L312-L326 HydrophobicContact CD2-CD2 4.47Å; L312-L326 HydrophobicContact CD2-CG 4.24Å; T322-L326 HydrophobicContact CG2-CD1 4.23Å; T322-L326 WeakPolarHBondContact O-CG 3.45Å; T322-L326 PolarHBondContact O-N 3.27Å; L323-L326 PolarHBondContact O-N 2.89Å; S324-L326 PolarHBondContact O-N 2.99Å; L326-Y328 VanDerWaalsContact C-N 3.27Å; L326-Y328 PolarHBondContact O-N 2.86Å; L326-A329 PolarHBondContact O-N 3.44Å; L326-N330 VanDerWaalsContact O-CB 3.29Å; L326-N330 WeakPolarHBondContact O-CB 3.38Å; L326-N330 PolarHBondContact O-N 2.81Å
327	R	96	Very high	94.9	Very high	141 Å²	141	36.7 Å²	36.7	53%	0.532	17%	0.172	S	C	.	.	H	α-helix	trans	-66.6	-25.9	174.7	-74.4	169.3	166.4	166.4	-6.4	113.4	F52 L323 S324 R331	F52-R327 HydrophobicContact CE1-CG 4.31Å; F52-R327 HydrophobicContact CZ-CG 4.22Å; L323-R327 HydrophobicContact CD1-CG 4.36Å; L323-R327 WeakPolarHBondContact O-CB 3.47Å; L323-R327 VanDerWaalsContact O-CG 3.27Å; L323-R327 WeakPolarHBondContact O-CG 3.31Å; L323-R327 PolarHBondContact O-N 3.24Å; S324-R327 PolarHBondContact O-N 3.23Å; R327-R331 PolarHBondContact O-NE 3.08Å
328	Y	94.3	Very high	95	Very high	9 Å²	9	40.8 Å²	40.8	4%	0.035	19%	0.187	C	C	.	.	H	α-helix	trans	-75.8	-52.5	174.6	-163	-79.5	0	0	0	110.4	Y90 L270 G271 I274 M308 S324 T325 L326 N330 R331 A332	Y90-Y328 AromaticContact CD1-CD1 4Å; Y90-Y328 HydrophobicContact CD1-CD1 4Å; Y90-Y328 HydrophobicContact CD1-CE1 4.35Å; Y90-Y328 HydrophobicContact CD1-CG 4.42Å; Y90-Y328 HydrophobicContact CD2-CE1 4.25Å; Y90-Y328 AromaticContact CE1-CD1 3.65Å; Y90-Y328 HydrophobicContact CE1-CD1 3.65Å; Y90-Y328 HydrophobicContact CE1-CD2 4.13Å; Y90-Y328 HydrophobicContact CE1-CE1 4.1Å; Y90-Y328 AromaticContact CE1-CG 3.64Å; Y90-Y328 HydrophobicContact CE1-CG 3.64Å; Y90-Y328 HydrophobicContact CE2-CD1 4.35Å; Y90-Y328 AromaticContact CE2-CE1 3.97Å; Y90-Y328 HydrophobicContact CE2-CE1 3.97Å; Y90-Y328 HydrophobicContact CE2-CE2 4.2Å; Y90-Y328 AromaticContact CE2-CZ 3.9Å; Y90-Y328 HydrophobicContact CG-CE1 4.43Å; Y90-Y328 AromaticContact CZ-CD1 3.84Å; Y90-Y328 AromaticContact CZ-CD2 3.76Å; Y90-Y328 AromaticContact CZ-CE1 3.9Å; Y90-Y328 AromaticContact CZ-CE2 3.84Å; Y90-Y328 AromaticContact CZ-CG 3.75Å; Y90-Y328 AromaticContact CZ-CZ 3.91Å; Y90-Y328 VanDerWaalsContact OH-CD2 3.29Å; Y90-Y328 WeakPolarHBondContact OH-CD2 3.43Å; Y90-Y328 WeakPolarHBondContact OH-CE2 3.49Å; L270-Y328 VanDerWaalsContact CB-OH 3.32Å; L270-Y328 WeakPolarHBondContact CB-OH 3.45Å; L270-Y328 WeakPolarHBondContact CD2-OH 3.39Å; L270-Y328 WeakPolarHBondContact CG-OH 3.28Å; L270-Y328 PolarHBondContact O-OH 3.45Å; G271-Y328 VanDerWaalsContact CA-CE2 3.47Å; G271-Y328 PolarHBondContact N-OH 3.22Å; G271-Y328 VanDerWaalsContact N-OH 3.13Å; I274-Y328 HydrophobicContact CD1-CD1 4.4Å; I274-Y328 HydrophobicContact CD1-CE1 3.58Å; M308-Y328 HydrophobicContact CE-CD1 3.71Å; M308-Y328 HydrophobicContact CE-CE1 4.24Å; M308-Y328 HydrophobicContact SD-CD1 4.48Å; S324-Y328 WeakPolarHBondContact O-CB 3.42Å; S324-Y328 PolarHBondContact O-N 3.08Å; T325-Y328 WeakPolarHBondContact O-CB 3.33Å; T325-Y328 PolarHBondContact O-N 2.66Å; L326-Y328 VanDerWaalsContact C-N 3.27Å; L326-Y328 PolarHBondContact O-N 2.86Å; Y328-N330 PolarHBondContact O-N 3.4Å; Y328-R331 PolarHBondContact O-N 3.03Å; Y328-R331 VanDerWaalsContact O-N 3.11Å; Y328-A332 PolarHBondContact O-N 3.37Å
329	A	96.6	Very high	95	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-55.2	-45.6	175.3	0	0	0	0	0	112.6	V8 F54 M308 A310 T325 L326 R331 A332 K333	V8-A329 HydrophobicContact CG1-CB 3.71Å; F54-A329 HydrophobicContact CD1-CB 4.48Å; F54-A329 HydrophobicContact CE1-CB 3.58Å; F54-A329 HydrophobicContact CZ-CB 4.04Å; M308-A329 HydrophobicContact CE-CB 4.07Å; M308-A329 HydrophobicContact SD-CB 4.31Å; A310-A329 HydrophobicContact CB-CB 3.85Å; T325-A329 WeakPolarHBondContact O-CB 3.47Å; T325-A329 PolarHBondContact O-N 3.47Å; L326-A329 PolarHBondContact O-N 3.44Å; A329-R331 PolarHBondContact O-N 2.96Å; A329-A332 PolarHBondContact O-N 2.8Å; A329-A332 VanDerWaalsContact O-N 3.13Å; A329-K333 PolarHBondContact O-N 2.92Å
330	N	96.3	Very high	94.8	Very high	54 Å²	54	47.6 Å²	47.6	29%	0.289	22%	0.215	S	C	.	.	H	α-helix	trans	-70.5	-17.2	-179.4	-173.4	68.2	0	0	0	113.7	F52 F54 L326 Y328 K333 N334	F52-N330 HydrophobicContact CD1-CB 3.89Å; F52-N330 HydrophobicContact CE1-CB 4.36Å; F54-N330 HydrophobicContact CE1-CB 4.18Å; F54-N330 HydrophobicContact CZ-CB 4.38Å; L326-N330 VanDerWaalsContact O-CB 3.29Å; L326-N330 WeakPolarHBondContact O-CB 3.38Å; L326-N330 PolarHBondContact O-N 2.81Å; Y328-N330 PolarHBondContact O-N 3.4Å; N330-K333 WeakPolarHBondContact OD1-CE 3.32Å; N330-K333 PolarHBondContact OD1-NZ 2.91Å; N330-N334 PolarHBondContact O-ND2 2.86Å
331	R	95.1	Very high	94.7	Very high	87 Å²	87	45.2 Å²	45.2	33%	0.328	20%	0.201	S	C	.	.	H	α-helix	trans	-79.4	-50	164.8	-78.3	176.9	-72.5	168.9	-1.7	110.4	I274 S275 V278 R327 Y328 A329 K333 N334	I274-R331 HydrophobicContact CG2-CB 3.97Å; S275-R331 PolarHBondContact OG-NH1 2.96Å; V278-R331 VanDerWaalsContact CG2-O 3.32Å; V278-R331 WeakPolarHBondContact CG2-O 3.36Å; R327-R331 PolarHBondContact O-NE 3.08Å; Y328-R331 PolarHBondContact O-N 3.03Å; Y328-R331 VanDerWaalsContact O-N 3.11Å; A329-R331 PolarHBondContact O-N 2.96Å; R331-K333 VanDerWaalsContact C-N 3.25Å; R331-K333 PolarHBondContact O-N 2.64Å; R331-K333 VanDerWaalsContact O-N 3.11Å; R331-N334 PolarHBondContact O-N 2.78Å; R331-N334 PolarHBondContact O-ND2 3.4Å; R331-N334 VanDerWaalsContact O-ND2 3.17Å
332	A	95.4	Very high	94.5	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-50.9	-39.1	-174.4	0	0	0	0	0	114	V8 I274 M308 Y328 A329 N334 I335	V8-A332 HydrophobicContact CG2-CB 4Å; I274-A332 HydrophobicContact CD1-CB 4.14Å; I274-A332 HydrophobicContact CG2-CB 4.38Å; M308-A332 HydrophobicContact SD-CB 3.61Å; Y328-A332 PolarHBondContact O-N 3.37Å; A329-A332 PolarHBondContact O-N 2.8Å; A329-A332 VanDerWaalsContact O-N 3.13Å; A332-N334 PolarHBondContact O-N 3.06Å; A332-I335 HydrophobicContact CB-CD1 4.39Å; A332-I335 WeakPolarHBondContact O-CB 3.48Å; A332-I335 WeakPolarHBondContact O-CD1 3.44Å; A332-I335 VanDerWaalsContact O-CG1 3.24Å; A332-I335 WeakPolarHBondContact O-CG1 3.45Å; A332-I335 PolarHBondContact O-N 3.43Å
333	K	95.2	Very high	94	Very high	51 Å²	51	48.4 Å²	48.4	22%	0.222	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-18.5	179.8	71.4	176.2	-175.3	179.3	0	115.4	S5 V6 V8 T53 A329 N330 R331	S5-K333 VanDerWaalsContact CB-O 3.32Å; S5-K333 WeakPolarHBondContact CB-O 3.22Å; S5-K333 PolarHBondContact OG-O 2.96Å; V6-K333 WeakPolarHBondContact O-CA 3.28Å; V8-K333 HydrophobicContact CB-CB 4.11Å; V8-K333 HydrophobicContact CG2-CB 3.61Å; T53-K333 PolarHBondContact O-NZ 3.28Å; A329-K333 PolarHBondContact O-N 2.92Å; N330-K333 WeakPolarHBondContact OD1-CE 3.32Å; N330-K333 PolarHBondContact OD1-NZ 2.91Å; R331-K333 VanDerWaalsContact C-N 3.25Å; R331-K333 PolarHBondContact O-N 2.64Å; R331-K333 VanDerWaalsContact O-N 3.11Å
334	N	94.7	Very high	93.1	Very high	77 Å²	77	51 Å²	51	41%	0.412	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-9.9	179.9	-50.8	-62.2	0	0	0	112.6	V278 N330 R331 A332 K336	V278-N334 HydrophobicContact CG1-CB 3.91Å; V278-N334 HydrophobicContact CG2-CB 4.07Å; N330-N334 PolarHBondContact O-ND2 2.86Å; R331-N334 PolarHBondContact O-N 2.78Å; R331-N334 PolarHBondContact O-ND2 3.4Å; R331-N334 VanDerWaalsContact O-ND2 3.17Å; A332-N334 PolarHBondContact O-N 3.06Å; N334-K336 PolarHBondContact O-N 3.39Å
335	I	94.6	Very high	91.8	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	25%	0.251	C	S	.	.			trans	-61.9	132.3	173.1	-59.2	167.7	0	0	0	108.7	S5 V6 I274 L277 V278 L300 A332	S5-I335 WeakPolarHBondContact CA-O 3.36Å; V6-I335 HydrophobicContact CB-CB 4.3Å; V6-I335 HydrophobicContact CG2-CB 3.71Å; V6-I335 HydrophobicContact CG2-CD1 4.47Å; V6-I335 HydrophobicContact CG2-CG2 3.75Å; V6-I335 PolarHBondContact N-O 3.04Å; I274-I335 HydrophobicContact CB-CD1 4.23Å; I274-I335 HydrophobicContact CD1-CD1 4.04Å; I274-I335 HydrophobicContact CG1-CD1 3.7Å; I274-I335 HydrophobicContact CG2-CD1 4.05Å; L277-I335 HydrophobicContact CB-CG1 4.17Å; L277-I335 HydrophobicContact CB-CG2 4.49Å; L277-I335 HydrophobicContact CD1-CD1 4.34Å; L277-I335 HydrophobicContact CD1-CG1 4.42Å; L277-I335 HydrophobicContact CD1-CG2 4.04Å; V278-I335 HydrophobicContact CG2-CG1 3.87Å; L300-I335 HydrophobicContact CD2-CD1 4.02Å; A332-I335 HydrophobicContact CB-CD1 4.39Å; A332-I335 WeakPolarHBondContact O-CB 3.48Å; A332-I335 WeakPolarHBondContact O-CD1 3.44Å; A332-I335 VanDerWaalsContact O-CG1 3.24Å; A332-I335 WeakPolarHBondContact O-CG1 3.45Å; A332-I335 PolarHBondContact O-N 3.43Å
336	K	93.8	Very high	90.2	Very high	113 Å²	113	59.6 Å²	59.6	49%	0.491	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	113.9	178.8	-62.7	-55.7	-175.4	-178.5	0	111.2	E4 S5 N334	E4-K336 CarbonylContact O-C 3.58Å; E4-K336 WeakPolarHBondContact O-CA 3.29Å; S5-K336 PolarHBondContact OG-NZ 3.49Å; N334-K336 PolarHBondContact O-N 3.39Å
337	N	94.4	Very high	88.7	Confident	2 Å²	2	60.1 Å²	60.1	1%	0.011	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	163.8	173	-71.5	13.8	0	0	0	110.3	S3 E4 S299 G301 T304 T306 P339	S3-N337 CarbonylContact C-O 3.58Å; S3-N337 WeakPolarHBondContact CA-O 3.49Å; S3-N337 WeakPolarHBondContact CB-O 3.35Å; E4-N337 PolarHBondContact N-O 3.38Å; E4-N337 PolarHBondContact O-N 2.81Å; S299-N337 PolarHBondContact O-ND2 2.95Å; G301-N337 WeakPolarHBondContact CA-OD1 3.31Å; G301-N337 PolarHBondContact N-OD1 2.9Å; T304-N337 WeakPolarHBondContact O-CB 3.39Å; T304-N337 PolarHBondContact O-ND2 3.4Å; T306-N337 PolarHBondContact OG1-ND2 2.89Å; T306-N337 VanDerWaalsContact OG1-ND2 3.14Å; N337-P339 VanDerWaalsContact C-CD 3.46Å
338	K	93.4	Very high	87.4	Confident	150 Å²	150	55.1 Å²	55.1	65%	0.652	27%	0.266	S	S	*	.			trans	-128	67.4	175.2	-65.6	178.8	-177.2	175.3	0	109.7	G302 R340	G302-K338 PolarHBondContact O-N 3.4Å; K338-R340 PolarHBondContact O-N 2.71Å
339	P	92.6	Very high	86.2	Confident	27 Å²	27	58.5 Å²	58.5	18%	0.175	28%	0.284	C	S	.	.			trans	-63.8	134.2	178.4	27.3	-33.6	0	0	0	111	E4 Y83 N303 K305 N337	E4-P339 HydrophobicContact CB-CG 4.17Å; Y83-P339 HydrophobicContact CD1-CB 3.89Å; Y83-P339 HydrophobicContact CE1-CB 4.19Å; N303-P339 WeakPolarHBondContact OD1-CA 3.33Å; K305-P339 HydrophobicContact CG-CB 3.78Å; K305-P339 HydrophobicContact CG-CG 4.12Å; N337-P339 VanDerWaalsContact C-CD 3.46Å
340	R	91.2	Very high	84.8	Confident	154 Å²	154	62.3 Å²	62.3	58%	0.581	30%	0.304	S	S	*	.			trans	-130.4	158.4	168.1	56.9	171.5	-174.8	-147.3	3.2	109.1	Y83 N303 K338	Y83-R340 VanDerWaalsContact CD1-O 3.26Å; Y83-R340 WeakPolarHBondContact CD1-O 3.4Å; Y83-R340 VanDerWaalsContact CE1-C 3.48Å; N303-R340 PolarHBondContact ND2-NE 2.72Å; N303-R340 VanDerWaalsContact OD1-CG 3.25Å; N303-R340 WeakPolarHBondContact OD1-CG 3.4Å; N303-R340 PolarHBondContact OD1-N 2.68Å; N303-R340 PolarHBondContact OD1-O 3.31Å; K338-R340 PolarHBondContact O-N 2.71Å
341	I	91.2	Very high	83.7	Confident	34 Å²	34	63.2 Å²	63.2	17%	0.174	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-62.8	136	164.3	-61	176.9	0	0	0	107.3	Y83 R232 E343	Y83-I341 HydrophobicContact CD2-CG1 3.91Å; Y83-I341 HydrophobicContact CE1-CG1 4.18Å; Y83-I341 HydrophobicContact CE2-CD1 4.16Å; Y83-I341 HydrophobicContact CE2-CG1 3.52Å; Y83-I341 HydrophobicContact CG-CG1 4.39Å; R232-I341 HydrophobicContact CG-CG2 4.25Å; I341-E343 HydrophobicContact CG2-CB 4.41Å
342	N	88.8	Confident	82.8	Confident	31 Å²	31	64.5 Å²	64.5	17%	0.166	31%	0.313	C	S	.	.			trans	-93	122	169.8	-38.6	-81.8	0	0	0	108.2	G82 N84 R232 A233 N303	G82-N342 PolarHBondContact O-N 2.92Å; G82-N342 PolarHBondContact O-ND2 3.12Å; N84-N342 VanDerWaalsContact CG-ND2 3.3Å; N84-N342 PolarHBondContact ND2-ND2 3.1Å; N84-N342 PolarHBondContact ND2-OD1 3.5Å; N84-N342 VanDerWaalsContact ND2-OD1 3.1Å; N84-N342 PolarHBondContact OD1-ND2 3.2Å; R232-N342 CarbonylContact C-O 3.59Å; R232-N342 WeakPolarHBondContact CA-O 3.3Å; R232-N342 WeakPolarHBondContact CB-O 3.37Å; A233-N342 HydrophobicContact CB-CB 4.4Å; A233-N342 PolarHBondContact N-O 2.86Å; A233-N342 WeakPolarHBondContact O-CB 3.36Å; A233-N342 PolarHBondContact O-ND2 3.12Å; N303-N342 PolarHBondContact ND2-OD1 3.3Å
343	E	85	Confident	81.6	Confident	39 Å²	39	70.6 Å²	70.6	18%	0.182	34%	0.337	C	S	.	.	B	Isolated β-bridge	trans	-150.4	171.3	-174.2	68.1	-158.9	144.3	0	0	111	L231 R232 I341 A348 R351	L231-E343 VanDerWaalsContact O-CA 3.27Å; L231-E343 WeakPolarHBondContact O-CA 3.19Å; L231-E343 WeakPolarHBondContact O-CB 3.4Å; R232-E343 HydrophobicContact CG-CB 4.11Å; I341-E343 HydrophobicContact CG2-CB 4.41Å; E343-A348 HydrophobicContact CG-CB 3.85Å; E343-A348 WeakPolarHBondContact OE1-CA 3.44Å; E343-R351 VanDerWaalsContact CD-NH1 3.26Å; E343-R351 IonicContact OE1-CZ 3.67Å; E343-R351 IonicContact OE1-NH1 3.75Å; E343-R351 PolarHBondContact OE1-NH1 3.13Å; E343-R351 IonicContact OE1-NH2 2.75Å; E343-R351 IonicContact OE2-CZ 3.97Å; E343-R351 VanDerWaalsContact OE2-CZ 3.31Å; E343-R351 IonicContact OE2-NH1 3.63Å; E343-R351 PolarHBondContact OE2-NH1 3.37Å; E343-R351 IonicContact OE2-NH2 3.8Å; E343-R351 PolarHBondContact OE2-NH2 2.84Å
344	D	77.3	Confident	80.4	Confident	64 Å²	64	74.1 Å²	74.1	34%	0.342	35%	0.354	S	S	.	.			trans	-59.4	129.5	175.6	-147.5	-58	0	0	0	110.3	L231 K346 D347 A348	L231-D344 PolarHBondContact O-N 3.46Å; L231-D344 VanDerWaalsContact O-N 3.14Å; D344-K346 PolarHBondContact O-N 2.92Å; D344-D347 WeakPolarHBondContact O-CB 3.27Å; D344-D347 PolarHBondContact O-N 3.43Å; D344-A348 PolarHBondContact O-N 3.05Å
345	P	68.6	Low	79.7	Confident	102 Å²	102	76.1 Å²	76.1	66%	0.662	36%	0.361	S	S	*	.	H	α-helix	trans	-56.1	-25.9	-170.5	-30.2	36.5	0	0	0	115.4	D347 L349	P345-D347 VanDerWaalsContact C-N 3.33Å; P345-L349 WeakPolarHBondContact O-CB 3.44Å; P345-L349 PolarHBondContact O-N 2.84Å; P345-L349 VanDerWaalsContact O-N 3.1Å
346	K	63	Low	78.8	Confident	117 Å²	117	79.7 Å²	79.7	51%	0.509	38%	0.378	S	S	.	.	H	α-helix	trans	-65.6	-35.3	174.5	-61.8	168.9	-173.8	160.6	0	112.5	D344 L350	D344-K346 PolarHBondContact O-N 2.92Å; K346-L350 WeakPolarHBondContact O-CB 3.35Å; K346-L350 WeakPolarHBondContact O-CD1 3.29Å; K346-L350 VanDerWaalsContact O-CG 3.27Å; K346-L350 WeakPolarHBondContact O-CG 3.46Å; K346-L350 PolarHBondContact O-N 3.24Å
347	D	65.8	Low	77.9	Confident	11 Å²	11	78.5 Å²	78.5	6%	0.059	38%	0.376	C	S	.	.	H	α-helix	trans	-81.7	-37	-177.2	-68	-14.3	0	0	0	111.3	K228 H230 D344 P345 L350 R351	K228-D347 IonicContact NZ-OD1 2.7Å; K228-D347 PolarHBondContact NZ-OD1 3.26Å; H230-D347 IonicContact CE1-OD1 2.83Å; H230-D347 IonicContact CE1-OD2 3.93Å; H230-D347 IonicContact CG-OD2 3.7Å; H230-D347 IonicContact ND1-OD1 3.87Å; H230-D347 IonicContact ND1-OD2 3.18Å; H230-D347 PolarHBondContact ND1-OD2 3.27Å; D344-D347 WeakPolarHBondContact O-CB 3.27Å; D344-D347 PolarHBondContact O-N 3.43Å; P345-D347 VanDerWaalsContact C-N 3.33Å; D347-L350 PolarHBondContact O-N 3.32Å; D347-R351 PolarHBondContact O-N 2.9Å
348	A	68.1	Low	77.2	Confident	36 Å²	36	86 Å²	86	30%	0.298	41%	0.409	S	S	.	.	H	α-helix	trans	-56.3	-51.4	167.8	0	0	0	0	0	111	E343 D344 L350 R351 E352	E343-A348 HydrophobicContact CG-CB 3.85Å; E343-A348 WeakPolarHBondContact OE1-CA 3.44Å; D344-A348 PolarHBondContact O-N 3.05Å; A348-L350 PolarHBondContact O-N 3.21Å; A348-R351 PolarHBondContact O-N 3.21Å; A348-E352 PolarHBondContact O-N 3.17Å
349	L	68.7	Low	76.6	Confident	80 Å²	80	86 Å²	86	42%	0.419	40%	0.404	S	S	.	.	H	α-helix	trans	-64.1	-40.8	179.5	-172.2	65.4	0	0	0	112.3	P345 R351 E352 Y353	P345-L349 WeakPolarHBondContact O-CB 3.44Å; P345-L349 PolarHBondContact O-N 2.84Å; P345-L349 VanDerWaalsContact O-N 3.1Å; L349-R351 VanDerWaalsContact C-N 3.34Å; L349-R351 PolarHBondContact O-N 2.91Å; L349-E352 PolarHBondContact O-N 3.08Å; L349-Y353 HydrophobicContact CD1-CE1 3.97Å; L349-Y353 HydrophobicContact CD1-CE2 4.01Å; L349-Y353 HydrophobicContact CD2-CE2 3.99Å; L349-Y353 HydrophobicContact CG-CD2 4.15Å; L349-Y353 HydrophobicContact CG-CE2 3.66Å; L349-Y353 PolarHBondContact O-N 3.4Å
350	L	68.1	Low	75.8	Confident	79 Å²	79	87.6 Å²	87.6	41%	0.414	41%	0.411	S	S	.	.	H	α-helix	trans	-63	-36.9	174.5	-82.7	166.8	0	0	0	112.6	K228 K346 D347 A348 Q354	K228-L350 VanDerWaalsContact NZ-CD1 3.29Å; K346-L350 WeakPolarHBondContact O-CB 3.35Å; K346-L350 WeakPolarHBondContact O-CD1 3.29Å; K346-L350 VanDerWaalsContact O-CG 3.27Å; K346-L350 WeakPolarHBondContact O-CG 3.46Å; K346-L350 PolarHBondContact O-N 3.24Å; D347-L350 PolarHBondContact O-N 3.32Å; A348-L350 PolarHBondContact O-N 3.21Å; L350-Q354 WeakPolarHBondContact O-CB 3.28Å; L350-Q354 VanDerWaalsContact O-CG 3.23Å; L350-Q354 WeakPolarHBondContact O-CG 3.28Å; L350-Q354 PolarHBondContact O-N 3.14Å
351	R	73.8	Confident	74.9	Confident	73 Å²	73	86.8 Å²	86.8	28%	0.275	41%	0.412	S	S	.	.	H	α-helix	trans	-70.5	-43.8	174.2	-168.4	-178.6	-52	98	10.8	111.8	E343 D347 A348 L349 Y353 Q354 E355	E343-R351 VanDerWaalsContact CD-NH1 3.26Å; E343-R351 IonicContact OE1-CZ 3.67Å; E343-R351 IonicContact OE1-NH1 3.75Å; E343-R351 PolarHBondContact OE1-NH1 3.13Å; E343-R351 IonicContact OE1-NH2 2.75Å; E343-R351 IonicContact OE2-CZ 3.97Å; E343-R351 VanDerWaalsContact OE2-CZ 3.31Å; E343-R351 IonicContact OE2-NH1 3.63Å; E343-R351 PolarHBondContact OE2-NH1 3.37Å; E343-R351 IonicContact OE2-NH2 3.8Å; E343-R351 PolarHBondContact OE2-NH2 2.84Å; D347-R351 PolarHBondContact O-N 2.9Å; A348-R351 PolarHBondContact O-N 3.21Å; L349-R351 VanDerWaalsContact C-N 3.34Å; L349-R351 PolarHBondContact O-N 2.91Å; R351-Y353 VanDerWaalsContact C-N 3.29Å; R351-Y353 PolarHBondContact O-N 3.13Å; R351-Q354 CarbonylContact O-C 3.58Å; R351-Q354 PolarHBondContact O-N 3.3Å; R351-E355 VanDerWaalsContact CD-OE1 3.29Å; R351-E355 WeakPolarHBondContact CD-OE1 3.48Å; R351-E355 HydrophobicContact CG-CG 4.23Å; R351-E355 WeakPolarHBondContact CG-OE1 3.09Å; R351-E355 PolarHBondContact O-N 3.31Å
352	E	74.8	Confident	74.3	Confident	115 Å²	115	87.8 Å²	87.8	54%	0.537	43%	0.425	S	S	.	.	H	α-helix	trans	-58.5	-42.9	177.9	-172.7	161.3	-148	0	0	111.1	A348 L349 E355 E356	A348-E352 PolarHBondContact O-N 3.17Å; L349-E352 PolarHBondContact O-N 3.08Å; E352-E355 PolarHBondContact O-N 3.43Å; E352-E356 PolarHBondContact O-N 3.49Å
353	Y	70.8	Confident	73.8	Confident	128 Å²	128	89.4 Å²	89.4	50%	0.502	43%	0.433	S	S	.	.	H	α-helix	trans	-64.4	-40.1	171	-67.3	-23.9	0	0	0	113.3	L349 R351 I357	L349-Y353 HydrophobicContact CD1-CE1 3.97Å; L349-Y353 HydrophobicContact CD1-CE2 4.01Å; L349-Y353 HydrophobicContact CD2-CE2 3.99Å; L349-Y353 HydrophobicContact CG-CD2 4.15Å; L349-Y353 HydrophobicContact CG-CE2 3.66Å; L349-Y353 PolarHBondContact O-N 3.4Å; R351-Y353 VanDerWaalsContact C-N 3.29Å; R351-Y353 PolarHBondContact O-N 3.13Å; Y353-I357 VanDerWaalsContact O-CB 3.23Å; Y353-I357 WeakPolarHBondContact O-CB 3.43Å; Y353-I357 WeakPolarHBondContact O-CD1 3.5Å; Y353-I357 WeakPolarHBondContact O-CG1 3.32Å; Y353-I357 PolarHBondContact O-N 2.96Å
354	Q	70.8	Confident	73.1	Confident	124 Å²	124	92 Å²	92	58%	0.579	45%	0.448	S	S	*	.	H	α-helix	trans	-66.2	-39.4	176.4	-76.2	174.2	23.8	0	0	112.9	L350 R351 K358	L350-Q354 WeakPolarHBondContact O-CB 3.28Å; L350-Q354 VanDerWaalsContact O-CG 3.23Å; L350-Q354 WeakPolarHBondContact O-CG 3.28Å; L350-Q354 PolarHBondContact O-N 3.14Å; R351-Q354 CarbonylContact O-C 3.58Å; R351-Q354 PolarHBondContact O-N 3.3Å; Q354-K358 VanDerWaalsContact O-CB 3.3Å; Q354-K358 WeakPolarHBondContact O-CB 3.4Å; Q354-K358 PolarHBondContact O-N 2.8Å
355	E	79.1	Confident	72.8	Confident	120 Å²	120	92.2 Å²	92.2	56%	0.561	46%	0.458	S	S	*	.	H	α-helix	trans	-67.5	-45.2	176.7	-75.4	-177.8	-159.7	0	0	111.4	R351 E352 K358 R359	R351-E355 VanDerWaalsContact CD-OE1 3.29Å; R351-E355 WeakPolarHBondContact CD-OE1 3.48Å; R351-E355 HydrophobicContact CG-CG 4.23Å; R351-E355 WeakPolarHBondContact CG-OE1 3.09Å; R351-E355 PolarHBondContact O-N 3.31Å; E352-E355 PolarHBondContact O-N 3.43Å; E355-K358 WeakPolarHBondContact O-CB 3.45Å; E355-K358 PolarHBondContact O-N 3.44Å; E355-R359 WeakPolarHBondContact O-CB 3.49Å; E355-R359 PolarHBondContact O-N 3.38Å
356	E	75.3	Confident	72.9	Confident	75 Å²	75	95.4 Å²	95.4	35%	0.35	47%	0.465	S	S	.	.	H	α-helix	trans	-70.4	-36	177.1	-165.5	63	-163.2	0	0	111.5	E352 K358 R359 L360	E352-E356 PolarHBondContact O-N 3.49Å; E356-K358 VanDerWaalsContact C-N 3.32Å; E356-K358 PolarHBondContact O-N 2.93Å; E356-R359 PolarHBondContact O-N 2.99Å; E356-R359 IonicContact OE1-CZ 3.13Å; E356-R359 IonicContact OE1-NH1 2.79Å; E356-R359 PolarHBondContact OE1-NH1 2.85Å; E356-R359 WeakPolarHBondContact OE2-CD 3Å; E356-R359 IonicContact OE2-CZ 3.94Å; E356-R359 IonicContact OE2-NE 3.75Å; E356-R359 IonicContact OE2-NH1 2.65Å; E356-R359 PolarHBondContact OE2-NH1 3.15Å; E356-L360 HydrophobicContact CG-CD1 4.14Å; E356-L360 HydrophobicContact CG-CG 4.34Å; E356-L360 WeakPolarHBondContact O-CB 3.19Å; E356-L360 VanDerWaalsContact O-CG 3.25Å; E356-L360 WeakPolarHBondContact O-CG 3.5Å; E356-L360 PolarHBondContact O-N 3.27Å
357	I	75.7	Confident	72.8	Confident	88 Å²	88	97 Å²	97	45%	0.451	47%	0.474	S	S	.	.	H	α-helix	trans	-59.5	-42.1	169.1	-74.5	165.5	0	0	0	111.1	Y353 K361	Y353-I357 VanDerWaalsContact O-CB 3.23Å; Y353-I357 WeakPolarHBondContact O-CB 3.43Å; Y353-I357 WeakPolarHBondContact O-CD1 3.5Å; Y353-I357 WeakPolarHBondContact O-CG1 3.32Å; Y353-I357 PolarHBondContact O-N 2.96Å; I357-K361 HydrophobicContact CG2-CD 4.01Å; I357-K361 VanDerWaalsContact O-CB 3.3Å; I357-K361 WeakPolarHBondContact O-CB 3.2Å; I357-K361 VanDerWaalsContact O-CG 3.24Å; I357-K361 WeakPolarHBondContact O-CG 3.24Å; I357-K361 PolarHBondContact O-N 2.72Å
358	K	78.8	Confident	72.2	Confident	159 Å²	159	100.3 Å²	100.3	69%	0.691	49%	0.49	S	S	*	.	H	α-helix	trans	-65.4	-40	177.1	-175.5	179.5	-179.5	-179.4	0	111.4	Q354 E355 E356 A362	Q354-K358 VanDerWaalsContact O-CB 3.3Å; Q354-K358 WeakPolarHBondContact O-CB 3.4Å; Q354-K358 PolarHBondContact O-N 2.8Å; E355-K358 WeakPolarHBondContact O-CB 3.45Å; E355-K358 PolarHBondContact O-N 3.44Å; E356-K358 VanDerWaalsContact C-N 3.32Å; E356-K358 PolarHBondContact O-N 2.93Å; K358-A362 WeakPolarHBondContact O-CB 3.35Å; K358-A362 PolarHBondContact O-N 3.45Å
359	R	81.3	Confident	71.3	Confident	149 Å²	149	100.8 Å²	100.8	56%	0.562	50%	0.498	S	S	*	.	H	α-helix	trans	-67.1	-47.8	176.7	-172.1	-166.2	-176.2	-167.7	-3.3	112.2	E355 E356 K361 A362 I363	E355-R359 WeakPolarHBondContact O-CB 3.49Å; E355-R359 PolarHBondContact O-N 3.38Å; E356-R359 PolarHBondContact O-N 2.99Å; E356-R359 IonicContact OE1-CZ 3.13Å; E356-R359 IonicContact OE1-NH1 2.79Å; E356-R359 PolarHBondContact OE1-NH1 2.85Å; E356-R359 WeakPolarHBondContact OE2-CD 3Å; E356-R359 IonicContact OE2-CZ 3.94Å; E356-R359 IonicContact OE2-NE 3.75Å; E356-R359 IonicContact OE2-NH1 2.65Å; E356-R359 PolarHBondContact OE2-NH1 3.15Å; R359-K361 VanDerWaalsContact C-N 3.34Å; R359-K361 PolarHBondContact O-N 2.89Å; R359-A362 WeakPolarHBondContact O-CB 3.47Å; R359-A362 PolarHBondContact O-N 2.96Å; R359-A362 VanDerWaalsContact O-N 3.11Å; R359-I363 HydrophobicContact CG-CD1 4.21Å; R359-I363 WeakPolarHBondContact O-CG1 3.2Å; R359-I363 PolarHBondContact O-N 3.4Å
360	L	74.9	Confident	70.4	Confident	61 Å²	61	103.2 Å²	103.2	32%	0.319	52%	0.519	S	S	.	.	H	α-helix	trans	-61.4	-41.7	175.6	-70.4	169.4	0	0	0	111.1	E356 A362 I363 L364	E356-L360 HydrophobicContact CG-CD1 4.14Å; E356-L360 HydrophobicContact CG-CG 4.34Å; E356-L360 WeakPolarHBondContact O-CB 3.19Å; E356-L360 VanDerWaalsContact O-CG 3.25Å; E356-L360 WeakPolarHBondContact O-CG 3.5Å; E356-L360 PolarHBondContact O-N 3.27Å; L360-A362 VanDerWaalsContact C-N 3.34Å; L360-A362 PolarHBondContact O-N 3.46Å; L360-I363 PolarHBondContact O-N 3.4Å; L360-L364 WeakPolarHBondContact O-CB 3.49Å; L360-L364 VanDerWaalsContact O-CG 3.3Å; L360-L364 WeakPolarHBondContact O-CG 3.45Å; L360-L364 PolarHBondContact O-N 2.75Å
361	K	72.9	Confident	69.6	Low	138 Å²	138	102.4 Å²	102.4	60%	0.6	53%	0.529	S	S	*	.	H	α-helix	trans	-60.5	-39.3	171.4	-78	174.3	177.5	-179.8	0	112.8	I357 R359 A365	I357-K361 HydrophobicContact CG2-CD 4.01Å; I357-K361 VanDerWaalsContact O-CB 3.3Å; I357-K361 WeakPolarHBondContact O-CB 3.2Å; I357-K361 VanDerWaalsContact O-CG 3.24Å; I357-K361 WeakPolarHBondContact O-CG 3.24Å; I357-K361 PolarHBondContact O-N 2.72Å; R359-K361 VanDerWaalsContact C-N 3.34Å; R359-K361 PolarHBondContact O-N 2.89Å; K361-A365 VanDerWaalsContact O-CB 3.28Å; K361-A365 WeakPolarHBondContact O-CB 3.47Å; K361-A365 PolarHBondContact O-N 3.18Å
362	A	79.5	Confident	68.6	Low	54 Å²	54	104 Å²	104	45%	0.446	54%	0.543	S	S	.	.	H	α-helix	trans	-67.9	-39.1	176	0	0	0	0	0	112.5	K358 R359 L360 A365 Q366	K358-A362 WeakPolarHBondContact O-CB 3.35Å; K358-A362 PolarHBondContact O-N 3.45Å; R359-A362 WeakPolarHBondContact O-CB 3.47Å; R359-A362 PolarHBondContact O-N 2.96Å; R359-A362 VanDerWaalsContact O-N 3.11Å; L360-A362 VanDerWaalsContact C-N 3.34Å; L360-A362 PolarHBondContact O-N 3.46Å; A362-A365 PolarHBondContact O-N 2.64Å; A362-Q366 WeakPolarHBondContact O-CG 3.22Å; A362-Q366 PolarHBondContact O-N 3.03Å
363	I	77.4	Confident	67.1	Low	65 Å²	65	104 Å²	104	33%	0.333	55%	0.546	S	S	.	.	H	α-helix	trans	-65	-46.5	174.6	-67.1	163.9	0	0	0	110.4	R359 L360 A365 Q366 Q367	R359-I363 HydrophobicContact CG-CD1 4.21Å; R359-I363 WeakPolarHBondContact O-CG1 3.2Å; R359-I363 PolarHBondContact O-N 3.4Å; L360-I363 PolarHBondContact O-N 3.4Å; I363-A365 VanDerWaalsContact C-N 3.32Å; I363-A365 PolarHBondContact O-N 3.11Å; I363-Q366 PolarHBondContact O-N 2.86Å; I363-Q366 VanDerWaalsContact O-N 3.08Å; I363-Q367 WeakPolarHBondContact O-CG 3.45Å; I363-Q367 PolarHBondContact O-N 3.46Å
364	L	70.9	Confident	66	Low	93 Å²	93	102.2 Å²	102.2	49%	0.487	55%	0.553	S	S	.	*	H	α-helix	trans	-59.7	-41	175	-73.5	166.5	0	0	0	111.8	L360 Q366 Q367 M368	L360-L364 WeakPolarHBondContact O-CB 3.49Å; L360-L364 VanDerWaalsContact O-CG 3.3Å; L360-L364 WeakPolarHBondContact O-CG 3.45Å; L360-L364 PolarHBondContact O-N 2.75Å; L364-Q366 VanDerWaalsContact C-N 3.28Å; L364-Q366 PolarHBondContact O-N 3.07Å; L364-Q367 PolarHBondContact O-N 3.41Å; L364-M368 WeakPolarHBondContact O-CB 3.22Å; L364-M368 PolarHBondContact O-N 3.28Å
365	A	71.6	Confident	64.8	Low	69 Å²	69	99 Å²	99	57%	0.57	55%	0.547	S	S	*	.	H	α-helix	trans	-71	-18.1	175.8	0	0	0	0	0	114.2	K361 A362 I363	K361-A365 VanDerWaalsContact O-CB 3.28Å; K361-A365 WeakPolarHBondContact O-CB 3.47Å; K361-A365 PolarHBondContact O-N 3.18Å; A362-A365 PolarHBondContact O-N 2.64Å; I363-A365 VanDerWaalsContact C-N 3.32Å; I363-A365 PolarHBondContact O-N 3.11Å
366	Q	69.1	Low	63.2	Low	170 Å²	170	99.2 Å²	99.2	79%	0.794	55%	0.552	S	S	*	*	H	α-helix	trans	-86.9	-31.2	170	-76.1	-177.1	-20.7	0	0	112.6	A362 I363 L364	A362-Q366 WeakPolarHBondContact O-CG 3.22Å; A362-Q366 PolarHBondContact O-N 3.03Å; I363-Q366 PolarHBondContact O-N 2.86Å; I363-Q366 VanDerWaalsContact O-N 3.08Å; L364-Q366 VanDerWaalsContact C-N 3.28Å; L364-Q366 PolarHBondContact O-N 3.07Å
367	Q	61.9	Low	61.7	Low	151 Å²	151	102.8 Å²	102.8	71%	0.706	57%	0.572	S	S	*	*	H	α-helix	trans	-83.1	-30.3	177.5	-70.2	-179.3	-14.4	0	0	113.1	I363 L364	I363-Q367 WeakPolarHBondContact O-CG 3.45Å; I363-Q367 PolarHBondContact O-N 3.46Å; L364-Q367 PolarHBondContact O-N 3.41Å
368	M	52.2	Low	60.1	Low	80 Å²	80	102.6 Å²	102.6	39%	0.394	58%	0.579	S	S	.	*	S	Bend	trans	-101.1	101.5	175.8	-61.2	-172.7	72.1	0	0	110	L364 N372	L364-M368 WeakPolarHBondContact O-CB 3.22Å; L364-M368 PolarHBondContact O-N 3.28Å; M368-N372 HydrophobicContact CE-CB 4.2Å
369	G	49.7	Very low	58.2	Low	46 Å²	46	100.4 Å²	100.4	47%	0.474	58%	0.579	S	S	.	*			trans	-55.5	152.7	176.8	0	0	0	0	0	113.1	G371 N372	G369-G371 PolarHBondContact O-N 3.44Å; G369-N372 PolarHBondContact O-N 2.89Å
370	P	50.6	Low	56.1	Low	131 Å²	131	102.1 Å²	102.1	85%	0.851	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	-9.9	-158.8	21.4	-33.9	0	0	0	116.8
371	G	49.7	Very low	54	Low	61 Å²	61	105.8 Å²	105.8	63%	0.629	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	-35.7	176.1	0	0	0	0	0	114.7	G369	G369-G371 PolarHBondContact O-N 3.44Å
372	N	52.9	Low	52.2	Low	106 Å²	106	104.9 Å²	104.9	57%	0.567	63%	0.627	S	S	*	*	S	Bend	trans	-82.9	-19	-167.2	-84.7	5.5	0	0	0	115.1	M368 G369	M368-N372 HydrophobicContact CE-CB 4.2Å; G369-N372 PolarHBondContact O-N 2.89Å
373	L	44	Very low	50.4	Low	115 Å²	115	108.6 Å²	108.6	60%	0.602	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	-31.6	-177.2	-162.3	69.8	0	0	0	112.4	A375	L373-A375 VanDerWaalsContact C-N 3.33Å; L373-A375 PolarHBondContact O-N 2.98Å
374	S	47.1	Very low	48	Very low	91 Å²	91	109 Å²	109	64%	0.636	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	-23.2	-179.7	-166.1	0	0	0	0	113.6	S378	S374-S378 PolarHBondContact O-OG 3.3Å
375	A	45.6	Very low	46.8	Very low	56 Å²	56	110.4 Å²	110.4	46%	0.463	68%	0.681	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.5	-31.7	-177	0	0	0	0	0	113	L373 L377 S378	L373-A375 VanDerWaalsContact C-N 3.33Å; L373-A375 PolarHBondContact O-N 2.98Å; A375-L377 VanDerWaalsContact C-N 3.32Å; A375-L377 PolarHBondContact O-N 2.78Å; A375-S378 PolarHBondContact O-OG 2.98Å
376	L	45.5	Very low	44.9	Very low	126 Å²	126	112.4 Å²	112.4	66%	0.66	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-13.6	-178.8	-77.3	164.5	0	0	0	113.9
377	L	45.5	Very low	43	Very low	150 Å²	150	112.9 Å²	112.9	79%	0.785	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.4	-6.8	-179.4	-78.7	163.4	0	0	0	113.7	A375	A375-L377 VanDerWaalsContact C-N 3.32Å; A375-L377 PolarHBondContact O-N 2.78Å
378	S	42	Very low	41.6	Very low	83 Å²	83	110.9 Å²	110.9	58%	0.58	69%	0.69	S	S	*	*			trans	-116.4	-0.3	-168.5	60.4	0	0	0	0	115.7	S374 A375 Q380	S374-S378 PolarHBondContact O-OG 3.3Å; A375-S378 PolarHBondContact O-OG 2.98Å; S378-Q380 PolarHBondContact O-N 3.33Å
379	T	37.3	Very low	40.6	Very low	114 Å²	114	115.5 Å²	115.5	70%	0.699	71%	0.711	S	S	*	*			trans	-81.9	72.8	-174.1	52.7	0	0	0	0	113.5
380	Q	37.3	Very low	39.8	Very low	185 Å²	185	120 Å²	120	86%	0.864	72%	0.72	S	S	*	*			trans	-135.1	75.9	159.8	-73	-164.2	16.2	0	0	111.5	S378	S378-Q380 PolarHBondContact O-N 3.33Å
381	T	30.7	Very low	38.9	Very low	138 Å²	138	121.9 Å²	121.9	85%	0.847	71%	0.714	S	S	*	*	S	Bend	trans	-167	155.1	153.7	4.8	0	0	0	0	111
382	P	35.4	Very low	38.1	Very low	119 Å²	119	126 Å²	126	77%	0.773	72%	0.721	S	S	*	*			trans	-79.5	168.4	-176	-13.7	31.5	0	0	0	114.5
383	P	43	Very low	37.1	Very low	132 Å²	132	128.8 Å²	128.8	86%	0.857	74%	0.736	S	S	*	*			trans	-86	153.6	-168	34.3	-36.5	0	0	0	115.3
384	G	26.8	Very low	36.8	Very low	72 Å²	72	127.2 Å²	127.2	74%	0.742	73%	0.734	S	S	*	*			trans	-130.7	156.5	160.2	0	0	0	0	0	110.6
385	P	44.4	Very low	36.6	Very low	123 Å²	123	128.4 Å²	128.4	80%	0.799	74%	0.74	S	S	*	*			trans	-115.4	179.6	-160.4	33.8	-17.6	0	0	0	115.7
386	V	32.1	Very low	36.3	Very low	112 Å²	112	130.2 Å²	130.2	68%	0.679	75%	0.745	S	S	*	*			trans	96.9	96.4	158.8	-169.9	0	0	0	0	118.6
387	Q	29.8	Very low	36.1	Very low	180 Å²	180	130.2 Å²	130.2	84%	0.841	75%	0.751	S	S	*	*			trans	64.4	157.6	138.6	-58.6	166.6	-0.1	0	0	118.7
388	S	31.2	Very low	35.9	Very low	108 Å²	108	128.5 Å²	128.5	76%	0.755	75%	0.746	S	S	*	*			cis	-144.2	177.6	11.5	-30.4	0	0	0	0	114
389	E	32.4	Very low	35.9	Very low	178 Å²	178	131 Å²	131	83%	0.832	75%	0.748	S	S	*	*			trans	-45.7	166.3	173.4	-53.3	172.6	120.3	0	0	116.1
390	E	32.9	Very low	36.1	Very low	139 Å²	139	132.8 Å²	132.8	65%	0.65	75%	0.749	S	S	*	*			cis	-148.7	154.5	36.6	-72.5	-166.2	108.8	0	0	116.4
391	K	30.8	Very low	36.5	Very low	171 Å²	171	130.1 Å²	130.1	74%	0.743	74%	0.741	S	S	*	*			trans	44	153.2	137.5	-63.9	168.2	-177.2	157.9	0	122.4
392	L	34.1	Very low	37.4	Very low	147 Å²	147	126 Å²	126	77%	0.77	72%	0.715	S	S	*	*			cis	-177	137.4	-25	177	65.4	0	0	0	107.4
393	L	31.9	Very low	38.4	Very low	166 Å²	166	126.3 Å²	126.3	87%	0.869	71%	0.706	S	S	*	*			trans	160.5	137.9	136.9	-87.5	164.4	0	0	0	110.4
394	S	37.5	Very low	39.3	Very low	82 Å²	82	122.3 Å²	122.3	57%	0.573	68%	0.684	S	S	*	*			trans	-120.3	173.6	179.9	68.1	0	0	0	0	112.1	T396	S394-T396 VanDerWaalsContact CB-OG1 3.29Å; S394-T396 WeakPolarHBondContact CB-OG1 3.16Å; S394-T396 PolarHBondContact OG-OG1 3.26Å
395	P	41.4	Very low	40.8	Very low	116 Å²	116	124.7 Å²	124.7	75%	0.753	68%	0.676	S	S	*	*				-122.6	140.9	104.1	-2	22.4	0	0	0	113.2
396	T	40.8	Very low	41.3	Very low	94 Å²	94	124.8 Å²	124.8	58%	0.577	66%	0.664	S	S	*	*			trans	-109.5	40.9	-158.2	-31.5	0	0	0	0	114.9	S394	S394-T396 VanDerWaalsContact CB-OG1 3.29Å; S394-T396 WeakPolarHBondContact CB-OG1 3.16Å; S394-T396 PolarHBondContact OG-OG1 3.26Å
397	T	39.9	Very low	42.7	Very low	126 Å²	126	125.5 Å²	125.5	77%	0.773	66%	0.66	S	S	*	*	S	Bend	trans	-130	0.9	-168.7	16.9	0	0	0	0	117.5
398	V	41.3	Very low	44.6	Very low	113 Å²	113	122.4 Å²	122.4	69%	0.685	65%	0.648	S	S	*	*	S	Bend	trans	-117.5	-16.9	179.5	-175.7	0	0	0	0	112.8
399	Q	41.8	Very low	46.3	Very low	135 Å²	135	121.7 Å²	121.7	63%	0.631	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-36.8	-170.7	-71.3	174.4	-28.9	0	0	113.5	T402 E403	Q399-T402 PolarHBondContact O-N 3.17Å; Q399-T402 PolarHBondContact O-OG1 3.38Å; Q399-E403 PolarHBondContact O-N 3.29Å
400	Q	41.8	Very low	47.7	Very low	153 Å²	153	121.1 Å²	121.1	72%	0.715	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	-43.5	-172	-69.2	-175.9	-51.6	0	0	113.6	T402 E403 A404	Q400-T402 VanDerWaalsContact C-N 3.28Å; Q400-T402 PolarHBondContact O-N 2.74Å; Q400-E403 PolarHBondContact O-N 3.45Å; Q400-E403 VanDerWaalsContact O-N 3.15Å; Q400-A404 PolarHBondContact O-N 2.78Å
401	D	46.6	Very low	49.5	Very low	129 Å²	129	120.6 Å²	120.6	69%	0.69	62%	0.623	S	S	*	*	H	α-helix	trans	-57.6	-43.2	174.1	-75.6	-32.2	0	0	0	111.1	E403 A404 E405	D401-E403 PolarHBondContact O-N 2.79Å; D401-A404 PolarHBondContact O-N 3.49Å; D401-E405 WeakPolarHBondContact O-CB 3.41Å; D401-E405 PolarHBondContact O-N 2.83Å
402	T	50.2	Low	51.4	Low	50 Å²	50	118.1 Å²	118.1	31%	0.307	61%	0.614	S	S	.	*	H	α-helix	trans	-73.3	-8	-178.7	76.3	0	0	0	0	114.4	Q399 Q400 K406	Q399-T402 PolarHBondContact O-N 3.17Å; Q399-T402 PolarHBondContact O-OG1 3.38Å; Q400-T402 VanDerWaalsContact C-N 3.28Å; Q400-T402 PolarHBondContact O-N 2.74Å; T402-K406 WeakPolarHBondContact O-CD 3.4Å; T402-K406 VanDerWaalsContact O-CE 3.22Å; T402-K406 WeakPolarHBondContact O-CE 3.44Å; T402-K406 WeakPolarHBondContact O-CG 3.47Å; T402-K406 PolarHBondContact O-NZ 3.13Å; T402-K406 PolarHBondContact OG1-NZ 2.73Å
403	E	55.6	Low	52.6	Low	127 Å²	127	117.4 Å²	117.4	59%	0.593	60%	0.602	S	S	*	*	H	α-helix	trans	-93.4	-40.7	170.4	-79.2	-172.4	139.7	0	0	111.4	Q399 Q400 D401 K406 Q407	Q399-E403 PolarHBondContact O-N 3.29Å; Q400-E403 PolarHBondContact O-N 3.45Å; Q400-E403 VanDerWaalsContact O-N 3.15Å; D401-E403 PolarHBondContact O-N 2.79Å; E403-K406 PolarHBondContact O-N 2.78Å; E403-Q407 WeakPolarHBondContact O-CG 3.37Å; E403-Q407 PolarHBondContact O-N 3.15Å
404	A	61.8	Low	54.3	Low	47 Å²	47	115.3 Å²	115.3	39%	0.388	59%	0.588	S	S	.	*	H	α-helix	trans	-61	-43.6	171.6	0	0	0	0	0	111.9	Q400 D401 K406 Q407 L408	Q400-A404 PolarHBondContact O-N 2.78Å; D401-A404 PolarHBondContact O-N 3.49Å; A404-K406 VanDerWaalsContact C-N 3.33Å; A404-K406 PolarHBondContact O-N 2.74Å; A404-Q407 PolarHBondContact O-N 3.26Å; A404-L408 PolarHBondContact O-N 2.69Å
405	E	58	Low	56.3	Low	123 Å²	123	116.3 Å²	116.3	58%	0.575	58%	0.584	S	S	*	*	H	α-helix	trans	-62.3	-38.5	176	-170.1	177.6	-138.8	0	0	111.9	D401 I409	D401-E405 WeakPolarHBondContact O-CB 3.41Å; D401-E405 PolarHBondContact O-N 2.83Å; E405-I409 HydrophobicContact CG-CD1 4.1Å; E405-I409 WeakPolarHBondContact O-CB 3.18Å; E405-I409 WeakPolarHBondContact O-CD1 3.32Å; E405-I409 VanDerWaalsContact O-CG1 3.24Å; E405-I409 WeakPolarHBondContact O-CG1 3.33Å; E405-I409 PolarHBondContact O-N 3.14Å
406	K	55.9	Low	57.8	Low	124 Å²	124	119 Å²	119	54%	0.539	58%	0.578	S	S	.	*	H	α-helix	trans	-70.4	-29.5	174.8	-73.8	174.9	-160.3	118.4	0	113.4	T402 E403 A404 R410	T402-K406 WeakPolarHBondContact O-CD 3.4Å; T402-K406 VanDerWaalsContact O-CE 3.22Å; T402-K406 WeakPolarHBondContact O-CE 3.44Å; T402-K406 WeakPolarHBondContact O-CG 3.47Å; T402-K406 PolarHBondContact O-NZ 3.13Å; T402-K406 PolarHBondContact OG1-NZ 2.73Å; E403-K406 PolarHBondContact O-N 2.78Å; A404-K406 VanDerWaalsContact C-N 3.33Å; A404-K406 PolarHBondContact O-N 2.74Å; K406-R410 WeakPolarHBondContact O-CB 3.3Å; K406-R410 PolarHBondContact O-N 3.34Å; K406-R410 VanDerWaalsContact O-N 3.14Å
407	Q	61.7	Low	58.7	Low	128 Å²	128	118.9 Å²	118.9	60%	0.598	57%	0.574	S	S	*	*	H	α-helix	trans	-70.4	-48.8	173.6	-76	174.1	-29.7	0	0	110.4	E403 A404 I409 R410 E411	E403-Q407 WeakPolarHBondContact O-CG 3.37Å; E403-Q407 PolarHBondContact O-N 3.15Å; A404-Q407 PolarHBondContact O-N 3.26Å; Q407-I409 PolarHBondContact O-N 3.1Å; Q407-R410 WeakPolarHBondContact O-CA 3.13Å; Q407-R410 WeakPolarHBondContact O-CB 2.84Å; Q407-R410 PolarHBondContact O-N 2.63Å; Q407-E411 WeakPolarHBondContact O-CG 3.45Å; Q407-E411 PolarHBondContact O-N 3.26Å
408	L	69.7	Low	60.5	Low	114 Å²	114	115.7 Å²	115.7	60%	0.597	56%	0.56	S	S	*	*	H	α-helix	trans	-56.6	-45.9	174.6	-74.3	164.9	0	0	0	112.5	A404 R410 E411 E412	A404-L408 PolarHBondContact O-N 2.69Å; L408-R410 VanDerWaalsContact C-N 3.28Å; L408-R410 PolarHBondContact O-N 3.07Å; L408-E411 PolarHBondContact O-N 2.85Å; L408-E412 PolarHBondContact O-N 2.97Å
409	I	64.9	Low	62.4	Low	94 Å²	94	117.7 Å²	117.7	48%	0.482	56%	0.555	S	S	.	*	H	α-helix	trans	-62	-35.5	175.9	-70.6	166.4	0	0	0	111.5	E405 Q407 Y413	E405-I409 HydrophobicContact CG-CD1 4.1Å; E405-I409 WeakPolarHBondContact O-CB 3.18Å; E405-I409 WeakPolarHBondContact O-CD1 3.32Å; E405-I409 VanDerWaalsContact O-CG1 3.24Å; E405-I409 WeakPolarHBondContact O-CG1 3.33Å; E405-I409 PolarHBondContact O-N 3.14Å; Q407-I409 PolarHBondContact O-N 3.1Å; I409-Y413 WeakPolarHBondContact O-CB 3.24Å; I409-Y413 PolarHBondContact O-N 3.29Å; I409-Y413 VanDerWaalsContact O-N 3.09Å
410	R	63.3	Low	63.5	Low	165 Å²	165	116.7 Å²	116.7	62%	0.623	55%	0.554	S	S	*	*	H	α-helix	trans	-69.8	-45.5	176.6	-176.9	179.6	-61.8	-175.7	1.2	111.6	K406 Q407 L408 Y413 E414	K406-R410 WeakPolarHBondContact O-CB 3.3Å; K406-R410 PolarHBondContact O-N 3.34Å; K406-R410 VanDerWaalsContact O-N 3.14Å; Q407-R410 WeakPolarHBondContact O-CA 3.13Å; Q407-R410 WeakPolarHBondContact O-CB 2.84Å; Q407-R410 PolarHBondContact O-N 2.63Å; L408-R410 VanDerWaalsContact C-N 3.28Å; L408-R410 PolarHBondContact O-N 3.07Å; R410-Y413 WeakPolarHBondContact O-CB 3.21Å; R410-Y413 PolarHBondContact O-N 2.79Å; R410-Y413 VanDerWaalsContact O-N 3.17Å; R410-E414 WeakPolarHBondContact CD-OE1 3.32Å; R410-E414 HydrophobicContact CG-CG 4.35Å; R410-E414 WeakPolarHBondContact CG-OE1 3.36Å; R410-E414 WeakPolarHBondContact O-CG 3.5Å; R410-E414 PolarHBondContact O-N 2.74Å
411	E	69.6	Low	64.9	Low	129 Å²	129	115.3 Å²	115.3	60%	0.603	55%	0.546	S	S	*	.	H	α-helix	trans	-61.9	-44	178.1	-70.4	177.1	166.2	0	0	111.2	Q407 L408 Y413 E414 E415	Q407-E411 WeakPolarHBondContact O-CG 3.45Å; Q407-E411 PolarHBondContact O-N 3.26Å; L408-E411 PolarHBondContact O-N 2.85Å; E411-Y413 VanDerWaalsContact C-N 3.31Å; E411-Y413 PolarHBondContact O-N 2.79Å; E411-E414 PolarHBondContact O-N 3.24Å; E411-E415 WeakPolarHBondContact O-CB 3.29Å; E411-E415 PolarHBondContact O-N 3.08Å
412	E	71.5	Confident	66.6	Low	119 Å²	119	111.8 Å²	111.8	56%	0.556	53%	0.534	S	S	*	.	H	α-helix	trans	-59.8	-41.5	172.9	-165.8	-162.8	155.5	0	0	111.4	L408 R416	L408-E412 PolarHBondContact O-N 2.97Å; E412-R416 WeakPolarHBondContact O-CB 3.35Å; E412-R416 PolarHBondContact O-N 2.93Å
413	Y	59.2	Low	67.8	Low	132 Å²	132	114.3 Å²	114.3	52%	0.518	55%	0.546	S	S	.	.	H	α-helix	trans	-66	-43.6	178.2	-132.8	-87	0	0	0	112.3	I409 R410 E411 R416 L417	I409-Y413 WeakPolarHBondContact O-CB 3.24Å; I409-Y413 PolarHBondContact O-N 3.29Å; I409-Y413 VanDerWaalsContact O-N 3.09Å; R410-Y413 WeakPolarHBondContact O-CB 3.21Å; R410-Y413 PolarHBondContact O-N 2.79Å; R410-Y413 VanDerWaalsContact O-N 3.17Å; E411-Y413 VanDerWaalsContact C-N 3.31Å; E411-Y413 PolarHBondContact O-N 2.79Å; Y413-R416 PolarHBondContact O-N 2.9Å; Y413-L417 HydrophobicContact CD1-CD1 4.41Å; Y413-L417 WeakPolarHBondContact O-CB 3.46Å; Y413-L417 PolarHBondContact O-N 3.01Å
414	E	68.4	Low	68.4	Low	122 Å²	122	115 Å²	115	57%	0.57	54%	0.544	S	S	*	.	H	α-helix	trans	-68.2	-41.9	179.8	-73.8	178.8	-160	0	0	111.5	R410 E411 L417 A418	R410-E414 WeakPolarHBondContact CD-OE1 3.32Å; R410-E414 HydrophobicContact CG-CG 4.35Å; R410-E414 WeakPolarHBondContact CG-OE1 3.36Å; R410-E414 WeakPolarHBondContact O-CG 3.5Å; R410-E414 PolarHBondContact O-N 2.74Å; E411-E414 PolarHBondContact O-N 3.24Å; E414-L417 PolarHBondContact O-N 3.46Å; E414-A418 WeakPolarHBondContact O-CB 3.47Å; E414-A418 PolarHBondContact O-N 3.38Å
415	E	78.1	Confident	69.3	Low	103 Å²	103	118.7 Å²	118.7	48%	0.481	55%	0.553	S	S	.	*	H	α-helix	trans	-64	-42.5	174.7	-154.1	-148.2	142.2	0	0	111.4	E411 L417 A418 R419	E411-E415 WeakPolarHBondContact O-CB 3.29Å; E411-E415 PolarHBondContact O-N 3.08Å; E415-L417 VanDerWaalsContact C-N 3.32Å; E415-L417 PolarHBondContact O-N 3Å; E415-A418 PolarHBondContact O-N 3.47Å; E415-R419 WeakPolarHBondContact O-CG 3.47Å; E415-R419 PolarHBondContact O-N 3.06Å; E415-R419 IonicContact OE1-CZ 3.17Å; E415-R419 IonicContact OE1-NE 2.66Å; E415-R419 PolarHBondContact OE1-NE 3.1Å; E415-R419 IonicContact OE1-NH2 2.78Å; E415-R419 PolarHBondContact OE1-NH2 2.96Å; E415-R419 IonicContact OE2-NH2 2.7Å
416	R	74.4	Confident	70.5	Confident	171 Å²	171	115.6 Å²	115.6	65%	0.645	55%	0.549	S	S	*	.	H	α-helix	trans	-64.5	-35.4	176	-171.4	172.7	-173.1	154.7	0.3	112.3	E412 Y413 L420	E412-R416 WeakPolarHBondContact O-CB 3.35Å; E412-R416 PolarHBondContact O-N 2.93Å; Y413-R416 PolarHBondContact O-N 2.9Å; R416-L420 WeakPolarHBondContact O-CB 3.38Å; R416-L420 PolarHBondContact O-N 3.45Å; R416-L420 VanDerWaalsContact O-N 3.11Å
417	L	58	Low	71.4	Confident	92 Å²	92	116.3 Å²	116.3	48%	0.482	55%	0.554	S	S	.	*	H	α-helix	trans	-72.2	-33.6	175.3	-143	121.2	0	0	0	112	Y413 E414 E415 K421	Y413-L417 HydrophobicContact CD1-CD1 4.41Å; Y413-L417 WeakPolarHBondContact O-CB 3.46Å; Y413-L417 PolarHBondContact O-N 3.01Å; E414-L417 PolarHBondContact O-N 3.46Å; E415-L417 VanDerWaalsContact C-N 3.32Å; E415-L417 PolarHBondContact O-N 3Å; L417-K421 WeakPolarHBondContact O-CG 3.29Å; L417-K421 PolarHBondContact O-N 3.36Å; L417-K421 VanDerWaalsContact O-N 3.17Å
418	A	77.7	Confident	71.9	Confident	59 Å²	59	114.2 Å²	114.2	49%	0.488	54%	0.544	S	S	.	.	H	α-helix	trans	-68.1	-46.2	174	0	0	0	0	0	111.8	E414 E415 L420 K421 A422	E414-A418 WeakPolarHBondContact O-CB 3.47Å; E414-A418 PolarHBondContact O-N 3.38Å; E415-A418 PolarHBondContact O-N 3.47Å; A418-L420 PolarHBondContact O-N 3Å; A418-K421 PolarHBondContact O-N 3.25Å; A418-A422 PolarHBondContact O-N 2.8Å
419	R	82.9	Confident	72.3	Confident	155 Å²	155	114.2 Å²	114.2	59%	0.585	54%	0.541	S	S	*	.	H	α-helix	trans	-56.6	-49.8	173.6	-69.9	175.7	-176.8	-142.2	11	111.4	E415 K421 A422 D423	E415-R419 WeakPolarHBondContact O-CG 3.47Å; E415-R419 PolarHBondContact O-N 3.06Å; E415-R419 IonicContact OE1-CZ 3.17Å; E415-R419 IonicContact OE1-NE 2.66Å; E415-R419 PolarHBondContact OE1-NE 3.1Å; E415-R419 IonicContact OE1-NH2 2.78Å; E415-R419 PolarHBondContact OE1-NH2 2.96Å; E415-R419 IonicContact OE2-NH2 2.7Å; R419-K421 VanDerWaalsContact C-N 3.26Å; R419-K421 PolarHBondContact O-N 3.46Å; R419-A422 PolarHBondContact O-N 3.26Å; R419-A422 VanDerWaalsContact O-N 3.07Å; R419-D423 PolarHBondContact O-N 2.92Å
420	L	64.4	Low	73.1	Confident	114 Å²	114	112.9 Å²	112.9	60%	0.597	54%	0.54	S	S	*	.	H	α-helix	trans	-64.4	-28	-178.7	-162.5	71.1	0	0	0	113.4	R416 A418 Y424	R416-L420 WeakPolarHBondContact O-CB 3.38Å; R416-L420 PolarHBondContact O-N 3.45Å; R416-L420 VanDerWaalsContact O-N 3.11Å; A418-L420 PolarHBondContact O-N 3Å; L420-Y424 WeakPolarHBondContact O-CB 3.21Å; L420-Y424 PolarHBondContact O-N 2.89Å
421	K	69.9	Low	73.5	Confident	125 Å²	125	110.9 Å²	110.9	54%	0.543	53%	0.533	S	S	.	.	H	α-helix	trans	-70.8	-45.9	169.9	-79.2	179	174.9	-177.8	0	112.2	L417 A418 R419 D423 Y424 E425	L417-K421 WeakPolarHBondContact O-CG 3.29Å; L417-K421 PolarHBondContact O-N 3.36Å; L417-K421 VanDerWaalsContact O-N 3.17Å; A418-K421 PolarHBondContact O-N 3.25Å; R419-K421 VanDerWaalsContact C-N 3.26Å; R419-K421 PolarHBondContact O-N 3.46Å; K421-D423 VanDerWaalsContact C-N 3.33Å; K421-D423 PolarHBondContact O-N 3.45Å; K421-Y424 WeakPolarHBondContact O-CB 3.46Å; K421-Y424 PolarHBondContact O-N 3.2Å; K421-E425 WeakPolarHBondContact O-CG 3.36Å; K421-E425 PolarHBondContact O-N 3.11Å
422	A	82.6	Confident	74.2	Confident	54 Å²	54	108.5 Å²	108.5	45%	0.446	53%	0.527	S	S	.	.	H	α-helix	trans	-61.9	-40.9	178.6	0	0	0	0	0	111.8	A418 R419 Y424 E425 A426	A418-A422 PolarHBondContact O-N 2.8Å; R419-A422 PolarHBondContact O-N 3.26Å; R419-A422 VanDerWaalsContact O-N 3.07Å; A422-Y424 VanDerWaalsContact C-N 3.35Å; A422-Y424 PolarHBondContact O-N 3.19Å; A422-E425 PolarHBondContact O-N 3.03Å; A422-A426 WeakPolarHBondContact O-CB 3.46Å; A422-A426 PolarHBondContact O-N 2.85Å
423	D	76.5	Confident	74.7	Confident	104 Å²	104	109.8 Å²	109.8	56%	0.556	53%	0.526	S	S	*	.	H	α-helix	trans	-60.5	-43.4	173.8	-66.3	-31.2	0	0	0	111.5	R419 K421 A426 E427	R419-D423 PolarHBondContact O-N 2.92Å; K421-D423 VanDerWaalsContact C-N 3.33Å; K421-D423 PolarHBondContact O-N 3.45Å; D423-A426 PolarHBondContact O-N 2.93Å; D423-E427 WeakPolarHBondContact O-CB 3.46Å; D423-E427 PolarHBondContact O-N 2.66Å
424	Y	68.2	Low	75.5	Confident	141 Å²	141	108.2 Å²	108.2	55%	0.553	53%	0.527	S	S	*	.	H	α-helix	trans	-66.5	-39.9	177.8	-179.7	-99.1	0	0	0	113.2	L420 K421 A422 E427 Q428	L420-Y424 WeakPolarHBondContact O-CB 3.21Å; L420-Y424 PolarHBondContact O-N 2.89Å; K421-Y424 WeakPolarHBondContact O-CB 3.46Å; K421-Y424 PolarHBondContact O-N 3.2Å; A422-Y424 VanDerWaalsContact C-N 3.35Å; A422-Y424 PolarHBondContact O-N 3.19Å; Y424-E427 PolarHBondContact O-N 3.36Å; Y424-Q428 HydrophobicContact CD1-CG 4.29Å; Y424-Q428 HydrophobicContact CE1-CG 3.98Å; Y424-Q428 WeakPolarHBondContact O-CB 3.2Å; Y424-Q428 VanDerWaalsContact O-CG 3.25Å; Y424-Q428 WeakPolarHBondContact O-CG 3.17Å; Y424-Q428 PolarHBondContact O-N 2.94Å; Y424-Q428 PolarHBondContact OH-NE2 3.36Å
425	E	80.9	Confident	75.8	Confident	124 Å²	124	107.8 Å²	107.8	58%	0.579	53%	0.525	S	S	*	.	H	α-helix	trans	-68.5	-39.2	176.4	-73	170.4	-173.8	0	0	111.3	K421 A422 Q428 E429	K421-E425 WeakPolarHBondContact O-CG 3.36Å; K421-E425 PolarHBondContact O-N 3.11Å; A422-E425 PolarHBondContact O-N 3.03Å; E425-Q428 WeakPolarHBondContact O-CB 3.5Å; E425-Q428 PolarHBondContact O-N 3.23Å; E425-E429 PolarHBondContact O-N 3.27Å
426	A	82.8	Confident	76	Confident	59 Å²	59	108.8 Å²	108.8	49%	0.488	53%	0.529	S	S	.	.	H	α-helix	trans	-65.6	-38.7	172.8	0	0	0	0	0	112.8	A422 D423 E429 S430	A422-A426 WeakPolarHBondContact O-CB 3.46Å; A422-A426 PolarHBondContact O-N 2.85Å; D423-A426 PolarHBondContact O-N 2.93Å; A426-E429 PolarHBondContact O-N 3.12Å; A426-S430 WeakPolarHBondContact O-CB 3.3Å; A426-S430 PolarHBondContact O-N 3.21Å
427	E	75.3	Confident	76.1	Confident	138 Å²	138	105.6 Å²	105.6	65%	0.645	53%	0.525	S	S	*	.	H	α-helix	trans	-69.1	-36.7	175	-169	172.1	-152.8	0	0	111.9	D423 Y424 S430 R431	D423-E427 WeakPolarHBondContact O-CB 3.46Å; D423-E427 PolarHBondContact O-N 2.66Å; Y424-E427 PolarHBondContact O-N 3.36Å; E427-S430 PolarHBondContact O-N 2.74Å; E427-R431 WeakPolarHBondContact O-CB 3.24Å; E427-R431 PolarHBondContact O-N 2.89Å
428	Q	71.7	Confident	76.9	Confident	84 Å²	84	106.6 Å²	106.6	39%	0.393	53%	0.53	S	S	.	.	H	α-helix	trans	-59.2	-50.7	170.4	-75.5	-83.2	7.9	0	0	111.6	Y424 E425 S430 R431 V432	Y424-Q428 HydrophobicContact CD1-CG 4.29Å; Y424-Q428 HydrophobicContact CE1-CG 3.98Å; Y424-Q428 WeakPolarHBondContact O-CB 3.2Å; Y424-Q428 VanDerWaalsContact O-CG 3.25Å; Y424-Q428 WeakPolarHBondContact O-CG 3.17Å; Y424-Q428 PolarHBondContact O-N 2.94Å; Y424-Q428 PolarHBondContact OH-NE2 3.36Å; E425-Q428 WeakPolarHBondContact O-CB 3.5Å; E425-Q428 PolarHBondContact O-N 3.23Å; Q428-S430 PolarHBondContact O-N 3.24Å; Q428-R431 PolarHBondContact O-N 2.7Å; Q428-V432 WeakPolarHBondContact O-CG2 3.3Å; Q428-V432 PolarHBondContact O-N 2.97Å
429	E	78.2	Confident	77	Confident	115 Å²	115	107.1 Å²	107.1	54%	0.537	53%	0.527	S	S	.	.	H	α-helix	trans	-58.9	-48.1	176.6	-83.8	-158.4	-158.6	0	0	112.5	E425 A426 R431 V432 R433	E425-E429 PolarHBondContact O-N 3.27Å; A426-E429 PolarHBondContact O-N 3.12Å; E429-R431 PolarHBondContact O-N 3.13Å; E429-V432 PolarHBondContact O-N 3.33Å; E429-R433 WeakPolarHBondContact O-CG 2.95Å; E429-R433 PolarHBondContact O-N 3.16Å; E429-R433 IonicContact OE2-CZ 3.32Å; E429-R433 IonicContact OE2-NE 3.47Å; E429-R433 IonicContact OE2-NH2 3.88Å; E429-R433 PolarHBondContact OE2-NH2 3.15Å
430	S	81.9	Confident	77.1	Confident	65 Å²	65	102.5 Å²	102.5	46%	0.455	52%	0.522	S	S	.	.	H	α-helix	trans	-55.9	-42.5	177.3	-177	0	0	0	0	111.4	A426 E427 Q428 R433 L434	A426-S430 WeakPolarHBondContact O-CB 3.3Å; A426-S430 PolarHBondContact O-N 3.21Å; E427-S430 PolarHBondContact O-N 2.74Å; Q428-S430 PolarHBondContact O-N 3.24Å; S430-R433 PolarHBondContact O-N 2.98Å; S430-L434 WeakPolarHBondContact O-CB 3.39Å; S430-L434 PolarHBondContact O-N 2.57Å
431	R	72.3	Confident	77.6	Confident	124 Å²	124	102.7 Å²	102.7	47%	0.468	52%	0.521	S	S	.	.	H	α-helix	trans	-71.5	-31.2	180	-168.3	170.6	-177	-71.4	-20.4	113.3	E427 Q428 E429 Q435	E427-R431 WeakPolarHBondContact O-CB 3.24Å; E427-R431 PolarHBondContact O-N 2.89Å; Q428-R431 PolarHBondContact O-N 2.7Å; E429-R431 PolarHBondContact O-N 3.13Å; R431-Q435 WeakPolarHBondContact O-CB 3.13Å; R431-Q435 PolarHBondContact O-N 3.23Å
432	V	84.3	Confident	77.8	Confident	78 Å²	78	104.7 Å²	104.7	47%	0.473	53%	0.525	S	S	.	.	H	α-helix	trans	-66	-50.9	170.7	170.6	0	0	0	0	110.3	Q428 E429 L434 Q435 E436	Q428-V432 WeakPolarHBondContact O-CG2 3.3Å; Q428-V432 PolarHBondContact O-N 2.97Å; E429-V432 PolarHBondContact O-N 3.33Å; V432-L434 VanDerWaalsContact C-N 3.34Å; V432-L434 PolarHBondContact O-N 3.02Å; V432-Q435 CarbonylContact O-C 3.59Å; V432-Q435 WeakPolarHBondContact O-CA 3.41Å; V432-Q435 WeakPolarHBondContact O-CB 2.98Å; V432-Q435 PolarHBondContact O-N 3.04Å; V432-E436 HydrophobicContact CG1-CG 4.46Å; V432-E436 PolarHBondContact O-N 3.37Å
433	R	81.9	Confident	77.7	Confident	147 Å²	147	106.6 Å²	106.6	56%	0.555	53%	0.528	S	S	*	.	H	α-helix	trans	-58.3	-43.9	179.4	-63.6	177.2	-160	-170.6	7.6	112	E429 S430 Q435 E436 D437	E429-R433 WeakPolarHBondContact O-CG 2.95Å; E429-R433 PolarHBondContact O-N 3.16Å; E429-R433 IonicContact OE2-CZ 3.32Å; E429-R433 IonicContact OE2-NE 3.47Å; E429-R433 IonicContact OE2-NH2 3.88Å; E429-R433 PolarHBondContact OE2-NH2 3.15Å; S430-R433 PolarHBondContact O-N 2.98Å; R433-Q435 VanDerWaalsContact C-N 3.26Å; R433-Q435 PolarHBondContact O-N 3.32Å; R433-E436 WeakPolarHBondContact O-CB 3.47Å; R433-E436 PolarHBondContact O-N 3.42Å; R433-D437 PolarHBondContact O-N 2.94Å
434	L	75.9	Confident	77.7	Confident	99 Å²	99	104.1 Å²	104.1	52%	0.518	52%	0.518	S	S	.	.	H	α-helix	trans	-58.5	-35.1	172.8	-92.7	158.8	0	0	0	113.2	S430 V432 I438	S430-L434 WeakPolarHBondContact O-CB 3.39Å; S430-L434 PolarHBondContact O-N 2.57Å; V432-L434 VanDerWaalsContact C-N 3.34Å; V432-L434 PolarHBondContact O-N 3.02Å; L434-I438 WeakPolarHBondContact O-CB 3.4Å; L434-I438 WeakPolarHBondContact O-CD1 3.47Å; L434-I438 WeakPolarHBondContact O-CG1 3.48Å; L434-I438 PolarHBondContact O-N 2.87Å
435	Q	73.6	Confident	77.9	Confident	113 Å²	113	104.2 Å²	104.2	53%	0.528	52%	0.519	S	S	.	.	H	α-helix	trans	-77.7	-31.3	178.5	-164	168.9	-57	0	0	112.1	R431 V432 R433 T439	R431-Q435 WeakPolarHBondContact O-CB 3.13Å; R431-Q435 PolarHBondContact O-N 3.23Å; V432-Q435 CarbonylContact O-C 3.59Å; V432-Q435 WeakPolarHBondContact O-CA 3.41Å; V432-Q435 WeakPolarHBondContact O-CB 2.98Å; V432-Q435 PolarHBondContact O-N 3.04Å; R433-Q435 VanDerWaalsContact C-N 3.26Å; R433-Q435 PolarHBondContact O-N 3.32Å; Q435-T439 WeakPolarHBondContact O-CB 3.49Å; Q435-T439 PolarHBondContact O-N 3.09Å; Q435-T439 VanDerWaalsContact O-N 3.11Å; Q435-T439 PolarHBondContact O-OG1 2.87Å
436	E	82.8	Confident	77.7	Confident	123 Å²	123	102 Å²	102	58%	0.575	51%	0.511	S	S	*	.	H	α-helix	trans	-66.1	-47.4	168.8	-66.9	177.8	140.1	0	0	111.2	V432 R433 I438 T439 A440	V432-E436 HydrophobicContact CG1-CG 4.46Å; V432-E436 PolarHBondContact O-N 3.37Å; R433-E436 WeakPolarHBondContact O-CB 3.47Å; R433-E436 PolarHBondContact O-N 3.42Å; E436-I438 PolarHBondContact O-N 3.1Å; E436-T439 CarbonylContact O-C 3.5Å; E436-T439 WeakPolarHBondContact O-CA 3.27Å; E436-T439 WeakPolarHBondContact O-CB 3.43Å; E436-T439 PolarHBondContact O-N 3.33Å; E436-A440 PolarHBondContact O-N 2.94Å
437	D	76.2	Confident	77.6	Confident	104 Å²	104	103.6 Å²	103.6	56%	0.556	51%	0.514	S	S	*	.	H	α-helix	trans	-58.5	-44.5	175.6	-82.2	-27.3	0	0	0	112.2	R433 T439 A440 M441	R433-D437 PolarHBondContact O-N 2.94Å; D437-T439 VanDerWaalsContact C-N 3.26Å; D437-T439 PolarHBondContact O-N 2.6Å; D437-A440 PolarHBondContact O-N 3.42Å; D437-M441 VanDerWaalsContact O-CB 3.27Å; D437-M441 WeakPolarHBondContact O-CB 3.46Å; D437-M441 VanDerWaalsContact O-CG 3.29Å; D437-M441 WeakPolarHBondContact O-CG 3.41Å; D437-M441 PolarHBondContact O-N 2.97Å
438	I	74.2	Confident	77.8	Confident	114 Å²	114	102.3 Å²	102.3	59%	0.585	51%	0.507	S	S	*	.	H	α-helix	trans	-61.1	-37.2	174.5	-73.9	165.8	0	0	0	111.1	L434 E436 R442	L434-I438 WeakPolarHBondContact O-CB 3.4Å; L434-I438 WeakPolarHBondContact O-CD1 3.47Å; L434-I438 WeakPolarHBondContact O-CG1 3.48Å; L434-I438 PolarHBondContact O-N 2.87Å; E436-I438 PolarHBondContact O-N 3.1Å; I438-R442 WeakPolarHBondContact O-CB 3.44Å; I438-R442 PolarHBondContact O-N 3.27Å
439	T	80.6	Confident	77.8	Confident	70 Å²	70	102.6 Å²	102.6	43%	0.429	51%	0.51	S	S	.	.	H	α-helix	trans	-72.9	-41	178.6	-55.9	0	0	0	0	111.6	Q435 E436 D437 R442 N443	Q435-T439 WeakPolarHBondContact O-CB 3.49Å; Q435-T439 PolarHBondContact O-N 3.09Å; Q435-T439 VanDerWaalsContact O-N 3.11Å; Q435-T439 PolarHBondContact O-OG1 2.87Å; E436-T439 CarbonylContact O-C 3.5Å; E436-T439 WeakPolarHBondContact O-CA 3.27Å; E436-T439 WeakPolarHBondContact O-CB 3.43Å; E436-T439 PolarHBondContact O-N 3.33Å; D437-T439 VanDerWaalsContact C-N 3.26Å; D437-T439 PolarHBondContact O-N 2.6Å; T439-R442 PolarHBondContact O-N 3.36Å; T439-N443 WeakPolarHBondContact O-CB 3.4Å; T439-N443 PolarHBondContact O-N 3.24Å; T439-N443 PolarHBondContact O-ND2 2.56Å; T439-N443 PolarHBondContact O-OD1 2.84Å
440	A	84.3	Confident	77.7	Confident	58 Å²	58	100 Å²	100	48%	0.479	51%	0.505	S	S	.	.	H	α-helix	trans	-64.5	-42.7	174.1	0	0	0	0	0	111.9	E436 D437 N443 S444	E436-A440 PolarHBondContact O-N 2.94Å; D437-A440 PolarHBondContact O-N 3.42Å; A440-N443 PolarHBondContact O-N 3.35Å; A440-S444 WeakPolarHBondContact O-CB 3.25Å; A440-S444 PolarHBondContact O-N 2.99Å
441	M	74.9	Confident	77.5	Confident	118 Å²	118	100.3 Å²	100.3	58%	0.581	50%	0.504	S	S	*	.	H	α-helix	trans	-56.7	-51.1	171.1	-82.3	-90.3	-81.7	0	0	111.2	D437 N443 S444 Y445	D437-M441 VanDerWaalsContact O-CB 3.27Å; D437-M441 WeakPolarHBondContact O-CB 3.46Å; D437-M441 VanDerWaalsContact O-CG 3.29Å; D437-M441 WeakPolarHBondContact O-CG 3.41Å; D437-M441 PolarHBondContact O-N 2.97Å; M441-N443 PolarHBondContact O-N 2.9Å; M441-S444 WeakPolarHBondContact O-CB 3.46Å; M441-S444 PolarHBondContact O-N 3.33Å; M441-S444 VanDerWaalsContact O-N 3.17Å; M441-Y445 WeakPolarHBondContact O-CD2 3.07Å; M441-Y445 PolarHBondContact O-N 3.19Å
442	R	74	Confident	77.5	Confident	167 Å²	167	99.5 Å²	99.5	63%	0.63	51%	0.508	S	S	*	.	H	α-helix	trans	-56.7	-50.8	177.4	178.7	179.1	174.9	175.6	1.2	111.7	I438 T439 S444 Y445 D446	I438-R442 WeakPolarHBondContact O-CB 3.44Å; I438-R442 PolarHBondContact O-N 3.27Å; T439-R442 PolarHBondContact O-N 3.36Å; R442-S444 VanDerWaalsContact C-N 3.25Å; R442-S444 PolarHBondContact O-N 3.16Å; R442-Y445 WeakPolarHBondContact O-CA 3.46Å; R442-Y445 WeakPolarHBondContact O-CB 3.3Å; R442-Y445 PolarHBondContact O-N 3.25Å; R442-D446 IonicContact NE-OD2 3.04Å; R442-D446 PolarHBondContact O-N 2.91Å
443	N	80.6	Confident	77	Confident	94 Å²	94	102.1 Å²	102.1	50%	0.503	52%	0.515	S	S	.	.	H	α-helix	trans	-59.7	-37.4	178.4	-66.7	-13.9	0	0	0	111.7	T439 A440 M441 D446 V447	T439-N443 WeakPolarHBondContact O-CB 3.4Å; T439-N443 PolarHBondContact O-N 3.24Å; T439-N443 PolarHBondContact O-ND2 2.56Å; T439-N443 PolarHBondContact O-OD1 2.84Å; A440-N443 PolarHBondContact O-N 3.35Å; M441-N443 PolarHBondContact O-N 2.9Å; N443-D446 PolarHBondContact O-N 3.21Å; N443-V447 WeakPolarHBondContact O-CB 3.47Å; N443-V447 WeakPolarHBondContact O-CG2 3.37Å; N443-V447 PolarHBondContact O-N 2.98Å
444	S	77.5	Confident	76.9	Confident	51 Å²	51	100.1 Å²	100.1	36%	0.357	51%	0.513	S	S	.	.	H	α-helix	trans	-64.6	-38.6	173.5	-166.5	0	0	0	0	112.8	A440 M441 R442 K448	A440-S444 WeakPolarHBondContact O-CB 3.25Å; A440-S444 PolarHBondContact O-N 2.99Å; M441-S444 WeakPolarHBondContact O-CB 3.46Å; M441-S444 PolarHBondContact O-N 3.33Å; M441-S444 VanDerWaalsContact O-N 3.17Å; R442-S444 VanDerWaalsContact C-N 3.25Å; R442-S444 PolarHBondContact O-N 3.16Å; S444-K448 VanDerWaalsContact O-CD 3.27Å; S444-K448 WeakPolarHBondContact O-CD 3.43Å; S444-K448 WeakPolarHBondContact O-CG 3.23Å; S444-K448 PolarHBondContact O-N 3.25Å; S444-K448 VanDerWaalsContact O-N 3.12Å; S444-K448 PolarHBondContact OG-NZ 3.03Å
445	Y	73.1	Confident	76.8	Confident	144 Å²	144	99 Å²	99	57%	0.565	51%	0.507	S	S	*	.	H	α-helix	trans	-69.1	-43.1	174.6	-90.6	-79.4	0	0	0	112.4	M441 R442 V447 K448 L449	M441-Y445 WeakPolarHBondContact O-CD2 3.07Å; M441-Y445 PolarHBondContact O-N 3.19Å; R442-Y445 WeakPolarHBondContact O-CA 3.46Å; R442-Y445 WeakPolarHBondContact O-CB 3.3Å; R442-Y445 PolarHBondContact O-N 3.25Å; Y445-V447 PolarHBondContact O-N 2.94Å; Y445-K448 PolarHBondContact O-N 3Å; Y445-L449 WeakPolarHBondContact O-CB 3.46Å; Y445-L449 PolarHBondContact O-N 2.95Å
446	D	74.8	Confident	76.7	Confident	78 Å²	78	98 Å²	98	42%	0.417	51%	0.505	S	S	.	.	H	α-helix	trans	-65.1	-38.4	179.5	-71	-27.8	0	0	0	111.3	R442 N443 L449 S450	R442-D446 IonicContact NE-OD2 3.04Å; R442-D446 PolarHBondContact O-N 2.91Å; N443-D446 PolarHBondContact O-N 3.21Å; D446-L449 PolarHBondContact O-N 3.18Å; D446-S450 PolarHBondContact O-N 3Å; D446-S450 PolarHBondContact O-OG 3.14Å
447	V	82.6	Confident	76.3	Confident	91 Å²	91	99.8 Å²	99.8	55%	0.552	51%	0.506	S	S	*	.	H	α-helix	trans	-67	-37.5	172	170.9	0	0	0	0	112.6	N443 Y445 L449 S450 T451	N443-V447 WeakPolarHBondContact O-CB 3.47Å; N443-V447 WeakPolarHBondContact O-CG2 3.37Å; N443-V447 PolarHBondContact O-N 2.98Å; Y445-V447 PolarHBondContact O-N 2.94Å; V447-L449 VanDerWaalsContact C-N 3.35Å; V447-S450 PolarHBondContact O-OG 3.01Å; V447-T451 WeakPolarHBondContact O-CB 3.46Å; V447-T451 PolarHBondContact O-N 3.23Å; V447-T451 PolarHBondContact O-OG1 3.02Å
448	K	78.3	Confident	76.3	Confident	112 Å²	112	99.4 Å²	99.4	49%	0.487	50%	0.5	S	S	.	.	H	α-helix	trans	-66.6	-37.9	173.8	-73.7	160.6	-175.6	150	0	111.5	S444 Y445 L452	S444-K448 VanDerWaalsContact O-CD 3.27Å; S444-K448 WeakPolarHBondContact O-CD 3.43Å; S444-K448 WeakPolarHBondContact O-CG 3.23Å; S444-K448 PolarHBondContact O-N 3.25Å; S444-K448 VanDerWaalsContact O-N 3.12Å; S444-K448 PolarHBondContact OG-NZ 3.03Å; Y445-K448 PolarHBondContact O-N 3Å; K448-L452 WeakPolarHBondContact O-CB 3.23Å; K448-L452 WeakPolarHBondContact O-CG 3.37Å; K448-L452 PolarHBondContact O-N 2.98Å
449	L	71.2	Confident	75.9	Confident	90 Å²	90	100 Å²	100	47%	0.471	50%	0.5	S	S	.	.	H	α-helix	trans	-64.6	-47.1	175.5	-90.9	163.1	0	0	0	112.2	Y445 D446 V447 L452 Q453	Y445-L449 WeakPolarHBondContact O-CB 3.46Å; Y445-L449 PolarHBondContact O-N 2.95Å; D446-L449 PolarHBondContact O-N 3.18Å; V447-L449 VanDerWaalsContact C-N 3.35Å; L449-L452 PolarHBondContact O-N 3.02Å; L449-Q453 WeakPolarHBondContact O-CB 3.02Å; L449-Q453 VanDerWaalsContact O-CG 3.31Å; L449-Q453 WeakPolarHBondContact O-CG 3.41Å; L449-Q453 PolarHBondContact O-N 3.07Å
450	S	75.8	Confident	75.2	Confident	60 Å²	60	104 Å²	104	42%	0.42	51%	0.512	S	S	.	.	H	α-helix	trans	-63.8	-42.3	176.5	64.2	0	0	0	0	112	D446 V447 L452 Q453 E454	D446-S450 PolarHBondContact O-N 3Å; D446-S450 PolarHBondContact O-OG 3.14Å; V447-S450 PolarHBondContact O-OG 3.01Å; S450-L452 VanDerWaalsContact C-N 3.35Å; S450-L452 PolarHBondContact O-N 2.79Å; S450-Q453 PolarHBondContact O-N 3.19Å; S450-E454 WeakPolarHBondContact O-CB 2.9Å; S450-E454 PolarHBondContact O-N 2.77Å
451	T	78.1	Confident	74.2	Confident	71 Å²	71	105.8 Å²	105.8	44%	0.436	51%	0.51	S	S	.	.	H	α-helix	trans	-60.3	-42.6	175.5	-53.4	0	0	0	0	111.8	V447 E454 N455	V447-T451 WeakPolarHBondContact O-CB 3.46Å; V447-T451 PolarHBondContact O-N 3.23Å; V447-T451 PolarHBondContact O-OG1 3.02Å; T451-E454 PolarHBondContact O-N 3.08Å; T451-N455 WeakPolarHBondContact O-CB 3.42Å; T451-N455 PolarHBondContact O-N 2.73Å; T451-N455 PolarHBondContact O-ND2 3.01Å
452	L	72.2	Confident	73.4	Confident	107 Å²	107	105.1 Å²	105.1	56%	0.56	51%	0.513	S	S	*	.	H	α-helix	trans	-65.8	-40.8	175.3	-79.3	165.7	0	0	0	112.4	K448 L449 S450 N455 L456	K448-L452 WeakPolarHBondContact O-CB 3.23Å; K448-L452 WeakPolarHBondContact O-CG 3.37Å; K448-L452 PolarHBondContact O-N 2.98Å; L449-L452 PolarHBondContact O-N 3.02Å; S450-L452 VanDerWaalsContact C-N 3.35Å; S450-L452 PolarHBondContact O-N 2.79Å; L452-N455 PolarHBondContact O-N 3.21Å; L452-L456 WeakPolarHBondContact O-CB 3.47Å; L452-L456 PolarHBondContact O-N 3.11Å
453	Q	74	Confident	72.2	Confident	133 Å²	133	100.5 Å²	100.5	62%	0.621	52%	0.517	S	S	*	.	H	α-helix	trans	-65.1	-40.6	176.2	-74.3	174.4	-4.9	0	0	112.1	L449 S450 L456 R457	L449-Q453 WeakPolarHBondContact O-CB 3.02Å; L449-Q453 VanDerWaalsContact O-CG 3.31Å; L449-Q453 WeakPolarHBondContact O-CG 3.41Å; L449-Q453 PolarHBondContact O-N 3.07Å; S450-Q453 PolarHBondContact O-N 3.19Å; Q453-L456 PolarHBondContact O-N 2.8Å; Q453-R457 WeakPolarHBondContact O-CB 3.29Å; Q453-R457 PolarHBondContact O-N 3.44Å
454	E	80.1	Confident	70.7	Confident	106 Å²	106	99.9 Å²	99.9	50%	0.495	53%	0.525	S	S	.	.	H	α-helix	trans	-71.4	-34.3	178.1	-160.6	-179.4	131	0	0	111.9	S450 T451 R457 K458	S450-E454 WeakPolarHBondContact O-CB 2.9Å; S450-E454 PolarHBondContact O-N 2.77Å; T451-E454 PolarHBondContact O-N 3.08Å; E454-R457 WeakPolarHBondContact O-CB 3.17Å; E454-R457 PolarHBondContact O-N 3.46Å; E454-K458 WeakPolarHBondContact O-CG 3.48Å; E454-K458 PolarHBondContact O-N 3.36Å; E454-K458 VanDerWaalsContact OE1-CE 3.23Å; E454-K458 WeakPolarHBondContact OE1-CE 3.33Å; E454-K458 IonicContact OE1-NZ 3.74Å; E454-K458 PolarHBondContact OE1-NZ 3.17Å
455	N	74.8	Confident	69.1	Low	76 Å²	76	104 Å²	104	41%	0.406	54%	0.542	S	S	.	.	H	α-helix	trans	-66.2	-46.8	170.9	-71.9	-12.1	0	0	0	111.6	T451 L452 R457 K458 E459	T451-N455 WeakPolarHBondContact O-CB 3.42Å; T451-N455 PolarHBondContact O-N 2.73Å; T451-N455 PolarHBondContact O-ND2 3.01Å; L452-N455 PolarHBondContact O-N 3.21Å; N455-R457 PolarHBondContact O-N 3.47Å; N455-K458 PolarHBondContact O-N 3.46Å; N455-K458 VanDerWaalsContact O-N 3.12Å; N455-E459 WeakPolarHBondContact O-CG 3.41Å; N455-E459 PolarHBondContact O-N 3.41Å
456	L	71.4	Confident	67.4	Low	92 Å²	92	103.2 Å²	103.2	48%	0.482	56%	0.556	S	S	.	*	H	α-helix	trans	-59	-30.3	173.5	-117.1	85.8	0	0	0	112.7	L452 Q453 K460	L452-L456 WeakPolarHBondContact O-CB 3.47Å; L452-L456 PolarHBondContact O-N 3.11Å; Q453-L456 PolarHBondContact O-N 2.8Å; L456-K460 WeakPolarHBondContact O-CG 3.47Å; L456-K460 PolarHBondContact O-N 3.16Å
457	R	74.4	Confident	65.9	Low	159 Å²	159	105.6 Å²	105.6	60%	0.6	58%	0.576	S	S	*	*	H	α-helix	trans	-72.5	-47.6	174.9	-179.6	176.5	176.6	166	2.4	111	Q453 E454 N455 E459 K460 E461	Q453-R457 WeakPolarHBondContact O-CB 3.29Å; Q453-R457 PolarHBondContact O-N 3.44Å; E454-R457 WeakPolarHBondContact O-CB 3.17Å; E454-R457 PolarHBondContact O-N 3.46Å; N455-R457 PolarHBondContact O-N 3.47Å; R457-E459 VanDerWaalsContact C-N 3.33Å; R457-E459 PolarHBondContact O-N 3.49Å; R457-K460 WeakPolarHBondContact O-CB 3.42Å; R457-K460 PolarHBondContact O-N 3.13Å; R457-K460 VanDerWaalsContact O-N 3.12Å; R457-E461 HydrophobicContact CG-CG 4.5Å; R457-E461 WeakPolarHBondContact CG-OE1 3.46Å; R457-E461 IonicContact CZ-OE1 3.97Å; R457-E461 IonicContact NE-OE1 3.49Å; R457-E461 PolarHBondContact NE-OE1 2.95Å; R457-E461 IonicContact NH2-OE1 3.99Å; R457-E461 PolarHBondContact NH2-OE1 2.75Å; R457-E461 WeakPolarHBondContact O-CG 3.41Å; R457-E461 PolarHBondContact O-N 3.04Å
458	K	74.9	Confident	64.1	Low	96 Å²	96	105 Å²	105	42%	0.417	59%	0.589	S	S	.	*	H	α-helix	trans	-60.7	-39.4	175.7	-73.3	165.4	-175.1	164.3	0	112	E454 N455 K460 E461 T462	E454-K458 WeakPolarHBondContact O-CG 3.48Å; E454-K458 PolarHBondContact O-N 3.36Å; E454-K458 VanDerWaalsContact OE1-CE 3.23Å; E454-K458 WeakPolarHBondContact OE1-CE 3.33Å; E454-K458 IonicContact OE1-NZ 3.74Å; E454-K458 PolarHBondContact OE1-NZ 3.17Å; N455-K458 PolarHBondContact O-N 3.46Å; N455-K458 VanDerWaalsContact O-N 3.12Å; K458-K460 VanDerWaalsContact C-N 3.33Å; K458-K460 PolarHBondContact O-N 3.38Å; K458-E461 PolarHBondContact O-N 2.71Å; K458-T462 WeakPolarHBondContact O-CG2 3.48Å; K458-T462 PolarHBondContact O-N 3.04Å; K458-T462 PolarHBondContact O-OG1 3.18Å; K458-T462 VanDerWaalsContact O-OG1 3.05Å
459	E	67.5	Low	61.8	Low	128 Å²	128	103.8 Å²	103.8	60%	0.598	60%	0.599	S	S	*	*	H	α-helix	trans	-62.1	-36.9	173.3	-73.5	177.9	157.6	0	0	112.9	N455 R457 T462 G463	N455-E459 WeakPolarHBondContact O-CG 3.41Å; N455-E459 PolarHBondContact O-N 3.41Å; R457-E459 VanDerWaalsContact C-N 3.33Å; R457-E459 PolarHBondContact O-N 3.49Å; E459-T462 PolarHBondContact O-OG1 3.03Å; E459-G463 PolarHBondContact O-N 2.79Å
460	K	64.2	Low	60.3	Low	153 Å²	153	106.1 Å²	106.1	67%	0.665	62%	0.617	S	S	*	*	H	α-helix	trans	-72.6	-34.7	174	-73.5	172	-178.6	179.3	0	112.7	L456 R457 K458 A464	L456-K460 WeakPolarHBondContact O-CG 3.47Å; L456-K460 PolarHBondContact O-N 3.16Å; R457-K460 WeakPolarHBondContact O-CB 3.42Å; R457-K460 PolarHBondContact O-N 3.13Å; R457-K460 VanDerWaalsContact O-N 3.12Å; K458-K460 VanDerWaalsContact C-N 3.33Å; K458-K460 PolarHBondContact O-N 3.38Å; K460-A464 PolarHBondContact O-N 3.37Å
461	E	62.9	Low	58.1	Low	96 Å²	96	114.4 Å²	114.4	45%	0.449	64%	0.639	S	S	.	*	H	α-helix	trans	-74.9	-35.1	178.5	-71.5	168.9	178.1	0	0	111.4	R457 K458	R457-E461 HydrophobicContact CG-CG 4.5Å; R457-E461 WeakPolarHBondContact CG-OE1 3.46Å; R457-E461 IonicContact CZ-OE1 3.97Å; R457-E461 IonicContact NE-OE1 3.49Å; R457-E461 PolarHBondContact NE-OE1 2.95Å; R457-E461 IonicContact NH2-OE1 3.99Å; R457-E461 PolarHBondContact NH2-OE1 2.75Å; R457-E461 WeakPolarHBondContact O-CG 3.41Å; R457-E461 PolarHBondContact O-N 3.04Å; K458-E461 PolarHBondContact O-N 2.71Å
462	T	58.2	Low	55.8	Low	104 Å²	104	119.3 Å²	119.3	64%	0.638	66%	0.657	S	S	*	*	H	α-helix	trans	-76.1	-36.5	171.1	56.1	0	0	0	0	112.9	K458 E459 A464 L465	K458-T462 WeakPolarHBondContact O-CG2 3.48Å; K458-T462 PolarHBondContact O-N 3.04Å; K458-T462 PolarHBondContact O-OG1 3.18Å; K458-T462 VanDerWaalsContact O-OG1 3.05Å; E459-T462 PolarHBondContact O-OG1 3.03Å; T462-A464 PolarHBondContact O-N 3.18Å; T462-A464 VanDerWaalsContact O-N 3.11Å; T462-L465 PolarHBondContact O-N 3.44Å
463	G	50.6	Low	53.9	Low	70 Å²	70	120.4 Å²	120.4	72%	0.722	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-11.7	175	0	0	0	0	0	114.9	E459	E459-G463 PolarHBondContact O-N 2.79Å
464	A	47.4	Very low	51.9	Low	80 Å²	80	121 Å²	121	66%	0.661	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	-2.8	177.5	0	0	0	0	0	114.5	K460 T462	K460-A464 PolarHBondContact O-N 3.37Å; T462-A464 PolarHBondContact O-N 3.18Å; T462-A464 VanDerWaalsContact O-N 3.11Å
465	L	44.5	Very low	49.5	Very low	139 Å²	139	121.1 Å²	121.1	73%	0.728	70%	0.697	S	S	*	*			trans	-124.5	57.5	-166.1	-84.3	162.8	0	0	0	114.4	T462	T462-L465 PolarHBondContact O-N 3.44Å
466	C	37.8	Very low	47.3	Very low	126 Å²	126	124 Å²	124	85%	0.851	72%	0.721	S	S	*	*			trans	-137.8	102	163.7	-84.9	0	0	0	0	112.3
467	P	42.7	Very low	45.5	Very low	128 Å²	128	129 Å²	129	83%	0.831	74%	0.74	S	S	*	*			trans	-85.8	116.1	172.8	32.3	-30.7	0	0	0	111.8
468	G	44.1	Very low	44.2	Very low	80 Å²	80	126.1 Å²	126.1	83%	0.825	74%	0.741	S	S	*	*			trans	78.2	97.8	158.2	0	0	0	0	0	117.6
469	A	31.9	Very low	42.2	Very low	85 Å²	85	131.2 Å²	131.2	70%	0.702	76%	0.759	S	S	*	*			trans	-146.9	105.5	157	0	0	0	0	0	110.3
470	T	38.8	Very low	40.3	Very low	139 Å²	139	133.8 Å²	133.8	85%	0.853	76%	0.764	S	S	*	*			trans	-75.2	129.3	170.5	45.9	0	0	0	0	110.4
471	W	29.8	Very low	38.4	Very low	234 Å²	234	135.8 Å²	135.8	89%	0.886	77%	0.767	S	S	*	*			trans	-135.4	123.5	170.3	-79.6	94.8	0	0	0	111.1
472	E	29.2	Very low	36.8	Very low	174 Å²	174	136.7 Å²	136.7	81%	0.813	78%	0.779	S	S	*	*			trans	-82.7	148.3	175.8	-61.5	-177.5	126.8	0	0	111.1	T474	E472-T474 PolarHBondContact O-N 3.41Å
473	P	32.1	Very low	35.6	Very low	130 Å²	130	141 Å²	141	84%	0.844	79%	0.789	S	S	*	*			trans	-86.2	104.7	178	32.8	-32.2	0	0	0	111.7
474	T	31.6	Very low	34.5	Very low	145 Å²	145	141 Å²	141	89%	0.89	79%	0.789	S	S	*	*			trans	-83.6	137.4	168.5	44.5	0	0	0	0	111.8	E472	E472-T474 PolarHBondContact O-N 3.41Å
475	S	30.8	Very low	34.3	Very low	110 Å²	110	143 Å²	143	77%	0.769	80%	0.795	S	S	*	*			trans	-97.5	137.4	-164.5	58.3	0	0	0	0	114.5
476	C	29.4	Very low	33.5	Very low	136 Å²	136	142.1 Å²	142.1	92%	0.919	80%	0.799	S	S	*	*			trans	-130.1	97.6	155.2	-83.4	0	0	0	0	111.3
477	F	32.4	Very low	33	Very low	198 Å²	198	144.5 Å²	144.5	87%	0.868	80%	0.8	S	S	*	*			trans	-134.6	146.2	163.8	-110.2	-68.2	0	0	0	106.3
478	P	48.3	Very low	32.4	Very low	98 Å²	98	145.1 Å²	145.1	64%	0.636	80%	0.801	S	S	*	*				-147.7	-177.8	87	43.9	-27.1	0	0	0	113
479	Y	31.6	Very low	31.6	Very low	202 Å²	202	144.2 Å²	144.2	79%	0.792	79%	0.792	S	S	*	*			cis	-150.7	162.9	18.8	-120	-54.9	0	0	0	114.5
480	R	27.5	Very low	31.5	Very low	183 Å²	183	146.4 Å²	146.4	69%	0.691	80%	0.802	S	S	*	*			trans	74.3	142.6	154.9	-75.2	168.6	164.3	171.4	-3.7	119.3
481	W	25.8	Very low	31	Very low	195 Å²	195	143.2 Å²	143.2	74%	0.739	80%	0.796	S	S	*	*			cis	-131	164.1	-13.3	-58.2	96.8	0	0	0	107.9
482	V	28.5	Very low	30.9	Very low	114 Å²	114	139.7 Å²	139.7	69%	0.691	79%	0.794	S	S	*	*			cis	72.9	117.7	30.7	179.3	0	0	0	0	114
483	K	32	Very low	30.9	Very low	195 Å²	195	135.5 Å²	135.5	85%	0.848	78%	0.784	S	S	*	*			cis	-155.5	145.1	-8.9	-107.4	174	-175.5	179.1	0	106.8
484	G	28.6	Very low	30.7	Very low	71 Å²	71	137.2 Å²	137.2	73%	0.732	78%	0.78	S	S	*	*				95.2	170.1	82.3	0	0	0	0	0	111.6
485	P	42.7	Very low	30.6	Very low	120 Å²	120	137.1 Å²	137.1	78%	0.779	77%	0.774	S	S	*	*			cis	-115.2	152.4	-11.7	39.2	-25	0	0	0	113.2
486	C	27	Very low	30.5	Very low	121 Å²	121	141.4 Å²	141.4	82%	0.818	78%	0.775	S	S	*	*				76.8	120.4	68.2	-52.6	0	0	0	0	118.1
487	M	28.1	Very low	30.4	Very low	177 Å²	177	142.3 Å²	142.3	87%	0.872	77%	0.77	S	S	*	*			trans	173.8	120.2	145.3	-86.8	-53.6	-172	0	0	105.3
488	V	30.5	Very low	30.3	Very low	140 Å²	140	139.6 Å²	139.6	85%	0.848	77%	0.765	S	S	*	*			cis	66.8	119.4	48.8	-171.2	0	0	0	0	112.5
489	G	28.1	Very low	30.3	Very low	62 Å²	62	139.9 Å²	139.9	64%	0.639	77%	0.766	S	S	*	*			cis	166.9	-171.5	-7.3	0	0	0	0	0	114.1
490	S	29.3	Very low	30.3	Very low	131 Å²	131	134.4 Å²	134.4	92%	0.916	76%	0.763	S	S	*	*			trans	79.4	136.2	162.7	76.9	0	0	0	0	122.4
491	G	27.1	Very low	30.4	Very low	71 Å²	71	136.4 Å²	136.4	73%	0.732	77%	0.771	S	S	*	*			trans	81.8	154.6	154.4	0	0	0	0	0	119.9
492	L	28.7	Very low	30.6	Very low	160 Å²	160	135.4 Å²	135.4	84%	0.838	77%	0.774	S	S	*	*			cis	-169.9	134.2	-26.6	-129.8	165.9	0	0	0	111.6
493	S	27.8	Very low	31	Very low	87 Å²	87	138 Å²	138	61%	0.608	78%	0.782	S	S	*	*			trans	66.2	155.8	152.6	62.8	0	0	0	0	123.4
494	H	29.3	Very low	31.4	Very low	165 Å²	165	134.4 Å²	134.4	76%	0.764	78%	0.779	S	S	*	*			trans	68.3	128.6	171	-57	-72.5	0	0	0	118.3
495	L	29.3	Very low	31.7	Very low	143 Å²	143	142.3 Å²	142.3	75%	0.749	79%	0.787	S	S	*	*			cis	85.4	121.7	21.7	-67.7	168.7	0	0	0	117.9
496	Y	28.5	Very low	31.3	Very low	201 Å²	201	144.8 Å²	144.8	79%	0.788	79%	0.793	S	S	*	*			trans	54.9	118.9	162.4	-79.1	-88.2	0	0	0	119.8
497	N	28.2	Very low	32.2	Very low	155 Å²	155	144.6 Å²	144.6	83%	0.829	79%	0.789	S	S	*	*				-172.8	161.4	93.3	-105.9	-30	0	0	0	116.6
498	N	29.7	Very low	32.6	Very low	141 Å²	141	141 Å²	141	75%	0.754	78%	0.782	S	S	*	*			trans	-123.4	179.8	161.9	-146.5	1.4	0	0	0	105
499	P	48.4	Very low	33.1	Very low	103 Å²	103	141 Å²	141	67%	0.669	78%	0.782	S	S	*	*			cis	-136.8	-176.6	-12.1	43.3	-25.7	0	0	0	115.4
500	A	30.3	Very low	33.5	Very low	87 Å²	87	143.7 Å²	143.7	72%	0.719	79%	0.79	S	S	*	*			trans	57.7	128.7	143.2	0	0	0	0	0	123.4
501	R	30.6	Very low	33.9	Very low	226 Å²	226	152.6 Å²	152.6	85%	0.853	80%	0.804	S	S	*	*				-175.5	123	128.3	-100.3	167	-169.4	-146.5	1	110.1
502	Q	30.8	Very low	34.2	Very low	174 Å²	174	156.7 Å²	156.7	81%	0.813	81%	0.807	S	S	*	*				70.5	124.1	94.4	-80.3	-173.4	-32.1	0	0	116.5
503	I	35.4	Very low	34.5	Very low	167 Å²	167	156.5 Å²	156.5	86%	0.856	81%	0.806	S	S	*	*			trans	-98	140.7	172.8	-59.7	163.5	0	0	0	109
504	P	40.5	Very low	34.9	Very low	120 Å²	120	160.4 Å²	160.4	78%	0.779	82%	0.817	S	S	*	*			trans	-132.4	167	138.4	28.5	-11.9	0	0	0	114.1
505	R	34.6	Very low	35.2	Very low	238 Å²	238	160.1 Å²	160.1	90%	0.898	82%	0.82	S	S	*	*			trans	-74.4	160.1	-173.1	-52.2	169.7	-178	179.7	-1.7	113
506	L	34.9	Very low	35.6	Very low	172 Å²	172	161.2 Å²	161.2	90%	0.901	82%	0.824	S	S	*	*			trans	-131.2	156	151.9	-82.3	176	0	0	0	111
507	P	45.9	Very low	36.1	Very low	116 Å²	116	158.5 Å²	158.5	75%	0.753	83%	0.827	S	S	*	*			trans	-105	178.6	-167.3	41.3	-36.2	0	0	0	114.7
508	S	37.4	Very low	36.6	Very low	103 Å²	103	158.8 Å²	158.8	72%	0.72	83%	0.827	S	S	*	*			trans	-67.3	147.5	169.5	53.8	0	0	0	0	114.7
509	T	41.3	Very low	37.2	Very low	138 Å²	138	160.2 Å²	160.2	85%	0.847	83%	0.832	S	S	*	*				-166.2	155.9	123.3	20.9	0	0	0	0	114.1
510	C	35.9	Very low	36.2	Very low	120 Å²	120	164.9 Å²	164.9	81%	0.811	85%	0.846	S	S	*	*			trans	-22.8	139.2	170.9	-46	0	0	0	0	119.7
511	R	36.9	Very low	36.8	Very low	318 Å²	318	172 Å²	172	100%	1.2	86%	0.857	S	S	*	*				-148.6	0	95.5	-107	-174.9	-174.2	-156.2	1.1	111.7

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