A0A087X3B8_POEFO Loading...

La-related protein 7

AlphaFold DB , UniProt , Accession A0A087X3B8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 558 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.7	Very low	40.2	Very low	230 Å²	230	160.7 Å²	160.7	100%	1.133	86%	0.857	S	S	*	*				0	131.8	0	-72.6	173.7	175.1	0	0	107.1
2	M	37.9	Very low	40.3	Very low	162 Å²	162	151.5 Å²	151.5	80%	0.798	83%	0.828	S	S	*	*			cis	-140.1	164.6	-6.5	-66.7	-154.1	-174.9	0	0	111.3
3	K	39.6	Very low	40.9	Very low	181 Å²	181	146.3 Å²	146.3	79%	0.787	82%	0.818	S	S	*	*			trans	11	121.9	143.3	-74.6	-179	178	-176	0	117.9
4	T	46.5	Very low	41.8	Very low	120 Å²	120	145.4 Å²	145.4	74%	0.736	82%	0.818	S	S	*	*				53	129.4	93	66.2	0	0	0	0	112.9
5	E	39.6	Very low	42.9	Very low	192 Å²	192	148.5 Å²	148.5	90%	0.897	82%	0.819	S	S	*	*				-133.8	172	64.2	-78.4	157.8	160.6	0	0	115.8
6	K	38.4	Very low	43.7	Very low	201 Å²	201	144.1 Å²	144.1	87%	0.874	80%	0.799	S	S	*	*			trans	-144.8	111.5	171.6	-178.9	179.5	-178.8	179.7	0	108.1
7	E	36.9	Very low	44.8	Very low	198 Å²	198	139.6 Å²	139.6	93%	0.925	78%	0.781	S	S	*	*			trans	-62.5	140.5	-179	-63.8	-177.5	127.9	0	0	111.6
8	A	42.1	Very low	46.1	Very low	97 Å²	97	138.3 Å²	138.3	80%	0.802	77%	0.772	S	S	*	*			trans	-124.7	111.1	173.4	0	0	0	0	0	108.4	D10	A8-D10 PolarHBondContact O-N 3.42Å
9	G	38.8	Very low	47.1	Very low	81 Å²	81	135.2 Å²	135.2	84%	0.835	76%	0.76	S	S	*	*			trans	-70.3	121.7	171.5	0	0	0	0	0	110.3	D11	G9-D11 PolarHBondContact O-N 3.21Å; G9-D11 VanDerWaalsContact O-N 3.17Å
10	D	39.1	Very low	48.1	Very low	156 Å²	156	130.5 Å²	130.5	83%	0.834	74%	0.737	S	S	*	*			trans	-76.8	95.1	176.7	-178.2	37	0	0	0	110.8	A8 G12	A8-D10 PolarHBondContact O-N 3.42Å; D10-G12 PolarHBondContact O-N 3.17Å
11	D	41.9	Very low	49.5	Very low	150 Å²	150	128 Å²	128	80%	0.802	72%	0.718	S	S	*	*			trans	-86.2	83.9	173.2	-165	-1.2	0	0	0	109.6	G9 A13	G9-D11 PolarHBondContact O-N 3.21Å; G9-D11 VanDerWaalsContact O-N 3.17Å; D11-A13 PolarHBondContact O-N 2.74Å
12	G	41.3	Very low	51.2	Low	50 Å²	50	121.6 Å²	121.6	52%	0.515	69%	0.685	S	S	.	*			trans	-66.1	60.4	-171.1	0	0	0	0	0	115.8	D10 T14	D10-G12 PolarHBondContact O-N 3.17Å; G12-T14 VanDerWaalsContact C-N 3.28Å; G12-T14 PolarHBondContact O-N 3.31Å; G12-T14 PolarHBondContact O-OG1 2.75Å
13	A	47.3	Very low	53.2	Low	84 Å²	84	117 Å²	117	69%	0.694	67%	0.666	S	S	*	*			trans	-66.1	76.3	-177.5	0	0	0	0	0	113.1	D11 K15	D11-A13 PolarHBondContact O-N 2.74Å; A13-K15 PolarHBondContact O-N 2.97Å
14	T	53.5	Low	55.2	Low	133 Å²	133	114.1 Å²	114.1	82%	0.816	66%	0.655	S	S	*	*			trans	-58.4	103.5	-178.8	-62.7	0	0	0	0	110.9	G12 P16	G12-T14 VanDerWaalsContact C-N 3.28Å; G12-T14 PolarHBondContact O-N 3.31Å; G12-T14 PolarHBondContact O-OG1 2.75Å; T14-P16 WeakPolarHBondContact O-CD 3.38Å
15	K	59.3	Low	57	Low	192 Å²	192	115.1 Å²	115.1	84%	0.835	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-63.4	119.6	-175.2	-73.1	175.2	-180	167.9	0	110.8	A13 S17	A13-K15 PolarHBondContact O-N 2.97Å; K15-S17 PolarHBondContact O-N 3.38Å
16	P	55	Low	59.2	Low	78 Å²	78	110.9 Å²	110.9	51%	0.506	63%	0.628	S	S	.	*	P	Polyproline II helix	trans	-63.4	132.2	-177.6	19.7	-29.2	0	0	0	112.1	T14 K21	T14-P16 WeakPolarHBondContact O-CD 3.38Å; P16-K21 WeakPolarHBondContact O-CE 3.47Å; P16-K21 PolarHBondContact O-NZ 3.45Å
17	S	63.4	Low	61.4	Low	69 Å²	69	107.2 Å²	107.2	48%	0.483	61%	0.612	S	S	.	*	P	Polyproline II helix	trans	-61.3	149.8	-177.6	61.8	0	0	0	0	112.4	K15 S19 S20 K21	K15-S17 PolarHBondContact O-N 3.38Å; S17-S19 VanDerWaalsContact C-N 3.28Å; S17-S19 PolarHBondContact O-N 2.79Å; S17-S19 PolarHBondContact OG-OG 3.03Å; S17-S20 WeakPolarHBondContact O-CB 3.13Å; S17-S20 PolarHBondContact O-N 3.18Å; S17-S20 PolarHBondContact O-OG 2.99Å; S17-K21 PolarHBondContact O-N 2.61Å
18	D	68.1	Low	63.8	Low	115 Å²	115	107.7 Å²	107.7	62%	0.615	61%	0.606	S	S	*	*	H	α-helix	trans	-67.3	-26.8	-171.3	-112.4	15.7	0	0	0	114.3	K21 E22	D18-K21 WeakPolarHBondContact OD1-CD 3.2Å; D18-K21 IonicContact OD1-NZ 3.78Å; D18-K21 PolarHBondContact OD1-NZ 3.5Å; D18-K21 VanDerWaalsContact OD1-NZ 3.11Å; D18-E22 WeakPolarHBondContact O-CB 3.48Å; D18-E22 PolarHBondContact O-N 3.33Å
19	S	63.7	Low	66.2	Low	80 Å²	80	106.8 Å²	106.8	56%	0.559	59%	0.593	S	S	*	*	H	α-helix	trans	-62	-43.4	170	55.8	0	0	0	0	112.2	S17 E22 T23	S17-S19 VanDerWaalsContact C-N 3.28Å; S17-S19 PolarHBondContact O-N 2.79Å; S17-S19 PolarHBondContact OG-OG 3.03Å; S19-E22 PolarHBondContact O-N 3.11Å; S19-T23 WeakPolarHBondContact O-CG2 3.07Å; S19-T23 PolarHBondContact O-N 3.06Å
20	S	68.3	Low	68.7	Low	41 Å²	41	112.2 Å²	112.2	29%	0.287	59%	0.589	S	S	.	*	H	α-helix	trans	-59.9	-50.5	177.6	71.5	0	0	0	0	111.3	S17 E22 T23 E24	S17-S20 WeakPolarHBondContact O-CB 3.13Å; S17-S20 PolarHBondContact O-N 3.18Å; S17-S20 PolarHBondContact O-OG 2.99Å; S20-E22 VanDerWaalsContact C-N 3.25Å; S20-E22 PolarHBondContact O-N 3.25Å; S20-T23 PolarHBondContact O-N 3.1Å; S20-T23 VanDerWaalsContact O-N 3.1Å; S20-T23 PolarHBondContact O-OG1 3.31Å; S20-E24 WeakPolarHBondContact O-CG 3.49Å; S20-E24 PolarHBondContact O-N 3.15Å
21	K	76.3	Confident	71.2	Confident	78 Å²	78	107.9 Å²	107.9	34%	0.339	57%	0.568	S	S	.	*	H	α-helix	trans	-56.8	-36.7	174.9	-69.2	160.8	178.3	149.7	0	112.3	P16 S17 D18 E24 K25	P16-K21 WeakPolarHBondContact O-CE 3.47Å; P16-K21 PolarHBondContact O-NZ 3.45Å; S17-K21 PolarHBondContact O-N 2.61Å; D18-K21 WeakPolarHBondContact OD1-CD 3.2Å; D18-K21 IonicContact OD1-NZ 3.78Å; D18-K21 PolarHBondContact OD1-NZ 3.5Å; D18-K21 VanDerWaalsContact OD1-NZ 3.11Å; K21-E24 PolarHBondContact O-N 2.63Å; K21-K25 WeakPolarHBondContact O-CB 3.49Å; K21-K25 WeakPolarHBondContact O-CD 3.45Å; K21-K25 WeakPolarHBondContact O-CG 3.33Å; K21-K25 PolarHBondContact O-N 2.97Å
22	E	77.4	Confident	73.6	Confident	96 Å²	96	108.1 Å²	108.1	45%	0.449	56%	0.561	S	S	.	*	H	α-helix	trans	-70	-39.5	177.7	-151.3	-135.2	173.1	0	0	112	D18 S19 S20 E24 K25 K26	D18-E22 WeakPolarHBondContact O-CB 3.48Å; D18-E22 PolarHBondContact O-N 3.33Å; S19-E22 PolarHBondContact O-N 3.11Å; S20-E22 VanDerWaalsContact C-N 3.25Å; S20-E22 PolarHBondContact O-N 3.25Å; E22-E24 VanDerWaalsContact C-N 3.34Å; E22-E24 PolarHBondContact O-N 2.68Å; E22-K25 PolarHBondContact O-N 3.45Å; E22-K26 VanDerWaalsContact O-CG 3.31Å; E22-K26 WeakPolarHBondContact O-CG 3.32Å; E22-K26 PolarHBondContact O-N 2.8Å; E22-K26 WeakPolarHBondContact OE1-CE 3.5Å; E22-K26 IonicContact OE1-NZ 2.63Å; E22-K26 PolarHBondContact OE1-NZ 3.45Å; E22-K26 WeakPolarHBondContact OE2-CE 3.02Å; E22-K26 IonicContact OE2-NZ 3.11Å; E22-K26 PolarHBondContact OE2-NZ 3.19Å
23	T	80.8	Confident	76.1	Confident	65 Å²	65	110.6 Å²	110.6	40%	0.399	56%	0.56	S	S	.	*	H	α-helix	trans	-64.8	-37.9	172.1	72.4	0	0	0	0	112.2	S19 S20 K26 K27	S19-T23 WeakPolarHBondContact O-CG2 3.07Å; S19-T23 PolarHBondContact O-N 3.06Å; S20-T23 PolarHBondContact O-N 3.1Å; S20-T23 VanDerWaalsContact O-N 3.1Å; S20-T23 PolarHBondContact O-OG1 3.31Å; T23-K26 WeakPolarHBondContact O-CB 3.46Å; T23-K26 PolarHBondContact O-N 3.27Å; T23-K27 WeakPolarHBondContact O-CG 3.31Å; T23-K27 PolarHBondContact O-N 2.95Å
24	E	81.4	Confident	78.3	Confident	120 Å²	120	109 Å²	109	56%	0.561	54%	0.539	S	S	*	.	H	α-helix	trans	-63.5	-47	175.4	-68.7	-112.3	112.1	0	0	112	S20 K21 E22 K26 K27 R28	S20-E24 WeakPolarHBondContact O-CG 3.49Å; S20-E24 PolarHBondContact O-N 3.15Å; K21-E24 PolarHBondContact O-N 2.63Å; E22-E24 VanDerWaalsContact C-N 3.34Å; E22-E24 PolarHBondContact O-N 2.68Å; E24-K26 VanDerWaalsContact C-N 3.27Å; E24-K26 PolarHBondContact O-N 3.27Å; E24-K27 PolarHBondContact O-N 3Å; E24-R28 WeakPolarHBondContact O-CB 3.47Å; E24-R28 PolarHBondContact O-N 3.5Å
25	K	83.6	Confident	80.2	Confident	141 Å²	141	104.4 Å²	104.4	61%	0.613	51%	0.509	S	S	*	.	H	α-helix	trans	-55.6	-43	172.8	-72.2	163.9	-174.8	173.1	0	110.9	K21 E22 S29	K21-K25 WeakPolarHBondContact O-CB 3.49Å; K21-K25 WeakPolarHBondContact O-CD 3.45Å; K21-K25 WeakPolarHBondContact O-CG 3.33Å; K21-K25 PolarHBondContact O-N 2.97Å; E22-K25 PolarHBondContact O-N 3.45Å; K25-S29 VanDerWaalsContact O-CB 3.32Å; K25-S29 WeakPolarHBondContact O-CB 3.32Å; K25-S29 PolarHBondContact O-N 2.83Å
26	K	85.7	Confident	81.9	Confident	104 Å²	104	97.6 Å²	97.6	45%	0.452	48%	0.484	S	S	.	.	H	α-helix	trans	-65.3	-43.1	175.5	-71.7	165.5	179.7	170.6	0	112.7	E22 T23 E24 S29 R30	E22-K26 VanDerWaalsContact O-CG 3.31Å; E22-K26 WeakPolarHBondContact O-CG 3.32Å; E22-K26 PolarHBondContact O-N 2.8Å; E22-K26 WeakPolarHBondContact OE1-CE 3.5Å; E22-K26 IonicContact OE1-NZ 2.63Å; E22-K26 PolarHBondContact OE1-NZ 3.45Å; E22-K26 WeakPolarHBondContact OE2-CE 3.02Å; E22-K26 IonicContact OE2-NZ 3.11Å; E22-K26 PolarHBondContact OE2-NZ 3.19Å; T23-K26 WeakPolarHBondContact O-CB 3.46Å; T23-K26 PolarHBondContact O-N 3.27Å; E24-K26 VanDerWaalsContact C-N 3.27Å; E24-K26 PolarHBondContact O-N 3.27Å; K26-S29 PolarHBondContact O-N 2.84Å; K26-R30 WeakPolarHBondContact O-CG 3.42Å; K26-R30 PolarHBondContact O-N 3.03Å; K26-R30 VanDerWaalsContact O-N 3.1Å
27	K	86.5	Confident	83.7	Confident	123 Å²	123	96.5 Å²	96.5	54%	0.535	47%	0.474	S	S	.	.	H	α-helix	trans	-60.3	-51.4	173.4	-70	168.7	-171.2	171.7	0	111	T23 E24 S29 R30 V31	T23-K27 WeakPolarHBondContact O-CG 3.31Å; T23-K27 PolarHBondContact O-N 2.95Å; E24-K27 PolarHBondContact O-N 3Å; K27-S29 VanDerWaalsContact C-N 3.31Å; K27-S29 PolarHBondContact O-N 3.37Å; K27-R30 PolarHBondContact O-N 3.17Å; K27-V31 WeakPolarHBondContact O-CG2 3.37Å; K27-V31 PolarHBondContact O-N 3.1Å
28	R	87.1	Confident	85.2	Confident	209 Å²	209	93.2 Å²	93.2	79%	0.789	45%	0.451	S	S	*	.	H	α-helix	trans	-60.4	-38.5	179.8	-168.7	175.3	-176.9	-178.8	1.2	112.1	E24 K32	E24-R28 WeakPolarHBondContact O-CB 3.47Å; E24-R28 PolarHBondContact O-N 3.5Å; R28-K32 WeakPolarHBondContact O-CB 3.41Å; R28-K32 PolarHBondContact O-N 2.94Å
29	S	91.5	Very high	86.5	Confident	77 Å²	77	90.6 Å²	90.6	54%	0.538	43%	0.434	S	S	.	.	H	α-helix	trans	-62.3	-49.9	173.3	-176.7	0	0	0	0	112.2	K25 K26 K27 V31 K32 Q33	K25-S29 VanDerWaalsContact O-CB 3.32Å; K25-S29 WeakPolarHBondContact O-CB 3.32Å; K25-S29 PolarHBondContact O-N 2.83Å; K26-S29 PolarHBondContact O-N 2.84Å; K27-S29 VanDerWaalsContact C-N 3.31Å; K27-S29 PolarHBondContact O-N 3.37Å; S29-V31 VanDerWaalsContact C-N 3.34Å; S29-V31 PolarHBondContact O-N 3.34Å; S29-K32 WeakPolarHBondContact O-CB 3.46Å; S29-K32 PolarHBondContact O-N 2.94Å; S29-K32 VanDerWaalsContact O-N 3.15Å; S29-Q33 PolarHBondContact O-N 2.99Å
30	R	90.6	Very high	87.8	Confident	196 Å²	196	95 Å²	95	74%	0.74	44%	0.438	S	S	*	.	H	α-helix	trans	-58.6	-42.6	176.4	-70.6	175	-178.5	-179.8	1	112.5	K26 K27 Q33 L34	K26-R30 WeakPolarHBondContact O-CG 3.42Å; K26-R30 PolarHBondContact O-N 3.03Å; K26-R30 VanDerWaalsContact O-N 3.1Å; K27-R30 PolarHBondContact O-N 3.17Å; R30-Q33 PolarHBondContact O-N 2.92Å; R30-L34 PolarHBondContact O-N 3.2Å
31	V	91.8	Very high	89	Confident	65 Å²	65	94.9 Å²	94.9	39%	0.394	43%	0.433	S	S	.	.	H	α-helix	trans	-66.5	-39.1	176.6	174.8	0	0	0	0	111.6	K27 S29 Q33 L34 L35	K27-V31 WeakPolarHBondContact O-CG2 3.37Å; K27-V31 PolarHBondContact O-N 3.1Å; S29-V31 VanDerWaalsContact C-N 3.34Å; S29-V31 PolarHBondContact O-N 3.34Å; V31-Q33 VanDerWaalsContact C-N 3.34Å; V31-L34 PolarHBondContact O-N 3.03Å; V31-L35 HydrophobicContact CG1-CD1 4.08Å; V31-L35 HydrophobicContact CG1-CG 4.47Å; V31-L35 VanDerWaalsContact O-CG 3.29Å; V31-L35 WeakPolarHBondContact O-CG 3.05Å; V31-L35 PolarHBondContact O-N 3.29Å
32	K	93.4	Very high	89.8	Confident	154 Å²	154	91.2 Å²	91.2	67%	0.67	42%	0.417	S	S	*	.	H	α-helix	trans	-62.3	-40.8	173.7	-175.2	-177.1	177.3	-175.7	0	111.6	R28 S29 T36	R28-K32 WeakPolarHBondContact O-CB 3.41Å; R28-K32 PolarHBondContact O-N 2.94Å; S29-K32 WeakPolarHBondContact O-CB 3.46Å; S29-K32 PolarHBondContact O-N 2.94Å; S29-K32 VanDerWaalsContact O-N 3.15Å; K32-T36 WeakPolarHBondContact O-CB 3.5Å; K32-T36 PolarHBondContact O-N 3.45Å; K32-T36 PolarHBondContact O-OG1 3.4Å
33	Q	93	Very high	90.6	Very high	103 Å²	103	88.1 Å²	88.1	48%	0.481	40%	0.403	S	S	.	.	H	α-helix	trans	-64	-50.1	176	-172.1	60.5	47.1	0	0	110.9	S29 R30 V31 L35 T36 D37	S29-Q33 PolarHBondContact O-N 2.99Å; R30-Q33 PolarHBondContact O-N 2.92Å; V31-Q33 VanDerWaalsContact C-N 3.34Å; Q33-L35 VanDerWaalsContact C-N 3.34Å; Q33-L35 PolarHBondContact O-N 2.84Å; Q33-T36 CarbonylContact O-C 3.5Å; Q33-T36 WeakPolarHBondContact O-CA 3.49Å; Q33-T36 VanDerWaalsContact O-CB 3.26Å; Q33-T36 WeakPolarHBondContact O-CB 3.3Å; Q33-T36 PolarHBondContact O-N 3.29Å; Q33-D37 PolarHBondContact NE2-OD1 3.33Å; Q33-D37 PolarHBondContact NE2-OD2 2.93Å; Q33-D37 VanDerWaalsContact O-CG 3.27Å; Q33-D37 PolarHBondContact O-N 2.75Å
34	L	93.8	Very high	91.1	Very high	51 Å²	51	88.6 Å²	88.6	27%	0.267	40%	0.4	S	S	.	.	H	α-helix	trans	-56.5	-44.3	178	179	61.1	0	0	0	112.9	R30 V31 T36 D37 I38 L83	R30-L34 PolarHBondContact O-N 3.2Å; V31-L34 PolarHBondContact O-N 3.03Å; L34-T36 VanDerWaalsContact C-N 3.27Å; L34-T36 PolarHBondContact O-N 3.27Å; L34-D37 PolarHBondContact O-N 3.41Å; L34-I38 HydrophobicContact CD1-CD1 3.92Å; L34-I38 HydrophobicContact CD1-CG1 4.25Å; L34-I38 HydrophobicContact CG-CD1 3.84Å; L34-I38 WeakPolarHBondContact O-CB 3.34Å; L34-I38 WeakPolarHBondContact O-CD1 3.47Å; L34-I38 VanDerWaalsContact O-CG1 3.24Å; L34-I38 WeakPolarHBondContact O-CG1 3.45Å; L34-I38 PolarHBondContact O-N 3.06Å; L34-L83 HydrophobicContact CD1-CB 4Å; L34-L83 HydrophobicContact CD1-CD2 4.2Å
35	L	94.4	Very high	91.7	Very high	35 Å²	35	84 Å²	84	18%	0.183	38%	0.377	C	S	.	.	H	α-helix	trans	-63.1	-33.6	174.3	-68.8	169.4	0	0	0	112.1	V31 Q33 K39 L89 A93	V31-L35 HydrophobicContact CG1-CD1 4.08Å; V31-L35 HydrophobicContact CG1-CG 4.47Å; V31-L35 VanDerWaalsContact O-CG 3.29Å; V31-L35 WeakPolarHBondContact O-CG 3.05Å; V31-L35 PolarHBondContact O-N 3.29Å; Q33-L35 VanDerWaalsContact C-N 3.34Å; Q33-L35 PolarHBondContact O-N 2.84Å; L35-K39 VanDerWaalsContact O-CB 3.24Å; L35-K39 WeakPolarHBondContact O-CB 3.42Å; L35-K39 PolarHBondContact O-N 3.36Å; L35-L89 HydrophobicContact CD2-CD2 3.69Å; L35-L89 HydrophobicContact CD2-CG 4.32Å; L35-A93 HydrophobicContact CB-CB 4.37Å; L35-A93 HydrophobicContact CD2-CB 3.81Å
36	T	94.2	Very high	92	Very high	49 Å²	49	77.2 Å²	77.2	30%	0.301	35%	0.348	S	S	.	.	H	α-helix	trans	-69.8	-42.4	176.4	-56	0	0	0	0	111.4	K32 Q33 L34 K39 R40	K32-T36 WeakPolarHBondContact O-CB 3.5Å; K32-T36 PolarHBondContact O-N 3.45Å; K32-T36 PolarHBondContact O-OG1 3.4Å; Q33-T36 CarbonylContact O-C 3.5Å; Q33-T36 WeakPolarHBondContact O-CA 3.49Å; Q33-T36 VanDerWaalsContact O-CB 3.26Å; Q33-T36 WeakPolarHBondContact O-CB 3.3Å; Q33-T36 PolarHBondContact O-N 3.29Å; L34-T36 VanDerWaalsContact C-N 3.27Å; L34-T36 PolarHBondContact O-N 3.27Å; T36-K39 PolarHBondContact O-N 2.97Å; T36-R40 WeakPolarHBondContact O-CB 3.48Å; T36-R40 WeakPolarHBondContact O-CG 3.43Å; T36-R40 PolarHBondContact O-N 3.27Å
37	D	93.4	Very high	92.2	Very high	55 Å²	55	73 Å²	73	29%	0.294	33%	0.333	S	S	.	.	H	α-helix	trans	-68.8	-42.9	-180	-60.5	-27.5	0	0	0	111.2	Q33 L34 R40 Q41 L83	Q33-D37 PolarHBondContact NE2-OD1 3.33Å; Q33-D37 PolarHBondContact NE2-OD2 2.93Å; Q33-D37 VanDerWaalsContact O-CG 3.27Å; Q33-D37 PolarHBondContact O-N 2.75Å; L34-D37 PolarHBondContact O-N 3.41Å; D37-R40 PolarHBondContact O-N 2.97Å; D37-Q41 WeakPolarHBondContact O-CB 3.24Å; D37-Q41 PolarHBondContact O-N 3.43Å; D37-L83 HydrophobicContact CB-CD2 4.42Å
38	I	94.3	Very high	92.2	Very high	0 Å²	0	71.9 Å²	71.9	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-59.9	-47.9	172.2	-68.8	163.7	0	0	0	110.7	L34 Q41 V42 M80 L83 T84 L89 I90 A93	L34-I38 HydrophobicContact CD1-CD1 3.92Å; L34-I38 HydrophobicContact CD1-CG1 4.25Å; L34-I38 HydrophobicContact CG-CD1 3.84Å; L34-I38 WeakPolarHBondContact O-CB 3.34Å; L34-I38 WeakPolarHBondContact O-CD1 3.47Å; L34-I38 VanDerWaalsContact O-CG1 3.24Å; L34-I38 WeakPolarHBondContact O-CG1 3.45Å; L34-I38 PolarHBondContact O-N 3.06Å; I38-Q41 PolarHBondContact O-N 3.15Å; I38-V42 WeakPolarHBondContact O-CG2 3.29Å; I38-V42 PolarHBondContact O-N 3.38Å; I38-V42 VanDerWaalsContact O-N 3.13Å; I38-M80 HydrophobicContact CG1-SD 4.29Å; I38-M80 HydrophobicContact CG2-CE 4.19Å; I38-M80 HydrophobicContact CG2-SD 4.23Å; I38-L83 HydrophobicContact CG1-CB 3.93Å; I38-L83 HydrophobicContact CG1-CD1 4.01Å; I38-T84 HydrophobicContact CD1-CG2 3.52Å; I38-T84 HydrophobicContact CG1-CG2 4.23Å; I38-L89 HydrophobicContact CD1-CD2 3.4Å; I38-L89 VanDerWaalsContact CD1-CD2 3.4Å; I38-I90 HydrophobicContact CG2-CB 4.42Å; I38-I90 HydrophobicContact CG2-CG1 4.19Å; I38-I90 HydrophobicContact CG2-CG2 4.23Å; I38-A93 HydrophobicContact CB-CB 4.18Å; I38-A93 HydrophobicContact CG2-CB 3.79Å
39	K	94.4	Very high	92.2	Very high	60 Å²	60	63.4 Å²	63.4	26%	0.261	30%	0.301	S	S	.	.	H	α-helix	trans	-56.9	-53.5	177.4	172.7	178.8	165.8	175.2	0	110.7	L35 T36 Q41 V42 E43 N96	L35-K39 VanDerWaalsContact O-CB 3.24Å; L35-K39 WeakPolarHBondContact O-CB 3.42Å; L35-K39 PolarHBondContact O-N 3.36Å; T36-K39 PolarHBondContact O-N 2.97Å; K39-Q41 VanDerWaalsContact C-N 3.28Å; K39-Q41 PolarHBondContact O-N 2.97Å; K39-V42 PolarHBondContact O-N 2.9Å; K39-E43 WeakPolarHBondContact CE-OE1 3.37Å; K39-E43 WeakPolarHBondContact CE-OE2 3.38Å; K39-E43 HydrophobicContact CG-CG 4.28Å; K39-E43 WeakPolarHBondContact CG-OE2 3.36Å; K39-E43 IonicContact NZ-OE1 2.64Å; K39-E43 IonicContact NZ-OE2 3.27Å; K39-E43 WeakPolarHBondContact O-CB 3.47Å; K39-E43 WeakPolarHBondContact O-CG 3.22Å; K39-E43 PolarHBondContact O-N 3.01Å; K39-N96 PolarHBondContact NZ-O 3.31Å
40	R	92.5	Very high	92.2	Very high	174 Å²	174	60.3 Å²	60.3	66%	0.657	28%	0.279	S	S	*	.	H	α-helix	trans	-55.2	-42.5	177.7	-77.2	176	172.8	-143	-3.6	112	T36 D37 V42 E43 F44	T36-R40 WeakPolarHBondContact O-CB 3.48Å; T36-R40 WeakPolarHBondContact O-CG 3.43Å; T36-R40 PolarHBondContact O-N 3.27Å; D37-R40 PolarHBondContact O-N 2.97Å; R40-V42 PolarHBondContact O-N 2.72Å; R40-E43 PolarHBondContact O-N 3.34Å; R40-F44 WeakPolarHBondContact O-CB 3.46Å; R40-F44 PolarHBondContact O-N 3.4Å
41	Q	92.9	Very high	92.1	Very high	38 Å²	38	51 Å²	51	18%	0.178	24%	0.244	C	C	.	.	H	α-helix	trans	-67.6	-36.6	-176.8	-171	55.7	73.8	0	0	113.3	D37 I38 K39 W45 L79 L83	D37-Q41 WeakPolarHBondContact O-CB 3.24Å; D37-Q41 PolarHBondContact O-N 3.43Å; I38-Q41 PolarHBondContact O-N 3.15Å; K39-Q41 VanDerWaalsContact C-N 3.28Å; K39-Q41 PolarHBondContact O-N 2.97Å; Q41-W45 HydrophobicContact CG-CD2 4.34Å; Q41-W45 HydrophobicContact CG-CE3 4.39Å; Q41-W45 HydrophobicContact CG-CH2 3.66Å; Q41-W45 HydrophobicContact CG-CZ2 3.61Å; Q41-W45 HydrophobicContact CG-CZ3 4.08Å; Q41-W45 PolarHBondContact O-N 2.95Å; Q41-L79 HydrophobicContact CG-CD2 4.43Å; Q41-L79 HydrophobicContact CG-CG 4.37Å; Q41-L83 HydrophobicContact CB-CD1 4.49Å
42	V	93.6	Very high	91.8	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-78.3	-40	176.2	179.4	0	0	0	0	111.3	I38 K39 R40 F44 W45 F46 L74 M80 L94 V100	I38-V42 WeakPolarHBondContact O-CG2 3.29Å; I38-V42 PolarHBondContact O-N 3.38Å; I38-V42 VanDerWaalsContact O-N 3.13Å; K39-V42 PolarHBondContact O-N 2.9Å; R40-V42 PolarHBondContact O-N 2.72Å; V42-F44 PolarHBondContact O-N 3.05Å; V42-W45 HydrophobicContact CG2-CE3 4.2Å; V42-W45 HydrophobicContact CG2-CZ3 4.3Å; V42-W45 PolarHBondContact O-N 3.07Å; V42-W45 VanDerWaalsContact O-N 3.09Å; V42-F46 HydrophobicContact CG1-CD2 3.74Å; V42-F46 HydrophobicContact CG1-CE2 3.94Å; V42-F46 WeakPolarHBondContact O-CD2 3.45Å; V42-F46 PolarHBondContact O-N 3Å; V42-L74 HydrophobicContact CG1-CD1 4.25Å; V42-L74 HydrophobicContact CG2-CD1 4.27Å; V42-M80 HydrophobicContact CG2-CE 3.74Å; V42-L94 HydrophobicContact CB-CD1 4.47Å; V42-L94 HydrophobicContact CB-CD2 3.68Å; V42-L94 HydrophobicContact CG1-CD1 3.95Å; V42-L94 HydrophobicContact CG1-CD2 3.8Å; V42-L94 HydrophobicContact CG2-CD1 4.4Å; V42-L94 HydrophobicContact CG2-CD2 4.08Å; V42-V100 HydrophobicContact CG1-CG2 4.37Å
43	E	93.4	Very high	91.6	Very high	32 Å²	32	47.9 Å²	47.9	15%	0.15	23%	0.226	C	C	.	.	H	α-helix	trans	-61.8	-32.3	173.6	-72.4	-177.5	145.4	0	0	112	K39 R40 G47 S97 S98 V99	K39-E43 WeakPolarHBondContact CE-OE1 3.37Å; K39-E43 WeakPolarHBondContact CE-OE2 3.38Å; K39-E43 HydrophobicContact CG-CG 4.28Å; K39-E43 WeakPolarHBondContact CG-OE2 3.36Å; K39-E43 IonicContact NZ-OE1 2.64Å; K39-E43 IonicContact NZ-OE2 3.27Å; K39-E43 WeakPolarHBondContact O-CB 3.47Å; K39-E43 WeakPolarHBondContact O-CG 3.22Å; K39-E43 PolarHBondContact O-N 3.01Å; R40-E43 PolarHBondContact O-N 3.34Å; E43-G47 VanDerWaalsContact O-CA 3.27Å; E43-G47 WeakPolarHBondContact O-CA 3.21Å; E43-G47 PolarHBondContact O-N 3.04Å; E43-S97 WeakPolarHBondContact OE1-CA 3.39Å; E43-S97 WeakPolarHBondContact OE1-CB 3.33Å; E43-S98 PolarHBondContact OE1-N 3.26Å; E43-S98 PolarHBondContact OE1-OG 3.48Å; E43-V99 HydrophobicContact CB-CB 4.42Å; E43-V99 HydrophobicContact CB-CG2 4.11Å; E43-V99 HydrophobicContact CG-CB 4.18Å; E43-V99 HydrophobicContact CG-CG2 4.13Å
44	F	92.3	Very high	91.5	Very high	75 Å²	75	44.9 Å²	44.9	33%	0.329	21%	0.213	S	C	.	.	H	α-helix	trans	-64.7	-48.1	168.2	171	-92.1	0	0	0	112.2	R40 V42 F46 G47 N50 V152 Y153	R40-F44 WeakPolarHBondContact O-CB 3.46Å; R40-F44 PolarHBondContact O-N 3.4Å; V42-F44 PolarHBondContact O-N 3.05Å; F44-F46 PolarHBondContact O-N 3.39Å; F44-G47 PolarHBondContact O-N 2.95Å; F44-G47 VanDerWaalsContact O-N 3.14Å; F44-N50 HydrophobicContact CD1-CB 4.47Å; F44-N50 HydrophobicContact CE1-CB 4.13Å; F44-N50 HydrophobicContact CZ-CB 4.23Å; F44-N50 WeakPolarHBondContact O-CB 3.19Å; F44-V152 WeakPolarHBondContact CE2-O 3.33Å; F44-Y153 HydrophobicContact CE2-CD2 4.01Å; F44-Y153 AromaticContact CZ-CD2 3.71Å; F44-Y153 HydrophobicContact CZ-CD2 3.71Å; F44-Y153 HydrophobicContact CZ-CE2 4.09Å
45	W	92.4	Very high	91.3	Very high	22 Å²	22	52 Å²	52	8%	0.083	24%	0.237	C	C	.	.	H	α-helix	trans	-64.3	-42.3	-176.1	-74.5	-32.5	0	0	0	114.2	Q41 V42 G47 N50 L57 L74 F77 L79 M80	Q41-W45 HydrophobicContact CG-CD2 4.34Å; Q41-W45 HydrophobicContact CG-CE3 4.39Å; Q41-W45 HydrophobicContact CG-CH2 3.66Å; Q41-W45 HydrophobicContact CG-CZ2 3.61Å; Q41-W45 HydrophobicContact CG-CZ3 4.08Å; Q41-W45 PolarHBondContact O-N 2.95Å; V42-W45 HydrophobicContact CG2-CE3 4.2Å; V42-W45 HydrophobicContact CG2-CZ3 4.3Å; V42-W45 PolarHBondContact O-N 3.07Å; V42-W45 VanDerWaalsContact O-N 3.09Å; W45-G47 VanDerWaalsContact C-N 3.3Å; W45-N50 PolarHBondContact O-ND2 2.98Å; W45-L57 HydrophobicContact CB-CD1 3.8Å; W45-L57 HydrophobicContact CG-CD1 4.26Å; W45-L74 HydrophobicContact CE3-CD2 4.26Å; W45-F77 HydrophobicContact CD2-CD2 4.15Å; W45-F77 HydrophobicContact CD2-CE2 4.4Å; W45-F77 AromaticContact CE3-CD2 3.96Å; W45-F77 HydrophobicContact CE3-CD2 3.96Å; W45-F77 HydrophobicContact CE3-CE2 4.29Å; W45-F77 HydrophobicContact CH2-CB 3.98Å; W45-F77 AromaticContact CH2-CD2 3.72Å; W45-F77 HydrophobicContact CH2-CD2 3.72Å; W45-F77 HydrophobicContact CH2-CG 4.37Å; W45-F77 HydrophobicContact CZ2-CB 4.25Å; W45-F77 AromaticContact CZ2-CD2 3.87Å; W45-F77 HydrophobicContact CZ2-CD2 3.87Å; W45-F77 AromaticContact CZ3-CD2 3.74Å; W45-F77 HydrophobicContact CZ3-CD2 3.74Å; W45-F77 HydrophobicContact CZ3-CE2 4.47Å; W45-L79 HydrophobicContact CZ2-CB 4.19Å; W45-M80 HydrophobicContact CH2-CB 3.98Å; W45-M80 HydrophobicContact CH2-CE 3.96Å; W45-M80 HydrophobicContact CZ3-CB 4.38Å; W45-M80 HydrophobicContact CZ3-CE 3.57Å
46	F	91.9	Very high	91.2	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-1.9	174.6	-69.1	-95.7	0	0	0	112.9	V42 F44 I61 V69 L74 V99 V100 V109 R111	V42-F46 HydrophobicContact CG1-CD2 3.74Å; V42-F46 HydrophobicContact CG1-CE2 3.94Å; V42-F46 WeakPolarHBondContact O-CD2 3.45Å; V42-F46 PolarHBondContact O-N 3Å; F44-F46 PolarHBondContact O-N 3.39Å; F46-I61 HydrophobicContact CD1-CD1 4.15Å; F46-I61 HydrophobicContact CE1-CD1 3.96Å; F46-V69 HydrophobicContact CE1-CG2 4.19Å; F46-V69 HydrophobicContact CZ-CB 4.16Å; F46-V69 HydrophobicContact CZ-CG2 4.23Å; F46-L74 HydrophobicContact CE2-CD1 4.15Å; F46-L74 HydrophobicContact CE2-CD2 4.22Å; F46-V99 HydrophobicContact CB-CG1 4.23Å; F46-V100 HydrophobicContact CB-CG1 3.49Å; F46-V100 VanDerWaalsContact CB-CG1 3.49Å; F46-V100 HydrophobicContact CD1-CG1 4.27Å; F46-V100 HydrophobicContact CD2-CG1 3.99Å; F46-V100 HydrophobicContact CG-CG1 3.66Å; F46-V109 HydrophobicContact CE2-CG1 4.18Å; F46-V109 HydrophobicContact CZ-CG1 3.93Å; F46-R111 HydrophobicContact CD1-CB 4.47Å; F46-R111 PolarHBondContact O-NH1 3.42Å
47	G	89.6	Confident	91	Very high	15 Å²	15	53.2 Å²	53.2	16%	0.155	24%	0.236	C	C	.	.	S	Bend	trans	-68.1	152.1	172.4	0	0	0	0	0	111.8	E43 F44 W45 V49 N50 L51	E43-G47 VanDerWaalsContact O-CA 3.27Å; E43-G47 WeakPolarHBondContact O-CA 3.21Å; E43-G47 PolarHBondContact O-N 3.04Å; F44-G47 PolarHBondContact O-N 2.95Å; F44-G47 VanDerWaalsContact O-N 3.14Å; W45-G47 VanDerWaalsContact C-N 3.3Å; G47-V49 PolarHBondContact O-N 3.41Å; G47-N50 PolarHBondContact O-N 3.13Å; G47-L51 WeakPolarHBondContact O-CB 3.46Å; G47-L51 PolarHBondContact O-N 2.84Å
48	E	86.8	Confident	90.8	Very high	99 Å²	99	55 Å²	55	46%	0.463	24%	0.241	S	C	.	.	H	α-helix	trans	-62.5	-42.6	-166.8	-64.6	-179.8	173.5	0	0	112.8	N50 L51 H52 R111	E48-N50 VanDerWaalsContact C-N 3.34Å; E48-N50 PolarHBondContact O-N 2.67Å; E48-L51 PolarHBondContact O-N 2.88Å; E48-H52 WeakPolarHBondContact O-CB 3.38Å; E48-H52 PolarHBondContact O-N 2.64Å; E48-H52 VanDerWaalsContact O-N 3.1Å; E48-H52 PolarHBondContact O-ND1 3.4Å; E48-R111 IonicContact OE1-CZ 3.71Å; E48-R111 IonicContact OE1-NH1 2.94Å; E48-R111 IonicContact OE1-NH2 2.6Å; E48-R111 PolarHBondContact OE1-NH2 2.91Å
49	V	86.6	Confident	90.7	Very high	31 Å²	31	61.1 Å²	61.1	19%	0.188	27%	0.268	C	S	.	.	H	α-helix	trans	-68.5	-32.2	-176.5	178.1	0	0	0	0	112.5	G47 K53 V152 Y153 E172	G47-V49 PolarHBondContact O-N 3.41Å; V49-K53 VanDerWaalsContact O-CD 3.23Å; V49-K53 WeakPolarHBondContact O-CD 3.43Å; V49-K53 VanDerWaalsContact O-CE 3.27Å; V49-K53 WeakPolarHBondContact O-CE 3.41Å; V49-K53 WeakPolarHBondContact O-CG 3.36Å; V49-K53 PolarHBondContact O-NZ 3.11Å; V49-V152 HydrophobicContact CB-CG1 3.91Å; V49-V152 HydrophobicContact CG1-CG1 4.25Å; V49-V152 HydrophobicContact CG2-CG1 3.68Å; V49-Y153 VanDerWaalsContact CG1-CB 3.49Å; V49-Y153 HydrophobicContact CG1-CD2 4.27Å; V49-Y153 HydrophobicContact CG1-CG 4Å; V49-E172 VanDerWaalsContact CG1-OE1 3.24Å; V49-E172 WeakPolarHBondContact CG1-OE1 3.36Å
50	N	90.6	Very high	90.5	Very high	13 Å²	13	60.2 Å²	60.2	7%	0.07	27%	0.266	C	S	.	.	H	α-helix	trans	-77.8	-48.7	172.6	-174.8	74.8	0	0	0	111.1	F44 W45 G47 E48 H52 K53 D54	F44-N50 HydrophobicContact CD1-CB 4.47Å; F44-N50 HydrophobicContact CE1-CB 4.13Å; F44-N50 HydrophobicContact CZ-CB 4.23Å; F44-N50 WeakPolarHBondContact O-CB 3.19Å; W45-N50 PolarHBondContact O-ND2 2.98Å; G47-N50 PolarHBondContact O-N 3.13Å; E48-N50 VanDerWaalsContact C-N 3.34Å; E48-N50 PolarHBondContact O-N 2.67Å; N50-H52 VanDerWaalsContact C-N 3.3Å; N50-H52 PolarHBondContact O-N 3.09Å; N50-K53 CarbonylContact O-C 3.51Å; N50-K53 WeakPolarHBondContact O-CA 3.39Å; N50-K53 WeakPolarHBondContact O-CB 3.29Å; N50-K53 PolarHBondContact O-N 3.13Å; N50-D54 PolarHBondContact O-N 3.27Å
51	L	88.7	Confident	90.4	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-72	-21.5	-168.8	-167.1	54.5	0	0	0	113.7	G47 E48 K53 L57 K58 I61 L115	G47-L51 WeakPolarHBondContact O-CB 3.46Å; G47-L51 PolarHBondContact O-N 2.84Å; E48-L51 PolarHBondContact O-N 2.88Å; L51-K53 VanDerWaalsContact C-N 3.25Å; L51-K53 PolarHBondContact O-N 2.85Å; L51-L57 HydrophobicContact CD1-CB 3.63Å; L51-K58 HydrophobicContact CD1-CB 4.24Å; L51-I61 HydrophobicContact CD1-CD1 4.12Å; L51-I61 HydrophobicContact CD2-CD1 3.78Å; L51-L115 HydrophobicContact CB-CD2 4.27Å; L51-L115 HydrophobicContact CD2-CD1 3.88Å; L51-L115 HydrophobicContact CD2-CD2 4.08Å; L51-L115 HydrophobicContact CD2-CG 4.23Å; L51-L115 HydrophobicContact CG-CD1 3.97Å; L51-L115 HydrophobicContact CG-CD2 4.28Å
52	H	86.6	Confident	90.2	Very high	68 Å²	68	56.8 Å²	56.8	32%	0.315	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-21.3	165.8	-79.2	103.3	0	0	0	114	E48 N50 G116 P118	E48-H52 WeakPolarHBondContact O-CB 3.38Å; E48-H52 PolarHBondContact O-N 2.64Å; E48-H52 VanDerWaalsContact O-N 3.1Å; E48-H52 PolarHBondContact O-ND1 3.4Å; N50-H52 VanDerWaalsContact C-N 3.3Å; N50-H52 PolarHBondContact O-N 3.09Å; H52-G116 PolarHBondContact NE2-O 3.18Å; H52-P118 WeakPolarHBondContact NE2-CA 3.28Å
53	K	87.6	Confident	90	Very high	84 Å²	84	63.8 Å²	63.8	37%	0.365	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	-33.5	-176.1	-60.1	171.3	-169.9	161.3	0	112.3	V49 N50 L51 R55 Y153 E172	V49-K53 VanDerWaalsContact O-CD 3.23Å; V49-K53 WeakPolarHBondContact O-CD 3.43Å; V49-K53 VanDerWaalsContact O-CE 3.27Å; V49-K53 WeakPolarHBondContact O-CE 3.41Å; V49-K53 WeakPolarHBondContact O-CG 3.36Å; V49-K53 PolarHBondContact O-NZ 3.11Å; N50-K53 CarbonylContact O-C 3.51Å; N50-K53 WeakPolarHBondContact O-CA 3.39Å; N50-K53 WeakPolarHBondContact O-CB 3.29Å; N50-K53 PolarHBondContact O-N 3.13Å; L51-K53 VanDerWaalsContact C-N 3.25Å; L51-K53 PolarHBondContact O-N 2.85Å; K53-R55 PolarHBondContact O-N 3.2Å; K53-Y153 HydrophobicContact CD-CD1 4.23Å; K53-Y153 HydrophobicContact CD-CD2 4.42Å; K53-Y153 HydrophobicContact CD-CE1 3.76Å; K53-Y153 HydrophobicContact CD-CE2 3.99Å; K53-E172 IonicContact NZ-OE2 2.88Å; K53-E172 PolarHBondContact NZ-OE2 2.91Å
54	D	91.3	Very high	89.8	Confident	41 Å²	41	64.3 Å²	64.3	22%	0.219	30%	0.301	C	S	.	.			trans	-78.6	90	-178.5	-166.9	-23.2	0	0	0	111.6	N50 F56 L57 K58	N50-D54 PolarHBondContact O-N 3.27Å; D54-F56 PolarHBondContact O-N 3.33Å; D54-F56 WeakPolarHBondContact OD1-CA 3.49Å; D54-F56 WeakPolarHBondContact OD1-CB 3.25Å; D54-F56 PolarHBondContact OD1-N 2.73Å; D54-L57 HydrophobicContact CB-CB 4.32Å; D54-L57 PolarHBondContact OD1-N 2.88Å; D54-L57 WeakPolarHBondContact OD2-CD1 3.42Å; D54-K58 WeakPolarHBondContact O-CB 3.17Å; D54-K58 PolarHBondContact O-N 3.4Å
55	R	89.4	Confident	89.1	Confident	201 Å²	201	69.5 Å²	69.5	76%	0.758	33%	0.332	S	S	*	.	H	α-helix	trans	-61.4	-19.6	174.1	-178.8	176.1	-74.6	-160.4	-4	113.5	K53 K59	K53-R55 PolarHBondContact O-N 3.2Å; R55-K59 HydrophobicContact CG-CD 4.3Å; R55-K59 WeakPolarHBondContact O-CB 3.49Å; R55-K59 WeakPolarHBondContact O-CD 3.1Å; R55-K59 VanDerWaalsContact O-CG 3.26Å; R55-K59 WeakPolarHBondContact O-CG 3.33Å; R55-K59 PolarHBondContact O-N 3.23Å
56	F	92.4	Very high	88.6	Confident	108 Å²	108	71.9 Å²	71.9	47%	0.474	35%	0.353	S	S	.	.	H	α-helix	trans	-80.2	-54.6	177.7	176.3	-95	0	0	0	110.6	D54 K58 K59 L60 V73 F77	D54-F56 PolarHBondContact O-N 3.33Å; D54-F56 WeakPolarHBondContact OD1-CA 3.49Å; D54-F56 WeakPolarHBondContact OD1-CB 3.25Å; D54-F56 PolarHBondContact OD1-N 2.73Å; F56-K58 VanDerWaalsContact C-N 3.35Å; F56-K58 PolarHBondContact O-N 3.29Å; F56-K59 PolarHBondContact O-N 3.36Å; F56-L60 HydrophobicContact CD1-CD1 4.08Å; F56-L60 HydrophobicContact CE1-CD1 3.43Å; F56-L60 VanDerWaalsContact CE1-CD1 3.43Å; F56-L60 HydrophobicContact CE1-CG 4.42Å; F56-L60 HydrophobicContact CE2-CD1 4.4Å; F56-L60 HydrophobicContact CZ-CD1 3.63Å; F56-L60 HydrophobicContact CZ-CG 4.4Å; F56-L60 PolarHBondContact O-N 3.21Å; F56-L60 VanDerWaalsContact O-N 3.16Å; F56-V73 HydrophobicContact CE1-CG1 4.04Å; F56-V73 HydrophobicContact CZ-CG1 4.28Å; F56-F77 HydrophobicContact CD1-CE1 4.27Å; F56-F77 HydrophobicContact CD1-CZ 4.17Å; F56-F77 AromaticContact CE1-CE1 3.69Å; F56-F77 HydrophobicContact CE1-CE1 3.69Å; F56-F77 AromaticContact CE1-CZ 3.85Å; F56-F77 HydrophobicContact CE1-CZ 3.85Å
57	L	90.7	Very high	88.3	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-62.8	-40.7	176.9	-80.2	175	0	0	0	112.1	W45 L51 D54 K59 L60 I61 L74 F77	W45-L57 HydrophobicContact CB-CD1 3.8Å; W45-L57 HydrophobicContact CG-CD1 4.26Å; L51-L57 HydrophobicContact CD1-CB 3.63Å; D54-L57 HydrophobicContact CB-CB 4.32Å; D54-L57 PolarHBondContact OD1-N 2.88Å; D54-L57 WeakPolarHBondContact OD2-CD1 3.42Å; L57-K59 PolarHBondContact O-N 2.95Å; L57-L60 PolarHBondContact O-N 2.88Å; L57-I61 WeakPolarHBondContact O-CG1 3.43Å; L57-I61 PolarHBondContact O-N 2.92Å; L57-L74 HydrophobicContact CD2-CD2 4.49Å; L57-F77 HydrophobicContact CD1-CE2 4.32Å; L57-F77 HydrophobicContact CD2-CE2 4.04Å; L57-F77 HydrophobicContact CD2-CZ 3.84Å; L57-F77 HydrophobicContact CG-CE2 4.36Å; L57-F77 HydrophobicContact CG-CZ 4.25Å
58	K	89.3	Confident	88.4	Confident	92 Å²	92	73.9 Å²	73.9	40%	0.4	36%	0.361	S	S	.	.	H	α-helix	trans	-59.3	-46.5	175.3	175.1	159.7	-178.2	165.8	0	111.5	L51 D54 F56 L60 I61 D62	L51-K58 HydrophobicContact CD1-CB 4.24Å; D54-K58 WeakPolarHBondContact O-CB 3.17Å; D54-K58 PolarHBondContact O-N 3.4Å; F56-K58 VanDerWaalsContact C-N 3.35Å; F56-K58 PolarHBondContact O-N 3.29Å; K58-L60 PolarHBondContact O-N 2.82Å; K58-I61 PolarHBondContact O-N 3.29Å; K58-I61 VanDerWaalsContact O-N 3.17Å; K58-D62 WeakPolarHBondContact CE-OD1 3.35Å; K58-D62 WeakPolarHBondContact CE-OD2 3.34Å; K58-D62 WeakPolarHBondContact CG-OD2 3.48Å; K58-D62 WeakPolarHBondContact O-CB 3.18Å; K58-D62 PolarHBondContact O-N 3.11Å
59	K	91.4	Very high	88.7	Confident	129 Å²	129	69.4 Å²	69.4	56%	0.561	34%	0.341	S	S	*	.	H	α-helix	trans	-57.4	-45	177.3	-88.5	175.6	159.4	-106.3	0	113.1	R55 F56 L57 I61 D62 E63	R55-K59 HydrophobicContact CG-CD 4.3Å; R55-K59 WeakPolarHBondContact O-CB 3.49Å; R55-K59 WeakPolarHBondContact O-CD 3.1Å; R55-K59 VanDerWaalsContact O-CG 3.26Å; R55-K59 WeakPolarHBondContact O-CG 3.33Å; R55-K59 PolarHBondContact O-N 3.23Å; F56-K59 PolarHBondContact O-N 3.36Å; L57-K59 PolarHBondContact O-N 2.95Å; K59-I61 PolarHBondContact O-N 3.49Å; K59-D62 PolarHBondContact O-N 2.79Å; K59-E63 WeakPolarHBondContact O-CB 3.44Å; K59-E63 PolarHBondContact O-N 3.01Å
60	L	91.4	Very high	89	Confident	42 Å²	42	71 Å²	71	22%	0.22	35%	0.348	C	S	.	.	H	α-helix	trans	-63.8	-30.5	180	-70	174.7	0	0	0	113.1	F56 L57 K58 S64 V69 V73	F56-L60 HydrophobicContact CD1-CD1 4.08Å; F56-L60 HydrophobicContact CE1-CD1 3.43Å; F56-L60 VanDerWaalsContact CE1-CD1 3.43Å; F56-L60 HydrophobicContact CE1-CG 4.42Å; F56-L60 HydrophobicContact CE2-CD1 4.4Å; F56-L60 HydrophobicContact CZ-CD1 3.63Å; F56-L60 HydrophobicContact CZ-CG 4.4Å; F56-L60 PolarHBondContact O-N 3.21Å; F56-L60 VanDerWaalsContact O-N 3.16Å; L57-L60 PolarHBondContact O-N 2.88Å; K58-L60 PolarHBondContact O-N 2.82Å; L60-S64 WeakPolarHBondContact O-CB 3.35Å; L60-S64 PolarHBondContact O-N 2.94Å; L60-S64 PolarHBondContact O-OG 2.91Å; L60-V69 HydrophobicContact CB-CG2 4.33Å; L60-V69 HydrophobicContact CD1-CG1 4.42Å; L60-V73 HydrophobicContact CD1-CG1 3.82Å
61	I	90.3	Very high	89	Confident	33 Å²	33	70.4 Å²	70.4	17%	0.169	35%	0.345	C	S	.	.	H	α-helix	trans	-77.5	-45.9	175.3	-64.3	168.1	0	0	0	110.2	F46 L51 L57 K58 K59 E63 S64 V69	F46-I61 HydrophobicContact CD1-CD1 4.15Å; F46-I61 HydrophobicContact CE1-CD1 3.96Å; L51-I61 HydrophobicContact CD1-CD1 4.12Å; L51-I61 HydrophobicContact CD2-CD1 3.78Å; L57-I61 WeakPolarHBondContact O-CG1 3.43Å; L57-I61 PolarHBondContact O-N 2.92Å; K58-I61 PolarHBondContact O-N 3.29Å; K58-I61 VanDerWaalsContact O-N 3.17Å; K59-I61 PolarHBondContact O-N 3.49Å; I61-E63 VanDerWaalsContact C-N 3.26Å; I61-E63 PolarHBondContact O-N 2.93Å; I61-S64 PolarHBondContact O-N 3.45Å; I61-S64 VanDerWaalsContact O-O 3.1Å; I61-V69 HydrophobicContact CD1-CG2 4.48Å; I61-V69 HydrophobicContact CG1-CG2 3.69Å
62	D	88.4	Confident	89.2	Confident	106 Å²	106	74.3 Å²	74.3	57%	0.567	37%	0.373	S	S	*	.	H	α-helix	trans	-65.2	-26.5	177.5	-63.2	-11.2	0	0	0	112.8	K58 K59	K58-D62 WeakPolarHBondContact CE-OD1 3.35Å; K58-D62 WeakPolarHBondContact CE-OD2 3.34Å; K58-D62 WeakPolarHBondContact CG-OD2 3.48Å; K58-D62 WeakPolarHBondContact O-CB 3.18Å; K58-D62 PolarHBondContact O-N 3.11Å; K59-D62 PolarHBondContact O-N 2.79Å
63	E	89.7	Confident	89.5	Confident	148 Å²	148	72.9 Å²	72.9	69%	0.692	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-8.1	177.9	-175.1	168.3	-159.8	0	0	112.9	K59 I61	K59-E63 WeakPolarHBondContact O-CB 3.44Å; K59-E63 PolarHBondContact O-N 3.01Å; I61-E63 VanDerWaalsContact C-N 3.26Å; I61-E63 PolarHBondContact O-N 2.93Å
64	S	87.8	Confident	89.7	Confident	42 Å²	42	68.9 Å²	68.9	29%	0.294	35%	0.351	S	S	.	.	S	Bend	trans	-112.4	110.5	179.7	-59.6	0	0	0	0	110.3	L60 I61 S66 G67	L60-S64 WeakPolarHBondContact O-CB 3.35Å; L60-S64 PolarHBondContact O-N 2.94Å; L60-S64 PolarHBondContact O-OG 2.91Å; I61-S64 PolarHBondContact O-N 3.45Å; I61-S64 VanDerWaalsContact O-O 3.1Å; S64-S66 PolarHBondContact O-N 3.41Å; S64-G67 PolarHBondContact O-N 2.86Å
65	D	78.3	Confident	89.7	Confident	184 Å²	184	68 Å²	68	98%	0.984	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-23.2	-175.7	-56	-47.4	0	0	0	115.1
66	S	80.8	Confident	89.9	Confident	73 Å²	73	61.1 Å²	61.1	51%	0.51	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.4	3.4	-178.8	55	0	0	0	0	114.7	S64 Y68	S64-S66 PolarHBondContact O-N 3.41Å; S66-Y68 VanDerWaalsContact C-N 3.26Å; S66-Y68 WeakPolarHBondContact O-CD2 3.24Å; S66-Y68 PolarHBondContact O-N 2.9Å
67	G	85.8	Confident	89.9	Confident	18 Å²	18	57.6 Å²	57.6	19%	0.186	32%	0.315	C	S	.	.			trans	68.4	12.9	176.1	0	0	0	0	0	116.2	S64 R110	S64-G67 PolarHBondContact O-N 2.86Å; G67-R110 WeakPolarHBondContact O-CB 3.5Å
68	Y	92.1	Very high	89.9	Confident	38 Å²	38	62 Å²	62	15%	0.149	35%	0.346	C	S	.	.			trans	-88.8	132.3	-179.5	-76.5	-80	0	0	0	112.8	S66 N103 K108 R110	S66-Y68 VanDerWaalsContact C-N 3.26Å; S66-Y68 WeakPolarHBondContact O-CD2 3.24Å; S66-Y68 PolarHBondContact O-N 2.9Å; Y68-N103 HydrophobicContact CD1-CB 4.44Å; Y68-N103 HydrophobicContact CE1-CB 3.96Å; Y68-K108 HydrophobicContact CD1-CB 3.96Å; Y68-K108 HydrophobicContact CG-CB 4.32Å; Y68-R110 HydrophobicContact CD1-CB 3.75Å; Y68-R110 HydrophobicContact CD1-CG 3.87Å; Y68-R110 HydrophobicContact CE1-CB 4.04Å; Y68-R110 HydrophobicContact CE1-CG 3.6Å; Y68-R110 HydrophobicContact CG-CB 4.11Å; Y68-R110 HydrophobicContact CG-CG 4.47Å; Y68-R110 PolarHBondContact OH-NE 3.02Å
69	V	92.8	Very high	89.9	Confident	5 Å²	5	61 Å²	61	3%	0.03	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	133.8	173.3	-177.7	0	0	0	0	109.7	F46 L60 I61 V73 K108 V109	F46-V69 HydrophobicContact CE1-CG2 4.19Å; F46-V69 HydrophobicContact CZ-CB 4.16Å; F46-V69 HydrophobicContact CZ-CG2 4.23Å; L60-V69 HydrophobicContact CB-CG2 4.33Å; L60-V69 HydrophobicContact CD1-CG1 4.42Å; I61-V69 HydrophobicContact CD1-CG2 4.48Å; I61-V69 HydrophobicContact CG1-CG2 3.69Å; V69-V73 HydrophobicContact CG1-CB 4.19Å; V69-V73 HydrophobicContact CG1-CG1 4.48Å; V69-K108 WeakPolarHBondContact O-CA 3.4Å; V69-V109 PolarHBondContact N-O 3.17Å; V69-V109 PolarHBondContact O-N 2.79Å
70	D	93	Very high	89.9	Confident	64 Å²	64	54.9 Å²	54.9	34%	0.342	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	138.2	-178.1	-70.7	16.8	0	0	0	111.8	S72 V73 K108	D70-S72 PolarHBondContact O-N 3.37Å; D70-S72 VanDerWaalsContact O-N 3.11Å; D70-V73 HydrophobicContact CB-CG2 4.37Å; D70-V73 WeakPolarHBondContact O-CB 3.26Å; D70-V73 PolarHBondContact O-N 3.27Å; D70-K108 VanDerWaalsContact CG-NZ 3.34Å; D70-K108 VanDerWaalsContact OD1-CD 3.28Å; D70-K108 WeakPolarHBondContact OD1-CD 3.33Å; D70-K108 WeakPolarHBondContact OD1-CE 3.34Å; D70-K108 VanDerWaalsContact OD1-CG 3.29Å; D70-K108 WeakPolarHBondContact OD1-CG 3.4Å; D70-K108 IonicContact OD1-NZ 2.68Å; D70-K108 PolarHBondContact OD1-NZ 2.86Å; D70-K108 IonicContact OD2-NZ 2.71Å; D70-K108 PolarHBondContact OD2-NZ 3.11Å
71	L	91.7	Very high	90	Very high	1 Å²	1	58.9 Å²	58.9	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-61.5	-22.7	176.7	-66.7	-176.5	0	0	0	112.6	V73 L74 T75 T87 I90 A91 L94 G106 T107 V109	L71-V73 VanDerWaalsContact C-N 3.26Å; L71-V73 PolarHBondContact O-N 3.13Å; L71-L74 HydrophobicContact CD2-CD1 3.91Å; L71-L74 PolarHBondContact O-N 3.1Å; L71-L74 VanDerWaalsContact O-N 3.13Å; L71-T75 PolarHBondContact O-N 3.27Å; L71-T75 PolarHBondContact O-OG1 2.91Å; L71-T87 HydrophobicContact CB-CG2 4.05Å; L71-I90 HydrophobicContact CD1-CG2 4.43Å; L71-I90 HydrophobicContact CD2-CG2 3.93Å; L71-A91 HydrophobicContact CD1-CB 4.05Å; L71-L94 HydrophobicContact CD2-CD1 4.31Å; L71-G106 WeakPolarHBondContact CD1-O 3.4Å; L71-T107 WeakPolarHBondContact CB-O 3.22Å; L71-T107 WeakPolarHBondContact CG-O 3.15Å; L71-T107 PolarHBondContact N-O 3.3Å; L71-V109 HydrophobicContact CD2-CB 4.08Å; L71-V109 HydrophobicContact CD2-CG1 3.71Å
72	S	92.2	Very high	90.1	Very high	84 Å²	84	65.3 Å²	65.3	59%	0.587	36%	0.36	S	S	*	.	H	α-helix	trans	-63	-29.3	171.8	-163.6	0	0	0	0	113.1	D70 T75 S76	D70-S72 PolarHBondContact O-N 3.37Å; D70-S72 VanDerWaalsContact O-N 3.11Å; S72-T75 WeakPolarHBondContact CA-OG1 2.91Å; S72-T75 PolarHBondContact O-OG1 3.27Å; S72-S76 PolarHBondContact O-N 3.31Å
73	V	93.1	Very high	90.3	Very high	38 Å²	38	62.7 Å²	62.7	23%	0.23	35%	0.346	C	S	.	.	H	α-helix	trans	-72.2	-40.3	171.9	-177.7	0	0	0	0	110.1	F56 L60 V69 D70 L71 S76 F77	F56-V73 HydrophobicContact CE1-CG1 4.04Å; F56-V73 HydrophobicContact CZ-CG1 4.28Å; L60-V73 HydrophobicContact CD1-CG1 3.82Å; V69-V73 HydrophobicContact CG1-CB 4.19Å; V69-V73 HydrophobicContact CG1-CG1 4.48Å; D70-V73 HydrophobicContact CB-CG2 4.37Å; D70-V73 WeakPolarHBondContact O-CB 3.26Å; D70-V73 PolarHBondContact O-N 3.27Å; L71-V73 VanDerWaalsContact C-N 3.26Å; L71-V73 PolarHBondContact O-N 3.13Å; V73-S76 VanDerWaalsContact O-CB 3.22Å; V73-S76 WeakPolarHBondContact O-CB 3.03Å; V73-S76 PolarHBondContact O-N 2.77Å; V73-S76 VanDerWaalsContact O-N 3.1Å; V73-S76 PolarHBondContact O-OG 2.99Å; V73-F77 HydrophobicContact CG1-CE1 3.95Å; V73-F77 HydrophobicContact CG1-CZ 4.15Å; V73-F77 WeakPolarHBondContact O-CD1 3.49Å; V73-F77 WeakPolarHBondContact O-CE1 3.39Å
74	L	91.3	Very high	90.4	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-67.6	-37.9	178.4	-58.9	-171.5	0	0	0	112.6	V42 W45 F46 L57 L71 S76 F77 M80 V109	V42-L74 HydrophobicContact CG1-CD1 4.25Å; V42-L74 HydrophobicContact CG2-CD1 4.27Å; W45-L74 HydrophobicContact CE3-CD2 4.26Å; F46-L74 HydrophobicContact CE2-CD1 4.15Å; F46-L74 HydrophobicContact CE2-CD2 4.22Å; L57-L74 HydrophobicContact CD2-CD2 4.49Å; L71-L74 HydrophobicContact CD2-CD1 3.91Å; L71-L74 PolarHBondContact O-N 3.1Å; L71-L74 VanDerWaalsContact O-N 3.13Å; L74-S76 PolarHBondContact O-N 2.61Å; L74-F77 HydrophobicContact CD2-CD2 4.09Å; L74-F77 HydrophobicContact CD2-CE2 3.56Å; L74-F77 HydrophobicContact CD2-CZ 4.15Å; L74-F77 WeakPolarHBondContact O-CB 3.41Å; L74-F77 PolarHBondContact O-N 2.87Å; L74-F77 VanDerWaalsContact O-N 3.11Å; L74-M80 WeakPolarHBondContact O-CB 3.22Å; L74-V109 HydrophobicContact CD1-CG1 3.83Å
75	T	92.7	Very high	90.7	Very high	22 Å²	22	59 Å²	59	14%	0.135	33%	0.331	C	S	.	.	H	α-helix	trans	-67.5	-15.7	172.8	58.9	0	0	0	0	112.7	L71 S72 F77 K81 T85 T87 I90	L71-T75 PolarHBondContact O-N 3.27Å; L71-T75 PolarHBondContact O-OG1 2.91Å; S72-T75 WeakPolarHBondContact CA-OG1 2.91Å; S72-T75 PolarHBondContact O-OG1 3.27Å; T75-F77 VanDerWaalsContact C-N 3.31Å; T75-K81 WeakPolarHBondContact O-CE 3.44Å; T75-K81 WeakPolarHBondContact O-CG 3.49Å; T75-T85 VanDerWaalsContact CG2-O 3.3Å; T75-T85 WeakPolarHBondContact CG2-O 3.24Å; T75-T87 HydrophobicContact CG2-CG2 4.31Å; T75-I90 HydrophobicContact CG2-CD1 3.56Å
76	S	92.5	Very high	91.4	Very high	57 Å²	57	54.1 Å²	54.1	40%	0.399	31%	0.306	S	S	.	.	H	α-helix	trans	-71.2	-24.7	171.1	88.5	0	0	0	0	113	S72 V73 L74 K81	S72-S76 PolarHBondContact O-N 3.31Å; V73-S76 VanDerWaalsContact O-CB 3.22Å; V73-S76 WeakPolarHBondContact O-CB 3.03Å; V73-S76 PolarHBondContact O-N 2.77Å; V73-S76 VanDerWaalsContact O-N 3.1Å; V73-S76 PolarHBondContact O-OG 2.99Å; L74-S76 PolarHBondContact O-N 2.61Å; S76-K81 VanDerWaalsContact O-CE 3.22Å; S76-K81 WeakPolarHBondContact O-CE 3.14Å; S76-K81 PolarHBondContact O-NZ 2.82Å
77	F	92.8	Very high	92	Very high	34 Å²	34	53.6 Å²	53.6	15%	0.149	30%	0.299	C	S	.	.	S	Bend	trans	-72.1	137.2	-172.2	-64.1	-8.2	0	0	0	112.5	W45 F56 L57 V73 L74 T75 L79 M80 K81	W45-F77 HydrophobicContact CD2-CD2 4.15Å; W45-F77 HydrophobicContact CD2-CE2 4.4Å; W45-F77 AromaticContact CE3-CD2 3.96Å; W45-F77 HydrophobicContact CE3-CD2 3.96Å; W45-F77 HydrophobicContact CE3-CE2 4.29Å; W45-F77 HydrophobicContact CH2-CB 3.98Å; W45-F77 AromaticContact CH2-CD2 3.72Å; W45-F77 HydrophobicContact CH2-CD2 3.72Å; W45-F77 HydrophobicContact CH2-CG 4.37Å; W45-F77 HydrophobicContact CZ2-CB 4.25Å; W45-F77 AromaticContact CZ2-CD2 3.87Å; W45-F77 HydrophobicContact CZ2-CD2 3.87Å; W45-F77 AromaticContact CZ3-CD2 3.74Å; W45-F77 HydrophobicContact CZ3-CD2 3.74Å; W45-F77 HydrophobicContact CZ3-CE2 4.47Å; F56-F77 HydrophobicContact CD1-CE1 4.27Å; F56-F77 HydrophobicContact CD1-CZ 4.17Å; F56-F77 AromaticContact CE1-CE1 3.69Å; F56-F77 HydrophobicContact CE1-CE1 3.69Å; F56-F77 AromaticContact CE1-CZ 3.85Å; F56-F77 HydrophobicContact CE1-CZ 3.85Å; L57-F77 HydrophobicContact CD1-CE2 4.32Å; L57-F77 HydrophobicContact CD2-CE2 4.04Å; L57-F77 HydrophobicContact CD2-CZ 3.84Å; L57-F77 HydrophobicContact CG-CE2 4.36Å; L57-F77 HydrophobicContact CG-CZ 4.25Å; V73-F77 HydrophobicContact CG1-CE1 3.95Å; V73-F77 HydrophobicContact CG1-CZ 4.15Å; V73-F77 WeakPolarHBondContact O-CD1 3.49Å; V73-F77 WeakPolarHBondContact O-CE1 3.39Å; L74-F77 HydrophobicContact CD2-CD2 4.09Å; L74-F77 HydrophobicContact CD2-CE2 3.56Å; L74-F77 HydrophobicContact CD2-CZ 4.15Å; L74-F77 WeakPolarHBondContact O-CB 3.41Å; L74-F77 PolarHBondContact O-N 2.87Å; L74-F77 VanDerWaalsContact O-N 3.11Å; T75-F77 VanDerWaalsContact C-N 3.31Å; F77-L79 PolarHBondContact O-N 2.74Å; F77-M80 PolarHBondContact O-N 3.42Å; F77-M80 VanDerWaalsContact O-N 3.11Å; F77-K81 WeakPolarHBondContact O-CG 3.39Å; F77-K81 PolarHBondContact O-N 2.81Å
78	S	91	Very high	92.3	Very high	93 Å²	93	61.4 Å²	61.4	65%	0.65	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-12.1	-172.8	61.7	0	0	0	0	115.4	K82	S78-K82 WeakPolarHBondContact O-CE 3.14Å
79	L	88.5	Confident	92.3	Very high	71 Å²	71	61.2 Å²	61.2	37%	0.372	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-33.8	175.4	-169.8	49.1	0	0	0	112.3	Q41 W45 F77 K82	Q41-L79 HydrophobicContact CG-CD2 4.43Å; Q41-L79 HydrophobicContact CG-CG 4.37Å; W45-L79 HydrophobicContact CZ2-CB 4.19Å; F77-L79 PolarHBondContact O-N 2.74Å; L79-K82 HydrophobicContact CD1-CD 4.23Å; L79-K82 PolarHBondContact O-N 3.49Å
80	M	92.3	Very high	92.4	Very high	0 Å²	0	61 Å²	61	0%	0	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-65	-42.5	170.1	-167.3	53.9	62	0	0	110.6	I38 V42 W45 L74 F77 K82 L83 T84 I90	I38-M80 HydrophobicContact CG1-SD 4.29Å; I38-M80 HydrophobicContact CG2-CE 4.19Å; I38-M80 HydrophobicContact CG2-SD 4.23Å; V42-M80 HydrophobicContact CG2-CE 3.74Å; W45-M80 HydrophobicContact CH2-CB 3.98Å; W45-M80 HydrophobicContact CH2-CE 3.96Å; W45-M80 HydrophobicContact CZ3-CB 4.38Å; W45-M80 HydrophobicContact CZ3-CE 3.57Å; L74-M80 WeakPolarHBondContact O-CB 3.22Å; F77-M80 PolarHBondContact O-N 3.42Å; F77-M80 VanDerWaalsContact O-N 3.11Å; M80-K82 PolarHBondContact O-N 3.28Å; M80-L83 WeakPolarHBondContact O-CA 3.17Å; M80-L83 PolarHBondContact O-N 2.76Å; M80-T84 CarbonylContact C-O 3.54Å; M80-T84 PolarHBondContact O-N 3.21Å; M80-T84 HydrophobicContact SD-CG2 4Å; M80-I90 HydrophobicContact CG-CD1 3.81Å; M80-I90 HydrophobicContact SD-CD1 3.81Å; M80-I90 HydrophobicContact SD-CG1 4.03Å
81	K	93.5	Very high	92.4	Very high	126 Å²	126	58.4 Å²	58.4	55%	0.548	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-54	-17.2	175	-75.5	174.8	166.7	159.5	0	115.3	T75 S76 F77	T75-K81 WeakPolarHBondContact O-CE 3.44Å; T75-K81 WeakPolarHBondContact O-CG 3.49Å; S76-K81 VanDerWaalsContact O-CE 3.22Å; S76-K81 WeakPolarHBondContact O-CE 3.14Å; S76-K81 PolarHBondContact O-NZ 2.82Å; F77-K81 WeakPolarHBondContact O-CG 3.39Å; F77-K81 PolarHBondContact O-N 2.81Å
82	K	92.1	Very high	92.5	Very high	167 Å²	167	64.9 Å²	64.9	73%	0.726	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-91.9	-16.3	175.5	-63.9	175	-177.2	178.6	0	113.5	S78 L79 M80	S78-K82 WeakPolarHBondContact O-CE 3.14Å; L79-K82 HydrophobicContact CD1-CD 4.23Å; L79-K82 PolarHBondContact O-N 3.49Å; M80-K82 PolarHBondContact O-N 3.28Å
83	L	92.4	Very high	92.5	Very high	51 Å²	51	61.4 Å²	61.4	27%	0.267	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-52.1	-179.5	-60.8	176.8	0	0	0	110.8	L34 D37 I38 Q41 M80	L34-L83 HydrophobicContact CD1-CB 4Å; L34-L83 HydrophobicContact CD1-CD2 4.2Å; D37-L83 HydrophobicContact CB-CD2 4.42Å; I38-L83 HydrophobicContact CG1-CB 3.93Å; I38-L83 HydrophobicContact CG1-CD1 4.01Å; Q41-L83 HydrophobicContact CB-CD1 4.49Å; M80-L83 WeakPolarHBondContact O-CA 3.17Å; M80-L83 PolarHBondContact O-N 2.76Å
84	T	93	Very high	92.5	Very high	14 Å²	14	59.6 Å²	59.6	9%	0.086	31%	0.305	C	S	.	.			trans	-165	156.6	178.9	-173.6	0	0	0	0	112.2	I38 M80 D86 L89 I90	I38-T84 HydrophobicContact CD1-CG2 3.52Å; I38-T84 HydrophobicContact CG1-CG2 4.23Å; M80-T84 CarbonylContact C-O 3.54Å; M80-T84 PolarHBondContact O-N 3.21Å; M80-T84 HydrophobicContact SD-CG2 4Å; T84-D86 WeakPolarHBondContact OG1-CB 3.28Å; T84-D86 PolarHBondContact OG1-N 2.83Å; T84-D86 PolarHBondContact OG1-OD2 3.35Å; T84-L89 HydrophobicContact CG2-CD2 4.37Å; T84-I90 HydrophobicContact CG2-CD1 4Å; T84-I90 HydrophobicContact CG2-CG1 3.56Å
85	T	92.9	Very high	92.5	Very high	98 Å²	98	66.9 Å²	66.9	60%	0.601	34%	0.337	S	S	*	.			trans	-98.6	-7.6	165.7	42.4	0	0	0	0	113.1	T75 T87	T75-T85 VanDerWaalsContact CG2-O 3.3Å; T75-T85 WeakPolarHBondContact CG2-O 3.24Å; T85-T87 PolarHBondContact O-N 2.84Å
86	D	93.7	Very high	92.3	Very high	83 Å²	83	72.4 Å²	72.4	44%	0.444	37%	0.366	S	S	.	.			trans	-94.7	106.1	-158.5	-52	-27.6	0	0	0	111.3	T84 K88 L89 I90	T84-D86 WeakPolarHBondContact OG1-CB 3.28Å; T84-D86 PolarHBondContact OG1-N 2.83Å; T84-D86 PolarHBondContact OG1-OD2 3.35Å; D86-K88 PolarHBondContact O-N 2.83Å; D86-L89 HydrophobicContact CB-CB 3.78Å; D86-L89 WeakPolarHBondContact O-CA 3.05Å; D86-L89 WeakPolarHBondContact O-CB 3.31Å; D86-L89 PolarHBondContact O-N 2.94Å; D86-I90 PolarHBondContact O-N 2.64Å
87	T	92.9	Very high	92.3	Very high	61 Å²	61	70 Å²	70	37%	0.374	35%	0.348	S	S	.	.	H	α-helix	trans	-52.1	-41.7	178.1	54.4	0	0	0	0	112.4	L71 T75 T85 L89 I90 A91	L71-T87 HydrophobicContact CB-CG2 4.05Å; T75-T87 HydrophobicContact CG2-CG2 4.31Å; T85-T87 PolarHBondContact O-N 2.84Å; T87-L89 VanDerWaalsContact C-N 3.33Å; T87-L89 PolarHBondContact O-N 2.96Å; T87-I90 PolarHBondContact O-N 2.93Å; T87-A91 WeakPolarHBondContact O-CB 2.9Å; T87-A91 PolarHBondContact O-N 2.8Å
88	K	92.3	Very high	92.2	Very high	182 Å²	182	72.1 Å²	72.1	79%	0.791	37%	0.368	S	S	*	.	H	α-helix	trans	-62	-35.6	175.9	-62.4	-178.1	-178.7	179.4	0	113	D86 R92	D86-K88 PolarHBondContact O-N 2.83Å; K88-R92 PolarHBondContact O-N 3.29Å
89	L	92.5	Very high	92.1	Very high	34 Å²	34	69.1 Å²	69.1	18%	0.178	35%	0.346	C	S	.	.	H	α-helix	trans	-75.8	-41.8	179.5	-162.3	157.4	0	0	0	110.5	L35 I38 T84 D86 T87 R92 A93	L35-L89 HydrophobicContact CD2-CD2 3.69Å; L35-L89 HydrophobicContact CD2-CG 4.32Å; I38-L89 HydrophobicContact CD1-CD2 3.4Å; I38-L89 VanDerWaalsContact CD1-CD2 3.4Å; T84-L89 HydrophobicContact CG2-CD2 4.37Å; D86-L89 HydrophobicContact CB-CB 3.78Å; D86-L89 WeakPolarHBondContact O-CA 3.05Å; D86-L89 WeakPolarHBondContact O-CB 3.31Å; D86-L89 PolarHBondContact O-N 2.94Å; T87-L89 VanDerWaalsContact C-N 3.33Å; T87-L89 PolarHBondContact O-N 2.96Å; L89-R92 PolarHBondContact O-N 3.36Å; L89-A93 PolarHBondContact O-N 3.39Å
90	I	93.3	Very high	92.4	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-59.6	-49.9	171.9	-60.6	168.5	0	0	0	110	I38 L71 T75 M80 T84 D86 T87 R92 A93 L94	I38-I90 HydrophobicContact CG2-CB 4.42Å; I38-I90 HydrophobicContact CG2-CG1 4.19Å; I38-I90 HydrophobicContact CG2-CG2 4.23Å; L71-I90 HydrophobicContact CD1-CG2 4.43Å; L71-I90 HydrophobicContact CD2-CG2 3.93Å; T75-I90 HydrophobicContact CG2-CD1 3.56Å; M80-I90 HydrophobicContact CG-CD1 3.81Å; M80-I90 HydrophobicContact SD-CD1 3.81Å; M80-I90 HydrophobicContact SD-CG1 4.03Å; T84-I90 HydrophobicContact CG2-CD1 4Å; T84-I90 HydrophobicContact CG2-CG1 3.56Å; D86-I90 PolarHBondContact O-N 2.64Å; T87-I90 PolarHBondContact O-N 2.93Å; I90-R92 VanDerWaalsContact C-N 3.28Å; I90-R92 PolarHBondContact O-N 2.9Å; I90-A93 WeakPolarHBondContact O-CB 3.38Å; I90-A93 PolarHBondContact O-N 3.23Å; I90-L94 HydrophobicContact CG2-CD1 3.77Å; I90-L94 HydrophobicContact CG2-CG 4.28Å; I90-L94 WeakPolarHBondContact O-CG 3.21Å; I90-L94 PolarHBondContact O-N 3.01Å; I90-L94 VanDerWaalsContact O-N 3.07Å
91	A	93.8	Very high	92.3	Very high	10 Å²	10	69.5 Å²	69.5	8%	0.083	35%	0.345	C	S	.	.	H	α-helix	trans	-56.3	-41.9	176.4	0	0	0	0	0	112	L71 T87 A93 L94 K95 I102	L71-A91 HydrophobicContact CD1-CB 4.05Å; T87-A91 WeakPolarHBondContact O-CB 2.9Å; T87-A91 PolarHBondContact O-N 2.8Å; A91-A93 VanDerWaalsContact C-N 3.34Å; A91-A93 PolarHBondContact O-N 3.48Å; A91-L94 PolarHBondContact O-N 3.49Å; A91-K95 WeakPolarHBondContact O-CG 3.31Å; A91-K95 PolarHBondContact O-N 3.23Å; A91-I102 HydrophobicContact CB-CD1 4.32Å; A91-I102 WeakPolarHBondContact O-CD1 3.27Å
92	R	92.9	Very high	92.3	Very high	138 Å²	138	64.9 Å²	64.9	52%	0.521	33%	0.326	S	S	.	.	H	α-helix	trans	-62.4	-36.9	174.5	-171.8	176.3	66.7	176.7	-2.6	113	K88 L89 I90	K88-R92 PolarHBondContact O-N 3.29Å; L89-R92 PolarHBondContact O-N 3.36Å; I90-R92 VanDerWaalsContact C-N 3.28Å; I90-R92 PolarHBondContact O-N 2.9Å
93	A	93.7	Very high	92.3	Very high	10 Å²	10	59 Å²	59	8%	0.083	30%	0.303	C	S	.	.	H	α-helix	trans	-66.8	-36.7	176.5	0	0	0	0	0	112.7	L35 I38 L89 I90 A91	L35-A93 HydrophobicContact CB-CB 4.37Å; L35-A93 HydrophobicContact CD2-CB 3.81Å; I38-A93 HydrophobicContact CB-CB 4.18Å; I38-A93 HydrophobicContact CG2-CB 3.79Å; L89-A93 PolarHBondContact O-N 3.39Å; I90-A93 WeakPolarHBondContact O-CB 3.38Å; I90-A93 PolarHBondContact O-N 3.23Å; A91-A93 VanDerWaalsContact C-N 3.34Å; A91-A93 PolarHBondContact O-N 3.48Å
94	L	93.4	Very high	92.1	Very high	1 Å²	1	64.8 Å²	64.8	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-85.5	-12.1	-171.5	-60.1	177.7	0	0	0	114.8	V42 L71 I90 A91 N96 S97 V100 I102 V109	V42-L94 HydrophobicContact CB-CD1 4.47Å; V42-L94 HydrophobicContact CB-CD2 3.68Å; V42-L94 HydrophobicContact CG1-CD1 3.95Å; V42-L94 HydrophobicContact CG1-CD2 3.8Å; V42-L94 HydrophobicContact CG2-CD1 4.4Å; V42-L94 HydrophobicContact CG2-CD2 4.08Å; L71-L94 HydrophobicContact CD2-CD1 4.31Å; I90-L94 HydrophobicContact CG2-CD1 3.77Å; I90-L94 HydrophobicContact CG2-CG 4.28Å; I90-L94 WeakPolarHBondContact O-CG 3.21Å; I90-L94 PolarHBondContact O-N 3.01Å; I90-L94 VanDerWaalsContact O-N 3.07Å; A91-L94 PolarHBondContact O-N 3.49Å; L94-N96 PolarHBondContact O-N 3.04Å; L94-N96 VanDerWaalsContact O-N 3.13Å; L94-S97 WeakPolarHBondContact O-CB 3.26Å; L94-S97 PolarHBondContact O-N 3.5Å; L94-S97 VanDerWaalsContact O-N 3.09Å; L94-S97 PolarHBondContact O-OG 3.09Å; L94-V100 HydrophobicContact CB-CG2 4.45Å; L94-V100 HydrophobicContact CD2-CG2 4.13Å; L94-I102 HydrophobicContact CB-CD1 3.85Å; L94-I102 HydrophobicContact CB-CG1 4.02Å; L94-V109 HydrophobicContact CD1-CG2 4.18Å
95	K	90.6	Very high	91.8	Very high	153 Å²	153	69.7 Å²	69.7	67%	0.665	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-40	-179.6	-68.1	-162.1	174.6	-165.8	0	112.8	A91 I102	A91-K95 WeakPolarHBondContact O-CG 3.31Å; A91-K95 PolarHBondContact O-N 3.23Å; K95-I102 HydrophobicContact CG-CD1 4.05Å
96	N	88.7	Confident	91.6	Very high	138 Å²	138	66 Å²	66	74%	0.738	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	34.2	-176.1	-59	14.9	0	0	0	111.7	K39 L94	K39-N96 PolarHBondContact NZ-O 3.31Å; L94-N96 PolarHBondContact O-N 3.04Å; L94-N96 VanDerWaalsContact O-N 3.13Å
97	S	92.5	Very high	91.4	Very high	5 Å²	5	65.4 Å²	65.4	4%	0.035	34%	0.34	C	S	.	.			trans	-87.1	148.9	175.4	60.4	0	0	0	0	112.2	E43 L94 V100 K112	E43-S97 WeakPolarHBondContact OE1-CA 3.39Å; E43-S97 WeakPolarHBondContact OE1-CB 3.33Å; L94-S97 WeakPolarHBondContact O-CB 3.26Å; L94-S97 PolarHBondContact O-N 3.5Å; L94-S97 VanDerWaalsContact O-N 3.09Å; L94-S97 PolarHBondContact O-OG 3.09Å; S97-V100 WeakPolarHBondContact OG-CG2 3.48Å; S97-V100 PolarHBondContact OG-O 2.95Å; S97-K112 PolarHBondContact O-NZ 3.35Å
98	S	89.4	Confident	91.4	Very high	79 Å²	79	65.9 Å²	65.9	55%	0.552	34%	0.337	S	S	*	.	S	Bend	trans	-88.3	-33.6	177.8	53.5	0	0	0	0	112.1	E43 K112	E43-S98 PolarHBondContact OE1-N 3.26Å; E43-S98 PolarHBondContact OE1-OG 3.48Å; S98-K112 WeakPolarHBondContact O-CD 3.46Å
99	V	90.5	Very high	91.5	Very high	31 Å²	31	57.2 Å²	57.2	19%	0.188	30%	0.299	C	S	.	.	S	Bend	trans	-86	-31.4	-173.4	-174.1	0	0	0	0	113.1	E43 F46 R111 K112	E43-V99 HydrophobicContact CB-CB 4.42Å; E43-V99 HydrophobicContact CB-CG2 4.11Å; E43-V99 HydrophobicContact CG-CB 4.18Å; E43-V99 HydrophobicContact CG-CG2 4.13Å; F46-V99 HydrophobicContact CB-CG1 4.23Å; V99-R111 HydrophobicContact CG1-CG 4.35Å; V99-K112 PolarHBondContact O-N 3.16Å
100	V	93	Very high	91.4	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	159.6	-169.6	-59.4	0	0	0	0	114	V42 F46 L94 S97 V109 R110 K112	V42-V100 HydrophobicContact CG1-CG2 4.37Å; F46-V100 HydrophobicContact CB-CG1 3.49Å; F46-V100 VanDerWaalsContact CB-CG1 3.49Å; F46-V100 HydrophobicContact CD1-CG1 4.27Å; F46-V100 HydrophobicContact CD2-CG1 3.99Å; F46-V100 HydrophobicContact CG-CG1 3.66Å; L94-V100 HydrophobicContact CB-CG2 4.45Å; L94-V100 HydrophobicContact CD2-CG2 4.13Å; S97-V100 WeakPolarHBondContact OG-CG2 3.48Å; S97-V100 PolarHBondContact OG-O 2.95Å; V100-V109 HydrophobicContact CB-CG2 3.67Å; V100-V109 HydrophobicContact CG1-CG2 4.28Å; V100-V109 HydrophobicContact CG2-CG2 3.84Å; V100-R110 CarbonylContact C-O 3.55Å; V100-R110 VanDerWaalsContact CA-O 3.24Å; V100-R110 WeakPolarHBondContact CA-O 3.46Å; V100-R110 VanDerWaalsContact CB-O 3.28Å; V100-R110 WeakPolarHBondContact CB-O 3.41Å; V100-K112 VanDerWaalsContact O-CD 3.31Å; V100-K112 WeakPolarHBondContact O-CD 3.36Å; V100-K112 WeakPolarHBondContact O-CE 3.45Å; V100-K112 PolarHBondContact O-NZ 3.46Å
101	Q	91.9	Very high	91.4	Very high	79 Å²	79	61.2 Å²	61.2	37%	0.369	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	140.5	176.2	-178.6	179.1	36.2	0	0	108.8	V109 R110 K112	Q101-V109 CarbonylContact O-C 3.57Å; Q101-V109 WeakPolarHBondContact O-CA 3.31Å; Q101-V109 WeakPolarHBondContact O-CG2 3.27Å; Q101-R110 HydrophobicContact CB-CG 4.3Å; Q101-R110 PolarHBondContact N-O 3.49Å; Q101-R110 PolarHBondContact O-N 3.22Å; Q101-K112 HydrophobicContact CB-CG 3.8Å
102	I	93.1	Very high	91.2	Very high	29 Å²	29	65.2 Å²	65.2	15%	0.149	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	148.2	176.3	-35.1	171.5	0	0	0	108.7	A91 L94 K95 K108	A91-I102 HydrophobicContact CB-CD1 4.32Å; A91-I102 WeakPolarHBondContact O-CD1 3.27Å; L94-I102 HydrophobicContact CB-CD1 3.85Å; L94-I102 HydrophobicContact CB-CG1 4.02Å; K95-I102 HydrophobicContact CG-CD1 4.05Å; I102-K108 CarbonylContact C-O 3.59Å; I102-K108 WeakPolarHBondContact CA-O 3.27Å; I102-K108 WeakPolarHBondContact CG2-O 3.09Å
103	N	92	Very high	90.9	Very high	44 Å²	44	64.4 Å²	64.4	24%	0.235	33%	0.329	C	S	.	.			trans	-64.1	161.2	166.6	-165.3	29.6	0	0	0	111.4	Y68 D105 G106 K108	Y68-N103 HydrophobicContact CD1-CB 4.44Å; Y68-N103 HydrophobicContact CE1-CB 3.96Å; N103-D105 VanDerWaalsContact C-N 3.28Å; N103-D105 PolarHBondContact ND2-OD2 3.39Å; N103-D105 PolarHBondContact O-N 3.46Å; N103-G106 PolarHBondContact O-N 2.82Å; N103-K108 HydrophobicContact CB-CB 4.33Å; N103-K108 PolarHBondContact N-O 3.33Å
104	L	87.1	Confident	90.3	Very high	172 Å²	172	69.3 Å²	69.3	90%	0.901	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	-44.4	178.3	-63.9	172.9	0	0	0	112.5	G106	L104-G106 PolarHBondContact O-N 3.34Å; L104-G106 VanDerWaalsContact O-N 3.15Å
105	D	88.1	Confident	89.7	Confident	116 Å²	116	72 Å²	72	62%	0.62	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-8.9	-179.5	-30.6	-53.1	0	0	0	114	N103 T107	N103-D105 VanDerWaalsContact C-N 3.28Å; N103-D105 PolarHBondContact ND2-OD2 3.39Å; N103-D105 PolarHBondContact O-N 3.46Å; D105-T107 HydrophobicContact CB-CG2 3.98Å; D105-T107 PolarHBondContact O-N 2.85Å
106	G	87.5	Confident	89.1	Confident	21 Å²	21	66.9 Å²	66.9	22%	0.216	37%	0.365	C	S	.	.	S	Bend	trans	73.5	6.2	-174.7	0	0	0	0	0	115.3	L71 N103 L104	L71-G106 WeakPolarHBondContact CD1-O 3.4Å; N103-G106 PolarHBondContact O-N 2.82Å; L104-G106 PolarHBondContact O-N 3.34Å; L104-G106 VanDerWaalsContact O-N 3.15Å
107	T	90.7	Very high	88.6	Confident	70 Å²	70	67.6 Å²	67.6	43%	0.429	37%	0.369	S	S	.	.	S	Bend	trans	-90.5	-30.6	-170.7	51.8	0	0	0	0	115	L71 D105	L71-T107 WeakPolarHBondContact CB-O 3.22Å; L71-T107 WeakPolarHBondContact CG-O 3.15Å; L71-T107 PolarHBondContact N-O 3.3Å; D105-T107 HydrophobicContact CB-CG2 3.98Å; D105-T107 PolarHBondContact O-N 2.85Å
108	K	92.1	Very high	87.8	Confident	72 Å²	72	71.1 Å²	71.1	31%	0.313	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	153.4	-176	-47.3	-173.1	-179.6	-99.8	0	111.6	Y68 V69 D70 I102 N103	Y68-K108 HydrophobicContact CD1-CB 3.96Å; Y68-K108 HydrophobicContact CG-CB 4.32Å; V69-K108 WeakPolarHBondContact O-CA 3.4Å; D70-K108 VanDerWaalsContact CG-NZ 3.34Å; D70-K108 VanDerWaalsContact OD1-CD 3.28Å; D70-K108 WeakPolarHBondContact OD1-CD 3.33Å; D70-K108 WeakPolarHBondContact OD1-CE 3.34Å; D70-K108 VanDerWaalsContact OD1-CG 3.29Å; D70-K108 WeakPolarHBondContact OD1-CG 3.4Å; D70-K108 IonicContact OD1-NZ 2.68Å; D70-K108 PolarHBondContact OD1-NZ 2.86Å; D70-K108 IonicContact OD2-NZ 2.71Å; D70-K108 PolarHBondContact OD2-NZ 3.11Å; I102-K108 CarbonylContact C-O 3.59Å; I102-K108 WeakPolarHBondContact CA-O 3.27Å; I102-K108 WeakPolarHBondContact CG2-O 3.09Å; N103-K108 HydrophobicContact CB-CB 4.33Å; N103-K108 PolarHBondContact N-O 3.33Å
109	V	93.7	Very high	87.1	Confident	0 Å²	0	70 Å²	70	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	139.2	178.6	61.9	0	0	0	0	111.1	F46 V69 L71 L74 L94 V100 Q101	F46-V109 HydrophobicContact CE2-CG1 4.18Å; F46-V109 HydrophobicContact CZ-CG1 3.93Å; V69-V109 PolarHBondContact N-O 3.17Å; V69-V109 PolarHBondContact O-N 2.79Å; L71-V109 HydrophobicContact CD2-CB 4.08Å; L71-V109 HydrophobicContact CD2-CG1 3.71Å; L74-V109 HydrophobicContact CD1-CG1 3.83Å; L94-V109 HydrophobicContact CD1-CG2 4.18Å; V100-V109 HydrophobicContact CB-CG2 3.67Å; V100-V109 HydrophobicContact CG1-CG2 4.28Å; V100-V109 HydrophobicContact CG2-CG2 3.84Å; Q101-V109 CarbonylContact O-C 3.57Å; Q101-V109 WeakPolarHBondContact O-CA 3.31Å; Q101-V109 WeakPolarHBondContact O-CG2 3.27Å
110	R	92	Very high	86.1	Confident	85 Å²	85	76.5 Å²	76.5	32%	0.321	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	165.8	171.8	67.2	175	179.9	-173.7	2.2	111.2	G67 Y68 V100 Q101	G67-R110 WeakPolarHBondContact O-CB 3.5Å; Y68-R110 HydrophobicContact CD1-CB 3.75Å; Y68-R110 HydrophobicContact CD1-CG 3.87Å; Y68-R110 HydrophobicContact CE1-CB 4.04Å; Y68-R110 HydrophobicContact CE1-CG 3.6Å; Y68-R110 HydrophobicContact CG-CB 4.11Å; Y68-R110 HydrophobicContact CG-CG 4.47Å; Y68-R110 PolarHBondContact OH-NE 3.02Å; V100-R110 CarbonylContact C-O 3.55Å; V100-R110 VanDerWaalsContact CA-O 3.24Å; V100-R110 WeakPolarHBondContact CA-O 3.46Å; V100-R110 VanDerWaalsContact CB-O 3.28Å; V100-R110 WeakPolarHBondContact CB-O 3.41Å; Q101-R110 HydrophobicContact CB-CG 4.3Å; Q101-R110 PolarHBondContact N-O 3.49Å; Q101-R110 PolarHBondContact O-N 3.22Å
111	R	92.4	Very high	85.4	Confident	32 Å²	32	79.6 Å²	79.6	12%	0.121	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	142.3	169	-160.5	179	137.2	102.6	-0.5	109.8	F46 E48 V99 H113 P114	F46-R111 HydrophobicContact CD1-CB 4.47Å; F46-R111 PolarHBondContact O-NH1 3.42Å; E48-R111 IonicContact OE1-CZ 3.71Å; E48-R111 IonicContact OE1-NH1 2.94Å; E48-R111 IonicContact OE1-NH2 2.6Å; E48-R111 PolarHBondContact OE1-NH2 2.91Å; V99-R111 HydrophobicContact CG1-CG 4.35Å; R111-H113 WeakPolarHBondContact CD-O 3.28Å; R111-H113 VanDerWaalsContact CG-O 3.27Å; R111-H113 WeakPolarHBondContact CG-O 3.37Å; R111-H113 PolarHBondContact NE-O 2.8Å; R111-P114 PolarHBondContact NE-O 3.37Å; R111-P114 PolarHBondContact NH2-O 2.92Å
112	K	89.5	Confident	85	Confident	94 Å²	94	77 Å²	77	41%	0.409	42%	0.422	S	S	.	.	S	Bend	trans	-74.4	-47.7	179.6	-88.5	172.2	169.1	171.4	0	112.8	S97 S98 V99 V100 Q101	S97-K112 PolarHBondContact O-NZ 3.35Å; S98-K112 WeakPolarHBondContact O-CD 3.46Å; V99-K112 PolarHBondContact O-N 3.16Å; V100-K112 VanDerWaalsContact O-CD 3.31Å; V100-K112 WeakPolarHBondContact O-CD 3.36Å; V100-K112 WeakPolarHBondContact O-CE 3.45Å; V100-K112 PolarHBondContact O-NZ 3.46Å; Q101-K112 HydrophobicContact CB-CG 3.8Å
113	H	86.2	Confident	84.7	Confident	121 Å²	121	78 Å²	78	56%	0.56	43%	0.428	S	S	*	.	S	Bend	trans	-99.7	148.4	178.5	-49.3	107.6	0	0	0	108.8	R111	R111-H113 WeakPolarHBondContact CD-O 3.28Å; R111-H113 VanDerWaalsContact CG-O 3.27Å; R111-H113 WeakPolarHBondContact CG-O 3.37Å; R111-H113 PolarHBondContact NE-O 2.8Å
114	P	82.6	Confident	84.5	Confident	113 Å²	113	76.8 Å²	76.8	73%	0.734	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-59.3	166.8	172.1	26.4	-34.5	0	0	0	111.5	R111	R111-P114 PolarHBondContact NE-O 3.37Å; R111-P114 PolarHBondContact NH2-O 2.92Å
115	L	81.1	Confident	84.8	Confident	58 Å²	58	71.6 Å²	71.6	30%	0.304	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-76	128.7	164.6	-77.5	165.1	0	0	0	108.7	L51	L51-L115 HydrophobicContact CB-CD2 4.27Å; L51-L115 HydrophobicContact CD2-CD1 3.88Å; L51-L115 HydrophobicContact CD2-CD2 4.08Å; L51-L115 HydrophobicContact CD2-CG 4.23Å; L51-L115 HydrophobicContact CG-CD1 3.97Å; L51-L115 HydrophobicContact CG-CD2 4.28Å
116	G	77.8	Confident	85	Confident	46 Å²	46	66.4 Å²	66.4	47%	0.474	36%	0.364	S	S	.	.			trans	-72.6	-179.3	164.8	0	0	0	0	0	111.8	H52	H52-G116 PolarHBondContact NE2-O 3.18Å
117	N	78.1	Confident	85.2	Confident	152 Å²	152	65.4 Å²	65.4	81%	0.813	35%	0.353	S	S	*	.	P	Polyproline II helix	trans	-64	151.2	169.7	-74	-40	0	0	0	111.1
118	P	75	Confident	85.3	Confident	80 Å²	80	62.6 Å²	62.6	52%	0.519	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-58.9	127.7	175.8	24.3	-33.9	0	0	0	110.3	H52 N120	H52-P118 WeakPolarHBondContact NE2-CA 3.28Å; P118-N120 PolarHBondContact O-N 3.46Å
119	P	73.8	Confident	85.2	Confident	54 Å²	54	59.2 Å²	59.2	35%	0.351	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-67.6	117.8	-177	16.2	-22.6	0	0	0	111.4	N121 V122	P119-N121 PolarHBondContact O-N 3.44Å; P119-N121 VanDerWaalsContact O-N 3.16Å; P119-V122 HydrophobicContact CB-CG2 4.36Å; P119-V122 HydrophobicContact CG-CG2 3.82Å; P119-V122 VanDerWaalsContact O-CG2 3.3Å; P119-V122 WeakPolarHBondContact O-CG2 3.28Å; P119-V122 PolarHBondContact O-N 2.75Å
120	N	70.8	Confident	84.9	Confident	169 Å²	169	61.8 Å²	61.8	90%	0.904	33%	0.332	S	S	*	.	S	Bend	trans	-55.9	-35	-177.7	-69.7	-14.4	0	0	0	113	P118 V122	P118-N120 PolarHBondContact O-N 3.46Å; N120-V122 PolarHBondContact O-N 2.86Å
121	N	78.1	Confident	84.4	Confident	65 Å²	65	61.5 Å²	61.5	35%	0.348	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	60.5	174.5	-164.6	2.2	0	0	0	112.3	P119 S124 R125 E176	P119-N121 PolarHBondContact O-N 3.44Å; P119-N121 VanDerWaalsContact O-N 3.16Å; N121-S124 WeakPolarHBondContact OD1-CB 3.37Å; N121-S124 PolarHBondContact OD1-OG 3.48Å; N121-R125 PolarHBondContact O-NE 3.47Å; N121-R125 PolarHBondContact O-NH2 3.03Å; N121-E176 PolarHBondContact ND2-OE2 3.2Å
122	V	83.6	Confident	84.1	Confident	25 Å²	25	60.7 Å²	60.7	15%	0.152	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-36.6	162.7	161.4	0	0	0	0	110.6	P119 N120 R125 T126	P119-V122 HydrophobicContact CB-CG2 4.36Å; P119-V122 HydrophobicContact CG-CG2 3.82Å; P119-V122 VanDerWaalsContact O-CG2 3.3Å; P119-V122 WeakPolarHBondContact O-CG2 3.28Å; P119-V122 PolarHBondContact O-N 2.75Å; N120-V122 PolarHBondContact O-N 2.86Å; V122-R125 CarbonylContact O-C 3.46Å; V122-R125 PolarHBondContact O-N 3.47Å; V122-R125 VanDerWaalsContact O-N 3.16Å; V122-T126 PolarHBondContact O-N 3.4Å; V122-T126 VanDerWaalsContact O-N 3.1Å; V122-T126 PolarHBondContact O-OG1 3.02Å
123	D	86.9	Confident	83.7	Confident	50 Å²	50	58.7 Å²	58.7	27%	0.267	33%	0.332	S	S	.	.	S	Bend	trans	-72.2	-38.5	-166.6	-80.6	37.7	0	0	0	113	R125 T126 K370	D123-R125 PolarHBondContact O-N 3.01Å; D123-T126 PolarHBondContact O-N 2.99Å; D123-T126 VanDerWaalsContact O-N 3.08Å; D123-K370 HydrophobicContact CB-CD 4.17Å; D123-K370 WeakPolarHBondContact O-CB 3.36Å; D123-K370 IonicContact OD1-NZ 2.73Å; D123-K370 PolarHBondContact OD1-NZ 3.41Å; D123-K370 WeakPolarHBondContact OD2-CD 3.47Å; D123-K370 WeakPolarHBondContact OD2-CE 3.42Å; D123-K370 IonicContact OD2-NZ 2.69Å; D123-K370 PolarHBondContact OD2-NZ 2.8Å
124	S	88.6	Confident	83.4	Confident	17 Å²	17	61.7 Å²	61.7	12%	0.119	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-22	173.9	-21.9	0	0	0	0	113	N121 T126 E176 K371	N121-S124 WeakPolarHBondContact OD1-CB 3.37Å; N121-S124 PolarHBondContact OD1-OG 3.48Å; S124-T126 VanDerWaalsContact C-N 3.32Å; S124-E176 WeakPolarHBondContact CB-OE1 3.44Å; S124-E176 WeakPolarHBondContact CB-OE2 3.22Å; S124-K371 WeakPolarHBondContact OG-CE 3.26Å; S124-K371 PolarHBondContact OG-NZ 3.01Å
125	R	91.4	Very high	83.3	Confident	63 Å²	63	63.4 Å²	63.4	24%	0.238	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-4.2	171.1	-73.5	-170.2	-74.7	170.3	0.8	113.8	N121 V122 D123 E172 F173 E174 E176	N121-R125 PolarHBondContact O-NE 3.47Å; N121-R125 PolarHBondContact O-NH2 3.03Å; V122-R125 CarbonylContact O-C 3.46Å; V122-R125 PolarHBondContact O-N 3.47Å; V122-R125 VanDerWaalsContact O-N 3.16Å; D123-R125 PolarHBondContact O-N 3.01Å; R125-E172 WeakPolarHBondContact O-CA 3.48Å; R125-F173 PolarHBondContact O-N 3.33Å; R125-E174 WeakPolarHBondContact CD-O 3.24Å; R125-E174 PolarHBondContact NH1-O 2.96Å; R125-E176 HydrophobicContact CG-CB 4.11Å
126	T	92.3	Very high	83.5	Confident	7 Å²	7	61 Å²	61	4%	0.043	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	131.4	179	-48.6	0	0	0	0	111	V122 D123 S124 F170 V171 K370	V122-T126 PolarHBondContact O-N 3.4Å; V122-T126 VanDerWaalsContact O-N 3.1Å; V122-T126 PolarHBondContact O-OG1 3.02Å; D123-T126 PolarHBondContact O-N 2.99Å; D123-T126 VanDerWaalsContact O-N 3.08Å; S124-T126 VanDerWaalsContact C-N 3.32Å; T126-F170 HydrophobicContact CG2-CB 3.98Å; T126-F170 HydrophobicContact CG2-CD1 4.3Å; T126-V171 WeakPolarHBondContact CA-O 3.49Å; T126-K370 HydrophobicContact CG2-CB 4.37Å; T126-K370 HydrophobicContact CG2-CD 3.77Å; T126-K370 VanDerWaalsContact O-CB 3.24Å; T126-K370 WeakPolarHBondContact O-CB 3.33Å; T126-K370 PolarHBondContact O-N 3.2Å
127	V	92.9	Very high	84	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	136.5	178.4	179.6	0	0	0	0	109.4	V129 F170 V171 F173 A179 A182 I183 V367 L368	V127-V129 HydrophobicContact CG1-CG2 4.22Å; V127-F170 WeakPolarHBondContact O-CA 3.23Å; V127-V171 PolarHBondContact N-O 3.28Å; V127-V171 PolarHBondContact O-N 2.94Å; V127-F173 HydrophobicContact CB-CE2 4.41Å; V127-F173 HydrophobicContact CG2-CD2 4.02Å; V127-F173 HydrophobicContact CG2-CE2 3.84Å; V127-A179 HydrophobicContact CG2-CB 3.54Å; V127-A182 HydrophobicContact CG2-CB 4.47Å; V127-I183 HydrophobicContact CG1-CG1 4.22Å; V127-I183 HydrophobicContact CG2-CG1 4.48Å; V127-V367 HydrophobicContact CG1-CG1 3.22Å; V127-L368 WeakPolarHBondContact CG1-O 3.4Å
128	Y	92.4	Very high	84.5	Confident	12 Å²	12	59.6 Å²	59.6	5%	0.047	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	132.3	168.9	174.8	-105.5	0	0	0	109.8	E130 F168 F170 V367 L368 W373	Y128-E130 HydrophobicContact CD1-CB 4.38Å; Y128-E130 HydrophobicContact CE1-CB 3.61Å; Y128-E130 HydrophobicContact CE1-CG 4.27Å; Y128-E130 WeakPolarHBondContact CE1-OE1 3.26Å; Y128-E130 PolarHBondContact OH-OE1 3.14Å; Y128-F168 HydrophobicContact CD2-CD2 4.27Å; Y128-F168 HydrophobicContact CE2-CB 3.7Å; Y128-F168 AromaticContact CE2-CD2 3.5Å; Y128-F168 HydrophobicContact CE2-CD2 3.5Å; Y128-F168 HydrophobicContact CE2-CE2 4.19Å; Y128-F168 AromaticContact CE2-CG 3.73Å; Y128-F168 HydrophobicContact CE2-CG 3.73Å; Y128-F170 HydrophobicContact CD2-CD1 4.14Å; Y128-F170 AromaticContact CD2-CE1 3.61Å; Y128-F170 HydrophobicContact CD2-CE1 3.61Å; Y128-F170 AromaticContact CD2-CZ 3.97Å; Y128-F170 HydrophobicContact CD2-CZ 3.97Å; Y128-F170 HydrophobicContact CE2-CE1 4.49Å; Y128-F170 HydrophobicContact CE2-CZ 4.44Å; Y128-F170 HydrophobicContact CG-CE1 4.38Å; Y128-V367 WeakPolarHBondContact O-CA 3.29Å; Y128-L368 HydrophobicContact CD1-CB 4.44Å; Y128-L368 HydrophobicContact CD1-CD1 4.16Å; Y128-L368 PolarHBondContact N-O 3.3Å; Y128-L368 PolarHBondContact O-N 2.89Å; Y128-W373 HydrophobicContact CD1-CB 4.32Å; Y128-W373 AromaticContact CD1-CD1 3.43Å; Y128-W373 VanDerWaalsContact CD1-CD1 3.43Å; Y128-W373 HydrophobicContact CD1-CG 4.07Å; Y128-W373 AromaticContact CD2-CD1 3.4Å; Y128-W373 VanDerWaalsContact CD2-CD1 3.4Å; Y128-W373 HydrophobicContact CD2-CD2 4.2Å; Y128-W373 AromaticContact CD2-CG 3.81Å; Y128-W373 HydrophobicContact CD2-CG 3.81Å; Y128-W373 AromaticContact CD2-NE1 3.53Å; Y128-W373 AromaticContact CE1-CD1 3.46Å; Y128-W373 VanDerWaalsContact CE1-CD1 3.46Å; Y128-W373 HydrophobicContact CE1-CG 4.47Å; Y128-W373 AromaticContact CE1-NE1 3.92Å; Y128-W373 AromaticContact CE2-CD1 3.42Å; Y128-W373 VanDerWaalsContact CE2-CD1 3.42Å; Y128-W373 AromaticContact CE2-CE2 3.95Å; Y128-W373 HydrophobicContact CE2-CG 4.24Å; Y128-W373 AromaticContact CE2-NE1 3.18Å; Y128-W373 HydrophobicContact CG-CB 4.03Å; Y128-W373 AromaticContact CG-CD1 3.39Å; Y128-W373 AromaticContact CG-CG 3.69Å; Y128-W373 HydrophobicContact CG-CG 3.69Å; Y128-W373 AromaticContact CZ-CD1 3.46Å; Y128-W373 VanDerWaalsContact CZ-CD1 3.46Å; Y128-W373 AromaticContact CZ-NE1 3.4Å
129	V	90.5	Very high	85.2	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.006	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	122.7	-177.9	-173.3	0	0	0	0	109.2	V127 L132 F145 F168 A169 V171 L365 V367	V127-V129 HydrophobicContact CG1-CG2 4.22Å; V129-L132 HydrophobicContact CG1-CD1 4.49Å; V129-L132 HydrophobicContact CG1-CD2 3.76Å; V129-L132 HydrophobicContact CG1-CG 4.15Å; V129-F145 HydrophobicContact CB-CZ 4.25Å; V129-F145 HydrophobicContact CG1-CE2 4.18Å; V129-F145 HydrophobicContact CG1-CZ 3.77Å; V129-F145 HydrophobicContact CG2-CE1 3.9Å; V129-F145 HydrophobicContact CG2-CE2 4.07Å; V129-F145 HydrophobicContact CG2-CZ 3.41Å; V129-F145 VanDerWaalsContact CG2-CZ 3.41Å; V129-F168 CarbonylContact O-C 3.17Å; V129-F168 WeakPolarHBondContact O-CA 3.33Å; V129-F168 VanDerWaalsContact O-CB 3.26Å; V129-F168 WeakPolarHBondContact O-CB 3.43Å; V129-A169 PolarHBondContact N-O 3.3Å; V129-A169 PolarHBondContact O-N 2.88Å; V129-V171 HydrophobicContact CG2-CG2 3.99Å; V129-L365 HydrophobicContact CG1-CD1 4.36Å; V129-L365 HydrophobicContact CG1-CD2 4.4Å; V129-V367 HydrophobicContact CG1-CG2 4.44Å
130	E	86.7	Confident	85.9	Confident	53 Å²	53	59 Å²	59	25%	0.248	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	165.8	-176.6	-179.4	165.6	-93.9	0	0	110.8	Y128 L132 R366	Y128-E130 HydrophobicContact CD1-CB 4.38Å; Y128-E130 HydrophobicContact CE1-CB 3.61Å; Y128-E130 HydrophobicContact CE1-CG 4.27Å; Y128-E130 WeakPolarHBondContact CE1-OE1 3.26Å; Y128-E130 PolarHBondContact OH-OE1 3.14Å; E130-L132 VanDerWaalsContact C-N 3.33Å; E130-R366 HydrophobicContact CB-CB 4.25Å; E130-R366 PolarHBondContact N-O 3.48Å; E130-R366 PolarHBondContact O-N 2.99Å; E130-R366 WeakPolarHBondContact OE2-CD 3.48Å; E130-R366 IonicContact OE2-CZ 3.85Å; E130-R366 IonicContact OE2-NH1 2.88Å; E130-R366 PolarHBondContact OE2-NH1 3.01Å
131	L	82.4	Confident	86.9	Confident	80 Å²	80	51 Å²	51	42%	0.419	26%	0.263	S	S	.	.	S	Bend	trans	67.7	26.1	-172.4	-51.3	176.8	0	0	0	114.3	G167 P190 A193 P364 R366	L131-G167 PolarHBondContact N-O 3.45Å; L131-P190 HydrophobicContact CD1-CG 4.43Å; L131-A193 HydrophobicContact CD1-CB 4.2Å; L131-P364 VanDerWaalsContact CD1-O 3.29Å; L131-P364 WeakPolarHBondContact CD1-O 3.29Å; L131-R366 HydrophobicContact CD1-CB 4.35Å
132	L	85.2	Confident	87.4	Confident	14 Å²	14	51.6 Å²	51.6	7%	0.073	26%	0.264	C	S	.	.			trans	-68	132.7	176.8	-67.8	177.3	0	0	0	112.3	V129 E130 V136 W140 I141 G167 A169 L365	V129-L132 HydrophobicContact CG1-CD1 4.49Å; V129-L132 HydrophobicContact CG1-CD2 3.76Å; V129-L132 HydrophobicContact CG1-CG 4.15Å; E130-L132 VanDerWaalsContact C-N 3.33Å; L132-V136 HydrophobicContact CB-CG2 4.21Å; L132-V136 HydrophobicContact CD1-CG1 4.47Å; L132-V136 HydrophobicContact CD2-CG2 4.38Å; L132-W140 HydrophobicContact CD2-CH2 4.16Å; L132-W140 HydrophobicContact CD2-CZ3 3.68Å; L132-I141 HydrophobicContact CD1-CD1 4.38Å; L132-G167 PolarHBondContact N-O 3.1Å; L132-A169 HydrophobicContact CD1-CB 3.45Å; L132-A169 VanDerWaalsContact CD1-CB 3.45Å; L132-L365 HydrophobicContact CD2-CD2 3.86Å
133	P	82.1	Confident	87.7	Confident	53 Å²	53	58.6 Å²	58.6	34%	0.344	29%	0.287	S	S	.	.			trans	-55.3	150.4	169.9	-25.9	33.4	0	0	0	113.1	D135 V136 I363	P133-D135 PolarHBondContact O-N 2.85Å; P133-V136 HydrophobicContact CB-CG2 4.07Å; P133-V136 HydrophobicContact CG-CG2 4.27Å; P133-V136 WeakPolarHBondContact O-CB 3.33Å; P133-V136 WeakPolarHBondContact O-CG2 3.45Å; P133-V136 PolarHBondContact O-N 3.33Å; P133-I363 HydrophobicContact CG-CG2 4.31Å
134	K	78.5	Confident	87.8	Confident	183 Å²	183	57.8 Å²	57.8	80%	0.796	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-34.1	-176.6	-63.7	177.5	-174.3	169.4	0	113.2	V136	K134-V136 VanDerWaalsContact C-N 3.26Å; K134-V136 PolarHBondContact O-N 3.07Å
135	D	81.9	Confident	87.9	Confident	149 Å²	149	57 Å²	57	80%	0.797	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	14.4	-175.2	-51.7	-52.5	0	0	0	113.3	P133 T137	P133-D135 PolarHBondContact O-N 2.85Å; D135-T137 PolarHBondContact O-N 3.22Å
136	V	83.9	Confident	87.9	Confident	7 Å²	7	58.3 Å²	58.3	4%	0.042	29%	0.294	C	S	.	.			trans	-63	133.9	179.5	163	0	0	0	0	112	L132 P133 K134 W140 I141 I156	L132-V136 HydrophobicContact CB-CG2 4.21Å; L132-V136 HydrophobicContact CD1-CG1 4.47Å; L132-V136 HydrophobicContact CD2-CG2 4.38Å; P133-V136 HydrophobicContact CB-CG2 4.07Å; P133-V136 HydrophobicContact CG-CG2 4.27Å; P133-V136 WeakPolarHBondContact O-CB 3.33Å; P133-V136 WeakPolarHBondContact O-CG2 3.45Å; P133-V136 PolarHBondContact O-N 3.33Å; K134-V136 VanDerWaalsContact C-N 3.26Å; K134-V136 PolarHBondContact O-N 3.07Å; V136-W140 HydrophobicContact CB-CE3 4.44Å; V136-W140 HydrophobicContact CG1-CE3 3.87Å; V136-W140 HydrophobicContact CG1-CZ3 4.32Å; V136-W140 HydrophobicContact CG2-CD2 4.23Å; V136-W140 HydrophobicContact CG2-CE3 3.76Å; V136-W140 HydrophobicContact CG2-CH2 4.44Å; V136-W140 HydrophobicContact CG2-CZ3 3.9Å; V136-I141 HydrophobicContact CG1-CD1 3.69Å; V136-I141 HydrophobicContact CG1-CG1 3.58Å; V136-I156 HydrophobicContact CG1-CD1 4.28Å
137	T	88.8	Confident	87.7	Confident	82 Å²	82	66 Å²	66	50%	0.503	33%	0.327	S	S	.	.			trans	-119.3	155.6	177.6	53.3	0	0	0	0	110.1	D135 S139 W140 I141	D135-T137 PolarHBondContact O-N 3.22Å; T137-S139 VanDerWaalsContact C-N 3.27Å; T137-S139 PolarHBondContact O-N 2.97Å; T137-W140 WeakPolarHBondContact O-CB 2.93Å; T137-W140 PolarHBondContact O-N 3.45Å; T137-I141 PolarHBondContact O-N 2.96Å; T137-I141 VanDerWaalsContact O-N 3.17Å
138	H	89	Confident	87.4	Confident	87 Å²	87	66.6 Å²	66.6	40%	0.403	33%	0.33	S	S	.	.	H	α-helix	trans	-53.2	-45.8	178.2	-55.5	103.2	0	0	0	111.4	W140 I141 E142 I156	H138-W140 PolarHBondContact O-N 3.43Å; H138-W140 VanDerWaalsContact O-N 3.14Å; H138-I141 WeakPolarHBondContact O-CA 3.33Å; H138-I141 WeakPolarHBondContact O-CB 3.38Å; H138-I141 PolarHBondContact O-N 2.8Å; H138-E142 WeakPolarHBondContact CB-OE1 3.17Å; H138-E142 WeakPolarHBondContact O-CG 3.45Å; H138-E142 PolarHBondContact O-N 2.98Å; H138-I156 VanDerWaalsContact CD2-CD1 3.42Å; H138-I156 WeakPolarHBondContact CD2-CD1 3.49Å
139	S	88.8	Confident	87.3	Confident	66 Å²	66	66.7 Å²	66.7	46%	0.462	34%	0.335	S	S	.	.	H	α-helix	trans	-70	-6	177.2	-44.8	0	0	0	0	116.2	T137 E142 R143	T137-S139 VanDerWaalsContact C-N 3.27Å; T137-S139 PolarHBondContact O-N 2.97Å; S139-E142 VanDerWaalsContact CA-OE2 3.28Å; S139-E142 WeakPolarHBondContact CA-OE2 3.45Å; S139-E142 PolarHBondContact OG-OE2 2.76Å; S139-R143 PolarHBondContact O-NH2 3.39Å
140	W	89.4	Confident	87.4	Confident	56 Å²	56	70.6 Å²	70.6	21%	0.212	36%	0.356	C	S	.	.	H	α-helix	trans	-87.5	-44.7	163.7	177.9	94.5	0	0	0	110.5	L132 V136 T137 H138 R143 V144 I363 L365	L132-W140 HydrophobicContact CD2-CH2 4.16Å; L132-W140 HydrophobicContact CD2-CZ3 3.68Å; V136-W140 HydrophobicContact CB-CE3 4.44Å; V136-W140 HydrophobicContact CG1-CE3 3.87Å; V136-W140 HydrophobicContact CG1-CZ3 4.32Å; V136-W140 HydrophobicContact CG2-CD2 4.23Å; V136-W140 HydrophobicContact CG2-CE3 3.76Å; V136-W140 HydrophobicContact CG2-CH2 4.44Å; V136-W140 HydrophobicContact CG2-CZ3 3.9Å; T137-W140 WeakPolarHBondContact O-CB 2.93Å; T137-W140 PolarHBondContact O-N 3.45Å; H138-W140 PolarHBondContact O-N 3.43Å; H138-W140 VanDerWaalsContact O-N 3.14Å; W140-R143 PolarHBondContact O-N 3Å; W140-V144 HydrophobicContact CD2-CG2 4.23Å; W140-V144 HydrophobicContact CE3-CG2 4.43Å; W140-V144 HydrophobicContact CH2-CG2 4.18Å; W140-V144 HydrophobicContact CZ2-CG2 3.96Å; W140-V144 HydrophobicContact CZ3-CG2 4.39Å; W140-V144 WeakPolarHBondContact O-CG2 3.42Å; W140-V144 PolarHBondContact O-N 2.73Å; W140-V144 VanDerWaalsContact O-N 3.09Å; W140-I363 HydrophobicContact CZ2-CD1 3.98Å; W140-L365 HydrophobicContact CH2-CD1 4.26Å; W140-L365 HydrophobicContact CH2-CD2 4.4Å
141	I	91	Very high	87.7	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-59.9	-51.4	176	-60.6	-176.7	0	0	0	109.9	L132 V136 T137 H138 R143 V144 F145 V154 I156 A169 V171	L132-I141 HydrophobicContact CD1-CD1 4.38Å; V136-I141 HydrophobicContact CG1-CD1 3.69Å; V136-I141 HydrophobicContact CG1-CG1 3.58Å; T137-I141 PolarHBondContact O-N 2.96Å; T137-I141 VanDerWaalsContact O-N 3.17Å; H138-I141 WeakPolarHBondContact O-CA 3.33Å; H138-I141 WeakPolarHBondContact O-CB 3.38Å; H138-I141 PolarHBondContact O-N 2.8Å; I141-R143 VanDerWaalsContact C-N 3.32Å; I141-R143 PolarHBondContact O-N 2.85Å; I141-V144 PolarHBondContact O-N 3.47Å; I141-V144 VanDerWaalsContact O-N 3.09Å; I141-F145 HydrophobicContact CG2-CD2 3.62Å; I141-F145 HydrophobicContact CG2-CE2 4.11Å; I141-F145 WeakPolarHBondContact O-CD2 3.43Å; I141-F145 PolarHBondContact O-N 3.3Å; I141-V154 HydrophobicContact CB-CG1 4.27Å; I141-V154 HydrophobicContact CD1-CG1 3.8Å; I141-V154 HydrophobicContact CG2-CG1 3.95Å; I141-V154 HydrophobicContact CG2-CG2 4.25Å; I141-I156 HydrophobicContact CD1-CD1 3.65Å; I141-I156 HydrophobicContact CD1-CG1 3.72Å; I141-A169 HydrophobicContact CD1-CB 3.76Å; I141-V171 HydrophobicContact CG2-CG2 3.58Å
142	E	90.1	Very high	88.1	Confident	78 Å²	78	67.8 Å²	67.8	36%	0.364	35%	0.346	S	S	.	.	H	α-helix	trans	-48.4	-52.9	174.2	-69.9	151.7	-152.3	0	0	110.7	H138 S139 V144 F145 T146	H138-E142 WeakPolarHBondContact CB-OE1 3.17Å; H138-E142 WeakPolarHBondContact O-CG 3.45Å; H138-E142 PolarHBondContact O-N 2.98Å; S139-E142 VanDerWaalsContact CA-OE2 3.28Å; S139-E142 WeakPolarHBondContact CA-OE2 3.45Å; S139-E142 PolarHBondContact OG-OE2 2.76Å; E142-V144 VanDerWaalsContact C-N 3.3Å; E142-V144 PolarHBondContact O-N 3.09Å; E142-F145 PolarHBondContact O-N 3.23Å; E142-T146 WeakPolarHBondContact O-CB 3.21Å; E142-T146 PolarHBondContact O-N 3.21Å; E142-T146 PolarHBondContact O-OG1 2.96Å
143	R	89.9	Confident	88.4	Confident	172 Å²	172	69.5 Å²	69.5	65%	0.649	35%	0.352	S	S	*	.	H	α-helix	trans	-61.2	-33.1	-178.8	-168.3	-174.2	-54.4	131.7	13.2	114.2	S139 W140 I141	S139-R143 PolarHBondContact O-NH2 3.39Å; W140-R143 PolarHBondContact O-N 3Å; I141-R143 VanDerWaalsContact C-N 3.32Å; I141-R143 PolarHBondContact O-N 2.85Å
144	V	88.3	Confident	88.9	Confident	33 Å²	33	68 Å²	68	20%	0.2	34%	0.341	C	S	.	.	H	α-helix	trans	-76.1	-53.5	177.1	172.9	0	0	0	0	110.1	W140 I141 E142 K147 L186	W140-V144 HydrophobicContact CD2-CG2 4.23Å; W140-V144 HydrophobicContact CE3-CG2 4.43Å; W140-V144 HydrophobicContact CH2-CG2 4.18Å; W140-V144 HydrophobicContact CZ2-CG2 3.96Å; W140-V144 HydrophobicContact CZ3-CG2 4.39Å; W140-V144 WeakPolarHBondContact O-CG2 3.42Å; W140-V144 PolarHBondContact O-N 2.73Å; W140-V144 VanDerWaalsContact O-N 3.09Å; I141-V144 PolarHBondContact O-N 3.47Å; I141-V144 VanDerWaalsContact O-N 3.09Å; E142-V144 VanDerWaalsContact C-N 3.3Å; E142-V144 PolarHBondContact O-N 3.09Å; V144-K147 WeakPolarHBondContact O-CB 3.41Å; V144-K147 PolarHBondContact O-N 3.27Å; V144-L186 HydrophobicContact CG1-CD1 3.96Å; V144-L186 HydrophobicContact CG1-CD2 4.25Å
145	F	89.9	Confident	89.5	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-81	-19.3	-170.4	-73	-86.3	0	0	0	114.1	V129 I141 E142 K147 C148 G149 V151 V171 F173 A182 L186 L365 V367	V129-F145 HydrophobicContact CB-CZ 4.25Å; V129-F145 HydrophobicContact CG1-CE2 4.18Å; V129-F145 HydrophobicContact CG1-CZ 3.77Å; V129-F145 HydrophobicContact CG2-CE1 3.9Å; V129-F145 HydrophobicContact CG2-CE2 4.07Å; V129-F145 HydrophobicContact CG2-CZ 3.41Å; V129-F145 VanDerWaalsContact CG2-CZ 3.41Å; I141-F145 HydrophobicContact CG2-CD2 3.62Å; I141-F145 HydrophobicContact CG2-CE2 4.11Å; I141-F145 WeakPolarHBondContact O-CD2 3.43Å; I141-F145 PolarHBondContact O-N 3.3Å; E142-F145 PolarHBondContact O-N 3.23Å; F145-K147 PolarHBondContact O-N 3.41Å; F145-K147 VanDerWaalsContact O-N 3.15Å; F145-C148 PolarHBondContact O-N 2.83Å; F145-G149 PolarHBondContact O-N 3.17Å; F145-V151 HydrophobicContact CB-CG2 3.79Å; F145-V171 HydrophobicContact CB-CG1 4.17Å; F145-V171 HydrophobicContact CD2-CG2 4.25Å; F145-V171 HydrophobicContact CE2-CG2 4.43Å; F145-V171 HydrophobicContact CG-CG1 4.25Å; F145-V171 HydrophobicContact CG-CG2 4.37Å; F145-F173 HydrophobicContact CB-CE1 4.47Å; F145-F173 HydrophobicContact CB-CZ 4Å; F145-F173 HydrophobicContact CD1-CE2 4.49Å; F145-F173 AromaticContact CD1-CZ 3.98Å; F145-F173 HydrophobicContact CD1-CZ 3.98Å; F145-F173 HydrophobicContact CG-CZ 4.44Å; F145-A182 HydrophobicContact CD1-CB 4.13Å; F145-A182 HydrophobicContact CE1-CB 4.4Å; F145-L186 HydrophobicContact CD1-CD1 3.51Å; F145-L186 HydrophobicContact CE1-CD1 3.37Å; F145-L186 HydrophobicContact CG-CD1 4.16Å; F145-L186 HydrophobicContact CZ-CD1 3.9Å; F145-L365 HydrophobicContact CE2-CD1 4.49Å; F145-L365 HydrophobicContact CZ-CD1 4.34Å; F145-V367 HydrophobicContact CE1-CG1 4.42Å; F145-V367 HydrophobicContact CZ-CG2 4.5Å
146	T	90.9	Very high	90	Very high	91 Å²	91	54.8 Å²	54.8	56%	0.558	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-20.7	168.7	-70.5	0	0	0	0	113	E142 C148 G149	E142-T146 WeakPolarHBondContact O-CB 3.21Å; E142-T146 PolarHBondContact O-N 3.21Å; E142-T146 PolarHBondContact O-OG1 2.96Å; T146-C148 PolarHBondContact O-N 3.29Å; T146-G149 WeakPolarHBondContact CA-O 3.3Å
147	K	88.5	Confident	90.3	Very high	169 Å²	169	55.6 Å²	55.6	74%	0.735	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-26.1	170.9	-65.7	-175	176.2	-174.3	0	113.3	V144 F145	V144-K147 WeakPolarHBondContact O-CB 3.41Å; V144-K147 PolarHBondContact O-N 3.27Å; F145-K147 PolarHBondContact O-N 3.41Å; F145-K147 VanDerWaalsContact O-N 3.15Å
148	C	87.5	Confident	90.2	Very high	12 Å²	12	57.9 Å²	57.9	8%	0.081	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	-24	-174.2	-56.9	0	0	0	0	112.9	F145 T146 A182	F145-C148 PolarHBondContact O-N 2.83Å; T146-C148 PolarHBondContact O-N 3.29Å; C148-A182 HydrophobicContact CB-CB 3.82Å
149	G	90.9	Very high	90	Very high	14 Å²	14	59 Å²	59	14%	0.144	29%	0.288	C	S	.	.	S	Bend	trans	174.7	-175.9	177.5	0	0	0	0	0	114.9	F145 T146 V151	F145-G149 PolarHBondContact O-N 3.17Å; T146-G149 WeakPolarHBondContact CA-O 3.3Å; G149-V151 PolarHBondContact O-N 2.82Å
150	N	92.1	Very high	89.7	Confident	84 Å²	84	68.2 Å²	68.2	45%	0.449	31%	0.313	S	S	.	.			trans	-79.5	111	177.7	-172	20.1	0	0	0	109.9	V152 F173 E174 Q178	N150-V152 PolarHBondContact O-N 2.99Å; N150-F173 WeakPolarHBondContact O-CA 3.44Å; N150-E174 HydrophobicContact CB-CB 4.17Å; N150-E174 WeakPolarHBondContact CB-OE2 3.32Å; N150-E174 PolarHBondContact ND2-OE2 3.34Å; N150-E174 PolarHBondContact O-N 3.3Å; N150-E174 VanDerWaalsContact O-N 3.13Å; N150-Q178 VanDerWaalsContact N-OE1 3.13Å
151	V	92.4	Very high	89.4	Confident	26 Å²	26	70.7 Å²	70.7	16%	0.158	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	110.7	-179.4	177.6	0	0	0	0	109.1	F145 G149 V154 V171 F173	F145-V151 HydrophobicContact CB-CG2 3.79Å; G149-V151 PolarHBondContact O-N 2.82Å; V151-V154 HydrophobicContact CG1-CG2 3.49Å; V151-V154 VanDerWaalsContact CG1-CG2 3.49Å; V151-V171 HydrophobicContact CB-CG1 4.48Å; V151-V171 HydrophobicContact CG1-CG1 3.75Å; V151-V171 HydrophobicContact CG2-CG1 3.96Å; V151-F173 HydrophobicContact CG2-CD1 4.22Å; V151-F173 HydrophobicContact CG2-CE1 3.69Å; V151-F173 HydrophobicContact CG2-CZ 4.23Å
152	V	90.9	Very high	89	Confident	48 Å²	48	75 Å²	75	29%	0.291	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	-32	-176.5	-175.3	0	0	0	0	111.7	F44 V49 N150 E172 E174	F44-V152 WeakPolarHBondContact CE2-O 3.33Å; V49-V152 HydrophobicContact CB-CG1 3.91Å; V49-V152 HydrophobicContact CG1-CG1 4.25Å; V49-V152 HydrophobicContact CG2-CG1 3.68Å; N150-V152 PolarHBondContact O-N 2.99Å; V152-E172 PolarHBondContact N-O 3.14Å; V152-E174 HydrophobicContact CG2-CB 3.79Å
153	Y	91.7	Very high	88.5	Confident	50 Å²	50	73 Å²	73	20%	0.196	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	140.6	-179.9	-176.8	-88.1	0	0	0	112.5	F44 V49 K53 E172	F44-Y153 HydrophobicContact CE2-CD2 4.01Å; F44-Y153 AromaticContact CZ-CD2 3.71Å; F44-Y153 HydrophobicContact CZ-CD2 3.71Å; F44-Y153 HydrophobicContact CZ-CE2 4.09Å; V49-Y153 VanDerWaalsContact CG1-CB 3.49Å; V49-Y153 HydrophobicContact CG1-CD2 4.27Å; V49-Y153 HydrophobicContact CG1-CG 4Å; K53-Y153 HydrophobicContact CD-CD1 4.23Å; K53-Y153 HydrophobicContact CD-CD2 4.42Å; K53-Y153 HydrophobicContact CD-CE1 3.76Å; K53-Y153 HydrophobicContact CD-CE2 3.99Å; Y153-E172 PolarHBondContact N-O 2.89Å; Y153-E172 PolarHBondContact O-N 3.38Å
154	V	92.8	Very high	88.1	Confident	21 Å²	21	69.1 Å²	69.1	13%	0.127	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	129.7	177.4	-178.3	0	0	0	0	109.8	I141 V151 I156	I141-V154 HydrophobicContact CB-CG1 4.27Å; I141-V154 HydrophobicContact CD1-CG1 3.8Å; I141-V154 HydrophobicContact CG2-CG1 3.95Å; I141-V154 HydrophobicContact CG2-CG2 4.25Å; V151-V154 HydrophobicContact CG1-CG2 3.49Å; V151-V154 VanDerWaalsContact CG1-CG2 3.49Å; V154-I156 HydrophobicContact CG1-CG1 4.14Å
155	S	91.3	Very high	87.9	Confident	37 Å²	37	68.6 Å²	68.6	26%	0.259	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	122.7	172.5	-166.5	0	0	0	0	110	P157 A169 F170	S155-P157 WeakPolarHBondContact O-CD 3.39Å; S155-A169 CarbonylContact O-C 3.57Å; S155-A169 WeakPolarHBondContact O-CA 3.49Å; S155-A169 VanDerWaalsContact O-CB 3.26Å; S155-A169 WeakPolarHBondContact O-CB 3.45Å; S155-F170 PolarHBondContact N-O 3.31Å; S155-F170 PolarHBondContact O-N 2.83Å
156	I	91.8	Very high	87.6	Confident	17 Å²	17	72.5 Å²	72.5	9%	0.087	37%	0.374	C	S	.	.			trans	-113.5	90.1	172	-51.4	177.3	0	0	0	108.8	V136 H138 I141 V154 R158 A165 A169	V136-I156 HydrophobicContact CG1-CD1 4.28Å; H138-I156 VanDerWaalsContact CD2-CD1 3.42Å; H138-I156 WeakPolarHBondContact CD2-CD1 3.49Å; I141-I156 HydrophobicContact CD1-CD1 3.65Å; I141-I156 HydrophobicContact CD1-CG1 3.72Å; V154-I156 HydrophobicContact CG1-CG1 4.14Å; I156-R158 PolarHBondContact O-N 3.36Å; I156-A165 HydrophobicContact CG2-CB 4.11Å; I156-A169 HydrophobicContact CG1-CB 4.35Å
157	P	89.8	Confident	87.2	Confident	25 Å²	25	69.3 Å²	69.3	16%	0.162	36%	0.36	C	S	.	.			trans	-60	127.4	179.3	-29.3	39.8	0	0	0	112.7	S155 K166 F168 F170	S155-P157 WeakPolarHBondContact O-CD 3.39Å; P157-K166 HydrophobicContact CB-CD 3.98Å; P157-K166 WeakPolarHBondContact O-CB 3.15Å; P157-K166 VanDerWaalsContact O-CG 3.29Å; P157-K166 WeakPolarHBondContact O-CG 3.42Å; P157-K166 PolarHBondContact O-N 3.42Å; P157-F168 HydrophobicContact CB-CE2 4.03Å; P157-F168 HydrophobicContact CB-CZ 4.18Å; P157-F168 HydrophobicContact CG-CD2 4.27Å; P157-F168 HydrophobicContact CG-CE2 3.71Å; P157-F168 HydrophobicContact CG-CZ 4.34Å; P157-F170 HydrophobicContact CG-CD2 4.33Å; P157-F170 HydrophobicContact CG-CE2 4.28Å
158	R	87.1	Confident	87.3	Confident	129 Å²	129	63.2 Å²	63.2	49%	0.487	33%	0.333	S	S	.	.	B	Isolated β-bridge	trans	-109.5	158.7	178.5	-72.1	170.9	177.8	-88.7	-4.9	112.4	I156 G163 D164 K166	I156-R158 PolarHBondContact O-N 3.36Å; R158-G163 VanDerWaalsContact CD-O 3.3Å; R158-G163 WeakPolarHBondContact CD-O 3.47Å; R158-G163 WeakPolarHBondContact CG-O 3.36Å; R158-G163 PolarHBondContact NH1-O 3.45Å; R158-D164 CarbonylContact C-O 3.49Å; R158-D164 WeakPolarHBondContact CA-O 3.33Å; R158-D164 WeakPolarHBondContact CB-O 3.41Å; R158-K166 WeakPolarHBondContact O-CE 3.42Å
159	Y	84.4	Confident	87.5	Confident	111 Å²	111	62.6 Å²	62.6	44%	0.435	33%	0.329	S	S	.	.			trans	-77.5	125.5	171.4	-71	-78	0	0	0	110.3	S161 T162 G163 D164 K166	Y159-S161 PolarHBondContact O-N 2.86Å; Y159-T162 PolarHBondContact O-N 3.34Å; Y159-G163 WeakPolarHBondContact O-CA 3.44Å; Y159-G163 PolarHBondContact O-N 3.27Å; Y159-D164 HydrophobicContact CD2-CB 4.17Å; Y159-D164 PolarHBondContact N-O 3.19Å; Y159-K166 HydrophobicContact CD1-CG 4.34Å; Y159-K166 HydrophobicContact CD2-CG 3.86Å; Y159-K166 HydrophobicContact CE1-CG 4.15Å; Y159-K166 HydrophobicContact CE2-CB 4.19Å; Y159-K166 HydrophobicContact CE2-CG 3.68Å; Y159-K166 HydrophobicContact CG-CG 4.21Å
160	R	83.3	Confident	87.6	Confident	260 Å²	260	63.5 Å²	63.5	98%	0.981	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-16.7	-179.4	-173.7	169.8	178.8	164.5	1.9	113.8
161	S	82.3	Confident	87.7	Confident	108 Å²	108	59.5 Å²	59.5	76%	0.755	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-35.8	179.6	45.9	0	0	0	0	114.1	Y159	Y159-S161 PolarHBondContact O-N 2.86Å
162	T	82.9	Confident	87.7	Confident	89 Å²	89	58.6 Å²	58.6	55%	0.546	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.3	-15.9	-171.6	54.6	0	0	0	0	114	Y159 D164	Y159-T162 PolarHBondContact O-N 3.34Å; T162-D164 WeakPolarHBondContact CB-OD2 3.34Å; T162-D164 PolarHBondContact O-N 3.48Å; T162-D164 PolarHBondContact OG1-OD2 3.14Å
163	G	80	Confident	87.8	Confident	37 Å²	37	56.4 Å²	56.4	38%	0.381	29%	0.288	S	S	.	.			trans	82	-9	-175.2	0	0	0	0	0	114.9	R158 Y159	R158-G163 VanDerWaalsContact CD-O 3.3Å; R158-G163 WeakPolarHBondContact CD-O 3.47Å; R158-G163 WeakPolarHBondContact CG-O 3.36Å; R158-G163 PolarHBondContact NH1-O 3.45Å; Y159-G163 WeakPolarHBondContact O-CA 3.44Å; Y159-G163 PolarHBondContact O-N 3.27Å
164	D	81.3	Confident	87.8	Confident	91 Å²	91	58.8 Å²	58.8	49%	0.487	30%	0.301	S	S	.	.			trans	-60.5	146.6	-179.4	-55.5	-50.1	0	0	0	112.5	R158 Y159 T162	R158-D164 CarbonylContact C-O 3.49Å; R158-D164 WeakPolarHBondContact CA-O 3.33Å; R158-D164 WeakPolarHBondContact CB-O 3.41Å; Y159-D164 HydrophobicContact CD2-CB 4.17Å; Y159-D164 PolarHBondContact N-O 3.19Å; T162-D164 WeakPolarHBondContact CB-OD2 3.34Å; T162-D164 PolarHBondContact O-N 3.48Å; T162-D164 PolarHBondContact OG1-OD2 3.14Å
165	A	84.4	Confident	87.8	Confident	21 Å²	21	62.8 Å²	62.8	17%	0.174	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-67.1	144.3	167.8	0	0	0	0	0	110.8	I156 G167	I156-A165 HydrophobicContact CG2-CB 4.11Å; A165-G167 PolarHBondContact O-N 3.45Å
166	K	82.6	Confident	87.8	Confident	82 Å²	82	64 Å²	64	36%	0.357	32%	0.318	S	S	.	.			trans	-78.5	3.7	-178.8	-67.3	-179.4	-168.8	170.3	0	115	P157 R158 Y159 F168	P157-K166 HydrophobicContact CB-CD 3.98Å; P157-K166 WeakPolarHBondContact O-CB 3.15Å; P157-K166 VanDerWaalsContact O-CG 3.29Å; P157-K166 WeakPolarHBondContact O-CG 3.42Å; P157-K166 PolarHBondContact O-N 3.42Å; R158-K166 WeakPolarHBondContact O-CE 3.42Å; Y159-K166 HydrophobicContact CD1-CG 4.34Å; Y159-K166 HydrophobicContact CD2-CG 3.86Å; Y159-K166 HydrophobicContact CE1-CG 4.15Å; Y159-K166 HydrophobicContact CE2-CB 4.19Å; Y159-K166 HydrophobicContact CE2-CG 3.68Å; Y159-K166 HydrophobicContact CG-CG 4.21Å; K166-F168 VanDerWaalsContact C-N 3.28Å; K166-F168 HydrophobicContact CB-CD1 3.63Å; K166-F168 HydrophobicContact CB-CE1 3.44Å; K166-F168 VanDerWaalsContact CB-CE1 3.44Å; K166-F168 HydrophobicContact CB-CZ 4.23Å; K166-F168 HydrophobicContact CD-CE1 3.68Å; K166-F168 HydrophobicContact CD-CZ 3.82Å; K166-F168 HydrophobicContact CG-CE1 4.22Å
167	G	84.1	Confident	87.8	Confident	25 Å²	25	67.6 Å²	67.6	26%	0.258	34%	0.335	S	S	.	.	S	Bend	trans	78.1	9.1	-173.9	0	0	0	0	0	114.7	L131 L132 A165	L131-G167 PolarHBondContact N-O 3.45Å; L132-G167 PolarHBondContact N-O 3.1Å; A165-G167 PolarHBondContact O-N 3.45Å
168	F	89.6	Confident	88	Confident	40 Å²	40	68 Å²	68	18%	0.175	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	159.2	175.4	70.8	-97.5	0	0	0	112.4	Y128 V129 P157 K166 F170	Y128-F168 HydrophobicContact CD2-CD2 4.27Å; Y128-F168 HydrophobicContact CE2-CB 3.7Å; Y128-F168 AromaticContact CE2-CD2 3.5Å; Y128-F168 HydrophobicContact CE2-CD2 3.5Å; Y128-F168 HydrophobicContact CE2-CE2 4.19Å; Y128-F168 AromaticContact CE2-CG 3.73Å; Y128-F168 HydrophobicContact CE2-CG 3.73Å; V129-F168 CarbonylContact O-C 3.17Å; V129-F168 WeakPolarHBondContact O-CA 3.33Å; V129-F168 VanDerWaalsContact O-CB 3.26Å; V129-F168 WeakPolarHBondContact O-CB 3.43Å; P157-F168 HydrophobicContact CB-CE2 4.03Å; P157-F168 HydrophobicContact CB-CZ 4.18Å; P157-F168 HydrophobicContact CG-CD2 4.27Å; P157-F168 HydrophobicContact CG-CE2 3.71Å; P157-F168 HydrophobicContact CG-CZ 4.34Å; K166-F168 VanDerWaalsContact C-N 3.28Å; K166-F168 HydrophobicContact CB-CD1 3.63Å; K166-F168 HydrophobicContact CB-CE1 3.44Å; K166-F168 VanDerWaalsContact CB-CE1 3.44Å; K166-F168 HydrophobicContact CB-CZ 4.23Å; K166-F168 HydrophobicContact CD-CE1 3.68Å; K166-F168 HydrophobicContact CD-CZ 3.82Å; K166-F168 HydrophobicContact CG-CE1 4.22Å; F168-F170 HydrophobicContact CD2-CE2 4.31Å; F168-F170 AromaticContact CE2-CE2 3.89Å; F168-F170 HydrophobicContact CE2-CE2 3.89Å; F168-F170 HydrophobicContact CE2-CZ 4.29Å
169	A	92.1	Very high	88.2	Confident	0 Å²	0	62 Å²	62	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	166.3	176.1	0	0	0	0	0	111.4	V129 L132 I141 S155 I156	V129-A169 PolarHBondContact N-O 3.3Å; V129-A169 PolarHBondContact O-N 2.88Å; L132-A169 HydrophobicContact CD1-CB 3.45Å; L132-A169 VanDerWaalsContact CD1-CB 3.45Å; I141-A169 HydrophobicContact CD1-CB 3.76Å; S155-A169 CarbonylContact O-C 3.57Å; S155-A169 WeakPolarHBondContact O-CA 3.49Å; S155-A169 VanDerWaalsContact O-CB 3.26Å; S155-A169 WeakPolarHBondContact O-CB 3.45Å; I156-A169 HydrophobicContact CG1-CB 4.35Å
170	F	93.1	Very high	88.5	Confident	33 Å²	33	61.2 Å²	61.2	15%	0.145	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	134.1	164.2	-60.4	-82.2	0	0	0	109.3	T126 V127 Y128 S155 P157 F168 W373	T126-F170 HydrophobicContact CG2-CB 3.98Å; T126-F170 HydrophobicContact CG2-CD1 4.3Å; V127-F170 WeakPolarHBondContact O-CA 3.23Å; Y128-F170 HydrophobicContact CD2-CD1 4.14Å; Y128-F170 AromaticContact CD2-CE1 3.61Å; Y128-F170 HydrophobicContact CD2-CE1 3.61Å; Y128-F170 AromaticContact CD2-CZ 3.97Å; Y128-F170 HydrophobicContact CD2-CZ 3.97Å; Y128-F170 HydrophobicContact CE2-CE1 4.49Å; Y128-F170 HydrophobicContact CE2-CZ 4.44Å; Y128-F170 HydrophobicContact CG-CE1 4.38Å; S155-F170 PolarHBondContact N-O 3.31Å; S155-F170 PolarHBondContact O-N 2.83Å; P157-F170 HydrophobicContact CG-CD2 4.33Å; P157-F170 HydrophobicContact CG-CE2 4.28Å; F168-F170 HydrophobicContact CD2-CE2 4.31Å; F168-F170 AromaticContact CE2-CE2 3.89Å; F168-F170 HydrophobicContact CE2-CE2 3.89Å; F168-F170 HydrophobicContact CE2-CZ 4.29Å; F170-W373 AromaticContact CE1-CD2 3.91Å; F170-W373 HydrophobicContact CE1-CD2 3.91Å; F170-W373 AromaticContact CE1-CE3 3.8Å; F170-W373 HydrophobicContact CE1-CE3 3.8Å; F170-W373 HydrophobicContact CE1-CH2 4.3Å; F170-W373 HydrophobicContact CE1-CZ2 4.41Å; F170-W373 AromaticContact CE1-CZ3 4Å; F170-W373 HydrophobicContact CE1-CZ3 4Å; F170-W373 HydrophobicContact CZ-CD2 4.08Å; F170-W373 AromaticContact CZ-CE2 3.93Å; F170-W373 AromaticContact CZ-CE3 3.98Å; F170-W373 HydrophobicContact CZ-CE3 3.98Å; F170-W373 AromaticContact CZ-CH2 3.63Å; F170-W373 HydrophobicContact CZ-CH2 3.63Å; F170-W373 AromaticContact CZ-CZ2 3.73Å; F170-W373 HydrophobicContact CZ-CZ2 3.73Å; F170-W373 AromaticContact CZ-CZ3 3.76Å; F170-W373 HydrophobicContact CZ-CZ3 3.76Å
171	V	93.6	Very high	88.9	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	123	178	-176.1	0	0	0	0	107.8	T126 V127 V129 I141 F145 V151 F173	T126-V171 WeakPolarHBondContact CA-O 3.49Å; V127-V171 PolarHBondContact N-O 3.28Å; V127-V171 PolarHBondContact O-N 2.94Å; V129-V171 HydrophobicContact CG2-CG2 3.99Å; I141-V171 HydrophobicContact CG2-CG2 3.58Å; F145-V171 HydrophobicContact CB-CG1 4.17Å; F145-V171 HydrophobicContact CD2-CG2 4.25Å; F145-V171 HydrophobicContact CE2-CG2 4.43Å; F145-V171 HydrophobicContact CG-CG1 4.25Å; F145-V171 HydrophobicContact CG-CG2 4.37Å; V151-V171 HydrophobicContact CB-CG1 4.48Å; V151-V171 HydrophobicContact CG1-CG1 3.75Å; V151-V171 HydrophobicContact CG2-CG1 3.96Å; V171-F173 HydrophobicContact CB-CE2 4.42Å; V171-F173 HydrophobicContact CG1-CD2 4.41Å; V171-F173 HydrophobicContact CG1-CE2 3.83Å; V171-F173 HydrophobicContact CG1-CZ 3.96Å
172	E	92.9	Very high	89.2	Confident	7 Å²	7	48.3 Å²	48.3	3%	0.033	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	128.6	178.7	-173.2	176.7	150.6	0	0	110.3	V49 K53 R125 V152 Y153	V49-E172 VanDerWaalsContact CG1-OE1 3.24Å; V49-E172 WeakPolarHBondContact CG1-OE1 3.36Å; K53-E172 IonicContact NZ-OE2 2.88Å; K53-E172 PolarHBondContact NZ-OE2 2.91Å; R125-E172 WeakPolarHBondContact O-CA 3.48Å; V152-E172 PolarHBondContact N-O 3.14Å; Y153-E172 PolarHBondContact N-O 2.89Å; Y153-E172 PolarHBondContact O-N 3.38Å
173	F	93.6	Very high	89.5	Confident	1 Å²	1	45.7 Å²	45.7	0%	0.004	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	161.5	-179.5	-70.7	-84	0	0	0	112	R125 V127 F145 N150 V151 V171 K175 Q178 A179 A182	R125-F173 PolarHBondContact O-N 3.33Å; V127-F173 HydrophobicContact CB-CE2 4.41Å; V127-F173 HydrophobicContact CG2-CD2 4.02Å; V127-F173 HydrophobicContact CG2-CE2 3.84Å; F145-F173 HydrophobicContact CB-CE1 4.47Å; F145-F173 HydrophobicContact CB-CZ 4Å; F145-F173 HydrophobicContact CD1-CE2 4.49Å; F145-F173 AromaticContact CD1-CZ 3.98Å; F145-F173 HydrophobicContact CD1-CZ 3.98Å; F145-F173 HydrophobicContact CG-CZ 4.44Å; N150-F173 WeakPolarHBondContact O-CA 3.44Å; V151-F173 HydrophobicContact CG2-CD1 4.22Å; V151-F173 HydrophobicContact CG2-CE1 3.69Å; V151-F173 HydrophobicContact CG2-CZ 4.23Å; V171-F173 HydrophobicContact CB-CE2 4.42Å; V171-F173 HydrophobicContact CG1-CD2 4.41Å; V171-F173 HydrophobicContact CG1-CE2 3.83Å; V171-F173 HydrophobicContact CG1-CZ 3.96Å; F173-K175 VanDerWaalsContact C-N 3.35Å; F173-Q178 HydrophobicContact CB-CB 3.83Å; F173-Q178 HydrophobicContact CD1-CB 3.78Å; F173-Q178 HydrophobicContact CG-CB 3.89Å; F173-A179 HydrophobicContact CD2-CB 4.01Å; F173-A182 HydrophobicContact CE2-CB 3.69Å; F173-A182 HydrophobicContact CZ-CB 3.66Å
174	E	90.9	Very high	89.8	Confident	100 Å²	100	51 Å²	51	47%	0.467	25%	0.247	S	C	.	.	S	Bend	trans	-66.2	-38.6	176.1	-172.1	171.5	-161.1	0	0	112	R125 N150 V152	R125-E174 WeakPolarHBondContact CD-O 3.24Å; R125-E174 PolarHBondContact NH1-O 2.96Å; N150-E174 HydrophobicContact CB-CB 4.17Å; N150-E174 WeakPolarHBondContact CB-OE2 3.32Å; N150-E174 PolarHBondContact ND2-OE2 3.34Å; N150-E174 PolarHBondContact O-N 3.3Å; N150-E174 VanDerWaalsContact O-N 3.13Å; V152-E174 HydrophobicContact CG2-CB 3.79Å
175	K	91.9	Very high	89.8	Confident	106 Å²	106	52 Å²	52	46%	0.461	25%	0.25	S	C	.	.	S	Bend	trans	-123.5	154.6	-179	-66.7	-168.5	170.2	-162.8	0	113.2	F173 E177 Q178 A179	F173-K175 VanDerWaalsContact C-N 3.35Å; K175-E177 IonicContact NZ-OE1 3.81Å; K175-E177 PolarHBondContact NZ-OE1 2.85Å; K175-Q178 HydrophobicContact CB-CG 4.17Å; K175-Q178 WeakPolarHBondContact O-CB 3.44Å; K175-Q178 PolarHBondContact O-N 2.83Å; K175-A179 PolarHBondContact O-N 3.08Å
176	E	91.6	Very high	89.7	Confident	61 Å²	61	52.4 Å²	52.4	29%	0.285	25%	0.249	S	C	.	.	H	α-helix	trans	-69.1	-38.4	177.6	-174.6	161.6	174.2	0	0	112	N121 S124 R125 Q178 A179 Q180	N121-E176 PolarHBondContact ND2-OE2 3.2Å; S124-E176 WeakPolarHBondContact CB-OE1 3.44Å; S124-E176 WeakPolarHBondContact CB-OE2 3.22Å; R125-E176 HydrophobicContact CG-CB 4.11Å; E176-Q178 PolarHBondContact O-N 3.46Å; E176-Q178 VanDerWaalsContact O-N 3.13Å; E176-A179 WeakPolarHBondContact O-CB 3.37Å; E176-A179 PolarHBondContact O-N 2.96Å; E176-Q180 PolarHBondContact O-N 3.4Å
177	E	92.8	Very high	89.6	Confident	93 Å²	93	51.2 Å²	51.2	44%	0.435	25%	0.247	S	C	.	.	H	α-helix	trans	-51.7	-35.2	171.5	-56.2	162.9	-131.3	0	0	113.2	K175 K181	K175-E177 IonicContact NZ-OE1 3.81Å; K175-E177 PolarHBondContact NZ-OE1 2.85Å; E177-K181 WeakPolarHBondContact O-CB 3.36Å; E177-K181 WeakPolarHBondContact O-CD 3.48Å; E177-K181 VanDerWaalsContact O-CG 3.26Å; E177-K181 WeakPolarHBondContact O-CG 3.27Å; E177-K181 PolarHBondContact O-N 3.42Å
178	Q	93.2	Very high	89.1	Confident	35 Å²	35	53.8 Å²	53.8	16%	0.164	26%	0.255	C	S	.	.	H	α-helix	trans	-76.6	-34.3	-178.7	-69.5	173.1	-6.3	0	0	111.5	N150 F173 K175 E176 A182	N150-Q178 VanDerWaalsContact N-OE1 3.13Å; F173-Q178 HydrophobicContact CB-CB 3.83Å; F173-Q178 HydrophobicContact CD1-CB 3.78Å; F173-Q178 HydrophobicContact CG-CB 3.89Å; K175-Q178 HydrophobicContact CB-CG 4.17Å; K175-Q178 WeakPolarHBondContact O-CB 3.44Å; K175-Q178 PolarHBondContact O-N 2.83Å; E176-Q178 PolarHBondContact O-N 3.46Å; E176-Q178 VanDerWaalsContact O-N 3.13Å; Q178-A182 WeakPolarHBondContact O-CB 3.2Å; Q178-A182 PolarHBondContact O-N 2.82Å
179	A	91.9	Very high	87.9	Confident	1 Å²	1	55 Å²	55	1%	0.008	27%	0.267	C	S	.	.	H	α-helix	trans	-66.4	-42.7	172.1	0	0	0	0	0	111.1	V127 F173 K175 E176 A182 I183	V127-A179 HydrophobicContact CG2-CB 3.54Å; F173-A179 HydrophobicContact CD2-CB 4.01Å; K175-A179 PolarHBondContact O-N 3.08Å; E176-A179 WeakPolarHBondContact O-CB 3.37Å; E176-A179 PolarHBondContact O-N 2.96Å; A179-A182 PolarHBondContact O-N 3.23Å; A179-I183 WeakPolarHBondContact O-CG1 3.1Å; A179-I183 PolarHBondContact O-N 3.32Å; A179-I183 VanDerWaalsContact O-N 3.09Å
180	Q	90.8	Very high	86.3	Confident	95 Å²	95	57.3 Å²	57.3	44%	0.444	28%	0.281	S	S	.	.	H	α-helix	trans	-61.6	-50.5	174.7	-69.4	169.4	-11.7	0	0	111.5	E176 A182 I183 E184	E176-Q180 PolarHBondContact O-N 3.4Å; Q180-A182 VanDerWaalsContact C-N 3.25Å; Q180-A182 PolarHBondContact O-N 3.39Å; Q180-I183 WeakPolarHBondContact O-CA 3.44Å; Q180-I183 WeakPolarHBondContact O-CB 3.2Å; Q180-I183 PolarHBondContact O-N 2.84Å; Q180-E184 PolarHBondContact O-N 2.76Å
181	K	91.1	Very high	84.5	Confident	98 Å²	98	65.4 Å²	65.4	43%	0.426	32%	0.32	S	S	.	.	H	α-helix	trans	-59.1	-33.7	175.1	-73.4	164.9	-175.4	167.3	0	113.1	E177 M185	E177-K181 WeakPolarHBondContact O-CB 3.36Å; E177-K181 WeakPolarHBondContact O-CD 3.48Å; E177-K181 VanDerWaalsContact O-CG 3.26Å; E177-K181 WeakPolarHBondContact O-CG 3.27Å; E177-K181 PolarHBondContact O-N 3.42Å; K181-M185 VanDerWaalsContact O-CB 3.26Å; K181-M185 WeakPolarHBondContact O-CB 3.36Å; K181-M185 WeakPolarHBondContact O-CG 3.41Å; K181-M185 PolarHBondContact O-N 3.06Å
182	A	89.3	Confident	82.5	Confident	0 Å²	0	72.7 Å²	72.7	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-68.2	-35.3	173.9	0	0	0	0	0	112.7	V127 F145 C148 F173 Q178 A179 Q180 L186	V127-A182 HydrophobicContact CG2-CB 4.47Å; F145-A182 HydrophobicContact CD1-CB 4.13Å; F145-A182 HydrophobicContact CE1-CB 4.4Å; C148-A182 HydrophobicContact CB-CB 3.82Å; F173-A182 HydrophobicContact CE2-CB 3.69Å; F173-A182 HydrophobicContact CZ-CB 3.66Å; Q178-A182 WeakPolarHBondContact O-CB 3.2Å; Q178-A182 PolarHBondContact O-N 2.82Å; A179-A182 PolarHBondContact O-N 3.23Å; Q180-A182 VanDerWaalsContact C-N 3.25Å; Q180-A182 PolarHBondContact O-N 3.39Å; A182-L186 VanDerWaalsContact O-CB 3.29Å; A182-L186 WeakPolarHBondContact O-CB 3.48Å; A182-L186 PolarHBondContact O-N 2.86Å
183	I	88	Confident	80.4	Confident	33 Å²	33	73.5 Å²	73.5	17%	0.169	37%	0.366	C	S	.	.	H	α-helix	trans	-67	-52.1	172.9	-65	159.1	0	0	0	109.6	V127 A179 Q180 M185 N187 V367	V127-I183 HydrophobicContact CG1-CG1 4.22Å; V127-I183 HydrophobicContact CG2-CG1 4.48Å; A179-I183 WeakPolarHBondContact O-CG1 3.1Å; A179-I183 PolarHBondContact O-N 3.32Å; A179-I183 VanDerWaalsContact O-N 3.09Å; Q180-I183 WeakPolarHBondContact O-CA 3.44Å; Q180-I183 WeakPolarHBondContact O-CB 3.2Å; Q180-I183 PolarHBondContact O-N 2.84Å; I183-M185 PolarHBondContact O-N 3.44Å; I183-N187 WeakPolarHBondContact O-CB 2.95Å; I183-N187 PolarHBondContact O-N 2.83Å; I183-V367 HydrophobicContact CG1-CG1 4.07Å
184	E	86.6	Confident	78.3	Confident	149 Å²	149	76.9 Å²	76.9	70%	0.696	39%	0.389	S	S	*	.	H	α-helix	trans	-58.4	-45.8	-179.6	-68.6	168.7	176.9	0	0	113.2	Q180	Q180-E184 PolarHBondContact O-N 2.76Å
185	M	82.6	Confident	76.1	Confident	111 Å²	111	84.3 Å²	84.3	55%	0.547	41%	0.412	S	S	.	.	H	α-helix	trans	-82.5	-26.8	-174	-66.1	178.9	72.1	0	0	114.5	K181 I183 N188	K181-M185 VanDerWaalsContact O-CB 3.26Å; K181-M185 WeakPolarHBondContact O-CB 3.36Å; K181-M185 WeakPolarHBondContact O-CG 3.41Å; K181-M185 PolarHBondContact O-N 3.06Å; I183-M185 PolarHBondContact O-N 3.44Å; M185-N188 PolarHBondContact O-ND2 3.44Å
186	L	81.5	Confident	74	Confident	30 Å²	30	85.5 Å²	85.5	16%	0.157	42%	0.417	C	S	.	.	H	α-helix	trans	-119.4	-7.7	-168.7	-57.4	172.4	0	0	0	114.3	V144 F145 A182 N188 V367	V144-L186 HydrophobicContact CG1-CD1 3.96Å; V144-L186 HydrophobicContact CG1-CD2 4.25Å; F145-L186 HydrophobicContact CD1-CD1 3.51Å; F145-L186 HydrophobicContact CE1-CD1 3.37Å; F145-L186 HydrophobicContact CG-CD1 4.16Å; F145-L186 HydrophobicContact CZ-CD1 3.9Å; A182-L186 VanDerWaalsContact O-CB 3.29Å; A182-L186 WeakPolarHBondContact O-CB 3.48Å; A182-L186 PolarHBondContact O-N 2.86Å; L186-N188 PolarHBondContact O-N 3.3Å; L186-V367 HydrophobicContact CB-CG2 3.94Å; L186-V367 WeakPolarHBondContact O-CG2 3.1Å
187	N	80.3	Confident	71.4	Confident	58 Å²	58	87.3 Å²	87.3	31%	0.31	43%	0.434	S	S	.	.			trans	-75.5	74.5	171.8	-170.1	38.6	0	0	0	110.9	I183 P189 V367	I183-N187 WeakPolarHBondContact O-CB 2.95Å; I183-N187 PolarHBondContact O-N 2.83Å; N187-P189 WeakPolarHBondContact O-CD 3.32Å; N187-V367 HydrophobicContact CB-CB 3.98Å; N187-V367 WeakPolarHBondContact CB-O 3.48Å; N187-V367 PolarHBondContact OD1-N 2.96Å; N187-V367 PolarHBondContact OD1-O 2.87Å
188	N	72.9	Confident	69.1	Low	79 Å²	79	84.6 Å²	84.6	42%	0.422	43%	0.432	S	S	.	.			trans	-109.1	68.5	172.5	-67.7	-79.8	0	0	0	109.3	M185 L186 V362 P364 L365	M185-N188 PolarHBondContact O-ND2 3.44Å; L186-N188 PolarHBondContact O-N 3.3Å; N188-V362 HydrophobicContact CB-CG1 4.09Å; N188-P364 CarbonylContact O-C 3.57Å; N188-P364 WeakPolarHBondContact O-CA 3.18Å; N188-P364 WeakPolarHBondContact O-CB 3.44Å; N188-L365 CarbonylContact C-O 3.56Å; N188-L365 PolarHBondContact N-O 3.19Å; N188-L365 PolarHBondContact O-N 2.87Å
189	P	65.3	Low	66.4	Low	66 Å²	66	88.1 Å²	88.1	43%	0.429	45%	0.451	S	S	.	.			trans	-63.3	135	173	29.6	-34.1	0	0	0	108.4	N187 R366	N187-P189 WeakPolarHBondContact O-CD 3.32Å; P189-R366 HydrophobicContact CB-CB 4.48Å
190	P	58.4	Low	63.6	Low	47 Å²	47	94.1 Å²	94.1	31%	0.305	48%	0.477	S	S	.	.			trans	-71.2	149.6	179.8	29.3	-26.7	0	0	0	109.2	L131 D192 A193 P364	L131-P190 HydrophobicContact CD1-CG 4.43Å; P190-D192 VanDerWaalsContact C-N 3.25Å; P190-D192 PolarHBondContact O-N 3.3Å; P190-A193 VanDerWaalsContact CD-CB 3.42Å; P190-A193 HydrophobicContact CG-CB 3.49Å; P190-A193 VanDerWaalsContact CG-CB 3.49Å; P190-A193 VanDerWaalsContact O-CB 3.29Å; P190-A193 WeakPolarHBondContact O-CB 3.14Å; P190-A193 PolarHBondContact O-N 3.48Å; P190-P364 HydrophobicContact CB-CB 3.72Å; P190-P364 HydrophobicContact CB-CG 3.84Å; P190-P364 HydrophobicContact CG-CB 3.74Å; P190-P364 HydrophobicContact CG-CG 3.64Å
191	E	54.4	Low	60.9	Low	204 Å²	204	94.9 Å²	94.9	95%	0.953	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-32.3	-173.5	-166.5	166.5	-153.1	0	0	113
192	D	51.4	Low	58.4	Low	153 Å²	153	97.9 Å²	97.9	82%	0.818	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	11.7	170.9	-165.9	37.5	0	0	0	113.4	P190 P194	P190-D192 VanDerWaalsContact C-N 3.25Å; P190-D192 PolarHBondContact O-N 3.3Å; D192-P194 VanDerWaalsContact O-CD 3.23Å; D192-P194 WeakPolarHBondContact O-CD 3.38Å
193	A	50.1	Low	55.9	Low	23 Å²	23	101.9 Å²	101.9	19%	0.19	53%	0.527	C	S	.	.	S	Bend	trans	-65.5	122.3	155	0	0	0	0	0	106.9	L131 P190 R195	L131-A193 HydrophobicContact CD1-CB 4.2Å; P190-A193 VanDerWaalsContact CD-CB 3.42Å; P190-A193 HydrophobicContact CG-CB 3.49Å; P190-A193 VanDerWaalsContact CG-CB 3.49Å; P190-A193 VanDerWaalsContact O-CB 3.29Å; P190-A193 WeakPolarHBondContact O-CB 3.14Å; P190-A193 PolarHBondContact O-N 3.48Å; A193-R195 PolarHBondContact O-N 3.35Å
194	P	48.8	Very low	53.6	Low	73 Å²	73	109.1 Å²	109.1	47%	0.474	57%	0.566	S	S	.	*			trans	-63.3	130.6	178.9	-21	33.5	0	0	0	109.8	D192 K196	D192-P194 VanDerWaalsContact O-CD 3.23Å; D192-P194 WeakPolarHBondContact O-CD 3.38Å; P194-K196 HydrophobicContact CB-CB 4.03Å; P194-K196 HydrophobicContact CB-CD 3.34Å; P194-K196 VanDerWaalsContact CB-CE 3.41Å; P194-K196 HydrophobicContact CB-CG 3.45Å; P194-K196 VanDerWaalsContact CB-CG 3.45Å; P194-K196 HydrophobicContact CG-CD 4.01Å; P194-K196 VanDerWaalsContact CG-NZ 3.28Å; P194-K196 PolarHBondContact O-N 2.79Å
195	R	44.7	Very low	51.4	Low	255 Å²	255	106 Å²	106	96%	0.962	56%	0.56	S	S	*	*			trans	-66.8	57.8	163.7	-56.9	-174.9	-166.2	177.3	4.9	110.4	A193 P197	A193-R195 PolarHBondContact O-N 3.35Å; R195-P197 WeakPolarHBondContact O-CD 3.2Å
196	K	47.6	Very low	49.6	Very low	131 Å²	131	113 Å²	113	57%	0.57	58%	0.581	S	S	*	*			trans	-101.3	98.2	-174.7	-78.8	175.3	-169.6	142.8	0	109.2	P194 G198 I199	P194-K196 HydrophobicContact CB-CB 4.03Å; P194-K196 HydrophobicContact CB-CD 3.34Å; P194-K196 VanDerWaalsContact CB-CE 3.41Å; P194-K196 HydrophobicContact CB-CG 3.45Å; P194-K196 VanDerWaalsContact CB-CG 3.45Å; P194-K196 HydrophobicContact CG-CD 4.01Å; P194-K196 VanDerWaalsContact CG-NZ 3.28Å; P194-K196 PolarHBondContact O-N 2.79Å; K196-G198 PolarHBondContact O-N 3.1Å; K196-I199 HydrophobicContact CB-CD1 4.4Å; K196-I199 HydrophobicContact CD-CD1 3.72Å
197	P	37.9	Very low	47.7	Very low	99 Å²	99	120.6 Å²	120.6	64%	0.643	61%	0.612	S	S	*	*	S	Bend	trans	-58.9	111.2	167.8	23.8	-33	0	0	0	110.3	R195	R195-P197 WeakPolarHBondContact O-CD 3.2Å
198	G	44.8	Very low	45.5	Very low	37 Å²	37	123.8 Å²	123.8	38%	0.381	64%	0.636	S	S	.	*			trans	71.9	79.3	163.1	0	0	0	0	0	118	K196 Y380	K196-G198 PolarHBondContact O-N 3.1Å; G198-Y380 VanDerWaalsContact CA-CE2 3.49Å; G198-Y380 VanDerWaalsContact O-CE2 3.27Å; G198-Y380 WeakPolarHBondContact O-CE2 3.34Å
199	I	35.4	Very low	43.9	Very low	109 Å²	109	126.5 Å²	126.5	56%	0.559	65%	0.649	S	S	*	*			trans	-111.1	131.6	160.2	-78	-174.9	0	0	0	106.9	K196	K196-I199 HydrophobicContact CB-CD1 4.4Å; K196-I199 HydrophobicContact CD-CD1 3.72Å
200	F	34.5	Very low	42.4	Very low	127 Å²	127	129.1 Å²	129.1	56%	0.557	67%	0.666	S	S	*	*			cis	-128.7	160.8	29.7	-82	-70.7	0	0	0	112.6	K202	F200-K202 HydrophobicContact CD1-CB 4.19Å; F200-K202 HydrophobicContact CD1-CG 3.32Å; F200-K202 HydrophobicContact CD2-CG 4.48Å; F200-K202 HydrophobicContact CE1-CB 4.49Å; F200-K202 HydrophobicContact CE1-CD 4.41Å; F200-K202 HydrophobicContact CE1-CG 3.44Å; F200-K202 VanDerWaalsContact CE1-CG 3.44Å; F200-K202 HydrophobicContact CG-CG 3.9Å; F200-K202 HydrophobicContact CZ-CG 4.08Å
201	P	32.8	Very low	41.2	Very low	110 Å²	110	136.1 Å²	136.1	71%	0.714	69%	0.692	S	S	*	*				-98.2	153.9	73.6	-20.1	35.3	0	0	0	115.1
202	K	38.5	Very low	40.2	Very low	162 Å²	162	131 Å²	131	70%	0.704	69%	0.685	S	S	*	*			trans	-83.6	108.7	171.3	-68.9	174.7	-178.7	176	0	109.5	F200	F200-K202 HydrophobicContact CD1-CB 4.19Å; F200-K202 HydrophobicContact CD1-CG 3.32Å; F200-K202 HydrophobicContact CD2-CG 4.48Å; F200-K202 HydrophobicContact CE1-CB 4.49Å; F200-K202 HydrophobicContact CE1-CD 4.41Å; F200-K202 HydrophobicContact CE1-CG 3.44Å; F200-K202 VanDerWaalsContact CE1-CG 3.44Å; F200-K202 HydrophobicContact CG-CG 3.9Å; F200-K202 HydrophobicContact CZ-CG 4.08Å
203	T	38.3	Very low	39.4	Very low	83 Å²	83	127.9 Å²	127.9	51%	0.509	68%	0.68	S	S	.	*			trans	-77.9	138	151.3	45.6	0	0	0	0	108.3	S205	T203-S205 PolarHBondContact O-N 3.32Å
204	L	38.1	Very low	38.5	Very low	186 Å²	186	134.4 Å²	134.4	97%	0.974	71%	0.711	S	S	*	*	S	Bend	trans	-83.8	45.9	-178.2	-91.2	164.3	0	0	0	112.2
205	S	40.9	Very low	38	Very low	83 Å²	83	135.8 Å²	135.8	58%	0.58	72%	0.715	S	S	*	*	S	Bend	trans	-160.9	121.5	172.2	52.2	0	0	0	0	110.6	T203 K207	T203-S205 PolarHBondContact O-N 3.32Å; S205-K207 PolarHBondContact O-N 3.2Å; S205-K207 VanDerWaalsContact O-N 3.14Å
206	R	43.8	Very low	37.8	Very low	259 Å²	259	128.8 Å²	128.8	98%	0.977	71%	0.705	S	S	*	*			trans	-81.4	87.3	179.4	-71	-174.5	179.3	-168.8	1.9	111.4
207	K	41.9	Very low	37.4	Very low	189 Å²	189	130.5 Å²	130.5	82%	0.822	72%	0.715	S	S	*	*			trans	-142.3	131.5	156.5	-69.1	-166.4	178	-174.4	0	110.1	S205	S205-K207 PolarHBondContact O-N 3.2Å; S205-K207 VanDerWaalsContact O-N 3.14Å
208	P	34	Very low	37.2	Very low	124 Å²	124	129 Å²	129	81%	0.805	71%	0.707	S	S	*	*			trans	-61.8	145.7	164.2	-18.1	31.7	0	0	0	110	P210	P208-P210 WeakPolarHBondContact O-CD 3.29Å
209	I	39.4	Very low	36.9	Very low	137 Å²	137	137.6 Å²	137.6	70%	0.703	73%	0.728	S	S	*	*			trans	-72.9	125	165.4	-59.8	173.3	0	0	0	106.7	F211	I209-F211 PolarHBondContact O-N 3.39Å; I209-F211 VanDerWaalsContact O-N 3.09Å
210	P	35.5	Very low	36.9	Very low	120 Å²	120	139.1 Å²	139.1	78%	0.779	73%	0.733	S	S	*	*			trans	-62.8	114.2	171.8	-20.3	33.1	0	0	0	109.2	P208 A212	P208-P210 WeakPolarHBondContact O-CD 3.29Å; P210-A212 PolarHBondContact O-N 2.97Å
211	F	32.9	Very low	37	Very low	194 Å²	194	138.9 Å²	138.9	85%	0.851	73%	0.733	S	S	*	*			trans	-70.8	111.5	164.4	-76.1	-89	0	0	0	107.4	I209 A213	I209-F211 PolarHBondContact O-N 3.39Å; I209-F211 VanDerWaalsContact O-N 3.09Å; F211-A213 PolarHBondContact O-N 3.13Å; F211-A213 VanDerWaalsContact O-N 3.07Å
212	A	33.3	Very low	37.3	Very low	98 Å²	98	139.3 Å²	139.3	81%	0.81	73%	0.726	S	S	*	*			trans	-60.8	111.1	158.5	0	0	0	0	0	106.8	P210 D214	P210-A212 PolarHBondContact O-N 2.97Å; A212-D214 PolarHBondContact O-N 3.37Å
213	A	33.2	Very low	37.4	Very low	86 Å²	86	139.3 Å²	139.3	71%	0.711	73%	0.726	S	S	*	*			trans	-62	128.5	173.6	0	0	0	0	0	108.4	F211 N215	F211-A213 PolarHBondContact O-N 3.13Å; F211-A213 VanDerWaalsContact O-N 3.07Å; A213-N215 VanDerWaalsContact C-N 3.28Å; A213-N215 PolarHBondContact O-N 3.21Å
214	D	32.7	Very low	37.5	Very low	160 Å²	160	142.7 Å²	142.7	86%	0.856	73%	0.734	S	S	*	*			trans	-71	91.9	172.6	-139.6	-21.6	0	0	0	106.7	A212 S216	A212-D214 PolarHBondContact O-N 3.37Å; D214-S216 PolarHBondContact O-N 3.09Å
215	N	37	Very low	37.6	Very low	102 Å²	102	140.3 Å²	140.3	55%	0.545	72%	0.715	S	S	.	*			trans	-80.4	70.7	-163.1	-173.7	3.3	0	0	0	111.3	A213 Q217 S218	A213-N215 VanDerWaalsContact C-N 3.28Å; A213-N215 PolarHBondContact O-N 3.21Å; N215-Q217 VanDerWaalsContact C-N 3.28Å; N215-Q217 PolarHBondContact O-N 3.22Å; N215-S218 PolarHBondContact ND2-OG 3.25Å; N215-S218 WeakPolarHBondContact OD1-CB 3.45Å; N215-S218 PolarHBondContact OD1-N 3.14Å; N215-S218 PolarHBondContact OD1-OG 2.59Å
216	S	41.8	Very low	37.6	Very low	108 Å²	108	145.6 Å²	145.6	76%	0.755	72%	0.723	S	S	*	*			trans	-83.3	7.1	-176.3	57.1	0	0	0	0	114.5	D214	D214-S216 PolarHBondContact O-N 3.09Å
217	Q	39.3	Very low	37.3	Very low	168 Å²	168	141.8 Å²	141.8	79%	0.785	71%	0.713	S	S	*	*	S	Bend	trans	-124.1	-24.4	-179.6	-70.6	-170.3	-40.5	0	0	115.5	N215 R219	N215-Q217 VanDerWaalsContact C-N 3.28Å; N215-Q217 PolarHBondContact O-N 3.22Å; Q217-R219 PolarHBondContact O-N 2.69Å; Q217-R219 VanDerWaalsContact O-N 3.12Å
218	S	33.4	Very low	37	Very low	68 Å²	68	141.6 Å²	141.6	48%	0.476	71%	0.712	S	S	.	*	H	α-helix	trans	-71.9	-7.4	-179	84.7	0	0	0	0	114.8	N215	N215-S218 PolarHBondContact ND2-OG 3.25Å; N215-S218 WeakPolarHBondContact OD1-CB 3.45Å; N215-S218 PolarHBondContact OD1-N 3.14Å; N215-S218 PolarHBondContact OD1-OG 2.59Å
219	R	37.4	Very low	37.1	Very low	217 Å²	217	144.9 Å²	144.9	82%	0.819	71%	0.714	S	S	*	*	H	α-helix	trans	-87.6	-4.5	-172.8	-141.9	176.9	-169.4	-169.4	3.3	114.8	Q217	Q217-R219 PolarHBondContact O-N 2.69Å; Q217-R219 VanDerWaalsContact O-N 3.12Å
220	E	37.1	Very low	36.8	Very low	140 Å²	140	147.8 Å²	147.8	65%	0.654	72%	0.721	S	S	*	*	H	α-helix	trans	-100.2	-35.5	-176.9	-154.4	173.5	-168.5	0	0	113.7	E222 K223 K224	E220-E222 PolarHBondContact O-N 3.24Å; E220-K223 PolarHBondContact O-N 3.38Å; E220-K224 PolarHBondContact O-N 2.67Å
221	E	36.7	Very low	36.7	Very low	122 Å²	122	151.3 Å²	151.3	57%	0.57	72%	0.724	S	S	*	*	H	α-helix	trans	-60.6	-43.2	176.2	-82.3	-128.5	121.2	0	0	113.5	K223 K224 K225	E221-K223 VanDerWaalsContact C-N 3.26Å; E221-K223 PolarHBondContact O-N 3.41Å; E221-K224 PolarHBondContact O-N 2.71Å; E221-K224 VanDerWaalsContact O-N 3.08Å; E221-K225 PolarHBondContact O-N 3.27Å; E221-K225 IonicContact OE2-NZ 3.04Å; E221-K225 PolarHBondContact OE2-NZ 2.89Å
222	E	38	Very low	36.7	Very low	119 Å²	119	151.1 Å²	151.1	56%	0.556	72%	0.723	S	S	*	*	H	α-helix	trans	-59.8	-36.2	179.8	-86.2	-150.6	95.3	0	0	112.4	E220 K224 K225 R226	E220-E222 PolarHBondContact O-N 3.24Å; E222-K224 VanDerWaalsContact C-N 3.33Å; E222-K224 PolarHBondContact O-N 3.44Å; E222-K225 PolarHBondContact O-N 2.94Å; E222-R226 WeakPolarHBondContact O-CG 3.26Å; E222-R226 PolarHBondContact O-N 3.15Å
223	K	40.6	Very low	36.4	Very low	162 Å²	162	154.4 Å²	154.4	70%	0.704	73%	0.727	S	S	*	*	H	α-helix	trans	-66.2	-35.3	176.7	-79.4	-174.5	173.3	-179.2	0	111.9	E220 E221 K227	E220-K223 PolarHBondContact O-N 3.38Å; E221-K223 VanDerWaalsContact C-N 3.26Å; E221-K223 PolarHBondContact O-N 3.41Å; K223-K227 PolarHBondContact O-N 2.85Å
224	K	41.4	Very low	36.1	Very low	155 Å²	155	154.2 Å²	154.2	67%	0.674	73%	0.734	S	S	*	*	H	α-helix	trans	-68.3	-44	173.5	-73.5	178	177.9	170.2	0	111.4	E220 E221 E222 K227 K228	E220-K224 PolarHBondContact O-N 2.67Å; E221-K224 PolarHBondContact O-N 2.71Å; E221-K224 VanDerWaalsContact O-N 3.08Å; E222-K224 VanDerWaalsContact C-N 3.33Å; E222-K224 PolarHBondContact O-N 3.44Å; K224-K227 PolarHBondContact O-N 3.32Å; K224-K228 PolarHBondContact O-N 3.18Å
225	K	40.5	Very low	35.8	Very low	136 Å²	136	153.6 Å²	153.6	59%	0.591	74%	0.736	S	S	*	*	H	α-helix	trans	-64.8	-41.4	177.7	-73.1	169.9	-179.4	155.4	0	112.4	E221 E222 K228	E221-K225 PolarHBondContact O-N 3.27Å; E221-K225 IonicContact OE2-NZ 3.04Å; E221-K225 PolarHBondContact OE2-NZ 2.89Å; E222-K225 PolarHBondContact O-N 2.94Å; K225-K228 PolarHBondContact O-N 3.02Å
226	R	40.3	Very low	35.2	Very low	194 Å²	194	153 Å²	153	73%	0.732	75%	0.745	S	S	*	*	H	α-helix	trans	-70.2	-29.6	178.2	-67.6	179	90.5	164.8	3.6	114	E222	E222-R226 WeakPolarHBondContact O-CG 3.26Å; E222-R226 PolarHBondContact O-N 3.15Å
227	K	37.1	Very low	34.5	Very low	179 Å²	179	157.4 Å²	157.4	78%	0.778	75%	0.751	S	S	*	*	H	α-helix	trans	-69.3	-33	172.2	-90.9	-170.4	172.5	-175.1	0	113.4	K223 K224 K229 K230	K223-K227 PolarHBondContact O-N 2.85Å; K224-K227 PolarHBondContact O-N 3.32Å; K227-K229 VanDerWaalsContact C-N 3.32Å; K227-K229 PolarHBondContact O-N 2.89Å; K227-K230 PolarHBondContact O-N 2.95Å
228	K	35.8	Very low	33.9	Very low	184 Å²	184	154.1 Å²	154.1	80%	0.8	75%	0.752	S	S	*	*	H	α-helix	trans	-72.7	-19.2	-177.1	-152.5	172.7	-174.8	179.8	0	114	K224 K225	K224-K228 PolarHBondContact O-N 3.18Å; K225-K228 PolarHBondContact O-N 3.02Å
229	K	35	Very low	33.5	Very low	194 Å²	194	156.6 Å²	156.6	84%	0.843	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-2.7	178.3	-153.8	175.8	179.9	-178	0	114.6	K227	K227-K229 VanDerWaalsContact C-N 3.32Å; K227-K229 PolarHBondContact O-N 2.89Å
230	K	33.7	Very low	32.9	Very low	197 Å²	197	150.6 Å²	150.6	86%	0.857	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.2	23.9	176.4	-145.2	-175.7	-175.9	-173.7	0	113.6	K227	K227-K230 PolarHBondContact O-N 2.95Å
231	K	33.8	Very low	32.4	Very low	194 Å²	194	153.2 Å²	153.2	84%	0.843	78%	0.778	S	S	*	*	S	Bend	trans	-134.6	44.7	176.4	-134.9	-171.1	-175.8	-165.9	0	111.4
232	K	31.9	Very low	31.9	Very low	190 Å²	190	155.7 Å²	155.7	83%	0.826	79%	0.787	S	S	*	*	S	Bend	trans	-146.2	42.3	172.7	-154.8	-164.1	175.7	-173.2	0	112.5
233	D	28.1	Very low	31.4	Very low	167 Å²	167	155.5 Å²	155.5	89%	0.893	79%	0.794	S	S	*	*	S	Bend	trans	-154.3	145.3	160	-87.6	-48.6	0	0	0	107.2
234	G	27.1	Very low	30.7	Very low	82 Å²	82	154 Å²	154	85%	0.845	79%	0.789	S	S	*	*			trans	93.7	94.8	-176.8	0	0	0	0	0	114.5
235	T	25.6	Very low	29.8	Very low	148 Å²	148	154.2 Å²	154.2	91%	0.908	79%	0.793	S	S	*	*			trans	-115.7	126.3	174.8	-61.9	0	0	0	0	110
236	A	25.7	Very low	29.1	Very low	88 Å²	88	154.2 Å²	154.2	73%	0.727	80%	0.804	S	S	*	*			trans	-177.6	147.1	147.9	0	0	0	0	0	113.9
237	K	26.8	Very low	28.4	Very low	202 Å²	202	148.8 Å²	148.8	88%	0.878	80%	0.8	S	S	*	*			trans	62.3	119.9	157.7	-72.9	-175	173.6	-176.9	0	121.4
238	A	25.7	Very low	27.8	Very low	98 Å²	98	149.3 Å²	149.3	81%	0.81	81%	0.808	S	S	*	*				57.7	142.8	130	0	0	0	0	0	120.6
239	S	26	Very low	27.2	Very low	121 Å²	121	149.4 Å²	149.4	85%	0.846	81%	0.811	S	S	*	*			cis	-154.1	-170	0	39.9	0	0	0	0	111.3
240	A	24.9	Very low	26.7	Very low	90 Å²	90	145.1 Å²	145.1	74%	0.744	81%	0.812	S	S	*	*			trans	-50.4	165	174.7	0	0	0	0	0	113.6
241	E	26.7	Very low	26.3	Very low	195 Å²	195	144 Å²	144	91%	0.911	81%	0.81	S	S	*	*			cis	-157	-172	46.3	-166.8	152.3	-167.9	0	0	115.3
242	K	25.2	Very low	26.2	Very low	175 Å²	175	139.7 Å²	139.7	76%	0.761	80%	0.802	S	S	*	*			trans	-113.4	178.2	-154.3	-177.4	-161.2	170.6	-166.5	0	111.3
243	V	26.9	Very low	25.9	Very low	114 Å²	114	135.6 Å²	135.6	69%	0.691	80%	0.797	S	S	*	*			trans	83	152.1	160.5	-172.6	0	0	0	0	115.9
244	Q	25.6	Very low	25.8	Very low	130 Å²	130	134.7 Å²	134.7	61%	0.607	79%	0.787	S	S	*	*			cis	-178.3	147.7	-41.2	-170.1	165.5	-32.6	0	0	108.4
245	E	23.5	Very low	25.9	Very low	161 Å²	161	137.3 Å²	137.3	75%	0.752	78%	0.777	S	S	*	*			trans	59.9	174.3	158.3	-87.3	155.9	-145.9	0	0	118.4
246	V	24.9	Very low	26	Very low	136 Å²	136	138.3 Å²	138.3	82%	0.824	77%	0.769	S	S	*	*			cis	-144.8	172.8	-43	109.5	0	0	0	0	108.9
247	A	26.5	Very low	26	Very low	80 Å²	80	145.1 Å²	145.1	66%	0.661	78%	0.776	S	S	*	*			trans	-79.2	156	180	0	0	0	0	0	114.7
248	M	23.9	Very low	25.9	Very low	189 Å²	189	143.4 Å²	143.4	93%	0.931	77%	0.768	S	S	*	*				-176.7	174	121.6	-99.9	175.5	69.8	0	0	113.4
249	E	24.1	Very low	25.9	Very low	186 Å²	186	145 Å²	145	87%	0.869	76%	0.759	S	S	*	*			trans	-81.9	156.5	-167.7	-47.3	-173.8	134.9	0	0	115.5
250	A	24.7	Very low	25.8	Very low	104 Å²	104	144.1 Å²	144.1	86%	0.86	75%	0.748	S	S	*	*				-171.8	150	130	0	0	0	0	0	114.2
251	E	23.7	Very low	25.7	Very low	174 Å²	174	145.9 Å²	145.9	81%	0.813	75%	0.75	S	S	*	*			trans	-59.7	-179.5	168.5	-81.4	-81.5	132.3	0	0	114.7
252	P	33.4	Very low	25.7	Very low	104 Å²	104	141 Å²	141	68%	0.675	74%	0.743	S	S	*	*			cis	-142.3	-172.5	13.1	41.4	-21	0	0	0	118.7
253	S	25	Very low	25.5	Very low	104 Å²	104	139.9 Å²	139.9	73%	0.727	75%	0.745	S	S	*	*			trans	84.6	148.9	148.8	81.8	0	0	0	0	119.3
254	E	26.8	Very low	25.4	Very low	148 Å²	148	140.8 Å²	140.8	69%	0.692	76%	0.755	S	S	*	*			cis	-157.8	156.2	-4.6	-135.6	-171.6	-163	0	0	113.7
255	H	27.8	Very low	25.4	Very low	136 Å²	136	141.4 Å²	141.4	63%	0.63	76%	0.763	S	S	*	*			trans	58.6	144.6	152.2	-74.4	1.6	0	0	0	121.1
256	K	27.9	Very low	25.8	Very low	169 Å²	169	139.4 Å²	139.4	74%	0.735	76%	0.764	S	S	*	*			cis	-151	132	-4.7	-95	155.2	-178.9	168.3	0	107
257	R	25.4	Very low	25.7	Very low	232 Å²	232	140.8 Å²	140.8	88%	0.875	76%	0.761	S	S	*	*				44.4	141.1	94	-65.8	-172.2	175.9	-173.8	0.7	115.7
258	K	26.2	Very low	25.5	Very low	166 Å²	166	142.8 Å²	142.8	72%	0.722	77%	0.765	S	S	*	*			cis	-167	177.6	-7.6	-100.7	-164.2	163.1	-144.5	0	105.6
259	H	25.5	Very low	25.6	Very low	132 Å²	132	139 Å²	139	61%	0.611	76%	0.757	S	S	*	*			cis	-160.6	172.3	-0.6	-130.2	-133.6	0	0	0	106.6
260	V	23.7	Very low	25.6	Very low	101 Å²	101	135.7 Å²	135.7	61%	0.612	76%	0.755	S	S	*	*			cis	83.3	119	14.9	171.5	0	0	0	0	115.4
261	T	23.4	Very low	25.6	Very low	128 Å²	128	134.7 Å²	134.7	79%	0.785	75%	0.746	S	S	*	*			cis	-168.6	173.3	-5.9	24.7	0	0	0	0	110.6
262	A	24.9	Very low	25.7	Very low	93 Å²	93	134.3 Å²	134.3	77%	0.769	75%	0.745	S	S	*	*			trans	107.3	166.2	146.7	0	0	0	0	0	121.7
263	D	22.6	Very low	25.2	Very low	151 Å²	151	138.2 Å²	138.2	81%	0.807	75%	0.751	S	S	*	*			trans	-79.8	157	-158.3	-50.8	-112.4	0	0	0	118.3
264	C	23.7	Very low	25.3	Very low	133 Å²	133	139.3 Å²	139.3	90%	0.899	75%	0.753	S	S	*	*				171.4	157.9	112.6	-99.2	0	0	0	0	114.6
265	D	25.4	Very low	25.5	Very low	143 Å²	143	138.4 Å²	138.4	77%	0.765	76%	0.76	S	S	*	*			trans	-82.7	158.7	170.1	-130.1	-68.2	0	0	0	110.8	E267	D265-E267 PolarHBondContact OD1-N 3.49Å
266	P	32.5	Very low	25.3	Very low	119 Å²	119	135.4 Å²	135.4	77%	0.773	77%	0.766	S	S	*	*				-155.2	144.5	83.5	39.1	-18.6	0	0	0	119.5
267	E	22.6	Very low	25.1	Very low	164 Å²	164	136.5 Å²	136.5	77%	0.766	77%	0.771	S	S	*	*			trans	39.1	139.8	134	-77.6	-135.7	113.4	0	0	126	D265	D265-E267 PolarHBondContact OD1-N 3.49Å
268	T	23.3	Very low	25.1	Very low	122 Å²	122	132.2 Å²	132.2	75%	0.748	76%	0.764	S	S	*	*			trans	87.7	104.6	145.1	56	0	0	0	0	124.6
269	S	26.1	Very low	25.2	Very low	109 Å²	109	129.8 Å²	129.8	76%	0.762	77%	0.768	S	S	*	*				-170.8	131.8	128.9	25.8	0	0	0	0	107.4
270	S	22.3	Very low	25.2	Very low	118 Å²	118	130.1 Å²	130.1	83%	0.825	77%	0.77	S	S	*	*			cis	71	127.8	47.5	86.4	0	0	0	0	113.1
271	A	26.1	Very low	25.2	Very low	82 Å²	82	133.3 Å²	133.3	68%	0.678	78%	0.776	S	S	*	*			cis	-162.7	161.6	-8.7	0	0	0	0	0	112.6
272	Q	24.4	Very low	25.3	Very low	167 Å²	167	136.6 Å²	136.6	78%	0.78	78%	0.779	S	S	*	*			trans	63.4	149.4	157.8	-65.6	176.7	24	0	0	117.8
273	K	24.7	Very low	25.4	Very low	186 Å²	186	143.7 Å²	143.7	81%	0.809	79%	0.786	S	S	*	*			cis	-162.4	158.3	31.6	-134.6	154.8	-168.3	169.7	0	112.1
274	T	25.4	Very low	25.6	Very low	127 Å²	127	148.2 Å²	148.2	78%	0.779	79%	0.792	S	S	*	*			trans	-97.7	-173.6	163.7	56.7	0	0	0	0	109.2
275	P	31.1	Very low	25.8	Very low	129 Å²	129	151.6 Å²	151.6	84%	0.838	79%	0.786	S	S	*	*			cis	-145	-165.7	11.1	45	-23.8	0	0	0	117.1
276	G	23.7	Very low	25.9	Very low	72 Å²	72	149.9 Å²	149.9	74%	0.742	79%	0.785	S	S	*	*			trans	132.4	87.4	161.3	0	0	0	0	0	115.2
277	K	25.1	Very low	25.6	Very low	192 Å²	192	150.8 Å²	150.8	84%	0.835	78%	0.779	S	S	*	*				72.7	107.2	76.1	-91.8	-168.4	171.1	-178.5	0	118.6
278	L	25.1	Very low	25.7	Very low	142 Å²	142	149.1 Å²	149.1	74%	0.743	78%	0.78	S	S	*	*			trans	62.6	116.2	131.7	-67.2	167.8	0	0	0	123.1
279	S	28.5	Very low	25.8	Very low	116 Å²	116	147.1 Å²	147.1	81%	0.811	78%	0.776	S	S	*	*				-137.9	135.8	117.7	50.2	0	0	0	0	107.2
280	E	24.5	Very low	25.8	Very low	139 Å²	139	151.1 Å²	151.1	65%	0.65	78%	0.782	S	S	*	*			cis	87.6	132.3	17.3	-121.9	-85.6	103.5	0	0	114.6
281	K	24.4	Very low	25.9	Very low	167 Å²	167	149.2 Å²	149.2	73%	0.726	78%	0.782	S	S	*	*			trans	72.4	144.6	-173.9	-62	158.5	-171.5	162.3	0	116.8
282	K	25.4	Very low	25.9	Very low	198 Å²	198	150.6 Å²	150.6	86%	0.861	79%	0.786	S	S	*	*			cis	-151.3	154.5	-0.3	-135.6	171.2	-176.9	176.8	0	113.9
283	R	26.5	Very low	25.9	Very low	241 Å²	241	151.5 Å²	151.5	91%	0.909	79%	0.791	S	S	*	*			trans	-83.3	145.8	167.5	-71.2	162.7	132.7	178.1	-2.7	112.4
284	R	27.2	Very low	25.9	Very low	246 Å²	246	146.4 Å²	146.4	93%	0.928	79%	0.791	S	S	*	*			trans	-155.5	136.7	142.9	-84	-171.4	166.2	172.9	-6.5	105.7
285	R	26.7	Very low	26	Very low	204 Å²	204	147.9 Å²	147.9	77%	0.77	79%	0.794	S	S	*	*			cis	67.6	105.5	6.6	-159.4	175.7	-173.2	-179.3	1.6	118.5	Q287	R285-Q287 VanDerWaalsContact CZ-OE1 3.29Å
286	S	28.9	Very low	26	Very low	107 Å²	107	147.6 Å²	147.6	75%	0.748	79%	0.789	S	S	*	*			trans	-166.4	147.7	157	40.5	0	0	0	0	106.8
287	Q	25.3	Very low	26.2	Very low	139 Å²	139	149.9 Å²	149.9	65%	0.65	79%	0.792	S	S	*	*			cis	60.4	138.6	-12.9	-60.9	-178.3	-60.6	0	0	117.1	R285	R285-Q287 VanDerWaalsContact CZ-OE1 3.29Å
288	T	25.3	Very low	26.3	Very low	129 Å²	129	145.9 Å²	145.9	79%	0.791	79%	0.788	S	S	*	*			cis	-99.7	180	9.1	52.6	0	0	0	0	111.9
289	A	25.1	Very low	26.3	Very low	79 Å²	79	148.9 Å²	148.9	65%	0.653	80%	0.795	S	S	*	*			cis	70.6	137.1	29.7	0	0	0	0	0	113.5
290	E	26.3	Very low	26.3	Very low	193 Å²	193	151.5 Å²	151.5	90%	0.902	80%	0.798	S	S	*	*			cis	-134.7	154.6	6.9	-64.6	179.6	145.8	0	0	110.9
291	G	24.5	Very low	26.4	Very low	79 Å²	79	156.6 Å²	156.6	81%	0.814	81%	0.811	S	S	*	*				125	160.6	97.1	0	0	0	0	0	109.4
292	S	25.3	Very low	26.5	Very low	111 Å²	111	156.9 Å²	156.9	78%	0.776	81%	0.812	S	S	*	*			cis	-158	175.1	-5.3	-168.5	0	0	0	0	110.4
293	E	24.9	Very low	26.5	Very low	186 Å²	186	152.5 Å²	152.5	87%	0.869	80%	0.802	S	S	*	*			trans	74.8	137.4	161.4	-47	-160.1	151.6	0	0	122.2
294	G	25.6	Very low	26.5	Very low	79 Å²	79	145.8 Å²	145.8	81%	0.814	79%	0.792	S	S	*	*			trans	75.1	142.9	162.8	0	0	0	0	0	118.5
295	D	25.9	Very low	26.4	Very low	157 Å²	157	141.2 Å²	141.2	84%	0.84	78%	0.781	S	S	*	*			cis	-157.3	168.2	-22.6	-156.1	-20.3	0	0	0	108.4
296	V	32.5	Very low	26.3	Very low	123 Å²	123	137.5 Å²	137.5	75%	0.745	79%	0.787	S	S	*	*			trans	-105.2	130.4	-177.8	-178.3	0	0	0	0	111.6
297	P	28	Very low	26.2	Very low	121 Å²	121	141.3 Å²	141.3	79%	0.786	79%	0.793	S	S	*	*			trans	-111.9	124.6	157.9	22.4	-6.7	0	0	0	112.4
298	S	26	Very low	26.1	Very low	108 Å²	108	142 Å²	142	76%	0.755	81%	0.806	S	S	*	*			trans	-81.2	163.8	168.9	-75.7	0	0	0	0	112.6
299	K	25.1	Very low	26.1	Very low	205 Å²	205	138.9 Å²	138.9	89%	0.891	80%	0.801	S	S	*	*			trans	-8.5	133.7	164	-67.4	169.9	174.2	171.5	0	117.1
300	I	29.7	Very low	26.2	Very low	170 Å²	170	143.5 Å²	143.5	87%	0.872	81%	0.808	S	S	*	*			trans	-126.9	132.1	136.2	-89.1	159.1	0	0	0	110
301	R	26.6	Very low	26.1	Very low	246 Å²	246	141.4 Å²	141.4	93%	0.928	80%	0.796	S	S	*	*			trans	-144	125.3	165.4	-105.4	-172.1	173.8	-175.7	-2.3	106.1
302	K	26.1	Very low	26.2	Very low	173 Å²	173	143.5 Å²	143.5	75%	0.752	79%	0.785	S	S	*	*			trans	-167.2	153.2	170.8	-113.3	-161.1	166.1	-159	0	107.3	E305	K302-E305 IonicContact NZ-OE1 2.67Å
303	T	25.6	Very low	26.1	Very low	107 Å²	107	146.2 Å²	146.2	66%	0.656	79%	0.785	S	S	*	*			cis	-125.2	-175.8	-9.8	36.8	0	0	0	0	107.8
304	S	25.4	Very low	26	Very low	100 Å²	100	144.4 Å²	144.4	70%	0.699	78%	0.781	S	S	*	*			cis	-139.1	140.9	1.9	43.9	0	0	0	0	107.6
305	E	25.9	Very low	25.9	Very low	149 Å²	149	148.2 Å²	148.2	70%	0.696	78%	0.778	S	S	*	*				71.5	99.2	60.9	-72.5	170.5	-161.1	0	0	114.7	K302	K302-E305 IonicContact NZ-OE1 2.67Å
306	S	25.3	Very low	26	Very low	126 Å²	126	144.4 Å²	144.4	88%	0.881	77%	0.768	S	S	*	*			trans	-167.3	126	134.9	60.3	0	0	0	0	109.2
307	E	25.1	Very low	25.6	Very low	187 Å²	187	144 Å²	144	87%	0.874	77%	0.771	S	S	*	*			trans	-117.8	153.1	-172.2	-64.3	-173.3	117.8	0	0	114.3
308	T	23.4	Very low	25.4	Very low	153 Å²	153	146.3 Å²	146.3	94%	0.939	77%	0.773	S	S	*	*			trans	163.4	150.9	152.2	27.1	0	0	0	0	107.5
309	G	26	Very low	25.4	Very low	65 Å²	65	147.1 Å²	147.1	67%	0.67	77%	0.769	S	S	*	*			cis	134.4	130.3	2.8	0	0	0	0	0	109.4
310	H	26.8	Very low	25.4	Very low	175 Å²	175	144.6 Å²	144.6	81%	0.81	77%	0.765	S	S	*	*			cis	-132.7	-178	2.4	-109.9	-121.9	0	0	0	109.5
311	K	24.3	Very low	25.6	Very low	149 Å²	149	141.8 Å²	141.8	65%	0.648	76%	0.757	S	S	*	*				38.5	138.5	74.6	-77.5	175.9	152.4	-106.6	0	114.7
312	E	25.8	Very low	25.5	Very low	123 Å²	123	134.4 Å²	134.4	58%	0.575	74%	0.743	S	S	*	*			cis	-163.4	168.9	0.1	-128.1	151.1	-179	0	0	111.3
313	E	24.5	Very low	25.7	Very low	169 Å²	169	135.9 Å²	135.9	79%	0.79	75%	0.75	S	S	*	*			trans	58.8	179	156	-71.6	162	-152.9	0	0	119.5
314	D	23	Very low	25.7	Very low	147 Å²	147	135 Å²	135	79%	0.786	75%	0.748	S	S	*	*				-153.3	-167.8	-69	-144.4	-38.4	0	0	0	110.1
315	E	24	Very low	25.8	Very low	160 Å²	160	137.5 Å²	137.5	75%	0.748	75%	0.754	S	S	*	*			trans	72.5	103.5	161.4	-73.5	-63.3	143.2	0	0	122.8
316	A	26.4	Very low	25.9	Very low	76 Å²	76	136.2 Å²	136.2	63%	0.628	76%	0.756	S	S	*	*				46.9	147.9	123.8	0	0	0	0	0	127.4
317	S	25.3	Very low	26.1	Very low	115 Å²	115	139.5 Å²	139.5	80%	0.804	76%	0.757	S	S	*	*			trans	77.4	156.1	147.7	83.4	0	0	0	0	119
318	M	24.1	Very low	26.2	Very low	170 Å²	170	134.1 Å²	134.1	84%	0.837	75%	0.753	S	S	*	*			cis	-155.9	171	-19.7	-112.3	-72.2	-174.8	0	0	110.5
319	N	24.3	Very low	26.4	Very low	125 Å²	125	133.7 Å²	133.7	67%	0.668	74%	0.744	S	S	*	*			trans	-66.9	147.6	-167.7	-60.4	-67.3	0	0	0	119.5
320	L	26.7	Very low	26.5	Very low	152 Å²	152	136.9 Å²	136.9	80%	0.796	75%	0.751	S	S	*	*			trans	60.7	161	132.2	-72.3	167.6	0	0	0	119.8
321	P	33.4	Very low	26.7	Very low	111 Å²	111	136.1 Å²	136.1	72%	0.721	75%	0.748	S	S	*	*			cis	-149.5	170.3	31.9	44.6	-23.4	0	0	0	121.5
322	S	24	Very low	27.1	Very low	90 Å²	90	138.3 Å²	138.3	63%	0.629	76%	0.757	S	S	*	*			trans	51.7	120.7	140.3	65.3	0	0	0	0	125.5
323	K	29.6	Very low	27.3	Very low	204 Å²	204	136.5 Å²	136.5	89%	0.887	77%	0.771	S	S	*	*				62.1	153.4	127.3	-69.4	-170.1	176.9	-170.1	0	119.9
324	S	26.3	Very low	27.7	Very low	89 Å²	89	138.4 Å²	138.4	62%	0.622	78%	0.777	S	S	*	*			cis	-161.2	155.1	6.1	28.2	0	0	0	0	112
325	D	28.4	Very low	28.2	Very low	153 Å²	153	139.2 Å²	139.2	82%	0.818	78%	0.776	S	S	*	*			trans	56.3	152.8	147.5	-51.7	-12	0	0	0	120.8
326	T	27.4	Very low	28.7	Very low	121 Å²	121	135.6 Å²	135.6	74%	0.742	77%	0.768	S	S	*	*			cis	-168	141.7	-23.3	-87.1	0	0	0	0	108
327	E	29.1	Very low	29.5	Very low	195 Å²	195	137.3 Å²	137.3	91%	0.911	77%	0.771	S	S	*	*			trans	158	164.4	144	-91.6	-172	-177.4	0	0	113.6
328	G	27.3	Very low	30.2	Very low	75 Å²	75	137.3 Å²	137.3	77%	0.773	76%	0.762	S	S	*	*			trans	114.7	2.1	135.1	0	0	0	0	0	122.9
329	N	27	Very low	31	Very low	143 Å²	143	131.9 Å²	131.9	77%	0.765	74%	0.737	S	S	*	*			trans	16.6	121.5	162.6	-179.2	43.4	0	0	0	121.4
330	T	29.1	Very low	32.1	Very low	132 Å²	132	131.5 Å²	131.5	81%	0.81	73%	0.734	S	S	*	*				-172.6	152	126.5	-74.1	0	0	0	0	111.4
331	E	31.4	Very low	33.1	Very low	159 Å²	159	127.4 Å²	127.4	74%	0.743	72%	0.715	S	S	*	*			trans	-81.6	142.2	-168.2	-48.2	-178.1	118.1	0	0	117
332	K	31.8	Very low	33.9	Very low	196 Å²	196	125 Å²	125	85%	0.852	70%	0.698	S	S	*	*				-172.3	138.6	95.1	-100.7	167.6	-174.7	167.8	0	112.9
333	G	29.6	Very low	35.3	Very low	84 Å²	84	124.3 Å²	124.3	87%	0.866	68%	0.684	S	S	*	*			trans	-88.7	164	-162.6	0	0	0	0	0	116.9
334	K	34.3	Very low	36.3	Very low	210 Å²	210	117.1 Å²	117.1	91%	0.913	66%	0.663	S	S	*	*			trans	-132	118.6	173.9	-153.4	171.7	-172.6	175.8	0	107.4
335	E	32.7	Very low	37.6	Very low	164 Å²	164	120.2 Å²	120.2	77%	0.766	67%	0.665	S	S	*	*			trans	-58.4	141.4	-173.4	-83.6	-172.8	114	0	0	112.4	K343	E335-K343 IonicContact OE1-NZ 3.39Å; E335-K343 PolarHBondContact OE1-NZ 3.43Å
336	S	33.7	Very low	38.8	Very low	83 Å²	83	121.3 Å²	121.3	58%	0.58	66%	0.658	S	S	*	*			trans	-93.2	156.2	177.6	65.8	0	0	0	0	113.5	D338	S336-D338 VanDerWaalsContact C-N 3.26Å; S336-D338 PolarHBondContact O-N 2.87Å
337	T	43.1	Very low	40.1	Very low	113 Å²	113	122.8 Å²	122.8	69%	0.693	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-25	-169.6	-43.5	0	0	0	0	114.5	D339 L340	T337-D339 VanDerWaalsContact C-N 3.34Å; T337-D339 PolarHBondContact O-N 2.99Å; T337-L340 WeakPolarHBondContact O-CB 3.29Å; T337-L340 PolarHBondContact O-N 2.86Å
338	D	40.4	Very low	41	Very low	114 Å²	114	123.7 Å²	123.7	61%	0.61	65%	0.649	S	S	*	*	H	α-helix	trans	-61.7	-36.8	-174	-75.7	-64	0	0	0	114.2	S336 L340 T341 V342	S336-D338 VanDerWaalsContact C-N 3.26Å; S336-D338 PolarHBondContact O-N 2.87Å; D338-L340 PolarHBondContact O-N 3.27Å; D338-T341 WeakPolarHBondContact O-CB 3.2Å; D338-T341 PolarHBondContact O-N 3.08Å; D338-T341 PolarHBondContact O-OG1 2.9Å; D338-V342 PolarHBondContact O-N 3.26Å
339	D	41.3	Very low	42.1	Very low	56 Å²	56	128.3 Å²	128.3	30%	0.299	65%	0.647	S	S	.	*	H	α-helix	trans	-67.1	-23.7	-177.5	-164.4	14.8	0	0	0	111.4	T337 T341 V342 K343	T337-D339 VanDerWaalsContact C-N 3.34Å; T337-D339 PolarHBondContact O-N 2.99Å; D339-T341 VanDerWaalsContact C-N 3.27Å; D339-T341 PolarHBondContact O-N 2.96Å; D339-V342 PolarHBondContact O-N 3.35Å; D339-K343 HydrophobicContact CB-CD 4.32Å; D339-K343 WeakPolarHBondContact O-CA 3.46Å; D339-K343 WeakPolarHBondContact O-CB 3.3Å; D339-K343 WeakPolarHBondContact O-CD 3.12Å; D339-K343 WeakPolarHBondContact O-CG 3.27Å; D339-K343 PolarHBondContact O-N 3.36Å; D339-K343 WeakPolarHBondContact OD2-CE 3.25Å; D339-K343 IonicContact OD2-NZ 3.98Å; D339-K343 PolarHBondContact OD2-NZ 2.86Å
340	L	47.2	Very low	43.1	Very low	118 Å²	118	128.3 Å²	128.3	62%	0.618	64%	0.641	S	S	*	*	H	α-helix	trans	-61.4	-37.2	170.2	-64.2	177.6	0	0	0	111.8	T337 D338 A344	T337-L340 WeakPolarHBondContact O-CB 3.29Å; T337-L340 PolarHBondContact O-N 2.86Å; D338-L340 PolarHBondContact O-N 3.27Å; L340-A344 VanDerWaalsContact O-CB 3.25Å; L340-A344 WeakPolarHBondContact O-CB 3.32Å; L340-A344 PolarHBondContact O-N 3.28Å
341	T	48.3	Very low	44.1	Very low	65 Å²	65	129 Å²	129	40%	0.399	63%	0.633	S	S	.	*	H	α-helix	trans	-73.2	-36	178.4	84.5	0	0	0	0	111.7	D338 D339 A344 K345	D338-T341 WeakPolarHBondContact O-CB 3.2Å; D338-T341 PolarHBondContact O-N 3.08Å; D338-T341 PolarHBondContact O-OG1 2.9Å; D339-T341 VanDerWaalsContact C-N 3.27Å; D339-T341 PolarHBondContact O-N 2.96Å; T341-A344 PolarHBondContact O-N 2.87Å; T341-K345 WeakPolarHBondContact O-CG 3.48Å; T341-K345 PolarHBondContact O-N 2.93Å
342	V	50.5	Low	44.6	Very low	60 Å²	60	127.3 Å²	127.3	36%	0.364	62%	0.624	S	S	.	*	H	α-helix	trans	-71.4	-46.9	175.7	179.6	0	0	0	0	110.4	D338 D339 A344 K345 R346	D338-V342 PolarHBondContact O-N 3.26Å; D339-V342 PolarHBondContact O-N 3.35Å; V342-A344 VanDerWaalsContact C-N 3.26Å; V342-A344 PolarHBondContact O-N 2.94Å; V342-K345 PolarHBondContact O-N 3.01Å; V342-R346 HydrophobicContact CG1-CG 4.45Å; V342-R346 VanDerWaalsContact O-CB 3.27Å; V342-R346 WeakPolarHBondContact O-CB 3.43Å; V342-R346 WeakPolarHBondContact O-CG 3.25Å; V342-R346 PolarHBondContact O-N 3.18Å
343	K	52.3	Low	45.2	Very low	77 Å²	77	125.2 Å²	125.2	34%	0.335	62%	0.615	S	S	.	*	H	α-helix	trans	-54.9	-38.9	169.6	-73.9	157	168.9	153.5	0	110.6	E335 D339 K347	E335-K343 IonicContact OE1-NZ 3.39Å; E335-K343 PolarHBondContact OE1-NZ 3.43Å; D339-K343 HydrophobicContact CB-CD 4.32Å; D339-K343 WeakPolarHBondContact O-CA 3.46Å; D339-K343 WeakPolarHBondContact O-CB 3.3Å; D339-K343 WeakPolarHBondContact O-CD 3.12Å; D339-K343 WeakPolarHBondContact O-CG 3.27Å; D339-K343 PolarHBondContact O-N 3.36Å; D339-K343 WeakPolarHBondContact OD2-CE 3.25Å; D339-K343 IonicContact OD2-NZ 3.98Å; D339-K343 PolarHBondContact OD2-NZ 2.86Å; K343-K347 VanDerWaalsContact O-CB 3.31Å; K343-K347 WeakPolarHBondContact O-CB 3.39Å; K343-K347 VanDerWaalsContact O-CG 3.26Å; K343-K347 WeakPolarHBondContact O-CG 3.48Å; K343-K347 PolarHBondContact O-N 2.86Å
344	A	52.2	Low	46.1	Very low	53 Å²	53	125.9 Å²	125.9	44%	0.438	60%	0.596	S	S	.	*	H	α-helix	trans	-69.8	-46.6	175.2	0	0	0	0	0	113.9	L340 T341 V342 K347 R348	L340-A344 VanDerWaalsContact O-CB 3.25Å; L340-A344 WeakPolarHBondContact O-CB 3.32Å; L340-A344 PolarHBondContact O-N 3.28Å; T341-A344 PolarHBondContact O-N 2.87Å; V342-A344 VanDerWaalsContact C-N 3.26Å; V342-A344 PolarHBondContact O-N 2.94Å; A344-K347 PolarHBondContact O-N 3.13Å; A344-R348 PolarHBondContact O-N 3.39Å
345	K	52.8	Low	46.7	Very low	153 Å²	153	124 Å²	124	67%	0.665	59%	0.588	S	S	*	*	H	α-helix	trans	-62.3	-41.6	174.7	-74.3	169.4	-178.6	166.1	0	111.2	T341 V342 R348 K349	T341-K345 WeakPolarHBondContact O-CG 3.48Å; T341-K345 PolarHBondContact O-N 2.93Å; V342-K345 PolarHBondContact O-N 3.01Å; K345-R348 PolarHBondContact O-N 2.92Å; K345-K349 PolarHBondContact O-N 2.86Å
346	R	54	Low	47.4	Very low	177 Å²	177	121.6 Å²	121.6	67%	0.668	58%	0.579	S	S	*	*	H	α-helix	trans	-62.6	-42.6	171.6	-77.2	178.2	167.5	164.7	-6.6	111.9	V342 K349 K350	V342-R346 HydrophobicContact CG1-CG 4.45Å; V342-R346 VanDerWaalsContact O-CB 3.27Å; V342-R346 WeakPolarHBondContact O-CB 3.43Å; V342-R346 WeakPolarHBondContact O-CG 3.25Å; V342-R346 PolarHBondContact O-N 3.18Å; R346-K349 PolarHBondContact O-N 3.28Å; R346-K350 WeakPolarHBondContact O-CB 3.15Å; R346-K350 PolarHBondContact O-N 3.3Å
347	K	53.6	Low	47.7	Very low	152 Å²	152	125.7 Å²	125.7	66%	0.661	59%	0.587	S	S	*	*	H	α-helix	trans	-63.2	-39.1	174.5	-80.6	173.9	179.5	177.8	0	112.7	K343 A344 K350 K351	K343-K347 VanDerWaalsContact O-CB 3.31Å; K343-K347 WeakPolarHBondContact O-CB 3.39Å; K343-K347 VanDerWaalsContact O-CG 3.26Å; K343-K347 WeakPolarHBondContact O-CG 3.48Å; K343-K347 PolarHBondContact O-N 2.86Å; A344-K347 PolarHBondContact O-N 3.13Å; K347-K350 PolarHBondContact O-N 2.6Å; K347-K351 PolarHBondContact O-N 2.81Å
348	R	48.7	Very low	47.5	Very low	213 Å²	213	124.9 Å²	124.9	80%	0.804	58%	0.577	S	S	*	*	H	α-helix	trans	-65.7	-45.9	172.3	-83.4	-174.9	172	173.3	-1	112.2	A344 K345 K350 K351 H352	A344-R348 PolarHBondContact O-N 3.39Å; K345-R348 PolarHBondContact O-N 2.92Å; R348-K350 PolarHBondContact O-N 2.94Å; R348-K351 PolarHBondContact O-N 3.29Å; R348-H352 WeakPolarHBondContact O-CB 3.45Å; R348-H352 PolarHBondContact O-N 3.16Å
349	K	49.7	Very low	47.4	Very low	172 Å²	172	122.7 Å²	122.7	75%	0.748	58%	0.582	S	S	*	*	H	α-helix	trans	-63.2	-36.9	173.2	-96.7	-172.5	174	-178	0	112.5	K345 R346 H352 K353	K345-K349 PolarHBondContact O-N 2.86Å; R346-K349 PolarHBondContact O-N 3.28Å; K349-H352 PolarHBondContact O-N 2.95Å; K349-K353 WeakPolarHBondContact O-CB 2.99Å; K349-K353 PolarHBondContact O-N 3.1Å
350	K	47.9	Very low	47.7	Very low	143 Å²	143	128.6 Å²	128.6	62%	0.622	61%	0.608	S	S	*	*	H	α-helix	trans	-63.6	-53.6	174.6	-170.9	175.4	178.4	-179.3	0	110.4	R346 K347 R348 H352 K353 E354	R346-K350 WeakPolarHBondContact O-CB 3.15Å; R346-K350 PolarHBondContact O-N 3.3Å; K347-K350 PolarHBondContact O-N 2.6Å; R348-K350 PolarHBondContact O-N 2.94Å; K350-H352 PolarHBondContact O-N 3.26Å; K350-K353 CarbonylContact O-C 3.2Å; K350-K353 PolarHBondContact O-N 2.78Å; K350-E354 WeakPolarHBondContact O-CB 3.35Å; K350-E354 PolarHBondContact O-N 2.84Å
351	K	50.8	Low	47.7	Very low	147 Å²	147	129.5 Å²	129.5	64%	0.639	61%	0.609	S	S	*	*	H	α-helix	trans	-59.2	-30.4	176.3	-76	-167.4	171.8	-170.7	0	113.5	K347 R348 K355	K347-K351 PolarHBondContact O-N 2.81Å; R348-K351 PolarHBondContact O-N 3.29Å; K351-K355 WeakPolarHBondContact O-CB 3.3Å; K351-K355 WeakPolarHBondContact O-CG 3.36Å; K351-K355 PolarHBondContact O-N 2.98Å
352	H	43.1	Very low	48.2	Very low	124 Å²	124	131.3 Å²	131.3	57%	0.574	62%	0.619	S	S	*	*	H	α-helix	trans	-73.8	-41.4	171.9	-163.3	-64.9	0	0	0	112.5	R348 K349 K350 E354 K355 L356	R348-H352 WeakPolarHBondContact O-CB 3.45Å; R348-H352 PolarHBondContact O-N 3.16Å; K349-H352 PolarHBondContact O-N 2.95Å; K350-H352 PolarHBondContact O-N 3.26Å; H352-E354 VanDerWaalsContact C-N 3.27Å; H352-E354 PolarHBondContact O-N 3.16Å; H352-K355 PolarHBondContact O-N 2.81Å; H352-L356 WeakPolarHBondContact ND1-CD1 3.36Å; H352-L356 VanDerWaalsContact O-CG 3.31Å; H352-L356 WeakPolarHBondContact O-CG 3.39Å; H352-L356 PolarHBondContact O-N 3.18Å
353	K	44.3	Very low	48.9	Very low	151 Å²	151	131.1 Å²	131.1	66%	0.657	62%	0.616	S	S	*	*	H	α-helix	trans	-68.7	-26.6	174.6	-169.8	169.9	-177.6	175.9	0	112.3	K349 K350 L356 K357	K349-K353 WeakPolarHBondContact O-CB 2.99Å; K349-K353 PolarHBondContact O-N 3.1Å; K350-K353 CarbonylContact O-C 3.2Å; K350-K353 PolarHBondContact O-N 2.78Å; K353-L356 CarbonylContact O-C 3.51Å; K353-L356 PolarHBondContact O-N 3.23Å; K353-K357 PolarHBondContact O-N 3.07Å
354	E	46.5	Very low	49.7	Very low	99 Å²	99	130 Å²	130	46%	0.463	62%	0.616	S	S	.	*	H	α-helix	trans	-74.8	-45.8	175.1	-167.8	163.9	-124.6	0	0	110.6	K350 H352 L356 K357 I358	K350-E354 WeakPolarHBondContact O-CB 3.35Å; K350-E354 PolarHBondContact O-N 2.84Å; H352-E354 VanDerWaalsContact C-N 3.27Å; H352-E354 PolarHBondContact O-N 3.16Å; E354-L356 PolarHBondContact O-N 2.95Å; E354-K357 PolarHBondContact O-N 2.85Å; E354-I358 PolarHBondContact O-N 2.85Å
355	K	47.6	Very low	51.1	Low	170 Å²	170	127.8 Å²	127.8	74%	0.739	60%	0.597	S	S	*	*	H	α-helix	trans	-62.4	-19.1	166.5	-76	-171.4	173.6	-164.7	0	114.4	K351 H352	K351-K355 WeakPolarHBondContact O-CB 3.3Å; K351-K355 WeakPolarHBondContact O-CG 3.36Å; K351-K355 PolarHBondContact O-N 2.98Å; H352-K355 PolarHBondContact O-N 2.81Å
356	L	47.5	Very low	52.6	Low	113 Å²	113	124.4 Å²	124.4	59%	0.592	58%	0.58	S	S	*	*	H	α-helix	trans	-91.8	-19.4	169.9	-70.1	170.2	0	0	0	113.2	H352 K353 E354 I358 G359	H352-L356 WeakPolarHBondContact ND1-CD1 3.36Å; H352-L356 VanDerWaalsContact O-CG 3.31Å; H352-L356 WeakPolarHBondContact O-CG 3.39Å; H352-L356 PolarHBondContact O-N 3.18Å; K353-L356 CarbonylContact O-C 3.51Å; K353-L356 PolarHBondContact O-N 3.23Å; E354-L356 PolarHBondContact O-N 2.95Å; L356-I358 VanDerWaalsContact C-N 3.33Å; L356-G359 WeakPolarHBondContact O-CA 3.4Å; L356-G359 PolarHBondContact O-N 2.92Å
357	K	39.9	Very low	54.2	Low	169 Å²	169	116 Å²	116	74%	0.735	55%	0.548	S	S	*	.	H	α-helix	trans	-77.1	-18.4	172.2	-91.3	-161.9	162.6	-146.9	0	113.3	K353 E354 G359	K353-K357 PolarHBondContact O-N 3.07Å; E354-K357 PolarHBondContact O-N 2.85Å; K357-G359 PolarHBondContact O-N 2.81Å
358	I	38.5	Very low	55.8	Low	96 Å²	96	109.5 Å²	109.5	49%	0.492	52%	0.521	S	S	.	.	G	3₁₀ helix	trans	-62.8	-10.3	159.5	-64.6	169.3	0	0	0	111.1	E354 L356 E360 E361	E354-I358 PolarHBondContact O-N 2.85Å; L356-I358 VanDerWaalsContact C-N 3.33Å; I358-E360 PolarHBondContact O-N 3.32Å; I358-E360 VanDerWaalsContact O-N 3.13Å; I358-E361 PolarHBondContact O-N 3.05Å
359	G	39.5	Very low	57.8	Low	69 Å²	69	100.2 Å²	100.2	71%	0.711	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-68.9	-0.4	178.4	0	0	0	0	0	116.6	L356 K357	L356-G359 WeakPolarHBondContact O-CA 3.4Å; L356-G359 PolarHBondContact O-N 2.92Å; K357-G359 PolarHBondContact O-N 2.81Å
360	E	46.2	Very low	59.7	Low	180 Å²	180	94 Å²	94	84%	0.841	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-133.2	7.8	175.5	-158.1	157.6	-137.5	0	0	113.3	I358 V362	I358-E360 PolarHBondContact O-N 3.32Å; I358-E360 VanDerWaalsContact O-N 3.13Å; E360-V362 PolarHBondContact O-N 2.79Å; E360-V362 VanDerWaalsContact O-N 3.1Å
361	E	48.2	Very low	61.6	Low	137 Å²	137	91.7 Å²	91.7	64%	0.64	45%	0.451	S	S	*	.	S	Bend	trans	-70.3	104.3	153.9	-76.8	-176.9	165.6	0	0	107	I358 I363	I358-E361 PolarHBondContact O-N 3.05Å; E361-I363 PolarHBondContact O-N 2.95Å
362	V	58.2	Low	63.3	Low	102 Å²	102	88 Å²	88	62%	0.618	44%	0.436	S	S	*	.			trans	-66.3	85.3	168.3	-178.5	0	0	0	0	107.1	N188 E360 P364	N188-V362 HydrophobicContact CB-CG1 4.09Å; E360-V362 PolarHBondContact O-N 2.79Å; E360-V362 VanDerWaalsContact O-N 3.1Å; V362-P364 WeakPolarHBondContact O-CD 3.44Å
363	I	64.9	Low	65.4	Low	57 Å²	57	84.6 Å²	84.6	29%	0.292	42%	0.418	S	S	.	.			trans	-52.5	117.7	173.6	-68.4	169.3	0	0	0	105.9	P133 W140 E361 L365	P133-I363 HydrophobicContact CG-CG2 4.31Å; W140-I363 HydrophobicContact CZ2-CD1 3.98Å; E361-I363 PolarHBondContact O-N 2.95Å; I363-L365 VanDerWaalsContact C-N 3.31Å; I363-L365 HydrophobicContact CG2-CD2 4.1Å; I363-L365 HydrophobicContact CG2-CG 4.43Å; I363-L365 PolarHBondContact O-N 2.85Å
364	P	70.3	Confident	67.4	Low	52 Å²	52	80.3 Å²	80.3	34%	0.338	40%	0.403	S	S	.	.			trans	-85.5	85.2	-159.2	35.8	-39.4	0	0	0	108.9	L131 N188 P190 V362	L131-P364 VanDerWaalsContact CD1-O 3.29Å; L131-P364 WeakPolarHBondContact CD1-O 3.29Å; N188-P364 CarbonylContact O-C 3.57Å; N188-P364 WeakPolarHBondContact O-CA 3.18Å; N188-P364 WeakPolarHBondContact O-CB 3.44Å; P190-P364 HydrophobicContact CB-CB 3.72Å; P190-P364 HydrophobicContact CB-CG 3.84Å; P190-P364 HydrophobicContact CG-CB 3.74Å; P190-P364 HydrophobicContact CG-CG 3.64Å; V362-P364 WeakPolarHBondContact O-CD 3.44Å
365	L	81.8	Confident	69.3	Low	8 Å²	8	81.2 Å²	81.2	4%	0.042	41%	0.407	C	S	.	.			trans	-78.9	140.6	-178.1	-64.1	179.5	0	0	0	110.2	V129 L132 W140 F145 N188 I363 V367	V129-L365 HydrophobicContact CG1-CD1 4.36Å; V129-L365 HydrophobicContact CG1-CD2 4.4Å; L132-L365 HydrophobicContact CD2-CD2 3.86Å; W140-L365 HydrophobicContact CH2-CD1 4.26Å; W140-L365 HydrophobicContact CH2-CD2 4.4Å; F145-L365 HydrophobicContact CE2-CD1 4.49Å; F145-L365 HydrophobicContact CZ-CD1 4.34Å; N188-L365 CarbonylContact C-O 3.56Å; N188-L365 PolarHBondContact N-O 3.19Å; N188-L365 PolarHBondContact O-N 2.87Å; I363-L365 VanDerWaalsContact C-N 3.31Å; I363-L365 HydrophobicContact CG2-CD2 4.1Å; I363-L365 HydrophobicContact CG2-CG 4.43Å; I363-L365 PolarHBondContact O-N 2.85Å; L365-V367 HydrophobicContact CB-CG2 4.01Å
366	R	83.4	Confident	70.9	Confident	81 Å²	81	76.3 Å²	76.3	31%	0.306	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	126	165.2	-176.6	179.4	-178.1	-147.8	3.5	108.6	E130 L131 P189 L368	E130-R366 HydrophobicContact CB-CB 4.25Å; E130-R366 PolarHBondContact N-O 3.48Å; E130-R366 PolarHBondContact O-N 2.99Å; E130-R366 WeakPolarHBondContact OE2-CD 3.48Å; E130-R366 IonicContact OE2-CZ 3.85Å; E130-R366 IonicContact OE2-NH1 2.88Å; E130-R366 PolarHBondContact OE2-NH1 3.01Å; L131-R366 HydrophobicContact CD1-CB 4.35Å; P189-R366 HydrophobicContact CB-CB 4.48Å; R366-L368 HydrophobicContact CG-CG 4.4Å
367	V	87.9	Confident	72.5	Confident	0 Å²	0	75 Å²	75	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	123.3	-171.5	-173	0	0	0	0	108.4	V127 Y128 V129 F145 I183 L186 N187 L365	V127-V367 HydrophobicContact CG1-CG1 3.22Å; Y128-V367 WeakPolarHBondContact O-CA 3.29Å; V129-V367 HydrophobicContact CG1-CG2 4.44Å; F145-V367 HydrophobicContact CE1-CG1 4.42Å; F145-V367 HydrophobicContact CZ-CG2 4.5Å; I183-V367 HydrophobicContact CG1-CG1 4.07Å; L186-V367 HydrophobicContact CB-CG2 3.94Å; L186-V367 WeakPolarHBondContact O-CG2 3.1Å; N187-V367 HydrophobicContact CB-CB 3.98Å; N187-V367 WeakPolarHBondContact CB-O 3.48Å; N187-V367 PolarHBondContact OD1-N 2.96Å; N187-V367 PolarHBondContact OD1-O 2.87Å; L365-V367 HydrophobicContact CB-CG2 4.01Å
368	L	87.5	Confident	74.6	Confident	17 Å²	17	72.8 Å²	72.8	9%	0.089	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	156.9	-172.1	-60.2	176.6	0	0	0	110.1	V127 Y128 R366 E372 L376	V127-L368 WeakPolarHBondContact CG1-O 3.4Å; Y128-L368 HydrophobicContact CD1-CB 4.44Å; Y128-L368 HydrophobicContact CD1-CD1 4.16Å; Y128-L368 PolarHBondContact N-O 3.3Å; Y128-L368 PolarHBondContact O-N 2.89Å; R366-L368 HydrophobicContact CG-CG 4.4Å; L368-E372 WeakPolarHBondContact CA-OE2 3.26Å; L368-E372 HydrophobicContact CB-CB 4.47Å; L368-E372 WeakPolarHBondContact CB-OE2 3.08Å; L368-L376 HydrophobicContact CD1-CD1 3.86Å
369	S	91.1	Very high	76.7	Confident	17 Å²	17	74.3 Å²	74.3	12%	0.119	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	155.8	167.1	80.2	0	0	0	0	111	K371 E372 W373	S369-K371 PolarHBondContact O-N 3Å; S369-K371 PolarHBondContact OG-N 3.01Å; S369-E372 WeakPolarHBondContact CB-OE1 3.44Å; S369-E372 PolarHBondContact N-OE1 2.83Å; S369-E372 PolarHBondContact N-OE2 3.04Å; S369-E372 PolarHBondContact O-N 3.25Å; S369-E372 PolarHBondContact OG-N 3.1Å; S369-E372 PolarHBondContact OG-OE1 2.82Å; S369-W373 PolarHBondContact O-N 3.3Å
370	K	88.1	Confident	78.5	Confident	43 Å²	43	73.9 Å²	73.9	19%	0.187	35%	0.353	C	S	.	.	H	α-helix	trans	-65.1	-22.8	174.4	-175.1	178.2	171.9	-156.8	0	112.6	D123 T126 W373 L374	D123-K370 HydrophobicContact CB-CD 4.17Å; D123-K370 WeakPolarHBondContact O-CB 3.36Å; D123-K370 IonicContact OD1-NZ 2.73Å; D123-K370 PolarHBondContact OD1-NZ 3.41Å; D123-K370 WeakPolarHBondContact OD2-CD 3.47Å; D123-K370 WeakPolarHBondContact OD2-CE 3.42Å; D123-K370 IonicContact OD2-NZ 2.69Å; D123-K370 PolarHBondContact OD2-NZ 2.8Å; T126-K370 HydrophobicContact CG2-CB 4.37Å; T126-K370 HydrophobicContact CG2-CD 3.77Å; T126-K370 VanDerWaalsContact O-CB 3.24Å; T126-K370 WeakPolarHBondContact O-CB 3.33Å; T126-K370 PolarHBondContact O-N 3.2Å; K370-W373 HydrophobicContact CG-CE3 4.49Å; K370-L374 HydrophobicContact CG-CD1 4.42Å; K370-L374 WeakPolarHBondContact O-CB 3.44Å; K370-L374 VanDerWaalsContact O-CG 3.25Å; K370-L374 WeakPolarHBondContact O-CG 3.38Å; K370-L374 PolarHBondContact O-N 2.86Å
371	K	87.6	Confident	80	Confident	93 Å²	93	68.7 Å²	68.7	40%	0.404	33%	0.33	S	S	.	.	H	α-helix	trans	-66.7	-56.9	174.2	-66.1	174.4	-175.5	164	0	110.4	S124 S369 W373 L374 E375	S124-K371 WeakPolarHBondContact OG-CE 3.26Å; S124-K371 PolarHBondContact OG-NZ 3.01Å; S369-K371 PolarHBondContact O-N 3Å; S369-K371 PolarHBondContact OG-N 3.01Å; K371-W373 PolarHBondContact O-N 3.49Å; K371-L374 WeakPolarHBondContact O-CA 3.38Å; K371-L374 WeakPolarHBondContact O-CB 3.43Å; K371-L374 PolarHBondContact O-N 3.13Å; K371-E375 WeakPolarHBondContact O-CG 3.33Å; K371-E375 PolarHBondContact O-N 3.3Å
372	E	86.4	Confident	81.7	Confident	69 Å²	69	65.8 Å²	65.8	32%	0.322	32%	0.321	S	S	.	.	H	α-helix	trans	-52.4	-42.2	173.1	-67.2	141.8	-125.4	0	0	111.7	L368 S369 E375 L376	L368-E372 WeakPolarHBondContact CA-OE2 3.26Å; L368-E372 HydrophobicContact CB-CB 4.47Å; L368-E372 WeakPolarHBondContact CB-OE2 3.08Å; S369-E372 WeakPolarHBondContact CB-OE1 3.44Å; S369-E372 PolarHBondContact N-OE1 2.83Å; S369-E372 PolarHBondContact N-OE2 3.04Å; S369-E372 PolarHBondContact O-N 3.25Å; S369-E372 PolarHBondContact OG-N 3.1Å; S369-E372 PolarHBondContact OG-OE1 2.82Å; E372-E375 PolarHBondContact O-N 3.08Å; E372-L376 VanDerWaalsContact O-CB 3.31Å; E372-L376 WeakPolarHBondContact O-CB 3.45Å; E372-L376 VanDerWaalsContact O-CG 3.23Å; E372-L376 WeakPolarHBondContact O-CG 3.24Å; E372-L376 PolarHBondContact O-N 3.49Å
373	W	88.5	Confident	82.7	Confident	53 Å²	53	65.6 Å²	65.6	20%	0.201	32%	0.317	C	S	.	.	H	α-helix	trans	-65.9	-36.4	177.6	177.6	79	0	0	0	113.2	Y128 F170 S369 K370 K371 K377	Y128-W373 HydrophobicContact CD1-CB 4.32Å; Y128-W373 AromaticContact CD1-CD1 3.43Å; Y128-W373 VanDerWaalsContact CD1-CD1 3.43Å; Y128-W373 HydrophobicContact CD1-CG 4.07Å; Y128-W373 AromaticContact CD2-CD1 3.4Å; Y128-W373 VanDerWaalsContact CD2-CD1 3.4Å; Y128-W373 HydrophobicContact CD2-CD2 4.2Å; Y128-W373 AromaticContact CD2-CG 3.81Å; Y128-W373 HydrophobicContact CD2-CG 3.81Å; Y128-W373 AromaticContact CD2-NE1 3.53Å; Y128-W373 AromaticContact CE1-CD1 3.46Å; Y128-W373 VanDerWaalsContact CE1-CD1 3.46Å; Y128-W373 HydrophobicContact CE1-CG 4.47Å; Y128-W373 AromaticContact CE1-NE1 3.92Å; Y128-W373 AromaticContact CE2-CD1 3.42Å; Y128-W373 VanDerWaalsContact CE2-CD1 3.42Å; Y128-W373 AromaticContact CE2-CE2 3.95Å; Y128-W373 HydrophobicContact CE2-CG 4.24Å; Y128-W373 AromaticContact CE2-NE1 3.18Å; Y128-W373 HydrophobicContact CG-CB 4.03Å; Y128-W373 AromaticContact CG-CD1 3.39Å; Y128-W373 AromaticContact CG-CG 3.69Å; Y128-W373 HydrophobicContact CG-CG 3.69Å; Y128-W373 AromaticContact CZ-CD1 3.46Å; Y128-W373 VanDerWaalsContact CZ-CD1 3.46Å; Y128-W373 AromaticContact CZ-NE1 3.4Å; F170-W373 AromaticContact CE1-CD2 3.91Å; F170-W373 HydrophobicContact CE1-CD2 3.91Å; F170-W373 AromaticContact CE1-CE3 3.8Å; F170-W373 HydrophobicContact CE1-CE3 3.8Å; F170-W373 HydrophobicContact CE1-CH2 4.3Å; F170-W373 HydrophobicContact CE1-CZ2 4.41Å; F170-W373 AromaticContact CE1-CZ3 4Å; F170-W373 HydrophobicContact CE1-CZ3 4Å; F170-W373 HydrophobicContact CZ-CD2 4.08Å; F170-W373 AromaticContact CZ-CE2 3.93Å; F170-W373 AromaticContact CZ-CE3 3.98Å; F170-W373 HydrophobicContact CZ-CE3 3.98Å; F170-W373 AromaticContact CZ-CH2 3.63Å; F170-W373 HydrophobicContact CZ-CH2 3.63Å; F170-W373 AromaticContact CZ-CZ2 3.73Å; F170-W373 HydrophobicContact CZ-CZ2 3.73Å; F170-W373 AromaticContact CZ-CZ3 3.76Å; F170-W373 HydrophobicContact CZ-CZ3 3.76Å; S369-W373 PolarHBondContact O-N 3.3Å; K370-W373 HydrophobicContact CG-CE3 4.49Å; K371-W373 PolarHBondContact O-N 3.49Å; W373-K377 HydrophobicContact CE3-CD 4.49Å; W373-K377 HydrophobicContact CH2-CD 3.43Å; W373-K377 VanDerWaalsContact CH2-CD 3.43Å; W373-K377 HydrophobicContact CZ2-CD 3.66Å; W373-K377 HydrophobicContact CZ3-CD 3.89Å; W373-K377 WeakPolarHBondContact O-CB 3.4Å; W373-K377 PolarHBondContact O-N 2.68Å
374	L	86.3	Confident	83.3	Confident	62 Å²	62	66.7 Å²	66.7	33%	0.325	32%	0.32	S	S	.	.	H	α-helix	trans	-68.2	-42	175.2	-76.9	170.6	0	0	0	111.4	K370 K371 K377 E378	K370-L374 HydrophobicContact CG-CD1 4.42Å; K370-L374 WeakPolarHBondContact O-CB 3.44Å; K370-L374 VanDerWaalsContact O-CG 3.25Å; K370-L374 WeakPolarHBondContact O-CG 3.38Å; K370-L374 PolarHBondContact O-N 2.86Å; K371-L374 WeakPolarHBondContact O-CA 3.38Å; K371-L374 WeakPolarHBondContact O-CB 3.43Å; K371-L374 PolarHBondContact O-N 3.13Å; L374-K377 WeakPolarHBondContact O-CB 3.33Å; L374-K377 PolarHBondContact O-N 2.88Å; L374-E378 PolarHBondContact O-N 3.16Å
375	E	86.4	Confident	83.9	Confident	117 Å²	117	70.7 Å²	70.7	55%	0.547	33%	0.333	S	S	.	.	H	α-helix	trans	-62.3	-56.1	176.4	-69.5	154	-160.7	0	0	111.1	K371 E372 K377 E378 E379	K371-E375 WeakPolarHBondContact O-CG 3.33Å; K371-E375 PolarHBondContact O-N 3.3Å; E372-E375 PolarHBondContact O-N 3.08Å; E375-K377 PolarHBondContact O-N 2.79Å; E375-K377 VanDerWaalsContact O-N 3.15Å; E375-E378 WeakPolarHBondContact O-CA 3.34Å; E375-E378 WeakPolarHBondContact O-CB 2.94Å; E375-E378 PolarHBondContact O-N 2.64Å; E375-E379 PolarHBondContact O-N 3.28Å
376	L	81.4	Confident	83.9	Confident	68 Å²	68	79.5 Å²	79.5	36%	0.356	37%	0.365	S	S	.	.	H	α-helix	trans	-56.9	-32.2	175.7	-71.5	168.6	0	0	0	112.7	L368 E372 Y380	L368-L376 HydrophobicContact CD1-CD1 3.86Å; E372-L376 VanDerWaalsContact O-CB 3.31Å; E372-L376 WeakPolarHBondContact O-CB 3.45Å; E372-L376 VanDerWaalsContact O-CG 3.23Å; E372-L376 WeakPolarHBondContact O-CG 3.24Å; E372-L376 PolarHBondContact O-N 3.49Å; L376-Y380 VanDerWaalsContact O-CB 3.24Å; L376-Y380 WeakPolarHBondContact O-CB 3.09Å; L376-Y380 PolarHBondContact O-N 3.03Å
377	K	81.3	Confident	83.7	Confident	85 Å²	85	78.6 Å²	78.6	37%	0.37	37%	0.371	S	S	.	.	H	α-helix	trans	-72.7	-37.9	174.5	166.4	175.3	149.4	-93.3	0	112.2	W373 L374 E375 L381	W373-K377 HydrophobicContact CE3-CD 4.49Å; W373-K377 HydrophobicContact CH2-CD 3.43Å; W373-K377 VanDerWaalsContact CH2-CD 3.43Å; W373-K377 HydrophobicContact CZ2-CD 3.66Å; W373-K377 HydrophobicContact CZ3-CD 3.89Å; W373-K377 WeakPolarHBondContact O-CB 3.4Å; W373-K377 PolarHBondContact O-N 2.68Å; L374-K377 WeakPolarHBondContact O-CB 3.33Å; L374-K377 PolarHBondContact O-N 2.88Å; E375-K377 PolarHBondContact O-N 2.79Å; E375-K377 VanDerWaalsContact O-N 3.15Å; K377-L381 HydrophobicContact CG-CD1 4.2Å; K377-L381 WeakPolarHBondContact O-CB 3.19Å; K377-L381 WeakPolarHBondContact O-CG 3.43Å; K377-L381 PolarHBondContact O-N 3.38Å
378	E	84.2	Confident	83.2	Confident	123 Å²	123	80.1 Å²	80.1	58%	0.575	38%	0.379	S	S	*	.	H	α-helix	trans	-67.1	-49.5	173.2	176.5	125.8	-127.5	0	0	110.6	L374 E375 Y380 L381 V382	L374-E378 PolarHBondContact O-N 3.16Å; E375-E378 WeakPolarHBondContact O-CA 3.34Å; E375-E378 WeakPolarHBondContact O-CB 2.94Å; E375-E378 PolarHBondContact O-N 2.64Å; E378-Y380 VanDerWaalsContact C-N 3.28Å; E378-Y380 PolarHBondContact O-N 3.41Å; E378-L381 CarbonylContact O-C 3.55Å; E378-L381 WeakPolarHBondContact O-CA 3.36Å; E378-L381 WeakPolarHBondContact O-CB 3.29Å; E378-L381 PolarHBondContact O-N 3.01Å; E378-V382 HydrophobicContact CG-CG2 4.4Å; E378-V382 WeakPolarHBondContact O-CG2 3.25Å; E378-V382 PolarHBondContact O-N 2.79Å
379	E	81.1	Confident	83	Confident	127 Å²	127	82 Å²	82	59%	0.593	40%	0.397	S	S	*	.	H	α-helix	trans	-52	-47.5	172.9	-70.2	-169.1	147.9	0	0	111.5	E375 L381 V382 L383	E375-E379 PolarHBondContact O-N 3.28Å; E379-L381 VanDerWaalsContact C-N 3.35Å; E379-L381 PolarHBondContact O-N 2.77Å; E379-V382 PolarHBondContact O-N 3.39Å; E379-L383 VanDerWaalsContact O-CB 3.3Å; E379-L383 WeakPolarHBondContact O-CB 3.35Å; E379-L383 PolarHBondContact O-N 2.79Å
380	Y	77.7	Confident	82.7	Confident	61 Å²	61	84.6 Å²	84.6	24%	0.239	42%	0.415	C	S	.	.	H	α-helix	trans	-61.4	-40.3	176.3	177.6	-104	0	0	0	112.7	G198 L376 E378 Q384	G198-Y380 VanDerWaalsContact CA-CE2 3.49Å; G198-Y380 VanDerWaalsContact O-CE2 3.27Å; G198-Y380 WeakPolarHBondContact O-CE2 3.34Å; L376-Y380 VanDerWaalsContact O-CB 3.24Å; L376-Y380 WeakPolarHBondContact O-CB 3.09Å; L376-Y380 PolarHBondContact O-N 3.03Å; E378-Y380 VanDerWaalsContact C-N 3.28Å; E378-Y380 PolarHBondContact O-N 3.41Å; Y380-Q384 WeakPolarHBondContact O-CB 3.39Å; Y380-Q384 PolarHBondContact O-N 3.3Å; Y380-Q384 PolarHBondContact OH-NE2 3.48Å
381	L	78.6	Confident	82.3	Confident	70 Å²	70	84.4 Å²	84.4	37%	0.366	42%	0.416	S	S	.	.	H	α-helix	trans	-68.7	-36.9	176.2	-74	168.2	0	0	0	112	K377 E378 E379 K385	K377-L381 HydrophobicContact CG-CD1 4.2Å; K377-L381 WeakPolarHBondContact O-CB 3.19Å; K377-L381 WeakPolarHBondContact O-CG 3.43Å; K377-L381 PolarHBondContact O-N 3.38Å; E378-L381 CarbonylContact O-C 3.55Å; E378-L381 WeakPolarHBondContact O-CA 3.36Å; E378-L381 WeakPolarHBondContact O-CB 3.29Å; E378-L381 PolarHBondContact O-N 3.01Å; E379-L381 VanDerWaalsContact C-N 3.35Å; E379-L381 PolarHBondContact O-N 2.77Å; L381-K385 WeakPolarHBondContact O-CB 3.44Å; L381-K385 WeakPolarHBondContact O-CD 3.07Å; L381-K385 WeakPolarHBondContact O-CG 3.22Å; L381-K385 PolarHBondContact O-N 2.89Å
382	V	83.8	Confident	82.1	Confident	76 Å²	76	85.9 Å²	85.9	46%	0.461	42%	0.422	S	S	.	.	H	α-helix	trans	-66.1	-46.2	173.4	171.6	0	0	0	0	110.7	E378 E379 Q384 K385 R386	E378-V382 HydrophobicContact CG-CG2 4.4Å; E378-V382 WeakPolarHBondContact O-CG2 3.25Å; E378-V382 PolarHBondContact O-N 2.79Å; E379-V382 PolarHBondContact O-N 3.39Å; V382-Q384 PolarHBondContact O-N 2.93Å; V382-K385 WeakPolarHBondContact O-CB 3.01Å; V382-K385 PolarHBondContact O-N 3.4Å; V382-R386 WeakPolarHBondContact O-CB 3.26Å; V382-R386 PolarHBondContact O-N 2.88Å
383	L	79.5	Confident	82.1	Confident	99 Å²	99	89.2 Å²	89.2	52%	0.518	44%	0.436	S	S	.	.	H	α-helix	trans	-62.5	-40.9	175.9	-176.4	60.8	0	0	0	111.6	E379 R386 S387	E379-L383 VanDerWaalsContact O-CB 3.3Å; E379-L383 WeakPolarHBondContact O-CB 3.35Å; E379-L383 PolarHBondContact O-N 2.79Å; L383-R386 PolarHBondContact O-N 2.93Å; L383-S387 VanDerWaalsContact O-CB 3.25Å; L383-S387 WeakPolarHBondContact O-CB 3.19Å; L383-S387 PolarHBondContact O-N 2.79Å
384	Q	76.7	Confident	81.8	Confident	79 Å²	79	89.7 Å²	89.7	37%	0.369	45%	0.446	S	S	.	.	H	α-helix	trans	-65.3	-43.1	174.5	-175.1	176.6	100.9	0	0	111.9	Y380 V382 S387 M388	Y380-Q384 WeakPolarHBondContact O-CB 3.39Å; Y380-Q384 PolarHBondContact O-N 3.3Å; Y380-Q384 PolarHBondContact OH-NE2 3.48Å; V382-Q384 PolarHBondContact O-N 2.93Å; Q384-S387 PolarHBondContact O-N 3.23Å; Q384-M388 WeakPolarHBondContact O-CB 3.07Å; Q384-M388 VanDerWaalsContact O-CG 3.31Å; Q384-M388 WeakPolarHBondContact O-CG 3.25Å; Q384-M388 PolarHBondContact O-N 2.98Å
385	K	82.2	Confident	81.7	Confident	137 Å²	137	87.4 Å²	87.4	60%	0.596	44%	0.435	S	S	*	.	H	α-helix	trans	-58.3	-48.9	172.3	-74	164	-175.1	173.4	0	110.7	L381 V382 M388 A389	L381-K385 WeakPolarHBondContact O-CB 3.44Å; L381-K385 WeakPolarHBondContact O-CD 3.07Å; L381-K385 WeakPolarHBondContact O-CG 3.22Å; L381-K385 PolarHBondContact O-N 2.89Å; V382-K385 WeakPolarHBondContact O-CB 3.01Å; V382-K385 PolarHBondContact O-N 3.4Å; K385-M388 PolarHBondContact O-N 3.01Å; K385-A389 WeakPolarHBondContact O-CB 3.2Å; K385-A389 PolarHBondContact O-N 3.19Å
386	R	82.4	Confident	81.5	Confident	192 Å²	192	84.1 Å²	84.1	73%	0.725	43%	0.425	S	S	*	.	H	α-helix	trans	-63.1	-43.4	179.8	-171.4	174.9	-179.3	172.9	-0	112.1	V382 L383 A389 S390	V382-R386 WeakPolarHBondContact O-CB 3.26Å; V382-R386 PolarHBondContact O-N 2.88Å; L383-R386 PolarHBondContact O-N 2.93Å; R386-A389 PolarHBondContact O-N 3.42Å; R386-S390 WeakPolarHBondContact O-CB 3.4Å; R386-S390 PolarHBondContact O-N 2.93Å
387	S	79.9	Confident	81.6	Confident	62 Å²	62	87.2 Å²	87.2	43%	0.434	44%	0.435	S	S	.	.	H	α-helix	trans	-60.9	-48.6	174.6	177.7	0	0	0	0	111.8	L383 Q384 A389 S390 L391	L383-S387 VanDerWaalsContact O-CB 3.25Å; L383-S387 WeakPolarHBondContact O-CB 3.19Å; L383-S387 PolarHBondContact O-N 2.79Å; Q384-S387 PolarHBondContact O-N 3.23Å; S387-A389 PolarHBondContact O-N 2.86Å; S387-S390 PolarHBondContact O-N 2.99Å; S387-L391 WeakPolarHBondContact O-CB 3.41Å; S387-L391 PolarHBondContact O-N 3.14Å
388	M	77.4	Confident	81.4	Confident	32 Å²	32	85.3 Å²	85.3	16%	0.158	43%	0.428	C	S	.	.	H	α-helix	trans	-67	-33.5	177.3	-70.6	-70.1	100.8	0	0	113.1	Q384 K385 L391 K392 T531 I535	Q384-M388 WeakPolarHBondContact O-CB 3.07Å; Q384-M388 VanDerWaalsContact O-CG 3.31Å; Q384-M388 WeakPolarHBondContact O-CG 3.25Å; Q384-M388 PolarHBondContact O-N 2.98Å; K385-M388 PolarHBondContact O-N 3.01Å; M388-L391 HydrophobicContact CE-CD2 3.69Å; M388-L391 HydrophobicContact SD-CD2 4.46Å; M388-K392 WeakPolarHBondContact O-CB 3.39Å; M388-K392 VanDerWaalsContact O-CG 3.27Å; M388-K392 WeakPolarHBondContact O-CG 3.41Å; M388-K392 PolarHBondContact O-N 2.61Å; M388-T531 HydrophobicContact CG-CG2 4.42Å; M388-T531 HydrophobicContact SD-CG2 3.94Å; M388-I535 HydrophobicContact CE-CD1 4.3Å; M388-I535 HydrophobicContact CE-CG1 4.16Å
389	A	83.4	Confident	80.9	Confident	58 Å²	58	83.7 Å²	83.7	48%	0.479	42%	0.424	S	S	.	.	H	α-helix	trans	-66.8	-44.2	173.3	0	0	0	0	0	111.6	K385 R386 S387 K392 K393	K385-A389 WeakPolarHBondContact O-CB 3.2Å; K385-A389 PolarHBondContact O-N 3.19Å; R386-A389 PolarHBondContact O-N 3.42Å; S387-A389 PolarHBondContact O-N 2.86Å; A389-K392 PolarHBondContact O-N 2.98Å; A389-K393 WeakPolarHBondContact O-CB 3.5Å; A389-K393 PolarHBondContact O-N 2.95Å
390	S	83.6	Confident	80	Confident	70 Å²	70	84.2 Å²	84.2	49%	0.49	43%	0.426	S	S	.	.	H	α-helix	trans	-60.3	-48.2	173.6	-168.6	0	0	0	0	111.3	R386 S387 K392 K393 C394	R386-S390 WeakPolarHBondContact O-CB 3.4Å; R386-S390 PolarHBondContact O-N 2.93Å; S387-S390 PolarHBondContact O-N 2.99Å; S390-K392 VanDerWaalsContact C-N 3.34Å; S390-K392 PolarHBondContact O-N 3.09Å; S390-K393 CarbonylContact O-C 3.56Å; S390-K393 WeakPolarHBondContact O-CA 3.47Å; S390-K393 PolarHBondContact O-N 2.91Å; S390-C394 PolarHBondContact O-N 3.18Å; S390-C394 PolarHBondContact O-SG 2.96Å
391	L	79.3	Confident	79.2	Confident	40 Å²	40	89.2 Å²	89.2	21%	0.209	45%	0.449	C	S	.	.	H	α-helix	trans	-57.8	-43.9	177.5	-170.3	67.2	0	0	0	112.3	S387 M388 C394 I395 I535 A538	S387-L391 WeakPolarHBondContact O-CB 3.41Å; S387-L391 PolarHBondContact O-N 3.14Å; M388-L391 HydrophobicContact CE-CD2 3.69Å; M388-L391 HydrophobicContact SD-CD2 4.46Å; L391-C394 PolarHBondContact O-N 2.78Å; L391-I395 HydrophobicContact CG-CD1 4.23Å; L391-I395 VanDerWaalsContact O-CG1 3.31Å; L391-I395 WeakPolarHBondContact O-CG1 3.07Å; L391-I395 PolarHBondContact O-N 2.68Å; L391-I535 HydrophobicContact CD2-CG1 4.14Å; L391-A538 HydrophobicContact CD1-CB 3.67Å; L391-A538 HydrophobicContact CG-CB 4.32Å
392	K	83.9	Confident	78	Confident	123 Å²	123	92.1 Å²	92.1	54%	0.535	47%	0.465	S	S	.	.	H	α-helix	trans	-60.7	-44.6	173.6	-75.4	173.2	178.7	-174.1	0	111.9	M388 A389 S390 C394 I395 S396 L534	M388-K392 WeakPolarHBondContact O-CB 3.39Å; M388-K392 VanDerWaalsContact O-CG 3.27Å; M388-K392 WeakPolarHBondContact O-CG 3.41Å; M388-K392 PolarHBondContact O-N 2.61Å; A389-K392 PolarHBondContact O-N 2.98Å; S390-K392 VanDerWaalsContact C-N 3.34Å; S390-K392 PolarHBondContact O-N 3.09Å; K392-C394 VanDerWaalsContact C-N 3.31Å; K392-C394 PolarHBondContact O-N 2.98Å; K392-I395 PolarHBondContact O-N 3Å; K392-S396 PolarHBondContact O-N 3.49Å; K392-S396 PolarHBondContact O-OG 3.49Å; K392-L534 HydrophobicContact CG-CD1 4.4Å
393	K	87	Confident	76.1	Confident	139 Å²	139	90.6 Å²	90.6	60%	0.604	46%	0.464	S	S	*	.	H	α-helix	trans	-66.2	-30.2	178.3	-168	170.8	-175.2	173.2	0	112.5	A389 S390 S396 K397	A389-K393 WeakPolarHBondContact O-CB 3.5Å; A389-K393 PolarHBondContact O-N 2.95Å; S390-K393 CarbonylContact O-C 3.56Å; S390-K393 WeakPolarHBondContact O-CA 3.47Å; S390-K393 PolarHBondContact O-N 2.91Å; K393-S396 PolarHBondContact O-OG 3.13Å; K393-K397 VanDerWaalsContact O-CB 3.32Å; K393-K397 WeakPolarHBondContact O-CB 3.33Å; K393-K397 VanDerWaalsContact O-CG 3.24Å; K393-K397 WeakPolarHBondContact O-CG 3.19Å; K393-K397 PolarHBondContact O-N 3.29Å; K393-K397 VanDerWaalsContact O-N 3.15Å
394	C	82.1	Confident	74.2	Confident	63 Å²	63	92.9 Å²	92.9	43%	0.426	48%	0.477	S	S	.	.	H	α-helix	trans	-70.2	-46.5	169.5	-68.6	0	0	0	0	111.8	S390 L391 K392 S396 K397 I398	S390-C394 PolarHBondContact O-N 3.18Å; S390-C394 PolarHBondContact O-SG 2.96Å; L391-C394 PolarHBondContact O-N 2.78Å; K392-C394 VanDerWaalsContact C-N 3.31Å; K392-C394 PolarHBondContact O-N 2.98Å; C394-S396 PolarHBondContact O-N 2.95Å; C394-K397 PolarHBondContact O-N 2.83Å; C394-I398 VanDerWaalsContact O-CG1 3.32Å; C394-I398 WeakPolarHBondContact O-CG1 3.47Å; C394-I398 PolarHBondContact O-N 2.99Å; C394-I398 VanDerWaalsContact O-N 3.09Å
395	I	83.2	Confident	72.5	Confident	15 Å²	15	94.1 Å²	94.1	8%	0.077	50%	0.501	C	S	.	.	H	α-helix	trans	-61.4	-43.3	178.1	-66.4	164.3	0	0	0	111.1	L391 K392 I398 N399 L534 K537 A538 I541	L391-I395 HydrophobicContact CG-CD1 4.23Å; L391-I395 VanDerWaalsContact O-CG1 3.31Å; L391-I395 WeakPolarHBondContact O-CG1 3.07Å; L391-I395 PolarHBondContact O-N 2.68Å; K392-I395 PolarHBondContact O-N 3Å; I395-I398 PolarHBondContact O-N 3.46Å; I395-N399 PolarHBondContact O-N 3.36Å; I395-N399 VanDerWaalsContact O-N 3.08Å; I395-N399 PolarHBondContact O-OD1 3.48Å; I395-L534 HydrophobicContact CD1-CD2 4.33Å; I395-K537 HydrophobicContact CG2-CD 4.26Å; I395-A538 HydrophobicContact CD1-CB 4.24Å; I395-A538 HydrophobicContact CG1-CB 4.37Å; I395-I541 HydrophobicContact CG1-CD1 4.49Å; I395-I541 HydrophobicContact CG2-CD1 4.3Å
396	S	83	Confident	70.3	Confident	48 Å²	48	91.8 Å²	91.8	34%	0.336	51%	0.507	S	S	.	.	H	α-helix	trans	-66.8	-44.2	177.2	63.8	0	0	0	0	112.1	K392 K393 C394 I398 N399 H400	K392-S396 PolarHBondContact O-N 3.49Å; K392-S396 PolarHBondContact O-OG 3.49Å; K393-S396 PolarHBondContact O-OG 3.13Å; C394-S396 PolarHBondContact O-N 2.95Å; S396-I398 PolarHBondContact O-N 3.29Å; S396-N399 WeakPolarHBondContact O-CB 3.39Å; S396-N399 PolarHBondContact O-N 2.81Å; S396-H400 PolarHBondContact O-CD2 2.98Å; S396-H400 PolarHBondContact O-N 3.28Å
397	K	82.8	Confident	68	Low	133 Å²	133	92 Å²	92	58%	0.578	52%	0.516	S	S	*	.	H	α-helix	trans	-57.2	-32.4	175.1	-83.1	-178	170.7	-164.9	0	113.8	K393 C394 K401	K393-K397 VanDerWaalsContact O-CB 3.32Å; K393-K397 WeakPolarHBondContact O-CB 3.33Å; K393-K397 VanDerWaalsContact O-CG 3.24Å; K393-K397 WeakPolarHBondContact O-CG 3.19Å; K393-K397 PolarHBondContact O-N 3.29Å; K393-K397 VanDerWaalsContact O-N 3.15Å; C394-K397 PolarHBondContact O-N 2.83Å; K397-K401 PolarHBondContact O-N 3.28Å
398	I	78.2	Confident	65.7	Low	44 Å²	44	96.7 Å²	96.7	23%	0.226	54%	0.537	C	S	.	.	H	α-helix	trans	-73.7	-52.6	175.7	-65.4	165.6	0	0	0	109.5	C394 I395 S396 H400 K401 D402 I541	C394-I398 VanDerWaalsContact O-CG1 3.32Å; C394-I398 WeakPolarHBondContact O-CG1 3.47Å; C394-I398 PolarHBondContact O-N 2.99Å; C394-I398 VanDerWaalsContact O-N 3.09Å; I395-I398 PolarHBondContact O-N 3.46Å; S396-I398 PolarHBondContact O-N 3.29Å; I398-H400 PolarHBondContact O-N 2.92Å; I398-K401 PolarHBondContact O-N 3.04Å; I398-D402 WeakPolarHBondContact CG2-OD2 3.16Å; I398-D402 VanDerWaalsContact O-CG 3.26Å; I398-D402 PolarHBondContact O-N 3.35Å; I398-I541 HydrophobicContact CD1-CG2 3.7Å; I398-I541 HydrophobicContact CG2-CG2 3.89Å
399	N	73	Confident	63.4	Low	90 Å²	90	98 Å²	98	48%	0.481	56%	0.559	S	S	.	*	H	α-helix	trans	-48	-37.8	173.4	-85.1	33.7	0	0	0	113.7	I395 S396	I395-N399 PolarHBondContact O-N 3.36Å; I395-N399 VanDerWaalsContact O-N 3.08Å; I395-N399 PolarHBondContact O-OD1 3.48Å; S396-N399 WeakPolarHBondContact O-CB 3.39Å; S396-N399 PolarHBondContact O-N 2.81Å
400	H	63	Low	61	Low	138 Å²	138	102.2 Å²	102.2	64%	0.639	57%	0.573	S	S	*	*	H	α-helix	trans	-76.1	-38.9	177.1	-68.8	-66.1	0	0	0	113.1	S396 I398 D402 G403	S396-H400 PolarHBondContact O-CD2 2.98Å; S396-H400 PolarHBondContact O-N 3.28Å; I398-H400 PolarHBondContact O-N 2.92Å; H400-D402 VanDerWaalsContact C-N 3.3Å; H400-D402 PolarHBondContact O-N 3.45Å; H400-G403 PolarHBondContact O-N 3.26Å; H400-G403 VanDerWaalsContact O-N 3.16Å
401	K	59.3	Low	58.4	Low	166 Å²	166	104.2 Å²	104.2	72%	0.722	58%	0.582	S	S	*	*	H	α-helix	trans	-69.3	-27.9	177.9	-84.3	-171	165.2	-95.2	0	113.5	K397 I398 G403	K397-K401 PolarHBondContact O-N 3.28Å; I398-K401 PolarHBondContact O-N 3.04Å; K401-G403 PolarHBondContact O-N 3.49Å
402	D	53.7	Low	56.2	Low	130 Å²	130	109 Å²	109	70%	0.695	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	0.7	175.2	-53.9	-22.6	0	0	0	112.2	I398 H400	I398-D402 WeakPolarHBondContact CG2-OD2 3.16Å; I398-D402 VanDerWaalsContact O-CG 3.26Å; I398-D402 PolarHBondContact O-N 3.35Å; H400-D402 VanDerWaalsContact C-N 3.3Å; H400-D402 PolarHBondContact O-N 3.45Å
403	G	45.1	Very low	53.6	Low	44 Å²	44	109.8 Å²	109.8	45%	0.454	62%	0.615	S	S	.	*	T	Hydrogen-bonded Turn	trans	-117.6	-5.7	-178.2	0	0	0	0	0	116.1	H400 K401 A405	H400-G403 PolarHBondContact O-N 3.26Å; H400-G403 VanDerWaalsContact O-N 3.16Å; K401-G403 PolarHBondContact O-N 3.49Å; G403-A405 PolarHBondContact O-N 2.8Å
404	D	39.9	Very low	51.1	Low	148 Å²	148	108.2 Å²	108.2	79%	0.791	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	34.2	-175.3	-113.6	-17	0	0	0	113.4
405	A	39.6	Very low	48.6	Very low	104 Å²	104	111.3 Å²	111.3	86%	0.86	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144.9	22.3	-177	0	0	0	0	0	113.1	G403	G403-A405 PolarHBondContact O-N 2.8Å
406	A	36.9	Very low	46.2	Very low	89 Å²	89	120 Å²	120	74%	0.736	67%	0.671	S	S	*	*	S	Bend	trans	-138.1	152.8	167.4	0	0	0	0	0	109
407	Q	33.3	Very low	43.8	Very low	195 Å²	195	121.7 Å²	121.7	91%	0.911	69%	0.688	S	S	*	*			trans	-69.4	156.8	-169	-71.3	173.9	-60.3	0	0	113.8
408	D	31.7	Very low	41.4	Very low	162 Å²	162	123.8 Å²	123.8	87%	0.866	70%	0.7	S	S	*	*			trans	-56.6	142.4	171.3	-165.4	-0	0	0	0	111
409	G	30.1	Very low	39.5	Very low	60 Å²	60	131.5 Å²	131.5	62%	0.619	73%	0.731	S	S	*	*			trans	-174.6	48.8	-159.5	0	0	0	0	0	111.9	V411	G409-V411 PolarHBondContact O-N 2.92Å
410	N	32.1	Very low	37.7	Very low	145 Å²	145	134.9 Å²	134.9	78%	0.775	74%	0.744	S	S	*	*			trans	-60.4	99.2	179.1	178.6	40.1	0	0	0	112.4
411	V	29.2	Very low	36.7	Very low	112 Å²	112	134.3 Å²	134.3	68%	0.679	75%	0.751	S	S	*	*			trans	-127	97	168.6	-175.7	0	0	0	0	108.9	G409 M413	G409-V411 PolarHBondContact O-N 2.92Å; V411-M413 VanDerWaalsContact C-N 3.29Å; V411-M413 HydrophobicContact CG1-CG 3.96Å; V411-M413 PolarHBondContact O-N 2.87Å
412	D	33.5	Very low	36.5	Very low	140 Å²	140	135.1 Å²	135.1	75%	0.749	75%	0.754	S	S	*	*			trans	-76.2	76.7	176.8	-169.2	3	0	0	0	111	S414	D412-S414 PolarHBondContact O-N 3.43Å
413	M	29.8	Very low	36.7	Very low	141 Å²	141	135.8 Å²	135.8	70%	0.695	75%	0.753	S	S	*	*			trans	-81.8	91.9	172.9	-88.2	-63.9	172.9	0	0	111	V411 D415	V411-M413 VanDerWaalsContact C-N 3.29Å; V411-M413 HydrophobicContact CG1-CG 3.96Å; V411-M413 PolarHBondContact O-N 2.87Å; M413-D415 PolarHBondContact O-N 2.96Å
414	S	34.1	Very low	37.6	Very low	105 Å²	105	135.1 Å²	135.1	73%	0.734	75%	0.746	S	S	*	*			trans	-74	38.4	173.4	51.6	0	0	0	0	113.4	D412 K416	D412-S414 PolarHBondContact O-N 3.43Å; S414-K416 VanDerWaalsContact C-N 3.32Å; S414-K416 PolarHBondContact O-N 2.83Å
415	D	28.4	Very low	39.1	Very low	129 Å²	129	129.9 Å²	129.9	69%	0.69	72%	0.72	S	S	*	*			trans	-68.5	85.7	-178.1	-106.2	-32.8	0	0	0	111.7	M413 A417	M413-D415 PolarHBondContact O-N 2.96Å; D415-A417 PolarHBondContact O-N 2.76Å
416	K	34.5	Very low	40.8	Very low	198 Å²	198	131.2 Å²	131.2	86%	0.861	71%	0.709	S	S	*	*			trans	-73.3	53.6	167.6	-169.4	-165.1	172.3	-167.3	0	109.6	S414 E418	S414-K416 VanDerWaalsContact C-N 3.32Å; S414-K416 PolarHBondContact O-N 2.83Å; K416-E418 PolarHBondContact O-N 2.92Å; K416-E418 VanDerWaalsContact O-N 3.16Å
417	A	31.6	Very low	42.9	Very low	83 Å²	83	132 Å²	132	69%	0.686	70%	0.696	S	S	*	*			trans	-49.7	122.4	179.7	0	0	0	0	0	109.7	D415	D415-A417 PolarHBondContact O-N 2.76Å
418	E	33.3	Very low	45.2	Very low	177 Å²	177	126 Å²	126	83%	0.827	67%	0.672	S	S	*	*			trans	-60.9	153.9	-177.7	-67.2	-143.8	124.3	0	0	110.5	K416 E420	K416-E418 PolarHBondContact O-N 2.92Å; K416-E418 VanDerWaalsContact O-N 3.16Å; E418-E420 PolarHBondContact O-N 3.5Å
419	K	37.5	Very low	47.4	Very low	205 Å²	205	121.8 Å²	121.8	89%	0.891	66%	0.655	S	S	*	*			trans	-82.4	61.5	-172.2	-163.6	-173.6	179	-173.8	0	110.7	T421	K419-T421 PolarHBondContact O-N 2.69Å
420	E	36.2	Very low	49.7	Very low	161 Å²	161	119.7 Å²	119.7	75%	0.752	63%	0.634	S	S	*	*			trans	-44.3	134.6	175.1	-68.7	-169.8	154.2	0	0	110.5	E418 K422	E418-E420 PolarHBondContact O-N 3.5Å; E420-K422 PolarHBondContact O-N 3.16Å
421	T	40.7	Very low	52.1	Low	127 Å²	127	113 Å²	113	78%	0.779	60%	0.598	S	S	*	*			trans	-71.6	72.7	176	38.1	0	0	0	0	109.7	K419 Q423	K419-T421 PolarHBondContact O-N 2.69Å; T421-Q423 WeakPolarHBondContact O-CA 3.36Å; T421-Q423 PolarHBondContact O-N 2.95Å
422	K	55.8	Low	54.7	Low	182 Å²	182	107.6 Å²	107.6	79%	0.791	57%	0.566	S	S	*	*			trans	-34.5	101	-176.6	-68.1	-156.4	175.5	-150.1	0	110.8	E420 R517	E420-K422 PolarHBondContact O-N 3.16Å; K422-R517 PolarHBondContact O-NH2 3.42Å; K422-R517 VanDerWaalsContact O-NH2 3.16Å
423	Q	58.3	Low	57.2	Low	145 Å²	145	101 Å²	101	68%	0.678	53%	0.53	S	S	*	.			trans	-61.2	155.8	-165	-61.3	-165	18.7	0	0	109.8	T421	T421-Q423 WeakPolarHBondContact O-CA 3.36Å; T421-Q423 PolarHBondContact O-N 2.95Å
424	G	62.4	Low	59.8	Low	29 Å²	29	96.2 Å²	96.2	30%	0.299	51%	0.506	S	S	.	.			trans	-56.2	145.4	168.6	0	0	0	0	0	108.9	Q426	G424-Q426 PolarHBondContact O-N 3.29Å
425	P	72.6	Confident	62.2	Low	39 Å²	39	91.3 Å²	91.3	25%	0.253	47%	0.471	S	S	.	.			trans	-60.7	115.1	171.2	30.5	-34.7	0	0	0	106.7	W510 I513	P425-W510 HydrophobicContact CB-CH2 4.43Å; P425-W510 HydrophobicContact CB-CZ3 3.9Å; P425-W510 HydrophobicContact CG-CZ3 4.23Å; P425-W510 WeakPolarHBondContact O-CZ3 3.2Å; P425-I513 HydrophobicContact CG-CG2 4.11Å
426	Q	74.6	Confident	64.7	Low	132 Å²	132	86.4 Å²	86.4	62%	0.617	45%	0.446	S	S	*	.			trans	-72.6	150.9	-175	-62.3	179.2	-1.9	0	0	109.6	G424 V428 W510	G424-Q426 PolarHBondContact O-N 3.29Å; Q426-V428 PolarHBondContact O-N 3.02Å; Q426-W510 WeakPolarHBondContact O-CH2 3.25Å; Q426-W510 VanDerWaalsContact O-CZ3 3.32Å; Q426-W510 WeakPolarHBondContact O-CZ3 3.35Å
427	F	81.1	Confident	66.8	Low	105 Å²	105	78.4 Å²	78.4	46%	0.461	41%	0.412	S	S	.	.			trans	-65.1	123.1	176.5	176.7	-87.5	0	0	0	109.7	E506 Q507 W510	F427-E506 HydrophobicContact CE2-CG 4.19Å; F427-Q507 HydrophobicContact CE2-CG 3.76Å; F427-Q507 HydrophobicContact CZ-CG 4.04Å; F427-W510 HydrophobicContact CD2-CB 3.98Å; F427-W510 AromaticContact CD2-CD1 3.3Å; F427-W510 HydrophobicContact CD2-CD2 4.15Å; F427-W510 AromaticContact CD2-CG 3.56Å; F427-W510 HydrophobicContact CD2-CG 3.56Å; F427-W510 AromaticContact CD2-NE1 3.69Å; F427-W510 AromaticContact CE2-CD1 3.4Å; F427-W510 HydrophobicContact CE2-CG 4.08Å; F427-W510 AromaticContact CE2-NE1 3.86Å
428	V	81.2	Confident	68.6	Low	69 Å²	69	79.1 Å²	79.1	42%	0.418	41%	0.412	S	S	.	.			trans	-132.4	130.3	169	-170.5	0	0	0	0	106.5	Q426 V431 W510	Q426-V428 PolarHBondContact O-N 3.02Å; V428-V431 HydrophobicContact CB-CG2 3.75Å; V428-V431 HydrophobicContact CG1-CG2 3.51Å; V428-W510 PolarHBondContact O-NE1 2.82Å
429	S	77.7	Confident	70.5	Confident	73 Å²	73	77.4 Å²	77.4	51%	0.51	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	145.5	-173.7	50.7	0	0	0	0	113.2	V431 E506	S429-V431 VanDerWaalsContact C-N 3.28Å; S429-V431 PolarHBondContact O-N 2.94Å; S429-E506 VanDerWaalsContact CA-OE2 3.25Å; S429-E506 WeakPolarHBondContact CA-OE2 3.4Å
430	G	79.1	Confident	72.4	Confident	16 Å²	16	71.8 Å²	71.8	17%	0.165	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.8	11.2	-179.4	0	0	0	0	0	114.6	A479 E506	G430-A479 WeakPolarHBondContact O-CB 3.48Å; G430-E506 VanDerWaalsContact N-CD 3.26Å; G430-E506 PolarHBondContact N-OE1 2.83Å; G430-E506 PolarHBondContact N-OE2 3.4Å
431	V	83.2	Confident	74.1	Confident	4 Å²	4	64.7 Å²	64.7	2%	0.024	35%	0.354	C	S	.	.			trans	-94.9	-0.9	-174.5	-169.7	0	0	0	0	112	V428 S429 R472 F473 P476 E506	V428-V431 HydrophobicContact CB-CG2 3.75Å; V428-V431 HydrophobicContact CG1-CG2 3.51Å; S429-V431 VanDerWaalsContact C-N 3.28Å; S429-V431 PolarHBondContact O-N 2.94Å; V431-R472 HydrophobicContact CG1-CG 4.02Å; V431-R472 WeakPolarHBondContact O-CA 3.11Å; V431-F473 HydrophobicContact CG1-CB 4.3Å; V431-F473 WeakPolarHBondContact CG1-O 3.34Å; V431-F473 PolarHBondContact O-N 2.76Å; V431-P476 HydrophobicContact CG2-CB 4.14Å; V431-E506 PolarHBondContact N-OE1 3.44Å
432	I	84.3	Confident	75.6	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	124.6	-171.9	-45.9	-164.9	0	0	0	110.7	V471 R472 L501 E506 Y509 W510	I432-V471 CarbonylContact C-O 3.42Å; I432-V471 WeakPolarHBondContact CA-O 3.3Å; I432-R472 HydrophobicContact CG1-CG 4.13Å; I432-L501 HydrophobicContact CB-CB 4.41Å; I432-L501 HydrophobicContact CB-CD1 4.44Å; I432-L501 HydrophobicContact CG2-CD1 3.79Å; I432-L501 PolarHBondContact O-N 3Å; I432-E506 HydrophobicContact CD1-CG 4.43Å; I432-Y509 HydrophobicContact CD1-CD1 3.54Å; I432-Y509 HydrophobicContact CD1-CE1 3.81Å; I432-Y509 HydrophobicContact CG2-CD1 3.75Å; I432-Y509 HydrophobicContact CG2-CE1 3.65Å; I432-W510 HydrophobicContact CD1-CD2 4.17Å; I432-W510 HydrophobicContact CD1-CG 4.23Å; I432-W510 HydrophobicContact CD1-CZ2 4.17Å
433	V	84.5	Confident	76.6	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.006	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	125.8	179.1	-179.9	0	0	0	0	108.9	I435 V471 F473 A479 V483 L498 E499	V433-I435 HydrophobicContact CG1-CG1 4.33Å; V433-V471 PolarHBondContact N-O 2.89Å; V433-V471 PolarHBondContact O-N 3.01Å; V433-F473 HydrophobicContact CB-CE2 4.06Å; V433-F473 HydrophobicContact CG2-CD2 4.03Å; V433-F473 HydrophobicContact CG2-CE2 3.63Å; V433-A479 HydrophobicContact CG2-CB 4.01Å; V433-V483 HydrophobicContact CB-CG2 4.28Å; V433-V483 HydrophobicContact CG1-CG2 3.6Å; V433-V483 HydrophobicContact CG2-CG2 3.62Å; V433-L498 HydrophobicContact CG1-CB 4.17Å; V433-L498 HydrophobicContact CG1-CD2 4.37Å; V433-L498 HydrophobicContact CG1-CG 4.33Å; V433-E499 CarbonylContact C-O 3.54Å; V433-E499 WeakPolarHBondContact CA-O 3.42Å
434	K	84.9	Confident	77.6	Confident	40 Å²	40	52.7 Å²	52.7	17%	0.174	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	134.9	166.4	-168	-173.6	-179.2	-167.3	0	108.8	T436 E468 L498 E499 L501	K434-T436 HydrophobicContact CD-CG2 4.16Å; K434-T436 HydrophobicContact CG-CG2 4.22Å; K434-E468 WeakPolarHBondContact CE-OE1 3.41Å; K434-E468 WeakPolarHBondContact CE-OE2 3.06Å; K434-E468 IonicContact NZ-OE1 3.8Å; K434-E468 PolarHBondContact NZ-OE1 3.27Å; K434-E468 IonicContact NZ-OE2 2.64Å; K434-E468 PolarHBondContact NZ-OE2 2.81Å; K434-E468 VanDerWaalsContact NZ-OE2 3.14Å; K434-L498 WeakPolarHBondContact O-CA 3.45Å; K434-E499 HydrophobicContact CB-CB 4.5Å; K434-E499 PolarHBondContact N-O 3.43Å; K434-E499 PolarHBondContact O-N 2.95Å; K434-L501 HydrophobicContact CB-CD1 3.97Å; K434-L501 HydrophobicContact CB-CG 4.05Å
435	I	84.1	Confident	78.3	Confident	3 Å²	3	59.1 Å²	59.1	2%	0.015	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	130.3	173.6	-47.8	-170.6	0	0	0	107.6	V433 I447 L451 E468 C469 V471 W496 K497 L498	V433-I435 HydrophobicContact CG1-CG1 4.33Å; I435-I447 HydrophobicContact CD1-CG2 4.49Å; I435-L451 HydrophobicContact CD1-CD1 3.68Å; I435-E468 CarbonylContact O-C 3.45Å; I435-E468 WeakPolarHBondContact O-CA 3.24Å; I435-C469 HydrophobicContact CB-CB 4.36Å; I435-C469 PolarHBondContact N-O 2.76Å; I435-C469 PolarHBondContact O-N 2.88Å; I435-V471 HydrophobicContact CD1-CG2 3.68Å; I435-V471 HydrophobicContact CG1-CG2 4.23Å; I435-W496 HydrophobicContact CG2-CB 4.03Å; I435-W496 HydrophobicContact CG2-CG 4.33Å; I435-K497 WeakPolarHBondContact CA-O 3.43Å; I435-L498 HydrophobicContact CD1-CG 4.44Å; I435-L498 HydrophobicContact CG1-CG 4.2Å; I435-L498 HydrophobicContact CG2-CD1 4.25Å; I435-L498 HydrophobicContact CG2-CG 4.49Å
436	T	81.4	Confident	78.6	Confident	25 Å²	25	61.1 Å²	61.1	15%	0.153	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	146.9	175	61.4	0	0	0	0	111.4	K434 V467 E468 K497	K434-T436 HydrophobicContact CD-CG2 4.16Å; K434-T436 HydrophobicContact CG-CG2 4.22Å; T436-V467 WeakPolarHBondContact CA-O 3.47Å; T436-E468 HydrophobicContact CG2-CB 4.29Å; T436-E468 HydrophobicContact CG2-CG 3.94Å; T436-K497 PolarHBondContact N-O 2.9Å; T436-K497 PolarHBondContact O-N 3.27Å
437	D	78.8	Confident	78.7	Confident	30 Å²	30	55 Å²	55	16%	0.16	30%	0.298	C	S	.	.			trans	-142.5	162.2	176.1	-168	3.8	0	0	0	110.2	K439 L441 V467 S495 W496	D437-K439 PolarHBondContact O-N 3.43Å; D437-L441 HydrophobicContact CB-CD2 3.62Å; D437-L441 HydrophobicContact CB-CG 4.41Å; D437-V467 PolarHBondContact N-O 3.41Å; D437-S495 PolarHBondContact OD1-OG 3.25Å; D437-W496 VanDerWaalsContact CG-CD1 3.5Å; D437-W496 PolarHBondContact OD2-NE1 3.43Å
438	S	69.9	Low	78.7	Confident	98 Å²	98	54.5 Å²	54.5	69%	0.685	30%	0.296	S	S	*	.	S	Bend	trans	-71.1	-11.6	174	61	0	0	0	0	114.5
439	K	73.4	Confident	78.7	Confident	141 Å²	141	55.6 Å²	55.6	61%	0.613	30%	0.299	S	S	*	.	S	Bend	trans	-130.2	152.4	-175.1	-69.5	174.6	-175.7	174.3	0	109.3	D437 L441	D437-K439 PolarHBondContact O-N 3.43Å; K439-L441 PolarHBondContact O-N 2.84Å
440	P	75.6	Confident	78.7	Confident	88 Å²	88	53.7 Å²	53.7	57%	0.571	29%	0.288	S	S	*	.	P	Polyproline II helix	trans	-57.4	129.9	178.1	24.2	-34.5	0	0	0	110.2
441	L	71.6	Confident	78.6	Confident	12 Å²	12	53.1 Å²	53.1	6%	0.063	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-71.1	146.1	-169.4	-73.6	171.8	0	0	0	111.5	D437 K439 I447 I462 D466 C469	D437-L441 HydrophobicContact CB-CD2 3.62Å; D437-L441 HydrophobicContact CB-CG 4.41Å; K439-L441 PolarHBondContact O-N 2.84Å; L441-I447 HydrophobicContact CB-CD1 4.13Å; L441-I462 HydrophobicContact CB-CD1 3.63Å; L441-D466 PolarHBondContact N-O 2.88Å; L441-C469 HydrophobicContact CD1-CB 3.53Å
442	P	73.3	Confident	78.4	Confident	34 Å²	34	55.8 Å²	55.8	22%	0.221	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-69	152.3	-175.3	28.9	-35.4	0	0	0	112	R444 I446 I447 W496	P442-R444 PolarHBondContact O-N 3.06Å; P442-I446 HydrophobicContact CB-CB 4.21Å; P442-I446 HydrophobicContact CB-CD1 4.09Å; P442-I446 HydrophobicContact CB-CG2 4.11Å; P442-I446 HydrophobicContact CG-CB 4.48Å; P442-I446 HydrophobicContact CG-CG2 4.11Å; P442-I447 HydrophobicContact CG-CG1 4.08Å; P442-I447 VanDerWaalsContact O-CD1 3.25Å; P442-I447 WeakPolarHBondContact O-CD1 3.36Å; P442-I447 WeakPolarHBondContact O-CG1 3.23Å; P442-W496 HydrophobicContact CG-CH2 4.01Å; P442-W496 HydrophobicContact CG-CZ2 3.66Å
443	A	75.8	Confident	78.2	Confident	54 Å²	54	64 Å²	64	45%	0.446	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-48	135.7	-173.8	0	0	0	0	0	113.6	K445 I446	A443-K445 CarbonylContact O-C 3.54Å; A443-K445 PolarHBondContact O-N 3.33Å; A443-I446 WeakPolarHBondContact O-CB 3.49Å; A443-I446 PolarHBondContact O-N 3.15Å
444	R	79.1	Confident	77.8	Confident	114 Å²	114	65.6 Å²	65.6	43%	0.43	35%	0.345	S	S	.	.	H	α-helix	trans	-31.6	-35.3	-173.5	-170.9	176.6	-177.6	-104.3	-4.8	118.2	P442 K448 V460 I462	P442-R444 PolarHBondContact O-N 3.06Å; R444-K448 PolarHBondContact O-N 3.26Å; R444-V460 HydrophobicContact CG-CB 4.06Å; R444-V460 HydrophobicContact CG-CG1 4Å; R444-V460 PolarHBondContact NE-O 3.24Å; R444-V460 PolarHBondContact NH2-O 3.15Å; R444-V460 VanDerWaalsContact NH2-O 3.14Å; R444-I462 HydrophobicContact CB-CG2 3.65Å; R444-I462 HydrophobicContact CG-CG2 3.84Å
445	K	77.4	Confident	77.5	Confident	164 Å²	164	64.1 Å²	64.1	71%	0.713	34%	0.34	S	S	*	.	H	α-helix	trans	-63.4	-52.1	174.5	-68.8	-172.2	177.6	-173.6	0	111.7	A443 I447 K448 D449	A443-K445 CarbonylContact O-C 3.54Å; A443-K445 PolarHBondContact O-N 3.33Å; K445-I447 VanDerWaalsContact C-N 3.28Å; K445-I447 PolarHBondContact O-N 3.22Å; K445-K448 CarbonylContact O-C 3.58Å; K445-K448 WeakPolarHBondContact O-CA 3.43Å; K445-K448 WeakPolarHBondContact O-CB 3.41Å; K445-K448 PolarHBondContact O-N 2.94Å; K445-D449 WeakPolarHBondContact O-CB 3.39Å; K445-D449 PolarHBondContact O-N 2.93Å
446	I	79.3	Confident	77.4	Confident	81 Å²	81	67.3 Å²	67.3	42%	0.415	36%	0.361	S	S	.	.	H	α-helix	trans	-58.4	-41.3	-175.7	-61	167.4	0	0	0	110.9	P442 A443 A450	P442-I446 HydrophobicContact CB-CB 4.21Å; P442-I446 HydrophobicContact CB-CD1 4.09Å; P442-I446 HydrophobicContact CB-CG2 4.11Å; P442-I446 HydrophobicContact CG-CB 4.48Å; P442-I446 HydrophobicContact CG-CG2 4.11Å; A443-I446 WeakPolarHBondContact O-CB 3.49Å; A443-I446 PolarHBondContact O-N 3.15Å; I446-A450 VanDerWaalsContact O-CB 3.27Å; I446-A450 WeakPolarHBondContact O-CB 3.25Å; I446-A450 PolarHBondContact O-N 2.87Å
447	I	77.6	Confident	77.4	Confident	2 Å²	2	66.5 Å²	66.5	1%	0.01	36%	0.356	C	S	.	.	H	α-helix	trans	-64.3	-46.7	174.6	-61.2	175.1	0	0	0	110.7	I435 L441 P442 K445 L451 V460 I462 C469 V471	I435-I447 HydrophobicContact CD1-CG2 4.49Å; L441-I447 HydrophobicContact CB-CD1 4.13Å; P442-I447 HydrophobicContact CG-CG1 4.08Å; P442-I447 VanDerWaalsContact O-CD1 3.25Å; P442-I447 WeakPolarHBondContact O-CD1 3.36Å; P442-I447 WeakPolarHBondContact O-CG1 3.23Å; K445-I447 VanDerWaalsContact C-N 3.28Å; K445-I447 PolarHBondContact O-N 3.22Å; I447-L451 HydrophobicContact CG2-CD1 3.74Å; I447-L451 WeakPolarHBondContact O-CB 3.17Å; I447-L451 WeakPolarHBondContact O-CG 3.46Å; I447-L451 PolarHBondContact O-N 2.97Å; I447-V460 HydrophobicContact CB-CG1 4.36Å; I447-V460 HydrophobicContact CG2-CG1 4.05Å; I447-I462 HydrophobicContact CD1-CD1 3.54Å; I447-C469 HydrophobicContact CD1-CB 4.32Å; I447-V471 HydrophobicContact CG2-CG2 4.35Å
448	K	80.9	Confident	77.6	Confident	96 Å²	96	66.4 Å²	66.4	42%	0.417	36%	0.359	S	S	.	.	H	α-helix	trans	-62.4	-48.3	178.7	-161.1	-157.6	173.2	-160.7	0	111.4	R444 K445 A450 L451 S452 V457 V460	R444-K448 PolarHBondContact O-N 3.26Å; K445-K448 CarbonylContact O-C 3.58Å; K445-K448 WeakPolarHBondContact O-CA 3.43Å; K445-K448 WeakPolarHBondContact O-CB 3.41Å; K445-K448 PolarHBondContact O-N 2.94Å; K448-A450 VanDerWaalsContact C-N 3.29Å; K448-A450 PolarHBondContact O-N 3.19Å; K448-L451 PolarHBondContact O-N 2.93Å; K448-S452 VanDerWaalsContact O-CB 3.28Å; K448-S452 WeakPolarHBondContact O-CB 3.47Å; K448-S452 PolarHBondContact O-N 3Å; K448-S452 PolarHBondContact O-OG 3.43Å; K448-V457 HydrophobicContact CG-CB 4.13Å; K448-V457 HydrophobicContact CG-CG1 4.09Å; K448-V460 HydrophobicContact CB-CG2 3.91Å; K448-V460 HydrophobicContact CG-CG2 4.06Å
449	D	80.9	Confident	78.1	Confident	92 Å²	92	66 Å²	66	49%	0.492	34%	0.343	S	S	.	.	H	α-helix	trans	-69.9	-27.4	-173.5	-56.8	-22.6	0	0	0	111.6	K445 S452	K445-D449 WeakPolarHBondContact O-CB 3.39Å; K445-D449 PolarHBondContact O-N 2.93Å; D449-S452 WeakPolarHBondContact CA-OG 3.41Å; D449-S452 PolarHBondContact O-OG 3.04Å
450	A	76.8	Confident	78.6	Confident	33 Å²	33	59.4 Å²	59.4	27%	0.273	32%	0.315	S	S	.	.	H	α-helix	trans	-71.7	-53.7	168.9	0	0	0	0	0	111.7	I446 K448 S452 K453	I446-A450 VanDerWaalsContact O-CB 3.27Å; I446-A450 WeakPolarHBondContact O-CB 3.25Å; I446-A450 PolarHBondContact O-N 2.87Å; K448-A450 VanDerWaalsContact C-N 3.29Å; K448-A450 PolarHBondContact O-N 3.19Å; A450-S452 VanDerWaalsContact C-N 3.33Å; A450-S452 PolarHBondContact O-N 2.81Å; A450-K453 WeakPolarHBondContact O-CB 3.07Å; A450-K453 PolarHBondContact O-N 3.42Å
451	L	77.6	Confident	78.9	Confident	4 Å²	4	56.4 Å²	56.4	2%	0.021	29%	0.294	C	S	.	.	H	α-helix	trans	-69.5	-28.7	-176.3	-66.6	171.1	0	0	0	113	I435 I447 K448 K453 V454 S455 V457 V471 A486	I435-L451 HydrophobicContact CD1-CD1 3.68Å; I447-L451 HydrophobicContact CG2-CD1 3.74Å; I447-L451 WeakPolarHBondContact O-CB 3.17Å; I447-L451 WeakPolarHBondContact O-CG 3.46Å; I447-L451 PolarHBondContact O-N 2.97Å; K448-L451 PolarHBondContact O-N 2.93Å; L451-K453 PolarHBondContact O-N 3.09Å; L451-V454 PolarHBondContact O-N 3.3Å; L451-S455 PolarHBondContact O-N 3.01Å; L451-S455 VanDerWaalsContact O-N 3.09Å; L451-V457 HydrophobicContact CB-CG2 3.63Å; L451-V471 HydrophobicContact CD1-CB 4.41Å; L451-V471 HydrophobicContact CD1-CG1 4.03Å; L451-V471 HydrophobicContact CD1-CG2 3.82Å; L451-A486 HydrophobicContact CD2-CB 4.47Å
452	S	79.1	Confident	79.3	Confident	59 Å²	59	56.7 Å²	56.7	41%	0.413	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-8.3	175.4	61.7	0	0	0	0	114.4	K448 D449 A450 V454	K448-S452 VanDerWaalsContact O-CB 3.28Å; K448-S452 WeakPolarHBondContact O-CB 3.47Å; K448-S452 PolarHBondContact O-N 3Å; K448-S452 PolarHBondContact O-OG 3.43Å; D449-S452 WeakPolarHBondContact CA-OG 3.41Å; D449-S452 PolarHBondContact O-OG 3.04Å; A450-S452 VanDerWaalsContact C-N 3.33Å; A450-S452 PolarHBondContact O-N 2.81Å; S452-V454 VanDerWaalsContact C-N 3.29Å
453	K	79.6	Confident	79.3	Confident	173 Å²	173	60.5 Å²	60.5	75%	0.752	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-20.3	166.4	-60.9	177	-178.9	-179.1	0	112.6	A450 L451	A450-K453 WeakPolarHBondContact O-CB 3.07Å; A450-K453 PolarHBondContact O-N 3.42Å; L451-K453 PolarHBondContact O-N 3.09Å
454	V	77.4	Confident	79	Confident	34 Å²	34	65.4 Å²	65.4	21%	0.206	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104	-48.8	-174.2	-172.2	0	0	0	0	111.1	L451 S452 N485 A486	L451-V454 PolarHBondContact O-N 3.3Å; S452-V454 VanDerWaalsContact C-N 3.29Å; V454-N485 HydrophobicContact CG1-CB 3.75Å; V454-A486 HydrophobicContact CG2-CB 4.43Å
455	S	78.5	Confident	78.5	Confident	9 Å²	9	62.4 Å²	62.4	6%	0.063	34%	0.336	C	S	.	.	S	Bend	trans	-157.3	157	175.3	66.9	0	0	0	0	112.5	L451 V457 F473 D478	L451-S455 PolarHBondContact O-N 3.01Å; L451-S455 VanDerWaalsContact O-N 3.09Å; S455-V457 PolarHBondContact O-N 3.42Å; S455-F473 WeakPolarHBondContact OG-CD1 3.46Å; S455-F473 WeakPolarHBondContact OG-CE1 3.46Å; S455-D478 WeakPolarHBondContact CB-O 3.26Å; S455-D478 PolarHBondContact OG-O 2.96Å
456	P	80.6	Confident	78.4	Confident	70 Å²	70	57.4 Å²	57.4	46%	0.455	32%	0.318	S	S	.	.			trans	-67.1	100.7	-173.1	25	-36.5	0	0	0	113.8	A458 H474 D478	P456-A458 PolarHBondContact O-N 3.32Å; P456-H474 PolarHBondContact O-CE1 3.24Å; P456-H474 PolarHBondContact O-ND1 3.12Å; P456-D478 VanDerWaalsContact CD-OD1 3.31Å; P456-D478 WeakPolarHBondContact CD-OD1 3.36Å
457	V	82.3	Confident	78.4	Confident	8 Å²	8	57.1 Å²	57.1	5%	0.048	32%	0.319	C	S	.	.			trans	-71.5	120.4	176.5	-179.4	0	0	0	0	112.6	K448 L451 S455 V460 V471 F473	K448-V457 HydrophobicContact CG-CB 4.13Å; K448-V457 HydrophobicContact CG-CG1 4.09Å; L451-V457 HydrophobicContact CB-CG2 3.63Å; S455-V457 PolarHBondContact O-N 3.42Å; V457-V460 HydrophobicContact CG1-CG2 3.67Å; V457-V471 HydrophobicContact CG1-CG1 3.65Å; V457-V471 HydrophobicContact CG2-CG1 4.24Å; V457-F473 HydrophobicContact CG2-CD1 4.24Å; V457-F473 HydrophobicContact CG2-CE1 3.64Å; V457-F473 HydrophobicContact CG2-CZ 4.22Å
458	A	82.3	Confident	78.6	Confident	29 Å²	29	60.9 Å²	60.9	24%	0.24	34%	0.337	C	S	.	.			trans	-80.7	-40.9	175.9	0	0	0	0	0	113.1	P456 R472 F473 H474	P456-A458 PolarHBondContact O-N 3.32Å; A458-R472 WeakPolarHBondContact CA-O 3.04Å; A458-R472 WeakPolarHBondContact CB-O 3.37Å; A458-R472 PolarHBondContact N-O 2.77Å; A458-F473 VanDerWaalsContact CB-O 3.23Å; A458-F473 WeakPolarHBondContact CB-O 3.35Å; A458-H474 WeakPolarHBondContact CA-CE1 3.08Å; A458-H474 VanDerWaalsContact CB-CE1 3.47Å; A458-H474 WeakPolarHBondContact CB-CE1 3.45Å; A458-H474 WeakPolarHBondContact CB-NE2 3.23Å
459	Y	81.5	Confident	78.7	Confident	89 Å²	89	56.3 Å²	56.3	35%	0.349	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	147.7	177.6	-162	-101.9	0	0	0	112.2	D461 V471 R472	Y459-D461 HydrophobicContact CD1-CB 4.1Å; Y459-D461 HydrophobicContact CE1-CB 3.8Å; Y459-V471 WeakPolarHBondContact O-CA 3.43Å; Y459-R472 PolarHBondContact N-O 2.94Å; Y459-R472 PolarHBondContact O-N 3Å
460	V	83	Confident	78.9	Confident	3 Å²	3	53.7 Å²	53.7	2%	0.018	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	122	168.9	-179.2	0	0	0	0	106.6	R444 I447 K448 V457 I462 C469 V471	R444-V460 HydrophobicContact CG-CB 4.06Å; R444-V460 HydrophobicContact CG-CG1 4Å; R444-V460 PolarHBondContact NE-O 3.24Å; R444-V460 PolarHBondContact NH2-O 3.15Å; R444-V460 VanDerWaalsContact NH2-O 3.14Å; I447-V460 HydrophobicContact CB-CG1 4.36Å; I447-V460 HydrophobicContact CG2-CG1 4.05Å; K448-V460 HydrophobicContact CB-CG2 3.91Å; K448-V460 HydrophobicContact CG-CG2 4.06Å; V457-V460 HydrophobicContact CG1-CG2 3.67Å; V460-I462 HydrophobicContact CG1-CG2 4.01Å; V460-C469 VanDerWaalsContact CG1-SG 3.5Å; V460-V471 HydrophobicContact CG1-CG2 4.38Å; V460-V471 HydrophobicContact CG2-CG1 4.38Å; V460-V471 HydrophobicContact CG2-CG2 4.39Å
461	D	82.2	Confident	79.3	Confident	24 Å²	24	52.1 Å²	52.1	13%	0.128	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	119.8	172.5	-157.4	43.3	0	0	0	108.6	Y459 C469 H470 Y509 K512	Y459-D461 HydrophobicContact CD1-CB 4.1Å; Y459-D461 HydrophobicContact CE1-CB 3.8Å; D461-C469 PolarHBondContact O-SG 3.36Å; D461-H470 HydrophobicContact CB-CB 4.4Å; D461-H470 PolarHBondContact N-O 2.55Å; D461-H470 PolarHBondContact O-N 3.41Å; D461-Y509 WeakPolarHBondContact CB-OH 3.29Å; D461-K512 IonicContact OD2-NZ 3.7Å; D461-K512 PolarHBondContact OD2-NZ 3.39Å
462	I	80.9	Confident	79.6	Confident	18 Å²	18	54.4 Å²	54.4	9%	0.092	30%	0.297	C	S	.	.			trans	-161.5	136	-177.8	179	169.9	0	0	0	106.8	L441 R444 I447 V460 D466 C469	L441-I462 HydrophobicContact CB-CD1 3.63Å; R444-I462 HydrophobicContact CB-CG2 3.65Å; R444-I462 HydrophobicContact CG-CG2 3.84Å; I447-I462 HydrophobicContact CD1-CD1 3.54Å; V460-I462 HydrophobicContact CG1-CG2 4.01Å; I462-D466 HydrophobicContact CG1-CB 4.4Å; I462-C469 HydrophobicContact CB-CB 4.29Å; I462-C469 HydrophobicContact CD1-CB 4.38Å
463	L	73.4	Confident	79.9	Confident	114 Å²	114	51.7 Å²	51.7	60%	0.597	28%	0.278	S	S	*	.			trans	-97.3	150	166.7	-48.4	175.9	0	0	0	109	G465 D466	L463-G465 PolarHBondContact O-N 3.06Å; L463-D466 WeakPolarHBondContact CA-OD2 3.38Å; L463-D466 WeakPolarHBondContact CB-OD2 3.15Å; L463-D466 WeakPolarHBondContact CG-OD2 3.19Å; L463-D466 PolarHBondContact N-OD2 3.19Å; L463-D466 PolarHBondContact O-N 2.99Å; L463-D466 VanDerWaalsContact O-N 3.07Å
464	D	69.1	Low	80	Confident	158 Å²	158	49.2 Å²	49.2	85%	0.845	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	102.5	-176	-63.4	-53.5	0	0	0	110.4
465	G	68.3	Low	80.3	Confident	50 Å²	50	50.3 Å²	50.3	52%	0.515	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	120.5	-9.6	-176.9	0	0	0	0	0	115.3	L463	L463-G465 PolarHBondContact O-N 3.06Å
466	D	76	Confident	80.5	Confident	60 Å²	60	52.6 Å²	52.6	32%	0.321	29%	0.29	S	S	.	.			trans	-65.6	143	179.6	-68.6	-23.4	0	0	0	112.5	L441 I462 L463 E468	L441-D466 PolarHBondContact N-O 2.88Å; I462-D466 HydrophobicContact CG1-CB 4.4Å; L463-D466 WeakPolarHBondContact CA-OD2 3.38Å; L463-D466 WeakPolarHBondContact CB-OD2 3.15Å; L463-D466 WeakPolarHBondContact CG-OD2 3.19Å; L463-D466 PolarHBondContact N-OD2 3.19Å; L463-D466 PolarHBondContact O-N 2.99Å; L463-D466 VanDerWaalsContact O-N 3.07Å; D466-E468 WeakPolarHBondContact CB-O 3.09Å
467	V	79.1	Confident	80.5	Confident	74 Å²	74	56.7 Å²	56.7	45%	0.448	30%	0.304	S	S	.	.	S	Bend	trans	-88.1	-5.5	167.7	-66	0	0	0	0	113.1	T436 D437	T436-V467 WeakPolarHBondContact CA-O 3.47Å; D437-V467 PolarHBondContact N-O 3.41Å
468	E	81	Confident	80.5	Confident	82 Å²	82	57.8 Å²	57.8	38%	0.383	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	136.9	176.5	-47.7	-157.8	145.2	0	0	110.9	K434 I435 T436 D466	K434-E468 WeakPolarHBondContact CE-OE1 3.41Å; K434-E468 WeakPolarHBondContact CE-OE2 3.06Å; K434-E468 IonicContact NZ-OE1 3.8Å; K434-E468 PolarHBondContact NZ-OE1 3.27Å; K434-E468 IonicContact NZ-OE2 2.64Å; K434-E468 PolarHBondContact NZ-OE2 2.81Å; K434-E468 VanDerWaalsContact NZ-OE2 3.14Å; I435-E468 CarbonylContact O-C 3.45Å; I435-E468 WeakPolarHBondContact O-CA 3.24Å; T436-E468 HydrophobicContact CG2-CB 4.29Å; T436-E468 HydrophobicContact CG2-CG 3.94Å; D466-E468 WeakPolarHBondContact CB-O 3.09Å
469	C	82.6	Confident	80.3	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	143.7	174.3	177.1	0	0	0	0	109.9	I435 L441 I447 V460 D461 I462	I435-C469 HydrophobicContact CB-CB 4.36Å; I435-C469 PolarHBondContact N-O 2.76Å; I435-C469 PolarHBondContact O-N 2.88Å; L441-C469 HydrophobicContact CD1-CB 3.53Å; I447-C469 HydrophobicContact CD1-CB 4.32Å; V460-C469 VanDerWaalsContact CG1-SG 3.5Å; D461-C469 PolarHBondContact O-SG 3.36Å; I462-C469 HydrophobicContact CB-CB 4.29Å; I462-C469 HydrophobicContact CD1-CB 4.38Å
470	H	86	Confident	80.2	Confident	37 Å²	37	54.1 Å²	54.1	17%	0.171	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	114.2	177.1	-68.8	60.7	0	0	0	109.5	D461 L501 Y509	D461-H470 HydrophobicContact CB-CB 4.4Å; D461-H470 PolarHBondContact N-O 2.55Å; D461-H470 PolarHBondContact O-N 3.41Å; H470-L501 VanDerWaalsContact CD2-CD1 3.48Å; H470-L501 WeakPolarHBondContact CD2-CD1 3.46Å; H470-Y509 HydrophobicContact CB-CD2 4.33Å; H470-Y509 HydrophobicContact CB-CE1 4.02Å; H470-Y509 HydrophobicContact CB-CE2 3.54Å; H470-Y509 VanDerWaalsContact CB-OH 3.29Å; H470-Y509 WeakPolarHBondContact CB-OH 3.49Å; H470-Y509 AromaticContact CD2-CD2 3.48Å; H470-Y509 VanDerWaalsContact CD2-CD2 3.48Å; H470-Y509 WeakPolarHBondContact CD2-CD2 3.48Å; H470-Y509 AromaticContact CD2-CE2 3.59Å; H470-Y509 AromaticContact CD2-CG 3.89Å; H470-Y509 AromaticContact CG-CE2 3.64Å; H470-Y509 AromaticContact CG-CZ 3.97Å
471	V	84.9	Confident	80	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	134.7	-177.5	-176.1	0	0	0	0	109.5	I432 V433 I435 I447 L451 V457 Y459 V460 F473	I432-V471 CarbonylContact C-O 3.42Å; I432-V471 WeakPolarHBondContact CA-O 3.3Å; V433-V471 PolarHBondContact N-O 2.89Å; V433-V471 PolarHBondContact O-N 3.01Å; I435-V471 HydrophobicContact CD1-CG2 3.68Å; I435-V471 HydrophobicContact CG1-CG2 4.23Å; I447-V471 HydrophobicContact CG2-CG2 4.35Å; L451-V471 HydrophobicContact CD1-CB 4.41Å; L451-V471 HydrophobicContact CD1-CG1 4.03Å; L451-V471 HydrophobicContact CD1-CG2 3.82Å; V457-V471 HydrophobicContact CG1-CG1 3.65Å; V457-V471 HydrophobicContact CG2-CG1 4.24Å; Y459-V471 WeakPolarHBondContact O-CA 3.43Å; V460-V471 HydrophobicContact CG1-CG2 4.38Å; V460-V471 HydrophobicContact CG2-CG1 4.38Å; V460-V471 HydrophobicContact CG2-CG2 4.39Å; V471-F473 HydrophobicContact CB-CE2 4.24Å; V471-F473 HydrophobicContact CG1-CD2 4.36Å; V471-F473 HydrophobicContact CG1-CE1 4.49Å; V471-F473 HydrophobicContact CG1-CE2 3.69Å; V471-F473 HydrophobicContact CG1-CZ 3.76Å
472	R	84.3	Confident	79.5	Confident	51 Å²	51	54.6 Å²	54.6	19%	0.192	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	130.2	174.3	-169.9	-171.8	75.7	-160.3	-0	110	V431 I432 A458 Y459	V431-R472 HydrophobicContact CG1-CG 4.02Å; V431-R472 WeakPolarHBondContact O-CA 3.11Å; I432-R472 HydrophobicContact CG1-CG 4.13Å; A458-R472 WeakPolarHBondContact CA-O 3.04Å; A458-R472 WeakPolarHBondContact CB-O 3.37Å; A458-R472 PolarHBondContact N-O 2.77Å; Y459-R472 PolarHBondContact N-O 2.94Å; Y459-R472 PolarHBondContact O-N 3Å
473	F	84.5	Confident	79.3	Confident	3 Å²	3	54.1 Å²	54.1	1%	0.013	30%	0.303	C	S	.	.			trans	-91.8	-167.6	175.7	-66.1	-87.7	0	0	0	111.2	V431 V433 S455 V457 A458 V471 D478 A479 A482	V431-F473 HydrophobicContact CG1-CB 4.3Å; V431-F473 WeakPolarHBondContact CG1-O 3.34Å; V431-F473 PolarHBondContact O-N 2.76Å; V433-F473 HydrophobicContact CB-CE2 4.06Å; V433-F473 HydrophobicContact CG2-CD2 4.03Å; V433-F473 HydrophobicContact CG2-CE2 3.63Å; S455-F473 WeakPolarHBondContact OG-CD1 3.46Å; S455-F473 WeakPolarHBondContact OG-CE1 3.46Å; V457-F473 HydrophobicContact CG2-CD1 4.24Å; V457-F473 HydrophobicContact CG2-CE1 3.64Å; V457-F473 HydrophobicContact CG2-CZ 4.22Å; A458-F473 VanDerWaalsContact CB-O 3.23Å; A458-F473 WeakPolarHBondContact CB-O 3.35Å; V471-F473 HydrophobicContact CB-CE2 4.24Å; V471-F473 HydrophobicContact CG1-CD2 4.36Å; V471-F473 HydrophobicContact CG1-CE1 4.49Å; V471-F473 HydrophobicContact CG1-CE2 3.69Å; V471-F473 HydrophobicContact CG1-CZ 3.76Å; F473-D478 HydrophobicContact CB-CB 3.75Å; F473-D478 HydrophobicContact CD1-CB 4.09Å; F473-D478 HydrophobicContact CG-CB 4.17Å; F473-A479 HydrophobicContact CB-CB 4.23Å; F473-A479 HydrophobicContact CD2-CB 3.71Å; F473-A479 HydrophobicContact CE2-CB 4.49Å; F473-A479 HydrophobicContact CG-CB 4.15Å; F473-A482 HydrophobicContact CE1-CB 3.73Å; F473-A482 HydrophobicContact CE2-CB 4.04Å; F473-A482 HydrophobicContact CZ-CB 3.45Å; F473-A482 VanDerWaalsContact CZ-CB 3.45Å
474	H	82.1	Confident	79.2	Confident	120 Å²	120	52.1 Å²	52.1	56%	0.556	30%	0.298	S	S	*	.	S	Bend	trans	-98.8	-42.6	174.5	-67.5	91.6	0	0	0	111.6	P456 A458	P456-H474 PolarHBondContact O-CE1 3.24Å; P456-H474 PolarHBondContact O-ND1 3.12Å; A458-H474 WeakPolarHBondContact CA-CE1 3.08Å; A458-H474 VanDerWaalsContact CB-CE1 3.47Å; A458-H474 WeakPolarHBondContact CB-CE1 3.45Å; A458-H474 WeakPolarHBondContact CB-NE2 3.23Å
475	T	84.3	Confident	79.1	Confident	57 Å²	57	48.4 Å²	48.4	35%	0.35	28%	0.278	S	S	.	.	S	Bend	trans	-111.7	162.2	173.2	69.7	0	0	0	0	111.4	E477 D478 A479	T475-E477 VanDerWaalsContact C-N 3.28Å; T475-E477 PolarHBondContact OG1-N 2.95Å; T475-D478 WeakPolarHBondContact CB-OD2 3.27Å; T475-D478 PolarHBondContact N-OD2 2.85Å; T475-D478 WeakPolarHBondContact OG1-CB 3.39Å; T475-D478 PolarHBondContact OG1-N 3Å; T475-D478 PolarHBondContact OG1-OD2 3.49Å; T475-A479 PolarHBondContact O-N 2.79Å
476	P	81.5	Confident	78.8	Confident	58 Å²	58	46.1 Å²	46.1	38%	0.377	26%	0.255	S	S	.	.	H	α-helix	trans	-70.2	-26.6	169.1	28.6	-34.5	0	0	0	112.1	V431 A479 A480	V431-P476 HydrophobicContact CG2-CB 4.14Å; P476-A479 PolarHBondContact O-N 3.25Å; P476-A480 PolarHBondContact O-N 3.2Å
477	E	81.9	Confident	77.9	Confident	156 Å²	156	48 Å²	48	73%	0.729	26%	0.26	S	S	*	.	H	α-helix	trans	-66.2	-43.7	175	-67.1	171.9	-157.9	0	0	111.1	T475 A479 A480 A481	T475-E477 VanDerWaalsContact C-N 3.28Å; T475-E477 PolarHBondContact OG1-N 2.95Å; E477-A479 PolarHBondContact O-N 2.9Å; E477-A480 PolarHBondContact O-N 3.27Å; E477-A481 VanDerWaalsContact O-CB 3.24Å; E477-A481 WeakPolarHBondContact O-CB 2.95Å; E477-A481 PolarHBondContact O-N 3.03Å
478	D	80.8	Confident	77.1	Confident	30 Å²	30	51.7 Å²	51.7	16%	0.16	27%	0.272	C	S	.	.	H	α-helix	trans	-56.1	-37.6	171.7	-69.4	-49	0	0	0	112.3	S455 P456 F473 T475 A482	S455-D478 WeakPolarHBondContact CB-O 3.26Å; S455-D478 PolarHBondContact OG-O 2.96Å; P456-D478 VanDerWaalsContact CD-OD1 3.31Å; P456-D478 WeakPolarHBondContact CD-OD1 3.36Å; F473-D478 HydrophobicContact CB-CB 3.75Å; F473-D478 HydrophobicContact CD1-CB 4.09Å; F473-D478 HydrophobicContact CG-CB 4.17Å; T475-D478 WeakPolarHBondContact CB-OD2 3.27Å; T475-D478 PolarHBondContact N-OD2 2.85Å; T475-D478 WeakPolarHBondContact OG1-CB 3.39Å; T475-D478 PolarHBondContact OG1-N 3Å; T475-D478 PolarHBondContact OG1-OD2 3.49Å; D478-A482 WeakPolarHBondContact O-CB 3.28Å; D478-A482 PolarHBondContact O-N 2.94Å
479	A	78.6	Confident	75.9	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-74.9	-42.3	-179.5	0	0	0	0	0	111.4	G430 V433 F473 T475 P476 E477 A482 V483	G430-A479 WeakPolarHBondContact O-CB 3.48Å; V433-A479 HydrophobicContact CG2-CB 4.01Å; F473-A479 HydrophobicContact CB-CB 4.23Å; F473-A479 HydrophobicContact CD2-CB 3.71Å; F473-A479 HydrophobicContact CE2-CB 4.49Å; F473-A479 HydrophobicContact CG-CB 4.15Å; T475-A479 PolarHBondContact O-N 2.79Å; P476-A479 PolarHBondContact O-N 3.25Å; E477-A479 PolarHBondContact O-N 2.9Å; A479-A482 PolarHBondContact O-N 3.14Å; A479-V483 WeakPolarHBondContact O-CG2 3.48Å; A479-V483 PolarHBondContact O-N 2.71Å
480	A	80.3	Confident	74.6	Confident	42 Å²	42	53.9 Å²	53.9	35%	0.347	28%	0.283	S	S	.	.	H	α-helix	trans	-64.1	-46.2	173.4	0	0	0	0	0	111.6	P476 E477 A482 V483 S484 I500	P476-A480 PolarHBondContact O-N 3.2Å; E477-A480 PolarHBondContact O-N 3.27Å; A480-A482 PolarHBondContact O-N 3.38Å; A480-V483 PolarHBondContact O-N 3.09Å; A480-S484 PolarHBondContact O-N 3.02Å; A480-S484 PolarHBondContact O-OG 3.35Å; A480-I500 HydrophobicContact CB-CD1 4.45Å
481	A	77.3	Confident	73	Confident	37 Å²	37	59.4 Å²	59.4	31%	0.306	31%	0.313	S	S	.	.	H	α-helix	trans	-62.3	-40.4	175.5	0	0	0	0	0	112	E477 S484 N485	E477-A481 VanDerWaalsContact O-CB 3.24Å; E477-A481 WeakPolarHBondContact O-CB 2.95Å; E477-A481 PolarHBondContact O-N 3.03Å; A481-S484 PolarHBondContact O-N 3.42Å; A481-N485 VanDerWaalsContact O-CB 3.26Å; A481-N485 WeakPolarHBondContact O-CB 3.47Å; A481-N485 PolarHBondContact O-N 2.84Å
482	A	72.9	Confident	71.6	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-60.1	-46.6	171.6	0	0	0	0	0	111.6	F473 D478 A479 A480 S484 A486	F473-A482 HydrophobicContact CE1-CB 3.73Å; F473-A482 HydrophobicContact CE2-CB 4.04Å; F473-A482 HydrophobicContact CZ-CB 3.45Å; F473-A482 VanDerWaalsContact CZ-CB 3.45Å; D478-A482 WeakPolarHBondContact O-CB 3.28Å; D478-A482 PolarHBondContact O-N 2.94Å; A479-A482 PolarHBondContact O-N 3.14Å; A480-A482 PolarHBondContact O-N 3.38Å; A482-S484 PolarHBondContact O-N 2.78Å; A482-A486 WeakPolarHBondContact O-CA 3.37Å; A482-A486 WeakPolarHBondContact O-CB 3.24Å; A482-A486 PolarHBondContact O-N 2.89Å
483	V	75.5	Confident	70.2	Confident	8 Å²	8	73.5 Å²	73.5	5%	0.048	38%	0.378	C	S	.	.	H	α-helix	trans	-68	-35.6	-178.8	172	0	0	0	0	112.3	V433 A479 A480 K487 L498 I500	V433-V483 HydrophobicContact CB-CG2 4.28Å; V433-V483 HydrophobicContact CG1-CG2 3.6Å; V433-V483 HydrophobicContact CG2-CG2 3.62Å; A479-V483 WeakPolarHBondContact O-CG2 3.48Å; A479-V483 PolarHBondContact O-N 2.71Å; A480-V483 PolarHBondContact O-N 3.09Å; V483-K487 HydrophobicContact CG1-CD 4.29Å; V483-K487 VanDerWaalsContact O-CB 3.3Å; V483-K487 WeakPolarHBondContact O-CB 3.06Å; V483-K487 WeakPolarHBondContact O-CD 3.31Å; V483-K487 WeakPolarHBondContact O-CG 3.31Å; V483-K487 PolarHBondContact O-N 3.02Å; V483-L498 HydrophobicContact CG1-CB 4.47Å; V483-L498 HydrophobicContact CG2-CB 4.22Å; V483-I500 HydrophobicContact CB-CD1 4.41Å; V483-I500 HydrophobicContact CB-CG1 4.18Å; V483-I500 HydrophobicContact CG1-CG1 4.32Å; V483-I500 HydrophobicContact CG2-CD1 4.38Å; V483-I500 HydrophobicContact CG2-CG1 3.7Å
484	S	72.3	Confident	69	Low	71 Å²	71	79 Å²	79	50%	0.497	40%	0.399	S	S	.	.	H	α-helix	trans	-75.1	-59.2	176	-63.6	0	0	0	0	112.1	A480 A481 A482 A486 K487 E488	A480-S484 PolarHBondContact O-N 3.02Å; A480-S484 PolarHBondContact O-OG 3.35Å; A481-S484 PolarHBondContact O-N 3.42Å; A482-S484 PolarHBondContact O-N 2.78Å; S484-A486 PolarHBondContact O-N 3.35Å; S484-K487 WeakPolarHBondContact O-CB 3.23Å; S484-K487 PolarHBondContact O-N 3.23Å; S484-K487 VanDerWaalsContact O-N 3.15Å; S484-E488 PolarHBondContact O-N 3.22Å
485	N	66	Low	67.9	Low	81 Å²	81	77 Å²	77	43%	0.433	40%	0.398	S	S	.	.	H	α-helix	trans	-69.2	-36.4	-173.3	-61.3	-8.5	0	0	0	111.7	V454 A481 E488 Q489	V454-N485 HydrophobicContact CG1-CB 3.75Å; A481-N485 VanDerWaalsContact O-CB 3.26Å; A481-N485 WeakPolarHBondContact O-CB 3.47Å; A481-N485 PolarHBondContact O-N 2.84Å; N485-E488 PolarHBondContact O-N 3.36Å; N485-Q489 WeakPolarHBondContact O-CG 3.22Å; N485-Q489 PolarHBondContact O-N 3.41Å; N485-Q489 VanDerWaalsContact O-N 3.09Å
486	A	62.4	Low	67.4	Low	2 Å²	2	75.1 Å²	75.1	2%	0.017	39%	0.385	C	S	.	.	H	α-helix	trans	-77.9	-17.9	175.5	0	0	0	0	0	112.8	L451 V454 A482 S484 L490 L498	L451-A486 HydrophobicContact CD2-CB 4.47Å; V454-A486 HydrophobicContact CG2-CB 4.43Å; A482-A486 WeakPolarHBondContact O-CA 3.37Å; A482-A486 WeakPolarHBondContact O-CB 3.24Å; A482-A486 PolarHBondContact O-N 2.89Å; S484-A486 PolarHBondContact O-N 3.35Å; A486-L490 HydrophobicContact CB-CD1 3.79Å; A486-L490 HydrophobicContact CB-CG 4.21Å; A486-L490 WeakPolarHBondContact O-CA 3.49Å; A486-L490 WeakPolarHBondContact O-CB 3.45Å; A486-L490 WeakPolarHBondContact O-CD1 3.48Å; A486-L490 WeakPolarHBondContact O-CG 3.48Å; A486-L490 PolarHBondContact O-N 2.98Å; A486-L498 HydrophobicContact CB-CD2 4.09Å
487	K	58.8	Low	67	Low	99 Å²	99	79.1 Å²	79.1	43%	0.43	40%	0.396	S	S	.	.	H	α-helix	trans	-60.9	-49.6	165.6	-90.1	168.6	-172.8	168.2	0	110.2	V483 S484 L491 L498	V483-K487 HydrophobicContact CG1-CD 4.29Å; V483-K487 VanDerWaalsContact O-CB 3.3Å; V483-K487 WeakPolarHBondContact O-CB 3.06Å; V483-K487 WeakPolarHBondContact O-CD 3.31Å; V483-K487 WeakPolarHBondContact O-CG 3.31Å; V483-K487 PolarHBondContact O-N 3.02Å; S484-K487 WeakPolarHBondContact O-CB 3.23Å; S484-K487 PolarHBondContact O-N 3.23Å; S484-K487 VanDerWaalsContact O-N 3.15Å; K487-L491 WeakPolarHBondContact O-CB 3.46Å; K487-L491 WeakPolarHBondContact O-CD1 3.48Å; K487-L491 WeakPolarHBondContact O-CG 3.44Å; K487-L491 PolarHBondContact O-N 3.31Å; K487-L498 WeakPolarHBondContact CE-O 3.18Å
488	E	61	Low	66.8	Low	152 Å²	152	72 Å²	72	71%	0.71	36%	0.363	S	S	*	.	H	α-helix	trans	-65.7	-42.2	-179.7	-63.1	-173.4	175.3	0	0	113.1	S484 N485	S484-E488 PolarHBondContact O-N 3.22Å; N485-E488 PolarHBondContact O-N 3.36Å
489	Q	56.4	Low	66.7	Low	112 Å²	112	75.7 Å²	75.7	52%	0.523	38%	0.379	S	S	.	.	H	α-helix	trans	-73.3	-42.2	179.6	-67.7	178.5	-0.1	0	0	112.4	N485 K492 E493	N485-Q489 WeakPolarHBondContact O-CG 3.22Å; N485-Q489 PolarHBondContact O-N 3.41Å; N485-Q489 VanDerWaalsContact O-N 3.09Å; Q489-K492 PolarHBondContact O-N 2.8Å; Q489-E493 PolarHBondContact O-N 3.25Å
490	L	55.7	Low	66.9	Low	15 Å²	15	78.7 Å²	78.7	8%	0.079	40%	0.395	C	S	.	.	H	α-helix	trans	-75.8	-33.1	-179.1	-61.2	166.7	0	0	0	111.9	A486 K492 E493 R494 W496 L498	A486-L490 HydrophobicContact CB-CD1 3.79Å; A486-L490 HydrophobicContact CB-CG 4.21Å; A486-L490 WeakPolarHBondContact O-CA 3.49Å; A486-L490 WeakPolarHBondContact O-CB 3.45Å; A486-L490 WeakPolarHBondContact O-CD1 3.48Å; A486-L490 WeakPolarHBondContact O-CG 3.48Å; A486-L490 PolarHBondContact O-N 2.98Å; L490-K492 PolarHBondContact O-N 3.19Å; L490-E493 PolarHBondContact O-N 2.84Å; L490-R494 CarbonylContact C-O 3.47Å; L490-R494 CarbonylContact O-C 3.57Å; L490-R494 PolarHBondContact O-N 3.47Å; L490-W496 HydrophobicContact CD1-CB 4.27Å; L490-W496 HydrophobicContact CD1-CE3 3.79Å; L490-W496 HydrophobicContact CD2-CD2 4.42Å; L490-W496 HydrophobicContact CD2-CE3 3.63Å; L490-W496 HydrophobicContact CD2-CZ3 3.95Å; L490-W496 HydrophobicContact CG-CE3 4.33Å; L490-L498 HydrophobicContact CD1-CD1 3.58Å; L490-L498 HydrophobicContact CD1-CD2 4.25Å
491	L	51.5	Low	66.9	Low	154 Å²	154	77.7 Å²	77.7	81%	0.806	38%	0.383	S	S	*	.	H	α-helix	trans	-57.6	-19.6	170.7	-78.3	168	0	0	0	113.3	K487	K487-L491 WeakPolarHBondContact O-CB 3.46Å; K487-L491 WeakPolarHBondContact O-CD1 3.48Å; K487-L491 WeakPolarHBondContact O-CG 3.44Å; K487-L491 PolarHBondContact O-N 3.31Å
492	K	54.8	Low	67	Low	192 Å²	192	80.5 Å²	80.5	84%	0.835	40%	0.397	S	S	*	.	H	α-helix	trans	-90	-21.5	170.5	-83.5	176.5	173.2	171.3	0	115.2	Q489 L490	Q489-K492 PolarHBondContact O-N 2.8Å; L490-K492 PolarHBondContact O-N 3.19Å
493	E	56	Low	67.4	Low	155 Å²	155	82.5 Å²	82.5	72%	0.724	42%	0.417	S	S	*	.	H	α-helix	trans	-117.5	-41.4	-173.7	-68.3	-168.4	179.4	0	0	115.1	Q489 L490	Q489-E493 PolarHBondContact O-N 3.25Å; L490-E493 PolarHBondContact O-N 2.84Å
494	R	58.9	Low	67.5	Low	118 Å²	118	83.9 Å²	83.9	45%	0.445	43%	0.434	S	S	.	.			trans	-152.7	143.5	-172.4	-64.9	-170.2	175.1	164.6	-0.3	113.5	L490 W496	L490-R494 CarbonylContact C-O 3.47Å; L490-R494 CarbonylContact O-C 3.57Å; L490-R494 PolarHBondContact O-N 3.47Å; R494-W496 HydrophobicContact CB-CD2 4.08Å; R494-W496 HydrophobicContact CB-CG 4.19Å; R494-W496 HydrophobicContact CB-CZ2 4.43Å; R494-W496 HydrophobicContact CG-CZ2 4.48Å; R494-W496 PolarHBondContact O-N 3.43Å
495	S	59.2	Low	67.8	Low	77 Å²	77	86.6 Å²	86.6	54%	0.538	44%	0.438	S	S	.	.			trans	-70.3	34.1	-174.9	45.7	0	0	0	0	116.7	D437	D437-S495 PolarHBondContact OD1-OG 3.25Å
496	W	74.6	Confident	68.7	Low	19 Å²	19	82.9 Å²	82.9	7%	0.072	42%	0.418	C	S	.	.			trans	-83	123.1	-173.8	-62.5	-8.4	0	0	0	112.2	I435 D437 P442 L490 R494 L498	I435-W496 HydrophobicContact CG2-CB 4.03Å; I435-W496 HydrophobicContact CG2-CG 4.33Å; D437-W496 VanDerWaalsContact CG-CD1 3.5Å; D437-W496 PolarHBondContact OD2-NE1 3.43Å; P442-W496 HydrophobicContact CG-CH2 4.01Å; P442-W496 HydrophobicContact CG-CZ2 3.66Å; L490-W496 HydrophobicContact CD1-CB 4.27Å; L490-W496 HydrophobicContact CD1-CE3 3.79Å; L490-W496 HydrophobicContact CD2-CD2 4.42Å; L490-W496 HydrophobicContact CD2-CE3 3.63Å; L490-W496 HydrophobicContact CD2-CZ3 3.95Å; L490-W496 HydrophobicContact CG-CE3 4.33Å; R494-W496 HydrophobicContact CB-CD2 4.08Å; R494-W496 HydrophobicContact CB-CG 4.19Å; R494-W496 HydrophobicContact CB-CZ2 4.43Å; R494-W496 HydrophobicContact CG-CZ2 4.48Å; R494-W496 PolarHBondContact O-N 3.43Å; W496-L498 HydrophobicContact CB-CD1 3.88Å; W496-L498 WeakPolarHBondContact O-CD1 3.45Å
497	K	71.6	Confident	69.6	Low	142 Å²	142	87.6 Å²	87.6	62%	0.617	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.1	119.9	172	-64.5	179.4	179.9	-179	0	109.5	I435 T436	I435-K497 WeakPolarHBondContact CA-O 3.43Å; T436-K497 PolarHBondContact N-O 2.9Å; T436-K497 PolarHBondContact O-N 3.27Å
498	L	77.3	Confident	70.9	Confident	7 Å²	7	91.3 Å²	91.3	4%	0.037	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	122.7	-179.7	-77.1	76	0	0	0	110.9	V433 K434 I435 V483 A486 K487 L490 W496	V433-L498 HydrophobicContact CG1-CB 4.17Å; V433-L498 HydrophobicContact CG1-CD2 4.37Å; V433-L498 HydrophobicContact CG1-CG 4.33Å; K434-L498 WeakPolarHBondContact O-CA 3.45Å; I435-L498 HydrophobicContact CD1-CG 4.44Å; I435-L498 HydrophobicContact CG1-CG 4.2Å; I435-L498 HydrophobicContact CG2-CD1 4.25Å; I435-L498 HydrophobicContact CG2-CG 4.49Å; V483-L498 HydrophobicContact CG1-CB 4.47Å; V483-L498 HydrophobicContact CG2-CB 4.22Å; A486-L498 HydrophobicContact CB-CD2 4.09Å; K487-L498 WeakPolarHBondContact CE-O 3.18Å; L490-L498 HydrophobicContact CD1-CD1 3.58Å; L490-L498 HydrophobicContact CD1-CD2 4.25Å; W496-L498 HydrophobicContact CB-CD1 3.88Å; W496-L498 WeakPolarHBondContact O-CD1 3.45Å
499	E	79.5	Confident	71.9	Confident	106 Å²	106	84.8 Å²	84.8	50%	0.495	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	129.6	-177	-66.2	173.1	176.5	0	0	109.9	V433 K434 L501	V433-E499 CarbonylContact C-O 3.54Å; V433-E499 WeakPolarHBondContact CA-O 3.42Å; K434-E499 HydrophobicContact CB-CB 4.5Å; K434-E499 PolarHBondContact N-O 3.43Å; K434-E499 PolarHBondContact O-N 2.95Å; E499-L501 PolarHBondContact O-N 2.86Å
500	I	82.3	Confident	73.2	Confident	64 Å²	64	80 Å²	80	33%	0.328	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	122.4	172.6	-55.1	175.8	0	0	0	107.9	A480 V483 T502	A480-I500 HydrophobicContact CB-CD1 4.45Å; V483-I500 HydrophobicContact CB-CD1 4.41Å; V483-I500 HydrophobicContact CB-CG1 4.18Å; V483-I500 HydrophobicContact CG1-CG1 4.32Å; V483-I500 HydrophobicContact CG2-CD1 4.38Å; V483-I500 HydrophobicContact CG2-CG1 3.7Å; I500-T502 HydrophobicContact CG2-CG2 4.15Å; I500-T502 PolarHBondContact O-N 2.8Å
501	L	80.4	Confident	74.6	Confident	21 Å²	21	84.9 Å²	84.9	11%	0.11	42%	0.42	C	S	.	.			trans	-72.9	126.8	172.4	-78	157.8	0	0	0	109	I432 K434 H470 E499 H505 E506	I432-L501 HydrophobicContact CB-CB 4.41Å; I432-L501 HydrophobicContact CB-CD1 4.44Å; I432-L501 HydrophobicContact CG2-CD1 3.79Å; I432-L501 PolarHBondContact O-N 3Å; K434-L501 HydrophobicContact CB-CD1 3.97Å; K434-L501 HydrophobicContact CB-CG 4.05Å; H470-L501 VanDerWaalsContact CD2-CD1 3.48Å; H470-L501 WeakPolarHBondContact CD2-CD1 3.46Å; E499-L501 PolarHBondContact O-N 2.86Å; L501-H505 HydrophobicContact CD2-CB 3.74Å; L501-E506 HydrophobicContact CB-CB 4.16Å
502	T	80.1	Confident	76.3	Confident	95 Å²	95	82 Å²	82	58%	0.583	40%	0.401	S	S	*	.			trans	-130.2	161	-179.9	56.1	0	0	0	0	111	I500 G504 H505	I500-T502 HydrophobicContact CG2-CG2 4.15Å; I500-T502 PolarHBondContact O-N 2.8Å; T502-G504 PolarHBondContact O-N 3.18Å; T502-H505 PolarHBondContact O-N 2.88Å
503	G	82.3	Confident	77.7	Confident	42 Å²	42	74.3 Å²	74.3	43%	0.433	37%	0.368	S	S	.	.	H	α-helix	trans	55.7	-133.2	173.5	0	0	0	0	0	114.2	H505 E506 Q507	G503-H505 VanDerWaalsContact C-N 3.29Å; G503-H505 PolarHBondContact O-N 3.33Å; G503-E506 PolarHBondContact O-N 3.03Å; G503-Q507 WeakPolarHBondContact O-CG 3.27Å; G503-Q507 PolarHBondContact O-N 2.91Å
504	G	76.4	Confident	79.1	Confident	38 Å²	38	70.9 Å²	70.9	39%	0.392	36%	0.355	S	S	.	.	H	α-helix	trans	-63.8	-27	-172.8	0	0	0	0	0	115.2	T502 R508	T502-G504 PolarHBondContact O-N 3.18Å; G504-R508 VanDerWaalsContact O-CG 3.28Å; G504-R508 WeakPolarHBondContact O-CG 3.5Å; G504-R508 PolarHBondContact O-N 2.91Å; G504-R508 VanDerWaalsContact O-N 3.1Å
505	H	79	Confident	80.4	Confident	128 Å²	128	69.8 Å²	69.8	59%	0.593	36%	0.361	S	S	*	.	H	α-helix	trans	-73.8	-42.3	177.8	-68.9	-99.4	0	0	0	111.2	L501 T502 G503 R508 Y509	L501-H505 HydrophobicContact CD2-CB 3.74Å; T502-H505 PolarHBondContact O-N 2.88Å; G503-H505 VanDerWaalsContact C-N 3.29Å; G503-H505 PolarHBondContact O-N 3.33Å; H505-R508 PolarHBondContact O-N 3.15Å; H505-Y509 PolarHBondContact O-N 2.96Å; H505-Y509 VanDerWaalsContact O-N 3.14Å
506	E	83.9	Confident	81.6	Confident	3 Å²	3	68.5 Å²	68.5	1%	0.014	35%	0.348	C	S	.	.	H	α-helix	trans	-61.2	-46.6	172.3	176.6	167.9	-136.8	0	0	111.3	F427 S429 G430 V431 I432 L501 G503 R508 Y509 W510	F427-E506 HydrophobicContact CE2-CG 4.19Å; S429-E506 VanDerWaalsContact CA-OE2 3.25Å; S429-E506 WeakPolarHBondContact CA-OE2 3.4Å; G430-E506 VanDerWaalsContact N-CD 3.26Å; G430-E506 PolarHBondContact N-OE1 2.83Å; G430-E506 PolarHBondContact N-OE2 3.4Å; V431-E506 PolarHBondContact N-OE1 3.44Å; I432-E506 HydrophobicContact CD1-CG 4.43Å; L501-E506 HydrophobicContact CB-CB 4.16Å; G503-E506 PolarHBondContact O-N 3.03Å; E506-R508 PolarHBondContact O-N 3.09Å; E506-Y509 PolarHBondContact O-N 3.34Å; E506-W510 VanDerWaalsContact O-CD1 3.3Å; E506-W510 PolarHBondContact O-N 2.93Å
507	Q	83	Confident	81.9	Confident	101 Å²	101	72 Å²	72	47%	0.472	36%	0.361	S	S	.	.	H	α-helix	trans	-58.6	-44.4	177.4	-70.1	175.8	11.2	0	0	112.9	F427 G503 Y509 W510 Q511	F427-Q507 HydrophobicContact CE2-CG 3.76Å; F427-Q507 HydrophobicContact CZ-CG 4.04Å; G503-Q507 WeakPolarHBondContact O-CG 3.27Å; G503-Q507 PolarHBondContact O-N 2.91Å; Q507-Y509 VanDerWaalsContact C-N 3.33Å; Q507-Y509 PolarHBondContact O-N 2.88Å; Q507-W510 PolarHBondContact O-N 3.47Å; Q507-Q511 WeakPolarHBondContact O-CG 3.45Å; Q507-Q511 PolarHBondContact O-N 3.49Å
508	R	84.1	Confident	82.5	Confident	177 Å²	177	69.4 Å²	69.4	67%	0.668	35%	0.351	S	S	*	.	H	α-helix	trans	-62	-39	176.2	-75.5	172	179.9	-179	1.3	112.3	G504 H505 E506 Q511 K512	G504-R508 VanDerWaalsContact O-CG 3.28Å; G504-R508 WeakPolarHBondContact O-CG 3.5Å; G504-R508 PolarHBondContact O-N 2.91Å; G504-R508 VanDerWaalsContact O-N 3.1Å; H505-R508 PolarHBondContact O-N 3.15Å; E506-R508 PolarHBondContact O-N 3.09Å; R508-Q511 WeakPolarHBondContact O-CB 3.47Å; R508-Q511 PolarHBondContact O-N 3.39Å; R508-K512 PolarHBondContact O-N 3.22Å
509	Y	83.4	Confident	82.9	Confident	14 Å²	14	72 Å²	72	6%	0.055	37%	0.367	C	S	.	.	H	α-helix	trans	-73.3	-34.9	177.4	179.9	-100.2	0	0	0	112.5	I432 D461 H470 H505 E506 Q507 K512 I513	I432-Y509 HydrophobicContact CD1-CD1 3.54Å; I432-Y509 HydrophobicContact CD1-CE1 3.81Å; I432-Y509 HydrophobicContact CG2-CD1 3.75Å; I432-Y509 HydrophobicContact CG2-CE1 3.65Å; D461-Y509 WeakPolarHBondContact CB-OH 3.29Å; H470-Y509 HydrophobicContact CB-CD2 4.33Å; H470-Y509 HydrophobicContact CB-CE1 4.02Å; H470-Y509 HydrophobicContact CB-CE2 3.54Å; H470-Y509 VanDerWaalsContact CB-OH 3.29Å; H470-Y509 WeakPolarHBondContact CB-OH 3.49Å; H470-Y509 AromaticContact CD2-CD2 3.48Å; H470-Y509 VanDerWaalsContact CD2-CD2 3.48Å; H470-Y509 WeakPolarHBondContact CD2-CD2 3.48Å; H470-Y509 AromaticContact CD2-CE2 3.59Å; H470-Y509 AromaticContact CD2-CG 3.89Å; H470-Y509 AromaticContact CG-CE2 3.64Å; H470-Y509 AromaticContact CG-CZ 3.97Å; H505-Y509 PolarHBondContact O-N 2.96Å; H505-Y509 VanDerWaalsContact O-N 3.14Å; E506-Y509 PolarHBondContact O-N 3.34Å; Q507-Y509 VanDerWaalsContact C-N 3.33Å; Q507-Y509 PolarHBondContact O-N 2.88Å; Y509-K512 HydrophobicContact CD2-CD 3.97Å; Y509-K512 HydrophobicContact CE2-CD 4.04Å; Y509-K512 WeakPolarHBondContact O-CB 3.5Å; Y509-K512 PolarHBondContact O-N 3.45Å; Y509-I513 HydrophobicContact CD1-CD1 3.91Å; Y509-I513 HydrophobicContact CE1-CD1 3.48Å; Y509-I513 VanDerWaalsContact CE1-CD1 3.48Å; Y509-I513 HydrophobicContact CE1-CG1 4.18Å; Y509-I513 WeakPolarHBondContact O-CG1 3.3Å; Y509-I513 PolarHBondContact O-N 3.32Å
510	W	83.5	Confident	83	Confident	12 Å²	12	71 Å²	71	5%	0.045	36%	0.361	C	S	.	.	H	α-helix	trans	-61.3	-41.8	167.5	-85.5	109.5	0	0	0	112.4	P425 Q426 F427 V428 I432 E506 Q507 I513 L514	P425-W510 HydrophobicContact CB-CH2 4.43Å; P425-W510 HydrophobicContact CB-CZ3 3.9Å; P425-W510 HydrophobicContact CG-CZ3 4.23Å; P425-W510 WeakPolarHBondContact O-CZ3 3.2Å; Q426-W510 WeakPolarHBondContact O-CH2 3.25Å; Q426-W510 VanDerWaalsContact O-CZ3 3.32Å; Q426-W510 WeakPolarHBondContact O-CZ3 3.35Å; F427-W510 HydrophobicContact CD2-CB 3.98Å; F427-W510 AromaticContact CD2-CD1 3.3Å; F427-W510 HydrophobicContact CD2-CD2 4.15Å; F427-W510 AromaticContact CD2-CG 3.56Å; F427-W510 HydrophobicContact CD2-CG 3.56Å; F427-W510 AromaticContact CD2-NE1 3.69Å; F427-W510 AromaticContact CE2-CD1 3.4Å; F427-W510 HydrophobicContact CE2-CG 4.08Å; F427-W510 AromaticContact CE2-NE1 3.86Å; V428-W510 PolarHBondContact O-NE1 2.82Å; I432-W510 HydrophobicContact CD1-CD2 4.17Å; I432-W510 HydrophobicContact CD1-CG 4.23Å; I432-W510 HydrophobicContact CD1-CZ2 4.17Å; E506-W510 VanDerWaalsContact O-CD1 3.3Å; E506-W510 PolarHBondContact O-N 2.93Å; Q507-W510 PolarHBondContact O-N 3.47Å; W510-I513 HydrophobicContact CE3-CD1 4.43Å; W510-I513 PolarHBondContact O-N 3.01Å; W510-L514 WeakPolarHBondContact O-CG 3.43Å; W510-L514 PolarHBondContact O-N 2.98Å; W510-L514 VanDerWaalsContact O-N 3.08Å
511	Q	85.5	Confident	82.9	Confident	118 Å²	118	72.3 Å²	72.3	55%	0.551	37%	0.368	S	S	*	.	H	α-helix	trans	-60.5	-44.6	172.5	-71.6	168.9	-6.3	0	0	111.6	Q507 R508 I513 L514 V515	Q507-Q511 WeakPolarHBondContact O-CG 3.45Å; Q507-Q511 PolarHBondContact O-N 3.49Å; R508-Q511 WeakPolarHBondContact O-CB 3.47Å; R508-Q511 PolarHBondContact O-N 3.39Å; Q511-I513 PolarHBondContact O-N 3.39Å; Q511-L514 PolarHBondContact O-N 3.41Å; Q511-V515 WeakPolarHBondContact O-CG2 3.31Å; Q511-V515 PolarHBondContact O-N 3.39Å
512	K	86.8	Confident	82.9	Confident	93 Å²	93	76.7 Å²	76.7	40%	0.404	39%	0.392	S	S	.	.	H	α-helix	trans	-52.5	-51.5	172	-177.6	-156.2	176.1	-168.6	0	110.8	D461 R508 Y509 L514 V515 D516	D461-K512 IonicContact OD2-NZ 3.7Å; D461-K512 PolarHBondContact OD2-NZ 3.39Å; R508-K512 PolarHBondContact O-N 3.22Å; Y509-K512 HydrophobicContact CD2-CD 3.97Å; Y509-K512 HydrophobicContact CE2-CD 4.04Å; Y509-K512 WeakPolarHBondContact O-CB 3.5Å; Y509-K512 PolarHBondContact O-N 3.45Å; K512-L514 VanDerWaalsContact C-N 3.31Å; K512-L514 PolarHBondContact O-N 2.9Å; K512-V515 PolarHBondContact O-N 2.86Å; K512-D516 WeakPolarHBondContact O-CB 3.38Å; K512-D516 PolarHBondContact O-N 3.35Å
513	I	84.9	Confident	82.9	Confident	30 Å²	30	79.8 Å²	79.8	15%	0.154	39%	0.393	C	S	.	.	H	α-helix	trans	-56.4	-43.5	179.4	-70.9	166.1	0	0	0	111.9	P425 Y509 W510 Q511 R517	P425-I513 HydrophobicContact CG-CG2 4.11Å; Y509-I513 HydrophobicContact CD1-CD1 3.91Å; Y509-I513 HydrophobicContact CE1-CD1 3.48Å; Y509-I513 VanDerWaalsContact CE1-CD1 3.48Å; Y509-I513 HydrophobicContact CE1-CG1 4.18Å; Y509-I513 WeakPolarHBondContact O-CG1 3.3Å; Y509-I513 PolarHBondContact O-N 3.32Å; W510-I513 HydrophobicContact CE3-CD1 4.43Å; W510-I513 PolarHBondContact O-N 3.01Å; Q511-I513 PolarHBondContact O-N 3.39Å; I513-R517 VanDerWaalsContact O-CB 3.3Å; I513-R517 WeakPolarHBondContact O-CB 3.2Å; I513-R517 PolarHBondContact O-N 2.92Å
514	L	85.3	Confident	82.4	Confident	84 Å²	84	84.1 Å²	84.1	44%	0.44	41%	0.413	S	S	.	.	H	α-helix	trans	-68.9	-43.4	-179.3	-67.8	173.7	0	0	0	112.1	W510 Q511 K512 R517 Q518	W510-L514 WeakPolarHBondContact O-CG 3.43Å; W510-L514 PolarHBondContact O-N 2.98Å; W510-L514 VanDerWaalsContact O-N 3.08Å; Q511-L514 PolarHBondContact O-N 3.41Å; K512-L514 VanDerWaalsContact C-N 3.31Å; K512-L514 PolarHBondContact O-N 2.9Å; L514-R517 PolarHBondContact O-N 3.35Å; L514-Q518 PolarHBondContact O-N 3.34Å
515	V	85.9	Confident	81.9	Confident	94 Å²	94	90.8 Å²	90.8	57%	0.57	43%	0.427	S	S	*	.	H	α-helix	trans	-61.4	-47.4	174.1	172.2	0	0	0	0	110.5	Q511 K512 R517 Q518 V519	Q511-V515 WeakPolarHBondContact O-CG2 3.31Å; Q511-V515 PolarHBondContact O-N 3.39Å; K512-V515 PolarHBondContact O-N 2.86Å; V515-R517 VanDerWaalsContact C-N 3.34Å; V515-R517 PolarHBondContact O-N 3.37Å; V515-Q518 PolarHBondContact O-N 2.98Å; V515-Q518 VanDerWaalsContact O-N 3.08Å; V515-V519 HydrophobicContact CG1-CG2 4.43Å; V515-V519 WeakPolarHBondContact O-CG2 3.4Å; V515-V519 PolarHBondContact O-N 2.95Å
516	D	84.2	Confident	81.3	Confident	50 Å²	50	92.1 Å²	92.1	27%	0.267	43%	0.433	S	S	.	.	H	α-helix	trans	-61.6	-40.3	177.9	-111.6	9.5	0	0	0	112.4	K512 Q518 V519 K520	K512-D516 WeakPolarHBondContact O-CB 3.38Å; K512-D516 PolarHBondContact O-N 3.35Å; D516-Q518 VanDerWaalsContact C-N 3.34Å; D516-V519 PolarHBondContact O-N 2.98Å; D516-K520 VanDerWaalsContact CG-NZ 3.33Å; D516-K520 VanDerWaalsContact O-CB 3.25Å; D516-K520 WeakPolarHBondContact O-CB 3.4Å; D516-K520 VanDerWaalsContact O-CD 3.27Å; D516-K520 WeakPolarHBondContact O-CD 3.47Å; D516-K520 WeakPolarHBondContact O-CG 3.48Å; D516-K520 PolarHBondContact O-N 2.85Å; D516-K520 IonicContact OD2-NZ 2.68Å; D516-K520 PolarHBondContact OD2-NZ 2.95Å
517	R	81.5	Confident	80.4	Confident	92 Å²	92	101.8 Å²	101.8	35%	0.347	48%	0.475	S	S	.	.	H	α-helix	trans	-60.4	-44.6	172.9	-178.5	-179.2	-178.8	-88	10.8	110.4	K422 I513 L514 V515 K520 L521	K422-R517 PolarHBondContact O-NH2 3.42Å; K422-R517 VanDerWaalsContact O-NH2 3.16Å; I513-R517 VanDerWaalsContact O-CB 3.3Å; I513-R517 WeakPolarHBondContact O-CB 3.2Å; I513-R517 PolarHBondContact O-N 2.92Å; L514-R517 PolarHBondContact O-N 3.35Å; V515-R517 VanDerWaalsContact C-N 3.34Å; V515-R517 PolarHBondContact O-N 3.37Å; R517-K520 PolarHBondContact O-N 3.16Å; R517-L521 HydrophobicContact CG-CD1 4.16Å; R517-L521 WeakPolarHBondContact O-CB 3.17Å; R517-L521 VanDerWaalsContact O-CG 3.29Å; R517-L521 WeakPolarHBondContact O-CG 3.48Å; R517-L521 PolarHBondContact O-N 3.11Å
518	Q	82.6	Confident	79.5	Confident	88 Å²	88	101.5 Å²	101.5	41%	0.411	47%	0.472	S	S	.	.	H	α-helix	trans	-67.7	-40.6	179.4	-163.3	59.7	42.6	0	0	112.2	L514 V515 D516 L521 N522	L514-Q518 PolarHBondContact O-N 3.34Å; V515-Q518 PolarHBondContact O-N 2.98Å; V515-Q518 VanDerWaalsContact O-N 3.08Å; D516-Q518 VanDerWaalsContact C-N 3.34Å; Q518-L521 PolarHBondContact O-N 3.15Å; Q518-N522 PolarHBondContact NE2-OD1 3.09Å; Q518-N522 WeakPolarHBondContact O-CB 3.41Å; Q518-N522 VanDerWaalsContact O-CG 3.23Å; Q518-N522 PolarHBondContact O-N 3.41Å; Q518-N522 PolarHBondContact O-OD1 2.92Å
519	V	85.4	Confident	78.9	Confident	61 Å²	61	102.2 Å²	102.2	37%	0.37	48%	0.475	S	S	.	.	H	α-helix	trans	-61.4	-45.4	172.1	171.1	0	0	0	0	110.8	V515 D516 L521 N522 R523	V515-V519 HydrophobicContact CG1-CG2 4.43Å; V515-V519 WeakPolarHBondContact O-CG2 3.4Å; V515-V519 PolarHBondContact O-N 2.95Å; D516-V519 PolarHBondContact O-N 2.98Å; V519-L521 PolarHBondContact O-N 3.09Å; V519-N522 PolarHBondContact O-N 3.42Å; V519-R523 VanDerWaalsContact O-CG 3.32Å; V519-R523 WeakPolarHBondContact O-CG 3.37Å; V519-R523 PolarHBondContact O-N 3.47Å
520	K	81.9	Confident	78.4	Confident	87 Å²	87	104.1 Å²	104.1	38%	0.378	50%	0.499	S	S	.	.	H	α-helix	trans	-67.7	-18.7	178.1	-68.7	160.7	-165.4	165	0	113.1	D516 R517 R525	D516-K520 VanDerWaalsContact CG-NZ 3.33Å; D516-K520 VanDerWaalsContact O-CB 3.25Å; D516-K520 WeakPolarHBondContact O-CB 3.4Å; D516-K520 VanDerWaalsContact O-CD 3.27Å; D516-K520 WeakPolarHBondContact O-CD 3.47Å; D516-K520 WeakPolarHBondContact O-CG 3.48Å; D516-K520 PolarHBondContact O-N 2.85Å; D516-K520 IonicContact OD2-NZ 2.68Å; D516-K520 PolarHBondContact OD2-NZ 2.95Å; R517-K520 PolarHBondContact O-N 3.16Å; K520-R525 PolarHBondContact O-NH2 3.22Å
521	L	80.3	Confident	77.8	Confident	90 Å²	90	106.5 Å²	106.5	47%	0.471	51%	0.514	S	S	.	.	H	α-helix	trans	-85.4	-44.7	169.5	-74.4	167.3	0	0	0	112.5	R517 Q518 V519	R517-L521 HydrophobicContact CG-CD1 4.16Å; R517-L521 WeakPolarHBondContact O-CB 3.17Å; R517-L521 VanDerWaalsContact O-CG 3.29Å; R517-L521 WeakPolarHBondContact O-CG 3.48Å; R517-L521 PolarHBondContact O-N 3.11Å; Q518-L521 PolarHBondContact O-N 3.15Å; V519-L521 PolarHBondContact O-N 3.09Å
522	N	80.3	Confident	77.3	Confident	113 Å²	113	104 Å²	104	60%	0.604	50%	0.503	S	S	*	.	H	α-helix	trans	-74.1	-22.6	-177.1	-70.5	2.8	0	0	0	113.5	Q518 V519	Q518-N522 PolarHBondContact NE2-OD1 3.09Å; Q518-N522 WeakPolarHBondContact O-CB 3.41Å; Q518-N522 VanDerWaalsContact O-CG 3.23Å; Q518-N522 PolarHBondContact O-N 3.41Å; Q518-N522 PolarHBondContact O-OD1 2.92Å; V519-N522 PolarHBondContact O-N 3.42Å
523	R	80.7	Confident	76.9	Confident	160 Å²	160	106 Å²	106	60%	0.604	51%	0.512	S	S	*	.	S	Bend	trans	-52	123.5	176.7	-86.7	175.6	-169.4	-157.1	3.8	110.9	V519 R525	V519-R523 VanDerWaalsContact O-CG 3.32Å; V519-R523 WeakPolarHBondContact O-CG 3.37Å; V519-R523 PolarHBondContact O-N 3.47Å; R523-R525 PolarHBondContact O-N 3.38Å
524	P	71.1	Confident	76.4	Confident	133 Å²	133	107 Å²	107	86%	0.864	52%	0.517	S	S	*	.			trans	-66	107.7	-176.9	25.9	-33.9	0	0	0	110.6
525	R	66.8	Low	76.1	Confident	179 Å²	179	105.6 Å²	105.6	68%	0.675	51%	0.509	S	S	*	.			trans	-85.1	125.6	178.9	-59.5	-177	-172.2	-177.8	0.9	110.3	K520 R523 K527	K520-R525 PolarHBondContact O-NH2 3.22Å; R523-R525 PolarHBondContact O-N 3.38Å; R525-K527 PolarHBondContact O-N 3.47Å
526	E	66.9	Low	75.7	Confident	156 Å²	156	103.3 Å²	103.3	73%	0.729	50%	0.497	S	S	*	.			trans	-54.5	121.5	167.5	-66.4	-167.3	143.5	0	0	110.2	K528	E526-K528 PolarHBondContact O-N 3.06Å; E526-K528 IonicContact OE2-NZ 2.68Å
527	K	63.3	Low	75.6	Confident	205 Å²	205	105.2 Å²	105.2	89%	0.891	50%	0.503	S	S	*	.			trans	-79.8	66.3	-179	-68.1	-177	179.6	176.6	0	110.9	R525 R529	R525-K527 PolarHBondContact O-N 3.47Å; K527-R529 PolarHBondContact O-N 2.95Å
528	K	65.6	Low	75.3	Confident	96 Å²	96	101.3 Å²	101.3	42%	0.417	49%	0.491	S	S	.	.			trans	-50.5	130.9	176.4	-65.8	-167.4	169.7	-78.1	0	111.2	E526 E532 K533	E526-K528 PolarHBondContact O-N 3.06Å; E526-K528 IonicContact OE2-NZ 2.68Å; K528-E532 WeakPolarHBondContact CA-OE2 3.44Å; K528-E532 WeakPolarHBondContact CB-OE2 3.25Å; K528-E532 VanDerWaalsContact CD-OE1 3.25Å; K528-E532 WeakPolarHBondContact CD-OE1 3.43Å; K528-E532 WeakPolarHBondContact CG-OE1 3.43Å; K528-E532 IonicContact NZ-OE1 3.14Å; K528-E532 PolarHBondContact NZ-OE1 2.99Å; K528-K533 HydrophobicContact CB-CG 4.34Å; K528-K533 WeakPolarHBondContact O-CE 3.22Å
529	R	71.5	Confident	75.2	Confident	192 Å²	192	100.4 Å²	100.4	73%	0.725	49%	0.486	S	S	*	.			trans	-68.7	156.8	-174.5	-74.6	-173.8	171.1	-157.7	-3	111.4	K527 T531 E532 K533	K527-R529 PolarHBondContact O-N 2.95Å; R529-T531 VanDerWaalsContact C-N 3.26Å; R529-T531 PolarHBondContact O-N 2.95Å; R529-E532 HydrophobicContact CB-CB 4.24Å; R529-E532 PolarHBondContact N-OE2 3.15Å; R529-E532 WeakPolarHBondContact O-CB 3.33Å; R529-E532 PolarHBondContact O-N 3.21Å; R529-E532 VanDerWaalsContact O-N 3.13Å; R529-K533 WeakPolarHBondContact O-CG 3.31Å; R529-K533 PolarHBondContact O-N 3.08Å
530	G	73.3	Confident	75	Confident	54 Å²	54	105 Å²	105	56%	0.557	50%	0.501	S	S	*	.	H	α-helix	trans	-58.1	-37.5	178.4	0	0	0	0	0	113.5	L534	G530-L534 PolarHBondContact O-N 2.85Å
531	T	70.8	Confident	74.9	Confident	61 Å²	61	102.4 Å²	102.4	37%	0.374	49%	0.492	S	S	.	.	H	α-helix	trans	-65.4	-45	173.3	46.6	0	0	0	0	112.5	M388 R529 K533 L534 I535	M388-T531 HydrophobicContact CG-CG2 4.42Å; M388-T531 HydrophobicContact SD-CG2 3.94Å; R529-T531 VanDerWaalsContact C-N 3.26Å; R529-T531 PolarHBondContact O-N 2.95Å; T531-K533 VanDerWaalsContact C-N 3.33Å; T531-K533 PolarHBondContact O-N 3Å; T531-L534 WeakPolarHBondContact O-CB 3.35Å; T531-L534 PolarHBondContact O-N 3.05Å; T531-L534 VanDerWaalsContact O-N 3.12Å; T531-I535 WeakPolarHBondContact O-CG1 3.31Å; T531-I535 PolarHBondContact O-N 3.21Å
532	E	73.4	Confident	74.8	Confident	65 Å²	65	103.5 Å²	103.5	30%	0.304	50%	0.497	S	S	.	.	H	α-helix	trans	-59.6	-41.6	176.6	-169.8	-166.9	158.8	0	0	111.7	K528 R529 L534 I535 S536	K528-E532 WeakPolarHBondContact CA-OE2 3.44Å; K528-E532 WeakPolarHBondContact CB-OE2 3.25Å; K528-E532 VanDerWaalsContact CD-OE1 3.25Å; K528-E532 WeakPolarHBondContact CD-OE1 3.43Å; K528-E532 WeakPolarHBondContact CG-OE1 3.43Å; K528-E532 IonicContact NZ-OE1 3.14Å; K528-E532 PolarHBondContact NZ-OE1 2.99Å; R529-E532 HydrophobicContact CB-CB 4.24Å; R529-E532 PolarHBondContact N-OE2 3.15Å; R529-E532 WeakPolarHBondContact O-CB 3.33Å; R529-E532 PolarHBondContact O-N 3.21Å; R529-E532 VanDerWaalsContact O-N 3.13Å; E532-L534 VanDerWaalsContact C-N 3.32Å; E532-L534 PolarHBondContact O-N 2.96Å; E532-I535 PolarHBondContact O-N 3.39Å; E532-S536 PolarHBondContact O-N 3.18Å
533	K	78.4	Confident	74.8	Confident	136 Å²	136	102.9 Å²	102.9	59%	0.591	49%	0.492	S	S	*	.	H	α-helix	trans	-63.3	-35	174.5	-67.7	178.4	-176.2	-179.4	0	113.1	K528 R529 T531 K537	K528-K533 HydrophobicContact CB-CG 4.34Å; K528-K533 WeakPolarHBondContact O-CE 3.22Å; R529-K533 WeakPolarHBondContact O-CG 3.31Å; R529-K533 PolarHBondContact O-N 3.08Å; T531-K533 VanDerWaalsContact C-N 3.33Å; T531-K533 PolarHBondContact O-N 3Å; K533-K537 WeakPolarHBondContact O-CB 3.27Å; K533-K537 PolarHBondContact O-N 3.27Å
534	L	74.9	Confident	74.8	Confident	51 Å²	51	98 Å²	98	27%	0.267	49%	0.486	S	S	.	.	H	α-helix	trans	-70.9	-43.3	174.8	-74.6	168.4	0	0	0	111.5	K392 I395 G530 T531 E532 K537 A538	K392-L534 HydrophobicContact CG-CD1 4.4Å; I395-L534 HydrophobicContact CD1-CD2 4.33Å; G530-L534 PolarHBondContact O-N 2.85Å; T531-L534 WeakPolarHBondContact O-CB 3.35Å; T531-L534 PolarHBondContact O-N 3.05Å; T531-L534 VanDerWaalsContact O-N 3.12Å; E532-L534 VanDerWaalsContact C-N 3.32Å; E532-L534 PolarHBondContact O-N 2.96Å; L534-K537 PolarHBondContact O-N 2.88Å; L534-A538 PolarHBondContact O-N 3.07Å
535	I	78.4	Confident	75.1	Confident	55 Å²	55	100 Å²	100	28%	0.282	48%	0.476	S	S	.	.	H	α-helix	trans	-58.9	-52.3	175.3	-67.7	163.9	0	0	0	109.7	M388 L391 T531 E532 K537 A538 E539	M388-I535 HydrophobicContact CE-CD1 4.3Å; M388-I535 HydrophobicContact CE-CG1 4.16Å; L391-I535 HydrophobicContact CD2-CG1 4.14Å; T531-I535 WeakPolarHBondContact O-CG1 3.31Å; T531-I535 PolarHBondContact O-N 3.21Å; E532-I535 PolarHBondContact O-N 3.39Å; I535-K537 VanDerWaalsContact C-N 3.25Å; I535-K537 PolarHBondContact O-N 3.1Å; I535-A538 WeakPolarHBondContact O-CA 3.48Å; I535-A538 WeakPolarHBondContact O-CB 3.46Å; I535-A538 PolarHBondContact O-N 3.12Å; I535-E539 HydrophobicContact CG2-CG 4.23Å; I535-E539 WeakPolarHBondContact O-CG 3.47Å; I535-E539 PolarHBondContact O-N 3.35Å
536	S	78.6	Confident	75.5	Confident	45 Å²	45	93.8 Å²	93.8	32%	0.315	46%	0.463	S	S	.	.	H	α-helix	trans	-71.7	-10.7	177.6	-61.4	0	0	0	0	115.4	E532 E539 K540	E532-S536 PolarHBondContact O-N 3.18Å; S536-E539 WeakPolarHBondContact CA-OE2 3.34Å; S536-E539 PolarHBondContact OG-OE2 3.4Å; S536-K540 WeakPolarHBondContact O-CD 3.48Å; S536-K540 VanDerWaalsContact O-CG 3.25Å; S536-K540 WeakPolarHBondContact O-CG 3.31Å
537	K	81.1	Confident	76	Confident	91 Å²	91	93.4 Å²	93.4	40%	0.396	46%	0.459	S	S	.	.	H	α-helix	trans	-76.6	-46.3	162.9	-174.7	176.7	175.3	-174.7	0	110.3	I395 K533 L534 I535 K540 I541	I395-K537 HydrophobicContact CG2-CD 4.26Å; K533-K537 WeakPolarHBondContact O-CB 3.27Å; K533-K537 PolarHBondContact O-N 3.27Å; L534-K537 PolarHBondContact O-N 2.88Å; I535-K537 VanDerWaalsContact C-N 3.25Å; I535-K537 PolarHBondContact O-N 3.1Å; K537-K540 PolarHBondContact O-N 3.16Å; K537-I541 HydrophobicContact CG-CD1 3.99Å; K537-I541 WeakPolarHBondContact O-CG1 3.39Å; K537-I541 PolarHBondContact O-N 3.23Å; K537-I541 VanDerWaalsContact O-N 3.09Å
538	A	76.1	Confident	76.5	Confident	10 Å²	10	88.8 Å²	88.8	8%	0.083	44%	0.441	C	S	.	.	H	α-helix	trans	-63	-44.8	177.5	0	0	0	0	0	112.6	L391 I395 L534 I535 K540 I541 I542	L391-A538 HydrophobicContact CD1-CB 3.67Å; L391-A538 HydrophobicContact CG-CB 4.32Å; I395-A538 HydrophobicContact CD1-CB 4.24Å; I395-A538 HydrophobicContact CG1-CB 4.37Å; L534-A538 PolarHBondContact O-N 3.07Å; I535-A538 WeakPolarHBondContact O-CA 3.48Å; I535-A538 WeakPolarHBondContact O-CB 3.46Å; I535-A538 PolarHBondContact O-N 3.12Å; A538-K540 VanDerWaalsContact C-N 3.3Å; A538-K540 PolarHBondContact O-N 3.45Å; A538-I541 PolarHBondContact O-N 3.11Å; A538-I541 VanDerWaalsContact O-N 3.15Å; A538-I542 VanDerWaalsContact O-CG1 3.31Å; A538-I542 WeakPolarHBondContact O-CG1 3.47Å; A538-I542 PolarHBondContact O-N 2.9Å
539	E	80.4	Confident	76.8	Confident	68 Å²	68	87 Å²	87	32%	0.318	44%	0.444	S	S	.	.	H	α-helix	trans	-54.6	-45.4	175.1	-69.5	167.8	154.5	0	0	111.2	I535 S536 I542 I543	I535-E539 HydrophobicContact CG2-CG 4.23Å; I535-E539 WeakPolarHBondContact O-CG 3.47Å; I535-E539 PolarHBondContact O-N 3.35Å; S536-E539 WeakPolarHBondContact CA-OE2 3.34Å; S536-E539 PolarHBondContact OG-OE2 3.4Å; E539-I542 PolarHBondContact O-N 3.34Å; E539-I543 WeakPolarHBondContact O-CB 3.34Å; E539-I543 WeakPolarHBondContact O-CD1 3.45Å; E539-I543 WeakPolarHBondContact O-CG1 3.32Å; E539-I543 PolarHBondContact O-N 2.82Å
540	K	81.9	Confident	76.8	Confident	157 Å²	157	83.6 Å²	83.6	68%	0.683	44%	0.44	S	S	*	.	H	α-helix	trans	-64.4	-40.8	177.1	-75.7	178.1	-179.2	-169	0	113.1	S536 K537 A538 I543 A544	S536-K540 WeakPolarHBondContact O-CD 3.48Å; S536-K540 VanDerWaalsContact O-CG 3.25Å; S536-K540 WeakPolarHBondContact O-CG 3.31Å; K537-K540 PolarHBondContact O-N 3.16Å; A538-K540 VanDerWaalsContact C-N 3.3Å; A538-K540 PolarHBondContact O-N 3.45Å; K540-I543 PolarHBondContact O-N 2.84Å; K540-A544 WeakPolarHBondContact O-CB 3.4Å; K540-A544 PolarHBondContact O-N 3.41Å
541	I	80.1	Confident	76.5	Confident	34 Å²	34	88.8 Å²	88.8	17%	0.174	45%	0.447	C	S	.	.	H	α-helix	trans	-64.3	-44.6	176.8	-69	165.1	0	0	0	110.5	I395 I398 K537 A538 A544 R545	I395-I541 HydrophobicContact CG1-CD1 4.49Å; I395-I541 HydrophobicContact CG2-CD1 4.3Å; I398-I541 HydrophobicContact CD1-CG2 3.7Å; I398-I541 HydrophobicContact CG2-CG2 3.89Å; K537-I541 HydrophobicContact CG-CD1 3.99Å; K537-I541 WeakPolarHBondContact O-CG1 3.39Å; K537-I541 PolarHBondContact O-N 3.23Å; K537-I541 VanDerWaalsContact O-N 3.09Å; A538-I541 PolarHBondContact O-N 3.11Å; A538-I541 VanDerWaalsContact O-N 3.15Å; I541-A544 PolarHBondContact O-N 3.35Å; I541-R545 WeakPolarHBondContact O-CB 3.24Å; I541-R545 PolarHBondContact O-N 3.19Å
542	I	77.3	Confident	75.8	Confident	113 Å²	113	93 Å²	93	58%	0.579	46%	0.463	S	S	*	.	H	α-helix	trans	-61.7	-45.3	176.8	-66.9	163.6	0	0	0	110.6	A538 E539 R545 A546	A538-I542 VanDerWaalsContact O-CG1 3.31Å; A538-I542 WeakPolarHBondContact O-CG1 3.47Å; A538-I542 PolarHBondContact O-N 2.9Å; E539-I542 PolarHBondContact O-N 3.34Å; I542-R545 PolarHBondContact O-N 3.12Å; I542-A546 VanDerWaalsContact O-CB 3.31Å; I542-A546 WeakPolarHBondContact O-CB 3.32Å; I542-A546 PolarHBondContact O-N 3.48Å
543	I	80	Confident	75	Confident	99 Å²	99	95.6 Å²	95.6	51%	0.508	48%	0.477	S	S	.	.	H	α-helix	trans	-65.5	-39.1	178	-69.1	164.1	0	0	0	111.6	E539 K540 K547	E539-I543 WeakPolarHBondContact O-CB 3.34Å; E539-I543 WeakPolarHBondContact O-CD1 3.45Å; E539-I543 WeakPolarHBondContact O-CG1 3.32Å; E539-I543 PolarHBondContact O-N 2.82Å; K540-I543 PolarHBondContact O-N 2.84Å; I543-K547 HydrophobicContact CG2-CD 4.46Å; I543-K547 WeakPolarHBondContact O-CG 3.44Å; I543-K547 PolarHBondContact O-N 2.93Å
544	A	80.1	Confident	73.5	Confident	57 Å²	57	99.4 Å²	99.4	47%	0.471	49%	0.488	S	S	.	.	H	α-helix	trans	-62.5	-51	176.1	0	0	0	0	0	111	K540 I541 A546 K547 E548	K540-A544 WeakPolarHBondContact O-CB 3.4Å; K540-A544 PolarHBondContact O-N 3.41Å; I541-A544 PolarHBondContact O-N 3.35Å; A544-A546 VanDerWaalsContact C-N 3.34Å; A544-A546 PolarHBondContact O-N 3.08Å; A544-K547 WeakPolarHBondContact O-CB 3.5Å; A544-K547 PolarHBondContact O-N 2.91Å; A544-K547 VanDerWaalsContact O-N 3.15Å; A544-E548 PolarHBondContact O-N 3.47Å
545	R	77.6	Confident	72.4	Confident	176 Å²	176	105.1 Å²	105.1	66%	0.664	51%	0.511	S	S	*	.	H	α-helix	trans	-64.8	-35	179.6	-166.3	174.4	-176.8	-163.8	-1.8	113.1	I541 I542 E548 A549	I541-R545 WeakPolarHBondContact O-CB 3.24Å; I541-R545 PolarHBondContact O-N 3.19Å; I542-R545 PolarHBondContact O-N 3.12Å; R545-E548 PolarHBondContact O-N 3.03Å; R545-A549 PolarHBondContact O-N 3.04Å
546	A	76.6	Confident	71	Confident	49 Å²	49	110.3 Å²	110.3	41%	0.405	53%	0.534	S	S	.	.	H	α-helix	trans	-65.8	-41.4	172.8	0	0	0	0	0	112	I542 A544 E548 N550	I542-A546 VanDerWaalsContact O-CB 3.31Å; I542-A546 WeakPolarHBondContact O-CB 3.32Å; I542-A546 PolarHBondContact O-N 3.48Å; A544-A546 VanDerWaalsContact C-N 3.34Å; A544-A546 PolarHBondContact O-N 3.08Å; A546-E548 VanDerWaalsContact C-N 3.27Å; A546-E548 PolarHBondContact O-N 3.48Å; A546-N550 WeakPolarHBondContact O-CB 3.35Å; A546-N550 VanDerWaalsContact O-CG 3.25Å; A546-N550 PolarHBondContact O-N 3.3Å; A546-N550 VanDerWaalsContact O-N 3.11Å; A546-N550 PolarHBondContact O-OD1 3.32Å
547	K	76.1	Confident	69.7	Low	148 Å²	148	117.3 Å²	117.3	64%	0.643	56%	0.562	S	S	*	*	H	α-helix	trans	-63.9	-33.6	173.5	-76	-178	174.5	-164.8	0	112.6	I543 A544 K551	I543-K547 HydrophobicContact CG2-CD 4.46Å; I543-K547 WeakPolarHBondContact O-CG 3.44Å; I543-K547 PolarHBondContact O-N 2.93Å; A544-K547 WeakPolarHBondContact O-CB 3.5Å; A544-K547 PolarHBondContact O-N 2.91Å; A544-K547 VanDerWaalsContact O-N 3.15Å; K547-K551 PolarHBondContact O-N 3.34Å
548	E	74.7	Confident	68.3	Low	108 Å²	108	124.4 Å²	124.4	51%	0.505	60%	0.604	S	S	.	*	H	α-helix	trans	-74.8	-41.9	179.1	-175.2	159.5	-112.1	0	0	113.1	A544 R545 A546 N550 K551 H552	A544-E548 PolarHBondContact O-N 3.47Å; R545-E548 PolarHBondContact O-N 3.03Å; A546-E548 VanDerWaalsContact C-N 3.27Å; A546-E548 PolarHBondContact O-N 3.48Å; E548-N550 VanDerWaalsContact C-N 3.28Å; E548-N550 PolarHBondContact O-N 3.35Å; E548-K551 WeakPolarHBondContact O-CB 3.44Å; E548-K551 PolarHBondContact O-N 3.24Å; E548-K551 VanDerWaalsContact O-N 3.12Å; E548-H552 PolarHBondContact O-ND1 3.47Å
549	A	71.4	Confident	67.9	Low	58 Å²	58	130.1 Å²	130.1	48%	0.479	63%	0.63	S	S	.	*	H	α-helix	trans	-56.7	-44.4	169.6	0	0	0	0	0	111.1	R545 K551 H552	R545-A549 PolarHBondContact O-N 3.04Å; A549-K551 PolarHBondContact O-N 3.46Å; A549-H552 PolarHBondContact O-N 3.39Å; A549-H552 VanDerWaalsContact O-N 3.1Å
550	N	71.9	Confident	67.3	Low	121 Å²	121	133.4 Å²	133.4	65%	0.647	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	-11.7	178.7	-69.9	17.4	0	0	0	114.6	A546 E548	A546-N550 WeakPolarHBondContact O-CB 3.35Å; A546-N550 VanDerWaalsContact O-CG 3.25Å; A546-N550 PolarHBondContact O-N 3.3Å; A546-N550 VanDerWaalsContact O-N 3.11Å; A546-N550 PolarHBondContact O-OD1 3.32Å; E548-N550 VanDerWaalsContact C-N 3.28Å; E548-N550 PolarHBondContact O-N 3.35Å
551	K	67.6	Low	66.5	Low	162 Å²	162	132.1 Å²	132.1	70%	0.704	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-21.5	171.3	-71.1	176.6	-177.8	177.8	0	113.3	K547 E548 A549	K547-K551 PolarHBondContact O-N 3.34Å; E548-K551 WeakPolarHBondContact O-CB 3.44Å; E548-K551 PolarHBondContact O-N 3.24Å; E548-K551 VanDerWaalsContact O-N 3.12Å; A549-K551 PolarHBondContact O-N 3.46Å
552	H	54.4	Low	65.7	Low	151 Å²	151	137.8 Å²	137.8	70%	0.699	67%	0.672	S	S	*	*	S	Bend	trans	-94.5	-0.4	-171.4	-68.3	86.3	0	0	0	113.2	E548 A549 R554	E548-H552 PolarHBondContact O-ND1 3.47Å; A549-H552 PolarHBondContact O-N 3.39Å; A549-H552 VanDerWaalsContact O-N 3.1Å; H552-R554 VanDerWaalsContact C-N 3.31Å; H552-R554 PolarHBondContact O-N 3.39Å; H552-R554 VanDerWaalsContact O-N 3.11Å
553	I	57.2	Low	65	Low	118 Å²	118	139.4 Å²	139.4	61%	0.605	68%	0.678	S	S	*	*			trans	-84.5	80.8	171.1	-52	177.6	0	0	0	107.9	F555	I553-F555 HydrophobicContact CG2-CD2 4Å; I553-F555 HydrophobicContact CG2-CE2 3.65Å; I553-F555 HydrophobicContact CG2-CZ 4.47Å
554	R	47.7	Very low	64	Low	216 Å²	216	142.1 Å²	142.1	82%	0.815	69%	0.689	S	S	*	*			trans	-94.9	111.7	162	-171.1	177.9	-167.4	170.2	1.6	106.5	H552	H552-R554 VanDerWaalsContact C-N 3.31Å; H552-R554 PolarHBondContact O-N 3.39Å; H552-R554 VanDerWaalsContact O-N 3.11Å
555	F	52.1	Low	62.8	Low	172 Å²	172	148.1 Å²	148.1	75%	0.754	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-71.7	130.3	158.6	-73.7	-91.4	0	0	0	106.5	I553	I553-F555 HydrophobicContact CG2-CD2 4Å; I553-F555 HydrophobicContact CG2-CE2 3.65Å; I553-F555 HydrophobicContact CG2-CZ 4.47Å
556	E	49	Very low	61.7	Low	163 Å²	163	146 Å²	146	76%	0.762	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-84	130.8	159.3	-62.7	-174.8	144.8	0	0	105.4
557	E	51.3	Low	60.4	Low	192 Å²	192	154.1 Å²	154.1	90%	0.897	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-93.7	120.2	175.5	-66.6	177.3	136.8	0	0	106.4
558	D	51.6	Low	59	Low	240 Å²	240	154.6 Å²	154.6	100%	1.283	74%	0.741	S	S	*	*			trans	-71.6	0	178.8	-66.8	-59.5	0	0	0	112.5

Retrieved 558 of 558 residues in 274.5 ms (Link to these results)

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