A0A087XYI5_POEFO Loading...

Zinc finger and BTB domain containing 49

AlphaFold DB , UniProt , Accession A0A087XYI5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 794 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.1	Very low	36.3	Very low	187 Å²	187	108.9 Å²	108.9	92%	0.921	60%	0.596	S	S	*	*				0	-54.6	0	-79.4	-70.4	-88.7	0	0	110	T3 L4	M1-T3 VanDerWaalsContact C-N 3.29Å; M1-T3 PolarHBondContact O-N 3.3Å; M1-L4 WeakPolarHBondContact O-CB 3.37Å; M1-L4 PolarHBondContact O-N 3.03Å
2	D	28.9	Very low	36.6	Very low	135 Å²	135	109.3 Å²	109.3	72%	0.722	60%	0.596	S	S	*	*	H	α-helix	trans	-65.2	-28.2	-168.7	-46.8	-82.3	0	0	0	113.8	L4 S5 S6	D2-L4 PolarHBondContact O-N 3.22Å; D2-S5 VanDerWaalsContact O-CB 3.28Å; D2-S5 WeakPolarHBondContact O-CB 3.41Å; D2-S5 PolarHBondContact O-N 2.94Å; D2-S6 PolarHBondContact O-N 3.27Å
3	T	35.5	Very low	36.8	Very low	115 Å²	115	110.3 Å²	110.3	71%	0.706	59%	0.594	S	S	*	*	H	α-helix	trans	-62.8	-18.7	171.5	45.9	0	0	0	0	114.7	M1 S6	M1-T3 VanDerWaalsContact C-N 3.29Å; M1-T3 PolarHBondContact O-N 3.3Å; T3-S6 PolarHBondContact O-OG 2.96Å
4	L	34	Very low	36.9	Very low	130 Å²	130	109.3 Å²	109.3	68%	0.681	58%	0.584	S	S	*	*	H	α-helix	trans	-87.1	-21.6	170.2	-73.5	164.8	0	0	0	112.4	M1 D2 S8	M1-L4 WeakPolarHBondContact O-CB 3.37Å; M1-L4 PolarHBondContact O-N 3.03Å; D2-L4 PolarHBondContact O-N 3.22Å; L4-S8 PolarHBondContact O-N 3.28Å; L4-S8 PolarHBondContact O-OG 3.4Å
5	S	34.6	Very low	36.9	Very low	77 Å²	77	109.5 Å²	109.5	54%	0.538	58%	0.584	S	S	.	*	H	α-helix	trans	-68	-53.2	178.1	-174.6	0	0	0	0	110.4	D2 H7 S8 S9	D2-S5 VanDerWaalsContact O-CB 3.28Å; D2-S5 WeakPolarHBondContact O-CB 3.41Å; D2-S5 PolarHBondContact O-N 2.94Å; S5-H7 VanDerWaalsContact C-N 3.32Å; S5-H7 PolarHBondContact O-N 2.97Å; S5-S8 PolarHBondContact O-N 3.48Å; S5-S8 PolarHBondContact O-OG 3.38Å; S5-S9 PolarHBondContact O-N 2.86Å; S5-S9 PolarHBondContact O-OG 3.48Å
6	S	37.4	Very low	37	Very low	73 Å²	73	111.5 Å²	111.5	51%	0.51	59%	0.589	S	S	.	*	H	α-helix	trans	-58.2	-39.8	-179.8	54.9	0	0	0	0	113.5	D2 T3 S8 S9 Y10	D2-S6 PolarHBondContact O-N 3.27Å; T3-S6 PolarHBondContact O-OG 2.96Å; S6-S8 VanDerWaalsContact C-N 3.34Å; S6-S8 PolarHBondContact O-N 3.19Å; S6-S9 WeakPolarHBondContact CA-OG 3.38Å; S6-S9 PolarHBondContact O-OG 3.1Å; S6-Y10 PolarHBondContact O-N 3.29Å
7	H	36.5	Very low	37.1	Very low	122 Å²	122	113.2 Å²	113.2	57%	0.565	59%	0.593	S	S	*	*	H	α-helix	trans	-67.8	-33.4	177.4	-132.9	113.5	0	0	0	112.5	S5 L11	S5-H7 VanDerWaalsContact C-N 3.32Å; S5-H7 PolarHBondContact O-N 2.97Å; H7-L11 PolarHBondContact O-N 3.18Å
8	S	38.8	Very low	37	Very low	61 Å²	61	116.3 Å²	116.3	43%	0.427	60%	0.604	S	S	.	*	H	α-helix	trans	-73	-36.8	178.7	70.2	0	0	0	0	112.8	L4 S5 S6 L12	L4-S8 PolarHBondContact O-N 3.28Å; L4-S8 PolarHBondContact O-OG 3.4Å; S5-S8 PolarHBondContact O-N 3.48Å; S5-S8 PolarHBondContact O-OG 3.38Å; S6-S8 VanDerWaalsContact C-N 3.34Å; S6-S8 PolarHBondContact O-N 3.19Å; S8-L12 WeakPolarHBondContact O-CD1 3.48Å; S8-L12 PolarHBondContact O-N 3.01Å
9	S	39	Very low	36.8	Very low	66 Å²	66	120.2 Å²	120.2	46%	0.462	61%	0.61	S	S	.	*	H	α-helix	trans	-64	-42.2	172.8	37.9	0	0	0	0	112.9	S5 S6 L12 Q13	S5-S9 PolarHBondContact O-N 2.86Å; S5-S9 PolarHBondContact O-OG 3.48Å; S6-S9 WeakPolarHBondContact CA-OG 3.38Å; S6-S9 PolarHBondContact O-OG 3.1Å; S9-L12 PolarHBondContact O-N 3.06Å; S9-Q13 PolarHBondContact O-N 3.34Å
10	Y	37.6	Very low	36.8	Very low	145 Å²	145	121.7 Å²	121.7	57%	0.569	62%	0.617	S	S	*	*	H	α-helix	trans	-63.5	-43.3	178.8	-172.3	-99.8	0	0	0	112	S6 Q13 Q14	S6-Y10 PolarHBondContact O-N 3.29Å; Y10-Q13 PolarHBondContact O-N 2.82Å; Y10-Q14 HydrophobicContact CE1-CG 4.47Å; Y10-Q14 PolarHBondContact O-N 3.27Å; Y10-Q14 VanDerWaalsContact O-N 3.16Å; Y10-Q14 PolarHBondContact OH-NE2 3.24Å
11	L	37.5	Very low	36.4	Very low	87 Å²	87	125.1 Å²	125.1	46%	0.455	63%	0.631	S	S	.	*	H	α-helix	trans	-66.1	-37.7	175	-75.6	168	0	0	0	112.7	H7 Q13 L15	H7-L11 PolarHBondContact O-N 3.18Å; L11-Q13 VanDerWaalsContact C-N 3.31Å; L11-Q13 PolarHBondContact O-N 3.13Å; L11-L15 WeakPolarHBondContact O-CB 3.47Å; L11-L15 WeakPolarHBondContact O-CD1 3.37Å; L11-L15 VanDerWaalsContact O-CG 3.23Å; L11-L15 WeakPolarHBondContact O-CG 3.43Å; L11-L15 PolarHBondContact O-N 2.91Å; L11-L15 VanDerWaalsContact O-N 3.07Å
12	L	40.1	Very low	35.9	Very low	114 Å²	114	120 Å²	120	60%	0.597	63%	0.626	S	S	*	*	H	α-helix	trans	-61.1	-41.2	172.9	-106.8	75.1	0	0	0	111.8	S8 S9 L15 Q16	S8-L12 WeakPolarHBondContact O-CD1 3.48Å; S8-L12 PolarHBondContact O-N 3.01Å; S9-L12 PolarHBondContact O-N 3.06Å; L12-L15 PolarHBondContact O-N 3.34Å; L12-Q16 WeakPolarHBondContact O-CB 3.18Å; L12-Q16 PolarHBondContact O-N 3.42Å
13	Q	39.8	Very low	36.1	Very low	122 Å²	122	121.6 Å²	121.6	57%	0.57	63%	0.634	S	S	*	*	H	α-helix	trans	-66.5	-47.6	-177.7	-167.9	159	-14.8	0	0	111.8	S9 Y10 L11 L15 Q16 E17	S9-Q13 PolarHBondContact O-N 3.34Å; Y10-Q13 PolarHBondContact O-N 2.82Å; L11-Q13 VanDerWaalsContact C-N 3.31Å; L11-Q13 PolarHBondContact O-N 3.13Å; Q13-L15 VanDerWaalsContact C-N 3.33Å; Q13-L15 PolarHBondContact O-N 2.88Å; Q13-Q16 WeakPolarHBondContact O-CB 3.38Å; Q13-Q16 PolarHBondContact O-N 3.16Å; Q13-E17 PolarHBondContact O-N 2.85Å; Q13-E17 VanDerWaalsContact O-N 3.12Å
14	Q	38.2	Very low	35.7	Very low	96 Å²	96	122.3 Å²	122.3	45%	0.449	63%	0.632	S	S	.	*	H	α-helix	trans	-61	-38.7	173.4	-70.9	-165.1	-21	0	0	112.9	Y10 Q16 E17 Q18	Y10-Q14 HydrophobicContact CE1-CG 4.47Å; Y10-Q14 PolarHBondContact O-N 3.27Å; Y10-Q14 VanDerWaalsContact O-N 3.16Å; Y10-Q14 PolarHBondContact OH-NE2 3.24Å; Q14-Q16 PolarHBondContact O-N 3.04Å; Q14-E17 PolarHBondContact O-N 2.97Å; Q14-Q18 WeakPolarHBondContact O-CB 3.5Å; Q14-Q18 VanDerWaalsContact O-CG 3.29Å; Q14-Q18 WeakPolarHBondContact O-CG 3.31Å; Q14-Q18 PolarHBondContact O-N 3.32Å; Q14-Q18 VanDerWaalsContact O-N 3.14Å
15	L	37.3	Very low	35.6	Very low	112 Å²	112	120.6 Å²	120.6	59%	0.586	63%	0.631	S	S	*	*	H	α-helix	trans	-69.2	-17.8	175.7	-74.2	170.3	0	0	0	113.7	L11 L12 Q13	L11-L15 WeakPolarHBondContact O-CB 3.47Å; L11-L15 WeakPolarHBondContact O-CD1 3.37Å; L11-L15 VanDerWaalsContact O-CG 3.23Å; L11-L15 WeakPolarHBondContact O-CG 3.43Å; L11-L15 PolarHBondContact O-N 2.91Å; L11-L15 VanDerWaalsContact O-N 3.07Å; L12-L15 PolarHBondContact O-N 3.34Å; Q13-L15 VanDerWaalsContact C-N 3.33Å; Q13-L15 PolarHBondContact O-N 2.88Å
16	Q	38.5	Very low	35.2	Very low	142 Å²	142	122.7 Å²	122.7	66%	0.664	64%	0.636	S	S	*	*	H	α-helix	trans	-88.2	-33.7	177.3	-168.7	160.3	-51.7	0	0	112	L12 Q13 Q14 R19	L12-Q16 WeakPolarHBondContact O-CB 3.18Å; L12-Q16 PolarHBondContact O-N 3.42Å; Q13-Q16 WeakPolarHBondContact O-CB 3.38Å; Q13-Q16 PolarHBondContact O-N 3.16Å; Q14-Q16 PolarHBondContact O-N 3.04Å; Q16-R19 VanDerWaalsContact O-CB 3.31Å; Q16-R19 WeakPolarHBondContact O-CB 3.38Å
17	E	37.2	Very low	35.1	Very low	140 Å²	140	122.8 Å²	122.8	65%	0.654	64%	0.635	S	S	*	*	H	α-helix	trans	-72.8	-39.3	174.3	-69.6	172	166.4	0	0	112.3	Q13 Q14 R19	Q13-E17 PolarHBondContact O-N 2.85Å; Q13-E17 VanDerWaalsContact O-N 3.12Å; Q14-E17 PolarHBondContact O-N 2.97Å; E17-R19 PolarHBondContact O-N 2.93Å
18	Q	36	Very low	35	Very low	169 Å²	169	123.5 Å²	123.5	79%	0.79	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	1.6	174.9	-72.4	-82.9	-47.2	0	0	114.6	Q14	Q14-Q18 WeakPolarHBondContact O-CB 3.5Å; Q14-Q18 VanDerWaalsContact O-CG 3.29Å; Q14-Q18 WeakPolarHBondContact O-CG 3.31Å; Q14-Q18 PolarHBondContact O-N 3.32Å; Q14-Q18 VanDerWaalsContact O-N 3.14Å
19	R	33	Very low	34.8	Very low	191 Å²	191	123.5 Å²	123.5	72%	0.721	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	7.6	-161.5	-132.9	179.2	-162.4	-169.2	7.7	116.2	Q16 E17	Q16-R19 VanDerWaalsContact O-CB 3.31Å; Q16-R19 WeakPolarHBondContact O-CB 3.38Å; E17-R19 PolarHBondContact O-N 2.93Å
20	I	37.7	Very low	34.6	Very low	149 Å²	149	124.2 Å²	124.2	76%	0.764	64%	0.637	S	S	*	*	S	Bend	trans	-116.7	52.2	-176.8	-43.8	178	0	0	0	112.3
21	Q	28.8	Very low	34.4	Very low	195 Å²	195	121 Å²	121	91%	0.911	63%	0.632	S	S	*	*	S	Bend	trans	-164.7	140.8	150	-110.2	165	52.2	0	0	111.1
22	G	27.6	Very low	34	Very low	78 Å²	78	127 Å²	127	80%	0.804	66%	0.655	S	S	*	*			trans	92	112.1	171.3	0	0	0	0	0	116
23	L	32.3	Very low	33.7	Very low	170 Å²	170	125 Å²	125	89%	0.89	66%	0.661	S	S	*	*			trans	-44.7	146.4	157.9	-58.7	137.7	0	0	0	112.3
24	L	28.4	Very low	33	Very low	129 Å²	129	123 Å²	123	68%	0.675	66%	0.657	S	S	*	*			trans	-173.6	175.2	133	-103.9	164.2	0	0	0	114.9
25	C	30.4	Very low	32.7	Very low	95 Å²	95	122 Å²	122	64%	0.642	66%	0.66	S	S	*	*			trans	-55.6	164.1	-162.4	-61	0	0	0	0	119
26	D	27.4	Very low	32.5	Very low	121 Å²	121	122.3 Å²	122.3	65%	0.647	66%	0.657	S	S	*	*			trans	-89.9	111.9	179.9	-73.2	37.3	0	0	0	112.4	K37	D26-K37 VanDerWaalsContact CG-CE 3.41Å; D26-K37 VanDerWaalsContact OD1-CE 3.24Å; D26-K37 WeakPolarHBondContact OD1-CE 3.42Å; D26-K37 IonicContact OD1-NZ 3.32Å; D26-K37 PolarHBondContact OD1-NZ 3.47Å; D26-K37 WeakPolarHBondContact OD2-CE 3.48Å; D26-K37 IonicContact OD2-NZ 2.65Å; D26-K37 PolarHBondContact OD2-NZ 3.08Å
27	C	35.5	Very low	32.2	Very low	74 Å²	74	121 Å²	121	50%	0.5	65%	0.649	S	S	.	*			trans	-129.3	145.4	155.6	-66.8	0	0	0	0	108.7	A38	C27-A38 PolarHBondContact O-N 3.07Å; C27-A38 VanDerWaalsContact O-N 3.12Å
28	M	33.3	Very low	32.3	Very low	138 Å²	138	115.1 Å²	115.1	68%	0.68	63%	0.625	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-110.9	141.7	172.8	-63.4	-155.9	-54.4	0	0	111.3	C35 F36	M28-C35 HydrophobicContact CE-CB 4.44Å; M28-C35 HydrophobicContact SD-CB 4.19Å; M28-F36 CarbonylContact C-O 3.58Å; M28-F36 WeakPolarHBondContact CA-O 3.27Å
29	L	35.7	Very low	32.4	Very low	61 Å²	61	110.9 Å²	110.9	32%	0.319	61%	0.605	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.9	139.9	164.7	-82.4	165	0	0	0	108.2	F36 A38 L43	L29-F36 PolarHBondContact N-O 3.07Å; L29-F36 PolarHBondContact O-N 3.45Å; L29-A38 HydrophobicContact CD1-CB 3.91Å; L29-L43 HydrophobicContact CD1-CD2 3.96Å; L29-L43 HydrophobicContact CD1-CG 4.4Å; L29-L43 HydrophobicContact CD2-CD2 4.23Å; L29-L43 HydrophobicContact CG-CD2 4.35Å
30	V	34	Very low	32.7	Very low	81 Å²	81	109.3 Å²	109.3	49%	0.491	60%	0.603	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-114.6	124.4	174	-172.4	0	0	0	0	108.3	V34	V30-V34 WeakPolarHBondContact CA-O 3.43Å
31	V	33.6	Very low	32.7	Very low	78 Å²	78	107.5 Å²	107.5	47%	0.473	60%	0.595	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-132.5	124.4	176.9	-178.2	0	0	0	0	108	G33 V34	V31-G33 PolarHBondContact O-N 3.44Å; V31-G33 VanDerWaalsContact O-N 3.17Å; V31-V34 PolarHBondContact N-O 3.3Å; V31-V34 VanDerWaalsContact N-O 3.11Å; V31-V34 PolarHBondContact O-N 3.11Å
32	K	30	Very low	33.2	Very low	212 Å²	212	101 Å²	101	92%	0.922	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	43.8	47.1	-177.1	-64.3	-169.8	175.3	-174	0	113.6	V34	K32-V34 VanDerWaalsContact C-N 3.34Å; K32-V34 PolarHBondContact O-N 3.09Å
33	G	32.4	Very low	34	Very low	71 Å²	71	100.8 Å²	100.8	73%	0.732	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	81	-1.5	175.8	0	0	0	0	0	116.4	V31	V31-G33 PolarHBondContact O-N 3.44Å; V31-G33 VanDerWaalsContact O-N 3.17Å
34	V	26.5	Very low	34.4	Very low	81 Å²	81	95.4 Å²	95.4	49%	0.491	53%	0.528	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	128.7	178	-175.7	0	0	0	0	110.7	V30 V31 K32 F36	V30-V34 WeakPolarHBondContact CA-O 3.43Å; V31-V34 PolarHBondContact N-O 3.3Å; V31-V34 VanDerWaalsContact N-O 3.11Å; V31-V34 PolarHBondContact O-N 3.11Å; K32-V34 VanDerWaalsContact C-N 3.34Å; K32-V34 PolarHBondContact O-N 3.09Å; V34-F36 HydrophobicContact CB-CE2 3.78Å; V34-F36 HydrophobicContact CB-CZ 4.08Å; V34-F36 HydrophobicContact CG1-CD2 4.35Å; V34-F36 HydrophobicContact CG1-CE1 4.21Å; V34-F36 HydrophobicContact CG1-CE2 3.68Å; V34-F36 HydrophobicContact CG1-CZ 3.6Å; V34-F36 WeakPolarHBondContact O-CD2 3.38Å
35	C	30.2	Very low	34.7	Very low	76 Å²	76	92.1 Å²	92.1	51%	0.514	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	117.3	-179.1	-59	0	0	0	0	111.6	M28	M28-C35 HydrophobicContact CE-CB 4.44Å; M28-C35 HydrophobicContact SD-CB 4.19Å
36	F	33.7	Very low	35.1	Very low	117 Å²	117	92.8 Å²	92.8	51%	0.513	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	130	176.9	-62.5	-85.7	0	0	0	111.1	M28 L29 V34 A38	M28-F36 CarbonylContact C-O 3.58Å; M28-F36 WeakPolarHBondContact CA-O 3.27Å; L29-F36 PolarHBondContact N-O 3.07Å; L29-F36 PolarHBondContact O-N 3.45Å; V34-F36 HydrophobicContact CB-CE2 3.78Å; V34-F36 HydrophobicContact CB-CZ 4.08Å; V34-F36 HydrophobicContact CG1-CD2 4.35Å; V34-F36 HydrophobicContact CG1-CE1 4.21Å; V34-F36 HydrophobicContact CG1-CE2 3.68Å; V34-F36 HydrophobicContact CG1-CZ 3.6Å; V34-F36 WeakPolarHBondContact O-CD2 3.38Å; F36-A38 PolarHBondContact O-N 3.39Å
37	K	33.1	Very low	35.8	Very low	116 Å²	116	89.6 Å²	89.6	50%	0.504	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	109.7	171.8	-176.3	167.3	175.2	167.2	0	109.6	D26	D26-K37 VanDerWaalsContact CG-CE 3.41Å; D26-K37 VanDerWaalsContact OD1-CE 3.24Å; D26-K37 WeakPolarHBondContact OD1-CE 3.42Å; D26-K37 IonicContact OD1-NZ 3.32Å; D26-K37 PolarHBondContact OD1-NZ 3.47Å; D26-K37 WeakPolarHBondContact OD2-CE 3.48Å; D26-K37 IonicContact OD2-NZ 2.65Å; D26-K37 PolarHBondContact OD2-NZ 3.08Å
38	A	38	Very low	36	Very low	16 Å²	16	89.7 Å²	89.7	13%	0.132	50%	0.5	C	S	.	.			trans	-113.5	139.8	-167.6	0	0	0	0	0	112.7	C27 L29 F36	C27-A38 PolarHBondContact O-N 3.07Å; C27-A38 VanDerWaalsContact O-N 3.12Å; L29-A38 HydrophobicContact CD1-CB 3.91Å; F36-A38 PolarHBondContact O-N 3.39Å
39	H	38.8	Very low	36.2	Very low	80 Å²	80	90 Å²	90	37%	0.37	50%	0.495	S	S	.	.			trans	-82.6	152.6	177.9	-174.3	-117.9	0	0	0	111.6	N41 V42	H39-N41 PolarHBondContact O-N 3.01Å; H39-V42 HydrophobicContact CB-CG2 4.48Å; H39-V42 WeakPolarHBondContact O-CB 3.38Å; H39-V42 PolarHBondContact O-N 3.48Å
40	K	39.6	Very low	36.4	Very low	157 Å²	157	91.2 Å²	91.2	68%	0.683	50%	0.498	S	S	*	.	H	α-helix	trans	-53.8	-33.3	-174.7	-173.2	168.6	-178.7	170.5	0	113.9	V42 L43 A44	K40-V42 VanDerWaalsContact C-N 3.31Å; K40-V42 PolarHBondContact O-N 3.27Å; K40-L43 PolarHBondContact O-N 3.34Å; K40-A44 PolarHBondContact O-N 3.17Å
41	N	38.2	Very low	36.6	Very low	112 Å²	112	95.4 Å²	95.4	60%	0.599	51%	0.505	S	S	*	.	H	α-helix	trans	-69.1	-27.3	178.7	-59.1	2.3	0	0	0	112.8	H39 A44 A45	H39-N41 PolarHBondContact O-N 3.01Å; N41-A44 PolarHBondContact O-N 3.1Å; N41-A45 PolarHBondContact O-N 3.11Å
42	V	39.3	Very low	36.8	Very low	57 Å²	57	95 Å²	95	35%	0.345	51%	0.505	S	S	.	.	H	α-helix	trans	-70.4	-44.8	177.8	-177.7	0	0	0	0	110	H39 K40 A44 A45 F46	H39-V42 HydrophobicContact CB-CG2 4.48Å; H39-V42 WeakPolarHBondContact O-CB 3.38Å; H39-V42 PolarHBondContact O-N 3.48Å; K40-V42 VanDerWaalsContact C-N 3.31Å; K40-V42 PolarHBondContact O-N 3.27Å; V42-A44 VanDerWaalsContact C-N 3.28Å; V42-A44 PolarHBondContact O-N 3.49Å; V42-A45 WeakPolarHBondContact O-CB 3.45Å; V42-A45 PolarHBondContact O-N 3.12Å; V42-A45 VanDerWaalsContact O-N 3.12Å; V42-F46 HydrophobicContact CG1-CD2 3.97Å; V42-F46 HydrophobicContact CG1-CE2 3.93Å; V42-F46 WeakPolarHBondContact O-CD2 3.48Å; V42-F46 PolarHBondContact O-N 3.31Å
43	L	44	Very low	37.1	Very low	75 Å²	75	87.5 Å²	87.5	39%	0.393	48%	0.475	S	S	.	.	H	α-helix	trans	-58.9	-39.2	173.1	-77.2	157.6	0	0	0	111.9	L29 K40 F46 S47	L29-L43 HydrophobicContact CD1-CD2 3.96Å; L29-L43 HydrophobicContact CD1-CG 4.4Å; L29-L43 HydrophobicContact CD2-CD2 4.23Å; L29-L43 HydrophobicContact CG-CD2 4.35Å; K40-L43 PolarHBondContact O-N 3.34Å; L43-F46 PolarHBondContact O-N 3.12Å; L43-S47 PolarHBondContact O-N 3.42Å
44	A	40.3	Very low	37.3	Very low	56 Å²	56	91.2 Å²	91.2	46%	0.463	47%	0.472	S	S	.	.	H	α-helix	trans	-63.7	-42.5	173.7	0	0	0	0	0	112.2	K40 N41 V42 S47 S48	K40-A44 PolarHBondContact O-N 3.17Å; N41-A44 PolarHBondContact O-N 3.1Å; V42-A44 VanDerWaalsContact C-N 3.28Å; V42-A44 PolarHBondContact O-N 3.49Å; A44-S47 WeakPolarHBondContact O-CB 3.42Å; A44-S47 PolarHBondContact O-N 3.21Å; A44-S47 VanDerWaalsContact O-N 3.15Å; A44-S47 PolarHBondContact O-OG 3.24Å; A44-S48 PolarHBondContact O-N 2.98Å; A44-S48 VanDerWaalsContact O-N 3.16Å
45	A	34.9	Very low	37.9	Very low	60 Å²	60	95.1 Å²	95.1	50%	0.496	48%	0.484	S	S	.	.	H	α-helix	trans	-62.6	-43.1	175.7	0	0	0	0	0	112.2	N41 V42 S47 S48 Y49	N41-A45 PolarHBondContact O-N 3.11Å; V42-A45 WeakPolarHBondContact O-CB 3.45Å; V42-A45 PolarHBondContact O-N 3.12Å; V42-A45 VanDerWaalsContact O-N 3.12Å; A45-S47 VanDerWaalsContact C-N 3.3Å; A45-S47 PolarHBondContact O-N 3.39Å; A45-S48 WeakPolarHBondContact O-CB 3.41Å; A45-S48 PolarHBondContact O-N 2.81Å; A45-Y49 PolarHBondContact O-N 3Å
46	F	39.7	Very low	38.2	Very low	109 Å²	109	97.4 Å²	97.4	48%	0.478	49%	0.492	S	S	.	.	H	α-helix	trans	-58.6	-40.1	171.4	-88.3	-84.3	0	0	0	112.1	V42 L43 S48 Y49 F50	V42-F46 HydrophobicContact CG1-CD2 3.97Å; V42-F46 HydrophobicContact CG1-CE2 3.93Å; V42-F46 WeakPolarHBondContact O-CD2 3.48Å; V42-F46 PolarHBondContact O-N 3.31Å; L43-F46 PolarHBondContact O-N 3.12Å; F46-S48 PolarHBondContact O-N 3.37Å; F46-Y49 PolarHBondContact O-N 2.88Å; F46-F50 HydrophobicContact CD1-CE2 4.47Å; F46-F50 VanDerWaalsContact O-CD2 3.32Å; F46-F50 WeakPolarHBondContact O-CD2 3.32Å; F46-F50 PolarHBondContact O-N 3.45Å
47	S	41.7	Very low	38.1	Very low	54 Å²	54	94.2 Å²	94.2	38%	0.378	48%	0.484	S	S	.	.	H	α-helix	trans	-67.3	-17	176.1	86	0	0	0	0	114.4	L43 A44 A45 R51	L43-S47 PolarHBondContact O-N 3.42Å; A44-S47 WeakPolarHBondContact O-CB 3.42Å; A44-S47 PolarHBondContact O-N 3.21Å; A44-S47 VanDerWaalsContact O-N 3.15Å; A44-S47 PolarHBondContact O-OG 3.24Å; A45-S47 VanDerWaalsContact C-N 3.3Å; A45-S47 PolarHBondContact O-N 3.39Å; S47-R51 WeakPolarHBondContact O-CG 3.41Å; S47-R51 PolarHBondContact O-NH1 3.32Å
48	S	38.5	Very low	38.2	Very low	76 Å²	76	94.1 Å²	94.1	53%	0.531	50%	0.495	S	S	.	.	H	α-helix	trans	-89.9	-40.4	172	-174.8	0	0	0	0	111.3	A44 A45 F46 F50 R51 S52	A44-S48 PolarHBondContact O-N 2.98Å; A44-S48 VanDerWaalsContact O-N 3.16Å; A45-S48 WeakPolarHBondContact O-CB 3.41Å; A45-S48 PolarHBondContact O-N 2.81Å; F46-S48 PolarHBondContact O-N 3.37Å; S48-F50 PolarHBondContact O-N 3.19Å; S48-R51 PolarHBondContact O-N 3.19Å; S48-R51 VanDerWaalsContact O-N 3.17Å; S48-S52 PolarHBondContact O-N 2.87Å
49	Y	37.8	Very low	38.1	Very low	144 Å²	144	98.7 Å²	98.7	57%	0.565	53%	0.526	S	S	*	.	H	α-helix	trans	-58.6	-45	173.9	-176.1	-108	0	0	0	112.2	A45 F46 R51 S52 L53	A45-Y49 PolarHBondContact O-N 3Å; F46-Y49 PolarHBondContact O-N 2.88Å; Y49-R51 PolarHBondContact O-N 2.97Å; Y49-S52 PolarHBondContact O-N 3.48Å; Y49-L53 HydrophobicContact CD1-CD1 3.87Å; Y49-L53 HydrophobicContact CE1-CD1 3.48Å; Y49-L53 VanDerWaalsContact CE1-CD1 3.48Å; Y49-L53 HydrophobicContact CE1-CG 4.35Å; Y49-L53 PolarHBondContact O-N 3.45Å
50	F	39.3	Very low	38.2	Very low	88 Å²	88	100.8 Å²	100.8	39%	0.386	54%	0.536	S	S	.	.	H	α-helix	trans	-61.4	-42.2	173.4	-84.2	-69.5	0	0	0	112.7	F46 S48 S52 L53 F54 V64	F46-F50 HydrophobicContact CD1-CE2 4.47Å; F46-F50 VanDerWaalsContact O-CD2 3.32Å; F46-F50 WeakPolarHBondContact O-CD2 3.32Å; F46-F50 PolarHBondContact O-N 3.45Å; S48-F50 PolarHBondContact O-N 3.19Å; F50-S52 VanDerWaalsContact C-N 3.32Å; F50-S52 PolarHBondContact O-N 3.26Å; F50-L53 PolarHBondContact O-N 3.01Å; F50-F54 WeakPolarHBondContact O-CD2 3.47Å; F50-F54 PolarHBondContact O-N 3.46Å; F50-V64 HydrophobicContact CE1-CG1 4.27Å
51	R	39.2	Very low	38	Very low	168 Å²	168	100.1 Å²	100.1	63%	0.634	53%	0.533	S	S	*	.	H	α-helix	trans	-60.4	-41.8	174.6	-77.7	-179	175.7	88.9	-5.3	112.1	S47 S48 Y49 F54 Q55	S47-R51 WeakPolarHBondContact O-CG 3.41Å; S47-R51 PolarHBondContact O-NH1 3.32Å; S48-R51 PolarHBondContact O-N 3.19Å; S48-R51 VanDerWaalsContact O-N 3.17Å; Y49-R51 PolarHBondContact O-N 2.97Å; R51-F54 PolarHBondContact O-N 2.63Å; R51-Q55 WeakPolarHBondContact O-CB 3.41Å; R51-Q55 PolarHBondContact O-N 3.29Å
52	S	37.4	Very low	37.9	Very low	69 Å²	69	101.2 Å²	101.2	48%	0.483	54%	0.539	S	S	.	.	H	α-helix	trans	-63.9	-40.1	176.8	-165.5	0	0	0	0	112.5	S48 Y49 F50 Q55 N56	S48-S52 PolarHBondContact O-N 2.87Å; Y49-S52 PolarHBondContact O-N 3.48Å; F50-S52 VanDerWaalsContact C-N 3.32Å; F50-S52 PolarHBondContact O-N 3.26Å; S52-Q55 PolarHBondContact O-N 2.87Å; S52-N56 PolarHBondContact O-ND2 3.13Å
53	L	36.2	Very low	37.7	Very low	55 Å²	55	104.6 Å²	104.6	29%	0.288	56%	0.555	S	S	.	*	H	α-helix	trans	-63.4	-47.5	174.2	-79.2	168.5	0	0	0	112.4	Y49 F50 Q55 N56	Y49-L53 HydrophobicContact CD1-CD1 3.87Å; Y49-L53 HydrophobicContact CE1-CD1 3.48Å; Y49-L53 VanDerWaalsContact CE1-CD1 3.48Å; Y49-L53 HydrophobicContact CE1-CG 4.35Å; Y49-L53 PolarHBondContact O-N 3.45Å; F50-L53 PolarHBondContact O-N 3.01Å; L53-Q55 PolarHBondContact O-N 3.22Å; L53-Q55 VanDerWaalsContact O-N 3.13Å; L53-N56 PolarHBondContact O-N 2.86Å
54	F	36.2	Very low	37.2	Very low	150 Å²	150	104.4 Å²	104.4	66%	0.658	56%	0.557	S	S	*	*	H	α-helix	trans	-60.5	-22.9	178.7	-84.4	-65.5	0	0	0	113.8	F50 R51 F65	F50-F54 WeakPolarHBondContact O-CD2 3.47Å; F50-F54 PolarHBondContact O-N 3.46Å; R51-F54 PolarHBondContact O-N 2.63Å; F54-F65 HydrophobicContact CZ-CZ 4.19Å
55	Q	39.5	Very low	36.6	Very low	163 Å²	163	108 Å²	108	76%	0.762	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	-4.1	-172.3	-158.1	147.4	22.1	0	0	114.4	R51 S52 L53	R51-Q55 WeakPolarHBondContact O-CB 3.41Å; R51-Q55 PolarHBondContact O-N 3.29Å; S52-Q55 PolarHBondContact O-N 2.87Å; L53-Q55 PolarHBondContact O-N 3.22Å; L53-Q55 VanDerWaalsContact O-N 3.13Å
56	N	36.3	Very low	36.5	Very low	124 Å²	124	111.4 Å²	111.4	66%	0.663	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.1	-17.3	-172.1	-71.5	-75.9	0	0	0	116.5	S52 L53	S52-N56 PolarHBondContact O-ND2 3.13Å; L53-N56 PolarHBondContact O-N 2.86Å
57	S	32.5	Very low	36.2	Very low	50 Å²	50	112.1 Å²	112.1	35%	0.35	58%	0.58	S	S	.	*			trans	-153.8	97.9	-177.4	44.1	0	0	0	0	114.7	S59	S57-S59 PolarHBondContact O-N 2.9Å
58	P	34.7	Very low	35.9	Very low	113 Å²	113	113.8 Å²	113.8	73%	0.734	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	-17.6	-178.3	-22.7	34.2	0	0	0	115.8
59	S	36.8	Very low	36	Very low	113 Å²	113	112.3 Å²	112.3	79%	0.79	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	-14	-165.1	45.2	0	0	0	0	115.5	S57 K61	S57-S59 PolarHBondContact O-N 2.9Å; S59-K61 VanDerWaalsContact C-N 3.33Å; S59-K61 PolarHBondContact O-N 3.01Å
60	Q	39.3	Very low	36.1	Very low	123 Å²	123	113.7 Å²	113.7	58%	0.575	59%	0.585	S	S	*	*			trans	-96.6	41.5	-176.8	-153.7	168.1	27	0	0	112.9	N62	Q60-N62 PolarHBondContact O-N 3.3Å
61	K	35.9	Very low	36.3	Very low	144 Å²	144	115.3 Å²	115.3	63%	0.626	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	-13.8	-169.3	-91.9	-174.7	175.6	-174.1	0	116.7	S59 F65	S59-K61 VanDerWaalsContact C-N 3.33Å; S59-K61 PolarHBondContact O-N 3.01Å; K61-F65 WeakPolarHBondContact O-CD2 3.29Å; K61-F65 WeakPolarHBondContact O-CE2 3.4Å
62	N	37.1	Very low	36.5	Very low	134 Å²	134	110.3 Å²	110.3	72%	0.717	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.8	-36.1	-166.6	-67.1	-13.2	0	0	0	115.1	Q60	Q60-N62 PolarHBondContact O-N 3.3Å
63	D	33.9	Very low	36.8	Very low	128 Å²	128	108.7 Å²	108.7	68%	0.684	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	-25.5	-171.4	-62.3	-53.3	0	0	0	114.6
64	V	33.5	Very low	37.4	Very low	72 Å²	72	107.1 Å²	107.1	44%	0.436	58%	0.577	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.5	-20.7	-177.4	-174.6	0	0	0	0	112.2	F50 N66	F50-V64 HydrophobicContact CE1-CG1 4.27Å; V64-N66 VanDerWaalsContact C-N 3.31Å; V64-N66 PolarHBondContact O-N 3.23Å
65	F	28.5	Very low	38.1	Very low	131 Å²	131	100.8 Å²	100.8	58%	0.575	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	5.7	-170.6	-78	-94.8	0	0	0	115.3	F54 K61 L67	F54-F65 HydrophobicContact CZ-CZ 4.19Å; K61-F65 WeakPolarHBondContact O-CD2 3.29Å; K61-F65 WeakPolarHBondContact O-CE2 3.4Å; F65-L67 PolarHBondContact O-N 2.94Å
66	N	31.9	Very low	38.3	Very low	132 Å²	132	94.9 Å²	94.9	71%	0.706	53%	0.533	S	S	*	.			trans	-74.1	42.1	171.9	-93	-65.8	0	0	0	113.8	V64 V68	V64-N66 VanDerWaalsContact C-N 3.31Å; V64-N66 PolarHBondContact O-N 3.23Å; N66-V68 VanDerWaalsContact C-N 3.32Å; N66-V68 PolarHBondContact O-N 3.27Å
67	L	34.7	Very low	39.1	Very low	124 Å²	124	95.8 Å²	95.8	65%	0.649	53%	0.533	S	S	*	.			trans	-88.8	72.6	161.9	-166.8	81.6	0	0	0	108.4	F65 I69	F65-L67 PolarHBondContact O-N 2.94Å; L67-I69 PolarHBondContact O-N 2.95Å
68	V	34.4	Very low	39.8	Very low	88 Å²	88	96.7 Å²	96.7	53%	0.533	53%	0.534	S	S	.	.			trans	-64.3	104.2	-171.8	-169.4	0	0	0	0	111	N66 Q70	N66-V68 VanDerWaalsContact C-N 3.32Å; N66-V68 PolarHBondContact O-N 3.27Å; V68-Q70 HydrophobicContact CB-CG 4.3Å; V68-Q70 HydrophobicContact CG1-CG 3.66Å; V68-Q70 PolarHBondContact O-N 3.37Å; V68-Q70 VanDerWaalsContact O-N 3.11Å
69	I	39.9	Very low	40.5	Very low	46 Å²	46	94 Å²	94	24%	0.236	51%	0.513	C	S	.	.			trans	-76.4	93.1	169	-57	175.7	0	0	0	107	L67 D71 I75 I78 L104	L67-I69 PolarHBondContact O-N 2.95Å; I69-D71 PolarHBondContact O-N 3.4Å; I69-I75 HydrophobicContact CG2-CG1 4.34Å; I69-I78 HydrophobicContact CD1-CD1 3.91Å; I69-L104 HydrophobicContact CB-CD1 4.35Å; I69-L104 WeakPolarHBondContact O-CD2 3.45Å
70	Q	40.7	Very low	41	Very low	172 Å²	172	93.4 Å²	93.4	80%	0.804	50%	0.501	S	S	*	.			trans	-72.8	-25.4	-171.6	-70	-179.6	-36.4	0	0	114	V68	V68-Q70 HydrophobicContact CB-CG 4.3Å; V68-Q70 HydrophobicContact CG1-CG 3.66Å; V68-Q70 PolarHBondContact O-N 3.37Å; V68-Q70 VanDerWaalsContact O-N 3.11Å
71	D	44.4	Very low	41.4	Very low	122 Å²	122	94.5 Å²	94.5	65%	0.652	50%	0.501	S	S	*	.	S	Bend	trans	-122.8	143.8	-173.3	-66.5	-30.3	0	0	0	113.6	I69 G73 G74	I69-D71 PolarHBondContact O-N 3.4Å; D71-G73 PolarHBondContact O-N 2.87Å; D71-G73 VanDerWaalsContact O-N 3.1Å; D71-G74 PolarHBondContact O-N 2.99Å
72	V	43	Very low	42	Very low	64 Å²	64	89.2 Å²	89.2	39%	0.388	48%	0.478	S	S	.	.	H	α-helix	trans	-54.1	-29.8	169.9	-175.7	0	0	0	0	112.2	G74 I75 G76 V106 M112	V72-G74 PolarHBondContact O-N 2.85Å; V72-I75 PolarHBondContact O-N 3.47Å; V72-G76 PolarHBondContact O-N 3Å; V72-V106 HydrophobicContact CG2-CG1 4.12Å; V72-M112 HydrophobicContact CG1-CE 4.01Å
73	G	43.9	Very low	42.4	Very low	35 Å²	35	87.8 Å²	87.8	36%	0.361	46%	0.464	S	S	.	.	H	α-helix	trans	-64.7	-20.9	175.2	0	0	0	0	0	114.7	D71 Q77	D71-G73 PolarHBondContact O-N 2.87Å; D71-G73 VanDerWaalsContact O-N 3.1Å; G73-Q77 WeakPolarHBondContact O-CG 3.26Å; G73-Q77 PolarHBondContact O-N 3.03Å; G73-Q77 PolarHBondContact O-NE2 3.07Å
74	G	47.8	Very low	42.8	Very low	22 Å²	22	85.9 Å²	85.9	23%	0.227	46%	0.457	C	S	.	.	H	α-helix	trans	-72.6	-43.5	172.8	0	0	0	0	0	112.1	D71 V72 G76 Q77 I78	D71-G74 PolarHBondContact O-N 2.99Å; V72-G74 PolarHBondContact O-N 2.85Å; G74-G76 VanDerWaalsContact C-N 3.31Å; G74-G76 PolarHBondContact O-N 3.22Å; G74-Q77 PolarHBondContact O-N 2.72Å; G74-Q77 VanDerWaalsContact O-N 3.15Å; G74-I78 WeakPolarHBondContact O-CG1 3.42Å; G74-I78 PolarHBondContact O-N 3.48Å; G74-I78 VanDerWaalsContact O-N 3.08Å
75	I	50.5	Low	43.1	Very low	16 Å²	16	84.8 Å²	84.8	8%	0.082	45%	0.453	C	S	.	.	H	α-helix	trans	-60.7	-42.6	175.9	-56	176.4	0	0	0	110.2	I69 V72 Q77 I78 L79 L104	I69-I75 HydrophobicContact CG2-CG1 4.34Å; V72-I75 PolarHBondContact O-N 3.47Å; I75-Q77 VanDerWaalsContact C-N 3.32Å; I75-Q77 PolarHBondContact O-N 2.65Å; I75-I78 PolarHBondContact O-N 2.9Å; I75-L79 HydrophobicContact CG2-CD1 4.23Å; I75-L79 WeakPolarHBondContact O-CG 3.3Å; I75-L79 PolarHBondContact O-N 3.03Å; I75-L104 HydrophobicContact CD1-CD1 4.16Å
76	G	45.6	Very low	43.5	Very low	40 Å²	40	86.8 Å²	86.8	41%	0.412	46%	0.463	S	S	.	.	H	α-helix	trans	-59.2	-37.6	175.1	0	0	0	0	0	114.1	V72 G74 D80	V72-G76 PolarHBondContact O-N 3Å; G74-G76 VanDerWaalsContact C-N 3.31Å; G74-G76 PolarHBondContact O-N 3.22Å; G76-D80 WeakPolarHBondContact O-CB 3.38Å; G76-D80 PolarHBondContact O-N 3.25Å
77	Q	51.6	Low	44.3	Very low	142 Å²	142	84.3 Å²	84.3	66%	0.664	45%	0.449	S	S	*	.	H	α-helix	trans	-71.9	-33.6	176.2	-74.2	169.1	66	0	0	112.7	G73 G74 I75 Y81	G73-Q77 WeakPolarHBondContact O-CG 3.26Å; G73-Q77 PolarHBondContact O-N 3.03Å; G73-Q77 PolarHBondContact O-NE2 3.07Å; G74-Q77 PolarHBondContact O-N 2.72Å; G74-Q77 VanDerWaalsContact O-N 3.15Å; I75-Q77 VanDerWaalsContact C-N 3.32Å; I75-Q77 PolarHBondContact O-N 2.65Å; Q77-Y81 VanDerWaalsContact O-CB 3.29Å; Q77-Y81 WeakPolarHBondContact O-CB 3.42Å; Q77-Y81 PolarHBondContact O-N 2.89Å
78	I	48.8	Very low	44.6	Very low	69 Å²	69	84.7 Å²	84.7	35%	0.354	45%	0.452	S	S	.	.	H	α-helix	trans	-65.9	-44.3	174	-66.8	165.7	0	0	0	110.1	I69 G74 I75 Y81 M82	I69-I78 HydrophobicContact CD1-CD1 3.91Å; G74-I78 WeakPolarHBondContact O-CG1 3.42Å; G74-I78 PolarHBondContact O-N 3.48Å; G74-I78 VanDerWaalsContact O-N 3.08Å; I75-I78 PolarHBondContact O-N 2.9Å; I78-Y81 PolarHBondContact O-N 3.47Å; I78-M82 HydrophobicContact CG2-SD 4.13Å; I78-M82 WeakPolarHBondContact O-CG 3.2Å; I78-M82 PolarHBondContact O-N 3.34Å
79	L	49	Very low	45.3	Very low	57 Å²	57	82.9 Å²	82.9	30%	0.298	44%	0.439	S	S	.	.	H	α-helix	trans	-64.1	-43	176.9	-68.7	171.4	0	0	0	112.5	I75 Y81 M82 Y83 L97	I75-L79 HydrophobicContact CG2-CD1 4.23Å; I75-L79 WeakPolarHBondContact O-CG 3.3Å; I75-L79 PolarHBondContact O-N 3.03Å; L79-Y81 VanDerWaalsContact C-N 3.34Å; L79-M82 PolarHBondContact O-N 3.18Å; L79-Y83 WeakPolarHBondContact O-CB 3.24Å; L79-Y83 PolarHBondContact O-N 3.2Å; L79-L97 HydrophobicContact CD2-CD1 3.95Å
80	D	47.2	Very low	45.6	Very low	100 Å²	100	85.1 Å²	85.1	54%	0.535	45%	0.451	S	S	.	.	H	α-helix	trans	-64.5	-37.9	174.7	-170.6	50.1	0	0	0	111.8	G76 Y83 T84	G76-D80 WeakPolarHBondContact O-CB 3.38Å; G76-D80 PolarHBondContact O-N 3.25Å; D80-Y83 PolarHBondContact O-N 3.42Å; D80-T84 WeakPolarHBondContact O-CB 3.41Å; D80-T84 WeakPolarHBondContact O-CG2 3.39Å; D80-T84 PolarHBondContact O-N 3.18Å; D80-T84 PolarHBondContact O-OG1 3.23Å
81	Y	47.3	Very low	45.8	Very low	147 Å²	147	84.2 Å²	84.2	58%	0.576	45%	0.447	S	S	*	.	H	α-helix	trans	-65.9	-40.6	173.6	-175.4	-97.5	0	0	0	112.7	Q77 I78 L79 T84 S85	Q77-Y81 VanDerWaalsContact O-CB 3.29Å; Q77-Y81 WeakPolarHBondContact O-CB 3.42Å; Q77-Y81 PolarHBondContact O-N 2.89Å; I78-Y81 PolarHBondContact O-N 3.47Å; L79-Y81 VanDerWaalsContact C-N 3.34Å; Y81-T84 PolarHBondContact O-OG1 3.45Å; Y81-S85 WeakPolarHBondContact O-CB 3.48Å; Y81-S85 PolarHBondContact O-N 2.98Å; Y81-S85 PolarHBondContact O-OG 3.39Å
82	M	48.1	Very low	45.8	Very low	32 Å²	32	84 Å²	84	16%	0.158	45%	0.446	C	S	.	.	H	α-helix	trans	-65.1	-44.1	175.3	-72.4	174.5	70	0	0	111.6	I78 L79 S85 H86 I87 L97	I78-M82 HydrophobicContact CG2-SD 4.13Å; I78-M82 WeakPolarHBondContact O-CG 3.2Å; I78-M82 PolarHBondContact O-N 3.34Å; L79-M82 PolarHBondContact O-N 3.18Å; M82-S85 PolarHBondContact O-N 3.32Å; M82-H86 PolarHBondContact O-N 3.26Å; M82-I87 PolarHBondContact O-N 3.36Å; M82-L97 HydrophobicContact CE-CD1 4.46Å; M82-L97 HydrophobicContact SD-CD1 4.25Å
83	Y	45.1	Very low	46	Very low	105 Å²	105	84 Å²	84	41%	0.412	44%	0.444	S	S	.	.	H	α-helix	trans	-63.3	-49.4	177.3	-178.1	-121.3	0	0	0	112.3	L79 D80 S85 H86 L205	L79-Y83 WeakPolarHBondContact O-CB 3.24Å; L79-Y83 PolarHBondContact O-N 3.2Å; D80-Y83 PolarHBondContact O-N 3.42Å; Y83-S85 PolarHBondContact O-N 2.68Å; Y83-H86 PolarHBondContact O-N 3.03Å; Y83-L205 HydrophobicContact CD2-CB 3.73Å; Y83-L205 HydrophobicContact CD2-CD2 3.64Å; Y83-L205 HydrophobicContact CD2-CG 4.26Å; Y83-L205 HydrophobicContact CE2-CB 3.5Å; Y83-L205 VanDerWaalsContact CE2-CB 3.5Å; Y83-L205 HydrophobicContact CE2-CD2 4.19Å; Y83-L205 HydrophobicContact CE2-CG 4.47Å; Y83-L205 HydrophobicContact CG-CD2 3.93Å
84	T	42	Very low	46.4	Very low	87 Å²	87	83.7 Å²	83.7	53%	0.534	44%	0.435	S	S	.	.	H	α-helix	trans	-70.3	-17.1	178.9	54.4	0	0	0	0	113.9	D80 Y81	D80-T84 WeakPolarHBondContact O-CB 3.41Å; D80-T84 WeakPolarHBondContact O-CG2 3.39Å; D80-T84 PolarHBondContact O-N 3.18Å; D80-T84 PolarHBondContact O-OG1 3.23Å; Y81-T84 PolarHBondContact O-OG1 3.45Å
85	S	40.2	Very low	46.5	Very low	50 Å²	50	87.5 Å²	87.5	35%	0.35	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-4.2	175.6	-60.9	0	0	0	0	114.2	Y81 M82 Y83 I87	Y81-S85 WeakPolarHBondContact O-CB 3.48Å; Y81-S85 PolarHBondContact O-N 2.98Å; Y81-S85 PolarHBondContact O-OG 3.39Å; M82-S85 PolarHBondContact O-N 3.32Å; Y83-S85 PolarHBondContact O-N 2.68Å; S85-I87 VanDerWaalsContact C-N 3.29Å; S85-I87 PolarHBondContact O-N 3.19Å
86	H	38.4	Very low	46.5	Very low	172 Å²	172	89 Å²	89	80%	0.796	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	45	-173.3	-67	-81.9	0	0	0	113.2	M82 Y83	M82-H86 PolarHBondContact O-N 3.26Å; Y83-H86 PolarHBondContact O-N 3.03Å
87	I	48.7	Very low	46.9	Very low	80 Å²	80	88.9 Å²	88.9	41%	0.41	45%	0.451	S	S	.	.			trans	-83.1	126.2	174.2	-62.6	170.9	0	0	0	108.6	M82 S85 I89	M82-I87 PolarHBondContact O-N 3.36Å; S85-I87 VanDerWaalsContact C-N 3.29Å; S85-I87 PolarHBondContact O-N 3.19Å; I87-I89 PolarHBondContact O-N 3.26Å
88	D	39.7	Very low	47	Very low	132 Å²	132	83.7 Å²	83.7	71%	0.706	43%	0.427	S	S	*	.			trans	-62.8	129.8	178.1	-68.4	-58.7	0	0	0	111.8	N90 N93	D88-N90 VanDerWaalsContact C-N 3.34Å; D88-N90 PolarHBondContact O-N 3.4Å; D88-N93 PolarHBondContact O-ND2 3.42Å
89	I	50.1	Low	47.1	Very low	51 Å²	51	83.9 Å²	83.9	26%	0.262	43%	0.429	S	S	.	.			trans	-87.9	78	-174.2	-55.3	179.9	0	0	0	108.8	I87 V94 L117 L205	I87-I89 PolarHBondContact O-N 3.26Å; I89-V94 HydrophobicContact CG2-CG2 3.45Å; I89-V94 VanDerWaalsContact CG2-CG2 3.45Å; I89-L117 HydrophobicContact CD1-CD2 4.28Å; I89-L117 HydrophobicContact CG2-CD1 4.47Å; I89-L205 HydrophobicContact CD1-CD1 3.62Å
90	N	45.8	Very low	47.2	Very low	93 Å²	93	85.1 Å²	85.1	50%	0.497	44%	0.435	S	S	.	.			trans	-64.8	151	169.2	-65.2	1.3	0	0	0	110.7	D88 D92 N93 V94	D88-N90 VanDerWaalsContact C-N 3.34Å; D88-N90 PolarHBondContact O-N 3.4Å; N90-D92 PolarHBondContact O-N 3.06Å; N90-N93 WeakPolarHBondContact O-CB 3.42Å; N90-N93 PolarHBondContact O-N 3.36Å; N90-V94 PolarHBondContact O-N 2.77Å
91	Q	44.9	Very low	47.2	Very low	152 Å²	152	80.5 Å²	80.5	71%	0.71	41%	0.411	S	S	*	.	H	α-helix	trans	-58.9	-35.5	-177.2	-170.4	166.3	-13.9	0	0	112.6	N93 V94 Q95	Q91-N93 VanDerWaalsContact C-N 3.32Å; Q91-N93 PolarHBondContact O-N 3.31Å; Q91-V94 WeakPolarHBondContact O-CB 3.38Å; Q91-V94 PolarHBondContact O-N 2.96Å; Q91-V94 VanDerWaalsContact O-N 3.15Å; Q91-Q95 PolarHBondContact O-N 3.44Å
92	D	43.7	Very low	47.3	Very low	119 Å²	119	80.7 Å²	80.7	64%	0.636	42%	0.418	S	S	*	.	H	α-helix	trans	-63.7	-35.9	177.1	-38.7	-74.6	0	0	0	112.5	N90 V94 Q95 A96	N90-D92 PolarHBondContact O-N 3.06Å; D92-V94 VanDerWaalsContact C-N 3.3Å; D92-V94 PolarHBondContact O-N 3.03Å; D92-Q95 PolarHBondContact O-N 3.05Å; D92-A96 WeakPolarHBondContact O-CB 3.12Å; D92-A96 PolarHBondContact O-N 2.94Å
93	N	48	Very low	47.3	Very low	64 Å²	64	84 Å²	84	34%	0.342	44%	0.443	S	S	.	.	H	α-helix	trans	-69.1	-31.9	176.8	-65.8	-28.8	0	0	0	111.3	D88 N90 Q91 L97	D88-N93 PolarHBondContact O-ND2 3.42Å; N90-N93 WeakPolarHBondContact O-CB 3.42Å; N90-N93 PolarHBondContact O-N 3.36Å; Q91-N93 VanDerWaalsContact C-N 3.32Å; Q91-N93 PolarHBondContact O-N 3.31Å; N93-L97 WeakPolarHBondContact O-CD1 3.19Å; N93-L97 WeakPolarHBondContact O-CG 3.21Å; N93-L97 PolarHBondContact O-N 3.36Å
94	V	51.9	Low	47.3	Very low	27 Å²	27	81.8 Å²	81.8	16%	0.164	44%	0.438	C	S	.	.	H	α-helix	trans	-73.1	-43.5	174.7	-176.4	0	0	0	0	110.3	I89 N90 Q91 D92 L97 L98 L117	I89-V94 HydrophobicContact CG2-CG2 3.45Å; I89-V94 VanDerWaalsContact CG2-CG2 3.45Å; N90-V94 PolarHBondContact O-N 2.77Å; Q91-V94 WeakPolarHBondContact O-CB 3.38Å; Q91-V94 PolarHBondContact O-N 2.96Å; Q91-V94 VanDerWaalsContact O-N 3.15Å; D92-V94 VanDerWaalsContact C-N 3.3Å; D92-V94 PolarHBondContact O-N 3.03Å; V94-L97 PolarHBondContact O-N 3.34Å; V94-L98 HydrophobicContact CG1-CD1 4.29Å; V94-L98 WeakPolarHBondContact O-CG 3.47Å; V94-L98 PolarHBondContact O-N 3.25Å; V94-L117 HydrophobicContact CG1-CD1 4.08Å; V94-L117 HydrophobicContact CG2-CD1 3.87Å
95	Q	49.2	Very low	47.5	Very low	103 Å²	103	85.9 Å²	85.9	48%	0.481	45%	0.451	S	S	.	.	H	α-helix	trans	-63	-46	177.7	-168.7	59.7	48.8	0	0	111.5	Q91 D92 L97 L98 D99	Q91-Q95 PolarHBondContact O-N 3.44Å; D92-Q95 PolarHBondContact O-N 3.05Å; Q95-L97 VanDerWaalsContact C-N 3.25Å; Q95-L97 PolarHBondContact O-N 3.14Å; Q95-L98 WeakPolarHBondContact O-CA 3.48Å; Q95-L98 WeakPolarHBondContact O-CB 3.47Å; Q95-L98 PolarHBondContact O-N 2.92Å; Q95-D99 PolarHBondContact NE2-OD1 3.25Å; Q95-D99 VanDerWaalsContact O-CG 3.25Å; Q95-D99 PolarHBondContact O-N 3.5Å
96	A	51.7	Low	48	Very low	47 Å²	47	85.7 Å²	85.7	39%	0.388	45%	0.448	S	S	.	.	H	α-helix	trans	-58.7	-35.1	176.1	0	0	0	0	0	113.1	D92 I100	D92-A96 WeakPolarHBondContact O-CB 3.12Å; D92-A96 PolarHBondContact O-N 2.94Å; A96-I100 WeakPolarHBondContact O-CB 3.45Å; A96-I100 WeakPolarHBondContact O-CD1 3.14Å; A96-I100 WeakPolarHBondContact O-CG1 3.22Å; A96-I100 PolarHBondContact O-N 3.47Å; A96-I100 VanDerWaalsContact O-N 3.13Å
97	L	52.6	Low	48.2	Very low	38 Å²	38	82.5 Å²	82.5	20%	0.199	44%	0.443	C	S	.	.	H	α-helix	trans	-70.2	-35.7	174	-80.1	166.4	0	0	0	112.7	L79 M82 N93 V94 Q95 A101	L79-L97 HydrophobicContact CD2-CD1 3.95Å; M82-L97 HydrophobicContact CE-CD1 4.46Å; M82-L97 HydrophobicContact SD-CD1 4.25Å; N93-L97 WeakPolarHBondContact O-CD1 3.19Å; N93-L97 WeakPolarHBondContact O-CG 3.21Å; N93-L97 PolarHBondContact O-N 3.36Å; V94-L97 PolarHBondContact O-N 3.34Å; Q95-L97 VanDerWaalsContact C-N 3.25Å; Q95-L97 PolarHBondContact O-N 3.14Å; L97-A101 VanDerWaalsContact O-CB 3.32Å; L97-A101 WeakPolarHBondContact O-CB 3.29Å; L97-A101 PolarHBondContact O-N 3.21Å; L97-A101 VanDerWaalsContact O-N 3.08Å
98	L	54.3	Low	48.4	Very low	32 Å²	32	84.6 Å²	84.6	17%	0.168	46%	0.455	C	S	.	.	H	α-helix	trans	-68.9	-43.8	174.5	-70.6	169.7	0	0	0	111.5	V94 Q95 I100 A101 Q102 Q110 C113	V94-L98 HydrophobicContact CG1-CD1 4.29Å; V94-L98 WeakPolarHBondContact O-CG 3.47Å; V94-L98 PolarHBondContact O-N 3.25Å; Q95-L98 WeakPolarHBondContact O-CA 3.48Å; Q95-L98 WeakPolarHBondContact O-CB 3.47Å; Q95-L98 PolarHBondContact O-N 2.92Å; L98-I100 PolarHBondContact O-N 3.01Å; L98-A101 WeakPolarHBondContact O-CB 3.29Å; L98-A101 PolarHBondContact O-N 2.86Å; L98-A101 VanDerWaalsContact O-N 3.14Å; L98-Q102 WeakPolarHBondContact O-CB 3.46Å; L98-Q102 PolarHBondContact O-N 3.06Å; L98-Q110 HydrophobicContact CD2-CB 4.31Å; L98-Q110 HydrophobicContact CD2-CG 4.28Å; L98-C113 HydrophobicContact CD2-CB 4.09Å
99	D	50.9	Low	49	Very low	74 Å²	74	78.8 Å²	78.8	40%	0.396	42%	0.424	S	S	.	.	H	α-helix	trans	-62.1	-42.4	178.4	-62.3	-8.3	0	0	0	111.5	Q95 Q102 S103	Q95-D99 PolarHBondContact NE2-OD1 3.25Å; Q95-D99 VanDerWaalsContact O-CG 3.25Å; Q95-D99 PolarHBondContact O-N 3.5Å; D99-Q102 PolarHBondContact O-N 3.24Å; D99-S103 WeakPolarHBondContact O-CB 3.47Å; D99-S103 PolarHBondContact O-N 3.03Å; D99-S103 PolarHBondContact O-OG 3.34Å
100	I	50.9	Low	48.9	Very low	82 Å²	82	82.5 Å²	82.5	42%	0.421	44%	0.44	S	S	.	.	H	α-helix	trans	-62.6	-43.6	173.3	-70.8	166	0	0	0	110.7	A96 L98 S103 L104	A96-I100 WeakPolarHBondContact O-CB 3.45Å; A96-I100 WeakPolarHBondContact O-CD1 3.14Å; A96-I100 WeakPolarHBondContact O-CG1 3.22Å; A96-I100 PolarHBondContact O-N 3.47Å; A96-I100 VanDerWaalsContact O-N 3.13Å; L98-I100 PolarHBondContact O-N 3.01Å; I100-S103 WeakPolarHBondContact O-CB 3.41Å; I100-S103 PolarHBondContact O-N 3.28Å; I100-L104 HydrophobicContact CG2-CD1 4.09Å; I100-L104 WeakPolarHBondContact O-CG 3.39Å; I100-L104 PolarHBondContact O-N 3.44Å; I100-L104 VanDerWaalsContact O-N 3.08Å
101	A	48.3	Very low	49.2	Very low	4 Å²	4	81.2 Å²	81.2	3%	0.033	44%	0.438	C	S	.	.	H	α-helix	trans	-66.5	-37.8	179.3	0	0	0	0	0	113.3	L97 L98 L104 Q105 V109	L97-A101 VanDerWaalsContact O-CB 3.32Å; L97-A101 WeakPolarHBondContact O-CB 3.29Å; L97-A101 PolarHBondContact O-N 3.21Å; L97-A101 VanDerWaalsContact O-N 3.08Å; L98-A101 WeakPolarHBondContact O-CB 3.29Å; L98-A101 PolarHBondContact O-N 2.86Å; L98-A101 VanDerWaalsContact O-N 3.14Å; A101-L104 PolarHBondContact O-N 3.08Å; A101-Q105 PolarHBondContact O-N 3.03Å; A101-V109 HydrophobicContact CB-CB 3.7Å; A101-V109 HydrophobicContact CB-CG1 3.43Å; A101-V109 VanDerWaalsContact CB-CG1 3.43Å; A101-V109 HydrophobicContact CB-CG2 3.95Å
102	Q	49.5	Very low	49.6	Very low	151 Å²	151	77.4 Å²	77.4	71%	0.706	42%	0.421	S	S	*	.	H	α-helix	trans	-67.7	-38.7	175.8	-161.3	168.4	20.5	0	0	110.8	L98 D99 L104 Q105	L98-Q102 WeakPolarHBondContact O-CB 3.46Å; L98-Q102 PolarHBondContact O-N 3.06Å; D99-Q102 PolarHBondContact O-N 3.24Å; Q102-L104 VanDerWaalsContact C-N 3.27Å; Q102-L104 PolarHBondContact O-N 3.25Å; Q102-Q105 PolarHBondContact O-N 2.9Å; Q102-Q105 VanDerWaalsContact O-N 3.1Å
103	S	47	Very low	49.9	Very low	100 Å²	100	72.7 Å²	72.7	70%	0.699	40%	0.398	S	S	*	.	H	α-helix	trans	-63.4	-29.7	172.5	-56.7	0	0	0	0	113.3	D99 I100 Q105	D99-S103 WeakPolarHBondContact O-CB 3.47Å; D99-S103 PolarHBondContact O-N 3.03Å; D99-S103 PolarHBondContact O-OG 3.34Å; I100-S103 WeakPolarHBondContact O-CB 3.41Å; I100-S103 PolarHBondContact O-N 3.28Å; S103-Q105 VanDerWaalsContact C-N 3.3Å
104	L	46.7	Very low	50	Low	59 Å²	59	74.7 Å²	74.7	31%	0.309	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	2.3	175.3	-68.5	168.9	0	0	0	113.7	I69 I75 I100 A101 Q102 V106	I69-L104 HydrophobicContact CB-CD1 4.35Å; I69-L104 WeakPolarHBondContact O-CD2 3.45Å; I75-L104 HydrophobicContact CD1-CD1 4.16Å; I100-L104 HydrophobicContact CG2-CD1 4.09Å; I100-L104 WeakPolarHBondContact O-CG 3.39Å; I100-L104 PolarHBondContact O-N 3.44Å; I100-L104 VanDerWaalsContact O-N 3.08Å; A101-L104 PolarHBondContact O-N 3.08Å; Q102-L104 VanDerWaalsContact C-N 3.27Å; Q102-L104 PolarHBondContact O-N 3.25Å; L104-V106 HydrophobicContact CB-CG2 4.03Å; L104-V106 PolarHBondContact O-N 3.05Å; L104-V106 VanDerWaalsContact O-N 3.09Å
105	Q	45.6	Very low	50	Low	173 Å²	173	78.8 Å²	78.8	81%	0.808	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	23.7	178.9	-54.2	-175.3	17.5	0	0	115.1	A101 Q102 S103 P107	A101-Q105 PolarHBondContact O-N 3.03Å; Q102-Q105 PolarHBondContact O-N 2.9Å; Q102-Q105 VanDerWaalsContact O-N 3.1Å; S103-Q105 VanDerWaalsContact C-N 3.3Å; Q105-P107 WeakPolarHBondContact O-CD 3.48Å
106	V	49.9	Very low	49.7	Very low	47 Å²	47	79 Å²	79	29%	0.285	43%	0.433	S	S	.	.			trans	-82.4	111.5	-177.2	-176.3	0	0	0	0	110	V72 L104 V109	V72-V106 HydrophobicContact CG2-CG1 4.12Å; L104-V106 HydrophobicContact CB-CG2 4.03Å; L104-V106 PolarHBondContact O-N 3.05Å; L104-V106 VanDerWaalsContact O-N 3.09Å; V106-V109 HydrophobicContact CB-CG2 3.62Å; V106-V109 HydrophobicContact CG1-CG2 3.53Å
107	P	43.5	Very low	49.4	Very low	104 Å²	104	78.1 Å²	78.1	68%	0.675	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	149.2	175.2	28.2	-34.6	0	0	0	110.6	Q105 V109	Q105-P107 WeakPolarHBondContact O-CD 3.48Å; P107-V109 PolarHBondContact O-N 3.32Å
108	N	52	Low	48.7	Very low	125 Å²	125	84.8 Å²	84.8	67%	0.668	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.5	9.6	178.6	-52	-57.4	0	0	0	117.5	Q110 S111 M112	N108-Q110 VanDerWaalsContact C-N 3.3Å; N108-Q110 PolarHBondContact O-N 2.92Å; N108-S111 WeakPolarHBondContact O-CA 3.39Å; N108-S111 VanDerWaalsContact O-CB 3.25Å; N108-S111 WeakPolarHBondContact O-CB 3.45Å; N108-S111 PolarHBondContact O-N 2.76Å; N108-M112 PolarHBondContact O-N 3.21Å
109	V	51.7	Low	48.1	Very low	9 Å²	9	87.8 Å²	87.8	6%	0.055	47%	0.47	C	S	.	.	H	α-helix	trans	-64.4	-35.8	173.2	-176.7	0	0	0	0	112.1	A101 V106 P107 S111 M112 C113	A101-V109 HydrophobicContact CB-CB 3.7Å; A101-V109 HydrophobicContact CB-CG1 3.43Å; A101-V109 VanDerWaalsContact CB-CG1 3.43Å; A101-V109 HydrophobicContact CB-CG2 3.95Å; V106-V109 HydrophobicContact CB-CG2 3.62Å; V106-V109 HydrophobicContact CG1-CG2 3.53Å; P107-V109 PolarHBondContact O-N 3.32Å; V109-S111 PolarHBondContact O-N 2.88Å; V109-M112 HydrophobicContact CB-CE 4.31Å; V109-M112 HydrophobicContact CG1-CE 4.11Å; V109-M112 HydrophobicContact CG2-CE 3.9Å; V109-M112 WeakPolarHBondContact O-CA 3.25Å; V109-M112 WeakPolarHBondContact O-CB 3.22Å; V109-M112 PolarHBondContact O-N 2.83Å; V109-C113 PolarHBondContact O-N 2.92Å; V109-C113 PolarHBondContact O-SG 2.86Å
110	Q	48.3	Very low	47.2	Very low	130 Å²	130	88.7 Å²	88.7	61%	0.607	48%	0.482	S	S	*	.	H	α-helix	trans	-61	-31.2	171.5	-162.3	174.2	15.7	0	0	112.1	L98 N108 N114	L98-Q110 HydrophobicContact CD2-CB 4.31Å; L98-Q110 HydrophobicContact CD2-CG 4.28Å; N108-Q110 VanDerWaalsContact C-N 3.3Å; N108-Q110 PolarHBondContact O-N 2.92Å; Q110-N114 VanDerWaalsContact O-CB 3.29Å; Q110-N114 WeakPolarHBondContact O-CB 3.29Å; Q110-N114 PolarHBondContact O-N 2.67Å; Q110-N114 PolarHBondContact O-ND2 2.76Å; Q110-N114 PolarHBondContact O-OD1 3.25Å
111	S	53.3	Low	46.3	Very low	65 Å²	65	90.2 Å²	90.2	46%	0.455	50%	0.497	S	S	.	.	H	α-helix	trans	-69.6	-40.7	171.5	-170.9	0	0	0	0	112	N108 V109 N114 T115	N108-S111 WeakPolarHBondContact O-CA 3.39Å; N108-S111 VanDerWaalsContact O-CB 3.25Å; N108-S111 WeakPolarHBondContact O-CB 3.45Å; N108-S111 PolarHBondContact O-N 2.76Å; V109-S111 PolarHBondContact O-N 2.88Å; S111-N114 PolarHBondContact O-N 3.31Å; S111-T115 VanDerWaalsContact O-CB 3.3Å; S111-T115 WeakPolarHBondContact O-CB 3.33Å; S111-T115 PolarHBondContact O-N 3.43Å; S111-T115 PolarHBondContact O-OG1 2.94Å
112	M	52.7	Low	45.7	Very low	72 Å²	72	95 Å²	95	36%	0.355	53%	0.528	S	S	.	.	H	α-helix	trans	-60.1	-50.4	170.5	-71.9	-161.4	-66.8	0	0	111.6	V72 N108 V109 N114 T115 F116	V72-M112 HydrophobicContact CG1-CE 4.01Å; N108-M112 PolarHBondContact O-N 3.21Å; V109-M112 HydrophobicContact CB-CE 4.31Å; V109-M112 HydrophobicContact CG1-CE 4.11Å; V109-M112 HydrophobicContact CG2-CE 3.9Å; V109-M112 WeakPolarHBondContact O-CA 3.25Å; V109-M112 WeakPolarHBondContact O-CB 3.22Å; V109-M112 PolarHBondContact O-N 2.83Å; M112-N114 VanDerWaalsContact C-N 3.35Å; M112-N114 PolarHBondContact O-N 2.85Å; M112-T115 WeakPolarHBondContact O-CA 3.19Å; M112-T115 WeakPolarHBondContact O-CB 3.49Å; M112-T115 PolarHBondContact O-N 3.05Å; M112-F116 VanDerWaalsContact O-CD2 3.23Å; M112-F116 WeakPolarHBondContact O-CD2 3.36Å; M112-F116 PolarHBondContact O-N 3.3Å
113	C	49.8	Very low	44.8	Very low	20 Å²	20	93.7 Å²	93.7	14%	0.135	53%	0.532	C	S	.	.	H	α-helix	trans	-57.1	-46.5	178.5	-68.4	0	0	0	0	111.6	L98 V109 T115 F116 L117	L98-C113 HydrophobicContact CD2-CB 4.09Å; V109-C113 PolarHBondContact O-N 2.92Å; V109-C113 PolarHBondContact O-SG 2.86Å; C113-T115 VanDerWaalsContact C-N 3.27Å; C113-T115 PolarHBondContact O-N 3.46Å; C113-F116 PolarHBondContact O-N 3.26Å; C113-L117 WeakPolarHBondContact O-CB 3.41Å; C113-L117 PolarHBondContact O-N 3.29Å
114	N	50.7	Low	44.1	Very low	106 Å²	106	94.9 Å²	94.9	57%	0.567	54%	0.535	S	S	*	.	H	α-helix	trans	-68.5	-22.5	176.4	-67.2	-8.4	0	0	0	113.5	Q110 S111 M112	Q110-N114 VanDerWaalsContact O-CB 3.29Å; Q110-N114 WeakPolarHBondContact O-CB 3.29Å; Q110-N114 PolarHBondContact O-N 2.67Å; Q110-N114 PolarHBondContact O-ND2 2.76Å; Q110-N114 PolarHBondContact O-OD1 3.25Å; S111-N114 PolarHBondContact O-N 3.31Å; M112-N114 VanDerWaalsContact C-N 3.35Å; M112-N114 PolarHBondContact O-N 2.85Å
115	T	51	Low	43.2	Very low	114 Å²	114	101 Å²	101	70%	0.699	56%	0.562	S	S	*	*	H	α-helix	trans	-79.2	-33.1	173.3	-58.6	0	0	0	0	111.8	S111 M112 C113	S111-T115 VanDerWaalsContact O-CB 3.3Å; S111-T115 WeakPolarHBondContact O-CB 3.33Å; S111-T115 PolarHBondContact O-N 3.43Å; S111-T115 PolarHBondContact O-OG1 2.94Å; M112-T115 WeakPolarHBondContact O-CA 3.19Å; M112-T115 WeakPolarHBondContact O-CB 3.49Å; M112-T115 PolarHBondContact O-N 3.05Å; C113-T115 VanDerWaalsContact C-N 3.27Å; C113-T115 PolarHBondContact O-N 3.46Å
116	F	43.7	Very low	42.4	Very low	107 Å²	107	100.6 Å²	100.6	47%	0.469	56%	0.562	S	S	.	*	H	α-helix	trans	-83.5	-28.6	175	-78	-69.7	0	0	0	113.7	M112 C113	M112-F116 VanDerWaalsContact O-CD2 3.23Å; M112-F116 WeakPolarHBondContact O-CD2 3.36Å; M112-F116 PolarHBondContact O-N 3.3Å; C113-F116 PolarHBondContact O-N 3.26Å
117	L	45.1	Very low	41.4	Very low	28 Å²	28	102.6 Å²	102.6	15%	0.147	58%	0.576	C	S	.	*			trans	-126.9	97.9	-176.2	-60.7	172	0	0	0	109.8	I89 V94 C113 Y203 L205	I89-L117 HydrophobicContact CD1-CD2 4.28Å; I89-L117 HydrophobicContact CG2-CD1 4.47Å; V94-L117 HydrophobicContact CG1-CD1 4.08Å; V94-L117 HydrophobicContact CG2-CD1 3.87Å; C113-L117 WeakPolarHBondContact O-CB 3.41Å; C113-L117 PolarHBondContact O-N 3.29Å; L117-Y203 HydrophobicContact CB-CD1 4.38Å; L117-Y203 HydrophobicContact CD2-CD1 4.22Å; L117-Y203 HydrophobicContact CD2-CG 4.19Å; L117-L205 HydrophobicContact CD2-CD1 3.76Å
118	K	38.4	Very low	40.6	Very low	179 Å²	179	103.9 Å²	103.9	78%	0.778	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-98.9	129.3	171.3	-160.4	175.9	-172.9	-180	0	109.9
119	P	41.4	Very low	39.5	Very low	94 Å²	94	107.5 Å²	107.5	61%	0.61	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-59.7	144.8	170	-22.6	33.5	0	0	0	111.4
120	C	31.2	Very low	38.3	Very low	94 Å²	94	110.7 Å²	110.7	64%	0.635	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-70	139.4	163.6	-69.8	0	0	0	0	109.3
121	P	33.7	Very low	37.3	Very low	113 Å²	113	112.1 Å²	112.1	73%	0.734	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-65.1	154.1	164.4	30.7	-34.2	0	0	0	109.8
122	P	35.7	Very low	36.4	Very low	105 Å²	105	114.8 Å²	114.8	68%	0.682	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-62	157.1	173.3	28.3	-35.4	0	0	0	111.1	V124	P122-V124 PolarHBondContact O-N 2.82Å
123	P	30.1	Very low	35.1	Very low	123 Å²	123	114.6 Å²	114.6	80%	0.799	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-63	121.7	174.1	27.5	-33.7	0	0	0	109.9	E125	P123-E125 PolarHBondContact O-N 3.2Å
124	V	31.5	Very low	34.1	Very low	126 Å²	126	121.5 Å²	121.5	76%	0.764	70%	0.697	S	S	*	*			trans	-80.2	113	169.7	177.9	0	0	0	0	107.7	P122 M126	P122-V124 PolarHBondContact O-N 2.82Å; V124-M126 PolarHBondContact O-N 3.24Å
125	E	29.1	Very low	33.1	Very low	186 Å²	186	123.3 Å²	123.3	87%	0.869	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-66	128.5	167.2	-64.7	-172.1	148.6	0	0	109.3	P123	P123-E125 PolarHBondContact O-N 3.2Å
126	M	27.3	Very low	31.9	Very low	165 Å²	165	122.7 Å²	122.7	81%	0.813	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-97.2	124.3	171.7	-68.9	-125.8	67.9	0	0	108.9	V124	V124-M126 PolarHBondContact O-N 3.24Å
127	P	29.1	Very low	31.3	Very low	90 Å²	90	122.3 Å²	122.3	58%	0.584	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-70.7	151.2	179.5	29.8	-35.1	0	0	0	111.5	F129	P127-F129 PolarHBondContact O-N 3.06Å
128	P	27.8	Very low	30.6	Very low	130 Å²	130	127.9 Å²	127.9	84%	0.844	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-74.8	118.2	-178.9	29.9	-34	0	0	0	111.6
129	F	27.9	Very low	30.1	Very low	201 Å²	201	128.2 Å²	128.2	88%	0.882	75%	0.747	S	S	*	*			trans	-85.9	105.9	165	-93.4	-89.7	0	0	0	110.4	P127	P127-F129 PolarHBondContact O-N 3.06Å
130	A	26.2	Very low	29.4	Very low	76 Å²	76	131.2 Å²	131.2	63%	0.628	76%	0.757	S	S	*	*			trans	-74.8	149.9	148.6	0	0	0	0	0	107.6
131	L	27.7	Very low	29.2	Very low	160 Å²	160	133.1 Å²	133.1	84%	0.838	77%	0.77	S	S	*	*				-171.8	-178.8	57.5	-79.7	166.3	0	0	0	107.8
132	P	34.3	Very low	28.9	Very low	121 Å²	121	135.3 Å²	135.3	79%	0.786	78%	0.775	S	S	*	*			cis	-115.7	168.9	-27.6	29.7	-12.3	0	0	0	111.2
133	G	26	Very low	28.5	Very low	68 Å²	68	138.8 Å²	138.8	70%	0.701	79%	0.787	S	S	*	*			trans	-107.8	168.3	-178.5	0	0	0	0	0	114.9
134	M	29.2	Very low	28.2	Very low	165 Å²	165	136.3 Å²	136.3	81%	0.813	78%	0.783	S	S	*	*			trans	-160.3	117.4	151	-99.4	-67.1	104.3	0	0	109.1
135	L	27.8	Very low	28.1	Very low	144 Å²	144	136.4 Å²	136.4	75%	0.754	79%	0.79	S	S	*	*			trans	27.3	138.6	143.3	-50.8	179.6	0	0	0	119.3
136	S	27.2	Very low	27.9	Very low	101 Å²	101	134.7 Å²	134.7	71%	0.706	79%	0.787	S	S	*	*			cis	-171.2	173.7	5.1	-99.1	0	0	0	0	107.3
137	S	29.7	Very low	27.9	Very low	99 Å²	99	134.1 Å²	134.1	69%	0.692	79%	0.786	S	S	*	*			cis	-156.1	172.3	0.8	30.9	0	0	0	0	109.8
138	E	30.8	Very low	28.5	Very low	146 Å²	146	134.1 Å²	134.1	68%	0.682	79%	0.786	S	S	*	*			trans	-62.5	160.4	-179.2	53.9	-96	70.1	0	0	117.1
139	H	28.5	Very low	28.5	Very low	186 Å²	186	136 Å²	136	86%	0.861	78%	0.783	S	S	*	*				-170.5	114.8	114.6	-98.1	-62.8	0	0	0	112.5
140	D	26.1	Very low	28.4	Very low	156 Å²	156	132.5 Å²	132.5	83%	0.834	77%	0.774	S	S	*	*			trans	-84.2	145.5	160.2	-87.8	-58.2	0	0	0	110.5
141	C	27.2	Very low	28.5	Very low	134 Å²	134	134.6 Å²	134.6	91%	0.905	78%	0.778	S	S	*	*				-172.3	168.5	127.6	-102.5	0	0	0	0	114.6
142	L	28.7	Very low	28.3	Very low	159 Å²	159	133.8 Å²	133.8	83%	0.832	78%	0.775	S	S	*	*			trans	-105.7	164.4	-170.6	-72.3	166.3	0	0	0	113.1
143	L	26.8	Very low	28	Very low	179 Å²	179	134.7 Å²	134.7	94%	0.937	77%	0.772	S	S	*	*			trans	68.2	143	165.4	-64	161.1	0	0	0	115.7
144	G	23.9	Very low	28.1	Very low	70 Å²	70	140 Å²	140	72%	0.722	78%	0.778	S	S	*	*			trans	-122.8	165	178	0	0	0	0	0	112.2
145	S	29.1	Very low	27.8	Very low	129 Å²	129	137.4 Å²	137.4	90%	0.902	78%	0.775	S	S	*	*			trans	-155.3	169	159.7	-81.8	0	0	0	0	108.9
146	N	23.9	Very low	28.5	Very low	150 Å²	150	136.2 Å²	136.2	80%	0.802	78%	0.776	S	S	*	*			trans	-112.9	157.5	-164.9	-101.8	-72.3	0	0	0	112.9
147	L	26.9	Very low	29.4	Very low	152 Å²	152	136.9 Å²	136.9	80%	0.796	78%	0.778	S	S	*	*			trans	67.8	163.1	165.1	-89	77.9	0	0	0	116.8
148	P	42.2	Very low	29	Very low	90 Å²	90	139.2 Å²	139.2	58%	0.584	78%	0.783	S	S	*	*			cis	-141.3	176.3	-33.9	39.3	-24	0	0	0	114.5
149	H	27.9	Very low	29.4	Very low	171 Å²	171	137.2 Å²	137.2	79%	0.792	78%	0.782	S	S	*	*			trans	62.1	154.6	151	-73.3	-54.2	0	0	0	118.3
150	D	25.2	Very low	29.2	Very low	127 Å²	127	137.2 Å²	137.2	68%	0.679	78%	0.783	S	S	*	*			cis	-161.7	179.1	-28.8	-144.2	-52.3	0	0	0	108
151	V	29.1	Very low	29.1	Very low	120 Å²	120	140.8 Å²	140.8	73%	0.727	79%	0.785	S	S	*	*			trans	61.3	89.1	161.1	-177.4	0	0	0	0	118
152	D	24.6	Very low	29	Very low	142 Å²	142	139.5 Å²	139.5	76%	0.759	78%	0.777	S	S	*	*				73.4	154.4	114.2	-118.4	-32.2	0	0	0	125.3
153	L	27.9	Very low	28.9	Very low	140 Å²	140	135.3 Å²	135.3	73%	0.733	77%	0.772	S	S	*	*			trans	66.8	107.1	157	-62.4	171.2	0	0	0	123.3
154	H	26.6	Very low	29	Very low	179 Å²	179	136 Å²	136	83%	0.829	76%	0.764	S	S	*	*			trans	62	110.5	132.3	-93	-79.2	0	0	0	123.5
155	C	24.3	Very low	29.2	Very low	111 Å²	111	142 Å²	142	75%	0.75	77%	0.766	S	S	*	*			trans	-74	175.4	147.2	-56.7	0	0	0	0	112.1
156	P	42.3	Very low	29.1	Very low	119 Å²	119	139.2 Å²	139.2	77%	0.773	76%	0.758	S	S	*	*			cis	-126.6	-152.9	-16.4	43.3	-26	0	0	0	110.2
157	P	44.8	Very low	29.2	Very low	115 Å²	115	138 Å²	138	75%	0.747	75%	0.752	S	S	*	*			cis	-132.8	-178.1	-12.5	41.9	-23.9	0	0	0	116.6
158	D	22.6	Very low	29.4	Very low	148 Å²	148	137.3 Å²	137.3	79%	0.791	75%	0.746	S	S	*	*			trans	-26.3	170.8	153.7	-84.3	-63.2	0	0	0	120.6
159	P	38.2	Very low	28.6	Very low	104 Å²	104	138.4 Å²	138.4	68%	0.675	75%	0.747	S	S	*	*			cis	-140.2	-167.7	-15.3	31.8	-8.6	0	0	0	115.4
160	Q	25.6	Very low	28.6	Very low	187 Å²	187	137.8 Å²	137.8	87%	0.874	74%	0.744	S	S	*	*			trans	79.9	160	166.5	-57	-168.5	-7.5	0	0	118.3
161	R	23.3	Very low	28.6	Very low	230 Å²	230	136.6 Å²	136.6	87%	0.868	74%	0.741	S	S	*	*				168.3	121.9	-50.9	172.3	-177.7	-167.1	-170.9	6.2	109
162	S	25.6	Very low	28.4	Very low	107 Å²	107	140.5 Å²	140.5	75%	0.748	74%	0.743	S	S	*	*			trans	63.7	137.2	174.5	-177.6	0	0	0	0	114.6
163	G	26.8	Very low	28.4	Very low	71 Å²	71	144.3 Å²	144.3	73%	0.732	75%	0.747	S	S	*	*			cis	-174	-154.1	10.3	0	0	0	0	0	106.3
164	Y	28.4	Very low	28.6	Very low	193 Å²	193	145.9 Å²	145.9	76%	0.757	75%	0.752	S	S	*	*			cis	-167.8	162.7	6.6	-133.9	-77.4	0	0	0	108.8
165	Y	27.6	Very low	29	Very low	197 Å²	197	142.8 Å²	142.8	77%	0.773	75%	0.748	S	S	*	*			trans	64.7	146.5	173.6	-73	-78.1	0	0	0	117.7
166	G	27.3	Very low	29.1	Very low	71 Å²	71	140.6 Å²	140.6	73%	0.732	75%	0.745	S	S	*	*			cis	176.2	-179.9	-1.7	0	0	0	0	0	109.8
167	D	26.3	Very low	28.3	Very low	125 Å²	125	140.6 Å²	140.6	67%	0.668	74%	0.743	S	S	*	*			cis	-167.5	-170.3	-13.6	-162	-6.2	0	0	0	107.7
168	M	29.7	Very low	27.4	Very low	137 Å²	137	141.3 Å²	141.3	68%	0.675	75%	0.745	S	S	*	*			trans	104.8	104.5	164.1	-54.4	-69	91.6	0	0	119.2
169	D	25.4	Very low	28.7	Very low	112 Å²	112	139.1 Å²	139.1	60%	0.599	74%	0.738	S	S	*	*				80.4	105.4	128.5	-72.3	1.6	0	0	0	124.8
170	H	29	Very low	28.3	Very low	159 Å²	159	141.5 Å²	141.5	74%	0.736	75%	0.745	S	S	*	*				66.3	141.2	114.3	-67.4	5.7	0	0	0	120.7
171	T	25.2	Very low	28.4	Very low	101 Å²	101	138.6 Å²	138.6	62%	0.62	75%	0.745	S	S	*	*			cis	-166.4	164.2	-12.7	33.3	0	0	0	0	112.3
172	R	25.5	Very low	28.5	Very low	202 Å²	202	131.1 Å²	131.1	76%	0.762	74%	0.74	S	S	*	*			trans	75.9	132.5	146.8	-77.7	162.7	-166.1	-111.8	1.6	122.8
173	R	23.2	Very low	28.6	Very low	222 Å²	222	131.3 Å²	131.3	84%	0.838	74%	0.742	S	S	*	*			trans	81.2	114.4	134.2	-81	-176.4	173.5	177.4	-4.2	123.3
174	M	32.6	Very low	28.4	Very low	173 Å²	173	133.8 Å²	133.8	85%	0.852	74%	0.742	S	S	*	*			trans	-62.9	162.4	135.1	-69.8	-72.8	-175.6	0	0	110.9
175	P	36.4	Very low	28.3	Very low	115 Å²	115	129.6 Å²	129.6	75%	0.747	74%	0.74	S	S	*	*			cis	-132	-162.3	42.2	38.2	-15.3	0	0	0	113
176	G	25.4	Very low	28.1	Very low	65 Å²	65	127.6 Å²	127.6	67%	0.67	74%	0.743	S	S	*	*			cis	76	154	42.3	0	0	0	0	0	112.2
177	T	24.6	Very low	28.1	Very low	119 Å²	119	129.6 Å²	129.6	73%	0.73	74%	0.741	S	S	*	*			cis	-174.4	156.4	18.7	-25.8	0	0	0	0	112.3
178	V	27.6	Very low	28.1	Very low	130 Å²	130	131.8 Å²	131.8	79%	0.788	75%	0.747	S	S	*	*			trans	56.4	172.8	153.6	-84.1	0	0	0	0	122.9
179	P	49.2	Very low	27.9	Very low	101 Å²	101	131.2 Å²	131.2	66%	0.656	76%	0.757	S	S	*	*			cis	-143	177	-33.6	36.5	-17.3	0	0	0	118.4
180	N	29	Very low	27.9	Very low	155 Å²	155	129.9 Å²	129.9	83%	0.829	77%	0.769	S	S	*	*			trans	62.8	123.4	139.3	-85	-2	0	0	0	125.4
181	S	28.9	Very low	27.7	Very low	125 Å²	125	127.3 Å²	127.3	87%	0.874	77%	0.769	S	S	*	*				178.2	150.4	96.2	42.4	0	0	0	0	110.9
182	G	25.1	Very low	27.6	Very low	73 Å²	73	131.4 Å²	131.4	75%	0.753	78%	0.781	S	S	*	*			cis	-179.5	169.7	-10	0	0	0	0	0	112.6
183	S	26.7	Very low	27.5	Very low	112 Å²	112	126.4 Å²	126.4	78%	0.783	78%	0.783	S	S	*	*			trans	84	97.5	163.8	-137.9	0	0	0	0	123
184	T	24.3	Very low	27.8	Very low	122 Å²	122	121.9 Å²	121.9	75%	0.748	78%	0.782	S	S	*	*				63.6	152.7	124.9	58.7	0	0	0	0	126.2
185	C	25.5	Very low	27.6	Very low	106 Å²	106	118.3 Å²	118.3	72%	0.716	78%	0.78	S	S	*	*			trans	71.7	86.5	153.4	63.5	0	0	0	0	122.9
186	D	23.8	Very low	27.1	Very low	155 Å²	155	122.3 Å²	122.3	83%	0.829	79%	0.789	S	S	*	*				76.2	136.1	106.4	-82.4	-66.2	0	0	0	125.7
187	V	26.9	Very low	27.2	Very low	113 Å²	113	128 Å²	128	69%	0.685	80%	0.795	S	S	*	*			trans	99.3	118.7	140.8	160.9	0	0	0	0	122.4
188	Q	26.9	Very low	27.2	Very low	171 Å²	171	131.7 Å²	131.7	80%	0.799	80%	0.804	S	S	*	*			trans	77.2	91.6	152.3	-79	164.9	17.2	0	0	123.4
189	S	25.8	Very low	27.1	Very low	125 Å²	125	131.2 Å²	131.2	87%	0.874	80%	0.796	S	S	*	*				49.4	124.3	108.2	-52.4	0	0	0	0	122.5
190	G	23.9	Very low	26.1	Very low	84 Å²	84	133.3 Å²	133.3	87%	0.866	81%	0.807	S	S	*	*			trans	167.3	131.7	156.4	0	0	0	0	0	113.2
191	S	24.6	Very low	26.2	Very low	105 Å²	105	132.5 Å²	132.5	73%	0.734	80%	0.798	S	S	*	*			trans	-124.4	163.1	-175	57.6	0	0	0	0	114.2
192	H	24.4	Very low	26.3	Very low	187 Å²	187	129.8 Å²	129.8	87%	0.866	79%	0.79	S	S	*	*			trans	76.2	110.9	174	-66.7	-88.2	0	0	0	120.3
193	A	23.8	Very low	26.8	Very low	97 Å²	97	131 Å²	131	80%	0.802	77%	0.772	S	S	*	*				-161.5	138.9	126.8	0	0	0	0	0	110.3
194	P	28.2	Very low	27	Very low	126 Å²	126	135.4 Å²	135.4	82%	0.818	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-91.4	167.9	176.3	36.6	-34.5	0	0	0	113.1
195	A	29.3	Very low	27.4	Very low	99 Å²	99	131.9 Å²	131.9	82%	0.818	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-78.6	133.5	-176.4	0	0	0	0	0	114.2
196	E	25.1	Very low	27.8	Very low	198 Å²	198	137.5 Å²	137.5	93%	0.925	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-81.2	130.9	169.7	-69.9	-163.4	119.2	0	0	112.3
197	K	27.3	Very low	28.5	Very low	184 Å²	184	136 Å²	136	80%	0.8	75%	0.752	S	S	*	*			trans	-100	112	164.6	-67.8	173.1	-179.1	169	0	108.3	L199	K197-L199 HydrophobicContact CB-CD1 3.83Å; K197-L199 WeakPolarHBondContact O-CD1 3.4Å; K197-L199 PolarHBondContact O-N 3.41Å
198	Q	24.8	Very low	28.7	Very low	198 Å²	198	139.4 Å²	139.4	93%	0.925	76%	0.758	S	S	*	*			trans	-76.2	89.3	179.7	-159.4	173.5	38.2	0	0	111.2	V200	Q198-V200 PolarHBondContact O-N 3.27Å
199	L	26	Very low	29.1	Very low	119 Å²	119	140.5 Å²	140.5	62%	0.623	76%	0.756	S	S	*	*			trans	-74	110.2	177.6	-90.1	74.3	0	0	0	111.3	K197 H201	K197-L199 HydrophobicContact CB-CD1 3.83Å; K197-L199 WeakPolarHBondContact O-CD1 3.4Å; K197-L199 PolarHBondContact O-N 3.41Å; L199-H201 PolarHBondContact O-N 3.24Å; L199-H201 VanDerWaalsContact O-N 3.16Å; L199-H201 PolarHBondContact O-ND1 2.97Å
200	V	27.6	Very low	29.6	Very low	146 Å²	146	139.5 Å²	139.5	89%	0.885	75%	0.749	S	S	*	*			trans	-62.8	113.7	168.8	-179.6	0	0	0	0	109.7	Q198	Q198-V200 PolarHBondContact O-N 3.27Å
201	H	31.1	Very low	29.9	Very low	137 Å²	137	144.3 Å²	144.3	63%	0.634	75%	0.746	S	S	*	*			trans	-86.5	124.2	-179.9	-80.8	55.5	0	0	0	111.4	L199	L199-H201 PolarHBondContact O-N 3.24Å; L199-H201 VanDerWaalsContact O-N 3.16Å; L199-H201 PolarHBondContact O-ND1 2.97Å
202	G	30.6	Very low	30.3	Very low	68 Å²	68	146.5 Å²	146.5	70%	0.701	75%	0.745	S	S	*	*			trans	-107.9	127.8	178	0	0	0	0	0	113.2
203	Y	35.5	Very low	30.7	Very low	98 Å²	98	146.3 Å²	146.3	38%	0.384	74%	0.738	S	S	.	*			trans	-82.9	148.8	177.1	-62.2	-85.7	0	0	0	112.6	L117	L117-Y203 HydrophobicContact CB-CD1 4.38Å; L117-Y203 HydrophobicContact CD2-CD1 4.22Å; L117-Y203 HydrophobicContact CD2-CG 4.19Å
204	K	32.5	Very low	31.2	Very low	205 Å²	205	149 Å²	149	89%	0.891	73%	0.732	S	S	*	*			trans	-124.3	115.7	170.6	-80.7	-179.6	177.1	170.4	0	111
205	L	31.3	Very low	31.4	Very low	49 Å²	49	150.1 Å²	150.1	26%	0.257	72%	0.724	S	S	.	*			trans	-68	144.1	170.4	-105.6	77	0	0	0	111.7	Y83 I89 L117	Y83-L205 HydrophobicContact CD2-CB 3.73Å; Y83-L205 HydrophobicContact CD2-CD2 3.64Å; Y83-L205 HydrophobicContact CD2-CG 4.26Å; Y83-L205 HydrophobicContact CE2-CB 3.5Å; Y83-L205 VanDerWaalsContact CE2-CB 3.5Å; Y83-L205 HydrophobicContact CE2-CD2 4.19Å; Y83-L205 HydrophobicContact CE2-CG 4.47Å; Y83-L205 HydrophobicContact CG-CD2 3.93Å; I89-L205 HydrophobicContact CD1-CD1 3.62Å; L117-L205 HydrophobicContact CD2-CD1 3.76Å
206	R	33.7	Very low	31.6	Very low	223 Å²	223	151.9 Å²	151.9	84%	0.842	72%	0.715	S	S	*	*			trans	-105.4	134.2	174.6	-155.9	176.4	-165.4	178.2	5.5	110.7
207	N	38.7	Very low	32.2	Very low	125 Å²	125	145.3 Å²	145.3	67%	0.668	69%	0.691	S	S	*	*			trans	-74.4	134.4	-179.3	-175.6	-2.5	0	0	0	111.4
208	F	31.5	Very low	32.6	Very low	183 Å²	183	139.1 Å²	139.1	80%	0.803	67%	0.674	S	S	*	*			trans	-148.6	146.2	174.7	-131.4	-91.4	0	0	0	114.2	S210	F208-S210 PolarHBondContact O-N 3.08Å
209	Y	35.5	Very low	33.5	Very low	195 Å²	195	135.2 Å²	135.2	77%	0.765	66%	0.658	S	S	*	*			trans	-75.3	111	-173.2	-100.4	-113.7	0	0	0	113.6	K211	Y209-K211 PolarHBondContact O-N 3.38Å
210	S	35.7	Very low	34	Very low	103 Å²	103	136.2 Å²	136.2	72%	0.72	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.8	58.6	-173.8	51.8	0	0	0	0	114.8	F208	F208-S210 PolarHBondContact O-N 3.08Å
211	K	30.7	Very low	34.6	Very low	185 Å²	185	134 Å²	134	80%	0.804	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.8	-6	174.9	-129.3	175.6	-172.2	174.7	0	119.1	Y209	Y209-K211 PolarHBondContact O-N 3.38Å
212	Q	33.5	Very low	34.8	Very low	151 Å²	151	133.7 Å²	133.7	71%	0.706	65%	0.65	S	S	*	*	S	Bend	trans	-103.7	-40.2	173.9	-64.1	-66.2	3.4	0	0	112.8	F214 K215	Q212-F214 PolarHBondContact O-N 3.39Å; Q212-K215 WeakPolarHBondContact O-CB 3.43Å; Q212-K215 PolarHBondContact O-N 3.07Å
213	Y	32	Very low	35	Very low	183 Å²	183	135 Å²	135	72%	0.718	65%	0.648	S	S	*	*	H	α-helix	trans	-57	-49.5	-173.3	-118.4	-92.8	0	0	0	114	K215 Q216 S217	Y213-K215 PolarHBondContact O-N 2.8Å; Y213-Q216 PolarHBondContact O-N 2.87Å; Y213-S217 PolarHBondContact O-N 2.9Å
214	F	35	Very low	34.8	Very low	154 Å²	154	134.5 Å²	134.5	68%	0.675	66%	0.664	S	S	*	*	H	α-helix	trans	-58.9	-20.2	178.6	-83.8	-79.8	0	0	0	114.2	Q212	Q212-F214 PolarHBondContact O-N 3.39Å
215	K	33	Very low	34.8	Very low	150 Å²	150	129.7 Å²	129.7	65%	0.652	66%	0.656	S	S	*	*	H	α-helix	trans	-82.1	-22.1	179	-156.7	-178	178.5	-169.1	0	113.2	Q212 Y213 I219	Q212-K215 WeakPolarHBondContact O-CB 3.43Å; Q212-K215 PolarHBondContact O-N 3.07Å; Y213-K215 PolarHBondContact O-N 2.8Å; K215-I219 VanDerWaalsContact O-CD1 3.29Å; K215-I219 WeakPolarHBondContact O-CD1 3.5Å; K215-I219 WeakPolarHBondContact O-CG1 3.26Å
216	Q	33.6	Very low	34.8	Very low	135 Å²	135	131.8 Å²	131.8	63%	0.631	68%	0.675	S	S	*	*	H	α-helix	trans	-85.4	-45.8	174.4	-87.1	176.7	-35.8	0	0	111.9	Y213 A218 I219 Q220	Y213-Q216 PolarHBondContact O-N 2.87Å; Q216-A218 VanDerWaalsContact C-N 3.27Å; Q216-A218 PolarHBondContact O-N 2.93Å; Q216-I219 PolarHBondContact O-N 3.28Å; Q216-Q220 PolarHBondContact O-N 3.25Å
217	S	36.9	Very low	34.5	Very low	60 Å²	60	127.5 Å²	127.5	42%	0.42	67%	0.669	S	S	.	*	H	α-helix	trans	-61.4	-33.3	-178.7	-52.1	0	0	0	0	113.2	Y213 I219 T221	Y213-S217 PolarHBondContact O-N 2.9Å; S217-I219 VanDerWaalsContact C-N 3.28Å; S217-I219 PolarHBondContact O-N 2.86Å; S217-T221 PolarHBondContact O-N 3.38Å; S217-T221 PolarHBondContact O-OG1 3.36Å
218	A	36.2	Very low	34	Very low	54 Å²	54	130 Å²	130	45%	0.446	68%	0.676	S	S	.	*	H	α-helix	trans	-73.2	-13.8	176.7	0	0	0	0	0	114.7	Q216 N222	Q216-A218 VanDerWaalsContact C-N 3.27Å; Q216-A218 PolarHBondContact O-N 2.93Å; A218-N222 PolarHBondContact O-ND2 2.72Å
219	I	42	Very low	33.6	Very low	116 Å²	116	124.5 Å²	124.5	60%	0.595	67%	0.672	S	S	*	*	H	α-helix	trans	-88.8	-42.9	175.9	-65.6	173.3	0	0	0	109.7	K215 Q216 S217 T221 N222	K215-I219 VanDerWaalsContact O-CD1 3.29Å; K215-I219 WeakPolarHBondContact O-CD1 3.5Å; K215-I219 WeakPolarHBondContact O-CG1 3.26Å; Q216-I219 PolarHBondContact O-N 3.28Å; S217-I219 VanDerWaalsContact C-N 3.28Å; S217-I219 PolarHBondContact O-N 2.86Å; I219-T221 VanDerWaalsContact C-N 3.3Å; I219-T221 PolarHBondContact O-N 3.43Å; I219-N222 PolarHBondContact O-N 2.83Å
220	Q	37.8	Very low	33.6	Very low	140 Å²	140	120.7 Å²	120.7	65%	0.654	67%	0.671	S	S	*	*	H	α-helix	trans	-66.7	-27.3	179.6	-70.1	176.2	-31.5	0	0	113.6	Q216 S223	Q216-Q220 PolarHBondContact O-N 3.25Å; Q220-S223 PolarHBondContact O-OG 2.83Å
221	T	40.7	Very low	33	Very low	99 Å²	99	123.7 Å²	123.7	61%	0.607	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-16.5	176.7	49.6	0	0	0	0	114.4	S217 I219	S217-T221 PolarHBondContact O-N 3.38Å; S217-T221 PolarHBondContact O-OG1 3.36Å; I219-T221 VanDerWaalsContact C-N 3.3Å; I219-T221 PolarHBondContact O-N 3.43Å
222	N	34.9	Very low	32.7	Very low	131 Å²	131	121.1 Å²	121.1	70%	0.701	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	-8.1	176.1	-81.5	-78.1	0	0	0	113.6	A218 I219	A218-N222 PolarHBondContact O-ND2 2.72Å; I219-N222 PolarHBondContact O-N 2.83Å
223	S	33.4	Very low	32.2	Very low	97 Å²	97	120.7 Å²	120.7	68%	0.678	68%	0.679	S	S	*	*	S	Bend	trans	-94.8	2.8	176.7	45.7	0	0	0	0	114.3	Q220	Q220-S223 PolarHBondContact O-OG 2.83Å
224	A	32.8	Very low	31.9	Very low	86 Å²	86	117.3 Å²	117.3	71%	0.711	68%	0.677	S	S	*	*	S	Bend	trans	-104.8	17.9	-170.1	0	0	0	0	0	114.7
225	S	32.9	Very low	31.3	Very low	104 Å²	104	117.1 Å²	117.1	73%	0.727	68%	0.678	S	S	*	*	S	Bend	trans	-133.9	41.9	-173.2	59.4	0	0	0	0	114
226	S	29.4	Very low	30.9	Very low	94 Å²	94	116.5 Å²	116.5	66%	0.657	68%	0.678	S	S	*	*	S	Bend	trans	-160	122	164.6	-164.7	0	0	0	0	111.6
227	N	27.7	Very low	30.5	Very low	133 Å²	133	116.8 Å²	116.8	71%	0.711	68%	0.679	S	S	*	*			trans	64.4	148.3	179.8	-55.2	-69.9	0	0	0	114.5
228	Q	29.3	Very low	29.9	Very low	176 Å²	176	121.2 Å²	121.2	82%	0.822	69%	0.694	S	S	*	*			cis	-156.8	178.2	-9.3	-112.4	160.2	35.8	0	0	107
229	G	22.5	Very low	29.3	Very low	68 Å²	68	122.9 Å²	122.9	70%	0.701	70%	0.701	S	S	*	*			trans	-140.9	-177.3	163.4	0	0	0	0	0	110.5
230	P	35.1	Very low	28.5	Very low	116 Å²	116	125.6 Å²	125.6	75%	0.753	71%	0.711	S	S	*	*			cis	-130.8	172.7	-2.1	42.3	-28.1	0	0	0	114.7
231	L	23.5	Very low	27.9	Very low	165 Å²	165	127.3 Å²	127.3	86%	0.864	72%	0.724	S	S	*	*			trans	64.7	153.5	169.6	-60.6	164.5	0	0	0	114.3
232	V	24.4	Very low	27.2	Very low	131 Å²	131	126.2 Å²	126.2	79%	0.794	73%	0.732	S	S	*	*			cis	-145.7	153.4	40.8	164	0	0	0	0	113
233	L	23.6	Very low	26.8	Very low	143 Å²	143	128.5 Å²	128.5	75%	0.749	74%	0.741	S	S	*	*			trans	-27.3	175.7	162.2	-135.6	130.3	0	0	0	120.8
234	V	24.8	Very low	26.4	Very low	111 Å²	111	128.6 Å²	128.6	67%	0.673	74%	0.742	S	S	*	*			trans	105	107.4	161.6	-171.6	0	0	0	0	116.5
235	E	23.9	Very low	26.1	Very low	150 Å²	150	133.4 Å²	133.4	70%	0.701	75%	0.749	S	S	*	*				18.1	158.4	123.8	-75.7	148.5	109	0	0	121.3
236	E	23.5	Very low	25.7	Very low	138 Å²	138	132.4 Å²	132.4	65%	0.645	76%	0.756	S	S	*	*			cis	-169.9	170.3	-24.2	-138.9	-160.7	122.1	0	0	107.1
237	Q	25.9	Very low	25.4	Very low	141 Å²	141	131.2 Å²	131.2	66%	0.659	76%	0.758	S	S	*	*			trans	61.8	170.9	155.4	-70.9	168.8	29.8	0	0	117.7
238	Q	24.4	Very low	25.3	Very low	153 Å²	153	132.4 Å²	132.4	72%	0.715	77%	0.765	S	S	*	*			cis	-159.8	153	-41.1	177.7	162	10.6	0	0	110.4
239	C	22	Very low	25.2	Very low	89 Å²	89	129.4 Å²	129.4	60%	0.601	76%	0.763	S	S	*	*			trans	62.6	123.9	160.2	-81.7	0	0	0	0	123.3
240	Q	25.9	Very low	25.3	Very low	172 Å²	172	130.2 Å²	130.2	80%	0.804	76%	0.763	S	S	*	*				68.7	109.3	125.4	-62.2	178.5	9.2	0	0	122.1
241	L	26.3	Very low	25.4	Very low	176 Å²	176	130.3 Å²	130.3	92%	0.921	76%	0.764	S	S	*	*				7.4	111.8	129.6	-68.1	163.3	0	0	0	118
242	G	24.1	Very low	25.5	Very low	77 Å²	77	128.5 Å²	128.5	79%	0.794	76%	0.759	S	S	*	*			trans	-118.3	143.7	152.2	0	0	0	0	0	110
243	M	27.9	Very low	25.6	Very low	179 Å²	179	128 Å²	128	88%	0.882	76%	0.756	S	S	*	*			trans	-105.3	158	-177	-63.8	-168.7	75.3	0	0	113.3
244	S	24.9	Very low	25.7	Very low	99 Å²	99	129.5 Å²	129.5	69%	0.692	76%	0.764	S	S	*	*			trans	114.4	143.1	135.3	84.3	0	0	0	0	119.5
245	Q	26.4	Very low	25.7	Very low	186 Å²	186	127.2 Å²	127.2	87%	0.869	76%	0.763	S	S	*	*			trans	56.8	105.2	149.9	-67.3	-179.2	74.2	0	0	121.7
246	G	23.3	Very low	25.8	Very low	84 Å²	84	127.4 Å²	127.4	87%	0.866	77%	0.769	S	S	*	*				95	163.4	102.2	0	0	0	0	0	119.2
247	G	24.4	Very low	25.8	Very low	68 Å²	68	126.7 Å²	126.7	70%	0.701	77%	0.774	S	S	*	*			trans	110.3	67.1	155.1	0	0	0	0	0	120.1
248	N	24.9	Very low	25.8	Very low	159 Å²	159	126.5 Å²	126.5	85%	0.85	78%	0.782	S	S	*	*			trans	61.8	162.3	134.2	-62.6	-13	0	0	0	123.8
249	S	26.8	Very low	25.9	Very low	113 Å²	113	126.6 Å²	126.6	79%	0.79	78%	0.782	S	S	*	*			trans	63.4	106.3	151.6	44	0	0	0	0	121
250	A	25.3	Very low	26.5	Very low	85 Å²	85	128.2 Å²	128.2	70%	0.702	79%	0.792	S	S	*	*			trans	-77.8	162	137.1	0	0	0	0	0	109.8
251	P	37.1	Very low	26.5	Very low	118 Å²	118	124.4 Å²	124.4	77%	0.766	78%	0.784	S	S	*	*				-127.5	150.5	85.4	8.2	14.6	0	0	0	112.7
252	V	25	Very low	28.1	Very low	126 Å²	126	121.3 Å²	121.3	76%	0.764	78%	0.775	S	S	*	*				60.2	121.6	69.8	-166.8	0	0	0	0	114.4
253	V	26.8	Very low	28.9	Very low	121 Å²	121	123 Å²	123	73%	0.733	77%	0.772	S	S	*	*			trans	154	126.5	134.5	161.2	0	0	0	0	112.7
254	L	25.8	Very low	28.7	Very low	174 Å²	174	119.5 Å²	119.5	91%	0.911	76%	0.764	S	S	*	*			trans	56.3	157.8	165.7	-96.4	56.9	0	0	0	119.4
255	G	24.6	Very low	28.6	Very low	63 Å²	63	121 Å²	121	65%	0.649	77%	0.769	S	S	*	*			cis	173.8	140.6	-10.4	0	0	0	0	0	116.2
256	N	26.8	Very low	28.6	Very low	154 Å²	154	116.9 Å²	116.9	82%	0.824	76%	0.761	S	S	*	*			trans	53	103.2	144.9	-69	9.8	0	0	0	124.1
257	T	24.1	Very low	28.6	Very low	124 Å²	124	119 Å²	119	76%	0.761	76%	0.757	S	S	*	*				83.3	151.4	115.7	-36.5	0	0	0	0	121.9
258	V	26	Very low	28.6	Very low	136 Å²	136	120.9 Å²	120.9	82%	0.824	76%	0.759	S	S	*	*			trans	105	134.7	156	-160.1	0	0	0	0	117.8
259	Q	26.2	Very low	28.7	Very low	155 Å²	155	117.8 Å²	117.8	72%	0.724	76%	0.755	S	S	*	*			trans	-65.9	173.2	171.4	-85.6	-83.8	-25.7	0	0	112
260	P	34.1	Very low	28.7	Very low	123 Å²	123	119.2 Å²	119.2	80%	0.799	75%	0.749	S	S	*	*			cis	-150.1	-169.6	44.3	43.1	-19.9	0	0	0	118.7
261	S	25.1	Very low	28.8	Very low	93 Å²	93	122.5 Å²	122.5	65%	0.65	75%	0.748	S	S	*	*			trans	-127.3	-176.5	172.6	58.9	0	0	0	0	109.1
262	P	60.5	Low	28.4	Very low	110 Å²	110	123.7 Å²	123.7	71%	0.714	75%	0.748	S	S	*	*			cis	-112.1	-154.5	-29.6	35.6	-16.3	0	0	0	109.8
263	P	41.3	Very low	28.5	Very low	114 Å²	114	121 Å²	121	74%	0.74	75%	0.746	S	S	*	*				-156.8	157.9	76.6	41.1	-19.3	0	0	0	119.8
264	C	22.9	Very low	28.6	Very low	104 Å²	104	122.3 Å²	122.3	70%	0.703	75%	0.754	S	S	*	*			trans	29.9	129.2	134.2	-49.4	0	0	0	0	125.5
265	T	24.2	Very low	28.6	Very low	131 Å²	131	118.2 Å²	118.2	80%	0.804	75%	0.745	S	S	*	*				53.6	152.5	123.1	64.9	0	0	0	0	122.4
266	S	25.5	Very low	28.6	Very low	100 Å²	100	120.4 Å²	120.4	70%	0.699	75%	0.75	S	S	*	*			cis	-174.8	-160.3	-3.7	47.7	0	0	0	0	110.3
267	V	23.6	Very low	28.4	Very low	129 Å²	129	121 Å²	121	78%	0.782	75%	0.753	S	S	*	*			trans	83.3	147.1	165.2	-168.5	0	0	0	0	116.3
268	S	23.9	Very low	28.7	Very low	107 Å²	107	121.4 Å²	121.4	75%	0.748	76%	0.755	S	S	*	*			cis	-178	167.4	-46.9	-90	0	0	0	0	110.1
269	A	27.3	Very low	28.9	Very low	94 Å²	94	120.7 Å²	120.7	78%	0.777	75%	0.753	S	S	*	*			trans	70.2	147.3	166.9	0	0	0	0	0	116.3
270	E	26	Very low	28.9	Very low	142 Å²	142	118.3 Å²	118.3	66%	0.664	75%	0.754	S	S	*	*			cis	-158.2	-168.7	-6	-121.8	-169.2	135.1	0	0	108.1
271	K	27.8	Very low	28.5	Very low	154 Å²	154	119.9 Å²	119.9	67%	0.67	76%	0.755	S	S	*	*			cis	-151.5	-162.2	12.2	-148.4	152.9	-177.9	73.8	0	111.7
272	N	28	Very low	28.6	Very low	144 Å²	144	122.1 Å²	122.1	77%	0.77	76%	0.76	S	S	*	*			trans	-77.5	168.3	-178	-50.8	-31.6	0	0	0	113.2
273	G	28.4	Very low	27	Very low	70 Å²	70	124.2 Å²	124.2	72%	0.722	76%	0.764	S	S	*	*			cis	158.2	175.9	4.2	0	0	0	0	0	109
274	V	27.6	Very low	26.2	Very low	148 Å²	148	125.6 Å²	125.6	90%	0.897	77%	0.766	S	S	*	*			cis	-133	-128.3	0.3	-159.7	0	0	0	0	106.5
275	A	26.2	Very low	26.4	Very low	88 Å²	88	126.6 Å²	126.6	73%	0.727	77%	0.769	S	S	*	*			cis	-169.5	161.9	-21.4	0	0	0	0	0	106.7
276	S	24.2	Very low	26.8	Very low	108 Å²	108	126.8 Å²	126.8	76%	0.755	77%	0.772	S	S	*	*			cis	-170.3	-172.4	-21.9	-167.9	0	0	0	0	109.1
277	L	24.5	Very low	26.7	Very low	167 Å²	167	126.4 Å²	126.4	87%	0.874	78%	0.775	S	S	*	*			trans	77.3	136.7	170.4	-56.3	179	0	0	0	120.1
278	T	29.7	Very low	26.7	Very low	132 Å²	132	126.5 Å²	126.5	81%	0.81	78%	0.78	S	S	*	*			trans	-110	168.5	168.1	57.8	0	0	0	0	109.8
279	P	29.6	Very low	26.6	Very low	122 Å²	122	128.7 Å²	128.7	79%	0.792	78%	0.783	S	S	*	*				-151.9	177.1	94.5	40	-22.2	0	0	0	115.9
280	S	27.5	Very low	27.1	Very low	105 Å²	105	130.1 Å²	130.1	73%	0.734	79%	0.785	S	S	*	*			trans	-112.2	155.3	171.3	-51.5	0	0	0	0	111.4
281	N	25.4	Very low	27.1	Very low	155 Å²	155	127.9 Å²	127.9	83%	0.829	79%	0.79	S	S	*	*			trans	-172.8	139.1	146.9	-88.4	-33.9	0	0	0	108.6
282	N	26.7	Very low	26.9	Very low	140 Å²	140	127.4 Å²	127.4	75%	0.749	80%	0.795	S	S	*	*			cis	92.2	156	33.4	-84.7	-38.5	0	0	0	116.1
283	L	27	Very low	26.9	Very low	154 Å²	154	125.6 Å²	125.6	81%	0.806	79%	0.794	S	S	*	*			trans	80.5	134.5	-170.4	-48.7	176.6	0	0	0	113.5
284	N	25.1	Very low	26.9	Very low	143 Å²	143	126.6 Å²	126.6	77%	0.765	80%	0.795	S	S	*	*			cis	-149.3	154.8	0.4	-106	-22.8	0	0	0	112.2
285	T	26.8	Very low	26.9	Very low	126 Å²	126	125.7 Å²	125.7	77%	0.773	79%	0.79	S	S	*	*			trans	-99.9	162.7	160	41.5	0	0	0	0	110.5
286	P	32.5	Very low	27	Very low	134 Å²	134	129.5 Å²	129.5	87%	0.87	80%	0.798	S	S	*	*				-132.6	174.1	100.8	37.3	-27.5	0	0	0	113.2
287	A	23.5	Very low	27.2	Very low	92 Å²	92	132.4 Å²	132.4	76%	0.76	80%	0.797	S	S	*	*			trans	-112.7	161.8	-168.1	0	0	0	0	0	114
288	C	22.9	Very low	27.5	Very low	131 Å²	131	130.7 Å²	130.7	89%	0.885	80%	0.796	S	S	*	*			trans	-164	106.5	151.5	-103.3	0	0	0	0	110
289	D	22.5	Very low	27.8	Very low	153 Å²	153	130 Å²	130	82%	0.818	79%	0.791	S	S	*	*			trans	-83.7	152	152.8	-73.1	-63.7	0	0	0	108.4
290	P	36.6	Very low	28.4	Very low	125 Å²	125	135.6 Å²	135.6	81%	0.812	80%	0.797	S	S	*	*				-131.7	160.3	93.4	38	-30.3	0	0	0	113.7
291	A	26.6	Very low	29.2	Very low	94 Å²	94	135.3 Å²	135.3	78%	0.777	79%	0.79	S	S	*	*			trans	-72.9	149.6	178.1	0	0	0	0	0	112.9
292	D	24	Very low	30	Very low	144 Å²	144	135.5 Å²	135.5	77%	0.77	78%	0.784	S	S	*	*				-163.3	144.9	101.7	-141.9	-41.9	0	0	0	114
293	S	28.1	Very low	30.6	Very low	107 Å²	107	138 Å²	138	75%	0.748	79%	0.788	S	S	*	*			trans	62.8	166.7	148	-80.3	0	0	0	0	123.8
294	A	27.3	Very low	31.2	Very low	90 Å²	90	135.4 Å²	135.4	74%	0.744	78%	0.779	S	S	*	*			trans	78.5	66.8	164.5	0	0	0	0	0	120.5	N296	A294-N296 PolarHBondContact O-N 3.15Å
295	V	28.6	Very low	32.3	Very low	130 Å²	130	133 Å²	133	79%	0.788	77%	0.769	S	S	*	*			trans	0.1	102.9	144.4	-174.6	0	0	0	0	116.9	K297	V295-K297 HydrophobicContact CG1-CG 4.43Å
296	N	27.2	Very low	33	Very low	167 Å²	167	135.9 Å²	135.9	89%	0.893	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-85.4	123.8	170.8	-110.6	-64.6	0	0	0	112.3	A294	A294-N296 PolarHBondContact O-N 3.15Å
297	K	29.7	Very low	33.6	Very low	169 Å²	169	134.6 Å²	134.6	74%	0.735	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-99.7	141.9	179.6	-65.6	170.5	-175.6	166.6	0	110.7	V295 V299	V295-K297 HydrophobicContact CG1-CG 4.43Å; K297-V299 PolarHBondContact O-N 2.95Å
298	P	29.1	Very low	34.6	Very low	132 Å²	132	138.2 Å²	138.2	86%	0.857	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-62.7	130.3	-179.7	24	-33.2	0	0	0	112.6	R300	P298-R300 PolarHBondContact O-N 3.14Å
299	V	36.1	Very low	35.7	Very low	118 Å²	118	138.7 Å²	138.7	72%	0.715	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-65.1	125	-170.1	177	0	0	0	0	112.8	K297	K297-V299 PolarHBondContact O-N 2.95Å
300	R	42.6	Very low	37.1	Very low	239 Å²	239	137.8 Å²	137.8	90%	0.902	72%	0.724	S	S	*	*			trans	-147.6	36	176.1	-145.2	176.4	-173.1	149.8	5.3	118	P298	P298-R300 PolarHBondContact O-N 3.14Å
301	T	45.7	Very low	37.6	Very low	98 Å²	98	135.9 Å²	135.9	60%	0.601	71%	0.707	S	S	*	*			trans	-128.9	-0.1	-178	43	0	0	0	0	117	T304	T301-T304 PolarHBondContact O-OG1 3.13Å; T301-T304 VanDerWaalsContact O-OG1 3.12Å
302	K	41.6	Very low	38.9	Very low	160 Å²	160	139 Å²	139	70%	0.696	70%	0.7	S	S	*	*	H	α-helix	trans	-69.7	-35.5	-174	-66.2	-170.8	176.9	-176.4	0	115.1	Y306	K302-Y306 PolarHBondContact O-N 2.79Å
303	K	39.5	Very low	40.6	Very low	193 Å²	193	136.5 Å²	136.5	84%	0.839	69%	0.686	S	S	*	*	H	α-helix	trans	-73.1	-31.7	-178.5	-75.7	-169	176	-176.7	0	114.5	L307	K303-L307 PolarHBondContact O-N 3.22Å
304	T	40.2	Very low	41.7	Very low	98 Å²	98	138.7 Å²	138.7	60%	0.601	68%	0.677	S	S	*	*	H	α-helix	trans	-73.7	-37.8	-179.3	43.9	0	0	0	0	112.3	T301 L307 K308	T301-T304 PolarHBondContact O-OG1 3.13Å; T301-T304 VanDerWaalsContact O-OG1 3.12Å; T304-L307 PolarHBondContact O-N 3.3Å; T304-K308 WeakPolarHBondContact O-CB 3.48Å; T304-K308 PolarHBondContact O-N 2.85Å
305	V	46.4	Very low	42.9	Very low	94 Å²	94	138.4 Å²	138.4	57%	0.57	67%	0.67	S	S	*	*	H	α-helix	trans	-64.3	-45.1	175.4	178.9	0	0	0	0	110.9	L307 K308 K309	V305-L307 PolarHBondContact O-N 2.93Å; V305-K308 PolarHBondContact O-N 3.47Å; V305-K309 WeakPolarHBondContact O-CB 3.41Å; V305-K309 PolarHBondContact O-N 2.94Å
306	Y	42.4	Very low	44	Very low	186 Å²	186	136.1 Å²	136.1	73%	0.729	65%	0.651	S	S	*	*	H	α-helix	trans	-59	-45.2	175.8	-99	-93.7	0	0	0	112.8	K302 K308 K309 Y310	K302-Y306 PolarHBondContact O-N 2.79Å; Y306-K308 PolarHBondContact O-N 3.09Å; Y306-K309 PolarHBondContact O-N 3.45Å; Y306-Y310 VanDerWaalsContact O-CB 3.3Å; Y306-Y310 WeakPolarHBondContact O-CB 3.3Å; Y306-Y310 PolarHBondContact O-N 3.01Å
307	L	45.8	Very low	45.8	Very low	106 Å²	106	133.8 Å²	133.8	56%	0.555	63%	0.633	S	S	*	*	H	α-helix	trans	-67.2	-35.8	178.5	-172.2	61.2	0	0	0	112.3	K303 T304 V305 N311	K303-L307 PolarHBondContact O-N 3.22Å; T304-L307 PolarHBondContact O-N 3.3Å; V305-L307 PolarHBondContact O-N 2.93Å; L307-N311 WeakPolarHBondContact O-CB 3.32Å; L307-N311 VanDerWaalsContact O-CG 3.26Å; L307-N311 PolarHBondContact O-N 3.41Å; L307-N311 PolarHBondContact O-ND2 3.02Å
308	K	43.3	Very low	47.1	Very low	168 Å²	168	127.8 Å²	127.8	73%	0.73	62%	0.615	S	S	*	*	H	α-helix	trans	-69.6	-40.5	176	-155.6	179.7	-176.1	-169.2	0	111.7	T304 V305 Y306 Y312	T304-K308 WeakPolarHBondContact O-CB 3.48Å; T304-K308 PolarHBondContact O-N 2.85Å; V305-K308 PolarHBondContact O-N 3.47Å; Y306-K308 PolarHBondContact O-N 3.09Å; K308-Y312 WeakPolarHBondContact O-CB 3.46Å; K308-Y312 PolarHBondContact O-N 3.26Å
309	K	46.9	Very low	48.6	Very low	142 Å²	142	126.5 Å²	126.5	62%	0.617	60%	0.6	S	S	*	*	H	α-helix	trans	-65.9	-43.1	173.8	-175.5	166.1	-177.5	175.2	0	111.7	V305 Y306 N311 Y312 L313	V305-K309 WeakPolarHBondContact O-CB 3.41Å; V305-K309 PolarHBondContact O-N 2.94Å; Y306-K309 PolarHBondContact O-N 3.45Å; K309-N311 PolarHBondContact O-N 2.61Å; K309-Y312 PolarHBondContact O-N 3.05Å; K309-L313 HydrophobicContact CD-CD1 4.46Å; K309-L313 HydrophobicContact CG-CD1 3.6Å; K309-L313 WeakPolarHBondContact O-CD1 3.46Å; K309-L313 PolarHBondContact O-N 3.34Å
310	Y	51	Low	49.9	Very low	134 Å²	134	125.9 Å²	125.9	53%	0.525	59%	0.589	S	S	.	*	H	α-helix	trans	-59.9	-45.9	175.1	-179.8	-97.9	0	0	0	112.1	Y306 Y312 R314	Y306-Y310 VanDerWaalsContact O-CB 3.3Å; Y306-Y310 WeakPolarHBondContact O-CB 3.3Å; Y306-Y310 PolarHBondContact O-N 3.01Å; Y310-Y312 VanDerWaalsContact C-N 3.33Å; Y310-Y312 PolarHBondContact O-N 3.14Å; Y310-R314 VanDerWaalsContact O-CB 3.29Å; Y310-R314 WeakPolarHBondContact O-CB 3.25Å; Y310-R314 PolarHBondContact O-N 3.4Å
311	N	47	Very low	51	Low	84 Å²	84	118.8 Å²	118.8	45%	0.449	57%	0.566	S	S	.	*	H	α-helix	trans	-67.4	-32.5	176.8	-70.6	-13	0	0	0	112.7	L307 K309 S315	L307-N311 WeakPolarHBondContact O-CB 3.32Å; L307-N311 VanDerWaalsContact O-CG 3.26Å; L307-N311 PolarHBondContact O-N 3.41Å; L307-N311 PolarHBondContact O-ND2 3.02Å; K309-N311 PolarHBondContact O-N 2.61Å; N311-S315 WeakPolarHBondContact O-CB 3.36Å; N311-S315 PolarHBondContact O-N 3.22Å
312	Y	53.9	Low	51.1	Low	161 Å²	161	119.4 Å²	119.4	63%	0.631	56%	0.564	S	S	*	*	H	α-helix	trans	-66.9	-52.9	173.8	-177.9	-98.4	0	0	0	111.7	K308 K309 Y310 R314 S315 Q316	K308-Y312 WeakPolarHBondContact O-CB 3.46Å; K308-Y312 PolarHBondContact O-N 3.26Å; K309-Y312 PolarHBondContact O-N 3.05Å; Y310-Y312 VanDerWaalsContact C-N 3.33Å; Y310-Y312 PolarHBondContact O-N 3.14Å; Y312-R314 PolarHBondContact O-N 2.83Å; Y312-S315 WeakPolarHBondContact O-CB 3.49Å; Y312-S315 PolarHBondContact O-N 3.31Å; Y312-Q316 PolarHBondContact O-N 2.8Å
313	L	59.8	Low	51.3	Low	90 Å²	90	115.6 Å²	115.6	47%	0.471	56%	0.556	S	S	.	*	H	α-helix	trans	-60.1	-33.7	176.1	-86.8	81.9	0	0	0	112.1	K309 Q316 K317	K309-L313 HydrophobicContact CD-CD1 4.46Å; K309-L313 HydrophobicContact CG-CD1 3.6Å; K309-L313 WeakPolarHBondContact O-CD1 3.46Å; K309-L313 PolarHBondContact O-N 3.34Å; L313-Q316 PolarHBondContact O-N 2.66Å; L313-K317 WeakPolarHBondContact O-CB 3.44Å; L313-K317 PolarHBondContact O-N 3.32Å
314	R	52.7	Low	51.6	Low	153 Å²	153	109.2 Å²	109.2	58%	0.577	54%	0.54	S	S	*	.	H	α-helix	trans	-67.8	-37.7	174.3	-166	178.5	-151.5	157.7	11.4	112.7	Y310 Y312 A318	Y310-R314 VanDerWaalsContact O-CB 3.29Å; Y310-R314 WeakPolarHBondContact O-CB 3.25Å; Y310-R314 PolarHBondContact O-N 3.4Å; Y312-R314 PolarHBondContact O-N 2.83Å; R314-A318 WeakPolarHBondContact O-CB 2.93Å; R314-A318 PolarHBondContact O-N 2.79Å; R314-A318 VanDerWaalsContact O-N 3.14Å
315	S	51.1	Low	51.9	Low	84 Å²	84	111.5 Å²	111.5	59%	0.587	54%	0.543	S	S	*	.	H	α-helix	trans	-71.7	-33	175	-165.4	0	0	0	0	112.1	N311 Y312 L319	N311-S315 WeakPolarHBondContact O-CB 3.36Å; N311-S315 PolarHBondContact O-N 3.22Å; Y312-S315 WeakPolarHBondContact O-CB 3.49Å; Y312-S315 PolarHBondContact O-N 3.31Å; S315-L319 PolarHBondContact O-N 2.77Å
316	Q	52.7	Low	51.8	Low	83 Å²	83	111.7 Å²	111.7	39%	0.388	55%	0.549	S	S	.	.	H	α-helix	trans	-69.6	-50.8	174.8	179.8	177.2	-9.5	0	0	110.7	Y312 L313 A318 L319 E320	Y312-Q316 PolarHBondContact O-N 2.8Å; L313-Q316 PolarHBondContact O-N 2.66Å; Q316-A318 VanDerWaalsContact C-N 3.27Å; Q316-A318 PolarHBondContact O-N 3.12Å; Q316-L319 WeakPolarHBondContact O-CA 3.23Å; Q316-L319 WeakPolarHBondContact O-CB 3.3Å; Q316-L319 PolarHBondContact O-N 3.17Å; Q316-E320 HydrophobicContact CG-CG 4.46Å; Q316-E320 VanDerWaalsContact CG-OE1 3.23Å; Q316-E320 WeakPolarHBondContact CG-OE1 3.46Å; Q316-E320 PolarHBondContact NE2-OE1 3.02Å; Q316-E320 WeakPolarHBondContact O-CG 3.36Å; Q316-E320 PolarHBondContact O-N 2.88Å
317	K	64	Low	52.1	Low	117 Å²	117	108.9 Å²	108.9	51%	0.509	55%	0.551	S	S	.	*	H	α-helix	trans	-60.2	-36.7	177.8	-166.7	173.6	-166.2	-80.8	0	112.4	L313 L319 E320 E321	L313-K317 WeakPolarHBondContact O-CB 3.44Å; L313-K317 PolarHBondContact O-N 3.32Å; K317-L319 VanDerWaalsContact C-N 3.29Å; K317-L319 PolarHBondContact O-N 3.13Å; K317-E320 PolarHBondContact O-N 3.27Å; K317-E321 HydrophobicContact CG-CG 4.34Å; K317-E321 IonicContact NZ-OE1 2.64Å; K317-E321 PolarHBondContact NZ-OE1 3.15Å; K317-E321 VanDerWaalsContact O-CB 3.3Å; K317-E321 WeakPolarHBondContact O-CB 3.47Å; K317-E321 VanDerWaalsContact O-CG 3.22Å; K317-E321 WeakPolarHBondContact O-CG 3.23Å; K317-E321 PolarHBondContact O-N 2.61Å
318	A	57.9	Low	52.1	Low	43 Å²	43	107.2 Å²	107.2	36%	0.355	55%	0.553	S	S	.	*	H	α-helix	trans	-67.2	-27.7	174.1	0	0	0	0	0	113.3	R314 Q316 M322	R314-A318 WeakPolarHBondContact O-CB 2.93Å; R314-A318 PolarHBondContact O-N 2.79Å; R314-A318 VanDerWaalsContact O-N 3.14Å; Q316-A318 VanDerWaalsContact C-N 3.27Å; Q316-A318 PolarHBondContact O-N 3.12Å; A318-M322 WeakPolarHBondContact O-CG 3.16Å; A318-M322 PolarHBondContact O-N 2.75Å
319	L	60	Low	51.6	Low	106 Å²	106	106.9 Å²	106.9	56%	0.555	55%	0.554	S	S	*	*	H	α-helix	trans	-76.5	-42.2	173.3	-170.7	66.1	0	0	0	110.8	S315 Q316 K317 M322 C323	S315-L319 PolarHBondContact O-N 2.77Å; Q316-L319 WeakPolarHBondContact O-CA 3.23Å; Q316-L319 WeakPolarHBondContact O-CB 3.3Å; Q316-L319 PolarHBondContact O-N 3.17Å; K317-L319 VanDerWaalsContact C-N 3.29Å; K317-L319 PolarHBondContact O-N 3.13Å; L319-M322 HydrophobicContact CD1-CE 3.93Å; L319-M322 PolarHBondContact O-N 2.96Å; L319-C323 PolarHBondContact O-N 2.75Å; L319-C323 PolarHBondContact O-SG 3.39Å; L319-C323 VanDerWaalsContact O-SG 3.4Å
320	E	63.9	Low	51.2	Low	104 Å²	104	105 Å²	105	49%	0.486	56%	0.556	S	S	.	*	H	α-helix	trans	-62.7	-39.3	174.1	-68.7	162.7	176.4	0	0	111.7	Q316 K317 C323 A324	Q316-E320 HydrophobicContact CG-CG 4.46Å; Q316-E320 VanDerWaalsContact CG-OE1 3.23Å; Q316-E320 WeakPolarHBondContact CG-OE1 3.46Å; Q316-E320 PolarHBondContact NE2-OE1 3.02Å; Q316-E320 WeakPolarHBondContact O-CG 3.36Å; Q316-E320 PolarHBondContact O-N 2.88Å; K317-E320 PolarHBondContact O-N 3.27Å; E320-C323 PolarHBondContact O-N 3.21Å; E320-A324 WeakPolarHBondContact O-CB 3.48Å; E320-A324 PolarHBondContact O-N 3.37Å
321	E	64.3	Low	50.4	Low	90 Å²	90	105.5 Å²	105.5	42%	0.421	57%	0.566	S	S	.	*	H	α-helix	trans	-63.8	-47.1	173.6	-77.1	166.2	167.8	0	0	111.7	K317 C323 A324 E325	K317-E321 HydrophobicContact CG-CG 4.34Å; K317-E321 IonicContact NZ-OE1 2.64Å; K317-E321 PolarHBondContact NZ-OE1 3.15Å; K317-E321 VanDerWaalsContact O-CB 3.3Å; K317-E321 WeakPolarHBondContact O-CB 3.47Å; K317-E321 VanDerWaalsContact O-CG 3.22Å; K317-E321 WeakPolarHBondContact O-CG 3.23Å; K317-E321 PolarHBondContact O-N 2.61Å; E321-C323 VanDerWaalsContact C-N 3.3Å; E321-C323 PolarHBondContact O-N 3.09Å; E321-A324 PolarHBondContact O-N 3.21Å; E321-A324 VanDerWaalsContact O-N 3.1Å; E321-E325 PolarHBondContact O-N 3.11Å
322	M	48.1	Very low	49.7	Very low	112 Å²	112	109.7 Å²	109.7	55%	0.552	59%	0.588	S	S	*	*	H	α-helix	trans	-63.1	-34.8	174.9	-71.9	-174.8	-55.9	0	0	112.7	A318 L319 S326	A318-M322 WeakPolarHBondContact O-CG 3.16Å; A318-M322 PolarHBondContact O-N 2.75Å; L319-M322 HydrophobicContact CD1-CE 3.93Å; L319-M322 PolarHBondContact O-N 2.96Å; M322-S326 PolarHBondContact O-N 2.92Å; M322-S326 PolarHBondContact O-OG 3.5Å
323	C	45.4	Very low	48.5	Very low	79 Å²	79	106.8 Å²	106.8	53%	0.534	59%	0.591	S	S	.	*	H	α-helix	trans	-71.1	-31.1	173.3	-72.3	0	0	0	0	112.8	L319 E320 E321 S326	L319-C323 PolarHBondContact O-N 2.75Å; L319-C323 PolarHBondContact O-SG 3.39Å; L319-C323 VanDerWaalsContact O-SG 3.4Å; E320-C323 PolarHBondContact O-N 3.21Å; E321-C323 VanDerWaalsContact C-N 3.3Å; E321-C323 PolarHBondContact O-N 3.09Å; C323-S326 WeakPolarHBondContact O-CB 3.36Å
324	A	47.2	Very low	47	Very low	59 Å²	59	108.2 Å²	108.2	49%	0.488	61%	0.607	S	S	.	*	H	α-helix	trans	-75.3	-42.4	175.9	0	0	0	0	0	112.5	E320 E321 S326 V327 A328	E320-A324 WeakPolarHBondContact O-CB 3.48Å; E320-A324 PolarHBondContact O-N 3.37Å; E321-A324 PolarHBondContact O-N 3.21Å; E321-A324 VanDerWaalsContact O-N 3.1Å; A324-S326 PolarHBondContact O-N 3.01Å; A324-V327 PolarHBondContact O-N 3.2Å; A324-A328 PolarHBondContact O-N 2.69Å
325	E	47.2	Very low	46.1	Very low	146 Å²	146	106.6 Å²	106.6	68%	0.682	62%	0.617	S	S	*	*	H	α-helix	trans	-63.1	-24.7	173.6	-70.7	179.4	138.3	0	0	111.8	E321 V327	E321-E325 PolarHBondContact O-N 3.11Å; E325-V327 PolarHBondContact O-N 2.66Å
326	S	43.7	Very low	45.1	Very low	99 Å²	99	112.3 Å²	112.3	69%	0.692	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	-6.5	171.9	-58.5	0	0	0	0	114.6	M322 C323 A324	M322-S326 PolarHBondContact O-N 2.92Å; M322-S326 PolarHBondContact O-OG 3.5Å; C323-S326 WeakPolarHBondContact O-CB 3.36Å; A324-S326 PolarHBondContact O-N 3.01Å
327	V	48.7	Very low	43.9	Very low	127 Å²	127	117.6 Å²	117.6	77%	0.77	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.5	-2.3	-174.8	-178.2	0	0	0	0	112.2	A324 E325	A324-V327 PolarHBondContact O-N 3.2Å; E325-V327 PolarHBondContact O-N 2.66Å
328	A	44.6	Very low	42.2	Very low	71 Å²	71	117 Å²	117	59%	0.587	67%	0.666	S	S	*	*			trans	-132.3	57.9	-167.8	0	0	0	0	0	114.5	A324 P330	A324-A328 PolarHBondContact O-N 2.69Å; A328-P330 WeakPolarHBondContact O-CD 3.11Å
329	E	34.6	Very low	40.9	Very low	161 Å²	161	122.5 Å²	122.5	75%	0.752	69%	0.689	S	S	*	*			trans	-106.5	89.5	170.9	-93.6	-75.9	175.7	0	0	111.6	I331	E329-I331 PolarHBondContact O-N 2.62Å
330	P	36.8	Very low	39.5	Very low	103 Å²	103	126.1 Å²	126.1	67%	0.669	70%	0.703	S	S	*	*			trans	-81	103	168.9	31.9	-31.7	0	0	0	110.3	A328 L332	A328-P330 WeakPolarHBondContact O-CD 3.11Å; P330-L332 PolarHBondContact O-N 2.86Å
331	I	35	Very low	37.7	Very low	143 Å²	143	124.7 Å²	124.7	73%	0.733	72%	0.716	S	S	*	*			trans	-62.7	98.6	-176.9	-54.9	174.4	0	0	0	111.3	E329 S333	E329-I331 PolarHBondContact O-N 2.62Å; I331-S333 VanDerWaalsContact C-N 3.33Å; I331-S333 PolarHBondContact O-N 3.17Å
332	L	31.8	Very low	35.8	Very low	173 Å²	173	124.1 Å²	124.1	91%	0.906	73%	0.734	S	S	*	*			trans	-77.5	79.8	173.8	-87.7	168.1	0	0	0	111.7	P330	P330-L332 PolarHBondContact O-N 2.86Å
333	S	28.9	Very low	35.5	Very low	99 Å²	99	124.6 Å²	124.6	69%	0.692	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-76.5	125	165.6	-63.7	0	0	0	0	110.8	I331	I331-S333 VanDerWaalsContact C-N 3.33Å; I331-S333 PolarHBondContact O-N 3.17Å
334	C	28.2	Very low	34.6	Very low	121 Å²	121	127.1 Å²	127.1	82%	0.818	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-78.2	147.8	163.9	-76	0	0	0	0	110.8
335	P	34.3	Very low	33.8	Very low	119 Å²	119	128.9 Å²	128.9	77%	0.773	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-76.2	150.4	-166.6	29.9	-36.2	0	0	0	114.1
336	K	30.3	Very low	32.8	Very low	203 Å²	203	130.4 Å²	130.4	88%	0.883	78%	0.779	S	S	*	*			trans	-104.8	125.3	153.3	-88.3	-175.8	171	-177.3	0	108.1
337	E	27.4	Very low	32.1	Very low	195 Å²	195	129.2 Å²	129.2	91%	0.911	78%	0.776	S	S	*	*			trans	-83.3	159.7	159.9	-65.8	-173.5	122.7	0	0	110.1
338	S	28.7	Very low	30.9	Very low	104 Å²	104	132.6 Å²	132.6	73%	0.727	78%	0.783	S	S	*	*			trans	-147.8	130.6	-161.8	59.6	0	0	0	0	114.3
339	L	29.5	Very low	30	Very low	159 Å²	159	132.3 Å²	132.3	83%	0.832	78%	0.781	S	S	*	*			trans	-133.2	108.3	156.8	-72.7	164.1	0	0	0	105.2
340	Q	31.9	Very low	30.8	Very low	182 Å²	182	126.8 Å²	126.8	85%	0.85	76%	0.759	S	S	*	*				79.7	117.9	59.9	-166.3	171.1	32.3	0	0	110.9
341	G	26.1	Very low	30.2	Very low	74 Å²	74	126.8 Å²	126.8	76%	0.763	75%	0.753	S	S	*	*			cis	-150.5	-161.4	3.6	0	0	0	0	0	114.2
342	G	23.3	Very low	29.8	Very low	78 Å²	78	125.7 Å²	125.7	80%	0.804	75%	0.753	S	S	*	*			trans	-90.6	-157.1	-176.5	0	0	0	0	0	115
343	P	42.4	Very low	29.6	Very low	121 Å²	121	121.8 Å²	121.8	79%	0.786	75%	0.746	S	S	*	*			cis	-137.1	159.2	18.7	41.7	-24.3	0	0	0	118.7
344	V	27	Very low	30.6	Very low	133 Å²	133	122 Å²	122	81%	0.806	75%	0.745	S	S	*	*			trans	30.6	120.5	137.8	-173.9	0	0	0	0	121
345	A	28.9	Very low	30.6	Very low	95 Å²	95	123 Å²	123	79%	0.785	74%	0.742	S	S	*	*				-166.1	153.2	127	0	0	0	0	0	115
346	H	26.8	Very low	30.2	Very low	179 Å²	179	126 Å²	126	83%	0.829	75%	0.745	S	S	*	*			trans	-47.3	169.2	170.7	-64.6	-88.3	0	0	0	117.6
347	A	28.7	Very low	29.9	Very low	74 Å²	74	120.4 Å²	120.4	61%	0.612	74%	0.738	S	S	*	*			cis	-172.9	167	-20.7	0	0	0	0	0	111.2
348	E	24.2	Very low	30.5	Very low	197 Å²	197	116.3 Å²	116.3	92%	0.921	73%	0.728	S	S	*	*			trans	62.4	175.2	158.7	-70.9	179.9	116.6	0	0	120.1
349	A	24.9	Very low	30.4	Very low	66 Å²	66	119.5 Å²	119.5	55%	0.545	73%	0.731	S	S	.	*			trans	-168.2	-163.6	-169	0	0	0	0	0	107.7	L714	A349-L714 HydrophobicContact CB-CD1 4.48Å
350	P	51.6	Low	30.4	Very low	45 Å²	45	115.9 Å²	115.9	29%	0.292	73%	0.725	S	S	.	*			cis	-121.5	-158	-29.9	35.8	-15.9	0	0	0	109.8	L714 K715	P350-L714 HydrophobicContact CB-CB 4.42Å; P350-L714 HydrophobicContact CG-CB 4.24Å; P350-L714 WeakPolarHBondContact CG-O 3.4Å; P350-K715 VanDerWaalsContact CD-NZ 3.28Å; P350-K715 HydrophobicContact CG-CD 3.89Å; P350-K715 HydrophobicContact CG-CG 4.05Å
351	D	24	Very low	30.6	Very low	103 Å²	103	112.8 Å²	112.8	55%	0.551	72%	0.72	S	S	*	*				165.9	142.3	115.6	-91.2	-50	0	0	0	114.7	K715	D351-K715 IonicContact OD1-NZ 2.68Å; D351-K715 IonicContact OD2-NZ 2.89Å; D351-K715 PolarHBondContact OD2-NZ 3.14Å
352	V	28	Very low	30.6	Very low	119 Å²	119	116 Å²	116	72%	0.721	72%	0.724	S	S	*	*			trans	47.3	103.5	145.6	-173	0	0	0	0	122.1
353	A	25.8	Very low	30.8	Very low	92 Å²	92	115.2 Å²	115.2	76%	0.76	72%	0.716	S	S	*	*				48.8	-173.1	122	0	0	0	0	0	121.7
354	P	51.5	Low	30	Very low	104 Å²	104	115 Å²	115	68%	0.675	72%	0.718	S	S	*	*				-122.9	176.8	-79.7	39.5	-25.6	0	0	0	113.5
355	D	27.2	Very low	30	Very low	142 Å²	142	114 Å²	114	76%	0.759	72%	0.717	S	S	*	*				170.4	156.1	109.3	-103	-31	0	0	0	115.5
356	E	26	Very low	31.1	Very low	180 Å²	180	114.5 Å²	114.5	84%	0.841	71%	0.712	S	S	*	*			trans	51.8	159	151.7	-72.1	-76.1	72.8	0	0	123.2
357	A	23.7	Very low	31	Very low	87 Å²	87	114.3 Å²	114.3	72%	0.719	72%	0.716	S	S	*	*			trans	-109.2	-147	-176.4	0	0	0	0	0	110.1
358	P	40.5	Very low	30.7	Very low	109 Å²	109	114.8 Å²	114.8	71%	0.708	73%	0.728	S	S	*	*			cis	-139.7	-166	11.4	41.1	-18	0	0	0	116
359	E	25.7	Very low	30.7	Very low	170 Å²	170	115.4 Å²	115.4	79%	0.794	72%	0.722	S	S	*	*			trans	62.4	110.6	163.3	-54.7	-48.2	80.8	0	0	121.1
360	A	29.6	Very low	30.7	Very low	84 Å²	84	118.7 Å²	118.7	69%	0.694	73%	0.726	S	S	*	*			trans	-79.5	177.3	145.1	0	0	0	0	0	110
361	P	36.8	Very low	29.4	Very low	117 Å²	117	124.7 Å²	124.7	76%	0.76	75%	0.75	S	S	*	*				-150.1	166.3	90.8	37.4	-19.4	0	0	0	116.8
362	V	26.9	Very low	29.3	Very low	140 Å²	140	125.3 Å²	125.3	85%	0.848	76%	0.761	S	S	*	*			trans	15.2	133	138.7	-170	0	0	0	0	117.9
363	G	26.5	Very low	29.1	Very low	62 Å²	62	125.7 Å²	125.7	64%	0.639	77%	0.769	S	S	*	*			cis	152.6	-152.1	5.4	0	0	0	0	0	111.9
364	S	25.4	Very low	29.1	Very low	116 Å²	116	130.7 Å²	130.7	81%	0.811	78%	0.777	S	S	*	*			trans	63.1	107	169.7	32.6	0	0	0	0	120
365	S	28.4	Very low	27.9	Very low	112 Å²	112	130.2 Å²	130.2	78%	0.783	78%	0.782	S	S	*	*			trans	-29.5	176.2	135.8	-32	0	0	0	0	117
366	P	50.5	Low	27.8	Very low	107 Å²	107	127.3 Å²	127.3	70%	0.695	78%	0.778	S	S	*	*			cis	-135.1	-159.2	-38.9	32.6	-10.8	0	0	0	111.6
367	L	25.2	Very low	27.8	Very low	175 Å²	175	126 Å²	126	92%	0.916	78%	0.776	S	S	*	*			trans	74.5	132.5	173.7	-51.3	170.1	0	0	0	114.5
368	G	21.9	Very low	27.9	Very low	83 Å²	83	125.3 Å²	125.3	86%	0.856	77%	0.771	S	S	*	*			trans	172.8	98.4	-176.1	0	0	0	0	0	113.8
369	R	24.6	Very low	27.4	Very low	210 Å²	210	128 Å²	128	79%	0.792	77%	0.774	S	S	*	*			trans	-51.1	160.5	170.8	-91.2	160	149.7	-137.3	3.6	117.9
370	E	25.3	Very low	27.8	Very low	136 Å²	136	127.8 Å²	127.8	64%	0.636	78%	0.778	S	S	*	*				104.2	137.3	128.2	-84.9	149.9	-178.4	0	0	123.4
371	E	23.6	Very low	28	Very low	170 Å²	170	128.9 Å²	128.9	79%	0.794	78%	0.777	S	S	*	*			trans	60.7	105	158.2	-62.7	-166.9	91	0	0	124.6
372	C	21.8	Very low	27.5	Very low	116 Å²	116	128.6 Å²	128.6	78%	0.784	78%	0.778	S	S	*	*				50.7	125.7	114.3	-61	0	0	0	0	122.6
373	S	25	Very low	28.2	Very low	127 Å²	127	127.8 Å²	127.8	89%	0.888	78%	0.776	S	S	*	*			trans	-146.1	160.4	133.1	-62.3	0	0	0	0	109.3
374	E	25.9	Very low	29.3	Very low	197 Å²	197	130.3 Å²	130.3	92%	0.921	78%	0.781	S	S	*	*			trans	-84.2	175.2	-159	-64.6	165.7	87.5	0	0	117.1
375	A	25.8	Very low	29.9	Very low	94 Å²	94	131 Å²	131	78%	0.777	78%	0.783	S	S	*	*			trans	83	96.4	148.1	0	0	0	0	0	120.5
376	A	25.8	Very low	29.8	Very low	82 Å²	82	128.2 Å²	128.2	68%	0.678	77%	0.771	S	S	*	*				60.4	107.5	116.1	0	0	0	0	0	120.8
377	D	25.3	Very low	28.8	Very low	152 Å²	152	131.6 Å²	131.6	81%	0.813	78%	0.778	S	S	*	*				79.7	148.2	117.5	-74.2	-58.9	0	0	0	120.5
378	A	26.7	Very low	29	Very low	73 Å²	73	132 Å²	132	60%	0.603	78%	0.775	S	S	*	*			cis	-155.7	168.8	2.1	0	0	0	0	0	113.3
379	Q	28.8	Very low	29.4	Very low	165 Å²	165	136.5 Å²	136.5	77%	0.771	77%	0.774	S	S	*	*			trans	61.8	105.4	152.7	-92.7	62.5	-46	0	0	121.5
380	L	33.7	Very low	29.7	Very low	166 Å²	166	133.9 Å²	133.9	87%	0.869	77%	0.77	S	S	*	*				-60	149.3	125.9	-81.2	158.2	0	0	0	109
381	P	34.2	Very low	30.2	Very low	106 Å²	106	135.7 Å²	135.7	69%	0.688	78%	0.779	S	S	*	*				-160.8	165.5	74.4	44	-23.8	0	0	0	119.3
382	S	27.1	Very low	30.5	Very low	112 Å²	112	132.8 Å²	132.8	78%	0.783	77%	0.769	S	S	*	*			trans	52.8	163.3	131.9	-60.1	0	0	0	0	123.3
383	P	40.1	Very low	31.1	Very low	123 Å²	123	133.9 Å²	133.9	80%	0.799	77%	0.766	S	S	*	*			trans	-117.6	-138.2	-147.7	35.3	-15.6	0	0	0	117
384	P	50.5	Low	31.1	Very low	114 Å²	114	136.8 Å²	136.8	74%	0.74	76%	0.763	S	S	*	*				-92.5	166.4	-118	42.7	-32.7	0	0	0	115.6
385	P	37.8	Very low	31.4	Very low	131 Å²	131	132.4 Å²	132.4	85%	0.851	75%	0.752	S	S	*	*				-136.5	-175.3	99.9	40.3	-28.7	0	0	0	110.8
386	G	27	Very low	31.6	Very low	53 Å²	53	135.5 Å²	135.5	55%	0.546	75%	0.75	S	S	.	*			cis	164.8	179.4	5.8	0	0	0	0	0	108.4
387	H	29.3	Very low	32.1	Very low	178 Å²	178	137 Å²	137	82%	0.824	75%	0.752	S	S	*	*			trans	65.5	107.2	-174.5	-45.2	-78.4	0	0	0	112.8
388	Q	28.4	Very low	32.4	Very low	185 Å²	185	137.3 Å²	137.3	86%	0.864	75%	0.749	S	S	*	*				52.2	98.5	52.1	-56.5	-176.4	-20.3	0	0	113.5
389	E	30.5	Very low	32.9	Very low	177 Å²	177	138.2 Å²	138.2	83%	0.827	75%	0.749	S	S	*	*				-132.9	138.7	115.9	-151.4	178.2	125.3	0	0	108.6
390	E	32.3	Very low	33.3	Very low	154 Å²	154	136.2 Å²	136.2	72%	0.72	75%	0.75	S	S	*	*			trans	-118.2	120	-172.3	-175.7	-169.9	134.7	0	0	109.4	N392	E390-N392 PolarHBondContact OE1-ND2 3.22Å
391	Q	34	Very low	33.5	Very low	175 Å²	175	136.4 Å²	136.4	82%	0.818	75%	0.746	S	S	*	*			trans	-129.9	143.9	164.2	-64.9	-163.6	22.1	0	0	110.4
392	N	31.4	Very low	33.6	Very low	109 Å²	109	140.3 Å²	140.3	58%	0.583	76%	0.755	S	S	*	*			trans	-132.3	134.9	-132.5	-176.4	-75.4	0	0	0	112.1	E390	E390-N392 PolarHBondContact OE1-ND2 3.22Å
393	L	33	Very low	34.1	Very low	139 Å²	139	139.8 Å²	139.8	73%	0.728	76%	0.758	S	S	*	*			trans	50.8	122.1	167.4	-69.5	172.4	0	0	0	119.7	P395	L393-P395 HydrophobicContact CD2-CG 4.25Å
394	K	26.1	Very low	34.3	Very low	187 Å²	187	137.1 Å²	137.1	81%	0.813	75%	0.753	S	S	*	*				-159.6	108.4	104.6	-155.7	148.3	-174.1	168.9	0	114
395	P	32.8	Very low	34.3	Very low	106 Å²	106	140 Å²	140	69%	0.688	76%	0.756	S	S	*	*			trans	-73.3	140.1	165.6	-15	30.6	0	0	0	111.4	L393	L393-P395 HydrophobicContact CD2-CG 4.25Å
396	Q	29.1	Very low	35.9	Very low	159 Å²	159	141.9 Å²	141.9	74%	0.743	75%	0.751	S	S	*	*			trans	-114.3	154.2	162.1	-78.9	-76.4	-1.2	0	0	108.5
397	P	36.1	Very low	38.4	Very low	112 Å²	112	145.8 Å²	145.8	73%	0.727	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-85.8	124.5	-163.3	32.1	-33.7	0	0	0	113.8
398	E	31.3	Very low	40.9	Very low	159 Å²	159	141 Å²	141	74%	0.743	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-68.5	140.8	165.6	-79.3	-74.1	113	0	0	111.4
399	P	36.6	Very low	43.4	Very low	92 Å²	92	134.8 Å²	134.8	60%	0.597	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-72.3	157.4	-179.7	29.3	-34.5	0	0	0	113.2	H401	P399-H401 PolarHBondContact O-N 3.06Å; P399-H401 VanDerWaalsContact O-N 3.14Å
400	P	39	Very low	46.1	Very low	124 Å²	124	126.5 Å²	126.5	81%	0.805	67%	0.668	S	S	*	*			trans	-68.3	113.7	-172.1	26.6	-34.8	0	0	0	112.6	Q402	P400-Q402 PolarHBondContact O-N 3.41Å
401	H	36.3	Very low	48.5	Very low	170 Å²	170	127.8 Å²	127.8	79%	0.787	67%	0.674	S	S	*	*			trans	-60.6	114.8	174.4	-84.8	67.6	0	0	0	111.4	P399	P399-H401 PolarHBondContact O-N 3.06Å; P399-H401 VanDerWaalsContact O-N 3.14Å
402	Q	36.8	Very low	50.7	Low	187 Å²	187	125 Å²	125	87%	0.874	66%	0.664	S	S	*	*			trans	-67	133.7	171.7	-65.1	-177	1.6	0	0	110.3	P400 G404	P400-Q402 PolarHBondContact O-N 3.41Å; Q402-G404 VanDerWaalsContact C-N 3.29Å; Q402-G404 PolarHBondContact O-N 3.11Å
403	A	37.9	Very low	53.3	Low	102 Å²	102	122 Å²	122	84%	0.843	65%	0.651	S	S	*	*			trans	-72.2	78.1	-177.6	0	0	0	0	0	112.3	H405	A403-H405 PolarHBondContact O-N 2.59Å; A403-H405 VanDerWaalsContact O-N 3.16Å
404	G	43.2	Very low	55.7	Low	67 Å²	67	118 Å²	118	69%	0.691	64%	0.643	S	S	*	*			trans	-60.1	114.6	177.9	0	0	0	0	0	112.1	Q402 K406	Q402-G404 VanDerWaalsContact C-N 3.29Å; Q402-G404 PolarHBondContact O-N 3.11Å; G404-K406 PolarHBondContact O-N 2.79Å
405	H	52.3	Low	58.4	Low	174 Å²	174	114.2 Å²	114.2	81%	0.806	63%	0.627	S	S	*	*			trans	-57.9	105.3	170.2	-82.3	-69.1	0	0	0	109.8	A403 Q407	A403-H405 PolarHBondContact O-N 2.59Å; A403-H405 VanDerWaalsContact O-N 3.16Å; H405-Q407 WeakPolarHBondContact O-CG 3.3Å; H405-Q407 PolarHBondContact O-N 3.18Å
406	K	70.8	Confident	60.9	Low	170 Å²	170	114 Å²	114	74%	0.739	62%	0.619	S	S	*	*			trans	-59.7	113.6	175.4	-74.8	-175.7	176.5	178.6	0	109.9	G404 Y408	G404-K406 PolarHBondContact O-N 2.79Å; K406-Y408 HydrophobicContact CB-CE2 4.26Å; K406-Y408 WeakPolarHBondContact O-CD2 3.35Å; K406-Y408 WeakPolarHBondContact O-CE2 3.4Å
407	Q	78.9	Confident	63.7	Low	135 Å²	135	108.8 Å²	108.8	63%	0.631	59%	0.593	S	S	*	*			trans	-99.3	140.2	176.9	-65.9	-175.6	23.3	0	0	109.6	H405 I416	H405-Q407 WeakPolarHBondContact O-CG 3.3Å; H405-Q407 PolarHBondContact O-N 3.18Å; Q407-I416 HydrophobicContact CB-CG2 3.67Å; Q407-I416 HydrophobicContact CG-CG2 4.29Å
408	Y	81.7	Confident	66	Low	79 Å²	79	111.8 Å²	111.8	31%	0.31	60%	0.595	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.7	103.2	-170.2	-63.6	-89.8	0	0	0	110.1	K406 F417 P420	K406-Y408 HydrophobicContact CB-CE2 4.26Å; K406-Y408 WeakPolarHBondContact O-CD2 3.35Å; K406-Y408 WeakPolarHBondContact O-CE2 3.4Å; Y408-F417 PolarHBondContact N-O 3.04Å; Y408-F417 PolarHBondContact O-N 2.95Å; Y408-P420 HydrophobicContact CD1-CB 3.89Å; Y408-P420 HydrophobicContact CE1-CB 3.76Å; Y408-P420 HydrophobicContact CE1-CG 4.18Å; Y408-P420 HydrophobicContact CE2-CG 4.49Å; Y408-P420 HydrophobicContact CG-CB 4.37Å
409	C	81.8	Confident	68.5	Low	53 Å²	53	109.4 Å²	109.4	36%	0.358	58%	0.584	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-86.9	143.8	-177.7	-166	0	0	0	0	113	K415 I416 L423	C409-K415 CarbonylContact C-O 3.54Å; C409-I416 HydrophobicContact CB-CG1 4.45Å; C409-L423 WeakPolarHBondContact O-CD2 3.43Å
410	C	87.2	Confident	70.7	Confident	4 Å²	4	108.2 Å²	108.2	3%	0.027	58%	0.576	C	S	.	*			trans	-92.4	106.2	170.7	-170.6	0	0	0	0	111	L412 C413 G414 K415 F417 L423	C410-L412 PolarHBondContact O-N 3.26Å; C410-C413 PolarHBondContact O-N 2.64Å; C410-G414 PolarHBondContact O-N 3.05Å; C410-K415 HydrophobicContact CB-CB 4.49Å; C410-K415 PolarHBondContact N-O 2.89Å; C410-F417 HydrophobicContact CB-CE2 4.29Å; C410-L423 HydrophobicContact CB-CD1 3.49Å; C410-L423 VanDerWaalsContact CB-CD1 3.49Å
411	Q	81.5	Confident	72.7	Confident	180 Å²	180	106 Å²	106	84%	0.841	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.2	-21.7	-178.2	-53.6	-62.9	22.9	0	0	114.1
412	L	81.3	Confident	74.9	Confident	118 Å²	118	101.4 Å²	101.4	62%	0.618	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-11.6	179.1	-60.9	178.3	0	0	0	114.4	C410 H430	C410-L412 PolarHBondContact O-N 3.26Å; L412-H430 HydrophobicContact CD1-CB 3.69Å
413	C	85.6	Confident	77.2	Confident	46 Å²	46	93.4 Å²	93.4	31%	0.311	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-159.5	14.9	-180	69.7	0	0	0	0	116.5	C410 K415 H426 H430	C410-C413 PolarHBondContact O-N 2.64Å; C413-K415 PolarHBondContact O-N 3.01Å; C413-K415 VanDerWaalsContact O-N 3.07Å; C413-H426 PolarHBondContact SG-NE2 3.05Å; C413-H430 WeakPolarHBondContact CB-NE2 3.37Å; C413-H430 PolarHBondContact SG-NE2 3.39Å
414	G	82.8	Confident	79.2	Confident	53 Å²	53	92.1 Å²	92.1	55%	0.546	49%	0.485	S	S	.	.			trans	67.8	3.1	177.3	0	0	0	0	0	116.1	C410 I416	C410-G414 PolarHBondContact O-N 3.05Å; G414-I416 PolarHBondContact O-N 3.33Å
415	K	84.5	Confident	81.1	Confident	109 Å²	109	91.3 Å²	91.3	47%	0.474	46%	0.464	S	S	.	.			trans	-75.2	129.2	-175.3	-71.7	176	-165.2	145.6	0	111.8	C409 C410 C413 F417	C409-K415 CarbonylContact C-O 3.54Å; C410-K415 HydrophobicContact CB-CB 4.49Å; C410-K415 PolarHBondContact N-O 2.89Å; C413-K415 PolarHBondContact O-N 3.01Å; C413-K415 VanDerWaalsContact O-N 3.07Å; K415-F417 HydrophobicContact CB-CE2 3.63Å; K415-F417 HydrophobicContact CB-CZ 3.91Å; K415-F417 WeakPolarHBondContact O-CD2 3.22Å; K415-F417 VanDerWaalsContact O-CE2 3.27Å; K415-F417 WeakPolarHBondContact O-CE2 3.49Å
416	I	84.7	Confident	82.6	Confident	102 Å²	102	84.1 Å²	84.1	52%	0.523	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	133.7	-175.9	-55.4	177.3	0	0	0	110.7	Q407 C409 G414	Q407-I416 HydrophobicContact CB-CG2 3.67Å; Q407-I416 HydrophobicContact CG-CG2 4.29Å; C409-I416 HydrophobicContact CB-CG1 4.45Å; G414-I416 PolarHBondContact O-N 3.33Å
417	F	87.5	Confident	83.1	Confident	48 Å²	48	80.2 Å²	80.2	21%	0.211	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	146.9	-178.6	-61	-89.8	0	0	0	111.5	Y408 C410 K415 H419 N422 L423 H426	Y408-F417 PolarHBondContact N-O 3.04Å; Y408-F417 PolarHBondContact O-N 2.95Å; C410-F417 HydrophobicContact CB-CE2 4.29Å; K415-F417 HydrophobicContact CB-CE2 3.63Å; K415-F417 HydrophobicContact CB-CZ 3.91Å; K415-F417 WeakPolarHBondContact O-CD2 3.22Å; K415-F417 VanDerWaalsContact O-CE2 3.27Å; K415-F417 WeakPolarHBondContact O-CE2 3.49Å; F417-H419 VanDerWaalsContact C-N 3.33Å; F417-H419 PolarHBondContact O-N 2.9Å; F417-N422 HydrophobicContact CB-CB 4.22Å; F417-N422 HydrophobicContact CD1-CB 3.93Å; F417-N422 HydrophobicContact CG-CB 4.38Å; F417-L423 HydrophobicContact CB-CB 4.22Å; F417-L423 HydrophobicContact CD2-CB 4.01Å; F417-L423 HydrophobicContact CD2-CD1 3.93Å; F417-L423 HydrophobicContact CE2-CD1 4.2Å; F417-L423 HydrophobicContact CG-CB 4.25Å; F417-H426 HydrophobicContact CE1-CB 4.03Å; F417-H426 HydrophobicContact CE2-CB 3.98Å; F417-H426 AromaticContact CE2-CD2 3.32Å; F417-H426 WeakPolarHBondContact CE2-CD2 3.47Å; F417-H426 AromaticContact CE2-CG 3.85Å; F417-H426 HydrophobicContact CZ-CB 3.54Å; F417-H426 AromaticContact CZ-CD2 3.27Å; F417-H426 WeakPolarHBondContact CZ-CD2 3.47Å; F417-H426 AromaticContact CZ-CG 3.39Å
418	K	84.3	Confident	83.3	Confident	176 Å²	176	77.2 Å²	77.2	77%	0.765	40%	0.397	S	S	*	.	S	Bend	trans	-77.8	-13.3	179.4	-62.6	-169.2	176.5	-168.7	0	114.7
419	H	83.6	Confident	83.2	Confident	108 Å²	108	77.2 Å²	77.2	50%	0.5	41%	0.408	S	S	.	.	S	Bend	trans	-143.7	146.5	-177.3	-59.7	-61.6	0	0	0	110.3	F417 S421 N422 L423	F417-H419 VanDerWaalsContact C-N 3.33Å; F417-H419 PolarHBondContact O-N 2.9Å; H419-S421 VanDerWaalsContact C-N 3.32Å; H419-S421 PolarHBondContact O-N 3.1Å; H419-N422 PolarHBondContact O-N 3.37Å; H419-L423 PolarHBondContact O-N 2.79Å
420	P	82.4	Confident	83.2	Confident	67 Å²	67	79 Å²	79	44%	0.435	41%	0.411	S	S	.	.	H	α-helix	trans	-66.6	-34.4	-177.6	26.3	-32.4	0	0	0	111.9	Y408 N422 L423 E424	Y408-P420 HydrophobicContact CD1-CB 3.89Å; Y408-P420 HydrophobicContact CE1-CB 3.76Å; Y408-P420 HydrophobicContact CE1-CG 4.18Å; Y408-P420 HydrophobicContact CE2-CG 4.49Å; Y408-P420 HydrophobicContact CG-CB 4.37Å; P420-N422 VanDerWaalsContact C-N 3.27Å; P420-N422 PolarHBondContact O-N 3.48Å; P420-L423 WeakPolarHBondContact O-CB 3.5Å; P420-L423 PolarHBondContact O-N 3.36Å; P420-L423 VanDerWaalsContact O-N 3.16Å; P420-E424 WeakPolarHBondContact O-CB 3.41Å; P420-E424 PolarHBondContact O-N 3.37Å
421	S	82.1	Confident	82.7	Confident	79 Å²	79	82.8 Å²	82.8	55%	0.552	43%	0.434	S	S	*	.	H	α-helix	trans	-59	-35.5	175.2	50.8	0	0	0	0	113.4	H419 L425	H419-S421 VanDerWaalsContact C-N 3.32Å; H419-S421 PolarHBondContact O-N 3.1Å; S421-L425 VanDerWaalsContact O-CB 3.26Å; S421-L425 WeakPolarHBondContact O-CB 3.22Å; S421-L425 PolarHBondContact O-N 3.23Å
422	N	82.1	Confident	82.5	Confident	72 Å²	72	75.9 Å²	75.9	39%	0.385	41%	0.411	S	S	.	.	H	α-helix	trans	-75.5	-35.7	176.4	-72.4	-30.4	0	0	0	112.1	F417 H419 P420 H426	F417-N422 HydrophobicContact CB-CB 4.22Å; F417-N422 HydrophobicContact CD1-CB 3.93Å; F417-N422 HydrophobicContact CG-CB 4.38Å; H419-N422 PolarHBondContact O-N 3.37Å; P420-N422 VanDerWaalsContact C-N 3.27Å; P420-N422 PolarHBondContact O-N 3.48Å; N422-H426 WeakPolarHBondContact O-CB 3.12Å; N422-H426 PolarHBondContact O-N 3.4Å
423	L	84.7	Confident	82.2	Confident	19 Å²	19	74.5 Å²	74.5	10%	0.099	40%	0.402	C	S	.	.	H	α-helix	trans	-63.8	-45.2	170.2	170.3	60.8	0	0	0	110.8	C409 C410 F417 H419 P420 H426 K427	C409-L423 WeakPolarHBondContact O-CD2 3.43Å; C410-L423 HydrophobicContact CB-CD1 3.49Å; C410-L423 VanDerWaalsContact CB-CD1 3.49Å; F417-L423 HydrophobicContact CB-CB 4.22Å; F417-L423 HydrophobicContact CD2-CB 4.01Å; F417-L423 HydrophobicContact CD2-CD1 3.93Å; F417-L423 HydrophobicContact CE2-CD1 4.2Å; F417-L423 HydrophobicContact CG-CB 4.25Å; H419-L423 PolarHBondContact O-N 2.79Å; P420-L423 WeakPolarHBondContact O-CB 3.5Å; P420-L423 PolarHBondContact O-N 3.36Å; P420-L423 VanDerWaalsContact O-N 3.16Å; L423-H426 CarbonylContact O-C 3.48Å; L423-H426 WeakPolarHBondContact O-CA 3.48Å; L423-H426 WeakPolarHBondContact O-CB 3.16Å; L423-H426 PolarHBondContact O-N 3.43Å; L423-K427 HydrophobicContact CD1-CG 4.47Å; L423-K427 PolarHBondContact O-N 3.24Å
424	E	80.8	Confident	81.9	Confident	76 Å²	76	77.9 Å²	77.9	36%	0.355	41%	0.411	S	S	.	.	H	α-helix	trans	-65.6	-44.8	-177.6	-163.1	54.7	-131.7	0	0	111.8	P420 H426 K427 R428	P420-E424 WeakPolarHBondContact O-CB 3.41Å; P420-E424 PolarHBondContact O-N 3.37Å; E424-H426 PolarHBondContact O-N 2.88Å; E424-K427 WeakPolarHBondContact O-CB 3.38Å; E424-K427 PolarHBondContact O-N 2.85Å; E424-K427 VanDerWaalsContact O-N 3.14Å; E424-K427 IonicContact OE1-NZ 2.67Å; E424-K427 WeakPolarHBondContact OE2-CD 3.49Å; E424-K427 VanDerWaalsContact OE2-CE 3.31Å; E424-K427 WeakPolarHBondContact OE2-CE 3.44Å; E424-K427 IonicContact OE2-NZ 3.09Å; E424-K427 PolarHBondContact OE2-NZ 3.42Å; E424-R428 PolarHBondContact O-N 3.18Å
425	L	82.5	Confident	81.6	Confident	49 Å²	49	78.9 Å²	78.9	26%	0.257	41%	0.408	S	S	.	.	H	α-helix	trans	-56.7	-33.4	168.7	171.4	59.3	0	0	0	112.6	S421 Q447	S421-L425 VanDerWaalsContact O-CB 3.26Å; S421-L425 WeakPolarHBondContact O-CB 3.22Å; S421-L425 PolarHBondContact O-N 3.23Å; L425-Q447 HydrophobicContact CD1-CG 3.43Å; L425-Q447 VanDerWaalsContact CD1-CG 3.43Å; L425-Q447 HydrophobicContact CD2-CG 4.15Å; L425-Q447 HydrophobicContact CG-CG 4.44Å
426	H	83.2	Confident	81.4	Confident	24 Å²	24	76.2 Å²	76.2	11%	0.111	40%	0.396	C	S	.	.	H	α-helix	trans	-76	-36.7	175.2	179.5	43.1	0	0	0	113	C413 F417 N422 L423 E424 R428 S429 H430	C413-H426 PolarHBondContact SG-NE2 3.05Å; F417-H426 HydrophobicContact CE1-CB 4.03Å; F417-H426 HydrophobicContact CE2-CB 3.98Å; F417-H426 AromaticContact CE2-CD2 3.32Å; F417-H426 WeakPolarHBondContact CE2-CD2 3.47Å; F417-H426 AromaticContact CE2-CG 3.85Å; F417-H426 HydrophobicContact CZ-CB 3.54Å; F417-H426 AromaticContact CZ-CD2 3.27Å; F417-H426 WeakPolarHBondContact CZ-CD2 3.47Å; F417-H426 AromaticContact CZ-CG 3.39Å; N422-H426 WeakPolarHBondContact O-CB 3.12Å; N422-H426 PolarHBondContact O-N 3.4Å; L423-H426 CarbonylContact O-C 3.48Å; L423-H426 WeakPolarHBondContact O-CA 3.48Å; L423-H426 WeakPolarHBondContact O-CB 3.16Å; L423-H426 PolarHBondContact O-N 3.43Å; E424-H426 PolarHBondContact O-N 2.88Å; H426-R428 PolarHBondContact O-N 2.93Å; H426-S429 PolarHBondContact CE1-OG 3.06Å; H426-S429 PolarHBondContact ND1-OG 3.39Å; H426-S429 WeakPolarHBondContact O-CA 3.24Å; H426-S429 WeakPolarHBondContact O-CB 3.22Å; H426-S429 PolarHBondContact O-N 3.48Å; H426-S429 PolarHBondContact O-OG 2.85Å; H426-H430 AromaticContact CE1-CD2 3.94Å; H426-H430 AromaticContact NE2-CD2 3.95Å
427	K	82.5	Confident	81.3	Confident	87 Å²	87	76.2 Å²	76.2	38%	0.378	39%	0.394	S	S	.	.	H	α-helix	trans	-54.8	-40.7	172.8	-67.7	-175.8	-165.2	160.1	0	111.7	L423 E424 S429 H430 T431	L423-K427 HydrophobicContact CD1-CG 4.47Å; L423-K427 PolarHBondContact O-N 3.24Å; E424-K427 WeakPolarHBondContact O-CB 3.38Å; E424-K427 PolarHBondContact O-N 2.85Å; E424-K427 VanDerWaalsContact O-N 3.14Å; E424-K427 IonicContact OE1-NZ 2.67Å; E424-K427 WeakPolarHBondContact OE2-CD 3.49Å; E424-K427 VanDerWaalsContact OE2-CE 3.31Å; E424-K427 WeakPolarHBondContact OE2-CE 3.44Å; E424-K427 IonicContact OE2-NZ 3.09Å; E424-K427 PolarHBondContact OE2-NZ 3.42Å; K427-S429 PolarHBondContact O-N 2.61Å; K427-S429 VanDerWaalsContact O-N 3.07Å; K427-H430 WeakPolarHBondContact O-CA 3.49Å; K427-H430 WeakPolarHBondContact O-CB 3.48Å; K427-H430 PolarHBondContact O-N 2.58Å; K427-T431 PolarHBondContact O-N 2.83Å
428	R	81.9	Confident	81.2	Confident	72 Å²	72	74 Å²	74	27%	0.272	38%	0.384	S	S	.	.	H	α-helix	trans	-59.1	-18.6	173.7	-64.7	-177.1	-178.3	158.6	4.9	114.7	E424 H426 G432 E433	E424-R428 PolarHBondContact O-N 3.18Å; H426-R428 PolarHBondContact O-N 2.93Å; R428-G432 CarbonylContact O-C 3.31Å; R428-G432 WeakPolarHBondContact O-CA 3.44Å; R428-G432 PolarHBondContact O-N 3.12Å; R428-G432 VanDerWaalsContact O-N 3.09Å; R428-E433 HydrophobicContact CB-CB 4.15Å; R428-E433 HydrophobicContact CG-CB 4.01Å; R428-E433 IonicContact NE-OE2 3.91Å; R428-E433 PolarHBondContact O-N 3.33Å
429	S	79.9	Confident	80.9	Confident	79 Å²	79	73 Å²	73	55%	0.552	39%	0.388	S	S	*	.	H	α-helix	trans	-82.6	-13.7	171.5	72.5	0	0	0	0	114.1	H426 K427	H426-S429 PolarHBondContact CE1-OG 3.06Å; H426-S429 PolarHBondContact ND1-OG 3.39Å; H426-S429 WeakPolarHBondContact O-CA 3.24Å; H426-S429 WeakPolarHBondContact O-CB 3.22Å; H426-S429 PolarHBondContact O-N 3.48Å; H426-S429 PolarHBondContact O-OG 2.85Å; K427-S429 PolarHBondContact O-N 2.61Å; K427-S429 VanDerWaalsContact O-N 3.07Å
430	H	81.3	Confident	80.8	Confident	91 Å²	91	72.6 Å²	72.6	42%	0.421	39%	0.392	S	S	.	.	H	α-helix	trans	-92.3	-48	169.1	-65.4	-75.8	0	0	0	111.8	L412 C413 H426 K427 G432	L412-H430 HydrophobicContact CD1-CB 3.69Å; C413-H430 WeakPolarHBondContact CB-NE2 3.37Å; C413-H430 PolarHBondContact SG-NE2 3.39Å; H426-H430 AromaticContact CE1-CD2 3.94Å; H426-H430 AromaticContact NE2-CD2 3.95Å; K427-H430 WeakPolarHBondContact O-CA 3.49Å; K427-H430 WeakPolarHBondContact O-CB 3.48Å; K427-H430 PolarHBondContact O-N 2.58Å; H430-G432 PolarHBondContact O-N 3.3Å
431	T	77.9	Confident	80.8	Confident	84 Å²	84	71.5 Å²	71.5	52%	0.515	39%	0.386	S	S	.	.	H	α-helix	trans	-72.6	-14.8	177.7	62	0	0	0	0	113	K427 E433	K427-T431 PolarHBondContact O-N 2.83Å; T431-E433 WeakPolarHBondContact CB-OE1 3.46Å; T431-E433 PolarHBondContact O-N 3.47Å; T431-E433 VanDerWaalsContact OG1-CD 3.22Å; T431-E433 WeakPolarHBondContact OG1-CG 3.23Å; T431-E433 PolarHBondContact OG1-OE1 3.42Å
432	G	76.9	Confident	80.7	Confident	34 Å²	34	69.6 Å²	69.6	35%	0.351	38%	0.379	S	S	.	.			trans	78.4	-3	-179.5	0	0	0	0	0	114.5	R428 H430 K434	R428-G432 CarbonylContact O-C 3.31Å; R428-G432 WeakPolarHBondContact O-CA 3.44Å; R428-G432 PolarHBondContact O-N 3.12Å; R428-G432 VanDerWaalsContact O-N 3.09Å; H430-G432 PolarHBondContact O-N 3.3Å; G432-K434 WeakPolarHBondContact O-CD 3.39Å; G432-K434 WeakPolarHBondContact O-CE 3.45Å; G432-K434 WeakPolarHBondContact O-CG 3.34Å; G432-K434 PolarHBondContact O-N 2.67Å
433	E	75	Confident	80.6	Confident	90 Å²	90	71.9 Å²	71.9	42%	0.421	39%	0.385	S	S	.	.			trans	-51.1	127	-179.6	-80.6	165.2	-117.4	0	0	113.2	R428 T431	R428-E433 HydrophobicContact CB-CB 4.15Å; R428-E433 HydrophobicContact CG-CB 4.01Å; R428-E433 IonicContact NE-OE2 3.91Å; R428-E433 PolarHBondContact O-N 3.33Å; T431-E433 WeakPolarHBondContact CB-OE1 3.46Å; T431-E433 PolarHBondContact O-N 3.47Å; T431-E433 VanDerWaalsContact OG1-CD 3.22Å; T431-E433 WeakPolarHBondContact OG1-CG 3.23Å; T431-E433 PolarHBondContact OG1-OE1 3.42Å
434	K	79	Confident	80.5	Confident	117 Å²	117	74.7 Å²	74.7	51%	0.509	40%	0.4	S	S	.	.			trans	-136.9	76.8	179.8	-72.5	152.2	-168.5	151.6	0	109.1	G432 F436 N444 F445	G432-K434 WeakPolarHBondContact O-CD 3.39Å; G432-K434 WeakPolarHBondContact O-CE 3.45Å; G432-K434 WeakPolarHBondContact O-CG 3.34Å; G432-K434 PolarHBondContact O-N 2.67Å; K434-F436 PolarHBondContact O-N 3.12Å; K434-F436 VanDerWaalsContact O-N 3.07Å; K434-N444 HydrophobicContact CB-CB 3.53Å; K434-N444 HydrophobicContact CD-CB 4.35Å; K434-N444 HydrophobicContact CG-CB 4.5Å; K434-N444 WeakPolarHBondContact O-CB 3.38Å; K434-F445 CarbonylContact C-O 3.13Å; K434-F445 VanDerWaalsContact CA-O 3.25Å; K434-F445 WeakPolarHBondContact CA-O 3.35Å
435	P	77.4	Confident	80.4	Confident	74 Å²	74	73.1 Å²	73.1	48%	0.481	39%	0.392	S	S	.	.			trans	-64.1	-16	-170.9	-23.8	35.5	0	0	0	115
436	F	79.3	Confident	80.2	Confident	52 Å²	52	72.3 Å²	72.3	23%	0.228	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	94.9	-169.1	-50.6	-68.3	0	0	0	111	K434 F445 Q447 Q448 L452	K434-F436 PolarHBondContact O-N 3.12Å; K434-F436 VanDerWaalsContact O-N 3.07Å; F436-F445 HydrophobicContact CB-CB 4.47Å; F436-F445 WeakPolarHBondContact CD2-O 3.31Å; F436-F445 PolarHBondContact N-O 3.45Å; F436-F445 PolarHBondContact O-N 2.98Å; F436-Q447 VanDerWaalsContact CD2-C 3.49Å; F436-Q448 HydrophobicContact CB-CB 4.44Å; F436-Q448 HydrophobicContact CD1-CB 3.62Å; F436-Q448 HydrophobicContact CD1-CG 3.9Å; F436-Q448 HydrophobicContact CD2-CB 4.05Å; F436-Q448 VanDerWaalsContact CD2-N 3.31Å; F436-Q448 HydrophobicContact CE1-CB 3.77Å; F436-Q448 HydrophobicContact CE1-CG 4.23Å; F436-Q448 VanDerWaalsContact CE1-OE1 3.29Å; F436-Q448 HydrophobicContact CE2-CB 4.18Å; F436-Q448 HydrophobicContact CG-CB 3.75Å; F436-Q448 HydrophobicContact CG-CG 4.33Å; F436-Q448 HydrophobicContact CZ-CB 4.04Å; F436-L452 HydrophobicContact CB-CD2 3.93Å
437	Q	82.8	Confident	79.8	Confident	103 Å²	103	74.5 Å²	74.5	48%	0.481	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	148.5	176.3	-173.9	159.8	62.2	0	0	112	G442 N444 L452	Q437-G442 PolarHBondContact NE2-O 3.27Å; Q437-N444 WeakPolarHBondContact CA-OD1 3.22Å; Q437-N444 VanDerWaalsContact CB-OD1 3.23Å; Q437-N444 WeakPolarHBondContact CB-OD1 3.3Å; Q437-N444 WeakPolarHBondContact CG-OD1 3.34Å; Q437-N444 PolarHBondContact NE2-OD1 2.87Å; Q437-L452 WeakPolarHBondContact O-CD2 3.28Å
438	C	85.1	Confident	79.4	Confident	0 Å²	0	75.9 Å²	75.9	0%	0	41%	0.409	C	S	.	.			trans	-93.6	109.4	166.3	176.4	0	0	0	0	110.7	V440 C441 G442 K443 F445 L452 H455 H459	C438-V440 PolarHBondContact O-N 3.37Å; C438-C441 PolarHBondContact O-N 2.92Å; C438-G442 PolarHBondContact O-N 3.36Å; C438-K443 WeakPolarHBondContact CB-O 3.2Å; C438-K443 PolarHBondContact N-O 2.79Å; C438-F445 HydrophobicContact CB-CE2 4.25Å; C438-L452 HydrophobicContact CB-CD1 3.64Å; C438-H455 PolarHBondContact SG-CD2 3.27Å; C438-H455 PolarHBondContact SG-NE2 3.29Å; C438-H459 PolarHBondContact SG-NE2 3.4Å; C438-H459 VanDerWaalsContact SG-NE2 3.39Å
439	N	79.2	Confident	78.6	Confident	157 Å²	157	76.7 Å²	76.7	84%	0.84	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-24.2	-178	-54	13.6	0	0	0	113.9
440	V	81.3	Confident	78.2	Confident	98 Å²	98	74.4 Å²	74.4	59%	0.594	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-20	-178.3	-172.3	0	0	0	0	113.1	C438 H459	C438-V440 PolarHBondContact O-N 3.37Å; V440-H459 HydrophobicContact CB-CB 4.45Å; V440-H459 HydrophobicContact CG1-CB 4.04Å; V440-H459 HydrophobicContact CG2-CB 4.45Å
441	C	81.8	Confident	78	Confident	45 Å²	45	73.4 Å²	73.4	30%	0.304	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-152.6	18.1	-176.3	71.4	0	0	0	0	116.1	C438 K443 H455 H459	C438-C441 PolarHBondContact O-N 2.92Å; C441-K443 PolarHBondContact O-N 2.94Å; C441-H455 PolarHBondContact SG-NE2 3.09Å; C441-H459 PolarHBondContact SG-NE2 3.16Å; C441-H459 VanDerWaalsContact SG-NE2 3.42Å
442	G	79.5	Confident	78.1	Confident	39 Å²	39	70.3 Å²	70.3	40%	0.402	40%	0.398	S	S	.	.			trans	65.6	0.7	176.1	0	0	0	0	0	116.2	Q437 C438 N444	Q437-G442 PolarHBondContact NE2-O 3.27Å; C438-G442 PolarHBondContact O-N 3.36Å; G442-N444 PolarHBondContact O-OD1 3.17Å; G442-N444 VanDerWaalsContact O-OD1 3.08Å
443	K	79.9	Confident	78.3	Confident	119 Å²	119	73.1 Å²	73.1	52%	0.517	40%	0.402	S	S	.	.			trans	-79.8	128.6	-171.6	-75.1	169	-168.8	167.1	0	111.7	C438 C441 F445	C438-K443 WeakPolarHBondContact CB-O 3.2Å; C438-K443 PolarHBondContact N-O 2.79Å; C441-K443 PolarHBondContact O-N 2.94Å; K443-F445 HydrophobicContact CB-CE2 4.04Å; K443-F445 HydrophobicContact CB-CZ 4.24Å; K443-F445 WeakPolarHBondContact O-CD2 3.37Å; K443-F445 WeakPolarHBondContact O-CE2 3.12Å
444	N	82.3	Confident	78.5	Confident	78 Å²	78	71.7 Å²	71.7	42%	0.417	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	139	-171.8	-61.9	-18.1	0	0	0	111.9	K434 Q437 G442	K434-N444 HydrophobicContact CB-CB 3.53Å; K434-N444 HydrophobicContact CD-CB 4.35Å; K434-N444 HydrophobicContact CG-CB 4.5Å; K434-N444 WeakPolarHBondContact O-CB 3.38Å; Q437-N444 WeakPolarHBondContact CA-OD1 3.22Å; Q437-N444 VanDerWaalsContact CB-OD1 3.23Å; Q437-N444 WeakPolarHBondContact CB-OD1 3.3Å; Q437-N444 WeakPolarHBondContact CG-OD1 3.34Å; Q437-N444 PolarHBondContact NE2-OD1 2.87Å; G442-N444 PolarHBondContact O-OD1 3.17Å; G442-N444 VanDerWaalsContact O-OD1 3.08Å
445	F	80.4	Confident	78.7	Confident	43 Å²	43	66.9 Å²	66.9	19%	0.189	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	148.4	-179.4	-62.5	-84.4	0	0	0	112	K434 F436 C438 K443 Q447 N451 L452 H455	K434-F445 CarbonylContact C-O 3.13Å; K434-F445 VanDerWaalsContact CA-O 3.25Å; K434-F445 WeakPolarHBondContact CA-O 3.35Å; F436-F445 HydrophobicContact CB-CB 4.47Å; F436-F445 WeakPolarHBondContact CD2-O 3.31Å; F436-F445 PolarHBondContact N-O 3.45Å; F436-F445 PolarHBondContact O-N 2.98Å; C438-F445 HydrophobicContact CB-CE2 4.25Å; K443-F445 HydrophobicContact CB-CE2 4.04Å; K443-F445 HydrophobicContact CB-CZ 4.24Å; K443-F445 WeakPolarHBondContact O-CD2 3.37Å; K443-F445 WeakPolarHBondContact O-CE2 3.12Å; F445-Q447 VanDerWaalsContact C-N 3.32Å; F445-N451 HydrophobicContact CB-CB 4.47Å; F445-N451 HydrophobicContact CD1-CB 4.03Å; F445-L452 HydrophobicContact CB-CB 4.32Å; F445-L452 HydrophobicContact CD2-CB 4.12Å; F445-L452 HydrophobicContact CD2-CD1 3.81Å; F445-L452 HydrophobicContact CE2-CD1 4.13Å; F445-L452 HydrophobicContact CG-CB 4.3Å; F445-H455 HydrophobicContact CE1-CB 4.36Å; F445-H455 HydrophobicContact CE2-CB 4.18Å; F445-H455 AromaticContact CE2-CE1 3.91Å; F445-H455 AromaticContact CE2-CG 3.77Å; F445-H455 AromaticContact CE2-ND1 3.75Å; F445-H455 HydrophobicContact CZ-CB 3.9Å; F445-H455 AromaticContact CZ-CE1 3.61Å; F445-H455 AromaticContact CZ-CG 3.55Å; F445-H455 AromaticContact CZ-ND1 3.17Å; F445-H455 WeakPolarHBondContact CZ-ND1 3.3Å
446	S	77.1	Confident	79	Confident	33 Å²	33	65.8 Å²	65.8	23%	0.231	37%	0.369	C	S	.	.	S	Bend	trans	-82.5	-6.2	175.1	55	0	0	0	0	114.1
447	Q	76.1	Confident	79.3	Confident	69 Å²	69	65.8 Å²	65.8	32%	0.322	37%	0.367	S	S	.	.			trans	-140.3	129.2	178.2	-59.5	173.5	31	0	0	111.4	L425 F436 F445 N451 L452	L425-Q447 HydrophobicContact CD1-CG 3.43Å; L425-Q447 VanDerWaalsContact CD1-CG 3.43Å; L425-Q447 HydrophobicContact CD2-CG 4.15Å; L425-Q447 HydrophobicContact CG-CG 4.44Å; F436-Q447 VanDerWaalsContact CD2-C 3.49Å; F445-Q447 VanDerWaalsContact C-N 3.32Å; Q447-N451 HydrophobicContact CB-CB 4.27Å; Q447-N451 VanDerWaalsContact CD-ND2 3.34Å; Q447-N451 PolarHBondContact NE2-ND2 3.44Å; Q447-L452 PolarHBondContact O-N 3.1Å
448	Q	72.6	Confident	79.1	Confident	116 Å²	116	68.5 Å²	68.5	54%	0.542	37%	0.373	S	S	.	.	I	π-helix	trans	-74.8	-63.2	177.9	-165.6	176.6	-6.2	0	0	112.1	F436 G450 L452 Q453	F436-Q448 HydrophobicContact CB-CB 4.44Å; F436-Q448 HydrophobicContact CD1-CB 3.62Å; F436-Q448 HydrophobicContact CD1-CG 3.9Å; F436-Q448 HydrophobicContact CD2-CB 4.05Å; F436-Q448 VanDerWaalsContact CD2-N 3.31Å; F436-Q448 HydrophobicContact CE1-CB 3.77Å; F436-Q448 HydrophobicContact CE1-CG 4.23Å; F436-Q448 VanDerWaalsContact CE1-OE1 3.29Å; F436-Q448 HydrophobicContact CE2-CB 4.18Å; F436-Q448 HydrophobicContact CG-CB 3.75Å; F436-Q448 HydrophobicContact CG-CG 4.33Å; F436-Q448 HydrophobicContact CZ-CB 4.04Å; Q448-G450 PolarHBondContact O-N 2.89Å; Q448-L452 WeakPolarHBondContact O-CB 3.23Å; Q448-Q453 PolarHBondContact O-N 3.4Å
449	A	66.8	Low	79	Confident	90 Å²	90	72 Å²	72	74%	0.744	39%	0.389	S	S	*	.	I	π-helix	trans	-65.7	-34.7	-166.6	0	0	0	0	0	115	Q453	A449-Q453 WeakPolarHBondContact O-CB 3.31Å; A449-Q453 WeakPolarHBondContact O-CG 3.21Å
450	G	70	Confident	79.1	Confident	30 Å²	30	67.8 Å²	67.8	31%	0.309	37%	0.372	S	S	.	.	I	π-helix	trans	-94.4	-65.8	179.5	0	0	0	0	0	113	Q448 T454	Q448-G450 PolarHBondContact O-N 2.89Å; G450-T454 VanDerWaalsContact O-CB 3.31Å; G450-T454 WeakPolarHBondContact O-CB 3.39Å; G450-T454 PolarHBondContact O-N 2.68Å; G450-T454 PolarHBondContact O-OG1 3.35Å
451	N	76.7	Confident	79.1	Confident	71 Å²	71	65.2 Å²	65.2	38%	0.38	37%	0.365	S	S	.	.	I	π-helix	trans	-74.2	-47.2	-167.3	-66.4	-26.1	0	0	0	113	F445 Q447 H455	F445-N451 HydrophobicContact CB-CB 4.47Å; F445-N451 HydrophobicContact CD1-CB 4.03Å; Q447-N451 HydrophobicContact CB-CB 4.27Å; Q447-N451 VanDerWaalsContact CD-ND2 3.34Å; Q447-N451 PolarHBondContact NE2-ND2 3.44Å; N451-H455 VanDerWaalsContact O-CB 3.31Å; N451-H455 WeakPolarHBondContact O-CB 3.42Å; N451-H455 PolarHBondContact O-N 3.36Å
452	L	81.6	Confident	79.1	Confident	18 Å²	18	68 Å²	68	9%	0.094	37%	0.374	C	S	.	.	I	π-helix	trans	-66.3	-43.6	177.1	174.5	60	0	0	0	111.3	F436 Q437 C438 F445 Q447 Q448 T454 H455 L456	F436-L452 HydrophobicContact CB-CD2 3.93Å; Q437-L452 WeakPolarHBondContact O-CD2 3.28Å; C438-L452 HydrophobicContact CB-CD1 3.64Å; F445-L452 HydrophobicContact CB-CB 4.32Å; F445-L452 HydrophobicContact CD2-CB 4.12Å; F445-L452 HydrophobicContact CD2-CD1 3.81Å; F445-L452 HydrophobicContact CE2-CD1 4.13Å; F445-L452 HydrophobicContact CG-CB 4.3Å; Q447-L452 PolarHBondContact O-N 3.1Å; Q448-L452 WeakPolarHBondContact O-CB 3.23Å; L452-T454 PolarHBondContact O-N 3.15Å; L452-H455 CarbonylContact O-C 3.6Å; L452-H455 WeakPolarHBondContact O-CA 3.34Å; L452-H455 VanDerWaalsContact O-CB 3.32Å; L452-H455 WeakPolarHBondContact O-CB 3.38Å; L452-H455 PolarHBondContact O-N 3.08Å; L452-H455 VanDerWaalsContact O-N 3.1Å; L452-L456 HydrophobicContact CD1-CD1 4.2Å; L452-L456 HydrophobicContact CD1-CD2 4.33Å; L452-L456 HydrophobicContact CD1-CG 3.96Å; L452-L456 HydrophobicContact CG-CD1 4.02Å; L452-L456 HydrophobicContact CG-CG 4.27Å; L452-L456 WeakPolarHBondContact O-CG 3.34Å; L452-L456 PolarHBondContact O-N 2.83Å
453	Q	79.5	Confident	79.3	Confident	94 Å²	94	71.3 Å²	71.3	44%	0.439	38%	0.377	S	S	.	.	H	α-helix	trans	-61	-46.4	176.7	-71.8	-66.1	-5.9	0	0	113.1	Q448 A449 H455 L456 R457	Q448-Q453 PolarHBondContact O-N 3.4Å; A449-Q453 WeakPolarHBondContact O-CB 3.31Å; A449-Q453 WeakPolarHBondContact O-CG 3.21Å; Q453-H455 PolarHBondContact O-N 3.42Å; Q453-L456 PolarHBondContact O-N 3.34Å; Q453-L456 VanDerWaalsContact O-N 3.16Å; Q453-R457 PolarHBondContact O-N 3.11Å
454	T	80.1	Confident	79.5	Confident	59 Å²	59	68.9 Å²	68.9	36%	0.362	37%	0.373	S	S	.	.	H	α-helix	trans	-63.8	-27.3	175.6	-52.5	0	0	0	0	112	G450 L452 A476	G450-T454 VanDerWaalsContact O-CB 3.31Å; G450-T454 WeakPolarHBondContact O-CB 3.39Å; G450-T454 PolarHBondContact O-N 2.68Å; G450-T454 PolarHBondContact O-OG1 3.35Å; L452-T454 PolarHBondContact O-N 3.15Å; T454-A476 HydrophobicContact CG2-CB 4.1Å
455	H	84.4	Confident	79.6	Confident	17 Å²	17	69.1 Å²	69.1	8%	0.079	37%	0.369	C	S	.	.	H	α-helix	trans	-74	-42.8	171.8	174.3	105.6	0	0	0	113	C438 C441 F445 N451 L452 Q453 R457 R458 H459	C438-H455 PolarHBondContact SG-CD2 3.27Å; C438-H455 PolarHBondContact SG-NE2 3.29Å; C441-H455 PolarHBondContact SG-NE2 3.09Å; F445-H455 HydrophobicContact CE1-CB 4.36Å; F445-H455 HydrophobicContact CE2-CB 4.18Å; F445-H455 AromaticContact CE2-CE1 3.91Å; F445-H455 AromaticContact CE2-CG 3.77Å; F445-H455 AromaticContact CE2-ND1 3.75Å; F445-H455 HydrophobicContact CZ-CB 3.9Å; F445-H455 AromaticContact CZ-CE1 3.61Å; F445-H455 AromaticContact CZ-CG 3.55Å; F445-H455 AromaticContact CZ-ND1 3.17Å; F445-H455 WeakPolarHBondContact CZ-ND1 3.3Å; N451-H455 VanDerWaalsContact O-CB 3.31Å; N451-H455 WeakPolarHBondContact O-CB 3.42Å; N451-H455 PolarHBondContact O-N 3.36Å; L452-H455 CarbonylContact O-C 3.6Å; L452-H455 WeakPolarHBondContact O-CA 3.34Å; L452-H455 VanDerWaalsContact O-CB 3.32Å; L452-H455 WeakPolarHBondContact O-CB 3.38Å; L452-H455 PolarHBondContact O-N 3.08Å; L452-H455 VanDerWaalsContact O-N 3.1Å; Q453-H455 PolarHBondContact O-N 3.42Å; H455-R457 VanDerWaalsContact C-N 3.27Å; H455-R457 PolarHBondContact O-N 3.26Å; H455-R458 PolarHBondContact CE1-NH2 3.44Å; H455-R458 PolarHBondContact ND1-NH2 3.41Å; H455-R458 VanDerWaalsContact O-CB 3.3Å; H455-R458 WeakPolarHBondContact O-CB 3.44Å; H455-R458 PolarHBondContact O-N 3.27Å; H455-H459 AromaticContact CD2-CD2 3.91Å; H455-H459 AromaticContact CD2-NE2 3.51Å; H455-H459 AromaticContact CE1-NE2 4Å; H455-H459 AromaticContact NE2-CD2 3.88Å; H455-H459 AromaticContact NE2-CE1 3.94Å; H455-H459 AromaticContact NE2-NE2 3.01Å; H455-H459 PolarHBondContact NE2-NE2 3.08Å
456	L	83	Confident	79.8	Confident	51 Å²	51	71.8 Å²	71.8	27%	0.267	38%	0.384	S	S	.	.	H	α-helix	trans	-60.6	-36.4	-179.9	-73.3	169.6	0	0	0	111.8	L452 Q453 R458 H459 S460	L452-L456 HydrophobicContact CD1-CD1 4.2Å; L452-L456 HydrophobicContact CD1-CD2 4.33Å; L452-L456 HydrophobicContact CD1-CG 3.96Å; L452-L456 HydrophobicContact CG-CD1 4.02Å; L452-L456 HydrophobicContact CG-CG 4.27Å; L452-L456 WeakPolarHBondContact O-CG 3.34Å; L452-L456 PolarHBondContact O-N 2.83Å; Q453-L456 PolarHBondContact O-N 3.34Å; Q453-L456 VanDerWaalsContact O-N 3.16Å; L456-R458 PolarHBondContact O-N 3.1Å; L456-H459 WeakPolarHBondContact O-CA 3.45Å; L456-H459 WeakPolarHBondContact O-CB 3.47Å; L456-H459 PolarHBondContact O-N 3Å; L456-S460 PolarHBondContact O-N 3Å; L456-S460 VanDerWaalsContact O-N 3.08Å
457	R	84.6	Confident	80.3	Confident	52 Å²	52	70.2 Å²	70.2	20%	0.196	37%	0.373	C	S	.	.	H	α-helix	trans	-57.5	-17.8	171.9	-69.5	-179.1	-177.8	161	3.7	115	Q453 H455 G461 E462 Y465 T475	Q453-R457 PolarHBondContact O-N 3.11Å; H455-R457 VanDerWaalsContact C-N 3.27Å; H455-R457 PolarHBondContact O-N 3.26Å; R457-G461 CarbonylContact O-C 3.48Å; R457-G461 WeakPolarHBondContact O-CA 3.45Å; R457-G461 PolarHBondContact O-N 3.38Å; R457-G461 VanDerWaalsContact O-N 3.1Å; R457-E462 HydrophobicContact CB-CB 4.32Å; R457-E462 HydrophobicContact CG-CB 4.07Å; R457-E462 PolarHBondContact O-N 3.1Å; R457-Y465 PolarHBondContact NH1-OH 2.97Å; R457-T475 HydrophobicContact CB-CG2 4.29Å; R457-T475 PolarHBondContact NH1-O 3.28Å
458	R	80.3	Confident	80.6	Confident	160 Å²	160	73 Å²	73	60%	0.604	39%	0.386	S	S	*	.	H	α-helix	trans	-77.7	-25.3	171.4	-176.1	172.9	57.2	-169.1	-7	112.6	H455 L456	H455-R458 PolarHBondContact CE1-NH2 3.44Å; H455-R458 PolarHBondContact ND1-NH2 3.41Å; H455-R458 VanDerWaalsContact O-CB 3.3Å; H455-R458 WeakPolarHBondContact O-CB 3.44Å; H455-R458 PolarHBondContact O-N 3.27Å; L456-R458 PolarHBondContact O-N 3.1Å
459	H	82.1	Confident	81	Confident	73 Å²	73	72.2 Å²	72.2	34%	0.338	39%	0.385	S	S	.	.	H	α-helix	trans	-88.3	-44.7	177.3	-56.5	-58.6	0	0	0	111.4	C438 V440 C441 H455 L456 G461	C438-H459 PolarHBondContact SG-NE2 3.4Å; C438-H459 VanDerWaalsContact SG-NE2 3.39Å; V440-H459 HydrophobicContact CB-CB 4.45Å; V440-H459 HydrophobicContact CG1-CB 4.04Å; V440-H459 HydrophobicContact CG2-CB 4.45Å; C441-H459 PolarHBondContact SG-NE2 3.16Å; C441-H459 VanDerWaalsContact SG-NE2 3.42Å; H455-H459 AromaticContact CD2-CD2 3.91Å; H455-H459 AromaticContact CD2-NE2 3.51Å; H455-H459 AromaticContact CE1-NE2 4Å; H455-H459 AromaticContact NE2-CD2 3.88Å; H455-H459 AromaticContact NE2-CE1 3.94Å; H455-H459 AromaticContact NE2-NE2 3.01Å; H455-H459 PolarHBondContact NE2-NE2 3.08Å; L456-H459 WeakPolarHBondContact O-CA 3.45Å; L456-H459 WeakPolarHBondContact O-CB 3.47Å; L456-H459 PolarHBondContact O-N 3Å; H459-G461 PolarHBondContact O-N 3.04Å
460	S	82.1	Confident	81.8	Confident	69 Å²	69	70 Å²	70	48%	0.483	36%	0.363	S	S	.	.	H	α-helix	trans	-73.1	-14.8	173.6	63.3	0	0	0	0	113.5	L456 E462	L456-S460 PolarHBondContact O-N 3Å; L456-S460 VanDerWaalsContact O-N 3.08Å; S460-E462 VanDerWaalsContact CB-OE1 3.25Å; S460-E462 WeakPolarHBondContact CB-OE1 3.48Å; S460-E462 PolarHBondContact O-N 2.74Å; S460-E462 VanDerWaalsContact OG-CD 3.24Å; S460-E462 WeakPolarHBondContact OG-CG 3.46Å; S460-E462 PolarHBondContact OG-OE1 2.7Å
461	G	81.1	Confident	82.4	Confident	43 Å²	43	71.2 Å²	71.2	44%	0.443	38%	0.377	S	S	.	.			trans	75.2	-2.1	-178.8	0	0	0	0	0	114.7	R457 H459 K463	R457-G461 CarbonylContact O-C 3.48Å; R457-G461 WeakPolarHBondContact O-CA 3.45Å; R457-G461 PolarHBondContact O-N 3.38Å; R457-G461 VanDerWaalsContact O-N 3.1Å; H459-G461 PolarHBondContact O-N 3.04Å; G461-K463 PolarHBondContact O-N 2.88Å
462	E	80.7	Confident	82.7	Confident	104 Å²	104	73.4 Å²	73.4	49%	0.486	38%	0.383	S	S	.	.			trans	-52.3	130.4	178.4	-79.1	165.4	-117.9	0	0	112.9	R457 S460 T475	R457-E462 HydrophobicContact CB-CB 4.32Å; R457-E462 HydrophobicContact CG-CB 4.07Å; R457-E462 PolarHBondContact O-N 3.1Å; S460-E462 VanDerWaalsContact CB-OE1 3.25Å; S460-E462 WeakPolarHBondContact CB-OE1 3.48Å; S460-E462 PolarHBondContact O-N 2.74Å; S460-E462 VanDerWaalsContact OG-CD 3.24Å; S460-E462 WeakPolarHBondContact OG-CG 3.46Å; S460-E462 PolarHBondContact OG-OE1 2.7Å; E462-T475 WeakPolarHBondContact O-CG2 3.31Å
463	K	84.9	Confident	82.9	Confident	108 Å²	108	75.1 Å²	75.1	47%	0.47	40%	0.396	S	S	.	.			trans	-131.4	72.8	178.4	-71.6	161.7	-171.8	169	0	110.5	G461 Y465 S473 F474 T475	G461-K463 PolarHBondContact O-N 2.88Å; K463-Y465 PolarHBondContact O-N 3.37Å; K463-Y465 VanDerWaalsContact O-N 3.13Å; K463-S473 WeakPolarHBondContact CB-OG 3.35Å; K463-S473 WeakPolarHBondContact CD-OG 3.25Å; K463-F474 CarbonylContact C-O 3.49Å; K463-F474 VanDerWaalsContact C-O 3.23Å; K463-F474 VanDerWaalsContact CA-O 3.25Å; K463-F474 WeakPolarHBondContact CA-O 3.44Å; K463-T475 HydrophobicContact CG-CG2 4.09Å
464	P	83.7	Confident	83.1	Confident	69 Å²	69	73.1 Å²	73.1	45%	0.448	39%	0.386	S	S	.	.			trans	-65.5	-19.6	-169.7	-22.3	35.3	0	0	0	114.3
465	Y	84.3	Confident	83.3	Confident	82 Å²	82	72.1 Å²	72.1	32%	0.322	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	110.5	-175.7	-47.5	-77.5	0	0	0	109.7	R457 K463 S473 F474 T475 S477 V480	R457-Y465 PolarHBondContact NH1-OH 2.97Å; K463-Y465 PolarHBondContact O-N 3.37Å; K463-Y465 VanDerWaalsContact O-N 3.13Å; Y465-S473 CarbonylContact O-C 3.56Å; Y465-S473 WeakPolarHBondContact O-CA 3.48Å; Y465-F474 PolarHBondContact N-O 3.05Å; Y465-F474 PolarHBondContact O-N 3.38Å; Y465-T475 WeakPolarHBondContact CE2-O 3.41Å; Y465-S477 VanDerWaalsContact CD2-N 3.28Å; Y465-V480 VanDerWaalsContact O-CG2 3.29Å; Y465-V480 WeakPolarHBondContact O-CG2 3.37Å
466	I	84	Confident	83.3	Confident	99 Å²	99	72.3 Å²	72.3	51%	0.508	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	139.1	-178.1	-55.7	177.8	0	0	0	109.4	E468	I466-E468 PolarHBondContact O-N 2.88Å
467	C	88	Confident	83.3	Confident	0 Å²	0	73.3 Å²	73.3	0%	0	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	103.8	171.3	-172.9	0	0	0	0	109.8	L469 C470 G471 K472 F474 V480 H487	C467-L469 PolarHBondContact O-N 3.45Å; C467-C470 PolarHBondContact O-N 3.12Å; C467-G471 PolarHBondContact O-N 3.23Å; C467-K472 WeakPolarHBondContact CB-O 3.43Å; C467-K472 PolarHBondContact N-O 3.37Å; C467-F474 HydrophobicContact CB-CE2 4.39Å; C467-V480 HydrophobicContact CB-CG1 4.21Å; C467-H487 PolarHBondContact SG-NE2 2.83Å
468	E	82.9	Confident	83.1	Confident	129 Å²	129	72.8 Å²	72.8	60%	0.603	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.1	-32.2	-179.4	-56.1	108.4	-107.1	0	0	113.5	I466 C470 K484	I466-E468 PolarHBondContact O-N 2.88Å; E468-C470 VanDerWaalsContact C-N 3.29Å; E468-C470 PolarHBondContact O-N 2.94Å; E468-K484 VanDerWaalsContact OE1-CE 3.3Å; E468-K484 WeakPolarHBondContact OE1-CE 3.29Å; E468-K484 IonicContact OE1-NZ 2.75Å; E468-K484 PolarHBondContact OE1-NZ 3.12Å; E468-K484 IonicContact OE2-NZ 3.85Å; E468-K484 PolarHBondContact OE2-NZ 3.22Å
469	L	81.6	Confident	83.3	Confident	98 Å²	98	67.5 Å²	67.5	51%	0.513	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-11.2	-176.2	-58.7	177.5	0	0	0	114.6	C467 H487	C467-L469 PolarHBondContact O-N 3.45Å; L469-H487 HydrophobicContact CD1-CB 3.59Å
470	C	82.4	Confident	83.4	Confident	43 Å²	43	64.5 Å²	64.5	29%	0.291	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-161.3	19.3	177.9	69.1	0	0	0	0	115.8	C467 E468 K472 H483 H487	C467-C470 PolarHBondContact O-N 3.12Å; E468-C470 VanDerWaalsContact C-N 3.29Å; E468-C470 PolarHBondContact O-N 2.94Å; C470-K472 PolarHBondContact O-N 3.29Å; C470-H483 PolarHBondContact SG-NE2 3.05Å; C470-H483 VanDerWaalsContact SG-NE2 3.39Å; C470-H487 WeakPolarHBondContact CB-CE1 3.34Å; C470-H487 PolarHBondContact SG-CE1 3.13Å; C470-H487 PolarHBondContact SG-NE2 3.31Å
471	G	81.8	Confident	83.4	Confident	57 Å²	57	67.2 Å²	67.2	59%	0.588	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.1	-0.4	178.3	0	0	0	0	0	116.7	C467 S473	C467-G471 PolarHBondContact O-N 3.23Å; G471-S473 PolarHBondContact O-N 3.02Å
472	K	84	Confident	83.4	Confident	117 Å²	117	70.2 Å²	70.2	51%	0.509	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	125.7	-173.9	-72.1	175.6	-171.4	163.7	0	110.9	C467 C470 F474	C467-K472 WeakPolarHBondContact CB-O 3.43Å; C467-K472 PolarHBondContact N-O 3.37Å; C470-K472 PolarHBondContact O-N 3.29Å; K472-F474 HydrophobicContact CB-CE2 3.75Å; K472-F474 HydrophobicContact CB-CZ 4.28Å; K472-F474 VanDerWaalsContact O-CD2 3.31Å; K472-F474 WeakPolarHBondContact O-CD2 3.3Å; K472-F474 VanDerWaalsContact O-CE2 3.28Å; K472-F474 WeakPolarHBondContact O-CE2 3.49Å
473	S	85.4	Confident	83.6	Confident	53 Å²	53	66.5 Å²	66.5	37%	0.371	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	144.2	-176.6	62.7	0	0	0	0	112.5	K463 Y465 G471	K463-S473 WeakPolarHBondContact CB-OG 3.35Å; K463-S473 WeakPolarHBondContact CD-OG 3.25Å; Y465-S473 CarbonylContact O-C 3.56Å; Y465-S473 WeakPolarHBondContact O-CA 3.48Å; G471-S473 PolarHBondContact O-N 3.02Å
474	F	84.9	Confident	83.4	Confident	52 Å²	52	63.8 Å²	63.8	23%	0.228	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	153.5	-174.6	-60.8	-104.2	0	0	0	111.5	K463 Y465 C467 K472 D479 V480 H483	K463-F474 CarbonylContact C-O 3.49Å; K463-F474 VanDerWaalsContact C-O 3.23Å; K463-F474 VanDerWaalsContact CA-O 3.25Å; K463-F474 WeakPolarHBondContact CA-O 3.44Å; Y465-F474 PolarHBondContact N-O 3.05Å; Y465-F474 PolarHBondContact O-N 3.38Å; C467-F474 HydrophobicContact CB-CE2 4.39Å; K472-F474 HydrophobicContact CB-CE2 3.75Å; K472-F474 HydrophobicContact CB-CZ 4.28Å; K472-F474 VanDerWaalsContact O-CD2 3.31Å; K472-F474 WeakPolarHBondContact O-CD2 3.3Å; K472-F474 VanDerWaalsContact O-CE2 3.28Å; K472-F474 WeakPolarHBondContact O-CE2 3.49Å; F474-D479 HydrophobicContact CB-CB 4.28Å; F474-D479 HydrophobicContact CD1-CB 3.94Å; F474-D479 HydrophobicContact CG-CB 4.42Å; F474-V480 HydrophobicContact CB-CG2 3.71Å; F474-V480 HydrophobicContact CD2-CG2 3.65Å; F474-V480 HydrophobicContact CG-CG2 3.91Å; F474-H483 HydrophobicContact CE1-CB 4.23Å; F474-H483 HydrophobicContact CE2-CB 4.17Å; F474-H483 AromaticContact CE2-CD2 3.45Å; F474-H483 VanDerWaalsContact CE2-CD2 3.45Å; F474-H483 WeakPolarHBondContact CE2-CD2 3.36Å; F474-H483 AromaticContact CE2-CG 3.99Å; F474-H483 HydrophobicContact CZ-CB 3.71Å; F474-H483 AromaticContact CZ-CD2 3.35Å; F474-H483 WeakPolarHBondContact CZ-CD2 3.46Å; F474-H483 AromaticContact CZ-CG 3.5Å
475	T	84.2	Confident	83.3	Confident	38 Å²	38	61.8 Å²	61.8	23%	0.233	34%	0.337	C	S	.	.	S	Bend	trans	-78	-21.6	-177.1	53.9	0	0	0	0	114	R457 E462 K463 Y465	R457-T475 HydrophobicContact CB-CG2 4.29Å; R457-T475 PolarHBondContact NH1-O 3.28Å; E462-T475 WeakPolarHBondContact O-CG2 3.31Å; K463-T475 HydrophobicContact CG-CG2 4.09Å; Y465-T475 WeakPolarHBondContact CE2-O 3.41Å
476	A	83.8	Confident	83.2	Confident	22 Å²	22	61.9 Å²	61.9	18%	0.182	35%	0.346	C	S	.	.	S	Bend	trans	-133.9	141.8	-176.8	0	0	0	0	0	112.6	T454 G478 D479 V480	T454-A476 HydrophobicContact CG2-CB 4.1Å; A476-G478 PolarHBondContact O-N 3.48Å; A476-D479 WeakPolarHBondContact O-CB 3.47Å; A476-D479 PolarHBondContact O-N 3.36Å; A476-D479 VanDerWaalsContact O-N 3.12Å; A476-V480 PolarHBondContact O-N 3.34Å
477	S	81.9	Confident	82.9	Confident	72 Å²	72	61.2 Å²	61.2	50%	0.503	34%	0.341	S	S	.	.	H	α-helix	trans	-61.9	-41.9	-177.1	53.4	0	0	0	0	113.2	Y465 D479 V480 Q481	Y465-S477 VanDerWaalsContact CD2-N 3.28Å; S477-D479 PolarHBondContact O-N 3.01Å; S477-V480 PolarHBondContact O-N 3.3Å; S477-V480 VanDerWaalsContact O-N 3.1Å; S477-Q481 PolarHBondContact O-N 3.04Å
478	G	81.1	Confident	82.4	Confident	41 Å²	41	65.1 Å²	65.1	42%	0.423	37%	0.365	S	S	.	.	H	α-helix	trans	-63	-22.3	176.4	0	0	0	0	0	114	A476 R482	A476-G478 PolarHBondContact O-N 3.48Å; G478-R482 VanDerWaalsContact O-CB 3.23Å; G478-R482 WeakPolarHBondContact O-CB 3.47Å; G478-R482 PolarHBondContact O-N 3.32Å; G478-R482 VanDerWaalsContact O-N 3.16Å
479	D	83.6	Confident	82	Confident	48 Å²	48	60.9 Å²	60.9	26%	0.257	36%	0.356	S	S	.	.	H	α-helix	trans	-77.9	-36.7	173.4	-70	-19.9	0	0	0	111.5	F474 A476 S477 R482 H483	F474-D479 HydrophobicContact CB-CB 4.28Å; F474-D479 HydrophobicContact CD1-CB 3.94Å; F474-D479 HydrophobicContact CG-CB 4.42Å; A476-D479 WeakPolarHBondContact O-CB 3.47Å; A476-D479 PolarHBondContact O-N 3.36Å; A476-D479 VanDerWaalsContact O-N 3.12Å; S477-D479 PolarHBondContact O-N 3.01Å; D479-R482 IonicContact OD1-CZ 2.66Å; D479-R482 IonicContact OD1-NH1 2.66Å; D479-R482 PolarHBondContact OD1-NH1 2.82Å; D479-R482 IonicContact OD1-NH2 2.61Å; D479-R482 PolarHBondContact OD1-NH2 3Å; D479-H483 WeakPolarHBondContact O-CB 3.33Å; D479-H483 PolarHBondContact O-N 2.7Å
480	V	85	Confident	81.6	Confident	11 Å²	11	61.7 Å²	61.7	7%	0.067	36%	0.357	C	S	.	.	H	α-helix	trans	-64.9	-47.3	170.8	-179.1	0	0	0	0	111.1	Y465 C467 F474 A476 S477 R482 H483 K484	Y465-V480 VanDerWaalsContact O-CG2 3.29Å; Y465-V480 WeakPolarHBondContact O-CG2 3.37Å; C467-V480 HydrophobicContact CB-CG1 4.21Å; F474-V480 HydrophobicContact CB-CG2 3.71Å; F474-V480 HydrophobicContact CD2-CG2 3.65Å; F474-V480 HydrophobicContact CG-CG2 3.91Å; A476-V480 PolarHBondContact O-N 3.34Å; S477-V480 PolarHBondContact O-N 3.3Å; S477-V480 VanDerWaalsContact O-N 3.1Å; V480-R482 VanDerWaalsContact C-N 3.29Å; V480-R482 PolarHBondContact O-N 3.18Å; V480-H483 CarbonylContact O-C 3.55Å; V480-H483 WeakPolarHBondContact O-CA 3.39Å; V480-H483 WeakPolarHBondContact O-CB 3.28Å; V480-H483 PolarHBondContact O-N 3.44Å; V480-K484 HydrophobicContact CG1-CG 4.35Å; V480-K484 PolarHBondContact O-N 3.43Å
481	Q	81.9	Confident	81.4	Confident	125 Å²	125	65.3 Å²	65.3	58%	0.584	37%	0.367	S	S	*	.	H	α-helix	trans	-62.2	-41.3	-178.3	-169.6	64.2	1.4	0	0	111.1	S477 H483 K484	S477-Q481 PolarHBondContact O-N 3.04Å; Q481-H483 VanDerWaalsContact C-N 3.25Å; Q481-H483 PolarHBondContact O-N 2.88Å; Q481-K484 PolarHBondContact O-N 2.71Å
482	R	81.3	Confident	81.2	Confident	107 Å²	107	66.5 Å²	66.5	40%	0.404	37%	0.365	S	S	.	.	H	α-helix	trans	-67.3	-23.3	172.3	-165.6	175.7	71.4	-117.6	-3.5	113.2	G478 D479 V480 N504	G478-R482 VanDerWaalsContact O-CB 3.23Å; G478-R482 WeakPolarHBondContact O-CB 3.47Å; G478-R482 PolarHBondContact O-N 3.32Å; G478-R482 VanDerWaalsContact O-N 3.16Å; D479-R482 IonicContact OD1-CZ 2.66Å; D479-R482 IonicContact OD1-NH1 2.66Å; D479-R482 PolarHBondContact OD1-NH1 2.82Å; D479-R482 IonicContact OD1-NH2 2.61Å; D479-R482 PolarHBondContact OD1-NH2 3Å; V480-R482 VanDerWaalsContact C-N 3.29Å; V480-R482 PolarHBondContact O-N 3.18Å; R482-N504 WeakPolarHBondContact CG-OD1 3.37Å
483	H	84.6	Confident	81	Confident	26 Å²	26	63.7 Å²	63.7	12%	0.12	35%	0.354	C	S	.	.	H	α-helix	trans	-80.2	-35.2	171.1	-176.8	40.7	0	0	0	113.2	C470 F474 D479 V480 Q481 V485 V486 H487	C470-H483 PolarHBondContact SG-NE2 3.05Å; C470-H483 VanDerWaalsContact SG-NE2 3.39Å; F474-H483 HydrophobicContact CE1-CB 4.23Å; F474-H483 HydrophobicContact CE2-CB 4.17Å; F474-H483 AromaticContact CE2-CD2 3.45Å; F474-H483 VanDerWaalsContact CE2-CD2 3.45Å; F474-H483 WeakPolarHBondContact CE2-CD2 3.36Å; F474-H483 AromaticContact CE2-CG 3.99Å; F474-H483 HydrophobicContact CZ-CB 3.71Å; F474-H483 AromaticContact CZ-CD2 3.35Å; F474-H483 WeakPolarHBondContact CZ-CD2 3.46Å; F474-H483 AromaticContact CZ-CG 3.5Å; D479-H483 WeakPolarHBondContact O-CB 3.33Å; D479-H483 PolarHBondContact O-N 2.7Å; V480-H483 CarbonylContact O-C 3.55Å; V480-H483 WeakPolarHBondContact O-CA 3.39Å; V480-H483 WeakPolarHBondContact O-CB 3.28Å; V480-H483 PolarHBondContact O-N 3.44Å; Q481-H483 VanDerWaalsContact C-N 3.25Å; Q481-H483 PolarHBondContact O-N 2.88Å; H483-V485 PolarHBondContact O-N 3.29Å; H483-V486 VanDerWaalsContact O-CB 3.23Å; H483-V486 WeakPolarHBondContact O-CB 3.49Å; H483-V486 WeakPolarHBondContact O-CG2 3.25Å; H483-V486 PolarHBondContact O-N 3.46Å; H483-H487 AromaticContact CD2-NE2 3.26Å; H483-H487 PolarHBondContact CD2-NE2 2.97Å; H483-H487 VanDerWaalsContact CD2-NE2 3.26Å; H483-H487 AromaticContact CE1-NE2 3.18Å; H483-H487 PolarHBondContact CE1-NE2 2.9Å; H483-H487 AromaticContact NE2-NE2 2.59Å; H483-H487 PolarHBondContact NE2-NE2 3.31Å
484	K	81.8	Confident	80.9	Confident	51 Å²	51	66.1 Å²	66.1	22%	0.222	36%	0.362	C	S	.	.	H	α-helix	trans	-56.2	-35.6	175	-72.4	-168.9	178.5	-167.9	0	111.4	E468 V480 Q481 V486 H487 T488	E468-K484 VanDerWaalsContact OE1-CE 3.3Å; E468-K484 WeakPolarHBondContact OE1-CE 3.29Å; E468-K484 IonicContact OE1-NZ 2.75Å; E468-K484 PolarHBondContact OE1-NZ 3.12Å; E468-K484 IonicContact OE2-NZ 3.85Å; E468-K484 PolarHBondContact OE2-NZ 3.22Å; V480-K484 HydrophobicContact CG1-CG 4.35Å; V480-K484 PolarHBondContact O-N 3.43Å; Q481-K484 PolarHBondContact O-N 2.71Å; K484-V486 PolarHBondContact O-N 3.35Å; K484-V486 VanDerWaalsContact O-N 3.17Å; K484-H487 WeakPolarHBondContact O-CB 3.49Å; K484-H487 PolarHBondContact O-N 2.72Å; K484-T488 PolarHBondContact O-N 3.19Å
485	V	81.9	Confident	81	Confident	26 Å²	26	63.6 Å²	63.6	16%	0.158	35%	0.351	C	S	.	.	H	α-helix	trans	-57.6	-25.7	171.9	-178.1	0	0	0	0	113.8	H483 H487 T488 G489 E490 T503	H483-V485 PolarHBondContact O-N 3.29Å; V485-H487 VanDerWaalsContact C-N 3.3Å; V485-T488 WeakPolarHBondContact CA-OG1 3.33Å; V485-T488 PolarHBondContact O-OG1 2.82Å; V485-G489 PolarHBondContact O-N 2.94Å; V485-E490 HydrophobicContact CG1-CB 4.27Å; V485-E490 VanDerWaalsContact CG1-O 3.25Å; V485-E490 WeakPolarHBondContact CG1-O 3.35Å; V485-T503 HydrophobicContact CG1-CG2 4.01Å
486	V	80.6	Confident	80.9	Confident	85 Å²	85	67.7 Å²	67.7	52%	0.515	37%	0.371	S	S	.	.	H	α-helix	trans	-71	-28.8	175.7	-175.5	0	0	0	0	111.6	H483 K484	H483-V486 VanDerWaalsContact O-CB 3.23Å; H483-V486 WeakPolarHBondContact O-CB 3.49Å; H483-V486 WeakPolarHBondContact O-CG2 3.25Å; H483-V486 PolarHBondContact O-N 3.46Å; K484-V486 PolarHBondContact O-N 3.35Å; K484-V486 VanDerWaalsContact O-N 3.17Å
487	H	78.8	Confident	80.8	Confident	84 Å²	84	71.9 Å²	71.9	39%	0.389	39%	0.39	S	S	.	.	H	α-helix	trans	-83.7	-38.7	178.4	-63.7	-74.6	0	0	0	112.4	C467 L469 C470 H483 K484 V485 G489	C467-H487 PolarHBondContact SG-NE2 2.83Å; L469-H487 HydrophobicContact CD1-CB 3.59Å; C470-H487 WeakPolarHBondContact CB-CE1 3.34Å; C470-H487 PolarHBondContact SG-CE1 3.13Å; C470-H487 PolarHBondContact SG-NE2 3.31Å; H483-H487 AromaticContact CD2-NE2 3.26Å; H483-H487 PolarHBondContact CD2-NE2 2.97Å; H483-H487 VanDerWaalsContact CD2-NE2 3.26Å; H483-H487 AromaticContact CE1-NE2 3.18Å; H483-H487 PolarHBondContact CE1-NE2 2.9Å; H483-H487 AromaticContact NE2-NE2 2.59Å; H483-H487 PolarHBondContact NE2-NE2 3.31Å; K484-H487 WeakPolarHBondContact O-CB 3.49Å; K484-H487 PolarHBondContact O-N 2.72Å; V485-H487 VanDerWaalsContact C-N 3.3Å; H487-G489 PolarHBondContact O-N 3.48Å
488	T	77.3	Confident	80.7	Confident	83 Å²	83	71.5 Å²	71.5	51%	0.509	39%	0.386	S	S	.	.	H	α-helix	trans	-69.3	-22.5	171.7	63.8	0	0	0	0	112.1	K484 V485 E490	K484-T488 PolarHBondContact O-N 3.19Å; V485-T488 WeakPolarHBondContact CA-OG1 3.33Å; V485-T488 PolarHBondContact O-OG1 2.82Å; T488-E490 WeakPolarHBondContact CB-OE2 3.42Å; T488-E490 PolarHBondContact O-N 2.89Å; T488-E490 WeakPolarHBondContact OG1-CB 3.37Å; T488-E490 VanDerWaalsContact OG1-CD 3.29Å; T488-E490 WeakPolarHBondContact OG1-CG 3.29Å; T488-E490 PolarHBondContact OG1-OE2 3.02Å
489	G	73.9	Confident	80.6	Confident	39 Å²	39	72.3 Å²	72.3	40%	0.402	39%	0.394	S	S	.	.			trans	74.2	2.1	-178.8	0	0	0	0	0	114	V485 H487 K491	V485-G489 PolarHBondContact O-N 2.94Å; H487-G489 PolarHBondContact O-N 3.48Å; G489-K491 PolarHBondContact O-NZ 2.94Å
490	E	72.8	Confident	80.4	Confident	116 Å²	116	77.3 Å²	77.3	54%	0.542	41%	0.41	S	S	.	.			trans	-62.4	151.3	179.7	-68	166.9	137.7	0	0	111.4	V485 T488	V485-E490 HydrophobicContact CG1-CB 4.27Å; V485-E490 VanDerWaalsContact CG1-O 3.25Å; V485-E490 WeakPolarHBondContact CG1-O 3.35Å; T488-E490 WeakPolarHBondContact CB-OE2 3.42Å; T488-E490 PolarHBondContact O-N 2.89Å; T488-E490 WeakPolarHBondContact OG1-CB 3.37Å; T488-E490 VanDerWaalsContact OG1-CD 3.29Å; T488-E490 WeakPolarHBondContact OG1-CG 3.29Å; T488-E490 PolarHBondContact OG1-OE2 3.02Å
491	K	79.7	Confident	80.2	Confident	118 Å²	118	77.6 Å²	77.6	51%	0.513	42%	0.415	S	S	.	.			trans	-135	68.9	-176.4	-73.5	161.7	-170.8	117.2	0	109.6	G489 H493 F502	G489-K491 PolarHBondContact O-NZ 2.94Å; K491-H493 PolarHBondContact O-N 3.32Å; K491-F502 CarbonylContact C-O 3.53Å; K491-F502 WeakPolarHBondContact CA-O 3.44Å
492	P	76.4	Confident	80.1	Confident	83 Å²	83	73.1 Å²	73.1	54%	0.539	39%	0.394	S	S	.	.			trans	-61.3	-15	-174.8	25.6	-35.6	0	0	0	113.5
493	H	80.7	Confident	79.9	Confident	58 Å²	58	69.9 Å²	69.9	27%	0.269	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	86.4	177.6	-55.5	-55.5	0	0	0	110.5	K491 F502 L505 L508	K491-H493 PolarHBondContact O-N 3.32Å; H493-F502 HydrophobicContact CB-CB 4.38Å; H493-F502 PolarHBondContact N-O 3.02Å; H493-F502 PolarHBondContact O-N 3.27Å; H493-L505 PolarHBondContact CD2-N 3.44Å; H493-L505 PolarHBondContact NE2-N 3.37Å; H493-L508 HydrophobicContact CB-CB 4.1Å; H493-L508 HydrophobicContact CB-CD2 3.81Å
494	L	84.1	Confident	79.7	Confident	103 Å²	103	70.1 Å²	70.1	54%	0.539	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	152.4	172.1	-61.1	-179.5	0	0	0	111.5	L508	L494-L508 WeakPolarHBondContact O-CD1 3.48Å; L494-L508 WeakPolarHBondContact O-CD2 3.29Å
495	C	85	Confident	79.6	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	40%	0.398	C	S	.	.			trans	-101.7	110.7	173.4	-171.2	0	0	0	0	110.5	I497 C498 G499 R500 F502 L508 H511 H515	C495-I497 PolarHBondContact O-N 2.97Å; C495-C498 PolarHBondContact O-N 3.46Å; C495-G499 WeakPolarHBondContact O-CA 3.32Å; C495-G499 PolarHBondContact O-N 3.43Å; C495-R500 HydrophobicContact CB-CB 4.49Å; C495-R500 VanDerWaalsContact CB-O 3.29Å; C495-R500 WeakPolarHBondContact CB-O 3.46Å; C495-R500 PolarHBondContact N-O 2.73Å; C495-F502 HydrophobicContact CB-CE2 4.37Å; C495-L508 HydrophobicContact CB-CD1 3.51Å; C495-H511 VanDerWaalsContact SG-CD2 3.59Å; C495-H515 PolarHBondContact SG-NE2 3.27Å; C495-H515 VanDerWaalsContact SG-NE2 3.44Å
496	D	82.8	Confident	79.5	Confident	124 Å²	124	74.8 Å²	74.8	66%	0.663	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-26.7	-172.8	-34.4	-63.3	0	0	0	113.2	K512	D496-K512 WeakPolarHBondContact OD2-CE 3.39Å; D496-K512 IonicContact OD2-NZ 3.18Å; D496-K512 PolarHBondContact OD2-NZ 3.35Å
497	I	82	Confident	79.6	Confident	110 Å²	110	74 Å²	74	56%	0.564	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-25.5	-178.3	-57.5	169.7	0	0	0	112.4	C495 H515	C495-I497 PolarHBondContact O-N 2.97Å; I497-H515 HydrophobicContact CB-CB 4.48Å; I497-H515 HydrophobicContact CD1-CB 3.63Å; I497-H515 HydrophobicContact CG2-CB 3.98Å
498	C	79.8	Confident	79.8	Confident	63 Å²	63	70.6 Å²	70.6	43%	0.426	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-144.9	8.2	-171.4	72.5	0	0	0	0	115.8	C495 R500 H511 H515	C495-C498 PolarHBondContact O-N 3.46Å; C498-R500 PolarHBondContact O-N 3.08Å; C498-R500 WeakPolarHBondContact SG-CB 3.47Å; C498-H511 PolarHBondContact SG-NE2 3.14Å; C498-H515 PolarHBondContact SG-NE2 3.23Å
499	G	78.3	Confident	80	Confident	58 Å²	58	73 Å²	73	60%	0.598	40%	0.402	S	S	*	.			trans	65.6	-0.4	-176.8	0	0	0	0	0	115.5	C495 G501	C495-G499 WeakPolarHBondContact O-CA 3.32Å; C495-G499 PolarHBondContact O-N 3.43Å; G499-G501 PolarHBondContact O-N 2.84Å
500	R	79.2	Confident	80.2	Confident	154 Å²	154	74.2 Å²	74.2	58%	0.581	40%	0.397	S	S	*	.			trans	-74.2	120	-172.2	-172.8	174.8	177.1	172.2	-0.9	111.6	C495 C498 F502	C495-R500 HydrophobicContact CB-CB 4.49Å; C495-R500 VanDerWaalsContact CB-O 3.29Å; C495-R500 WeakPolarHBondContact CB-O 3.46Å; C495-R500 PolarHBondContact N-O 2.73Å; C498-R500 PolarHBondContact O-N 3.08Å; C498-R500 WeakPolarHBondContact SG-CB 3.47Å; R500-F502 HydrophobicContact CB-CE2 4Å; R500-F502 HydrophobicContact CG-CE2 3.7Å; R500-F502 HydrophobicContact CG-CZ 3.87Å; R500-F502 VanDerWaalsContact O-CD2 3.26Å; R500-F502 WeakPolarHBondContact O-CD2 3.46Å; R500-F502 WeakPolarHBondContact O-CE2 3.23Å
501	G	80.6	Confident	80.7	Confident	17 Å²	17	69.8 Å²	69.8	18%	0.175	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	145.6	177.4	0	0	0	0	0	115.5	G499	G499-G501 PolarHBondContact O-N 2.84Å
502	F	80.3	Confident	80.8	Confident	31 Å²	31	68.1 Å²	68.1	14%	0.136	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	151.8	178.2	-63.5	-96.5	0	0	0	111.4	K491 H493 C495 R500 N507 L508 H511	K491-F502 CarbonylContact C-O 3.53Å; K491-F502 WeakPolarHBondContact CA-O 3.44Å; H493-F502 HydrophobicContact CB-CB 4.38Å; H493-F502 PolarHBondContact N-O 3.02Å; H493-F502 PolarHBondContact O-N 3.27Å; C495-F502 HydrophobicContact CB-CE2 4.37Å; R500-F502 HydrophobicContact CB-CE2 4Å; R500-F502 HydrophobicContact CG-CE2 3.7Å; R500-F502 HydrophobicContact CG-CZ 3.87Å; R500-F502 VanDerWaalsContact O-CD2 3.26Å; R500-F502 WeakPolarHBondContact O-CD2 3.46Å; R500-F502 WeakPolarHBondContact O-CE2 3.23Å; F502-N507 HydrophobicContact CD1-CB 3.91Å; F502-L508 HydrophobicContact CB-CB 4.38Å; F502-L508 HydrophobicContact CD2-CB 4.28Å; F502-L508 HydrophobicContact CD2-CD1 4.08Å; F502-L508 HydrophobicContact CE2-CD1 4.4Å; F502-L508 HydrophobicContact CG-CB 4.41Å; F502-H511 HydrophobicContact CE1-CB 4.03Å; F502-H511 HydrophobicContact CE2-CB 3.95Å; F502-H511 AromaticContact CE2-CD2 3.22Å; F502-H511 WeakPolarHBondContact CE2-CD2 3.45Å; F502-H511 AromaticContact CE2-CG 3.78Å; F502-H511 HydrophobicContact CZ-CB 3.52Å; F502-H511 AromaticContact CZ-CD2 3.25Å; F502-H511 WeakPolarHBondContact CZ-CD2 3.23Å; F502-H511 AromaticContact CZ-CG 3.37Å
503	T	77.8	Confident	80.8	Confident	38 Å²	38	71.3 Å²	71.3	23%	0.233	37%	0.37	C	S	.	.	S	Bend	trans	-80.3	-20.5	175.6	58.1	0	0	0	0	113.2	V485	V485-T503 HydrophobicContact CG1-CG2 4.01Å
504	N	79.4	Confident	80.6	Confident	32 Å²	32	71.6 Å²	71.6	17%	0.171	38%	0.376	C	S	.	.			trans	-130.9	132.7	-173.3	-49.3	8	0	0	0	110.5	R482 S506 N507 L508	R482-N504 WeakPolarHBondContact CG-OD1 3.37Å; N504-S506 VanDerWaalsContact C-N 3.28Å; N504-S506 PolarHBondContact O-N 2.94Å; N504-N507 HydrophobicContact CB-CB 4.15Å; N504-N507 WeakPolarHBondContact O-CB 3.29Å; N504-N507 PolarHBondContact O-N 2.84Å; N504-L508 PolarHBondContact O-N 3.03Å; N504-L508 VanDerWaalsContact O-N 3.11Å
505	L	79.9	Confident	80	Confident	85 Å²	85	69.8 Å²	69.8	45%	0.445	37%	0.365	S	S	.	.	H	α-helix	trans	-58.4	-37.5	176	-176.7	61.4	0	0	0	112.6	H493 N507 L508 K509	H493-L505 PolarHBondContact CD2-N 3.44Å; H493-L505 PolarHBondContact NE2-N 3.37Å; L505-N507 VanDerWaalsContact C-N 3.29Å; L505-N507 PolarHBondContact O-N 3.35Å; L505-L508 HydrophobicContact CD1-CD2 4.24Å; L505-L508 WeakPolarHBondContact O-CB 3.39Å; L505-L508 PolarHBondContact O-N 2.91Å; L505-K509 PolarHBondContact O-N 3.4Å
506	S	80.3	Confident	79.2	Confident	90 Å²	90	72 Å²	72	63%	0.629	38%	0.383	S	S	*	.	H	α-helix	trans	-62.4	-35.9	176.3	-47.5	0	0	0	0	112.6	N504 K509 E510	N504-S506 VanDerWaalsContact C-N 3.28Å; N504-S506 PolarHBondContact O-N 2.94Å; S506-K509 PolarHBondContact O-N 3.49Å; S506-E510 PolarHBondContact O-N 3.22Å
507	N	82	Confident	78	Confident	68 Å²	68	72.7 Å²	72.7	36%	0.364	39%	0.392	S	S	.	.	H	α-helix	trans	-73.1	-35.2	177.2	-60.6	6.9	0	0	0	110.6	F502 N504 L505 H511	F502-N507 HydrophobicContact CD1-CB 3.91Å; N504-N507 HydrophobicContact CB-CB 4.15Å; N504-N507 WeakPolarHBondContact O-CB 3.29Å; N504-N507 PolarHBondContact O-N 2.84Å; L505-N507 VanDerWaalsContact C-N 3.29Å; L505-N507 PolarHBondContact O-N 3.35Å; N507-H511 WeakPolarHBondContact O-CB 3.49Å; N507-H511 PolarHBondContact O-N 2.92Å
508	L	83.9	Confident	77	Confident	13 Å²	13	72 Å²	72	7%	0.068	39%	0.39	C	S	.	.	H	α-helix	trans	-64.2	-41.5	169.6	173.3	62.1	0	0	0	111.5	H493 L494 C495 F502 N504 L505 H511 K512	H493-L508 HydrophobicContact CB-CB 4.1Å; H493-L508 HydrophobicContact CB-CD2 3.81Å; L494-L508 WeakPolarHBondContact O-CD1 3.48Å; L494-L508 WeakPolarHBondContact O-CD2 3.29Å; C495-L508 HydrophobicContact CB-CD1 3.51Å; F502-L508 HydrophobicContact CB-CB 4.38Å; F502-L508 HydrophobicContact CD2-CB 4.28Å; F502-L508 HydrophobicContact CD2-CD1 4.08Å; F502-L508 HydrophobicContact CE2-CD1 4.4Å; F502-L508 HydrophobicContact CG-CB 4.41Å; N504-L508 PolarHBondContact O-N 3.03Å; N504-L508 VanDerWaalsContact O-N 3.11Å; L505-L508 HydrophobicContact CD1-CD2 4.24Å; L505-L508 WeakPolarHBondContact O-CB 3.39Å; L505-L508 PolarHBondContact O-N 2.91Å; L508-H511 CarbonylContact O-C 3.5Å; L508-H511 PolarHBondContact O-N 3.45Å; L508-H511 VanDerWaalsContact O-N 3.15Å; L508-K512 HydrophobicContact CD1-CG 4.18Å; L508-K512 PolarHBondContact O-N 3Å
509	K	81.6	Confident	76	Confident	133 Å²	133	75.9 Å²	75.9	58%	0.578	40%	0.395	S	S	*	.	H	α-helix	trans	-64.5	-42.5	175.8	-72.5	-172.7	178	-171.5	0	112.1	L505 S506 H511 K512 R513	L505-K509 PolarHBondContact O-N 3.4Å; S506-K509 PolarHBondContact O-N 3.49Å; K509-H511 VanDerWaalsContact C-N 3.27Å; K509-H511 PolarHBondContact O-N 2.81Å; K509-K512 PolarHBondContact O-N 3.27Å; K509-R513 PolarHBondContact O-N 3.25Å
510	E	78.8	Confident	75.6	Confident	64 Å²	64	76.9 Å²	76.9	30%	0.299	39%	0.39	S	S	.	.	H	α-helix	trans	-62.3	-35	171.2	-165.8	-176.6	138.4	0	0	111.4	S506 R534 K535	S506-E510 PolarHBondContact O-N 3.22Å; E510-R534 IonicContact OE2-NH2 2.68Å; E510-K535 IonicContact OE1-NZ 3.09Å; E510-K535 PolarHBondContact OE1-NZ 2.7Å
511	H	82.7	Confident	75.3	Confident	23 Å²	23	72.9 Å²	72.9	11%	0.106	38%	0.377	C	S	.	.	H	α-helix	trans	-73.3	-37	175.9	-175.6	39.4	0	0	0	114.2	C495 C498 F502 N507 L508 K509 R513 T514 H515	C495-H511 VanDerWaalsContact SG-CD2 3.59Å; C498-H511 PolarHBondContact SG-NE2 3.14Å; F502-H511 HydrophobicContact CE1-CB 4.03Å; F502-H511 HydrophobicContact CE2-CB 3.95Å; F502-H511 AromaticContact CE2-CD2 3.22Å; F502-H511 WeakPolarHBondContact CE2-CD2 3.45Å; F502-H511 AromaticContact CE2-CG 3.78Å; F502-H511 HydrophobicContact CZ-CB 3.52Å; F502-H511 AromaticContact CZ-CD2 3.25Å; F502-H511 WeakPolarHBondContact CZ-CD2 3.23Å; F502-H511 AromaticContact CZ-CG 3.37Å; N507-H511 WeakPolarHBondContact O-CB 3.49Å; N507-H511 PolarHBondContact O-N 2.92Å; L508-H511 CarbonylContact O-C 3.5Å; L508-H511 PolarHBondContact O-N 3.45Å; L508-H511 VanDerWaalsContact O-N 3.15Å; K509-H511 VanDerWaalsContact C-N 3.27Å; K509-H511 PolarHBondContact O-N 2.81Å; H511-R513 PolarHBondContact O-N 3.26Å; H511-T514 PolarHBondContact CE1-OG1 3.45Å; H511-T514 VanDerWaalsContact CE1-OG1 3.32Å; H511-T514 PolarHBondContact ND1-OG1 3.44Å; H511-T514 WeakPolarHBondContact O-CA 3.3Å; H511-T514 WeakPolarHBondContact O-CB 3.47Å; H511-T514 PolarHBondContact O-N 3.16Å; H511-T514 PolarHBondContact O-OG1 3.07Å; H511-H515 AromaticContact CD2-NE2 3.75Å; H511-H515 AromaticContact CE1-CE1 3.6Å; H511-H515 AromaticContact CE1-NE2 3.25Å; H511-H515 PolarHBondContact CE1-NE2 3.09Å; H511-H515 VanDerWaalsContact CE1-NE2 3.25Å; H511-H515 AromaticContact NE2-CE1 3.72Å; H511-H515 AromaticContact NE2-NE2 3.08Å; H511-H515 PolarHBondContact NE2-NE2 3.09Å
512	K	80.6	Confident	75.2	Confident	83 Å²	83	75.9 Å²	75.9	36%	0.361	39%	0.392	S	S	.	.	H	α-helix	trans	-60.6	-34.5	174.9	-76.5	-170.5	172.3	-168.2	0	111.2	D496 L508 K509 T514 H515 A516	D496-K512 WeakPolarHBondContact OD2-CE 3.39Å; D496-K512 IonicContact OD2-NZ 3.18Å; D496-K512 PolarHBondContact OD2-NZ 3.35Å; L508-K512 HydrophobicContact CD1-CG 4.18Å; L508-K512 PolarHBondContact O-N 3Å; K509-K512 PolarHBondContact O-N 3.27Å; K512-T514 PolarHBondContact O-N 3.14Å; K512-T514 VanDerWaalsContact O-N 3.14Å; K512-H515 PolarHBondContact O-N 3.49Å; K512-A516 PolarHBondContact O-N 3.23Å; K512-A516 VanDerWaalsContact O-N 3.13Å
513	R	78.1	Confident	75.4	Confident	150 Å²	150	74.5 Å²	74.5	57%	0.566	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-1.5	168.2	-65.7	177.6	177.1	160.8	-3.6	115.1	K509 H511 N531	K509-R513 PolarHBondContact O-N 3.25Å; H511-R513 PolarHBondContact O-N 3.26Å; R513-N531 HydrophobicContact CB-CB 4.35Å; R513-N531 WeakPolarHBondContact O-CB 3.45Å
514	T	74.7	Confident	75.6	Confident	65 Å²	65	78.2 Å²	78.2	40%	0.399	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-9	168.2	79.7	0	0	0	0	113.2	H511 K512	H511-T514 PolarHBondContact CE1-OG1 3.45Å; H511-T514 VanDerWaalsContact CE1-OG1 3.32Å; H511-T514 PolarHBondContact ND1-OG1 3.44Å; H511-T514 WeakPolarHBondContact O-CA 3.3Å; H511-T514 WeakPolarHBondContact O-CB 3.47Å; H511-T514 PolarHBondContact O-N 3.16Å; H511-T514 PolarHBondContact O-OG1 3.07Å; K512-T514 PolarHBondContact O-N 3.14Å; K512-T514 VanDerWaalsContact O-N 3.14Å
515	H	73.1	Confident	75.7	Confident	64 Å²	64	82.1 Å²	82.1	30%	0.296	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-33.6	174.3	-60.1	-58.4	0	0	0	111.9	C495 I497 C498 H511 K512 T517	C495-H515 PolarHBondContact SG-NE2 3.27Å; C495-H515 VanDerWaalsContact SG-NE2 3.44Å; I497-H515 HydrophobicContact CB-CB 4.48Å; I497-H515 HydrophobicContact CD1-CB 3.63Å; I497-H515 HydrophobicContact CG2-CB 3.98Å; C498-H515 PolarHBondContact SG-NE2 3.23Å; H511-H515 AromaticContact CD2-NE2 3.75Å; H511-H515 AromaticContact CE1-CE1 3.6Å; H511-H515 AromaticContact CE1-NE2 3.25Å; H511-H515 PolarHBondContact CE1-NE2 3.09Å; H511-H515 VanDerWaalsContact CE1-NE2 3.25Å; H511-H515 AromaticContact NE2-CE1 3.72Å; H511-H515 AromaticContact NE2-NE2 3.08Å; H511-H515 PolarHBondContact NE2-NE2 3.09Å; K512-H515 PolarHBondContact O-N 3.49Å; H515-T517 PolarHBondContact O-N 2.95Å
516	A	67.5	Low	75.9	Confident	47 Å²	47	80 Å²	80	39%	0.388	41%	0.414	S	S	.	.	S	Bend	trans	-57.2	129.7	164.2	0	0	0	0	0	109.6	K512 D518	K512-A516 PolarHBondContact O-N 3.23Å; K512-A516 VanDerWaalsContact O-N 3.13Å; A516-D518 HydrophobicContact CB-CB 4.37Å; A516-D518 PolarHBondContact O-N 3.23Å
517	T	58.6	Low	75.8	Confident	139 Å²	139	78.6 Å²	78.6	85%	0.853	41%	0.413	S	S	*	.	S	Bend	trans	-68.2	-16.9	171.4	38.6	0	0	0	0	112.3	H515 R519	H515-T517 PolarHBondContact O-N 2.95Å; T517-R519 VanDerWaalsContact C-N 3.32Å; T517-R519 PolarHBondContact O-N 3.44Å
518	D	59.2	Low	75.7	Confident	95 Å²	95	80.9 Å²	80.9	51%	0.508	42%	0.42	S	S	.	.			trans	-58.1	90.5	166.1	173.5	23.3	0	0	0	111.5	A516 T520	A516-D518 HydrophobicContact CB-CB 4.37Å; A516-D518 PolarHBondContact O-N 3.23Å; D518-T520 VanDerWaalsContact C-N 3.31Å; D518-T520 WeakPolarHBondContact OD1-CA 3.36Å; D518-T520 VanDerWaalsContact OD1-CG2 3.31Å; D518-T520 WeakPolarHBondContact OD1-CG2 3.41Å; D518-T520 PolarHBondContact OD1-N 3.24Å; D518-T520 PolarHBondContact OD1-OG1 2.99Å
519	R	60.3	Low	75.4	Confident	144 Å²	144	82.2 Å²	82.2	54%	0.543	43%	0.43	S	S	.	.			trans	-98.5	46.8	168.5	-61	176.9	-176.8	170.7	6.2	110.6	T517 F521 S529 F530	T517-R519 VanDerWaalsContact C-N 3.32Å; T517-R519 PolarHBondContact O-N 3.44Å; R519-F521 CarbonylContact O-C 3.58Å; R519-F521 PolarHBondContact O-N 3Å; R519-S529 WeakPolarHBondContact CD-OG 3.41Å; R519-S529 PolarHBondContact NH1-OG 3.42Å; R519-F530 CarbonylContact C-O 3.59Å
520	T	68.7	Low	75.3	Confident	80 Å²	80	78.2 Å²	78.2	49%	0.491	41%	0.413	S	S	.	.	B	Isolated β-bridge	trans	-8.8	-43.7	167.4	14	0	0	0	0	117.7	D518	D518-T520 VanDerWaalsContact C-N 3.31Å; D518-T520 WeakPolarHBondContact OD1-CA 3.36Å; D518-T520 VanDerWaalsContact OD1-CG2 3.31Å; D518-T520 WeakPolarHBondContact OD1-CG2 3.41Å; D518-T520 PolarHBondContact OD1-N 3.24Å; D518-T520 PolarHBondContact OD1-OG1 2.99Å
521	F	73.1	Confident	75.1	Confident	69 Å²	69	76.9 Å²	76.9	30%	0.303	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	81	-174.6	-54.8	-75.4	0	0	0	111.4	R519 F530 H533 L536	R519-F521 CarbonylContact O-C 3.58Å; R519-F521 PolarHBondContact O-N 3Å; F521-F530 HydrophobicContact CB-CB 4.37Å; F521-F530 WeakPolarHBondContact CB-O 3.2Å; F521-F530 PolarHBondContact N-O 3.47Å; F521-F530 PolarHBondContact O-N 3.28Å; F521-H533 HydrophobicContact CD1-CB 3.8Å; F521-H533 AromaticContact CD1-CD2 3.94Å; F521-H533 VanDerWaalsContact CD2-N 3.32Å; F521-H533 HydrophobicContact CE1-CB 3.7Å; F521-H533 HydrophobicContact CE2-CB 4.48Å; F521-H533 HydrophobicContact CG-CB 4.24Å; F521-H533 HydrophobicContact CZ-CB 4.06Å; F521-L536 HydrophobicContact CB-CB 3.94Å; F521-L536 HydrophobicContact CB-CD2 3.75Å; F521-L536 HydrophobicContact CB-CG 4.46Å
522	T	79.3	Confident	74.7	Confident	81 Å²	81	76.8 Å²	76.8	50%	0.497	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	152.8	170	39.5	0	0	0	0	112.6	K528 L536	T522-K528 CarbonylContact C-O 3.57Å; T522-L536 WeakPolarHBondContact O-CD1 3.38Å; T522-L536 WeakPolarHBondContact O-CD2 3.25Å
523	C	84.6	Confident	74.7	Confident	1 Å²	1	77.9 Å²	77.9	1%	0.007	42%	0.415	C	S	.	.			trans	-107.3	99	171.6	-172.8	0	0	0	0	109.7	Q525 C526 G527 K528 F530 L536	C523-Q525 PolarHBondContact O-N 3.05Å; C523-C526 CarbonylContact O-C 3.42Å; C523-C526 PolarHBondContact O-N 2.83Å; C523-G527 WeakPolarHBondContact O-CA 3.32Å; C523-G527 PolarHBondContact O-N 3.37Å; C523-K528 VanDerWaalsContact CB-O 3.23Å; C523-K528 WeakPolarHBondContact CB-O 3.14Å; C523-K528 PolarHBondContact N-O 3.04Å; C523-F530 HydrophobicContact CB-CE2 4.44Å; C523-L536 HydrophobicContact CB-CD1 3.52Å
524	D	81.1	Confident	74.7	Confident	116 Å²	116	78.6 Å²	78.6	62%	0.62	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.8	-36.9	178.7	7.9	-63.2	0	0	0	113.5	C526 K540	D524-C526 PolarHBondContact O-N 3.5Å; D524-K540 IonicContact OD1-NZ 3.96Å; D524-K540 PolarHBondContact OD1-NZ 3Å; D524-K540 WeakPolarHBondContact OD2-CE 3.36Å; D524-K540 IonicContact OD2-NZ 2.67Å; D524-K540 PolarHBondContact OD2-NZ 2.86Å
525	Q	81.3	Confident	74.9	Confident	115 Å²	115	78.8 Å²	78.8	54%	0.537	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-8.3	179.9	-65.1	177.8	-3.8	0	0	115.7	C523	C523-Q525 PolarHBondContact O-N 3.05Å
526	C	84	Confident	75.4	Confident	41 Å²	41	76.3 Å²	76.3	28%	0.277	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-159.3	19	175.2	73.5	0	0	0	0	116.7	C523 D524 K528 H539 H543	C523-C526 CarbonylContact O-C 3.42Å; C523-C526 PolarHBondContact O-N 2.83Å; D524-C526 PolarHBondContact O-N 3.5Å; C526-K528 PolarHBondContact O-N 3.44Å; C526-H539 PolarHBondContact SG-NE2 2.94Å; C526-H543 WeakPolarHBondContact CB-NE2 3.31Å; C526-H543 PolarHBondContact SG-NE2 3.5Å
527	G	78.6	Confident	76.1	Confident	59 Å²	59	79 Å²	79	61%	0.608	41%	0.409	S	S	*	.			trans	66.8	-7.2	179.5	0	0	0	0	0	116.5	C523 S529	C523-G527 WeakPolarHBondContact O-CA 3.32Å; C523-G527 PolarHBondContact O-N 3.37Å; G527-S529 PolarHBondContact O-N 3.12Å
528	K	79.4	Confident	77.1	Confident	117 Å²	117	77.3 Å²	77.3	51%	0.509	39%	0.39	S	S	.	.			trans	-70.7	125.7	-172.1	-72.9	170.3	-169.9	155.2	0	111	T522 C523 C526 F530	T522-K528 CarbonylContact C-O 3.57Å; C523-K528 VanDerWaalsContact CB-O 3.23Å; C523-K528 WeakPolarHBondContact CB-O 3.14Å; C523-K528 PolarHBondContact N-O 3.04Å; C526-K528 PolarHBondContact O-N 3.44Å; K528-F530 HydrophobicContact CB-CE2 3.79Å; K528-F530 HydrophobicContact CB-CZ 4.19Å; K528-F530 VanDerWaalsContact O-CD2 3.3Å; K528-F530 WeakPolarHBondContact O-CD2 3.4Å; K528-F530 WeakPolarHBondContact O-CE2 3.01Å
529	S	78.4	Confident	78.2	Confident	40 Å²	40	73 Å²	73	28%	0.28	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	137.8	-169.9	52.2	0	0	0	0	112.8	R519 G527	R519-S529 WeakPolarHBondContact CD-OG 3.41Å; R519-S529 PolarHBondContact NH1-OG 3.42Å; G527-S529 PolarHBondContact O-N 3.12Å
530	F	78.8	Confident	79.2	Confident	50 Å²	50	68.9 Å²	68.9	22%	0.219	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	144.6	-167.9	-63.4	-96	0	0	0	112.3	R519 F521 C523 K528 T532 K535 L536 H539	R519-F530 CarbonylContact C-O 3.59Å; F521-F530 HydrophobicContact CB-CB 4.37Å; F521-F530 WeakPolarHBondContact CB-O 3.2Å; F521-F530 PolarHBondContact N-O 3.47Å; F521-F530 PolarHBondContact O-N 3.28Å; C523-F530 HydrophobicContact CB-CE2 4.44Å; K528-F530 HydrophobicContact CB-CE2 3.79Å; K528-F530 HydrophobicContact CB-CZ 4.19Å; K528-F530 VanDerWaalsContact O-CD2 3.3Å; K528-F530 WeakPolarHBondContact O-CD2 3.4Å; K528-F530 WeakPolarHBondContact O-CE2 3.01Å; F530-T532 VanDerWaalsContact C-N 3.26Å; F530-T532 PolarHBondContact O-N 3.28Å; F530-K535 HydrophobicContact CB-CB 4.3Å; F530-K535 HydrophobicContact CD1-CB 3.83Å; F530-K535 HydrophobicContact CG-CB 4.37Å; F530-L536 HydrophobicContact CB-CB 4.42Å; F530-L536 HydrophobicContact CD2-CB 4.34Å; F530-L536 HydrophobicContact CD2-CD1 4.18Å; F530-H539 HydrophobicContact CE1-CB 4.36Å; F530-H539 HydrophobicContact CE2-CB 4.22Å; F530-H539 AromaticContact CE2-CD2 3.14Å; F530-H539 WeakPolarHBondContact CE2-CD2 3.46Å; F530-H539 AromaticContact CE2-CG 3.93Å; F530-H539 AromaticContact CE2-NE2 3.93Å; F530-H539 HydrophobicContact CZ-CB 3.85Å; F530-H539 AromaticContact CZ-CD2 3.22Å; F530-H539 WeakPolarHBondContact CZ-CD2 3.31Å; F530-H539 AromaticContact CZ-CG 3.6Å; F530-H539 AromaticContact CZ-NE2 3.93Å
531	N	75.1	Confident	79.8	Confident	35 Å²	35	66 Å²	66	19%	0.187	34%	0.337	C	S	.	.	S	Bend	trans	-82.2	12	176.8	50.1	49.8	0	0	0	114.7	R513 K535	R513-N531 HydrophobicContact CB-CB 4.35Å; R513-N531 WeakPolarHBondContact O-CB 3.45Å; N531-K535 WeakPolarHBondContact OD1-CD 3.34Å; N531-K535 PolarHBondContact OD1-NZ 3.4Å
532	T	74.7	Confident	80.1	Confident	22 Å²	22	69.8 Å²	69.8	14%	0.135	35%	0.349	C	S	.	.	S	Bend	trans	-162.7	130.8	177	-41.9	0	0	0	0	111.4	F530 R534 K535 L536	F530-T532 VanDerWaalsContact C-N 3.26Å; F530-T532 PolarHBondContact O-N 3.28Å; T532-R534 VanDerWaalsContact C-N 3.28Å; T532-R534 HydrophobicContact CG2-CB 4.22Å; T532-R534 PolarHBondContact O-N 3.22Å; T532-K535 WeakPolarHBondContact O-CA 3.49Å; T532-K535 WeakPolarHBondContact O-CB 3.42Å; T532-K535 PolarHBondContact O-N 3.1Å; T532-K535 PolarHBondContact OG1-NZ 3.18Å; T532-L536 PolarHBondContact O-N 2.7Å
533	H	79.3	Confident	80	Confident	106 Å²	106	70.1 Å²	70.1	49%	0.491	35%	0.345	S	S	.	.	H	α-helix	trans	-48.8	-44.1	175.2	-173.3	-120.2	0	0	0	113.8	F521 K535 L536 L537	F521-H533 HydrophobicContact CD1-CB 3.8Å; F521-H533 AromaticContact CD1-CD2 3.94Å; F521-H533 VanDerWaalsContact CD2-N 3.32Å; F521-H533 HydrophobicContact CE1-CB 3.7Å; F521-H533 HydrophobicContact CE2-CB 4.48Å; F521-H533 HydrophobicContact CG-CB 4.24Å; F521-H533 HydrophobicContact CZ-CB 4.06Å; H533-K535 PolarHBondContact O-N 3.39Å; H533-L536 CarbonylContact O-C 3.23Å; H533-L536 WeakPolarHBondContact O-CB 3.5Å; H533-L536 PolarHBondContact O-N 3.31Å; H533-L536 VanDerWaalsContact O-N 3.09Å; H533-L537 PolarHBondContact O-N 3.36Å
534	R	79.3	Confident	79.4	Confident	165 Å²	165	73.5 Å²	73.5	62%	0.623	37%	0.365	S	S	*	.	H	α-helix	trans	-57.4	-30.5	176	179.9	174.5	60.8	-176.4	-5	114.1	E510 T532 K538	E510-R534 IonicContact OE2-NH2 2.68Å; T532-R534 VanDerWaalsContact C-N 3.28Å; T532-R534 HydrophobicContact CG2-CB 4.22Å; T532-R534 PolarHBondContact O-N 3.22Å; R534-K538 PolarHBondContact O-N 2.62Å
535	K	79.4	Confident	78.7	Confident	69 Å²	69	69.7 Å²	69.7	30%	0.3	35%	0.354	S	S	.	.	H	α-helix	trans	-79.5	-38.8	176.9	-63.1	177.9	-175.9	114.7	0	110.8	E510 F530 N531 T532 H533 H539	E510-K535 IonicContact OE1-NZ 3.09Å; E510-K535 PolarHBondContact OE1-NZ 2.7Å; F530-K535 HydrophobicContact CB-CB 4.3Å; F530-K535 HydrophobicContact CD1-CB 3.83Å; F530-K535 HydrophobicContact CG-CB 4.37Å; N531-K535 WeakPolarHBondContact OD1-CD 3.34Å; N531-K535 PolarHBondContact OD1-NZ 3.4Å; T532-K535 WeakPolarHBondContact O-CA 3.49Å; T532-K535 WeakPolarHBondContact O-CB 3.42Å; T532-K535 PolarHBondContact O-N 3.1Å; T532-K535 PolarHBondContact OG1-NZ 3.18Å; H533-K535 PolarHBondContact O-N 3.39Å; K535-H539 WeakPolarHBondContact O-CB 3.19Å; K535-H539 PolarHBondContact O-N 3.08Å; K535-H539 VanDerWaalsContact O-N 3.12Å
536	L	83.1	Confident	78.1	Confident	11 Å²	11	69.9 Å²	69.9	6%	0.058	36%	0.355	C	S	.	.	H	α-helix	trans	-60.8	-47.4	170.9	172.8	61.8	0	0	0	111.4	F521 T522 C523 F530 T532 H533 K538 H539 K540	F521-L536 HydrophobicContact CB-CB 3.94Å; F521-L536 HydrophobicContact CB-CD2 3.75Å; F521-L536 HydrophobicContact CB-CG 4.46Å; T522-L536 WeakPolarHBondContact O-CD1 3.38Å; T522-L536 WeakPolarHBondContact O-CD2 3.25Å; C523-L536 HydrophobicContact CB-CD1 3.52Å; F530-L536 HydrophobicContact CB-CB 4.42Å; F530-L536 HydrophobicContact CD2-CB 4.34Å; F530-L536 HydrophobicContact CD2-CD1 4.18Å; T532-L536 PolarHBondContact O-N 2.7Å; H533-L536 CarbonylContact O-C 3.23Å; H533-L536 WeakPolarHBondContact O-CB 3.5Å; H533-L536 PolarHBondContact O-N 3.31Å; H533-L536 VanDerWaalsContact O-N 3.09Å; L536-K538 PolarHBondContact O-N 3.37Å; L536-H539 CarbonylContact O-C 3.51Å; L536-H539 WeakPolarHBondContact O-CA 3.47Å; L536-H539 VanDerWaalsContact O-CB 3.3Å; L536-H539 WeakPolarHBondContact O-CB 3.17Å; L536-H539 PolarHBondContact O-N 3.04Å; L536-K540 HydrophobicContact CD1-CD 4.39Å; L536-K540 HydrophobicContact CD1-CG 3.96Å; L536-K540 HydrophobicContact CG-CD 4.48Å; L536-K540 HydrophobicContact CG-CG 4.33Å; L536-K540 PolarHBondContact O-N 3.37Å
537	L	81.8	Confident	77.5	Confident	105 Å²	105	72.2 Å²	72.2	55%	0.55	36%	0.36	S	S	.	.	H	α-helix	trans	-62	-46.3	-179.3	-172.9	63.3	0	0	0	112	H533 H539 K540 A541	H533-L537 PolarHBondContact O-N 3.36Å; L537-H539 PolarHBondContact O-N 3.26Å; L537-H539 VanDerWaalsContact O-N 3.13Å; L537-K540 PolarHBondContact O-N 3.13Å; L537-A541 WeakPolarHBondContact O-CB 3.46Å; L537-A541 PolarHBondContact O-N 3.01Å
538	K	79.5	Confident	77.4	Confident	103 Å²	103	73.8 Å²	73.8	45%	0.448	36%	0.362	S	S	.	.	H	α-helix	trans	-61.7	-17.8	171.5	-80.5	-165.9	162.8	-170.9	0	113.9	R534 L536 D560	R534-K538 PolarHBondContact O-N 2.62Å; L536-K538 PolarHBondContact O-N 3.37Å; K538-D560 IonicContact NZ-OD1 3.89Å; K538-D560 PolarHBondContact NZ-OD1 3.24Å; K538-D560 IonicContact NZ-OD2 3.82Å; K538-D560 PolarHBondContact NZ-OD2 3.05Å
539	H	83.1	Confident	77.3	Confident	4 Å²	4	71.4 Å²	71.4	2%	0.019	35%	0.353	C	S	.	.	H	α-helix	trans	-89.7	-42.5	173.9	176.9	30.9	0	0	0	112.9	C526 F530 K535 L536 L537 A541 R542 H543	C526-H539 PolarHBondContact SG-NE2 2.94Å; F530-H539 HydrophobicContact CE1-CB 4.36Å; F530-H539 HydrophobicContact CE2-CB 4.22Å; F530-H539 AromaticContact CE2-CD2 3.14Å; F530-H539 WeakPolarHBondContact CE2-CD2 3.46Å; F530-H539 AromaticContact CE2-CG 3.93Å; F530-H539 AromaticContact CE2-NE2 3.93Å; F530-H539 HydrophobicContact CZ-CB 3.85Å; F530-H539 AromaticContact CZ-CD2 3.22Å; F530-H539 WeakPolarHBondContact CZ-CD2 3.31Å; F530-H539 AromaticContact CZ-CG 3.6Å; F530-H539 AromaticContact CZ-NE2 3.93Å; K535-H539 WeakPolarHBondContact O-CB 3.19Å; K535-H539 PolarHBondContact O-N 3.08Å; K535-H539 VanDerWaalsContact O-N 3.12Å; L536-H539 CarbonylContact O-C 3.51Å; L536-H539 WeakPolarHBondContact O-CA 3.47Å; L536-H539 VanDerWaalsContact O-CB 3.3Å; L536-H539 WeakPolarHBondContact O-CB 3.17Å; L536-H539 PolarHBondContact O-N 3.04Å; L537-H539 PolarHBondContact O-N 3.26Å; L537-H539 VanDerWaalsContact O-N 3.13Å; H539-A541 VanDerWaalsContact C-N 3.27Å; H539-A541 PolarHBondContact O-N 3.04Å; H539-R542 PolarHBondContact CE1-NH2 3.33Å; H539-R542 VanDerWaalsContact CE1-NH2 3.28Å; H539-R542 PolarHBondContact ND1-NH2 3.25Å; H539-R542 VanDerWaalsContact O-CB 3.29Å; H539-R542 WeakPolarHBondContact O-CB 3.32Å; H539-R542 PolarHBondContact O-N 3.46Å; H539-H543 AromaticContact CE1-CD2 3.82Å; H539-H543 AromaticContact CE1-NE2 3.98Å
540	K	81.2	Confident	77.5	Confident	57 Å²	57	74 Å²	74	25%	0.248	36%	0.363	C	S	.	.	H	α-helix	trans	-57.8	-41.5	172.9	-68.9	-163.5	-178.2	-165.4	0	110.6	D524 L536 L537 R542 H543 T544	D524-K540 IonicContact OD1-NZ 3.96Å; D524-K540 PolarHBondContact OD1-NZ 3Å; D524-K540 WeakPolarHBondContact OD2-CE 3.36Å; D524-K540 IonicContact OD2-NZ 2.67Å; D524-K540 PolarHBondContact OD2-NZ 2.86Å; L536-K540 HydrophobicContact CD1-CD 4.39Å; L536-K540 HydrophobicContact CD1-CG 3.96Å; L536-K540 HydrophobicContact CG-CD 4.48Å; L536-K540 HydrophobicContact CG-CG 4.33Å; L536-K540 PolarHBondContact O-N 3.37Å; L537-K540 PolarHBondContact O-N 3.13Å; K540-R542 PolarHBondContact O-N 3.24Å; K540-H543 WeakPolarHBondContact O-CB 3.45Å; K540-H543 PolarHBondContact O-N 2.76Å; K540-T544 PolarHBondContact O-N 3.41Å; K540-T544 PolarHBondContact O-OG1 3.34Å
541	A	80.5	Confident	77.9	Confident	19 Å²	19	71.7 Å²	71.7	16%	0.157	35%	0.352	C	S	.	.	H	α-helix	trans	-59.6	-13.1	172.3	0	0	0	0	0	115.3	L537 H539 T544 I559	L537-A541 WeakPolarHBondContact O-CB 3.46Å; L537-A541 PolarHBondContact O-N 3.01Å; H539-A541 VanDerWaalsContact C-N 3.27Å; H539-A541 PolarHBondContact O-N 3.04Å; A541-T544 WeakPolarHBondContact CA-OG1 3.44Å; A541-I559 HydrophobicContact CB-CG2 3.79Å
542	R	78.9	Confident	78.1	Confident	150 Å²	150	75.1 Å²	75.1	57%	0.566	39%	0.385	S	S	*	.	H	α-helix	trans	-87.6	-21.6	171.4	-165.9	172.5	70.5	-133.5	-2.1	113	H539 K540 I559	H539-R542 PolarHBondContact CE1-NH2 3.33Å; H539-R542 VanDerWaalsContact CE1-NH2 3.28Å; H539-R542 PolarHBondContact ND1-NH2 3.25Å; H539-R542 VanDerWaalsContact O-CB 3.29Å; H539-R542 WeakPolarHBondContact O-CB 3.32Å; H539-R542 PolarHBondContact O-N 3.46Å; K540-R542 PolarHBondContact O-N 3.24Å; R542-I559 HydrophobicContact CB-CD1 3.72Å; R542-I559 HydrophobicContact CG-CD1 3.66Å
543	H	77.1	Confident	78.4	Confident	87 Å²	87	78.7 Å²	78.7	40%	0.403	41%	0.407	S	S	.	.	H	α-helix	trans	-88.1	-44.9	174.9	-62.8	-66.1	0	0	0	111.7	C526 H539 K540 G545	C526-H543 WeakPolarHBondContact CB-NE2 3.31Å; C526-H543 PolarHBondContact SG-NE2 3.5Å; H539-H543 AromaticContact CE1-CD2 3.82Å; H539-H543 AromaticContact CE1-NE2 3.98Å; K540-H543 WeakPolarHBondContact O-CB 3.45Å; K540-H543 PolarHBondContact O-N 2.76Å; H543-G545 PolarHBondContact O-N 3.37Å; H543-G545 VanDerWaalsContact O-N 3.15Å
544	T	72.1	Confident	78.6	Confident	72 Å²	72	76 Å²	76	44%	0.442	40%	0.4	S	S	.	.	S	Bend	trans	-66.1	-14.1	175.9	59.4	0	0	0	0	113.1	K540 A541 E546	K540-T544 PolarHBondContact O-N 3.41Å; K540-T544 PolarHBondContact O-OG1 3.34Å; A541-T544 WeakPolarHBondContact CA-OG1 3.44Å; T544-E546 WeakPolarHBondContact CB-OE2 3.47Å; T544-E546 PolarHBondContact O-N 3.25Å; T544-E546 WeakPolarHBondContact OG1-CG 3.49Å; T544-E546 PolarHBondContact OG1-OE2 3.01Å
545	G	67.9	Low	78.7	Confident	37 Å²	37	70.3 Å²	70.3	38%	0.381	39%	0.393	S	S	.	.			trans	72.3	4.9	-178.7	0	0	0	0	0	114.1	H543 K547	H543-G545 PolarHBondContact O-N 3.37Å; H543-G545 VanDerWaalsContact O-N 3.15Å; G545-K547 VanDerWaalsContact C-N 3.25Å; G545-K547 WeakPolarHBondContact O-CG 3.48Å; G545-K547 PolarHBondContact O-N 3.42Å
546	E	67.3	Low	78.8	Confident	119 Å²	119	73 Å²	73	56%	0.556	41%	0.405	S	S	*	.			trans	-65.4	78.9	-177.3	-70.7	172.4	115.4	0	0	112.2	T544 S548	T544-E546 WeakPolarHBondContact CB-OE2 3.47Å; T544-E546 PolarHBondContact O-N 3.25Å; T544-E546 WeakPolarHBondContact OG1-CG 3.49Å; T544-E546 PolarHBondContact OG1-OE2 3.01Å; E546-S548 PolarHBondContact O-N 3.47Å
547	K	71.7	Confident	78.7	Confident	89 Å²	89	79.1 Å²	79.1	39%	0.387	43%	0.427	S	S	.	.			trans	-89.5	86	177.5	-69.4	153.2	174.7	177.8	0	109	G545 H549 R557 F558 I559	G545-K547 VanDerWaalsContact C-N 3.25Å; G545-K547 WeakPolarHBondContact O-CG 3.48Å; G545-K547 PolarHBondContact O-N 3.42Å; K547-H549 PolarHBondContact O-N 2.99Å; K547-R557 HydrophobicContact CB-CB 3.4Å; K547-R557 HydrophobicContact CD-CB 4Å; K547-R557 WeakPolarHBondContact CD-O 3.39Å; K547-R557 HydrophobicContact CG-CB 4.25Å; K547-R557 PolarHBondContact O-NE 3.32Å; K547-R557 PolarHBondContact O-NH2 2.82Å; K547-F558 CarbonylContact C-O 3.55Å; K547-F558 VanDerWaalsContact C-O 3.31Å; K547-F558 WeakPolarHBondContact CA-O 3.36Å; K547-F558 WeakPolarHBondContact CB-O 3.18Å; K547-I559 HydrophobicContact CG-CG1 3.79Å
548	S	76.2	Confident	78.6	Confident	92 Å²	92	76.3 Å²	76.3	64%	0.643	41%	0.41	S	S	*	.			trans	-68	-18.5	-178.5	-41.5	0	0	0	0	113.9	E546 F558	E546-S548 PolarHBondContact O-N 3.47Å; S548-F558 PolarHBondContact N-O 3.39Å
549	H	77.6	Confident	78.6	Confident	68 Å²	68	73.5 Å²	73.5	32%	0.315	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	104	-173.1	-63.9	-56.8	0	0	0	111.4	K547 R557 F558 D560 S561 L564	K547-H549 PolarHBondContact O-N 2.99Å; H549-R557 CarbonylContact O-C 3.45Å; H549-R557 WeakPolarHBondContact O-CA 3.46Å; H549-F558 HydrophobicContact CB-CB 4.4Å; H549-F558 PolarHBondContact N-O 2.88Å; H549-F558 VanDerWaalsContact N-O 3.09Å; H549-F558 PolarHBondContact O-N 3.36Å; H549-D560 VanDerWaalsContact CD2-C 3.45Å; H549-S561 PolarHBondContact CD2-N 2.75Å; H549-S561 PolarHBondContact NE2-N 3.38Å; H549-L564 HydrophobicContact CB-CB 4.08Å; H549-L564 HydrophobicContact CB-CD2 3.82Å
550	I	82.9	Confident	78.4	Confident	95 Å²	95	75.6 Å²	75.6	49%	0.487	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	138.5	-176.6	-47	-170.3	0	0	0	110.5	R557 L564	I550-R557 HydrophobicContact CD1-CG 4.37Å; I550-R557 HydrophobicContact CG1-CG 4.04Å; I550-R557 HydrophobicContact CG2-CG 4.29Å; I550-L564 WeakPolarHBondContact O-CD2 3.17Å
551	C	86.4	Confident	78.4	Confident	1 Å²	1	75.9 Å²	75.9	1%	0.007	42%	0.42	C	S	.	.			trans	-85.2	109.8	170.8	-175.3	0	0	0	0	110.8	T553 C554 G555 K556 F558 L564 H571	C551-T553 PolarHBondContact O-N 3.03Å; C551-C554 PolarHBondContact O-N 3.25Å; C551-G555 WeakPolarHBondContact O-CA 3.41Å; C551-G555 PolarHBondContact O-N 3.48Å; C551-K556 WeakPolarHBondContact CB-O 3.48Å; C551-K556 PolarHBondContact N-O 3.21Å; C551-F558 HydrophobicContact CB-CE2 4.31Å; C551-L564 HydrophobicContact CB-CD1 3.55Å; C551-H571 VanDerWaalsContact SG-CD2 3.59Å; C551-H571 PolarHBondContact SG-NE2 3.24Å; C551-H571 VanDerWaalsContact SG-NE2 3.42Å
552	A	81.2	Confident	78.5	Confident	106 Å²	106	76.9 Å²	76.9	88%	0.876	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-39.2	178.9	0	0	0	0	0	113	C554	A552-C554 VanDerWaalsContact C-N 3.29Å; A552-C554 PolarHBondContact O-N 3.1Å
553	T	80.9	Confident	78.6	Confident	97 Å²	97	72.3 Å²	72.3	60%	0.595	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-16.2	-176.3	-33.7	0	0	0	0	114.7	C551 H571	C551-T553 PolarHBondContact O-N 3.03Å; T553-H571 HydrophobicContact CG2-CB 4.09Å
554	C	83.4	Confident	79.1	Confident	49 Å²	49	69.2 Å²	69.2	33%	0.331	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-159.1	15.2	-175.4	68.7	0	0	0	0	116.1	C551 A552 K556 H567 H571	C551-C554 PolarHBondContact O-N 3.25Å; A552-C554 VanDerWaalsContact C-N 3.29Å; A552-C554 PolarHBondContact O-N 3.1Å; C554-K556 PolarHBondContact O-N 3.03Å; C554-H567 PolarHBondContact SG-NE2 3.49Å; C554-H571 VanDerWaalsContact SG-CE1 3.54Å; C554-H571 PolarHBondContact SG-NE2 2.91Å
555	G	81.3	Confident	79.6	Confident	47 Å²	47	70.6 Å²	70.6	49%	0.485	41%	0.407	S	S	.	.			trans	66.9	-10.5	179.9	0	0	0	0	0	116.6	C551 R557	C551-G555 WeakPolarHBondContact O-CA 3.41Å; C551-G555 PolarHBondContact O-N 3.48Å; G555-R557 WeakPolarHBondContact O-CG 3.06Å; G555-R557 PolarHBondContact O-N 3.16Å
556	K	80.9	Confident	80.4	Confident	125 Å²	125	73.2 Å²	73.2	54%	0.543	41%	0.405	S	S	.	.			trans	-61.6	124.7	-174.7	-69.8	175.3	-174.1	170.9	0	111	C551 C554 F558	C551-K556 WeakPolarHBondContact CB-O 3.48Å; C551-K556 PolarHBondContact N-O 3.21Å; C554-K556 PolarHBondContact O-N 3.03Å; K556-F558 HydrophobicContact CB-CE2 3.76Å; K556-F558 HydrophobicContact CB-CZ 4.08Å; K556-F558 WeakPolarHBondContact O-CD2 3.32Å; K556-F558 WeakPolarHBondContact O-CE2 3.27Å
557	R	81.6	Confident	81.2	Confident	140 Å²	140	68.8 Å²	68.8	53%	0.528	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	137.9	-175.5	-49	-179.1	56.4	173.2	-1.4	111.6	K547 H549 I550 G555	K547-R557 HydrophobicContact CB-CB 3.4Å; K547-R557 HydrophobicContact CD-CB 4Å; K547-R557 WeakPolarHBondContact CD-O 3.39Å; K547-R557 HydrophobicContact CG-CB 4.25Å; K547-R557 PolarHBondContact O-NE 3.32Å; K547-R557 PolarHBondContact O-NH2 2.82Å; H549-R557 CarbonylContact O-C 3.45Å; H549-R557 WeakPolarHBondContact O-CA 3.46Å; I550-R557 HydrophobicContact CD1-CG 4.37Å; I550-R557 HydrophobicContact CG1-CG 4.04Å; I550-R557 HydrophobicContact CG2-CG 4.29Å; G555-R557 WeakPolarHBondContact O-CG 3.06Å; G555-R557 PolarHBondContact O-N 3.16Å
558	F	80	Confident	81.9	Confident	45 Å²	45	66.7 Å²	66.7	20%	0.197	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	155.7	-176.9	-61.6	-90.8	0	0	0	112.2	K547 S548 H549 C551 K556 D563 L564 H567	K547-F558 CarbonylContact C-O 3.55Å; K547-F558 VanDerWaalsContact C-O 3.31Å; K547-F558 WeakPolarHBondContact CA-O 3.36Å; K547-F558 WeakPolarHBondContact CB-O 3.18Å; S548-F558 PolarHBondContact N-O 3.39Å; H549-F558 HydrophobicContact CB-CB 4.4Å; H549-F558 PolarHBondContact N-O 2.88Å; H549-F558 VanDerWaalsContact N-O 3.09Å; H549-F558 PolarHBondContact O-N 3.36Å; C551-F558 HydrophobicContact CB-CE2 4.31Å; K556-F558 HydrophobicContact CB-CE2 3.76Å; K556-F558 HydrophobicContact CB-CZ 4.08Å; K556-F558 WeakPolarHBondContact O-CD2 3.32Å; K556-F558 WeakPolarHBondContact O-CE2 3.27Å; F558-D563 HydrophobicContact CB-CB 4.35Å; F558-D563 HydrophobicContact CD1-CB 4.06Å; F558-L564 HydrophobicContact CB-CB 4.15Å; F558-L564 HydrophobicContact CD2-CB 4.09Å; F558-L564 HydrophobicContact CD2-CD1 3.92Å; F558-L564 HydrophobicContact CE2-CD1 4.26Å; F558-L564 HydrophobicContact CG-CB 4.24Å; F558-H567 HydrophobicContact CE1-CB 4Å; F558-H567 HydrophobicContact CE2-CB 4.02Å; F558-H567 AromaticContact CE2-CD2 3.24Å; F558-H567 WeakPolarHBondContact CE2-CD2 3.27Å; F558-H567 AromaticContact CE2-CG 3.8Å; F558-H567 HydrophobicContact CZ-CB 3.55Å; F558-H567 AromaticContact CZ-CD2 3.26Å; F558-H567 WeakPolarHBondContact CZ-CD2 3.38Å; F558-H567 AromaticContact CZ-CG 3.37Å
559	I	77.9	Confident	82.3	Confident	45 Å²	45	65.2 Å²	65.2	23%	0.231	36%	0.357	C	S	.	.	S	Bend	trans	-87.8	-24.4	-177.9	-55.7	161.8	0	0	0	111.5	A541 R542 K547	A541-I559 HydrophobicContact CB-CG2 3.79Å; R542-I559 HydrophobicContact CB-CD1 3.72Å; R542-I559 HydrophobicContact CG-CD1 3.66Å; K547-I559 HydrophobicContact CG-CG1 3.79Å
560	D	79.6	Confident	82.6	Confident	48 Å²	48	65.8 Å²	65.8	26%	0.257	37%	0.369	S	S	.	.	S	Bend	trans	-129.2	137.9	-176.5	-155.8	-9.3	0	0	0	110.3	K538 H549 G562 D563 L564	K538-D560 IonicContact NZ-OD1 3.89Å; K538-D560 PolarHBondContact NZ-OD1 3.24Å; K538-D560 IonicContact NZ-OD2 3.82Å; K538-D560 PolarHBondContact NZ-OD2 3.05Å; H549-D560 VanDerWaalsContact CD2-C 3.45Å; D560-G562 PolarHBondContact O-N 3.16Å; D560-D563 HydrophobicContact CB-CB 4.18Å; D560-D563 WeakPolarHBondContact O-CA 3.36Å; D560-D563 WeakPolarHBondContact O-CB 3.37Å; D560-D563 PolarHBondContact O-N 2.72Å; D560-L564 PolarHBondContact O-N 3.28Å
561	S	81.3	Confident	82.5	Confident	62 Å²	62	64.7 Å²	64.7	43%	0.434	36%	0.362	S	S	.	.	H	α-helix	trans	-63.2	-31.4	179.1	61.1	0	0	0	0	111.6	H549 D563 L564 Q565	H549-S561 PolarHBondContact CD2-N 2.75Å; H549-S561 PolarHBondContact NE2-N 3.38Å; S561-D563 VanDerWaalsContact C-N 3.3Å; S561-D563 PolarHBondContact O-N 3.15Å; S561-L564 PolarHBondContact O-N 2.98Å; S561-Q565 WeakPolarHBondContact O-CB 3.47Å; S561-Q565 VanDerWaalsContact O-CG 3.3Å; S561-Q565 WeakPolarHBondContact O-CG 3.38Å; S561-Q565 PolarHBondContact O-N 2.98Å
562	G	82.1	Confident	82.3	Confident	40 Å²	40	68.3 Å²	68.3	41%	0.412	38%	0.384	S	S	.	.	H	α-helix	trans	-69.5	-22	171.9	0	0	0	0	0	114.6	D560 R566	D560-G562 PolarHBondContact O-N 3.16Å; G562-R566 WeakPolarHBondContact O-CB 3.36Å; G562-R566 PolarHBondContact O-N 3.24Å
563	D	82.3	Confident	82.2	Confident	55 Å²	55	65.4 Å²	65.4	29%	0.294	36%	0.364	S	S	.	.	H	α-helix	trans	-81.1	-42.4	172	-77.2	-14.5	0	0	0	110.9	F558 D560 S561 R566 H567	F558-D563 HydrophobicContact CB-CB 4.35Å; F558-D563 HydrophobicContact CD1-CB 4.06Å; D560-D563 HydrophobicContact CB-CB 4.18Å; D560-D563 WeakPolarHBondContact O-CA 3.36Å; D560-D563 WeakPolarHBondContact O-CB 3.37Å; D560-D563 PolarHBondContact O-N 2.72Å; S561-D563 VanDerWaalsContact C-N 3.3Å; S561-D563 PolarHBondContact O-N 3.15Å; D563-R566 VanDerWaalsContact CG-NH2 3.28Å; D563-R566 PolarHBondContact O-N 3.48Å; D563-R566 IonicContact OD1-CZ 2.7Å; D563-R566 IonicContact OD1-NH1 3.33Å; D563-R566 PolarHBondContact OD1-NH1 3.44Å; D563-R566 IonicContact OD1-NH2 2.72Å; D563-R566 PolarHBondContact OD1-NH2 2.92Å; D563-R566 IonicContact OD2-NH2 3.88Å; D563-H567 PolarHBondContact O-N 3.38Å
564	L	85.9	Confident	82.2	Confident	21 Å²	21	64.8 Å²	64.8	11%	0.11	35%	0.354	C	S	.	.	H	α-helix	trans	-58	-50.9	170.7	170.3	59.6	0	0	0	111.2	H549 I550 C551 F558 D560 S561 R566 H567 I568	H549-L564 HydrophobicContact CB-CB 4.08Å; H549-L564 HydrophobicContact CB-CD2 3.82Å; I550-L564 WeakPolarHBondContact O-CD2 3.17Å; C551-L564 HydrophobicContact CB-CD1 3.55Å; F558-L564 HydrophobicContact CB-CB 4.15Å; F558-L564 HydrophobicContact CD2-CB 4.09Å; F558-L564 HydrophobicContact CD2-CD1 3.92Å; F558-L564 HydrophobicContact CE2-CD1 4.26Å; F558-L564 HydrophobicContact CG-CB 4.24Å; D560-L564 PolarHBondContact O-N 3.28Å; S561-L564 PolarHBondContact O-N 2.98Å; L564-R566 VanDerWaalsContact C-N 3.28Å; L564-R566 PolarHBondContact O-N 2.95Å; L564-H567 CarbonylContact O-C 3.55Å; L564-H567 WeakPolarHBondContact O-CA 3.43Å; L564-H567 WeakPolarHBondContact O-CB 3.46Å; L564-H567 PolarHBondContact O-N 3.35Å; L564-I568 HydrophobicContact CD1-CD1 3.98Å; L564-I568 HydrophobicContact CD1-CG1 4.01Å; L564-I568 HydrophobicContact CG-CD1 3.92Å; L564-I568 HydrophobicContact CG-CG1 4.4Å; L564-I568 WeakPolarHBondContact O-CG1 3.5Å; L564-I568 PolarHBondContact O-N 3.25Å
565	Q	82.9	Confident	82.2	Confident	102 Å²	102	67.8 Å²	67.8	48%	0.477	36%	0.362	S	S	.	.	H	α-helix	trans	-61.7	-34.4	179.3	-77.4	-69	-22	0	0	112.6	S561 H567	S561-Q565 WeakPolarHBondContact O-CB 3.47Å; S561-Q565 VanDerWaalsContact O-CG 3.3Å; S561-Q565 WeakPolarHBondContact O-CG 3.38Å; S561-Q565 PolarHBondContact O-N 2.98Å; Q565-H567 VanDerWaalsContact C-N 3.29Å; Q565-H567 PolarHBondContact O-N 3.42Å
566	R	84.3	Confident	82.3	Confident	92 Å²	92	68.9 Å²	68.9	35%	0.347	36%	0.361	S	S	.	.	H	α-helix	trans	-66.1	-32.3	170.9	-179.7	179.1	65.1	-111.6	2.5	112.5	G562 D563 L564 R588	G562-R566 WeakPolarHBondContact O-CB 3.36Å; G562-R566 PolarHBondContact O-N 3.24Å; D563-R566 VanDerWaalsContact CG-NH2 3.28Å; D563-R566 PolarHBondContact O-N 3.48Å; D563-R566 IonicContact OD1-CZ 2.7Å; D563-R566 IonicContact OD1-NH1 3.33Å; D563-R566 PolarHBondContact OD1-NH1 3.44Å; D563-R566 IonicContact OD1-NH2 2.72Å; D563-R566 PolarHBondContact OD1-NH2 2.92Å; D563-R566 IonicContact OD2-NH2 3.88Å; L564-R566 VanDerWaalsContact C-N 3.28Å; L564-R566 PolarHBondContact O-N 2.95Å; R566-R588 HydrophobicContact CG-CG 4.49Å
567	H	85.8	Confident	82.4	Confident	26 Å²	26	66.8 Å²	66.8	12%	0.12	35%	0.35	C	S	.	.	H	α-helix	trans	-79.8	-33.1	177.9	173.8	51.2	0	0	0	113.1	C554 F558 D563 L564 Q565 R569 S570 H571	C554-H567 PolarHBondContact SG-NE2 3.49Å; F558-H567 HydrophobicContact CE1-CB 4Å; F558-H567 HydrophobicContact CE2-CB 4.02Å; F558-H567 AromaticContact CE2-CD2 3.24Å; F558-H567 WeakPolarHBondContact CE2-CD2 3.27Å; F558-H567 AromaticContact CE2-CG 3.8Å; F558-H567 HydrophobicContact CZ-CB 3.55Å; F558-H567 AromaticContact CZ-CD2 3.26Å; F558-H567 WeakPolarHBondContact CZ-CD2 3.38Å; F558-H567 AromaticContact CZ-CG 3.37Å; D563-H567 PolarHBondContact O-N 3.38Å; L564-H567 CarbonylContact O-C 3.55Å; L564-H567 WeakPolarHBondContact O-CA 3.43Å; L564-H567 WeakPolarHBondContact O-CB 3.46Å; L564-H567 PolarHBondContact O-N 3.35Å; Q565-H567 VanDerWaalsContact C-N 3.29Å; Q565-H567 PolarHBondContact O-N 3.42Å; H567-R569 PolarHBondContact O-N 3.49Å; H567-S570 PolarHBondContact ND1-OG 3.41Å; H567-S570 PolarHBondContact O-N 2.96Å; H567-S570 PolarHBondContact O-OG 3.38Å; H567-H571 AromaticContact CD2-NE2 3.82Å; H567-H571 AromaticContact CE1-CE1 3.59Å; H567-H571 AromaticContact CE1-NE2 3.2Å; H567-H571 PolarHBondContact CE1-NE2 3.32Å; H567-H571 AromaticContact NE2-CE1 3.76Å; H567-H571 AromaticContact NE2-NE2 3.03Å; H567-H571 PolarHBondContact NE2-NE2 3.07Å
568	I	84.9	Confident	82.6	Confident	44 Å²	44	63.6 Å²	63.6	23%	0.226	35%	0.346	C	S	.	.	H	α-helix	trans	-56.5	-37.4	173.5	-69.7	167.7	0	0	0	110.6	L564 S570 H571 T572	L564-I568 HydrophobicContact CD1-CD1 3.98Å; L564-I568 HydrophobicContact CD1-CG1 4.01Å; L564-I568 HydrophobicContact CG-CD1 3.92Å; L564-I568 HydrophobicContact CG-CG1 4.4Å; L564-I568 WeakPolarHBondContact O-CG1 3.5Å; L564-I568 PolarHBondContact O-N 3.25Å; I568-S570 PolarHBondContact O-N 3.15Å; I568-S570 VanDerWaalsContact O-N 3.13Å; I568-H571 WeakPolarHBondContact O-CA 3.42Å; I568-H571 WeakPolarHBondContact O-CB 3.46Å; I568-H571 PolarHBondContact O-N 3.05Å; I568-T572 HydrophobicContact CG2-CG2 3.99Å; I568-T572 PolarHBondContact O-N 2.93Å; I568-T572 PolarHBondContact O-OG1 3.4Å
569	R	85.4	Confident	83	Confident	62 Å²	62	61.6 Å²	61.6	23%	0.234	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-9.3	172.4	-59.8	-167.3	-171	111.1	15	116.3	H567 E574	H567-R569 PolarHBondContact O-N 3.49Å; R569-E574 HydrophobicContact CB-CB 4.15Å; R569-E574 HydrophobicContact CG-CB 3.91Å; R569-E574 IonicContact NE-OE2 2.7Å; R569-E574 PolarHBondContact NE-OE2 3.33Å
570	S	82.8	Confident	83.1	Confident	79 Å²	79	67.1 Å²	67.1	55%	0.552	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-13.4	167	54.6	0	0	0	0	113.4	H567 I568	H567-S570 PolarHBondContact ND1-OG 3.41Å; H567-S570 PolarHBondContact O-N 2.96Å; H567-S570 PolarHBondContact O-OG 3.38Å; I568-S570 PolarHBondContact O-N 3.15Å; I568-S570 VanDerWaalsContact O-N 3.13Å
571	H	82.2	Confident	83.2	Confident	73 Å²	73	69.8 Å²	69.8	34%	0.338	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-46.6	171.6	-54.8	-56	0	0	0	111.6	C551 T553 C554 H567 I568 G573	C551-H571 VanDerWaalsContact SG-CD2 3.59Å; C551-H571 PolarHBondContact SG-NE2 3.24Å; C551-H571 VanDerWaalsContact SG-NE2 3.42Å; T553-H571 HydrophobicContact CG2-CB 4.09Å; C554-H571 VanDerWaalsContact SG-CE1 3.54Å; C554-H571 PolarHBondContact SG-NE2 2.91Å; H567-H571 AromaticContact CD2-NE2 3.82Å; H567-H571 AromaticContact CE1-CE1 3.59Å; H567-H571 AromaticContact CE1-NE2 3.2Å; H567-H571 PolarHBondContact CE1-NE2 3.32Å; H567-H571 AromaticContact NE2-CE1 3.76Å; H567-H571 AromaticContact NE2-NE2 3.03Å; H567-H571 PolarHBondContact NE2-NE2 3.07Å; I568-H571 WeakPolarHBondContact O-CA 3.42Å; I568-H571 WeakPolarHBondContact O-CB 3.46Å; I568-H571 PolarHBondContact O-N 3.05Å; H571-G573 PolarHBondContact O-N 3.07Å
572	T	81.8	Confident	83.4	Confident	76 Å²	76	69.3 Å²	69.3	47%	0.466	38%	0.382	S	S	.	.	S	Bend	trans	-73.6	-6.7	179.8	62.2	0	0	0	0	113.7	I568 E574	I568-T572 HydrophobicContact CG2-CG2 3.99Å; I568-T572 PolarHBondContact O-N 2.93Å; I568-T572 PolarHBondContact O-OG1 3.4Å; T572-E574 WeakPolarHBondContact CB-OE1 3.39Å; T572-E574 PolarHBondContact O-N 3.49Å; T572-E574 VanDerWaalsContact OG1-CD 3.29Å; T572-E574 WeakPolarHBondContact OG1-CG 3.47Å; T572-E574 PolarHBondContact OG1-OE1 3.15Å
573	G	79.1	Confident	83.4	Confident	45 Å²	45	70 Å²	70	46%	0.464	39%	0.388	S	S	.	.			trans	67.2	-1.2	-177.3	0	0	0	0	0	115.2	H571 K575	H571-G573 PolarHBondContact O-N 3.07Å; G573-K575 WeakPolarHBondContact O-CG 3.43Å; G573-K575 PolarHBondContact O-N 3.34Å
574	E	80.9	Confident	83.4	Confident	85 Å²	85	73.2 Å²	73.2	40%	0.397	40%	0.4	S	S	.	.			trans	-50.2	123.3	-177.3	-85.2	168	-116.1	0	0	112.9	R569 T572 P576 T587	R569-E574 HydrophobicContact CB-CB 4.15Å; R569-E574 HydrophobicContact CG-CB 3.91Å; R569-E574 IonicContact NE-OE2 2.7Å; R569-E574 PolarHBondContact NE-OE2 3.33Å; T572-E574 WeakPolarHBondContact CB-OE1 3.39Å; T572-E574 PolarHBondContact O-N 3.49Å; T572-E574 VanDerWaalsContact OG1-CD 3.29Å; T572-E574 WeakPolarHBondContact OG1-CG 3.47Å; T572-E574 PolarHBondContact OG1-OE1 3.15Å; E574-P576 VanDerWaalsContact C-CD 3.5Å; E574-P576 HydrophobicContact CB-CG 4.45Å; E574-P576 WeakPolarHBondContact O-CD 3.49Å; E574-T587 WeakPolarHBondContact O-CG2 3.25Å
575	K	82.9	Confident	83.4	Confident	111 Å²	111	74.6 Å²	74.6	48%	0.483	41%	0.411	S	S	.	.			trans	-122.3	68.4	177.4	-72.1	158.3	-175.5	174.1	0	111.7	G573 Y577 S585 F586 T587	G573-K575 WeakPolarHBondContact O-CG 3.43Å; G573-K575 PolarHBondContact O-N 3.34Å; K575-Y577 PolarHBondContact O-N 2.91Å; K575-S585 WeakPolarHBondContact CD-OG 3.37Å; K575-F586 CarbonylContact C-O 3.27Å; K575-F586 VanDerWaalsContact C-O 3.27Å; K575-F586 WeakPolarHBondContact CA-O 3.44Å; K575-T587 HydrophobicContact CG-CG2 3.84Å
576	P	83.8	Confident	83.4	Confident	71 Å²	71	71.8 Å²	71.8	46%	0.461	40%	0.398	S	S	.	.			trans	-69.8	5.5	-172.2	-17.4	33	0	0	0	115.2	E574	E574-P576 VanDerWaalsContact C-CD 3.5Å; E574-P576 HydrophobicContact CB-CG 4.45Å; E574-P576 WeakPolarHBondContact O-CD 3.49Å
577	Y	83.9	Confident	83.3	Confident	81 Å²	81	69.4 Å²	69.4	32%	0.318	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	79.6	-176.9	-55.3	-68.4	0	0	0	109.4	K575 F586	K575-Y577 PolarHBondContact O-N 2.91Å; Y577-F586 WeakPolarHBondContact CB-O 3.38Å; Y577-F586 WeakPolarHBondContact CD2-O 3.48Å; Y577-F586 PolarHBondContact N-O 3.04Å; Y577-F586 WeakPolarHBondContact O-CD2 3.37Å; Y577-F586 PolarHBondContact O-N 2.84Å
578	V	85.2	Confident	83.3	Confident	73 Å²	73	73.4 Å²	73.4	44%	0.442	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	151.3	172	-172.6	0	0	0	0	110	L592	V578-L592 WeakPolarHBondContact O-CD1 3.42Å; V578-L592 VanDerWaalsContact O-CD2 3.27Å; V578-L592 WeakPolarHBondContact O-CD2 3.17Å
579	C	87.2	Confident	83.3	Confident	3 Å²	3	73.8 Å²	73.8	2%	0.02	41%	0.414	C	S	.	.			trans	-103.8	108.2	172.7	-167.6	0	0	0	0	110.5	T581 C582 G583 K584 F586 L592	C579-T581 PolarHBondContact O-N 2.62Å; C579-C582 VanDerWaalsContact CB-SG 3.58Å; C579-C582 PolarHBondContact O-N 3.06Å; C579-G583 PolarHBondContact O-N 3.08Å; C579-K584 WeakPolarHBondContact CB-O 3.39Å; C579-K584 PolarHBondContact N-O 2.81Å; C579-F586 HydrophobicContact CB-CE2 4.26Å; C579-L592 HydrophobicContact CB-CD1 3.38Å
580	D	81.5	Confident	83.3	Confident	160 Å²	160	73.1 Å²	73.1	86%	0.856	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-32.5	-172.5	-38.7	-44	0	0	0	113.3
581	T	81.7	Confident	83.3	Confident	104 Å²	104	73 Å²	73	64%	0.638	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-11.6	-178.9	-33.7	0	0	0	0	114.8	C579 C600	C579-T581 PolarHBondContact O-N 2.62Å; T581-C600 HydrophobicContact CG2-CB 3.99Å
582	C	85.5	Confident	83.6	Confident	53 Å²	53	71 Å²	71	36%	0.358	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-154.4	7.2	-171.7	69.5	0	0	0	0	116	C579 K584 H595	C579-C582 VanDerWaalsContact CB-SG 3.58Å; C579-C582 PolarHBondContact O-N 3.06Å; C582-K584 PolarHBondContact O-N 3.22Å; C582-H595 PolarHBondContact SG-NE2 2.87Å
583	G	81.4	Confident	83.7	Confident	54 Å²	54	73.6 Å²	73.6	56%	0.557	41%	0.406	S	S	*	.			trans	67.8	-11.7	-179.4	0	0	0	0	0	116.1	C579 S585	C579-G583 PolarHBondContact O-N 3.08Å; G583-S585 PolarHBondContact O-N 2.84Å
584	K	82	Confident	84	Confident	123 Å²	123	79.8 Å²	79.8	54%	0.535	42%	0.416	S	S	.	.			trans	-67.1	123	-173.5	-68	179.9	179.8	179.1	0	111.3	C579 C582 F586	C579-K584 WeakPolarHBondContact CB-O 3.39Å; C579-K584 PolarHBondContact N-O 2.81Å; C582-K584 PolarHBondContact O-N 3.22Å; K584-F586 HydrophobicContact CB-CE2 3.98Å; K584-F586 HydrophobicContact CB-CZ 4Å; K584-F586 WeakPolarHBondContact O-CD2 3.41Å; K584-F586 WeakPolarHBondContact O-CE2 3.49Å
585	S	85.8	Confident	84.2	Confident	50 Å²	50	76.8 Å²	76.8	35%	0.35	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	139.8	-174.3	63.8	0	0	0	0	112.6	K575 G583	K575-S585 WeakPolarHBondContact CD-OG 3.37Å; G583-S585 PolarHBondContact O-N 2.84Å
586	F	83.2	Confident	84.1	Confident	43 Å²	43	73.2 Å²	73.2	19%	0.189	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	145.1	-173.9	-59.3	-82.7	0	0	0	112.7	K575 Y577 C579 K584 R588 M591 L592 H595	K575-F586 CarbonylContact C-O 3.27Å; K575-F586 VanDerWaalsContact C-O 3.27Å; K575-F586 WeakPolarHBondContact CA-O 3.44Å; Y577-F586 WeakPolarHBondContact CB-O 3.38Å; Y577-F586 WeakPolarHBondContact CD2-O 3.48Å; Y577-F586 PolarHBondContact N-O 3.04Å; Y577-F586 WeakPolarHBondContact O-CD2 3.37Å; Y577-F586 PolarHBondContact O-N 2.84Å; C579-F586 HydrophobicContact CB-CE2 4.26Å; K584-F586 HydrophobicContact CB-CE2 3.98Å; K584-F586 HydrophobicContact CB-CZ 4Å; K584-F586 WeakPolarHBondContact O-CD2 3.41Å; K584-F586 WeakPolarHBondContact O-CE2 3.49Å; F586-R588 PolarHBondContact O-N 3.01Å; F586-M591 HydrophobicContact CB-CB 4.04Å; F586-M591 HydrophobicContact CD1-CB 3.86Å; F586-M591 HydrophobicContact CG-CB 4.13Å; F586-L592 HydrophobicContact CB-CB 4.41Å; F586-L592 HydrophobicContact CD2-CB 3.94Å; F586-L592 HydrophobicContact CD2-CD1 4.06Å; F586-L592 HydrophobicContact CE2-CD1 4.28Å; F586-L592 HydrophobicContact CG-CB 4.42Å; F586-H595 HydrophobicContact CE1-CB 4.23Å; F586-H595 HydrophobicContact CE2-CB 3.82Å; F586-H595 AromaticContact CE2-CD2 3.77Å; F586-H595 AromaticContact CE2-CG 3.76Å; F586-H595 HydrophobicContact CZ-CB 3.51Å; F586-H595 AromaticContact CZ-CD2 3.73Å; F586-H595 AromaticContact CZ-CG 3.36Å; F586-H595 AromaticContact CZ-ND1 3.78Å
587	T	83.4	Confident	84	Confident	41 Å²	41	75.3 Å²	75.3	25%	0.252	40%	0.398	S	S	.	.	S	Bend	trans	-71.8	-14.4	176.6	64.3	0	0	0	0	113.2	E574 K575	E574-T587 WeakPolarHBondContact O-CG2 3.25Å; K575-T587 HydrophobicContact CG-CG2 3.84Å
588	R	83.9	Confident	83.8	Confident	110 Å²	110	78 Å²	78	42%	0.415	42%	0.415	S	S	.	.	S	Bend	trans	-140.8	132.6	-177.6	-57.9	172	71.4	171.5	4.1	112.1	R566 F586 A590 M591 L592	R566-R588 HydrophobicContact CG-CG 4.49Å; F586-R588 PolarHBondContact O-N 3.01Å; R588-A590 PolarHBondContact O-N 3.34Å; R588-M591 HydrophobicContact CB-CG 4.23Å; R588-M591 HydrophobicContact CB-SD 3.8Å; R588-M591 HydrophobicContact CG-SD 4.01Å; R588-M591 WeakPolarHBondContact O-CB 3.23Å; R588-M591 PolarHBondContact O-N 3.17Å; R588-L592 PolarHBondContact O-N 3.47Å
589	S	85.5	Confident	83	Confident	53 Å²	53	80.8 Å²	80.8	37%	0.371	42%	0.423	S	S	.	.	H	α-helix	trans	-60.4	-14.1	173.6	64.3	0	0	0	0	115	R593	S589-R593 WeakPolarHBondContact O-CB 3.19Å; S589-R593 VanDerWaalsContact O-CG 3.31Å; S589-R593 WeakPolarHBondContact O-CG 3.26Å; S589-R593 PolarHBondContact O-N 2.85Å; S589-R593 PolarHBondContact O-NE 3.28Å
590	A	85.1	Confident	81.9	Confident	47 Å²	47	82 Å²	82	39%	0.388	43%	0.431	S	S	.	.	H	α-helix	trans	-79.8	-30.9	170.8	0	0	0	0	0	112.9	R588 R594	R588-A590 PolarHBondContact O-N 3.34Å; A590-R594 PolarHBondContact O-N 2.95Å
591	M	84.5	Confident	81	Confident	78 Å²	78	83 Å²	83	38%	0.384	43%	0.428	S	S	.	.	H	α-helix	trans	-73	-47.8	172.5	-68.5	156.5	160.9	0	0	109.7	F586 R588 R593 R594 H595	F586-M591 HydrophobicContact CB-CB 4.04Å; F586-M591 HydrophobicContact CD1-CB 3.86Å; F586-M591 HydrophobicContact CG-CB 4.13Å; R588-M591 HydrophobicContact CB-CG 4.23Å; R588-M591 HydrophobicContact CB-SD 3.8Å; R588-M591 HydrophobicContact CG-SD 4.01Å; R588-M591 WeakPolarHBondContact O-CB 3.23Å; R588-M591 PolarHBondContact O-N 3.17Å; M591-R593 PolarHBondContact O-N 3.38Å; M591-R594 WeakPolarHBondContact O-CA 3.39Å; M591-R594 WeakPolarHBondContact O-CB 3.35Å; M591-R594 PolarHBondContact O-N 3.42Å; M591-H595 PolarHBondContact O-N 3.13Å
592	L	87.4	Confident	79.3	Confident	31 Å²	31	81.4 Å²	81.4	16%	0.162	43%	0.432	C	S	.	.	H	α-helix	trans	-50.9	-52.1	171.9	171.8	59.6	0	0	0	111.7	V578 C579 F586 R588 R594 H595 S596	V578-L592 WeakPolarHBondContact O-CD1 3.42Å; V578-L592 VanDerWaalsContact O-CD2 3.27Å; V578-L592 WeakPolarHBondContact O-CD2 3.17Å; C579-L592 HydrophobicContact CB-CD1 3.38Å; F586-L592 HydrophobicContact CB-CB 4.41Å; F586-L592 HydrophobicContact CD2-CB 3.94Å; F586-L592 HydrophobicContact CD2-CD1 4.06Å; F586-L592 HydrophobicContact CE2-CD1 4.28Å; F586-L592 HydrophobicContact CG-CB 4.42Å; R588-L592 PolarHBondContact O-N 3.47Å; L592-R594 PolarHBondContact O-N 3.21Å; L592-H595 PolarHBondContact O-N 3.4Å; L592-H595 VanDerWaalsContact O-N 3.13Å; L592-S596 PolarHBondContact O-N 3.16Å; L592-S596 PolarHBondContact O-OG 3.44Å
593	R	84.2	Confident	77.3	Confident	129 Å²	129	85.4 Å²	85.4	49%	0.487	46%	0.457	S	S	.	.	H	α-helix	trans	-65.1	-21.5	177.8	-76.5	-174.3	-59.9	121.5	-2.2	114.8	S589 M591 N597	S589-R593 WeakPolarHBondContact O-CB 3.19Å; S589-R593 VanDerWaalsContact O-CG 3.31Å; S589-R593 WeakPolarHBondContact O-CG 3.26Å; S589-R593 PolarHBondContact O-N 2.85Å; S589-R593 PolarHBondContact O-NE 3.28Å; M591-R593 PolarHBondContact O-N 3.38Å; R593-N597 WeakPolarHBondContact O-CB 3.31Å; R593-N597 PolarHBondContact O-ND2 2.82Å; R593-N597 VanDerWaalsContact O-ND2 3.1Å
594	R	85.2	Confident	75.2	Confident	176 Å²	176	88.1 Å²	88.1	66%	0.664	47%	0.467	S	S	*	.	H	α-helix	trans	-76.1	-48.3	170.8	-175.6	-171.4	-67.3	165.1	-5.7	109.3	A590 M591 L592 N597 M598	A590-R594 PolarHBondContact O-N 2.95Å; M591-R594 WeakPolarHBondContact O-CA 3.39Å; M591-R594 WeakPolarHBondContact O-CB 3.35Å; M591-R594 PolarHBondContact O-N 3.42Å; L592-R594 PolarHBondContact O-N 3.21Å; R594-N597 PolarHBondContact O-N 3.47Å; R594-M598 HydrophobicContact CG-SD 3.81Å; R594-M598 WeakPolarHBondContact O-CG 3.46Å; R594-M598 PolarHBondContact O-N 3.04Å
595	H	84.9	Confident	73	Confident	22 Å²	22	87.3 Å²	87.3	10%	0.102	48%	0.484	C	S	.	.	H	α-helix	trans	-59.5	-51	179.3	-176.1	73.5	0	0	0	112.3	C582 F586 M591 L592 N597 M598 H599	C582-H595 PolarHBondContact SG-NE2 2.87Å; F586-H595 HydrophobicContact CE1-CB 4.23Å; F586-H595 HydrophobicContact CE2-CB 3.82Å; F586-H595 AromaticContact CE2-CD2 3.77Å; F586-H595 AromaticContact CE2-CG 3.76Å; F586-H595 HydrophobicContact CZ-CB 3.51Å; F586-H595 AromaticContact CZ-CD2 3.73Å; F586-H595 AromaticContact CZ-CG 3.36Å; F586-H595 AromaticContact CZ-ND1 3.78Å; M591-H595 PolarHBondContact O-N 3.13Å; L592-H595 PolarHBondContact O-N 3.4Å; L592-H595 VanDerWaalsContact O-N 3.13Å; H595-N597 PolarHBondContact O-N 2.97Å; H595-M598 PolarHBondContact O-N 3.03Å; H595-H599 AromaticContact CE1-CD2 3.28Å; H595-H599 PolarHBondContact CE1-CD2 3.26Å; H595-H599 AromaticContact CE1-CG 3.54Å; H595-H599 AromaticContact CE1-NE2 3.99Å; H595-H599 AromaticContact ND1-CD2 3.18Å; H595-H599 PolarHBondContact ND1-CD2 3.27Å; H595-H599 AromaticContact ND1-CG 3.9Å; H595-H599 AromaticContact ND1-NE2 3.86Å; H595-H599 PolarHBondContact O-N 2.82Å
596	S	81.5	Confident	70.5	Confident	36 Å²	36	90.4 Å²	90.4	25%	0.252	51%	0.506	S	S	.	.	H	α-helix	trans	-60.3	-32.9	178.8	71	0	0	0	0	112.8	L592 M598 C600	L592-S596 PolarHBondContact O-N 3.16Å; L592-S596 PolarHBondContact O-OG 3.44Å; S596-M598 VanDerWaalsContact C-N 3.29Å; S596-M598 PolarHBondContact O-N 3.34Å; S596-C600 WeakPolarHBondContact O-CB 3.39Å; S596-C600 PolarHBondContact O-N 3.23Å
597	N	82.3	Confident	67.9	Low	114 Å²	114	93.8 Å²	93.8	61%	0.61	53%	0.534	S	S	*	.	H	α-helix	trans	-75.4	-15.4	176.6	-75.7	-5.3	0	0	0	113.7	R593 R594 H595	R593-N597 WeakPolarHBondContact O-CB 3.31Å; R593-N597 PolarHBondContact O-ND2 2.82Å; R593-N597 VanDerWaalsContact O-ND2 3.1Å; R594-N597 PolarHBondContact O-N 3.47Å; H595-N597 PolarHBondContact O-N 2.97Å
598	M	77.9	Confident	66	Low	138 Å²	138	98.3 Å²	98.3	68%	0.68	57%	0.565	S	S	*	*	H	α-helix	trans	-112.1	-33.8	-174.5	-70.1	177.4	65.7	0	0	113.7	R594 H595 S596	R594-M598 HydrophobicContact CG-SD 3.81Å; R594-M598 WeakPolarHBondContact O-CG 3.46Å; R594-M598 PolarHBondContact O-N 3.04Å; H595-M598 PolarHBondContact O-N 3.03Å; S596-M598 VanDerWaalsContact C-N 3.29Å; S596-M598 PolarHBondContact O-N 3.34Å
599	H	68.8	Low	63.5	Low	132 Å²	132	98 Å²	98	61%	0.611	59%	0.586	S	S	*	*	H	α-helix	trans	-113.8	-16	-175.3	-67.1	-85.7	0	0	0	114.6	H595	H595-H599 AromaticContact CE1-CD2 3.28Å; H595-H599 PolarHBondContact CE1-CD2 3.26Å; H595-H599 AromaticContact CE1-CG 3.54Å; H595-H599 AromaticContact CE1-NE2 3.99Å; H595-H599 AromaticContact ND1-CD2 3.18Å; H595-H599 PolarHBondContact ND1-CD2 3.27Å; H595-H599 AromaticContact ND1-CG 3.9Å; H595-H599 AromaticContact ND1-NE2 3.86Å; H595-H599 PolarHBondContact O-N 2.82Å
600	C	64.8	Low	60.8	Low	29 Å²	29	100.4 Å²	100.4	20%	0.196	61%	0.609	C	S	.	*	S	Bend	trans	-112.9	46.2	-168.6	-51.3	0	0	0	0	111.6	T581 S596	T581-C600 HydrophobicContact CG2-CB 3.99Å; S596-C600 WeakPolarHBondContact O-CB 3.39Å; S596-C600 PolarHBondContact O-N 3.23Å
601	K	61.3	Low	58.1	Low	180 Å²	180	102.8 Å²	102.8	78%	0.783	63%	0.628	S	S	*	*			trans	-136.5	97.2	-178.8	-85.9	-165.3	160.4	-154.1	0	112.7
602	G	47.1	Very low	55.6	Low	70 Å²	70	104.1 Å²	104.1	72%	0.722	65%	0.645	S	S	*	*			trans	123.7	155.8	165	0	0	0	0	0	113.5
603	P	42.8	Very low	52.9	Low	137 Å²	137	107 Å²	107	89%	0.89	67%	0.668	S	S	*	*	P	Polyproline II helix	cis	-86.1	170.9	-11.3	36.4	-33.7	0	0	0	112.2
604	S	37.1	Very low	50.3	Low	111 Å²	111	108.9 Å²	108.9	78%	0.776	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-98.3	140.1	168.3	50.1	0	0	0	0	110.6
605	A	36.4	Very low	47.7	Very low	106 Å²	106	108.4 Å²	108.4	88%	0.876	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-59.1	148.2	167	0	0	0	0	0	111
606	S	34.2	Very low	44.9	Very low	116 Å²	116	112.8 Å²	112.8	81%	0.811	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-88.4	157	-168	43.9	0	0	0	0	114.2
607	S	28.6	Very low	42.5	Very low	113 Å²	113	118.8 Å²	118.8	79%	0.79	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-103.6	160.5	152.1	-67.1	0	0	0	0	109.2
608	P	42.1	Very low	39.9	Very low	137 Å²	137	119.8 Å²	119.8	89%	0.89	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-71.8	164.5	-164.1	-21.1	35.3	0	0	0	116.1
609	A	32	Very low	37.4	Very low	104 Å²	104	118.1 Å²	118.1	86%	0.86	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-94.4	170.1	-169.7	0	0	0	0	0	114.9
610	A	27.7	Very low	35.5	Very low	103 Å²	103	119.5 Å²	119.5	85%	0.851	76%	0.759	S	S	*	*			trans	-138.4	146.8	150.2	0	0	0	0	0	108.6
611	A	30.3	Very low	33.8	Very low	97 Å²	97	121.8 Å²	121.8	80%	0.802	79%	0.788	S	S	*	*			trans	-107.3	179.7	-175.6	0	0	0	0	0	110.4
612	S	31.1	Very low	32.4	Very low	105 Å²	105	119.4 Å²	119.4	73%	0.734	79%	0.791	S	S	*	*			cis	-164.4	168.7	-1.4	-141.9	0	0	0	0	109.7
613	S	31	Very low	31.4	Very low	93 Å²	93	120.5 Å²	120.5	65%	0.65	79%	0.793	S	S	*	*			trans	63.2	149.5	158	-77.2	0	0	0	0	119
614	E	29.8	Very low	30.6	Very low	167 Å²	167	119 Å²	119	78%	0.78	79%	0.786	S	S	*	*			cis	-158.8	-176.8	-7	-128	164.7	106.4	0	0	113.4
615	Q	30.2	Very low	30.1	Very low	166 Å²	166	122.9 Å²	122.9	78%	0.776	79%	0.789	S	S	*	*			trans	79.9	94.8	160.8	-80.4	-172.1	3.5	0	0	122.8
616	T	25	Very low	29.7	Very low	114 Å²	114	123.5 Å²	123.5	70%	0.699	78%	0.782	S	S	*	*				75.6	126.1	122.9	37.6	0	0	0	0	125.9
617	Q	31.6	Very low	29.5	Very low	163 Å²	163	126.7 Å²	126.7	76%	0.762	78%	0.781	S	S	*	*			trans	91.6	109.5	139.6	-72.1	-174.5	32.8	0	0	123.2
618	N	27	Very low	29.3	Very low	135 Å²	135	127.4 Å²	127.4	72%	0.722	79%	0.786	S	S	*	*				74.5	100	129.5	-64.2	-1.2	0	0	0	123.3
619	S	27.3	Very low	28.6	Very low	102 Å²	102	126.7 Å²	126.7	71%	0.713	77%	0.774	S	S	*	*				105.2	142.8	117.7	79.7	0	0	0	0	121.2
620	N	28.3	Very low	28.4	Very low	161 Å²	161	132 Å²	132	86%	0.861	77%	0.772	S	S	*	*			trans	67.7	121.3	154.5	-60.1	-23.3	0	0	0	121.9
621	G	28.4	Very low	28.4	Very low	78 Å²	78	137.1 Å²	137.1	80%	0.804	77%	0.769	S	S	*	*			trans	107	129.3	142.6	0	0	0	0	0	117
622	P	33	Very low	28.3	Very low	130 Å²	130	136.7 Å²	136.7	84%	0.844	76%	0.76	S	S	*	*			trans	-110.9	175	-170.8	41.1	-35.3	0	0	0	116.4
623	A	24.8	Very low	28.2	Very low	93 Å²	93	139.3 Å²	139.3	77%	0.769	76%	0.758	S	S	*	*			trans	84.5	70	153.3	0	0	0	0	0	120.6
624	S	26.3	Very low	28.1	Very low	104 Å²	104	140.9 Å²	140.9	73%	0.727	77%	0.767	S	S	*	*				5.8	131.1	126.9	-177.9	0	0	0	0	119.8
625	F	27.2	Very low	28	Very low	194 Å²	194	137 Å²	137	85%	0.851	76%	0.758	S	S	*	*			trans	-174.2	116.8	138.4	-88	-55.1	0	0	0	109.6
626	T	28.1	Very low	28.1	Very low	119 Å²	119	133.7 Å²	133.7	73%	0.73	76%	0.759	S	S	*	*				-178.6	128.9	77.8	27	0	0	0	0	109.5
627	K	29.5	Very low	28.1	Very low	183 Å²	183	133 Å²	133	80%	0.796	77%	0.765	S	S	*	*				85.3	105.2	81.2	-169.2	-170.8	-168.3	172.2	0	114.7
628	S	23.8	Very low	28	Very low	127 Å²	127	131.2 Å²	131.2	89%	0.888	77%	0.765	S	S	*	*			trans	-119.1	168.6	153.7	-161.9	0	0	0	0	111.2
629	L	27.3	Very low	27.9	Very low	122 Å²	122	131.4 Å²	131.4	64%	0.639	77%	0.771	S	S	*	*			trans	-132.2	153.9	-144.1	-166.4	72.7	0	0	0	113.9
630	R	27.8	Very low	28	Very low	216 Å²	216	134.8 Å²	134.8	82%	0.815	78%	0.776	S	S	*	*			trans	91.3	133.2	166.8	-50.3	-177	-174.6	-170.9	1.8	113.7
631	R	29.7	Very low	28	Very low	211 Å²	211	136.9 Å²	136.9	80%	0.796	78%	0.781	S	S	*	*			cis	85.5	119.9	30.8	-175.1	-167	175.9	-172.4	-2	111.5
632	S	28.2	Very low	27.9	Very low	87 Å²	87	141.4 Å²	141.4	61%	0.608	78%	0.781	S	S	*	*			cis	-177.7	166.9	-0.9	50.1	0	0	0	0	113.6
633	K	28	Very low	27.5	Very low	160 Å²	160	145.4 Å²	145.4	70%	0.696	79%	0.785	S	S	*	*			trans	75.5	141.5	153.9	-94.1	-156.5	165.3	-147.6	0	115.8
634	P	28.7	Very low	27.6	Very low	127 Å²	127	145.5 Å²	145.5	83%	0.825	78%	0.78	S	S	*	*				-117.9	-170.8	89.9	38.1	-37.2	0	0	0	114.1
635	S	28.1	Very low	27.7	Very low	86 Å²	86	144.9 Å²	144.9	60%	0.601	78%	0.782	S	S	*	*			trans	-169.3	103.7	160.4	156.5	0	0	0	0	102.3
636	A	31.3	Very low	27.7	Very low	96 Å²	96	143.5 Å²	143.5	79%	0.793	78%	0.782	S	S	*	*				74.6	131.8	70.2	0	0	0	0	0	111.3
637	A	26	Very low	27.9	Very low	100 Å²	100	146 Å²	146	83%	0.826	79%	0.787	S	S	*	*			trans	-120.3	154.3	176.8	0	0	0	0	0	109.2
638	T	29.3	Very low	28.6	Very low	124 Å²	124	143 Å²	143	76%	0.761	79%	0.786	S	S	*	*			trans	-83.8	159.5	-169.7	-19.7	0	0	0	0	112.9
639	T	25.7	Very low	28.8	Very low	139 Å²	139	144.3 Å²	144.3	85%	0.853	78%	0.783	S	S	*	*			trans	-133.8	137.9	148.1	-55.6	0	0	0	0	107.4
640	E	28.9	Very low	29	Very low	174 Å²	174	145.7 Å²	145.7	81%	0.813	80%	0.797	S	S	*	*			trans	-103.3	149.4	178.7	-63.5	171.5	127.5	0	0	109.1
641	Q	29	Very low	28.9	Very low	205 Å²	205	142.4 Å²	142.4	96%	0.958	80%	0.796	S	S	*	*			trans	-149.8	153.8	158	-118	174.5	4.2	0	0	109.9
642	Q	26.1	Very low	28.9	Very low	173 Å²	173	140.1 Å²	140.1	81%	0.808	80%	0.798	S	S	*	*			trans	-140.3	129.8	-160.9	173.1	-175.2	-2.9	0	0	108.6
643	F	24	Very low	28.8	Very low	213 Å²	213	140 Å²	140	93%	0.934	81%	0.811	S	S	*	*			trans	-151.9	161.7	164.5	-127.7	-88.2	0	0	0	110.7
644	S	26.1	Very low	28.9	Very low	95 Å²	95	142 Å²	142	66%	0.664	82%	0.82	S	S	*	*			trans	-123.1	155.6	-163.7	-60.4	0	0	0	0	113.8
645	A	29.5	Very low	29.5	Very low	92 Å²	92	141.6 Å²	141.6	76%	0.76	82%	0.817	S	S	*	*			trans	67.2	135	157.7	0	0	0	0	0	119.5
646	I	27	Very low	29.4	Very low	165 Å²	165	143.4 Å²	143.4	85%	0.846	83%	0.829	S	S	*	*				-177.1	136.9	128.7	-93.1	154.8	0	0	0	107.5
647	M	31.5	Very low	29.3	Very low	170 Å²	170	144.1 Å²	144.1	84%	0.837	83%	0.828	S	S	*	*			trans	-103.9	163.3	168.4	-69.5	-66.2	-150.9	0	0	109.7
648	P	45.3	Very low	29.2	Very low	122 Å²	122	145.6 Å²	145.6	79%	0.792	83%	0.831	S	S	*	*			trans	-133.6	143.8	132.9	36.1	-26.7	0	0	0	113.5
649	D	28.3	Very low	29.3	Very low	154 Å²	154	145 Å²	145	82%	0.824	83%	0.832	S	S	*	*			trans	-80.7	156.2	171.3	-66.2	-77.1	0	0	0	112.9
650	T	29.9	Very low	30.5	Very low	151 Å²	151	144.1 Å²	144.1	93%	0.926	83%	0.829	S	S	*	*			trans	-155	151.8	150.5	-18.4	0	0	0	0	109.8
651	D	27	Very low	31.1	Very low	147 Å²	147	141.5 Å²	141.5	79%	0.786	83%	0.827	S	S	*	*			trans	-121.4	178.5	-152.2	-169.6	20.7	0	0	0	114.4
652	L	30	Very low	31.9	Very low	163 Å²	163	137.6 Å²	137.6	85%	0.853	82%	0.82	S	S	*	*			trans	92.5	107.2	163.2	-61.9	164.6	0	0	0	118.4
653	G	26	Very low	32	Very low	84 Å²	84	135.5 Å²	135.5	87%	0.866	82%	0.819	S	S	*	*			trans	179.8	93.1	167.1	0	0	0	0	0	113.3
654	K	30	Very low	32.4	Very low	203 Å²	203	134.5 Å²	134.5	88%	0.883	82%	0.817	S	S	*	*			trans	-139.9	168.1	-178.6	-118.1	-178.1	179.1	173.6	0	109.3
655	P	40.3	Very low	32.5	Very low	117 Å²	117	133.7 Å²	133.7	76%	0.76	82%	0.816	S	S	*	*			cis	-133.3	175.1	-7.9	41	-25.7	0	0	0	114.6
656	S	26.7	Very low	32.4	Very low	125 Å²	125	136.9 Å²	136.9	87%	0.874	82%	0.819	S	S	*	*			trans	-154.2	160.4	141.1	-167.8	0	0	0	0	109.6
657	S	30	Very low	32.5	Very low	110 Å²	110	137.1 Å²	137.1	77%	0.769	82%	0.816	S	S	*	*			trans	-141.8	142.8	-162.9	57.4	0	0	0	0	113.6
658	C	23	Very low	33.3	Very low	131 Å²	131	133.9 Å²	133.9	89%	0.885	81%	0.808	S	S	*	*			trans	-157.8	144.5	154.3	-140.4	0	0	0	0	111.8
659	S	31.2	Very low	32.5	Very low	112 Å²	112	135.1 Å²	135.1	78%	0.783	81%	0.806	S	S	*	*			trans	-135.4	158.6	176.2	-70.8	0	0	0	0	110
660	P	50.5	Low	32.4	Very low	121 Å²	121	136.2 Å²	136.2	79%	0.786	81%	0.806	S	S	*	*			trans	-93.1	161.6	-163.7	37.3	-37.7	0	0	0	115
661	P	41.5	Very low	32.5	Very low	118 Å²	118	135.2 Å²	135.2	77%	0.766	80%	0.8	S	S	*	*				-151.2	-165.9	124	41.2	-24.8	0	0	0	112.6
662	P	46.9	Very low	33.3	Very low	124 Å²	124	134.3 Å²	134.3	81%	0.805	80%	0.803	S	S	*	*			cis	-128	-170.5	-32.7	23.4	0.3	0	0	0	113.8
663	T	27.7	Very low	33.3	Very low	129 Å²	129	129.8 Å²	129.8	79%	0.791	80%	0.795	S	S	*	*			trans	-112.1	147.1	179.2	-41.1	0	0	0	0	113.4
664	Q	31.3	Very low	34.8	Very low	191 Å²	191	132 Å²	132	89%	0.893	79%	0.794	S	S	*	*			trans	173.3	159	152.1	-99.8	156	87.6	0	0	111.2
665	A	28.7	Very low	34.7	Very low	79 Å²	79	127.4 Å²	127.4	65%	0.653	79%	0.788	S	S	*	*			cis	-173.6	172.2	-30.5	0	0	0	0	0	111.2
666	I	28.8	Very low	34.3	Very low	159 Å²	159	128.8 Å²	128.8	82%	0.815	79%	0.786	S	S	*	*			trans	77	124.7	166.4	-53.1	175.7	0	0	0	115.4
667	Q	28.7	Very low	34.5	Very low	169 Å²	169	129.8 Å²	129.8	79%	0.79	78%	0.777	S	S	*	*			cis	95.1	156.4	29.6	-69.5	-84.2	-1.7	0	0	114.1
668	P	47.4	Very low	34.5	Very low	103 Å²	103	132.4 Å²	132.4	67%	0.669	78%	0.781	S	S	*	*			cis	-136.6	-151.1	2.1	41	-19	0	0	0	115.8
669	I	28.3	Very low	34.6	Very low	147 Å²	147	129.5 Å²	129.5	75%	0.754	77%	0.774	S	S	*	*			trans	102	123.2	168.5	-57.8	170.4	0	0	0	114.8
670	E	26.8	Very low	35.2	Very low	177 Å²	177	130.3 Å²	130.3	83%	0.827	78%	0.776	S	S	*	*			cis	-155.9	171.9	-14.3	-119.2	-179.1	168.4	0	0	110.5
671	T	31.1	Very low	34.2	Very low	130 Å²	130	129.1 Å²	129.1	80%	0.798	78%	0.776	S	S	*	*			trans	-144.1	162.2	178.4	55.2	0	0	0	0	112.2
672	P	44.7	Very low	33.6	Very low	129 Å²	129	131.6 Å²	131.6	84%	0.838	78%	0.782	S	S	*	*				-142.8	155.9	121.5	35.3	-20.9	0	0	0	116.2
673	G	29.1	Very low	32.8	Very low	68 Å²	68	131.8 Å²	131.8	70%	0.701	78%	0.781	S	S	*	*			trans	-100.8	-151.8	165.7	0	0	0	0	0	112.1
674	P	57.8	Low	32.9	Very low	129 Å²	129	131.4 Å²	131.4	84%	0.838	78%	0.784	S	S	*	*			cis	-112.1	-143.2	19.8	30.3	-8.1	0	0	0	111.6
675	S	28.2	Very low	33.1	Very low	107 Å²	107	130.4 Å²	130.4	75%	0.748	78%	0.784	S	S	*	*			cis	-160.8	-167.9	12.4	-154.6	0	0	0	0	114.2
676	M	32.2	Very low	33.5	Very low	146 Å²	146	132.4 Å²	132.4	72%	0.719	79%	0.79	S	S	*	*			trans	-110.7	179	-170.8	-46.5	-76.6	-86.2	0	0	111.3
677	H	30.3	Very low	33.6	Very low	147 Å²	147	131.4 Å²	131.4	68%	0.681	78%	0.782	S	S	*	*			cis	-158.7	146.4	18.8	-112.2	-68.2	0	0	0	111.9
678	L	30.4	Very low	33.7	Very low	164 Å²	164	132 Å²	132	86%	0.859	79%	0.79	S	S	*	*			trans	51.5	142.9	146.6	-63.4	165.8	0	0	0	123
679	G	25.8	Very low	32.8	Very low	71 Å²	71	136.6 Å²	136.6	73%	0.732	79%	0.794	S	S	*	*			trans	-104.2	-163.3	176.4	0	0	0	0	0	114.8
680	P	43.7	Very low	32.8	Very low	129 Å²	129	135 Å²	135	84%	0.838	80%	0.795	S	S	*	*				-146.5	168	64.9	41.4	-24.3	0	0	0	118.4
681	A	29.3	Very low	33.1	Very low	95 Å²	95	134.1 Å²	134.1	79%	0.785	80%	0.796	S	S	*	*			trans	48.7	100.1	149.9	0	0	0	0	0	121.5
682	L	27.8	Very low	33.4	Very low	170 Å²	170	133.2 Å²	133.2	89%	0.89	79%	0.79	S	S	*	*				-154.3	166.6	124.3	-109.8	175.1	0	0	0	111.2
683	T	30.4	Very low	32.9	Very low	128 Å²	128	132.7 Å²	132.7	79%	0.785	79%	0.786	S	S	*	*			trans	-62.8	133.1	-163	48.8	0	0	0	0	117.6
684	S	30.8	Very low	33.2	Very low	122 Å²	122	137.4 Å²	137.4	85%	0.853	79%	0.79	S	S	*	*			trans	-164.3	161.5	146.5	45.6	0	0	0	0	112.1
685	L	35.5	Very low	32	Very low	170 Å²	170	139.5 Å²	139.5	89%	0.89	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-96.4	149.5	-170.7	-74.3	158.9	0	0	0	113.4
686	P	36.2	Very low	32.3	Very low	121 Å²	121	141.1 Å²	141.1	79%	0.786	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-85.2	149.9	170.6	34.4	-33.9	0	0	0	113.3
687	E	30.7	Very low	32.1	Very low	138 Å²	138	141.4 Å²	141.4	65%	0.645	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-66.9	149.4	175	-61.7	-174.3	98.9	0	0	113.6	R689	E687-R689 IonicContact OE1-NE 2.61Å; E687-R689 IonicContact OE2-CZ 2.69Å; E687-R689 IonicContact OE2-NE 2.58Å; E687-R689 PolarHBondContact OE2-NE 3.05Å; E687-R689 IonicContact OE2-NH2 2.85Å; E687-R689 PolarHBondContact OE2-NH2 2.83Å
688	L	30.8	Very low	32.1	Very low	181 Å²	181	139.8 Å²	139.8	95%	0.948	80%	0.796	S	S	*	*			trans	-121.7	124.6	142.7	-87.7	176.6	0	0	0	109.6
689	R	29.5	Very low	32	Very low	199 Å²	199	137.4 Å²	137.4	75%	0.751	79%	0.793	S	S	*	*			trans	-82.1	129.5	-175.9	-64.9	178	-176	138.3	8.2	111.1	E687	E687-R689 IonicContact OE1-NE 2.61Å; E687-R689 IonicContact OE2-CZ 2.69Å; E687-R689 IonicContact OE2-NE 2.58Å; E687-R689 PolarHBondContact OE2-NE 3.05Å; E687-R689 IonicContact OE2-NH2 2.85Å; E687-R689 PolarHBondContact OE2-NH2 2.83Å
690	S	28.6	Very low	32.1	Very low	113 Å²	113	137 Å²	137	79%	0.79	79%	0.79	S	S	*	*			trans	-128	107.9	161.5	-171.8	0	0	0	0	108.6	V692	S690-V692 PolarHBondContact O-N 3.07Å
691	L	31.1	Very low	31.3	Very low	159 Å²	159	140.2 Å²	140.2	83%	0.832	79%	0.793	S	S	*	*			trans	-86.8	110.2	-174.6	-77.3	163.3	0	0	0	110.9
692	V	39	Very low	31.4	Very low	112 Å²	112	143.5 Å²	143.5	68%	0.679	79%	0.792	S	S	*	*			trans	-135.4	112.5	165	-179.6	0	0	0	0	109.8	S690	S690-V692 PolarHBondContact O-N 3.07Å
693	P	34	Very low	31.5	Very low	117 Å²	117	142.1 Å²	142.1	76%	0.76	78%	0.781	S	S	*	*			trans	-110.5	110.7	159.8	0.4	21.3	0	0	0	111.1
694	H	35.9	Very low	31.4	Very low	168 Å²	168	147.5 Å²	147.5	78%	0.778	79%	0.787	S	S	*	*			trans	-94.8	103.6	160	-98.7	-89.9	0	0	0	108.7
695	H	32.6	Very low	31.3	Very low	172 Å²	172	145.5 Å²	145.5	80%	0.796	79%	0.786	S	S	*	*			trans	-174.6	145.2	170.9	-88.6	-45.2	0	0	0	107.1
696	L	32.7	Very low	30.9	Very low	141 Å²	141	142.7 Å²	142.7	74%	0.738	79%	0.787	S	S	*	*			cis	-147.9	-172.2	-5.1	-91.2	156.3	0	0	0	105.8
697	L	29.7	Very low	30.8	Very low	153 Å²	153	141.6 Å²	141.6	80%	0.801	79%	0.788	S	S	*	*			cis	-138.1	151.9	14	-81.4	165.8	0	0	0	110.7
698	S	29	Very low	30.6	Very low	113 Å²	113	143.3 Å²	143.3	79%	0.79	80%	0.8	S	S	*	*			trans	-107.9	150.1	143.6	-173.6	0	0	0	0	107.3
699	S	29.1	Very low	30.6	Very low	113 Å²	113	142.3 Å²	142.3	79%	0.79	80%	0.795	S	S	*	*			trans	-140.7	140.8	165.3	-171.8	0	0	0	0	108.2
700	G	27.6	Very low	31.9	Very low	64 Å²	64	138.2 Å²	138.2	66%	0.66	79%	0.794	S	S	*	*			trans	-133.2	161.8	-176.1	0	0	0	0	0	111.5
701	H	27.6	Very low	31.8	Very low	196 Å²	196	140 Å²	140	91%	0.907	80%	0.801	S	S	*	*			trans	-120.7	116.7	167.3	-93.3	-80.5	0	0	0	110.2
702	Q	30.8	Very low	31.7	Very low	163 Å²	163	138.8 Å²	138.8	76%	0.762	80%	0.795	S	S	*	*			trans	-90.8	158.6	151.9	-117.3	178.9	-84.6	0	0	106.3
703	E	30.7	Very low	31.4	Very low	141 Å²	141	141.9 Å²	141.9	66%	0.659	80%	0.795	S	S	*	*			cis	-144.1	156.3	8.2	-60.4	-164.1	124.2	0	0	111.1
704	R	26.6	Very low	31.2	Very low	242 Å²	242	141.5 Å²	141.5	91%	0.913	79%	0.786	S	S	*	*				166.2	155.7	107	-90.9	-171.1	175.8	-174.5	-3.6	110.4
705	G	30.5	Very low	30.7	Very low	80 Å²	80	140.7 Å²	140.7	83%	0.825	78%	0.78	S	S	*	*			trans	-150.5	152.2	170.8	0	0	0	0	0	110.4
706	A	25.5	Very low	30.5	Very low	110 Å²	110	139.5 Å²	139.5	91%	0.909	78%	0.778	S	S	*	*			trans	-138.8	153.7	167.4	0	0	0	0	0	107.7
707	A	34.1	Very low	30.2	Very low	98 Å²	98	140.1 Å²	140.1	81%	0.81	78%	0.783	S	S	*	*			trans	-138.7	144.5	179.3	0	0	0	0	0	109.6
708	L	27.1	Very low	30.2	Very low	174 Å²	174	141.1 Å²	141.1	91%	0.911	78%	0.78	S	S	*	*			trans	-159.1	167.1	157.7	-104.8	172.5	0	0	0	109.4
709	L	29.9	Very low	30.1	Very low	160 Å²	160	141.6 Å²	141.6	84%	0.838	78%	0.781	S	S	*	*			trans	-116.6	-158.4	178.8	-67.4	163.8	0	0	0	109.4
710	P	57.3	Low	30	Very low	113 Å²	113	141.3 Å²	141.3	73%	0.734	78%	0.775	S	S	*	*				-125.6	157.4	-101.5	37.7	-20.5	0	0	0	115.1
711	T	26.9	Very low	30	Very low	152 Å²	152	147.6 Å²	147.6	93%	0.933	79%	0.787	S	S	*	*			trans	-147.9	178.3	170.2	0.2	0	0	0	0	112.7
712	D	28.4	Very low	29.9	Very low	132 Å²	132	147 Å²	147	71%	0.706	79%	0.785	S	S	*	*			trans	-126	163.2	-137.4	-157.8	10.9	0	0	0	116.1
713	R	32.8	Very low	29.8	Very low	178 Å²	178	144.1 Å²	144.1	67%	0.672	79%	0.788	S	S	*	*			trans	70.2	119.3	153.5	-81.3	167.1	179.3	-133.8	-10.1	124.5
714	L	31.4	Very low	29.7	Very low	108 Å²	108	143.1 Å²	143.1	57%	0.565	79%	0.791	S	S	*	*				67.4	118.4	124.7	-66.3	167.3	0	0	0	122	A349 P350	A349-L714 HydrophobicContact CB-CD1 4.48Å; P350-L714 HydrophobicContact CB-CB 4.42Å; P350-L714 HydrophobicContact CG-CB 4.24Å; P350-L714 WeakPolarHBondContact CG-O 3.4Å
715	K	25.1	Very low	29.7	Very low	152 Å²	152	143 Å²	143	66%	0.661	79%	0.793	S	S	*	*				-159.3	163.3	105.5	-121.6	163.3	177.8	162.2	0	112.1	P350 D351	P350-K715 VanDerWaalsContact CD-NZ 3.28Å; P350-K715 HydrophobicContact CG-CD 3.89Å; P350-K715 HydrophobicContact CG-CG 4.05Å; D351-K715 IonicContact OD1-NZ 2.68Å; D351-K715 IonicContact OD2-NZ 2.89Å; D351-K715 PolarHBondContact OD2-NZ 3.14Å
716	L	28.8	Very low	29.4	Very low	146 Å²	146	142.4 Å²	142.4	76%	0.764	79%	0.787	S	S	*	*			trans	-135	133.8	-177	173	75	0	0	0	109.1
717	N	24.7	Very low	30.4	Very low	155 Å²	155	143.4 Å²	143.4	83%	0.829	78%	0.784	S	S	*	*			trans	-179.7	158.6	133.5	-94.9	-26.4	0	0	0	114.4
718	K	29.9	Very low	30	Very low	173 Å²	173	148.5 Å²	148.5	75%	0.752	78%	0.784	S	S	*	*			trans	-81.1	164.3	169.4	-64.4	-179.6	170.6	-176.9	0	110.5	T720	K718-T720 WeakPolarHBondContact CD-OG1 3.21Å
719	P	28.3	Very low	30.2	Very low	124 Å²	124	146.3 Å²	146.3	81%	0.805	78%	0.778	S	S	*	*				-108.5	157.2	70.3	35.1	-35.7	0	0	0	112.6
720	T	26.1	Very low	30.2	Very low	106 Å²	106	145.9 Å²	145.9	65%	0.65	77%	0.771	S	S	*	*			cis	76.6	87.6	25.5	-43.7	0	0	0	0	115.3	K718	K718-T720 WeakPolarHBondContact CD-OG1 3.21Å
721	Q	26.8	Very low	28.9	Very low	197 Å²	197	147.9 Å²	147.9	92%	0.921	78%	0.775	S	S	*	*			trans	-152.7	144.9	149.5	-127.9	173.7	8.5	0	0	110.7
722	E	26.9	Very low	28.8	Very low	184 Å²	184	144.2 Å²	144.2	86%	0.86	77%	0.768	S	S	*	*			trans	-122	141.4	-179.8	-65.3	179.4	116.1	0	0	110.6	V724	E722-V724 HydrophobicContact CB-CG2 4.47Å
723	A	27.1	Very low	28.8	Very low	101 Å²	101	145.9 Å²	145.9	84%	0.835	78%	0.777	S	S	*	*			trans	-156	121.5	159.8	0	0	0	0	0	106.9
724	V	28.7	Very low	28.5	Very low	120 Å²	120	144.1 Å²	144.1	73%	0.727	79%	0.786	S	S	*	*			cis	92.3	94	21.9	-169.7	0	0	0	0	114.1	E722	E722-V724 HydrophobicContact CB-CG2 4.47Å
725	Y	26.8	Very low	28.3	Very low	239 Å²	239	144.3 Å²	144.3	94%	0.937	80%	0.796	S	S	*	*			trans	75.9	155	159.9	-83.5	-110.4	0	0	0	121
726	G	25.6	Very low	28.4	Very low	69 Å²	69	144.3 Å²	144.3	71%	0.711	80%	0.802	S	S	*	*			trans	-106.6	-140.4	-174.3	0	0	0	0	0	113.8
727	P	45.7	Very low	28.3	Very low	130 Å²	130	143.8 Å²	143.8	84%	0.844	80%	0.8	S	S	*	*			cis	-138.8	-132.7	13.7	43.8	-21.9	0	0	0	115
728	Y	26.1	Very low	28.5	Very low	206 Å²	206	148.1 Å²	148.1	81%	0.808	81%	0.805	S	S	*	*			trans	-47.3	168.7	172.9	-94	-120.5	0	0	0	115
729	V	31	Very low	28.6	Very low	128 Å²	128	146.4 Å²	146.4	78%	0.776	80%	0.804	S	S	*	*			cis	-148.4	-164	39.7	-158.1	0	0	0	0	112.6
730	E	30.4	Very low	29.6	Very low	151 Å²	151	146.2 Å²	146.2	71%	0.706	80%	0.803	S	S	*	*			trans	-87.4	-179.3	-164.2	-50.5	166.7	127	0	0	118.9
731	N	28.4	Very low	29.9	Very low	154 Å²	154	145.8 Å²	145.8	82%	0.824	81%	0.81	S	S	*	*			trans	96.4	141.3	146	-67.3	-47.9	0	0	0	121.4
732	G	25.1	Very low	29.8	Very low	76 Å²	76	140.2 Å²	140.2	78%	0.784	81%	0.805	S	S	*	*			trans	146.6	108.7	164.1	0	0	0	0	0	116.4
733	N	28.6	Very low	30	Very low	166 Å²	166	142.9 Å²	142.9	89%	0.888	81%	0.807	S	S	*	*			trans	-114.9	127.8	171.2	-81	-25.9	0	0	0	111.4
734	T	28.1	Very low	30.7	Very low	141 Å²	141	142.9 Å²	142.9	87%	0.865	80%	0.799	S	S	*	*			trans	-178.6	132.9	148.4	37.1	0	0	0	0	107.7
735	C	25.4	Very low	30.5	Very low	113 Å²	113	147.9 Å²	147.9	76%	0.764	81%	0.806	S	S	*	*			cis	95	143.7	32.6	-162	0	0	0	0	113.7
736	L	28.3	Very low	30.7	Very low	151 Å²	151	143.8 Å²	143.8	79%	0.791	80%	0.8	S	S	*	*			trans	75	149.8	-179.9	-51.5	-179.9	0	0	0	117.6
737	D	27	Very low	31.4	Very low	136 Å²	136	145.3 Å²	145.3	73%	0.727	80%	0.797	S	S	*	*			cis	-168.1	137.1	-40.8	-138.1	-45.6	0	0	0	111.2
738	R	28.2	Very low	30.8	Very low	245 Å²	245	145.5 Å²	145.5	93%	0.925	80%	0.798	S	S	*	*			trans	178.9	119.8	146.5	-112.5	178.5	169.7	168.4	-2.4	115.3
739	D	31.6	Very low	31.1	Very low	138 Å²	138	140.4 Å²	140.4	74%	0.738	79%	0.793	S	S	*	*			trans	-78.3	177.8	161.4	-125.1	-37.3	0	0	0	110.5	A741	D739-A741 PolarHBondContact OD1-N 2.83Å
740	P	49.9	Very low	31	Very low	120 Å²	120	141.8 Å²	141.8	78%	0.779	80%	0.796	S	S	*	*			cis	-143.6	160.4	41	41.7	-21.3	0	0	0	120.4
741	A	31.1	Very low	31	Very low	96 Å²	96	141 Å²	141	79%	0.793	80%	0.797	S	S	*	*			trans	99.9	121.8	137.7	0	0	0	0	0	119.9	D739	D739-A741 PolarHBondContact OD1-N 2.83Å
742	G	26.7	Very low	31.1	Very low	80 Å²	80	142.6 Å²	142.6	83%	0.825	80%	0.799	S	S	*	*			trans	135.3	75.1	160.5	0	0	0	0	0	116.9
743	R	29.6	Very low	31.1	Very low	241 Å²	241	144.8 Å²	144.8	91%	0.909	80%	0.8	S	S	*	*			trans	-145.6	167.3	170.4	-100.5	-167.6	-168.8	-127.3	7.1	109.7
744	P	41.8	Very low	31	Very low	101 Å²	101	141.5 Å²	141.5	66%	0.656	80%	0.797	S	S	*	*			cis	-128.5	-175.4	-12.2	40.1	-25.2	0	0	0	112.7
745	Y	24.1	Very low	31.1	Very low	224 Å²	224	139.2 Å²	139.2	88%	0.878	79%	0.787	S	S	*	*				-156.6	157.7	129.2	-125.2	-87	0	0	0	110.9
746	L	32.4	Very low	31.2	Very low	154 Å²	154	142.7 Å²	142.7	81%	0.806	79%	0.789	S	S	*	*			trans	-116.5	-151.2	175.2	-63.7	166.1	0	0	0	110.2
747	P	39.2	Very low	31.3	Very low	101 Å²	101	142.2 Å²	142.2	66%	0.656	79%	0.792	S	S	*	*			trans	-106.1	174.6	-131.6	36.9	-18.9	0	0	0	113.9
748	P	34.7	Very low	31.2	Very low	133 Å²	133	138.9 Å²	138.9	86%	0.864	79%	0.79	S	S	*	*			trans	-77.8	125.7	154.8	-4.8	23.7	0	0	0	109.6
749	S	32.3	Very low	31.2	Very low	100 Å²	100	133.9 Å²	133.9	70%	0.699	79%	0.793	S	S	*	*			trans	-135.6	132.5	161	-67.2	0	0	0	0	106.5
750	D	28.4	Very low	30.9	Very low	157 Å²	157	130.5 Å²	130.5	84%	0.84	79%	0.791	S	S	*	*			trans	-145.6	155.5	168.2	-124.7	-36.5	0	0	0	112.2
751	N	30.1	Very low	29.9	Very low	135 Å²	135	136.6 Å²	136.6	72%	0.722	80%	0.798	S	S	*	*			trans	-100.5	164.6	-162	-64.4	-85.6	0	0	0	112.7
752	H	30.3	Very low	30.1	Very low	186 Å²	186	137.4 Å²	137.4	86%	0.861	80%	0.795	S	S	*	*				-170.8	169.5	114.9	-97.5	-60.8	0	0	0	112.8
753	C	26.3	Very low	30	Very low	122 Å²	122	144.3 Å²	144.3	82%	0.824	80%	0.798	S	S	*	*			trans	-71.2	171.8	-175.1	-65.3	0	0	0	0	112.7
754	A	26.3	Very low	29.9	Very low	98 Å²	98	143.4 Å²	143.4	81%	0.81	80%	0.795	S	S	*	*			cis	-155.8	174.5	27.4	0	0	0	0	0	116.6
755	S	29.6	Very low	29.3	Very low	93 Å²	93	143.1 Å²	143.1	65%	0.65	80%	0.795	S	S	*	*			trans	-54.7	166.7	171.8	-50.4	0	0	0	0	114.1
756	F	26.8	Very low	29.4	Very low	185 Å²	185	137.9 Å²	137.9	81%	0.811	79%	0.792	S	S	*	*			cis	-161.3	154.7	45.6	-93	-79.2	0	0	0	115.2
757	T	30.1	Very low	29.4	Very low	141 Å²	141	138.6 Å²	138.6	87%	0.865	79%	0.791	S	S	*	*			trans	59	146.1	155.5	53.3	0	0	0	0	119.6
758	G	25.6	Very low	28.9	Very low	66 Å²	66	136.6 Å²	136.6	68%	0.68	79%	0.789	S	S	*	*			cis	160.7	152.3	-3.9	0	0	0	0	0	111.6
759	S	28.3	Very low	28.8	Very low	140 Å²	140	138.1 Å²	138.1	98%	0.979	78%	0.784	S	S	*	*			trans	68.5	148.5	-172.8	-159.2	0	0	0	0	114.7
760	G	25.5	Very low	28.7	Very low	68 Å²	68	143.2 Å²	143.2	70%	0.701	79%	0.794	S	S	*	*			cis	178.4	136.4	-6.3	0	0	0	0	0	110.7
761	R	28.3	Very low	29.4	Very low	247 Å²	247	141.1 Å²	141.1	93%	0.932	78%	0.782	S	S	*	*			trans	-83.3	175.1	179.4	-63.3	-174.9	176.3	-162.6	0.6	111.1
762	P	36.6	Very low	29.7	Very low	113 Å²	113	137.5 Å²	137.5	73%	0.734	77%	0.767	S	S	*	*			cis	-133.4	175.9	-1.5	41.1	-25.7	0	0	0	115.4
763	Y	24.8	Very low	30.2	Very low	226 Å²	226	133.4 Å²	133.4	89%	0.886	76%	0.759	S	S	*	*			trans	-142.2	160.4	136.5	-144.5	-101.6	0	0	0	112.1
764	R	26.9	Very low	31.2	Very low	221 Å²	221	133 Å²	133	83%	0.834	75%	0.753	S	S	*	*			trans	-79.2	154.7	-165.3	-67.8	-174.8	174.5	-165.6	-0.8	114.1
765	S	28.1	Very low	32.3	Very low	96 Å²	96	131.9 Å²	131.9	67%	0.671	74%	0.736	S	S	*	*			trans	-67.1	143	152.8	-178.9	0	0	0	0	110.6
766	S	27.3	Very low	33	Very low	114 Å²	114	132.8 Å²	132.8	80%	0.797	73%	0.733	S	S	*	*			trans	-148.2	98	157.7	60.4	0	0	0	0	108.1	G768	S766-G768 PolarHBondContact O-N 3.09Å
767	E	31.6	Very low	33.7	Very low	169 Å²	169	133.5 Å²	133.5	79%	0.79	73%	0.73	S	S	*	*			trans	-72.5	87.5	-178.4	-72.2	179.2	93.3	0	0	111.7	Q769	E767-Q769 PolarHBondContact O-N 2.88Å
768	G	28.8	Very low	34.6	Very low	59 Å²	59	129 Å²	129	61%	0.608	71%	0.712	S	S	*	*			trans	-80.4	87.2	167.1	0	0	0	0	0	111.1	S766 F770	S766-G768 PolarHBondContact O-N 3.09Å; G768-F770 PolarHBondContact O-N 3.34Å
769	Q	33.1	Very low	35.5	Very low	165 Å²	165	131.2 Å²	131.2	77%	0.771	71%	0.708	S	S	*	*			trans	-64.8	104	175.1	-72.1	-171	-2.1	0	0	111.3	E767 I771	E767-Q769 PolarHBondContact O-N 2.88Å; Q769-I771 PolarHBondContact O-N 2.61Å
770	F	30.6	Very low	36.2	Very low	207 Å²	207	126.9 Å²	126.9	91%	0.908	68%	0.68	S	S	*	*			trans	-74	87.4	171.6	-84.1	-85.5	0	0	0	111	G768 S772	G768-F770 PolarHBondContact O-N 3.34Å; F770-S772 PolarHBondContact O-N 3.29Å
771	I	41.8	Very low	37.3	Very low	113 Å²	113	128.9 Å²	128.9	58%	0.579	67%	0.673	S	S	*	*			trans	-58	127.6	170	-59.3	175.9	0	0	0	108.9	Q769	Q769-I771 PolarHBondContact O-N 2.61Å
772	S	38.3	Very low	38	Very low	59 Å²	59	123.9 Å²	123.9	41%	0.413	66%	0.658	S	S	.	*			trans	-69	146.9	179.6	90.5	0	0	0	0	111.4	F770 V774 T775 L776	F770-S772 PolarHBondContact O-N 3.29Å; S772-V774 PolarHBondContact O-N 3.44Å; S772-V774 PolarHBondContact OG-N 2.84Å; S772-T775 PolarHBondContact O-N 3.06Å; S772-T775 PolarHBondContact O-OG1 2.86Å; S772-T775 PolarHBondContact OG-N 2.84Å; S772-T775 PolarHBondContact OG-OG1 3Å; S772-L776 PolarHBondContact O-N 3.49Å
773	S	39.8	Very low	38.4	Very low	99 Å²	99	122.3 Å²	122.3	69%	0.692	65%	0.646	S	S	*	*	H	α-helix	trans	-63.8	-12.7	176.2	53.1	0	0	0	0	114.2
774	V	46.9	Very low	39.3	Very low	115 Å²	115	116.8 Å²	116.8	70%	0.697	63%	0.631	S	S	*	*	H	α-helix	trans	-77.3	-39.3	172.3	-176.1	0	0	0	0	110.8	S772 L776 W777 G778	S772-V774 PolarHBondContact O-N 3.44Å; S772-V774 PolarHBondContact OG-N 2.84Å; V774-L776 VanDerWaalsContact C-N 3.34Å; V774-L776 PolarHBondContact O-N 3.16Å; V774-W777 PolarHBondContact O-N 3.3Å; V774-G778 PolarHBondContact O-N 3.07Å; V774-G778 VanDerWaalsContact O-N 3.12Å
775	T	49.8	Very low	40	Very low	74 Å²	74	112.7 Å²	112.7	45%	0.454	62%	0.622	S	S	.	*	H	α-helix	trans	-67.4	-36.8	179.7	-16	0	0	0	0	111.4	S772 G778 L779	S772-T775 PolarHBondContact O-N 3.06Å; S772-T775 PolarHBondContact O-OG1 2.86Å; S772-T775 PolarHBondContact OG-N 2.84Å; S772-T775 PolarHBondContact OG-OG1 3Å; T775-G778 PolarHBondContact O-N 3.25Å; T775-L779 PolarHBondContact O-N 3.01Å; T775-L779 VanDerWaalsContact O-N 3.11Å
776	L	43.3	Very low	40.5	Very low	112 Å²	112	112.7 Å²	112.7	59%	0.586	61%	0.614	S	S	*	*	H	α-helix	trans	-64.6	-39.6	177.9	-143.7	78.6	0	0	0	112.6	S772 V774 A780	S772-L776 PolarHBondContact O-N 3.49Å; V774-L776 VanDerWaalsContact C-N 3.34Å; V774-L776 PolarHBondContact O-N 3.16Å; L776-A780 WeakPolarHBondContact O-CB 3.45Å; L776-A780 PolarHBondContact O-N 3.22Å; L776-A780 VanDerWaalsContact O-N 3.1Å
777	W	42.9	Very low	41.2	Very low	199 Å²	199	113.3 Å²	113.3	75%	0.754	60%	0.604	S	S	*	*	H	α-helix	trans	-70.5	-33.6	174.3	-94.3	64.8	0	0	0	112.9	V774 M781	V774-W777 PolarHBondContact O-N 3.3Å; W777-M781 WeakPolarHBondContact O-CG 3.44Å; W777-M781 PolarHBondContact O-N 3.16Å; W777-M781 VanDerWaalsContact O-N 3.17Å
778	G	47.9	Very low	41.6	Very low	48 Å²	48	111.8 Å²	111.8	50%	0.495	60%	0.602	S	S	.	*	H	α-helix	trans	-63.7	-39	174.1	0	0	0	0	0	113	V774 T775 K782	V774-G778 PolarHBondContact O-N 3.07Å; V774-G778 VanDerWaalsContact O-N 3.12Å; T775-G778 PolarHBondContact O-N 3.25Å; G778-K782 PolarHBondContact O-N 3.21Å
779	L	44.9	Very low	42.2	Very low	112 Å²	112	116.1 Å²	116.1	59%	0.586	61%	0.606	S	S	*	*	H	α-helix	trans	-72.4	-44.4	176.7	-70.6	167.7	0	0	0	112.1	T775 M781 K782 T783	T775-L779 PolarHBondContact O-N 3.01Å; T775-L779 VanDerWaalsContact O-N 3.11Å; L779-M781 VanDerWaalsContact C-N 3.31Å; L779-M781 PolarHBondContact O-N 3.07Å; L779-K782 PolarHBondContact O-N 3.41Å; L779-T783 PolarHBondContact O-N 3.3Å; L779-T783 PolarHBondContact O-OG1 3.36Å
780	A	42.9	Very low	42.6	Very low	48 Å²	48	114.8 Å²	114.8	40%	0.397	61%	0.605	S	S	.	*	H	α-helix	trans	-62.7	-33.1	179.7	0	0	0	0	0	113.8	L776 K782 T783 L784	L776-A780 WeakPolarHBondContact O-CB 3.45Å; L776-A780 PolarHBondContact O-N 3.22Å; L776-A780 VanDerWaalsContact O-N 3.1Å; A780-K782 VanDerWaalsContact C-N 3.34Å; A780-T783 PolarHBondContact O-OG1 2.68Å; A780-T783 VanDerWaalsContact O-OG1 3.08Å; A780-L784 WeakPolarHBondContact O-CG 3.37Å; A780-L784 PolarHBondContact O-N 3.32Å
781	M	48.2	Very low	43	Very low	111 Å²	111	112.3 Å²	112.3	55%	0.547	60%	0.601	S	S	.	*	H	α-helix	trans	-71.1	-29.8	172.9	-71.4	-63	-56.4	0	0	112.5	W777 L779 Q785	W777-M781 WeakPolarHBondContact O-CG 3.44Å; W777-M781 PolarHBondContact O-N 3.16Å; W777-M781 VanDerWaalsContact O-N 3.17Å; L779-M781 VanDerWaalsContact C-N 3.31Å; L779-M781 PolarHBondContact O-N 3.07Å; M781-Q785 PolarHBondContact O-N 3.18Å
782	K	43	Very low	42.9	Very low	142 Å²	142	115.2 Å²	115.2	62%	0.617	61%	0.614	S	S	*	*	H	α-helix	trans	-81.2	-31.4	-178.6	-167.1	165.1	-177	176.7	0	112.7	G778 L779 A780 Q785 N786	G778-K782 PolarHBondContact O-N 3.21Å; L779-K782 PolarHBondContact O-N 3.41Å; A780-K782 VanDerWaalsContact C-N 3.34Å; K782-Q785 PolarHBondContact O-N 3.05Å; K782-N786 PolarHBondContact O-N 2.8Å
783	T	45.4	Very low	42.9	Very low	80 Å²	80	121 Å²	121	49%	0.491	63%	0.634	S	S	.	*	H	α-helix	trans	-65.8	-45.8	171	48	0	0	0	0	111.8	L779 A780 Q785 N786 E787	L779-T783 PolarHBondContact O-N 3.3Å; L779-T783 PolarHBondContact O-OG1 3.36Å; A780-T783 PolarHBondContact O-OG1 2.68Å; A780-T783 VanDerWaalsContact O-OG1 3.08Å; T783-Q785 PolarHBondContact O-N 2.95Å; T783-N786 PolarHBondContact O-N 2.95Å; T783-N786 VanDerWaalsContact O-N 3.09Å; T783-E787 PolarHBondContact O-N 2.64Å; T783-E787 VanDerWaalsContact O-N 3.11Å
784	L	43.1	Very low	42.7	Very low	109 Å²	109	129 Å²	129	57%	0.571	66%	0.66	S	S	*	*	H	α-helix	trans	-64.1	-12.1	176.8	-74.5	171.9	0	0	0	114.5	A780	A780-L784 WeakPolarHBondContact O-CG 3.37Å; A780-L784 PolarHBondContact O-N 3.32Å
785	Q	43.2	Very low	42.5	Very low	136 Å²	136	129.7 Å²	129.7	64%	0.636	66%	0.658	S	S	*	*	H	α-helix	trans	-94.7	-29.4	175.8	-142.3	166.2	-11.3	0	0	111.9	M781 K782 T783	M781-Q785 PolarHBondContact O-N 3.18Å; K782-Q785 PolarHBondContact O-N 3.05Å; T783-Q785 PolarHBondContact O-N 2.95Å
786	N	38.3	Very low	42.1	Very low	95 Å²	95	132.6 Å²	132.6	51%	0.508	67%	0.669	S	S	.	*	H	α-helix	trans	-78.6	-28.3	174.2	-94.2	93.4	0	0	0	113.6	K782 T783 N788	K782-N786 PolarHBondContact O-N 2.8Å; T783-N786 PolarHBondContact O-N 2.95Å; T783-N786 VanDerWaalsContact O-N 3.09Å; N786-N788 VanDerWaalsContact C-N 3.31Å
787	E	41.6	Very low	42	Very low	127 Å²	127	133.8 Å²	133.8	59%	0.593	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-69.5	-28.5	176.7	-71.9	175.7	161.7	0	0	112.3	T783 E789	T783-E787 PolarHBondContact O-N 2.64Å; T783-E787 VanDerWaalsContact O-N 3.11Å; E787-E789 VanDerWaalsContact C-N 3.35Å; E787-E789 PolarHBondContact O-N 3.14Å
788	N	39.9	Very low	42	Very low	137 Å²	137	129.9 Å²	129.9	73%	0.733	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-79	-7.3	179.1	-91.4	14.4	0	0	0	115	N786	N786-N788 VanDerWaalsContact C-N 3.31Å
789	E	41.2	Very low	41.6	Very low	150 Å²	150	135.1 Å²	135.1	70%	0.701	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-98	-8.9	-179.4	-70.2	-175.2	150.4	0	0	113.4	E787	E787-E789 VanDerWaalsContact C-N 3.35Å; E787-E789 PolarHBondContact O-N 3.14Å
790	N	40.8	Very low	41.4	Very low	138 Å²	138	136.6 Å²	136.6	74%	0.738	69%	0.686	S	S	*	*	S	Bend	trans	-97.9	-17	179.7	-83	9.9	0	0	0	114.7	M792	N790-M792 VanDerWaalsContact C-N 3.3Å; N790-M792 PolarHBondContact O-N 3.02Å
791	D	39.8	Very low	41.3	Very low	155 Å²	155	142.9 Å²	142.9	83%	0.829	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	29.6	-177.1	-81.5	-15.7	0	0	0	113.4
792	M	39.7	Very low	40.7	Very low	173 Å²	173	145.4 Å²	145.4	85%	0.852	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.9	20	176.6	-153	-179.9	-73.7	0	0	114.8	N790	N790-M792 VanDerWaalsContact C-N 3.3Å; N790-M792 PolarHBondContact O-N 3.02Å
793	E	38	Very low	40.6	Very low	180 Å²	180	145.7 Å²	145.7	84%	0.841	73%	0.728	S	S	*	*			trans	-134.8	79.1	163.8	-73	-161.6	145.4	0	0	111.5
794	H	35.7	Very low	40.1	Very low	268 Å²	268	151.6 Å²	151.6	100%	1.241	75%	0.749	S	S	*	*			trans	-161.9	0	153	-110.1	-47.6	0	0	0	114.1

Retrieved 794 of 794 residues in 396.2 ms (Link to these results)

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