A0A087YJF3_POEFO Loading...

POZ/BTB and AT hook containing zinc finger 1

AlphaFold DB , UniProt , Accession A0A087YJF3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 650 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.1	Very low	33.5	Very low	251 Å²	251	153.1 Å²	153.1	100%	1.236	82%	0.823	S	S	*	*				0	169.6	0	-78.4	163.1	167.1	0	0	108.2
2	E	29.3	Very low	32.7	Very low	163 Å²	163	149.7 Å²	149.7	76%	0.762	82%	0.819	S	S	*	*			trans	-78.4	167	-160.5	-71.8	178.2	73.9	0	0	116.1
3	K	32	Very low	32.4	Very low	177 Å²	177	152.8 Å²	152.8	77%	0.77	81%	0.814	S	S	*	*			trans	12.8	147.5	142.2	-57.8	172.7	-180	164.5	0	117.9
4	V	31.9	Very low	32	Very low	135 Å²	135	150.5 Å²	150.5	82%	0.818	81%	0.808	S	S	*	*				-157.1	156.7	59.2	163.4	0	0	0	0	112
5	A	29.6	Very low	31.7	Very low	82 Å²	82	153.7 Å²	153.7	68%	0.678	81%	0.806	S	S	*	*			trans	-13.1	157.7	156.9	0	0	0	0	0	119.7
6	E	37	Very low	31.6	Very low	178 Å²	178	155.9 Å²	155.9	83%	0.832	81%	0.811	S	S	*	*			cis	-160.9	175.8	1.4	-107.1	-87.3	106.6	0	0	107.9
7	P	49.7	Very low	31.7	Very low	87 Å²	87	153 Å²	153	57%	0.565	80%	0.801	S	S	*	*			trans	-92.9	165.6	-165.4	37.7	-36.9	0	0	0	115.5
8	S	27.6	Very low	32	Very low	122 Å²	122	148.5 Å²	148.5	85%	0.853	79%	0.785	S	S	*	*			trans	-130.7	129.7	154.5	54.1	0	0	0	0	109.7
9	W	29.8	Very low	32.3	Very low	237 Å²	237	148.6 Å²	148.6	90%	0.898	78%	0.778	S	S	*	*			trans	-86.1	141.6	-172.3	-84	36.4	0	0	0	112.6	S11	W9-S11 PolarHBondContact O-N 3.43Å
10	T	40.5	Very low	32.4	Very low	145 Å²	145	148.2 Å²	148.2	89%	0.89	77%	0.771	S	S	*	*			trans	-76.7	114.4	166.7	45.9	0	0	0	0	110.9
11	S	26.8	Very low	32.7	Very low	107 Å²	107	142.9 Å²	142.9	75%	0.748	75%	0.747	S	S	*	*			trans	-143.1	88.5	166.5	-166.1	0	0	0	0	111.4	W9	W9-S11 PolarHBondContact O-N 3.43Å
12	S	24.8	Very low	33.2	Very low	112 Å²	112	133.5 Å²	133.5	78%	0.783	71%	0.71	S	S	*	*			trans	-94.7	99.9	178.6	54.8	0	0	0	0	110.9
13	Y	28.6	Very low	33.8	Very low	191 Å²	191	130.1 Å²	130.1	75%	0.749	69%	0.694	S	S	*	*			trans	-91.6	109.6	-179.4	-136.5	-89.5	0	0	0	111.8	Y15	Y13-Y15 HydrophobicContact CD1-CD2 4.27Å; Y13-Y15 AromaticContact CD1-CE2 3.9Å; Y13-Y15 HydrophobicContact CD1-CE2 3.9Å; Y13-Y15 HydrophobicContact CE1-CE2 4.48Å
14	T	26.5	Very low	34.1	Very low	120 Å²	120	126.1 Å²	126.1	74%	0.736	68%	0.679	S	S	*	*			trans	-99.2	104.5	-179.5	42.3	0	0	0	0	111.6	Q16	T14-Q16 PolarHBondContact O-N 3.11Å; T14-Q16 VanDerWaalsContact O-N 3.16Å
15	Y	27.5	Very low	34.5	Very low	198 Å²	198	125 Å²	125	78%	0.776	67%	0.668	S	S	*	*			trans	-71.3	107.5	173	-84.1	-93.2	0	0	0	111	Y13 V17	Y13-Y15 HydrophobicContact CD1-CD2 4.27Å; Y13-Y15 AromaticContact CD1-CE2 3.9Å; Y13-Y15 HydrophobicContact CD1-CE2 3.9Å; Y13-Y15 HydrophobicContact CE1-CE2 4.48Å; Y15-V17 PolarHBondContact O-N 3.2Å; Y15-V17 VanDerWaalsContact O-N 3.12Å
16	Q	29.6	Very low	35.2	Very low	190 Å²	190	127.2 Å²	127.2	89%	0.888	66%	0.664	S	S	*	*			trans	-73	101.2	171.8	-70.9	-171.6	-8.2	0	0	110.4	T14 S18	T14-Q16 PolarHBondContact O-N 3.11Å; T14-Q16 VanDerWaalsContact O-N 3.16Å; Q16-S18 PolarHBondContact O-N 2.99Å
17	V	33.8	Very low	35.5	Very low	106 Å²	106	123 Å²	123	64%	0.642	65%	0.647	S	S	*	*			trans	-66	127.1	169.2	179.8	0	0	0	0	108.7	Y15 S21	Y15-V17 PolarHBondContact O-N 3.2Å; Y15-V17 VanDerWaalsContact O-N 3.12Å; V17-S21 WeakPolarHBondContact CG1-OG 3.39Å
18	S	37.3	Very low	35	Very low	72 Å²	72	123.2 Å²	123.2	50%	0.503	64%	0.643	S	S	.	*			trans	-56.4	141.8	178.4	176.8	0	0	0	0	111.5	Q16 H20 S21 A22	Q16-S18 PolarHBondContact O-N 2.99Å; S18-H20 PolarHBondContact O-N 2.87Å; S18-H20 VanDerWaalsContact O-N 3.13Å; S18-H20 PolarHBondContact OG-N 2.78Å; S18-S21 PolarHBondContact N-OG 3.12Å; S18-S21 PolarHBondContact O-N 2.94Å; S18-S21 PolarHBondContact O-OG 3.33Å; S18-A22 PolarHBondContact O-N 3.29Å; S18-A22 VanDerWaalsContact O-N 3.08Å
19	K	38.3	Very low	35.7	Very low	151 Å²	151	121.8 Å²	121.8	66%	0.657	63%	0.626	S	S	*	*	H	α-helix	trans	-52.8	-36	175.1	179.6	173.7	169.6	178.4	0	111.8	A22 E23	K19-A22 PolarHBondContact O-N 2.78Å; K19-E23 WeakPolarHBondContact CE-OE1 3.43Å; K19-E23 HydrophobicContact CG-CG 4.36Å; K19-E23 IonicContact NZ-OE1 3.68Å; K19-E23 WeakPolarHBondContact O-CB 3.27Å; K19-E23 WeakPolarHBondContact O-CG 3.21Å; K19-E23 PolarHBondContact O-N 3.3Å
20	H	33.9	Very low	36.3	Very low	139 Å²	139	114 Å²	114	64%	0.644	60%	0.604	S	S	*	*	H	α-helix	trans	-63.4	-41.8	177.1	-176.3	52	0	0	0	112.8	S18 M24	S18-H20 PolarHBondContact O-N 2.87Å; S18-H20 VanDerWaalsContact O-N 3.13Å; S18-H20 PolarHBondContact OG-N 2.78Å; H20-M24 VanDerWaalsContact O-CB 3.29Å; H20-M24 WeakPolarHBondContact O-CB 3.45Å; H20-M24 PolarHBondContact O-N 3.43Å
21	S	37.5	Very low	36.3	Very low	38 Å²	38	114.5 Å²	114.5	27%	0.266	60%	0.596	S	S	.	*	H	α-helix	trans	-71.8	-33.1	176.2	31.9	0	0	0	0	112.4	V17 S18 M24 L25	V17-S21 WeakPolarHBondContact CG1-OG 3.39Å; S18-S21 PolarHBondContact N-OG 3.12Å; S18-S21 PolarHBondContact O-N 2.94Å; S18-S21 PolarHBondContact O-OG 3.33Å; S21-M24 PolarHBondContact O-N 3.18Å; S21-L25 VanDerWaalsContact O-CD1 3.26Å; S21-L25 WeakPolarHBondContact O-CD1 3.46Å; S21-L25 PolarHBondContact O-N 3.28Å
22	A	44.4	Very low	36.7	Very low	54 Å²	54	115.3 Å²	115.3	45%	0.446	58%	0.583	S	S	.	*	H	α-helix	trans	-64.7	-46.5	171.7	0	0	0	0	0	112	S18 K19 M24 L25 H26	S18-A22 PolarHBondContact O-N 3.29Å; S18-A22 VanDerWaalsContact O-N 3.08Å; K19-A22 PolarHBondContact O-N 2.78Å; A22-M24 VanDerWaalsContact C-N 3.31Å; A22-M24 PolarHBondContact O-N 2.87Å; A22-L25 PolarHBondContact O-N 2.77Å; A22-H26 WeakPolarHBondContact O-CB 3.45Å; A22-H26 PolarHBondContact O-N 2.87Å
23	E	42.3	Very low	37.3	Very low	91 Å²	91	118.9 Å²	118.9	43%	0.425	58%	0.584	S	S	.	*	H	α-helix	trans	-65.2	-32.7	174.5	-72.7	173.8	159.6	0	0	111.9	K19 H26 N27	K19-E23 WeakPolarHBondContact CE-OE1 3.43Å; K19-E23 HydrophobicContact CG-CG 4.36Å; K19-E23 IonicContact NZ-OE1 3.68Å; K19-E23 WeakPolarHBondContact O-CB 3.27Å; K19-E23 WeakPolarHBondContact O-CG 3.21Å; K19-E23 PolarHBondContact O-N 3.3Å; E23-H26 PolarHBondContact O-N 2.65Å; E23-N27 WeakPolarHBondContact O-CB 3.16Å; E23-N27 PolarHBondContact O-N 3.11Å; E23-N27 PolarHBondContact O-ND2 3.49Å
24	M	39.1	Very low	37.6	Very low	93 Å²	93	117.2 Å²	117.2	46%	0.458	59%	0.589	S	S	.	*	H	α-helix	trans	-68.3	-44.9	174.8	-166.7	179.6	-163.4	0	0	112.1	H20 S21 A22 H26 N27 L28	H20-M24 VanDerWaalsContact O-CB 3.29Å; H20-M24 WeakPolarHBondContact O-CB 3.45Å; H20-M24 PolarHBondContact O-N 3.43Å; S21-M24 PolarHBondContact O-N 3.18Å; A22-M24 VanDerWaalsContact C-N 3.31Å; A22-M24 PolarHBondContact O-N 2.87Å; M24-H26 VanDerWaalsContact C-N 3.35Å; M24-N27 PolarHBondContact O-N 3.47Å; M24-L28 HydrophobicContact CG-CD1 4.32Å; M24-L28 WeakPolarHBondContact O-CB 3.22Å; M24-L28 VanDerWaalsContact O-CG 3.32Å; M24-L28 WeakPolarHBondContact O-CG 3.41Å; M24-L28 PolarHBondContact O-N 2.84Å
25	L	41	Very low	38	Very low	113 Å²	113	115.5 Å²	115.5	59%	0.592	60%	0.595	S	S	*	*	H	α-helix	trans	-60.8	-44.4	172.5	-96	81.9	0	0	0	111.2	S21 A22 N27 L28 N29	S21-L25 VanDerWaalsContact O-CD1 3.26Å; S21-L25 WeakPolarHBondContact O-CD1 3.46Å; S21-L25 PolarHBondContact O-N 3.28Å; A22-L25 PolarHBondContact O-N 2.77Å; L25-N27 PolarHBondContact O-N 3.12Å; L25-L28 PolarHBondContact O-N 3.31Å; L25-N29 PolarHBondContact O-N 3.04Å
26	H	43.8	Very low	38.3	Very low	127 Å²	127	107.6 Å²	107.6	59%	0.588	57%	0.573	S	S	*	*	H	α-helix	trans	-60.3	-45.7	178.2	-170	79	0	0	0	111.6	A22 E23 M24 L28 N29 V30	A22-H26 WeakPolarHBondContact O-CB 3.45Å; A22-H26 PolarHBondContact O-N 2.87Å; E23-H26 PolarHBondContact O-N 2.65Å; M24-H26 VanDerWaalsContact C-N 3.35Å; H26-L28 PolarHBondContact O-N 3.31Å; H26-N29 PolarHBondContact O-N 3.45Å; H26-V30 WeakPolarHBondContact O-CB 3.13Å; H26-V30 VanDerWaalsContact O-CG2 3.31Å; H26-V30 WeakPolarHBondContact O-CG2 3.47Å; H26-V30 PolarHBondContact O-N 3.46Å
27	N	43	Very low	38.5	Very low	91 Å²	91	109.8 Å²	109.8	49%	0.487	57%	0.573	S	S	.	*	H	α-helix	trans	-64.9	-37.4	176.3	-80.9	-66.6	0	0	0	113.1	E23 M24 L25 N29 V30 Q31	E23-N27 WeakPolarHBondContact O-CB 3.16Å; E23-N27 PolarHBondContact O-N 3.11Å; E23-N27 PolarHBondContact O-ND2 3.49Å; M24-N27 PolarHBondContact O-N 3.47Å; L25-N27 PolarHBondContact O-N 3.12Å; N27-N29 VanDerWaalsContact C-N 3.33Å; N27-V30 PolarHBondContact O-N 3.42Å; N27-Q31 WeakPolarHBondContact O-CB 3.18Å; N27-Q31 WeakPolarHBondContact O-CG 3.19Å; N27-Q31 PolarHBondContact O-N 2.86Å
28	L	39.2	Very low	38.4	Very low	91 Å²	91	111.8 Å²	111.8	48%	0.476	57%	0.574	S	S	.	*	H	α-helix	trans	-65.7	-35.5	174.3	-73.9	167.6	0	0	0	112.1	M24 L25 H26	M24-L28 HydrophobicContact CG-CD1 4.32Å; M24-L28 WeakPolarHBondContact O-CB 3.22Å; M24-L28 VanDerWaalsContact O-CG 3.32Å; M24-L28 WeakPolarHBondContact O-CG 3.41Å; M24-L28 PolarHBondContact O-N 2.84Å; L25-L28 PolarHBondContact O-N 3.31Å; H26-L28 PolarHBondContact O-N 3.31Å
29	N	42.2	Very low	38.2	Very low	91 Å²	91	113.6 Å²	113.6	49%	0.487	59%	0.585	S	S	.	*	H	α-helix	trans	-69.3	-43.3	173.2	-129.5	0.3	0	0	0	111.1	L25 H26 N27 Q31 R32	L25-N29 PolarHBondContact O-N 3.04Å; H26-N29 PolarHBondContact O-N 3.45Å; N27-N29 VanDerWaalsContact C-N 3.33Å; N29-Q31 VanDerWaalsContact C-N 3.34Å; N29-Q31 PolarHBondContact O-N 3.16Å; N29-R32 PolarHBondContact O-N 2.63Å
30	V	42.5	Very low	37.7	Very low	73 Å²	73	113.6 Å²	113.6	44%	0.442	59%	0.592	S	S	.	*	H	α-helix	trans	-68.3	-28.1	178.4	169.6	0	0	0	0	113.1	H26 N27 R32	H26-V30 WeakPolarHBondContact O-CB 3.13Å; H26-V30 VanDerWaalsContact O-CG2 3.31Å; H26-V30 WeakPolarHBondContact O-CG2 3.47Å; H26-V30 PolarHBondContact O-N 3.46Å; N27-V30 PolarHBondContact O-N 3.42Å; V30-R32 VanDerWaalsContact C-N 3.27Å; V30-R32 PolarHBondContact O-N 3.37Å
31	Q	39.8	Very low	37.5	Very low	156 Å²	156	111.9 Å²	111.9	73%	0.729	59%	0.591	S	S	*	*	H	α-helix	trans	-69.8	-21.4	173.3	-79.6	-176.2	-0	0	0	113.2	N27 N29 K33	N27-Q31 WeakPolarHBondContact O-CB 3.18Å; N27-Q31 WeakPolarHBondContact O-CG 3.19Å; N27-Q31 PolarHBondContact O-N 2.86Å; N29-Q31 VanDerWaalsContact C-N 3.34Å; N29-Q31 PolarHBondContact O-N 3.16Å; Q31-K33 VanDerWaalsContact C-N 3.26Å; Q31-K33 PolarHBondContact O-N 2.86Å
32	R	36	Very low	37.2	Very low	124 Å²	124	115.8 Å²	115.8	47%	0.468	61%	0.608	S	S	.	*			trans	-82.3	65.3	172	-68.9	-177	170.7	-166.9	-3.2	111.5	N29 V30 D34 G36	N29-R32 PolarHBondContact O-N 2.63Å; V30-R32 VanDerWaalsContact C-N 3.27Å; V30-R32 PolarHBondContact O-N 3.37Å; R32-D34 PolarHBondContact O-N 3.21Å; R32-G36 PolarHBondContact NH1-O 3.24Å
33	K	36.2	Very low	36.6	Very low	187 Å²	187	117.6 Å²	117.6	81%	0.813	61%	0.61	S	S	*	*			trans	-66.5	-11.5	177.7	-85.8	-163.9	171.1	-173.8	0	115.2	Q31	Q31-K33 VanDerWaalsContact C-N 3.26Å; Q31-K33 PolarHBondContact O-N 2.86Å
34	D	35.8	Very low	36	Very low	157 Å²	157	124.3 Å²	124.3	84%	0.84	63%	0.631	S	S	*	*	S	Bend	trans	-112.2	99.3	171.9	-72.8	-65.1	0	0	0	112.1	R32 G36	R32-D34 PolarHBondContact O-N 3.21Å; D34-G36 PolarHBondContact O-N 3.02Å
35	G	35.8	Very low	35.7	Very low	84 Å²	84	123.7 Å²	123.7	87%	0.866	63%	0.632	S	S	*	*	S	Bend	trans	78.6	-21.1	148.3	0	0	0	0	0	120.4	R37	G35-R37 PolarHBondContact O-N 2.98Å
36	G	32.4	Very low	35.3	Very low	31 Å²	31	120.9 Å²	120.9	32%	0.32	63%	0.631	S	S	.	*			trans	-91.2	66.4	-166.3	0	0	0	0	0	117.4	R32 D34	R32-G36 PolarHBondContact NH1-O 3.24Å; D34-G36 PolarHBondContact O-N 3.02Å
37	R	33.8	Very low	34.8	Very low	237 Å²	237	124.4 Å²	124.4	89%	0.894	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-72.6	122	170	-68.4	-166	-63.3	-141.7	2.3	111.3	G35	G35-R37 PolarHBondContact O-N 2.98Å
38	F	32.3	Very low	34.5	Very low	148 Å²	148	128.7 Å²	128.7	65%	0.649	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-70.8	139.1	153.5	-81.4	-82.5	0	0	0	108.6
39	C	32.4	Very low	34.7	Very low	110 Å²	110	128.8 Å²	128.8	74%	0.743	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-75.2	134.5	160.9	-60.1	0	0	0	0	108.1	V41	C39-V41 VanDerWaalsContact C-N 3.35Å; C39-V41 PolarHBondContact O-N 3.45Å
40	D	27.8	Very low	34.9	Very low	151 Å²	151	132.5 Å²	132.5	81%	0.807	69%	0.685	S	S	*	*			trans	-73.6	85.8	179.8	-73.6	-49	0	0	0	111	I42	D40-I42 PolarHBondContact O-N 3.44Å
41	V	30.8	Very low	35.1	Very low	102 Å²	102	131.3 Å²	131.3	62%	0.618	68%	0.679	S	S	*	*			trans	-79.3	97.5	177.1	-178	0	0	0	0	109.7	C39 L43	C39-V41 VanDerWaalsContact C-N 3.35Å; C39-V41 PolarHBondContact O-N 3.45Å; V41-L43 HydrophobicContact CG1-CD2 4.27Å; V41-L43 HydrophobicContact CG1-CG 4.32Å; V41-L43 PolarHBondContact O-N 3.21Å
42	I	31.5	Very low	35.1	Very low	121 Å²	121	125.5 Å²	125.5	62%	0.621	66%	0.658	S	S	*	*			trans	-73	91.5	177.5	-56.5	-179.5	0	0	0	110	D40 R44	D40-I42 PolarHBondContact O-N 3.44Å; I42-R44 PolarHBondContact O-N 2.86Å; I42-R44 VanDerWaalsContact O-N 3.07Å
43	L	30.1	Very low	35.2	Very low	92 Å²	92	122.2 Å²	122.2	48%	0.482	65%	0.647	S	S	.	*			trans	-72.3	95.4	175.4	-71.1	170.8	0	0	0	111.3	V41 V45 A55	V41-L43 HydrophobicContact CG1-CD2 4.27Å; V41-L43 HydrophobicContact CG1-CG 4.32Å; V41-L43 PolarHBondContact O-N 3.21Å; L43-V45 PolarHBondContact O-N 2.81Å; L43-A55 HydrophobicContact CD1-CB 3.95Å; L43-A55 HydrophobicContact CD2-CB 4.23Å
44	R	29.9	Very low	35.7	Very low	232 Å²	232	118.4 Å²	118.4	88%	0.875	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-74.1	117.9	164.8	-69.8	-173.9	177.5	-125.5	1.7	109.8	I42	I42-R44 PolarHBondContact O-N 2.86Å; I42-R44 VanDerWaalsContact O-N 3.07Å
45	V	33.7	Very low	36.2	Very low	80 Å²	80	112.5 Å²	112.5	49%	0.485	60%	0.603	S	S	.	*	P	Polyproline II helix	trans	-100	117.2	-179.6	-178.7	0	0	0	0	108.8	L43 P51	L43-V45 PolarHBondContact O-N 2.81Å; V45-P51 HydrophobicContact CG1-CG 4.43Å; V45-P51 HydrophobicContact CG2-CG 4.2Å
46	G	31.7	Very low	36.6	Very low	54 Å²	54	110.3 Å²	110.3	56%	0.557	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-71.5	166.3	165.8	0	0	0	0	0	111.4	E48	G46-E48 CarbonylContact O-C 3.45Å; G46-E48 PolarHBondContact O-N 2.86Å
47	E	34.5	Very low	37.2	Very low	200 Å²	200	112.1 Å²	112.1	94%	0.935	58%	0.575	S	S	*	*	S	Bend	trans	-58.8	-28.7	-162.9	-59.3	-177.9	139.3	0	0	114.5	S49	E47-S49 PolarHBondContact O-N 3.07Å; E47-S49 VanDerWaalsContact O-N 3.12Å
48	E	36	Very low	37.9	Very low	182 Å²	182	103 Å²	103	85%	0.85	55%	0.55	S	S	*	*	S	Bend	trans	-75.8	91.3	166.5	-75.8	-69.6	112.5	0	0	111.2	G46 F50	G46-E48 CarbonylContact O-C 3.45Å; G46-E48 PolarHBondContact O-N 2.86Å; E48-F50 VanDerWaalsContact C-N 3.35Å; E48-F50 PolarHBondContact O-N 3.27Å
49	S	42.7	Very low	38.6	Very low	93 Å²	93	98 Å²	98	65%	0.65	54%	0.537	S	S	*	.			trans	-76.7	60.3	-162.6	46.3	0	0	0	0	116.6	E47	E47-S49 PolarHBondContact O-N 3.07Å; E47-S49 VanDerWaalsContact O-N 3.12Å
50	F	47.8	Very low	39.1	Very low	168 Å²	168	97.2 Å²	97.2	74%	0.737	53%	0.531	S	S	*	.			trans	-132	57.4	-178.1	-96.5	-78	0	0	0	119.7	E48	E48-F50 VanDerWaalsContact C-N 3.35Å; E48-F50 PolarHBondContact O-N 3.27Å
51	P	47.1	Very low	40.1	Very low	49 Å²	49	91.3 Å²	91.3	32%	0.318	50%	0.502	S	S	.	.			trans	-110.6	-32.9	164.5	4.7	17.1	0	0	0	116	V45 H53 K54 A55	V45-P51 HydrophobicContact CG1-CG 4.43Å; V45-P51 HydrophobicContact CG2-CG 4.2Å; P51-H53 PolarHBondContact O-N 3.1Å; P51-H53 VanDerWaalsContact O-N 3.14Å; P51-K54 PolarHBondContact O-N 3.07Å; P51-A55 PolarHBondContact O-N 2.89Å; P51-A55 VanDerWaalsContact O-N 3.12Å
52	A	38.7	Very low	40.6	Very low	34 Å²	34	93.3 Å²	93.3	28%	0.281	50%	0.504	S	S	.	.	H	α-helix	trans	-57	-40.6	-159.5	0	0	0	0	0	115.2	K54 A55 V56 M122	A52-K54 VanDerWaalsContact C-N 3.26Å; A52-K54 PolarHBondContact O-N 2.86Å; A52-A55 PolarHBondContact O-N 3.29Å; A52-V56 WeakPolarHBondContact O-CG2 3.22Å; A52-V56 PolarHBondContact O-N 3.38Å; A52-V56 VanDerWaalsContact O-N 3.11Å; A52-M122 HydrophobicContact CB-CE 3.64Å; A52-M122 HydrophobicContact CB-SD 3.94Å
53	H	38.8	Very low	41	Very low	55 Å²	55	95.6 Å²	95.6	26%	0.255	51%	0.506	S	S	.	.	H	α-helix	trans	-63.8	-33.9	179.7	-173.2	-174.1	0	0	0	112	P51 L57 M122 V125	P51-H53 PolarHBondContact O-N 3.1Å; P51-H53 VanDerWaalsContact O-N 3.14Å; H53-L57 WeakPolarHBondContact O-CG 3.46Å; H53-L57 PolarHBondContact O-N 2.92Å; H53-M122 HydrophobicContact CB-CE 3.71Å; H53-V125 HydrophobicContact CB-CG2 3.99Å; H53-V125 WeakPolarHBondContact CD2-CG2 3.49Å; H53-V125 VanDerWaalsContact CG-CG2 3.41Å
54	K	45.4	Very low	41.7	Very low	107 Å²	107	94.8 Å²	94.8	47%	0.465	50%	0.499	S	S	.	.	H	α-helix	trans	-80.5	-36.4	-178.9	-60.3	173.6	-175.8	170.2	0	110.9	P51 A52 A58	P51-K54 PolarHBondContact O-N 3.07Å; A52-K54 VanDerWaalsContact C-N 3.26Å; A52-K54 PolarHBondContact O-N 2.86Å; K54-A58 VanDerWaalsContact O-CB 3.31Å; K54-A58 WeakPolarHBondContact O-CB 3.12Å; K54-A58 PolarHBondContact O-N 2.85Å
55	A	47.3	Very low	42.5	Very low	32 Å²	32	90.4 Å²	90.4	26%	0.264	49%	0.489	S	S	.	.	H	α-helix	trans	-62.7	-47.5	174.8	0	0	0	0	0	112.5	L43 P51 A52 A58 A59	L43-A55 HydrophobicContact CD1-CB 3.95Å; L43-A55 HydrophobicContact CD2-CB 4.23Å; P51-A55 PolarHBondContact O-N 2.89Å; P51-A55 VanDerWaalsContact O-N 3.12Å; A52-A55 PolarHBondContact O-N 3.29Å; A55-A58 PolarHBondContact O-N 2.91Å; A55-A59 WeakPolarHBondContact O-CB 3.13Å; A55-A59 PolarHBondContact O-N 3.26Å
56	V	44.3	Very low	43.1	Very low	38 Å²	38	90.4 Å²	90.4	23%	0.23	49%	0.492	C	S	.	.	H	α-helix	trans	-63.2	-44.8	178.8	174.8	0	0	0	0	111.5	A52 A58 A59 C60 L113 L120	A52-V56 WeakPolarHBondContact O-CG2 3.22Å; A52-V56 PolarHBondContact O-N 3.38Å; A52-V56 VanDerWaalsContact O-N 3.11Å; V56-A58 VanDerWaalsContact C-N 3.35Å; V56-A58 PolarHBondContact O-N 3.27Å; V56-A59 PolarHBondContact O-N 3.46Å; V56-C60 PolarHBondContact O-N 3.32Å; V56-C60 VanDerWaalsContact O-N 3.1Å; V56-C60 PolarHBondContact O-SG 2.91Å; V56-C60 VanDerWaalsContact O-SG 3.37Å; V56-L113 HydrophobicContact CG1-CD1 3.59Å; V56-L120 HydrophobicContact CG2-CD1 4.34Å
57	L	44.9	Very low	43.5	Very low	70 Å²	70	91 Å²	91	37%	0.366	49%	0.485	S	S	.	.	H	α-helix	trans	-67.4	-32.5	178.1	-71	175	0	0	0	113.2	H53	H53-L57 WeakPolarHBondContact O-CG 3.46Å; H53-L57 PolarHBondContact O-N 2.92Å
58	A	48.9	Very low	44	Very low	44 Å²	44	85.7 Å²	85.7	36%	0.364	46%	0.459	S	S	.	.	H	α-helix	trans	-67.1	-47.6	173.3	0	0	0	0	0	111.5	K54 A55 V56 C60 S61 F64	K54-A58 VanDerWaalsContact O-CB 3.31Å; K54-A58 WeakPolarHBondContact O-CB 3.12Å; K54-A58 PolarHBondContact O-N 2.85Å; A55-A58 PolarHBondContact O-N 2.91Å; V56-A58 VanDerWaalsContact C-N 3.35Å; V56-A58 PolarHBondContact O-N 3.27Å; A58-C60 VanDerWaalsContact C-N 3.25Å; A58-C60 PolarHBondContact O-N 3.41Å; A58-S61 WeakPolarHBondContact O-CB 3.39Å; A58-S61 PolarHBondContact O-N 3.11Å; A58-S61 VanDerWaalsContact O-N 3.14Å; A58-S61 PolarHBondContact O-OG 3.42Å; A58-F64 VanDerWaalsContact O-CB 3.28Å; A58-F64 WeakPolarHBondContact O-CB 3.5Å
59	A	46.9	Very low	44.3	Very low	44 Å²	44	79.9 Å²	79.9	36%	0.364	45%	0.448	S	S	.	.	H	α-helix	trans	-61.8	-30.7	178.7	0	0	0	0	0	113.1	A55 V56 S61	A55-A59 WeakPolarHBondContact O-CB 3.13Å; A55-A59 PolarHBondContact O-N 3.26Å; V56-A59 PolarHBondContact O-N 3.46Å; A59-S61 VanDerWaalsContact C-N 3.28Å; A59-S61 PolarHBondContact O-N 2.77Å
60	C	43.4	Very low	44.1	Very low	94 Å²	94	85.7 Å²	85.7	64%	0.635	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	19.3	175.7	-64.6	0	0	0	0	114.6	V56 A58	V56-C60 PolarHBondContact O-N 3.32Å; V56-C60 VanDerWaalsContact O-N 3.1Å; V56-C60 PolarHBondContact O-SG 2.91Å; V56-C60 VanDerWaalsContact O-SG 3.37Å; A58-C60 VanDerWaalsContact C-N 3.25Å; A58-C60 PolarHBondContact O-N 3.41Å
61	S	47.5	Very low	43.7	Very low	27 Å²	27	85.1 Å²	85.1	19%	0.189	46%	0.455	C	S	.	.	S	Bend	trans	-107.5	140.6	-179.5	73.8	0	0	0	0	113	A58 A59 Y63 F64 E65	A58-S61 WeakPolarHBondContact O-CB 3.39Å; A58-S61 PolarHBondContact O-N 3.11Å; A58-S61 VanDerWaalsContact O-N 3.14Å; A58-S61 PolarHBondContact O-OG 3.42Å; A59-S61 VanDerWaalsContact C-N 3.28Å; A59-S61 PolarHBondContact O-N 2.77Å; S61-Y63 PolarHBondContact O-N 2.89Å; S61-F64 WeakPolarHBondContact O-CB 3.29Å; S61-F64 PolarHBondContact O-N 3.16Å; S61-F64 PolarHBondContact OG-N 3.31Å; S61-E65 PolarHBondContact O-N 3.32Å
62	E	41	Very low	43.5	Very low	143 Å²	143	88.7 Å²	88.7	67%	0.668	48%	0.476	S	S	*	.	H	α-helix	trans	-58.4	-22.5	176	-64	179.5	162.8	0	0	112.4	S66	E62-S66 VanDerWaalsContact O-CB 3.29Å; E62-S66 WeakPolarHBondContact O-CB 3.3Å; E62-S66 PolarHBondContact O-N 3Å
63	Y	39.8	Very low	43.8	Very low	169 Å²	169	96.5 Å²	96.5	66%	0.663	51%	0.507	S	S	*	.	H	α-helix	trans	-67.7	-39.4	172.2	-176.4	-102.7	0	0	0	112.2	S61 S66 V67	S61-Y63 PolarHBondContact O-N 2.89Å; Y63-S66 PolarHBondContact O-N 2.9Å; Y63-V67 HydrophobicContact CD1-CG2 4.35Å; Y63-V67 HydrophobicContact CE1-CG2 4Å; Y63-V67 HydrophobicContact CE2-CG2 4.18Å; Y63-V67 WeakPolarHBondContact O-CG2 3.44Å; Y63-V67 PolarHBondContact O-N 2.99Å
64	F	46.7	Very low	43.9	Very low	76 Å²	76	97.3 Å²	97.3	33%	0.333	53%	0.53	S	S	.	.	H	α-helix	trans	-67.4	-43.1	177.3	-156.6	-88.8	0	0	0	110.9	A58 S61 S66 V67 F68	A58-F64 VanDerWaalsContact O-CB 3.28Å; A58-F64 WeakPolarHBondContact O-CB 3.5Å; S61-F64 WeakPolarHBondContact O-CB 3.29Å; S61-F64 PolarHBondContact O-N 3.16Å; S61-F64 PolarHBondContact OG-N 3.31Å; F64-S66 VanDerWaalsContact C-N 3.33Å; F64-S66 PolarHBondContact O-N 3.45Å; F64-V67 PolarHBondContact O-N 2.75Å; F64-F68 AromaticContact CD1-CD2 3.68Å; F64-F68 HydrophobicContact CD1-CD2 3.68Å; F64-F68 HydrophobicContact CD1-CE2 4.35Å; F64-F68 AromaticContact CD2-CD2 3.9Å; F64-F68 HydrophobicContact CD2-CD2 3.9Å; F64-F68 AromaticContact CD2-CE2 3.76Å; F64-F68 HydrophobicContact CD2-CE2 3.76Å; F64-F68 AromaticContact CE1-CD2 3.64Å; F64-F68 HydrophobicContact CE1-CD2 3.64Å; F64-F68 HydrophobicContact CE1-CE2 4.16Å; F64-F68 HydrophobicContact CE1-CG 4.34Å; F64-F68 AromaticContact CE2-CD2 3.86Å; F64-F68 HydrophobicContact CE2-CD2 3.86Å; F64-F68 AromaticContact CE2-CE2 3.54Å; F64-F68 HydrophobicContact CE2-CE2 3.54Å; F64-F68 AromaticContact CG-CD2 3.81Å; F64-F68 HydrophobicContact CG-CD2 3.81Å; F64-F68 HydrophobicContact CG-CE2 4.16Å; F64-F68 AromaticContact CZ-CD2 3.73Å; F64-F68 HydrophobicContact CZ-CD2 3.73Å; F64-F68 AromaticContact CZ-CE2 3.76Å; F64-F68 HydrophobicContact CZ-CE2 3.76Å; F64-F68 WeakPolarHBondContact O-CB 3.2Å; F64-F68 WeakPolarHBondContact O-CD2 3.27Å; F64-F68 PolarHBondContact O-N 2.74Å
65	E	44.8	Very low	43.6	Very low	140 Å²	140	101.4 Å²	101.4	65%	0.654	55%	0.551	S	S	*	*	H	α-helix	trans	-62	-38.4	171.6	-65.2	-172.1	147.7	0	0	112.3	S61 G69	S61-E65 PolarHBondContact O-N 3.32Å; E65-G69 WeakPolarHBondContact O-CA 3.48Å; E65-G69 PolarHBondContact O-N 3.28Å
66	S	47	Very low	43.4	Very low	80 Å²	80	104 Å²	104	56%	0.559	58%	0.582	S	S	*	*	H	α-helix	trans	-69.5	-31.7	177.9	-170.3	0	0	0	0	113.8	E62 Y63 F64	E62-S66 VanDerWaalsContact O-CB 3.29Å; E62-S66 WeakPolarHBondContact O-CB 3.3Å; E62-S66 PolarHBondContact O-N 3Å; Y63-S66 PolarHBondContact O-N 2.9Å; F64-S66 VanDerWaalsContact C-N 3.33Å; F64-S66 PolarHBondContact O-N 3.45Å
67	V	41.2	Very low	42.8	Very low	66 Å²	66	108.3 Å²	108.3	40%	0.4	60%	0.603	S	S	.	*	H	α-helix	trans	-85.7	-39.7	179.9	172	0	0	0	0	112.2	Y63 F64	Y63-V67 HydrophobicContact CD1-CG2 4.35Å; Y63-V67 HydrophobicContact CE1-CG2 4Å; Y63-V67 HydrophobicContact CE2-CG2 4.18Å; Y63-V67 WeakPolarHBondContact O-CG2 3.44Å; Y63-V67 PolarHBondContact O-N 2.99Å; F64-V67 PolarHBondContact O-N 2.75Å
68	F	43.1	Very low	42.3	Very low	89 Å²	89	109.4 Å²	109.4	39%	0.39	62%	0.622	S	S	.	*	H	α-helix	trans	-105.8	-20.7	-173.7	-61	-70.3	0	0	0	114.4	F64 R70 L81	F64-F68 AromaticContact CD1-CD2 3.68Å; F64-F68 HydrophobicContact CD1-CD2 3.68Å; F64-F68 HydrophobicContact CD1-CE2 4.35Å; F64-F68 AromaticContact CD2-CD2 3.9Å; F64-F68 HydrophobicContact CD2-CD2 3.9Å; F64-F68 AromaticContact CD2-CE2 3.76Å; F64-F68 HydrophobicContact CD2-CE2 3.76Å; F64-F68 AromaticContact CE1-CD2 3.64Å; F64-F68 HydrophobicContact CE1-CD2 3.64Å; F64-F68 HydrophobicContact CE1-CE2 4.16Å; F64-F68 HydrophobicContact CE1-CG 4.34Å; F64-F68 AromaticContact CE2-CD2 3.86Å; F64-F68 HydrophobicContact CE2-CD2 3.86Å; F64-F68 AromaticContact CE2-CE2 3.54Å; F64-F68 HydrophobicContact CE2-CE2 3.54Å; F64-F68 AromaticContact CG-CD2 3.81Å; F64-F68 HydrophobicContact CG-CD2 3.81Å; F64-F68 HydrophobicContact CG-CE2 4.16Å; F64-F68 AromaticContact CZ-CD2 3.73Å; F64-F68 HydrophobicContact CZ-CD2 3.73Å; F64-F68 AromaticContact CZ-CE2 3.76Å; F64-F68 HydrophobicContact CZ-CE2 3.76Å; F64-F68 WeakPolarHBondContact O-CB 3.2Å; F64-F68 WeakPolarHBondContact O-CD2 3.27Å; F64-F68 PolarHBondContact O-N 2.74Å; F68-R70 PolarHBondContact O-N 3.46Å; F68-R70 VanDerWaalsContact O-N 3.14Å; F68-L81 HydrophobicContact CE1-CD2 3.52Å; F68-L81 HydrophobicContact CZ-CD2 3.8Å
69	G	42.3	Very low	41.6	Very low	60 Å²	60	115 Å²	115	62%	0.619	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	3.5	177	0	0	0	0	0	115.2	E65	E65-G69 WeakPolarHBondContact O-CA 3.48Å; E65-G69 PolarHBondContact O-N 3.28Å
70	R	40	Very low	40.8	Very low	214 Å²	214	120.6 Å²	120.6	81%	0.808	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.8	47.6	176.2	-84.4	-175.1	161.5	152.1	-4.1	113.1	F68	F68-R70 PolarHBondContact O-N 3.46Å; F68-R70 VanDerWaalsContact O-N 3.14Å
71	Q	39.2	Very low	40.4	Very low	157 Å²	157	122 Å²	122	73%	0.734	66%	0.657	S	S	*	*			trans	-125.9	56.2	162.1	-66.1	-166.2	23.6	0	0	112
72	T	42.7	Very low	39.6	Very low	124 Å²	124	128 Å²	128	76%	0.761	68%	0.682	S	S	*	*			trans	-86.1	132.9	139.6	53.4	0	0	0	0	106.4
73	E	43.8	Very low	39.1	Very low	197 Å²	197	127.9 Å²	127.9	92%	0.921	68%	0.683	S	S	*	*	S	Bend	cis	-136.8	166.5	17.1	-58.4	174	136.3	0	0	110.4
74	G	41.4	Very low	38.8	Very low	73 Å²	73	126.6 Å²	126.6	75%	0.753	68%	0.683	S	S	*	*			trans	126.4	100.1	171.3	0	0	0	0	0	115
75	E	39.2	Very low	38	Very low	192 Å²	192	129.5 Å²	129.5	90%	0.897	71%	0.708	S	S	*	*			trans	32.7	102.9	144.5	-159.2	159.2	-168.8	0	0	120	D77	E75-D77 PolarHBondContact O-N 3.28Å; E75-D77 VanDerWaalsContact O-N 3.13Å
76	G	43.4	Very low	37.6	Very low	88 Å²	88	126.2 Å²	126.2	91%	0.907	69%	0.694	S	S	*	*				83.8	0.4	111.3	0	0	0	0	0	120.1
77	D	31.6	Very low	37.1	Very low	128 Å²	128	125 Å²	125	68%	0.684	69%	0.686	S	S	*	*			trans	-121.4	136.7	177.6	-167.6	22.6	0	0	0	114	E75 K79	E75-D77 PolarHBondContact O-N 3.28Å; E75-D77 VanDerWaalsContact O-N 3.13Å; D77-K79 PolarHBondContact O-N 3.43Å; D77-K79 VanDerWaalsContact O-N 3.15Å
78	A	35.3	Very low	36.8	Very low	92 Å²	92	127.2 Å²	127.2	76%	0.76	70%	0.701	S	S	*	*			trans	-89.4	71.8	-176.9	0	0	0	0	0	110.3	E80	A78-E80 PolarHBondContact O-N 2.86Å
79	K	33	Very low	36.4	Very low	162 Å²	162	130.7 Å²	130.7	70%	0.704	72%	0.716	S	S	*	*			trans	-58.6	102.6	-178.6	-76.2	179.4	176.4	168.7	0	112.4	D77 L81	D77-K79 PolarHBondContact O-N 3.43Å; D77-K79 VanDerWaalsContact O-N 3.15Å; K79-L81 PolarHBondContact O-N 3.1Å; K79-L81 VanDerWaalsContact O-N 3.11Å
80	E	31	Very low	36.2	Very low	162 Å²	162	131.3 Å²	131.3	76%	0.757	71%	0.708	S	S	*	*			trans	-58.8	110.6	161	-69.3	-168.4	125.1	0	0	108.7	A78 E82	A78-E80 PolarHBondContact O-N 2.86Å; E80-E82 VanDerWaalsContact C-N 3.33Å; E80-E82 PolarHBondContact O-N 2.79Å
81	L	33.9	Very low	36.1	Very low	123 Å²	123	125.6 Å²	125.6	64%	0.644	69%	0.689	S	S	*	*			trans	-84.5	77	-178.4	-165.1	79.3	0	0	0	110.1	F68 K79 M83	F68-L81 HydrophobicContact CE1-CD2 3.52Å; F68-L81 HydrophobicContact CZ-CD2 3.8Å; K79-L81 PolarHBondContact O-N 3.1Å; K79-L81 VanDerWaalsContact O-N 3.11Å; L81-M83 PolarHBondContact O-N 3.04Å
82	E	32.1	Very low	36	Very low	153 Å²	153	123.3 Å²	123.3	72%	0.715	68%	0.676	S	S	*	*			trans	-67.7	99.6	176.9	-164.5	174.8	-123.7	0	0	110.5	E80 H84	E80-E82 VanDerWaalsContact C-N 3.33Å; E80-E82 PolarHBondContact O-N 2.79Å; E82-H84 VanDerWaalsContact C-N 3.34Å; E82-H84 PolarHBondContact O-N 2.79Å; E82-H84 IonicContact OE2-CE1 3.71Å; E82-H84 PolarHBondContact OE2-CE1 3.24Å; E82-H84 IonicContact OE2-ND1 3.57Å
83	M	29.6	Very low	35.7	Very low	140 Å²	140	121.6 Å²	121.6	69%	0.69	66%	0.663	S	S	*	*			trans	-79.6	78.7	-172.7	-169.2	173	68.2	0	0	111.1	L81 T85 I86	L81-M83 PolarHBondContact O-N 3.04Å; M83-T85 PolarHBondContact O-N 2.97Å; M83-T85 VanDerWaalsContact O-N 3.11Å; M83-I86 HydrophobicContact CE-CD1 3.85Å; M83-I86 HydrophobicContact CG-CD1 4.15Å; M83-I86 HydrophobicContact CG-CG1 4.34Å; M83-I86 HydrophobicContact SD-CD1 3.69Å
84	H	32.8	Very low	35.6	Very low	143 Å²	143	116.4 Å²	116.4	66%	0.662	64%	0.64	S	S	*	*			trans	-51.1	115.1	-178.5	-63	-42.4	0	0	0	112.9	E82 I86	E82-H84 VanDerWaalsContact C-N 3.34Å; E82-H84 PolarHBondContact O-N 2.79Å; E82-H84 IonicContact OE2-CE1 3.71Å; E82-H84 PolarHBondContact OE2-CE1 3.24Å; E82-H84 IonicContact OE2-ND1 3.57Å; H84-I86 PolarHBondContact O-N 3.04Å; H84-I86 VanDerWaalsContact O-N 3.13Å
85	T	30.9	Very low	35.4	Very low	137 Å²	137	115.6 Å²	115.6	84%	0.84	62%	0.618	S	S	*	*			trans	33.4	63.4	156.8	52.5	0	0	0	0	117.1	M83 S87	M83-T85 PolarHBondContact O-N 2.97Å; M83-T85 VanDerWaalsContact O-N 3.11Å; T85-S87 PolarHBondContact O-N 2.85Å; T85-S87 VanDerWaalsContact O-N 3.07Å
86	I	36.1	Very low	35.4	Very low	70 Å²	70	110 Å²	110	36%	0.359	59%	0.594	S	S	.	*			trans	-54.8	119	163.2	-61.2	-179.2	0	0	0	108.5	M83 H84 V90 F91	M83-I86 HydrophobicContact CE-CD1 3.85Å; M83-I86 HydrophobicContact CG-CD1 4.15Å; M83-I86 HydrophobicContact CG-CG1 4.34Å; M83-I86 HydrophobicContact SD-CD1 3.69Å; H84-I86 PolarHBondContact O-N 3.04Å; H84-I86 VanDerWaalsContact O-N 3.13Å; I86-V90 HydrophobicContact CG2-CB 3.9Å; I86-V90 HydrophobicContact CG2-CG1 3.76Å; I86-F91 HydrophobicContact CG2-CB 4.08Å
87	S	35.7	Very low	35	Very low	56 Å²	56	112 Å²	112	39%	0.392	58%	0.579	S	S	.	*			trans	-59.8	147	-176.6	76.4	0	0	0	0	111.7	T85 K89 V90 F91	T85-S87 PolarHBondContact O-N 2.85Å; T85-S87 VanDerWaalsContact O-N 3.07Å; S87-K89 PolarHBondContact O-N 3.04Å; S87-V90 PolarHBondContact O-N 2.93Å; S87-V90 WeakPolarHBondContact OG-CG2 3.3Å; S87-V90 PolarHBondContact OG-N 2.92Å; S87-F91 PolarHBondContact O-N 3.03Å
88	P	36.7	Very low	35.4	Very low	111 Å²	111	107.6 Å²	107.6	72%	0.721	56%	0.56	S	S	*	*	H	α-helix	trans	-56.2	-25.9	-178.9	-29.2	36.3	0	0	0	114.9	K92	P88-K92 VanDerWaalsContact O-CB 3.28Å; P88-K92 WeakPolarHBondContact O-CB 3.32Å; P88-K92 PolarHBondContact O-N 3.08Å
89	K	34	Very low	35.6	Very low	163 Å²	163	112.9 Å²	112.9	71%	0.709	56%	0.561	S	S	*	*	H	α-helix	trans	-68.9	-56.7	171.6	-73	-175.1	176.2	-179.7	0	111.3	S87 F91 K92 D93	S87-K89 PolarHBondContact O-N 3.04Å; K89-F91 PolarHBondContact O-N 2.91Å; K89-K92 CarbonylContact O-C 3.56Å; K89-K92 WeakPolarHBondContact O-CA 3.2Å; K89-K92 WeakPolarHBondContact O-CB 3.47Å; K89-K92 PolarHBondContact O-N 3.17Å; K89-D93 PolarHBondContact O-N 2.78Å; K89-D93 VanDerWaalsContact O-OD2 3.13Å
90	V	37.2	Very low	35.5	Very low	73 Å²	73	110.1 Å²	110.1	44%	0.442	56%	0.558	S	S	.	*	H	α-helix	trans	-58.2	-37.1	177.8	177.1	0	0	0	0	111.3	I86 S87 D93 I94	I86-V90 HydrophobicContact CG2-CB 3.9Å; I86-V90 HydrophobicContact CG2-CG1 3.76Å; S87-V90 PolarHBondContact O-N 2.93Å; S87-V90 WeakPolarHBondContact OG-CG2 3.3Å; S87-V90 PolarHBondContact OG-N 2.92Å; V90-D93 PolarHBondContact O-N 2.8Å; V90-I94 HydrophobicContact CG1-CD1 3.84Å; V90-I94 HydrophobicContact CG1-CG1 4.46Å; V90-I94 WeakPolarHBondContact O-CB 3.49Å; V90-I94 WeakPolarHBondContact O-CD1 3.43Å; V90-I94 VanDerWaalsContact O-CG1 3.22Å; V90-I94 WeakPolarHBondContact O-CG1 3.5Å; V90-I94 PolarHBondContact O-N 3.36Å
91	F	37.8	Very low	35.5	Very low	94 Å²	94	104.3 Å²	104.3	41%	0.412	54%	0.535	S	S	.	.	H	α-helix	trans	-65.5	-43.5	173.4	-175.7	-114.9	0	0	0	112.8	I86 S87 K89 D93 L95	I86-F91 HydrophobicContact CG2-CB 4.08Å; S87-F91 PolarHBondContact O-N 3.03Å; K89-F91 PolarHBondContact O-N 2.91Å; F91-D93 VanDerWaalsContact C-N 3.35Å; F91-L95 HydrophobicContact CD1-CD1 3.86Å; F91-L95 HydrophobicContact CE1-CD1 3.57Å; F91-L95 HydrophobicContact CE2-CD1 4.47Å; F91-L95 HydrophobicContact CG-CD1 4.45Å; F91-L95 HydrophobicContact CZ-CD1 3.91Å; F91-L95 HydrophobicContact CZ-CG 4.49Å; F91-L95 WeakPolarHBondContact O-CB 3.49Å; F91-L95 VanDerWaalsContact O-CG 3.3Å; F91-L95 WeakPolarHBondContact O-CG 3.21Å; F91-L95 PolarHBondContact O-N 2.62Å
92	K	37.2	Very low	35.4	Very low	108 Å²	108	106.2 Å²	106.2	47%	0.47	53%	0.534	S	S	.	.	H	α-helix	trans	-61.5	-42.4	172.6	-177.9	-162.8	153.9	-63.1	0	111.3	P88 K89 L95 D96	P88-K92 VanDerWaalsContact O-CB 3.28Å; P88-K92 WeakPolarHBondContact O-CB 3.32Å; P88-K92 PolarHBondContact O-N 3.08Å; K89-K92 CarbonylContact O-C 3.56Å; K89-K92 WeakPolarHBondContact O-CA 3.2Å; K89-K92 WeakPolarHBondContact O-CB 3.47Å; K89-K92 PolarHBondContact O-N 3.17Å; K92-L95 CarbonylContact O-C 3.56Å; K92-L95 WeakPolarHBondContact O-CA 3.22Å; K92-L95 WeakPolarHBondContact O-CB 3.41Å; K92-L95 PolarHBondContact O-N 3.38Å; K92-L95 VanDerWaalsContact O-N 3.12Å; K92-D96 IonicContact NZ-OD2 3.2Å; K92-D96 PolarHBondContact NZ-OD2 3.33Å; K92-D96 PolarHBondContact O-N 2.84Å
93	D	37.5	Very low	35.7	Very low	89 Å²	89	103.5 Å²	103.5	48%	0.476	52%	0.523	S	S	.	.	H	α-helix	trans	-73.2	-31.6	-176	-57.7	-29.3	0	0	0	111.3	K89 V90 F91 F97	K89-D93 PolarHBondContact O-N 2.78Å; K89-D93 VanDerWaalsContact O-OD2 3.13Å; V90-D93 PolarHBondContact O-N 2.8Å; F91-D93 VanDerWaalsContact C-N 3.35Å; D93-F97 VanDerWaalsContact O-CB 3.29Å; D93-F97 WeakPolarHBondContact O-CB 3.46Å; D93-F97 PolarHBondContact O-N 2.84Å
94	I	40.3	Very low	35.9	Very low	88 Å²	88	102.5 Å²	102.5	45%	0.451	53%	0.525	S	S	.	.	H	α-helix	trans	-67.5	-36.5	166.6	-70.2	166.8	0	0	0	111.5	V90 F97 A98	V90-I94 HydrophobicContact CG1-CD1 3.84Å; V90-I94 HydrophobicContact CG1-CG1 4.46Å; V90-I94 WeakPolarHBondContact O-CB 3.49Å; V90-I94 WeakPolarHBondContact O-CD1 3.43Å; V90-I94 VanDerWaalsContact O-CG1 3.22Å; V90-I94 WeakPolarHBondContact O-CG1 3.5Å; V90-I94 PolarHBondContact O-N 3.36Å; I94-F97 PolarHBondContact O-N 3.21Å; I94-A98 WeakPolarHBondContact O-CB 3.48Å; I94-A98 PolarHBondContact O-N 3.18Å
95	L	38.3	Very low	36.3	Very low	56 Å²	56	98 Å²	98	29%	0.293	51%	0.507	S	S	.	.	H	α-helix	trans	-69.8	-43.4	174.9	-76.1	169.7	0	0	0	112.3	F91 K92 F97 A98 Y99	F91-L95 HydrophobicContact CD1-CD1 3.86Å; F91-L95 HydrophobicContact CE1-CD1 3.57Å; F91-L95 HydrophobicContact CE2-CD1 4.47Å; F91-L95 HydrophobicContact CG-CD1 4.45Å; F91-L95 HydrophobicContact CZ-CD1 3.91Å; F91-L95 HydrophobicContact CZ-CG 4.49Å; F91-L95 WeakPolarHBondContact O-CB 3.49Å; F91-L95 VanDerWaalsContact O-CG 3.3Å; F91-L95 WeakPolarHBondContact O-CG 3.21Å; F91-L95 PolarHBondContact O-N 2.62Å; K92-L95 CarbonylContact O-C 3.56Å; K92-L95 WeakPolarHBondContact O-CA 3.22Å; K92-L95 WeakPolarHBondContact O-CB 3.41Å; K92-L95 PolarHBondContact O-N 3.38Å; K92-L95 VanDerWaalsContact O-N 3.12Å; L95-F97 VanDerWaalsContact C-N 3.31Å; L95-F97 PolarHBondContact O-N 3.49Å; L95-A98 PolarHBondContact O-N 3.34Å; L95-Y99 WeakPolarHBondContact O-CD2 3.29Å; L95-Y99 PolarHBondContact O-N 3.26Å
96	D	38.3	Very low	36.6	Very low	73 Å²	73	98 Å²	98	39%	0.39	49%	0.492	S	S	.	.	H	α-helix	trans	-59.1	-44.5	170.2	-91.6	-45.4	0	0	0	109.9	K92 A98 Y99 T100	K92-D96 IonicContact NZ-OD2 3.2Å; K92-D96 PolarHBondContact NZ-OD2 3.33Å; K92-D96 PolarHBondContact O-N 2.84Å; D96-A98 VanDerWaalsContact C-N 3.34Å; D96-A98 PolarHBondContact O-N 3.24Å; D96-Y99 PolarHBondContact O-N 2.97Å; D96-T100 VanDerWaalsContact O-CB 3.26Å; D96-T100 WeakPolarHBondContact O-CB 3.47Å; D96-T100 VanDerWaalsContact O-CG2 3.28Å; D96-T100 WeakPolarHBondContact O-CG2 3.24Å; D96-T100 PolarHBondContact O-N 3.46Å; D96-T100 PolarHBondContact O-OG1 3.48Å
97	F	36.8	Very low	37	Very low	132 Å²	132	100.2 Å²	100.2	58%	0.579	50%	0.504	S	S	*	.	H	α-helix	trans	-59.5	-42	174.3	-177.1	-102.4	0	0	0	112.3	D93 I94 L95 S101	D93-F97 VanDerWaalsContact O-CB 3.29Å; D93-F97 WeakPolarHBondContact O-CB 3.46Å; D93-F97 PolarHBondContact O-N 2.84Å; I94-F97 PolarHBondContact O-N 3.21Å; L95-F97 VanDerWaalsContact C-N 3.31Å; L95-F97 PolarHBondContact O-N 3.49Å; F97-S101 WeakPolarHBondContact CE2-OG 2.97Å; F97-S101 WeakPolarHBondContact O-CA 3.33Å; F97-S101 WeakPolarHBondContact O-CB 3.49Å; F97-S101 PolarHBondContact O-N 3.3Å; F97-S101 PolarHBondContact O-OG 2.04Å
98	A	39.4	Very low	37.4	Very low	35 Å²	35	103.8 Å²	103.8	29%	0.289	51%	0.514	S	S	.	.	H	α-helix	trans	-73	-29	-179.7	0	0	0	0	0	114.3	I94 L95 D96 I103	I94-A98 WeakPolarHBondContact O-CB 3.48Å; I94-A98 PolarHBondContact O-N 3.18Å; L95-A98 PolarHBondContact O-N 3.34Å; D96-A98 VanDerWaalsContact C-N 3.34Å; D96-A98 PolarHBondContact O-N 3.24Å; A98-I103 HydrophobicContact CB-CD1 4.04Å; A98-I103 WeakPolarHBondContact O-CD1 3.37Å
99	Y	38.1	Very low	37.9	Very low	202 Å²	202	100.8 Å²	100.8	79%	0.792	50%	0.495	S	S	*	.	H	α-helix	trans	-90.3	-28.1	176.8	-88.5	-89	0	0	0	113.8	L95 D96	L95-Y99 WeakPolarHBondContact O-CD2 3.29Å; L95-Y99 PolarHBondContact O-N 3.26Å; D96-Y99 PolarHBondContact O-N 2.97Å
100	T	31.8	Very low	39	Very low	104 Å²	104	94.1 Å²	94.1	64%	0.638	47%	0.467	S	S	*	.	H	α-helix	trans	-85.4	-34.4	175.1	59.2	0	0	0	0	112.1	D96 R102	D96-T100 VanDerWaalsContact O-CB 3.26Å; D96-T100 WeakPolarHBondContact O-CB 3.47Å; D96-T100 VanDerWaalsContact O-CG2 3.28Å; D96-T100 WeakPolarHBondContact O-CG2 3.24Å; D96-T100 PolarHBondContact O-N 3.46Å; D96-T100 PolarHBondContact O-OG1 3.48Å; T100-R102 PolarHBondContact O-N 2.78Å
101	S	30.7	Very low	39.6	Very low	40 Å²	40	93.7 Å²	93.7	28%	0.28	47%	0.465	S	S	.	.	S	Bend	trans	-67.1	129.1	167.6	-61.6	0	0	0	0	109	F97 I103	F97-S101 WeakPolarHBondContact CE2-OG 2.97Å; F97-S101 WeakPolarHBondContact O-CA 3.33Å; F97-S101 WeakPolarHBondContact O-CB 3.49Å; F97-S101 PolarHBondContact O-N 3.3Å; F97-S101 PolarHBondContact O-OG 2.04Å; S101-I103 VanDerWaalsContact C-N 3.26Å; S101-I103 PolarHBondContact O-N 2.72Å
102	R	32.8	Very low	40.2	Very low	163 Å²	163	95 Å²	95	62%	0.615	47%	0.473	S	S	*	.			trans	-71.1	84.7	170.1	-69.7	172.1	172.2	156.1	-5.8	108.8	T100 V104 D394 S396	T100-R102 PolarHBondContact O-N 2.78Å; R102-V104 VanDerWaalsContact C-N 3.28Å; R102-V104 HydrophobicContact CB-CG2 4.39Å; R102-V104 WeakPolarHBondContact O-CG2 3.43Å; R102-V104 PolarHBondContact O-N 2.9Å; R102-D394 PolarHBondContact NH1-O 3.41Å; R102-D394 PolarHBondContact NH2-O 3.11Å; R102-S396 PolarHBondContact NH1-OG 3.33Å
103	I	37.3	Very low	40.9	Very low	96 Å²	96	90.9 Å²	90.9	49%	0.492	46%	0.456	S	S	.	.			trans	-66.6	91.3	170.1	-58.5	-179.4	0	0	0	107.5	A98 S101 V105	A98-I103 HydrophobicContact CB-CD1 4.04Å; A98-I103 WeakPolarHBondContact O-CD1 3.37Å; S101-I103 VanDerWaalsContact C-N 3.26Å; S101-I103 PolarHBondContact O-N 2.72Å; I103-V105 VanDerWaalsContact C-N 3.25Å; I103-V105 HydrophobicContact CG2-CG2 4.13Å; I103-V105 PolarHBondContact O-N 3.26Å
104	V	34.1	Very low	41.7	Very low	120 Å²	120	87.8 Å²	87.8	73%	0.727	44%	0.439	S	S	*	.			trans	-79.3	79.6	177.4	-174.8	0	0	0	0	108.3	R102 R106	R102-V104 VanDerWaalsContact C-N 3.28Å; R102-V104 HydrophobicContact CB-CG2 4.39Å; R102-V104 WeakPolarHBondContact O-CG2 3.43Å; R102-V104 PolarHBondContact O-N 2.9Å; V104-R106 PolarHBondContact O-N 3.27Å; V104-R106 VanDerWaalsContact O-N 3.15Å
105	V	40.7	Very low	42.2	Very low	47 Å²	47	86.9 Å²	86.9	29%	0.285	44%	0.437	S	S	.	.			trans	-54.5	121.5	164.1	-175.1	0	0	0	0	107.1	I103 F110	I103-V105 VanDerWaalsContact C-N 3.25Å; I103-V105 HydrophobicContact CG2-CG2 4.13Å; I103-V105 PolarHBondContact O-N 3.26Å; V105-F110 HydrophobicContact CB-CE2 3.77Å; V105-F110 HydrophobicContact CB-CZ 4.05Å; V105-F110 HydrophobicContact CG1-CD2 4.01Å; V105-F110 HydrophobicContact CG1-CE2 3.5Å; V105-F110 HydrophobicContact CG1-CZ 4.02Å
106	R	37.1	Very low	42.6	Very low	139 Å²	139	86 Å²	86	53%	0.525	44%	0.438	S	S	.	.			trans	-71.7	140.8	-177.2	-58	-173.7	-172.4	176.2	7.7	109.6	V104 E108 C109 F110	V104-R106 PolarHBondContact O-N 3.27Å; V104-R106 VanDerWaalsContact O-N 3.15Å; R106-E108 HydrophobicContact CB-CG 3.79Å; R106-E108 WeakPolarHBondContact CD-OE1 3.48Å; R106-E108 IonicContact NE-OE1 2.63Å; R106-E108 IonicContact NH1-OE1 2.78Å; R106-E108 PolarHBondContact NH1-OE1 3.41Å; R106-E108 PolarHBondContact O-N 3.24Å; R106-C109 PolarHBondContact O-N 2.98Å; R106-F110 WeakPolarHBondContact O-CD2 3.42Å
107	L	44.7	Very low	43.3	Very low	116 Å²	116	82.7 Å²	82.7	61%	0.607	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-59.2	-25.9	-175.9	-80.8	80.1	0	0	0	112.9	C109 F110	L107-C109 VanDerWaalsContact C-N 3.29Å; L107-C109 PolarHBondContact O-N 3.02Å; L107-F110 PolarHBondContact O-N 3.12Å
108	E	44.4	Very low	44.1	Very low	130 Å²	130	81.8 Å²	81.8	61%	0.607	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-61.7	-30.2	175.3	60	-151.4	179.1	0	0	113.9	R106 P111	R106-E108 HydrophobicContact CB-CG 3.79Å; R106-E108 WeakPolarHBondContact CD-OE1 3.48Å; R106-E108 IonicContact NE-OE1 2.63Å; R106-E108 IonicContact NH1-OE1 2.78Å; R106-E108 PolarHBondContact NH1-OE1 3.41Å; R106-E108 PolarHBondContact O-N 3.24Å; E108-P111 WeakPolarHBondContact O-CD 3.41Å
109	C	47.9	Very low	44.4	Very low	48 Å²	48	86.1 Å²	86.1	32%	0.324	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-88.1	-10.9	-177.6	-54.1	0	0	0	0	114.1	R106 L107 E112 L113	R106-C109 PolarHBondContact O-N 2.98Å; L107-C109 VanDerWaalsContact C-N 3.29Å; L107-C109 PolarHBondContact O-N 3.02Å; C109-E112 PolarHBondContact O-N 3.34Å; C109-L113 WeakPolarHBondContact O-CB 3.42Å; C109-L113 PolarHBondContact O-N 3.29Å
110	F	56.1	Low	44.7	Very low	23 Å²	23	81.3 Å²	81.3	10%	0.101	42%	0.417	C	S	.	.	H	α-helix	trans	-63.5	-37.5	-176.9	-85.3	-99.8	0	0	0	115	V105 R106 L107 E112 M114 C129 V132 I133	V105-F110 HydrophobicContact CB-CE2 3.77Å; V105-F110 HydrophobicContact CB-CZ 4.05Å; V105-F110 HydrophobicContact CG1-CD2 4.01Å; V105-F110 HydrophobicContact CG1-CE2 3.5Å; V105-F110 HydrophobicContact CG1-CZ 4.02Å; R106-F110 WeakPolarHBondContact O-CD2 3.42Å; L107-F110 PolarHBondContact O-N 3.12Å; F110-E112 VanDerWaalsContact C-N 3.28Å; F110-E112 PolarHBondContact O-N 3.28Å; F110-M114 WeakPolarHBondContact O-CB 3.22Å; F110-M114 VanDerWaalsContact O-CG 3.27Å; F110-M114 WeakPolarHBondContact O-CG 3.12Å; F110-M114 PolarHBondContact O-N 3.38Å; F110-C129 HydrophobicContact CD1-CB 4.31Å; F110-V132 HydrophobicContact CD1-CG1 4.27Å; F110-V132 HydrophobicContact CE1-CB 3.88Å; F110-V132 HydrophobicContact CE1-CG1 3.47Å; F110-V132 VanDerWaalsContact CE1-CG1 3.47Å; F110-V132 HydrophobicContact CZ-CB 4.49Å; F110-V132 HydrophobicContact CZ-CG1 3.65Å; F110-I133 HydrophobicContact CB-CD1 4.4Å; F110-I133 HydrophobicContact CB-CG1 4.42Å; F110-I133 HydrophobicContact CD1-CG1 4.46Å
111	P	50.1	Low	45.4	Very low	64 Å²	64	83.5 Å²	83.5	42%	0.416	42%	0.424	S	S	.	.	H	α-helix	trans	-62.7	-35.5	174.3	-23.1	35.2	0	0	0	112.8	E108 T115	E108-P111 WeakPolarHBondContact O-CD 3.41Å; P111-T115 WeakPolarHBondContact O-CB 3.18Å; P111-T115 PolarHBondContact O-N 3.13Å; P111-T115 VanDerWaalsContact O-N 3.08Å; P111-T115 PolarHBondContact O-OG1 3.06Å
112	E	49.9	Very low	46.2	Very low	122 Å²	122	82.8 Å²	82.8	57%	0.57	42%	0.417	S	S	*	.	H	α-helix	trans	-72.9	-47.8	179.6	-55.2	177.6	131.4	0	0	110.3	C109 F110 M114 T115 A116	C109-E112 PolarHBondContact O-N 3.34Å; F110-E112 VanDerWaalsContact C-N 3.28Å; F110-E112 PolarHBondContact O-N 3.28Å; E112-M114 PolarHBondContact O-N 2.95Å; E112-T115 WeakPolarHBondContact O-CA 3.43Å; E112-T115 WeakPolarHBondContact O-CB 3.44Å; E112-T115 PolarHBondContact O-N 3.02Å; E112-A116 PolarHBondContact O-N 3.26Å
113	L	51.8	Low	46.8	Very low	22 Å²	22	83.7 Å²	83.7	12%	0.115	42%	0.42	C	S	.	.	H	α-helix	trans	-59.4	-42.5	174.1	-177.1	61.5	0	0	0	112.2	V56 C109 T115 A117	V56-L113 HydrophobicContact CG1-CD1 3.59Å; C109-L113 WeakPolarHBondContact O-CB 3.42Å; C109-L113 PolarHBondContact O-N 3.29Å; L113-T115 VanDerWaalsContact C-N 3.27Å; L113-T115 PolarHBondContact O-N 2.95Å; L113-A117 WeakPolarHBondContact O-CB 3.44Å; L113-A117 PolarHBondContact O-N 3.07Å
114	M	55.6	Low	47.1	Very low	24 Å²	24	81.9 Å²	81.9	12%	0.118	42%	0.416	C	S	.	.	H	α-helix	trans	-60.5	-34.7	171.8	-86.2	-85.3	-80.5	0	0	113	F110 E112 K118 I126 C129 Q130 I133	F110-M114 WeakPolarHBondContact O-CB 3.22Å; F110-M114 VanDerWaalsContact O-CG 3.27Å; F110-M114 WeakPolarHBondContact O-CG 3.12Å; F110-M114 PolarHBondContact O-N 3.38Å; E112-M114 PolarHBondContact O-N 2.95Å; M114-K118 WeakPolarHBondContact O-CB 3.46Å; M114-K118 WeakPolarHBondContact O-CD 3.31Å; M114-K118 VanDerWaalsContact O-CG 3.22Å; M114-K118 WeakPolarHBondContact O-CG 3.12Å; M114-K118 PolarHBondContact O-N 3.21Å; M114-K118 VanDerWaalsContact O-N 3.14Å; M114-I126 HydrophobicContact SD-CG2 4.37Å; M114-C129 HydrophobicContact CG-CB 3.55Å; M114-C129 HydrophobicContact SD-CB 3.5Å; M114-C129 VanDerWaalsContact SD-CB 3.5Å; M114-Q130 HydrophobicContact CE-CG 3.63Å; M114-Q130 HydrophobicContact SD-CG 4.01Å; M114-I133 HydrophobicContact CE-CD1 4.22Å; M114-I133 HydrophobicContact CG-CD1 3.91Å; M114-I133 HydrophobicContact SD-CD1 4.45Å
115	T	49.8	Very low	47.8	Very low	68 Å²	68	76.4 Å²	76.4	42%	0.417	38%	0.383	S	S	.	.	H	α-helix	trans	-76.2	-46.8	-178.9	-61.7	0	0	0	0	110.3	P111 E112 L113 A117 K118 F119	P111-T115 WeakPolarHBondContact O-CB 3.18Å; P111-T115 PolarHBondContact O-N 3.13Å; P111-T115 VanDerWaalsContact O-N 3.08Å; P111-T115 PolarHBondContact O-OG1 3.06Å; E112-T115 WeakPolarHBondContact O-CA 3.43Å; E112-T115 WeakPolarHBondContact O-CB 3.44Å; E112-T115 PolarHBondContact O-N 3.02Å; L113-T115 VanDerWaalsContact C-N 3.27Å; L113-T115 PolarHBondContact O-N 2.95Å; T115-A117 PolarHBondContact O-N 2.94Å; T115-K118 PolarHBondContact O-N 3.48Å; T115-F119 HydrophobicContact CG2-CD2 3.87Å; T115-F119 HydrophobicContact CG2-CE2 3.61Å; T115-F119 VanDerWaalsContact O-CD2 3.26Å; T115-F119 WeakPolarHBondContact O-CD2 3.14Å; T115-F119 PolarHBondContact O-N 2.87Å
116	A	47.4	Very low	48.6	Very low	38 Å²	38	75.5 Å²	75.5	31%	0.314	38%	0.376	S	S	.	.	H	α-helix	trans	-58.4	-45.7	172.5	0	0	0	0	0	112	E112 K118 F119 L120	E112-A116 PolarHBondContact O-N 3.26Å; A116-K118 VanDerWaalsContact C-N 3.3Å; A116-K118 PolarHBondContact O-N 3.07Å; A116-F119 PolarHBondContact O-N 2.8Å; A116-L120 WeakPolarHBondContact O-CG 3.4Å; A116-L120 PolarHBondContact O-N 3.25Å
117	A	53.5	Low	49.4	Very low	4 Å²	4	73.5 Å²	73.5	3%	0.033	37%	0.373	C	S	.	.	H	α-helix	trans	-61.5	-35.1	177.1	0	0	0	0	0	113.1	L113 T115 L121 M122 V125 I126	L113-A117 WeakPolarHBondContact O-CB 3.44Å; L113-A117 PolarHBondContact O-N 3.07Å; T115-A117 PolarHBondContact O-N 2.94Å; A117-L121 PolarHBondContact O-N 3.36Å; A117-M122 HydrophobicContact CB-CB 4.48Å; A117-M122 PolarHBondContact O-N 3.36Å; A117-V125 HydrophobicContact CB-CB 3.88Å; A117-V125 HydrophobicContact CB-CG1 3.84Å; A117-I126 HydrophobicContact CB-CG1 3.83Å
118	K	51.9	Low	49.8	Very low	113 Å²	113	72.3 Å²	72.3	49%	0.491	37%	0.366	S	S	.	.	H	α-helix	trans	-68.1	-45.5	172.9	-77.8	170.3	-179.4	-177.5	0	112.4	M114 T115 A116 L120 L121 I126	M114-K118 WeakPolarHBondContact O-CB 3.46Å; M114-K118 WeakPolarHBondContact O-CD 3.31Å; M114-K118 VanDerWaalsContact O-CG 3.22Å; M114-K118 WeakPolarHBondContact O-CG 3.12Å; M114-K118 PolarHBondContact O-N 3.21Å; M114-K118 VanDerWaalsContact O-N 3.14Å; T115-K118 PolarHBondContact O-N 3.48Å; A116-K118 VanDerWaalsContact C-N 3.3Å; A116-K118 PolarHBondContact O-N 3.07Å; K118-L120 PolarHBondContact O-N 3.06Å; K118-L121 PolarHBondContact O-N 3.46Å; K118-I126 HydrophobicContact CB-CD1 4.47Å; K118-I126 HydrophobicContact CG-CD1 3.88Å; K118-I126 HydrophobicContact CG-CG1 4.2Å
119	F	45.8	Very low	50.4	Low	126 Å²	126	66.3 Å²	66.3	55%	0.553	34%	0.338	S	S	*	.	H	α-helix	trans	-60.7	-34.5	176.9	-83.1	-65	0	0	0	112.5	T115 A116 L121	T115-F119 HydrophobicContact CG2-CD2 3.87Å; T115-F119 HydrophobicContact CG2-CE2 3.61Å; T115-F119 VanDerWaalsContact O-CD2 3.26Å; T115-F119 WeakPolarHBondContact O-CD2 3.14Å; T115-F119 PolarHBondContact O-N 2.87Å; A116-F119 PolarHBondContact O-N 2.8Å; F119-L121 VanDerWaalsContact C-N 3.33Å
120	L	44.9	Very low	50.9	Low	100 Å²	100	68.7 Å²	68.7	52%	0.524	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	5.2	177	-62.6	172.2	0	0	0	113.7	V56 A116 K118 M122	V56-L120 HydrophobicContact CG2-CD1 4.34Å; A116-L120 WeakPolarHBondContact O-CG 3.4Å; A116-L120 PolarHBondContact O-N 3.25Å; K118-L120 PolarHBondContact O-N 3.06Å; L120-M122 HydrophobicContact CB-CG 3.59Å; L120-M122 HydrophobicContact CB-SD 3.35Å; L120-M122 WeakPolarHBondContact CB-SD 3.47Å; L120-M122 HydrophobicContact CD1-SD 3.53Å; L120-M122 VanDerWaalsContact CD1-SD 3.53Å; L120-M122 HydrophobicContact CG-SD 4.08Å; L120-M122 WeakPolarHBondContact O-CG 3.3Å; L120-M122 PolarHBondContact O-N 2.56Å
121	L	46.9	Very low	50.8	Low	151 Å²	151	71 Å²	71	79%	0.791	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	24.1	-178.1	-56.9	175.6	0	0	0	115.1	A117 K118 F119 R123	A117-L121 PolarHBondContact O-N 3.36Å; K118-L121 PolarHBondContact O-N 3.46Å; F119-L121 VanDerWaalsContact C-N 3.33Å; L121-R123 VanDerWaalsContact C-N 3.34Å; L121-R123 PolarHBondContact O-N 3.47Å
122	M	46.9	Very low	50.8	Low	25 Å²	25	70.7 Å²	70.7	12%	0.123	35%	0.352	C	S	.	.			trans	-82.1	73.1	-169	-62.8	168.4	68.3	0	0	112.5	A52 H53 A117 L120 S124 V125 I126	A52-M122 HydrophobicContact CB-CE 3.64Å; A52-M122 HydrophobicContact CB-SD 3.94Å; H53-M122 HydrophobicContact CB-CE 3.71Å; A117-M122 HydrophobicContact CB-CB 4.48Å; A117-M122 PolarHBondContact O-N 3.36Å; L120-M122 HydrophobicContact CB-CG 3.59Å; L120-M122 HydrophobicContact CB-SD 3.35Å; L120-M122 WeakPolarHBondContact CB-SD 3.47Å; L120-M122 HydrophobicContact CD1-SD 3.53Å; L120-M122 VanDerWaalsContact CD1-SD 3.53Å; L120-M122 HydrophobicContact CG-SD 4.08Å; L120-M122 WeakPolarHBondContact O-CG 3.3Å; L120-M122 PolarHBondContact O-N 2.56Å; M122-S124 VanDerWaalsContact C-N 3.31Å; M122-S124 PolarHBondContact O-N 3.12Å; M122-S124 VanDerWaalsContact O-N 3.11Å; M122-V125 HydrophobicContact CB-CB 4.29Å; M122-V125 HydrophobicContact CB-CG2 3.95Å; M122-V125 HydrophobicContact CE-CG2 3.77Å; M122-V125 PolarHBondContact O-N 3.17Å; M122-I126 WeakPolarHBondContact O-CG1 3.42Å; M122-I126 PolarHBondContact O-N 3.03Å; M122-I126 VanDerWaalsContact O-N 3.15Å
123	R	45	Very low	51.2	Low	182 Å²	182	68.1 Å²	68.1	69%	0.687	34%	0.342	S	S	*	.	H	α-helix	trans	-43.9	-46.5	-173.8	-175.6	172.4	178.8	160.9	2	115.1	L121 V125 I126 E127	L121-R123 VanDerWaalsContact C-N 3.34Å; L121-R123 PolarHBondContact O-N 3.47Å; R123-V125 PolarHBondContact O-N 2.87Å; R123-I126 WeakPolarHBondContact O-CB 3.46Å; R123-I126 PolarHBondContact O-N 3.13Å; R123-E127 HydrophobicContact CG-CG 4.44Å; R123-E127 WeakPolarHBondContact CG-OE1 3.41Å; R123-E127 IonicContact CZ-OE1 3.57Å; R123-E127 IonicContact NE-OE1 3.59Å; R123-E127 PolarHBondContact NE-OE1 3.04Å; R123-E127 IonicContact NH2-OE1 2.85Å; R123-E127 PolarHBondContact NH2-OE1 3.2Å; R123-E127 WeakPolarHBondContact O-CG 3.47Å; R123-E127 PolarHBondContact O-N 3.2Å
124	S	45.1	Very low	51.4	Low	57 Å²	57	74 Å²	74	40%	0.399	37%	0.367	S	S	.	.	H	α-helix	trans	-64.6	-36	-179.3	52.7	0	0	0	0	113.4	M122 E127 I128	M122-S124 VanDerWaalsContact C-N 3.31Å; M122-S124 PolarHBondContact O-N 3.12Å; M122-S124 VanDerWaalsContact O-N 3.11Å; S124-E127 PolarHBondContact O-N 2.71Å; S124-I128 WeakPolarHBondContact O-CB 3.3Å; S124-I128 WeakPolarHBondContact O-CD1 3.39Å; S124-I128 WeakPolarHBondContact O-CG1 3.23Å; S124-I128 PolarHBondContact O-N 2.97Å
125	V	48.8	Very low	50.8	Low	6 Å²	6	79.5 Å²	79.5	4%	0.036	39%	0.392	C	S	.	.	H	α-helix	trans	-71.2	-38.7	176	-168.6	0	0	0	0	110.7	H53 A117 M122 R123 I128 C129	H53-V125 HydrophobicContact CB-CG2 3.99Å; H53-V125 WeakPolarHBondContact CD2-CG2 3.49Å; H53-V125 VanDerWaalsContact CG-CG2 3.41Å; A117-V125 HydrophobicContact CB-CB 3.88Å; A117-V125 HydrophobicContact CB-CG1 3.84Å; M122-V125 HydrophobicContact CB-CB 4.29Å; M122-V125 HydrophobicContact CB-CG2 3.95Å; M122-V125 HydrophobicContact CE-CG2 3.77Å; M122-V125 PolarHBondContact O-N 3.17Å; R123-V125 PolarHBondContact O-N 2.87Å; V125-I128 PolarHBondContact O-N 3.02Å; V125-C129 VanDerWaalsContact O-CB 3.29Å; V125-C129 WeakPolarHBondContact O-CB 3.39Å; V125-C129 PolarHBondContact O-N 2.77Å; V125-C129 PolarHBondContact O-SG 3.01Å
126	I	56.9	Low	50.5	Low	28 Å²	28	78.2 Å²	78.2	14%	0.144	39%	0.385	C	S	.	.	H	α-helix	trans	-61.9	-47.1	174.7	-59.7	168.1	0	0	0	109.8	M114 A117 K118 M122 R123 C129 Q130	M114-I126 HydrophobicContact SD-CG2 4.37Å; A117-I126 HydrophobicContact CB-CG1 3.83Å; K118-I126 HydrophobicContact CB-CD1 4.47Å; K118-I126 HydrophobicContact CG-CD1 3.88Å; K118-I126 HydrophobicContact CG-CG1 4.2Å; M122-I126 WeakPolarHBondContact O-CG1 3.42Å; M122-I126 PolarHBondContact O-N 3.03Å; M122-I126 VanDerWaalsContact O-N 3.15Å; R123-I126 WeakPolarHBondContact O-CB 3.46Å; R123-I126 PolarHBondContact O-N 3.13Å; I126-C129 PolarHBondContact O-N 3.07Å; I126-Q130 HydrophobicContact CG2-CG 4.38Å; I126-Q130 VanDerWaalsContact O-CB 3.28Å; I126-Q130 WeakPolarHBondContact O-CB 3.32Å; I126-Q130 WeakPolarHBondContact O-CG 3.48Å; I126-Q130 PolarHBondContact O-N 3.34Å
127	E	53.7	Low	50.1	Low	97 Å²	97	83.4 Å²	83.4	45%	0.453	41%	0.408	S	S	.	.	H	α-helix	trans	-65.3	-42.5	178.7	-72.7	172	-176.8	0	0	112	R123 S124 Q130 E131	R123-E127 HydrophobicContact CG-CG 4.44Å; R123-E127 WeakPolarHBondContact CG-OE1 3.41Å; R123-E127 IonicContact CZ-OE1 3.57Å; R123-E127 IonicContact NE-OE1 3.59Å; R123-E127 PolarHBondContact NE-OE1 3.04Å; R123-E127 IonicContact NH2-OE1 2.85Å; R123-E127 PolarHBondContact NH2-OE1 3.2Å; R123-E127 WeakPolarHBondContact O-CG 3.47Å; R123-E127 PolarHBondContact O-N 3.2Å; S124-E127 PolarHBondContact O-N 2.71Å; E127-Q130 PolarHBondContact O-N 3.3Å; E127-E131 WeakPolarHBondContact O-CB 3.46Å; E127-E131 PolarHBondContact O-N 2.97Å
128	I	54.5	Low	48.9	Very low	90 Å²	90	88.4 Å²	88.4	46%	0.462	44%	0.438	S	S	.	.	H	α-helix	trans	-62	-49.1	174.2	-71.2	163.7	0	0	0	111.1	S124 V125 Q130 E131 V132	S124-I128 WeakPolarHBondContact O-CB 3.3Å; S124-I128 WeakPolarHBondContact O-CD1 3.39Å; S124-I128 WeakPolarHBondContact O-CG1 3.23Å; S124-I128 PolarHBondContact O-N 2.97Å; V125-I128 PolarHBondContact O-N 3.02Å; I128-Q130 PolarHBondContact O-N 3.09Å; I128-E131 PolarHBondContact O-N 2.89Å; I128-V132 WeakPolarHBondContact O-CG2 3.15Å; I128-V132 PolarHBondContact O-N 3.32Å
129	C	55.8	Low	47.7	Very low	4 Å²	4	91.6 Å²	91.6	3%	0.027	46%	0.455	C	S	.	.	H	α-helix	trans	-66.7	-37.7	-179.8	-68	0	0	0	0	111.9	F110 M114 V125 I126 V132 I133	F110-C129 HydrophobicContact CD1-CB 4.31Å; M114-C129 HydrophobicContact CG-CB 3.55Å; M114-C129 HydrophobicContact SD-CB 3.5Å; M114-C129 VanDerWaalsContact SD-CB 3.5Å; V125-C129 VanDerWaalsContact O-CB 3.29Å; V125-C129 WeakPolarHBondContact O-CB 3.39Å; V125-C129 PolarHBondContact O-N 2.77Å; V125-C129 PolarHBondContact O-SG 3.01Å; I126-C129 PolarHBondContact O-N 3.07Å; C129-V132 PolarHBondContact O-N 3.16Å; C129-I133 WeakPolarHBondContact O-CB 3.41Å; C129-I133 WeakPolarHBondContact O-CD1 3.36Å; C129-I133 WeakPolarHBondContact O-CG1 3.43Å; C129-I133 PolarHBondContact O-N 2.95Å
130	Q	58.2	Low	46.7	Very low	98 Å²	98	91.9 Å²	91.9	46%	0.458	46%	0.461	S	S	.	.	H	α-helix	trans	-61.5	-44.4	172.5	-77.6	179.5	21.3	0	0	111.8	M114 I126 E127 I128 I133 K134	M114-Q130 HydrophobicContact CE-CG 3.63Å; M114-Q130 HydrophobicContact SD-CG 4.01Å; I126-Q130 HydrophobicContact CG2-CG 4.38Å; I126-Q130 VanDerWaalsContact O-CB 3.28Å; I126-Q130 WeakPolarHBondContact O-CB 3.32Å; I126-Q130 WeakPolarHBondContact O-CG 3.48Å; I126-Q130 PolarHBondContact O-N 3.34Å; E127-Q130 PolarHBondContact O-N 3.3Å; I128-Q130 PolarHBondContact O-N 3.09Å; Q130-I133 PolarHBondContact O-N 3.01Å; Q130-K134 WeakPolarHBondContact O-CB 3.43Å; Q130-K134 PolarHBondContact O-N 2.65Å
131	E	53.6	Low	45.7	Very low	71 Å²	71	94.7 Å²	94.7	33%	0.332	48%	0.475	S	S	.	.	H	α-helix	trans	-67.8	-38.5	178.4	-172.7	57.1	-146.5	0	0	111.7	E127 I128 K134 Q135	E127-E131 WeakPolarHBondContact O-CB 3.46Å; E127-E131 PolarHBondContact O-N 2.97Å; I128-E131 PolarHBondContact O-N 2.89Å; E131-K134 PolarHBondContact O-N 2.87Å; E131-K134 WeakPolarHBondContact OE2-CD 3.39Å; E131-K134 VanDerWaalsContact OE2-CE 3.29Å; E131-K134 WeakPolarHBondContact OE2-CE 3.43Å; E131-K134 IonicContact OE2-NZ 2.8Å; E131-K134 PolarHBondContact OE2-NZ 2.78Å; E131-Q135 WeakPolarHBondContact O-CB 3.14Å; E131-Q135 VanDerWaalsContact O-CG 3.32Å; E131-Q135 WeakPolarHBondContact O-CG 3.32Å; E131-Q135 PolarHBondContact O-N 3.42Å; E131-Q135 PolarHBondContact OE1-NE2 2.84Å
132	V	51.2	Low	44.9	Very low	58 Å²	58	92.7 Å²	92.7	35%	0.352	47%	0.469	S	S	.	.	H	α-helix	trans	-65.9	-41	173.8	174.2	0	0	0	0	111.6	F110 I128 C129 Q135 S136	F110-V132 HydrophobicContact CD1-CG1 4.27Å; F110-V132 HydrophobicContact CE1-CB 3.88Å; F110-V132 HydrophobicContact CE1-CG1 3.47Å; F110-V132 VanDerWaalsContact CE1-CG1 3.47Å; F110-V132 HydrophobicContact CZ-CB 4.49Å; F110-V132 HydrophobicContact CZ-CG1 3.65Å; I128-V132 WeakPolarHBondContact O-CG2 3.15Å; I128-V132 PolarHBondContact O-N 3.32Å; C129-V132 PolarHBondContact O-N 3.16Å; V132-Q135 PolarHBondContact O-N 3.18Å; V132-S136 WeakPolarHBondContact O-CB 3.44Å; V132-S136 PolarHBondContact O-N 3.41Å; V132-S136 PolarHBondContact O-OG 3.09Å
133	I	57	Low	44.1	Very low	69 Å²	69	96.9 Å²	96.9	35%	0.354	50%	0.498	S	S	.	.	H	α-helix	trans	-62.8	-42.8	173.4	-71.3	164.3	0	0	0	110.7	F110 M114 C129 Q130 Q135 S136	F110-I133 HydrophobicContact CB-CD1 4.4Å; F110-I133 HydrophobicContact CB-CG1 4.42Å; F110-I133 HydrophobicContact CD1-CG1 4.46Å; M114-I133 HydrophobicContact CE-CD1 4.22Å; M114-I133 HydrophobicContact CG-CD1 3.91Å; M114-I133 HydrophobicContact SD-CD1 4.45Å; C129-I133 WeakPolarHBondContact O-CB 3.41Å; C129-I133 WeakPolarHBondContact O-CD1 3.36Å; C129-I133 WeakPolarHBondContact O-CG1 3.43Å; C129-I133 PolarHBondContact O-N 2.95Å; Q130-I133 PolarHBondContact O-N 3.01Å; I133-Q135 VanDerWaalsContact C-N 3.33Å; I133-Q135 PolarHBondContact O-N 3.33Å; I133-S136 WeakPolarHBondContact CA-OG 3.46Å; I133-S136 CarbonylContact O-C 3.45Å; I133-S136 PolarHBondContact O-N 3.07Å; I133-S136 PolarHBondContact O-OG 3.3Å
134	K	56.6	Low	43.7	Very low	146 Å²	146	94.8 Å²	94.8	64%	0.635	51%	0.506	S	S	*	.	H	α-helix	trans	-67	-29.1	178.1	175.4	177.3	155.8	-153.2	0	113.1	Q130 E131	Q130-K134 WeakPolarHBondContact O-CB 3.43Å; Q130-K134 PolarHBondContact O-N 2.65Å; E131-K134 PolarHBondContact O-N 2.87Å; E131-K134 WeakPolarHBondContact OE2-CD 3.39Å; E131-K134 VanDerWaalsContact OE2-CE 3.29Å; E131-K134 WeakPolarHBondContact OE2-CE 3.43Å; E131-K134 IonicContact OE2-NZ 2.8Å; E131-K134 PolarHBondContact OE2-NZ 2.78Å
135	Q	43.4	Very low	43.1	Very low	139 Å²	139	98 Å²	98	65%	0.65	52%	0.523	S	S	*	.	H	α-helix	trans	-85	-31.2	172	-69.1	-177.7	26.8	0	0	113	E131 V132 I133 N137	E131-Q135 WeakPolarHBondContact O-CB 3.14Å; E131-Q135 VanDerWaalsContact O-CG 3.32Å; E131-Q135 WeakPolarHBondContact O-CG 3.32Å; E131-Q135 PolarHBondContact O-N 3.42Å; E131-Q135 PolarHBondContact OE1-NE2 2.84Å; V132-Q135 PolarHBondContact O-N 3.18Å; I133-Q135 VanDerWaalsContact C-N 3.33Å; I133-Q135 PolarHBondContact O-N 3.33Å; Q135-N137 VanDerWaalsContact C-N 3.3Å; Q135-N137 PolarHBondContact O-N 3.42Å
136	S	44	Very low	42.4	Very low	40 Å²	40	109.7 Å²	109.7	28%	0.28	57%	0.567	S	S	.	*	S	Bend	trans	-84.2	71.5	174.2	54.3	0	0	0	0	111.4	V132 I133 V138	V132-S136 WeakPolarHBondContact O-CB 3.44Å; V132-S136 PolarHBondContact O-N 3.41Å; V132-S136 PolarHBondContact O-OG 3.09Å; I133-S136 WeakPolarHBondContact CA-OG 3.46Å; I133-S136 CarbonylContact O-C 3.45Å; I133-S136 PolarHBondContact O-N 3.07Å; I133-S136 PolarHBondContact O-OG 3.3Å; S136-V138 VanDerWaalsContact C-N 3.33Å; S136-V138 PolarHBondContact O-N 3.41Å
137	N	37.6	Very low	41.2	Very low	147 Å²	147	112 Å²	112	79%	0.786	60%	0.597	S	S	*	*			trans	-63.5	75.3	-164.1	-146.4	-1.3	0	0	0	115.6	Q135	Q135-N137 VanDerWaalsContact C-N 3.3Å; Q135-N137 PolarHBondContact O-N 3.42Å
138	V	28.4	Very low	40	Very low	110 Å²	110	111 Å²	111	67%	0.667	61%	0.612	S	S	*	*			trans	-131	114.8	167.8	178	0	0	0	0	107.7	S136 I140	S136-V138 VanDerWaalsContact C-N 3.33Å; S136-V138 PolarHBondContact O-N 3.41Å; V138-I140 PolarHBondContact O-N 2.81Å
139	Q	27.3	Very low	38.8	Very low	180 Å²	180	116 Å²	116	84%	0.841	63%	0.634	S	S	*	*			trans	-73.5	99.3	175.2	-72.4	177.7	-40.7	0	0	110.1	L141	Q139-L141 PolarHBondContact O-N 2.82Å; Q139-L141 VanDerWaalsContact O-N 3.11Å
140	I	25.6	Very low	37.5	Very low	132 Å²	132	120.1 Å²	120.1	68%	0.677	67%	0.668	S	S	*	*			trans	-74	96.8	161.9	-57.9	-179.3	0	0	0	107.1	V138 V142	V138-I140 PolarHBondContact O-N 2.81Å; I140-V142 HydrophobicContact CG2-CG2 3.98Å; I140-V142 PolarHBondContact O-N 2.8Å
141	L	24.5	Very low	36.5	Very low	158 Å²	158	121.1 Å²	121.1	83%	0.827	69%	0.686	S	S	*	*			trans	-80.4	98.1	175.7	-160.4	80.9	0	0	0	108.8	Q139 P143	Q139-L141 PolarHBondContact O-N 2.82Å; Q139-L141 VanDerWaalsContact O-N 3.11Å; L141-P143 WeakPolarHBondContact O-CD 3.41Å
142	V	29.9	Very low	35.4	Very low	110 Å²	110	124.9 Å²	124.9	67%	0.667	71%	0.708	S	S	*	*			trans	-85.1	119.6	174.2	-177.2	0	0	0	0	109.2	I140 T144	I140-V142 HydrophobicContact CG2-CG2 3.98Å; I140-V142 PolarHBondContact O-N 2.8Å; V142-T144 PolarHBondContact O-N 3.06Å
143	P	28.6	Very low	34.2	Very low	112 Å²	112	131.2 Å²	131.2	73%	0.727	73%	0.731	S	S	*	*			trans	-71.2	123.6	172.9	-15.3	30.9	0	0	0	110.6	L141	L141-P143 WeakPolarHBondContact O-CD 3.41Å
144	T	36.4	Very low	32.7	Very low	139 Å²	139	136.8 Å²	136.8	85%	0.853	76%	0.755	S	S	*	*			trans	-86.7	108.5	173.1	49.7	0	0	0	0	111	V142	V142-T144 PolarHBondContact O-N 3.06Å
145	T	33.7	Very low	31.2	Very low	123 Å²	123	134.1 Å²	134.1	76%	0.755	76%	0.761	S	S	*	*			trans	-129	111.9	163.6	52	0	0	0	0	107.5
146	R	34.4	Very low	30.4	Very low	253 Å²	253	132.3 Å²	132.3	96%	0.955	77%	0.77	S	S	*	*				80	119.2	91	-172.5	-170.2	-166.4	177.7	5.5	111.1
147	G	31.3	Very low	29.5	Very low	75 Å²	75	133.9 Å²	133.9	77%	0.773	79%	0.792	S	S	*	*			cis	160.5	170.5	-2.4	0	0	0	0	0	111.1
148	G	28.1	Very low	29.1	Very low	76 Å²	76	131.5 Å²	131.5	78%	0.784	79%	0.793	S	S	*	*			trans	90.7	151.9	-178.8	0	0	0	0	0	113.7
149	E	28.6	Very low	29.1	Very low	196 Å²	196	132 Å²	132	92%	0.916	80%	0.797	S	S	*	*			cis	-149.9	-178.3	4.1	-86	-117	121	0	0	111.2
150	A	29	Very low	29.2	Very low	90 Å²	90	130.8 Å²	130.8	74%	0.744	79%	0.791	S	S	*	*			trans	71.5	102.7	163.8	0	0	0	0	0	119.1
151	S	37.3	Very low	29.3	Very low	120 Å²	120	131.4 Å²	131.4	84%	0.839	79%	0.794	S	S	*	*			trans	-96.2	132.3	151.6	-56.2	0	0	0	0	109.7
152	L	30.6	Very low	29.4	Very low	150 Å²	150	126.8 Å²	126.8	79%	0.785	79%	0.785	S	S	*	*			trans	-147.3	148.1	168.6	-84.6	-179.3	0	0	0	111.8
153	F	25	Very low	29.1	Very low	190 Å²	190	131.1 Å²	131.1	83%	0.833	80%	0.795	S	S	*	*			trans	70.5	103	170.7	-67.4	-71.9	0	0	0	120.7
154	Q	26	Very low	29.5	Very low	186 Å²	186	131 Å²	131	87%	0.869	79%	0.794	S	S	*	*			trans	-68.3	160.9	138.5	-77.5	170.6	-104.1	0	0	110.2
155	A	26.5	Very low	29.2	Very low	91 Å²	91	131.5 Å²	131.5	75%	0.752	80%	0.797	S	S	*	*			cis	-167.1	-140.8	-16	0	0	0	0	0	105.6
156	A	25.5	Very low	29.2	Very low	101 Å²	101	129.5 Å²	129.5	84%	0.835	79%	0.793	S	S	*	*			cis	-165.7	159.1	-0.9	0	0	0	0	0	109.2
157	G	25.6	Very low	30	Very low	73 Å²	73	123.4 Å²	123.4	75%	0.753	79%	0.786	S	S	*	*			trans	140.4	126.2	157.4	0	0	0	0	0	116.8
158	A	28.4	Very low	31.1	Very low	97 Å²	97	124.8 Å²	124.8	80%	0.802	78%	0.782	S	S	*	*			trans	58.2	139.8	148.3	0	0	0	0	0	119.8
159	T	28.6	Very low	31	Very low	121 Å²	121	129 Å²	129	74%	0.742	78%	0.781	S	S	*	*			cis	-169.4	156.3	-4.9	11.7	0	0	0	0	108.2
160	E	29.5	Very low	31.2	Very low	153 Å²	153	126.5 Å²	126.5	72%	0.715	77%	0.773	S	S	*	*			trans	47.6	135.1	151.8	-54.9	-45.2	81.6	0	0	120.5
161	L	28.6	Very low	31.3	Very low	145 Å²	145	127.9 Å²	127.9	76%	0.759	77%	0.772	S	S	*	*			cis	-159.8	177.3	4.9	-106	163.8	0	0	0	110.6
162	G	24.8	Very low	31	Very low	61 Å²	61	130 Å²	130	63%	0.629	77%	0.774	S	S	*	*			trans	-61	-170.8	-174.3	0	0	0	0	0	119.1
163	F	24.4	Very low	31	Very low	202 Å²	202	125.4 Å²	125.4	89%	0.886	76%	0.762	S	S	*	*			cis	-146.3	173.5	33.4	-83.6	-96.8	0	0	0	114.7
164	P	36.8	Very low	31.2	Very low	108 Å²	108	123.9 Å²	123.9	70%	0.701	77%	0.769	S	S	*	*			trans	-122	150.7	-175.1	40.4	-27.4	0	0	0	118.3
165	V	31.1	Very low	31.3	Very low	150 Å²	150	118.3 Å²	118.3	91%	0.909	76%	0.762	S	S	*	*			trans	54.5	145.9	137.8	-172.2	0	0	0	0	122.7
166	A	32.3	Very low	31.5	Very low	82 Å²	82	121.7 Å²	121.7	68%	0.678	77%	0.765	S	S	*	*			trans	-98.1	-163.3	-174.1	0	0	0	0	0	114.3
167	P	52.8	Low	31.6	Very low	124 Å²	124	124.8 Å²	124.8	81%	0.805	77%	0.767	S	S	*	*			cis	-133.2	-99.9	-0.8	25.9	4.1	0	0	0	120.3
168	P	53.1	Low	31.9	Very low	105 Å²	105	128.4 Å²	128.4	68%	0.682	77%	0.768	S	S	*	*			trans	-144.5	-169.5	-135.9	47.6	-25.8	0	0	0	121.2
169	E	26.8	Very low	32	Very low	163 Å²	163	131.1 Å²	131.1	76%	0.762	77%	0.769	S	S	*	*			trans	92.8	145.1	149	-81.6	-68.4	103.1	0	0	125.2
170	L	32.4	Very low	32	Very low	144 Å²	144	128.4 Å²	128.4	75%	0.754	77%	0.765	S	S	*	*			trans	93.2	89.9	151.7	-76.5	161.1	0	0	0	126.5
171	V	31.3	Very low	32.2	Very low	119 Å²	119	130.5 Å²	130.5	72%	0.721	78%	0.775	S	S	*	*				44.7	119.7	119.2	-178.2	0	0	0	0	124.6
172	N	30.4	Very low	32.1	Very low	166 Å²	166	127.3 Å²	127.3	89%	0.888	78%	0.777	S	S	*	*				175.3	158	122.8	-106.4	-33.5	0	0	0	111.4
173	G	30.1	Very low	32.2	Very low	52 Å²	52	133.8 Å²	133.8	54%	0.536	79%	0.788	S	S	.	*			cis	169.9	150.8	-9	0	0	0	0	0	113.5
174	T	30.6	Very low	32.4	Very low	159 Å²	159	130.1 Å²	130.1	98%	0.975	78%	0.782	S	S	*	*			trans	66.9	144.5	170.2	63.1	0	0	0	0	120.7
175	G	27.5	Very low	32.1	Very low	69 Å²	69	131.6 Å²	131.6	71%	0.711	78%	0.784	S	S	*	*			cis	167.2	165.9	-11.6	0	0	0	0	0	117.5
176	I	30.8	Very low	31.9	Very low	161 Å²	161	131 Å²	131	83%	0.826	78%	0.776	S	S	*	*			trans	76.4	116	156.4	-55.7	177.8	0	0	0	121
177	L	28.6	Very low	31.7	Very low	166 Å²	166	132.3 Å²	132.3	87%	0.869	78%	0.776	S	S	*	*				-157.3	162.9	119.5	-110.2	174	0	0	0	111.8
178	L	30.5	Very low	30.5	Very low	150 Å²	150	134 Å²	134	79%	0.785	77%	0.773	S	S	*	*			trans	-106.2	171.8	-176.4	-57.8	148.4	0	0	0	109.6
179	N	31.8	Very low	29.1	Very low	153 Å²	153	136.7 Å²	136.7	82%	0.818	78%	0.779	S	S	*	*			cis	-161.5	173.4	5.5	-151.1	2.5	0	0	0	110.2
180	G	27.6	Very low	29.1	Very low	64 Å²	64	136.6 Å²	136.6	66%	0.66	78%	0.778	S	S	*	*			trans	126.9	143.6	154.3	0	0	0	0	0	117.9
181	Q	33	Very low	28.8	Very low	197 Å²	197	136.1 Å²	136.1	92%	0.921	78%	0.775	S	S	*	*			trans	-117.5	158.1	-174.6	-56.8	122.2	-76.4	0	0	113.7
182	G	27.7	Very low	28.5	Very low	78 Å²	78	135.8 Å²	135.8	80%	0.804	77%	0.769	S	S	*	*			trans	-173.3	149.4	167.8	0	0	0	0	0	112
183	F	26.6	Very low	28.3	Very low	197 Å²	197	135.4 Å²	135.4	86%	0.864	76%	0.762	S	S	*	*			trans	-138	150	-172.7	-120.3	-73.3	0	0	0	111.7
184	V	29.5	Very low	28.1	Very low	125 Å²	125	138.3 Å²	138.3	76%	0.758	77%	0.774	S	S	*	*			trans	60.1	148.3	169.6	-54.2	0	0	0	0	116.9
185	N	28.9	Very low	27.8	Very low	140 Å²	140	134 Å²	134	75%	0.749	76%	0.761	S	S	*	*			cis	-160.6	148	17.3	-143.7	-2.4	0	0	0	114.9
186	N	27.3	Very low	27.7	Very low	137 Å²	137	138.4 Å²	138.4	73%	0.733	77%	0.769	S	S	*	*			trans	74.8	153.3	140.3	-138.6	8.5	0	0	0	125
187	T	28.3	Very low	27.5	Very low	110 Å²	110	136.7 Å²	136.7	68%	0.675	77%	0.766	S	S	*	*			trans	75.1	93.6	156.7	26.5	0	0	0	0	123.1
188	Q	27.1	Very low	27.9	Very low	158 Å²	158	134.1 Å²	134.1	74%	0.738	76%	0.759	S	S	*	*				71.3	142.8	114.1	-152.2	77.6	12.6	0	0	122.3
189	M	25.3	Very low	27.7	Very low	163 Å²	163	131.4 Å²	131.4	80%	0.803	76%	0.758	S	S	*	*			trans	77.6	158.4	167.9	-49.8	-57.4	-159.3	0	0	117.3
190	H	26.9	Very low	27.4	Very low	161 Å²	161	129.8 Å²	129.8	75%	0.745	75%	0.754	S	S	*	*			cis	-170.8	164.7	-39	-171.5	-110.6	0	0	0	109.1
191	L	25.5	Very low	27.3	Very low	133 Å²	133	133.8 Å²	133.8	70%	0.696	76%	0.759	S	S	*	*			trans	83.4	111	158.5	-142.7	72.6	0	0	0	120.4
192	D	24.5	Very low	27.2	Very low	113 Å²	113	130.2 Å²	130.2	60%	0.604	75%	0.746	S	S	*	*			trans	50.3	148.1	139	-73.4	-103.8	0	0	0	128.7
193	Q	26.8	Very low	27.2	Very low	158 Å²	158	134 Å²	134	74%	0.738	74%	0.742	S	S	*	*			trans	63.3	114.6	143	-71.5	161.4	52.1	0	0	118.7
194	S	25.5	Very low	27.2	Very low	113 Å²	113	132.3 Å²	132.3	79%	0.79	74%	0.742	S	S	*	*			cis	91	122.2	49.7	74	0	0	0	0	113.6
195	G	24.9	Very low	27.1	Very low	68 Å²	68	129.6 Å²	129.6	70%	0.701	74%	0.74	S	S	*	*			trans	168.6	81.8	176.4	0	0	0	0	0	115.5
196	D	24.7	Very low	26.8	Very low	162 Å²	162	129 Å²	129	87%	0.866	75%	0.745	S	S	*	*			trans	59.1	176.1	144.7	-65.1	-58.1	0	0	0	123.6
197	T	25.9	Very low	26.6	Very low	124 Å²	124	130.8 Å²	130.8	76%	0.761	75%	0.749	S	S	*	*			trans	-120.3	-171.2	-169.6	57.9	0	0	0	0	108.3
198	P	37.2	Very low	26.6	Very low	112 Å²	112	130.6 Å²	130.6	73%	0.727	75%	0.752	S	S	*	*			cis	-151	160.4	18	43.3	-21	0	0	0	121.8
199	A	26.1	Very low	26.5	Very low	93 Å²	93	128 Å²	128	77%	0.769	75%	0.752	S	S	*	*			trans	65.2	171.2	136.1	0	0	0	0	0	124.4
200	V	25.3	Very low	26.6	Very low	120 Å²	120	126.4 Å²	126.4	73%	0.727	75%	0.751	S	S	*	*			trans	106.5	98.9	150.9	-173.8	0	0	0	0	120.7
201	L	26.9	Very low	26.8	Very low	147 Å²	147	124.3 Å²	124.3	77%	0.77	75%	0.752	S	S	*	*			trans	69.5	160.8	138.3	-58.1	-179.8	0	0	0	121.4
202	L	29.7	Very low	26.8	Very low	122 Å²	122	125.6 Å²	125.6	64%	0.639	76%	0.756	S	S	*	*			cis	-167.3	159.7	-6.4	-110.5	168.6	0	0	0	113.4
203	E	28.2	Very low	26.8	Very low	157 Å²	157	127.3 Å²	127.3	73%	0.734	76%	0.764	S	S	*	*			trans	40.8	175.6	159.6	-35.1	-61.2	45.5	0	0	122.4
204	D	26.1	Very low	26.7	Very low	162 Å²	162	127.9 Å²	127.9	87%	0.866	77%	0.767	S	S	*	*			cis	-160.5	173.1	0.5	-148.5	-32.6	0	0	0	112.1
205	G	27.3	Very low	27.6	Very low	69 Å²	69	127.5 Å²	127.5	71%	0.711	76%	0.762	S	S	*	*			trans	132.1	145.7	157.1	0	0	0	0	0	119.8
206	C	23.3	Very low	27.8	Very low	127 Å²	127	129.8 Å²	129.8	86%	0.858	76%	0.762	S	S	*	*			trans	-152.4	165.2	-172.4	-171.8	0	0	0	0	114.1
207	E	24.2	Very low	27.9	Very low	175 Å²	175	131.1 Å²	131.1	82%	0.818	76%	0.763	S	S	*	*			trans	162.3	148.2	136.5	-88.2	-91	69.1	0	0	117.4
208	S	26.4	Very low	28	Very low	105 Å²	105	128.5 Å²	128.5	73%	0.734	76%	0.76	S	S	*	*			trans	67.8	172.3	164.1	-122.3	0	0	0	0	119
209	S	24.9	Very low	27.4	Very low	104 Å²	104	131.5 Å²	131.5	73%	0.727	77%	0.769	S	S	*	*			cis	-158.8	-174.4	0.6	-134.9	0	0	0	0	113.7
210	V	27.3	Very low	27.3	Very low	129 Å²	129	131.2 Å²	131.2	78%	0.782	76%	0.762	S	S	*	*			trans	-147	166.9	-179.1	-133.4	0	0	0	0	112.7
211	P	33	Very low	27.4	Very low	118 Å²	118	133.7 Å²	133.7	77%	0.766	77%	0.767	S	S	*	*				-137.3	161	70	24	0.3	0	0	0	115.1
212	M	23.8	Very low	27.4	Very low	160 Å²	160	132 Å²	132	79%	0.788	77%	0.768	S	S	*	*				73.5	125.3	60	-133.6	-165.5	-179.7	0	0	114
213	L	26.3	Very low	28.1	Very low	149 Å²	149	131.5 Å²	131.5	78%	0.78	77%	0.772	S	S	*	*				-161.9	176.5	60.9	-90.3	160.5	0	0	0	115
214	E	23.5	Very low	28.2	Very low	170 Å²	170	129.4 Å²	129.4	79%	0.794	77%	0.774	S	S	*	*			trans	-110.1	-149.6	-175	-40.3	176.5	96	0	0	113.9
215	P	44.4	Very low	28.5	Very low	104 Å²	104	126.1 Å²	126.1	68%	0.675	77%	0.77	S	S	*	*			cis	-139.2	-169.7	-23.2	26.4	-1.1	0	0	0	116.3
216	V	29.1	Very low	28.5	Very low	116 Å²	116	131.4 Å²	131.4	70%	0.703	78%	0.776	S	S	*	*			trans	128.5	116.7	140.5	179.7	0	0	0	0	119.2
217	E	27.7	Very low	28.9	Very low	191 Å²	191	132 Å²	132	89%	0.893	77%	0.769	S	S	*	*			trans	21.9	154.6	142.7	-50.7	177.2	141.3	0	0	123.6
218	G	27.5	Very low	29.1	Very low	68 Å²	68	130.5 Å²	130.5	70%	0.701	77%	0.772	S	S	*	*			cis	162.6	151.2	-7.9	0	0	0	0	0	115.3
219	L	25	Very low	29.1	Very low	175 Å²	175	128.8 Å²	128.8	92%	0.916	77%	0.772	S	S	*	*			trans	59.9	160.5	161.1	-55.6	-179	0	0	0	120.2
220	S	24.4	Very low	29.4	Very low	87 Å²	87	129.6 Å²	129.6	61%	0.608	78%	0.777	S	S	*	*			cis	-169.1	172.4	-29.4	62.4	0	0	0	0	112.6
221	M	26.4	Very low	29.5	Very low	173 Å²	173	130.9 Å²	130.9	85%	0.852	78%	0.777	S	S	*	*			trans	83.2	162.2	160.4	-61.7	-59.5	122.4	0	0	123.1
222	S	27	Very low	29.3	Very low	112 Å²	112	133.7 Å²	133.7	78%	0.783	78%	0.777	S	S	*	*			trans	-130.4	-161.5	-172.2	-51	0	0	0	0	109.7
223	P	44.8	Very low	29.7	Very low	110 Å²	110	132.9 Å²	132.9	71%	0.714	77%	0.771	S	S	*	*			cis	-147.6	-177.1	-1.6	45.8	-25.8	0	0	0	119.2
224	S	30.3	Very low	29.9	Very low	113 Å²	113	133 Å²	133	79%	0.79	77%	0.767	S	S	*	*			trans	84.9	149.7	138.3	-72.4	0	0	0	0	126.8
225	A	31.3	Very low	30	Very low	94 Å²	94	131.2 Å²	131.2	78%	0.777	76%	0.763	S	S	*	*			trans	82	149.6	152.4	0	0	0	0	0	121.9
226	E	28.2	Very low	29.2	Very low	179 Å²	179	130.8 Å²	130.8	84%	0.836	77%	0.769	S	S	*	*			cis	-174.1	-178	-29.6	-96.2	-125.1	124.8	0	0	110.8
227	I	31.2	Very low	29	Very low	140 Å²	140	128.8 Å²	128.8	72%	0.718	77%	0.771	S	S	*	*			trans	95.1	110	151.2	-51.6	-163.1	0	0	0	122.5
228	T	28.3	Very low	29.1	Very low	143 Å²	143	125.6 Å²	125.6	88%	0.877	77%	0.77	S	S	*	*			trans	36.6	168.1	143.1	75.3	0	0	0	0	124
229	G	27.8	Very low	29.7	Very low	70 Å²	70	128.8 Å²	128.8	72%	0.722	78%	0.778	S	S	*	*			cis	-167.2	-168.3	7.6	0	0	0	0	0	114.9
230	S	29.8	Very low	29.8	Very low	120 Å²	120	124.2 Å²	124.2	84%	0.839	77%	0.773	S	S	*	*			trans	-131.2	-172.3	-155.8	-51.2	0	0	0	0	118.3
231	M	29.1	Very low	30.2	Very low	157 Å²	157	125.9 Å²	125.9	77%	0.773	79%	0.785	S	S	*	*			trans	97.3	159.9	173.5	-61	-173.2	177.3	0	0	116.5
232	F	29.8	Very low	30.4	Very low	176 Å²	176	127.9 Å²	127.9	77%	0.772	79%	0.789	S	S	*	*			cis	-173.6	175.9	-14.6	-99.4	-3.4	0	0	0	108.6
233	H	31.6	Very low	30.5	Very low	143 Å²	143	134.7 Å²	134.7	66%	0.662	80%	0.797	S	S	*	*			cis	-170.9	176.1	-32.8	-164.1	-114.9	0	0	0	110
234	H	30.4	Very low	29.7	Very low	151 Å²	151	133 Å²	133	70%	0.699	80%	0.799	S	S	*	*			trans	66.7	159	168.8	-72.1	-60.6	0	0	0	120.1
235	D	25.7	Very low	29.9	Very low	134 Å²	134	140.1 Å²	140.1	72%	0.717	81%	0.809	S	S	*	*			cis	-162.6	169.9	-31.1	-139.8	-62.2	0	0	0	112.9
236	A	28.5	Very low	29.7	Very low	95 Å²	95	139 Å²	139	79%	0.785	81%	0.806	S	S	*	*			trans	45.3	139.6	157.1	0	0	0	0	0	125.4
237	G	24.9	Very low	30.2	Very low	73 Å²	73	142 Å²	142	75%	0.753	81%	0.81	S	S	*	*			trans	154.1	136.2	153.9	0	0	0	0	0	119.9
238	S	29.5	Very low	30.2	Very low	124 Å²	124	141.1 Å²	141.1	87%	0.867	81%	0.813	S	S	*	*			trans	-172.5	161.1	168.5	-84.6	0	0	0	0	109.5
239	P	40.5	Very low	30.3	Very low	135 Å²	135	143.2 Å²	143.2	88%	0.877	81%	0.81	S	S	*	*			cis	-141.6	-171.2	27.7	43.5	-24.1	0	0	0	116.3
240	G	25.9	Very low	30.3	Very low	79 Å²	79	147.4 Å²	147.4	81%	0.814	81%	0.808	S	S	*	*			trans	159.1	135.6	161.3	0	0	0	0	0	117.4
241	S	32.6	Very low	29.9	Very low	122 Å²	122	148.9 Å²	148.9	85%	0.853	80%	0.802	S	S	*	*			trans	-99.3	137.5	-173.4	-67.4	0	0	0	0	115.7
242	K	30.7	Very low	30	Very low	216 Å²	216	145.3 Å²	145.3	94%	0.939	80%	0.797	S	S	*	*			trans	-165.1	170	143.6	-108.3	152.8	-170.1	173.7	0	113.3
243	R	28.8	Very low	29.7	Very low	255 Å²	255	143.8 Å²	143.8	96%	0.962	80%	0.802	S	S	*	*			trans	-91.2	140.5	-164.4	-55.7	173.6	-173.2	160.7	2.1	113
244	G	28.8	Very low	29.5	Very low	73 Å²	73	144.2 Å²	144.2	75%	0.753	80%	0.804	S	S	*	*			trans	174.8	118.3	161.7	0	0	0	0	0	113.8	G246	G244-G246 PolarHBondContact O-N 3.44Å
245	R	34.3	Very low	29.2	Very low	264 Å²	264	146.8 Å²	146.8	100%	0.996	81%	0.814	S	S	*	*			trans	-82.5	67.3	170.4	-80.3	-167.4	175	-168.2	-0.1	110.9
246	G	26.6	Very low	29.1	Very low	69 Å²	69	145.6 Å²	145.6	71%	0.711	81%	0.808	S	S	*	*			trans	-75.5	143.5	167.2	0	0	0	0	0	111.3	G244	G244-G246 PolarHBondContact O-N 3.44Å
247	R	39.9	Very low	29	Very low	243 Å²	243	150.2 Å²	150.2	92%	0.917	81%	0.813	S	S	*	*			trans	-111.5	106.4	170.8	175.7	-172.2	176.7	-176.9	2.5	108.9
248	P	30.5	Very low	29.2	Very low	121 Å²	121	152.2 Å²	152.2	79%	0.786	81%	0.805	S	S	*	*			trans	-71.5	172.6	171.1	-17.4	32.6	0	0	0	112.7
249	K	29.9	Very low	29	Very low	187 Å²	187	154 Å²	154	81%	0.813	81%	0.805	S	S	*	*			trans	-151.6	155.5	-176.4	-166	-171.7	-178.1	-173.9	0	107
250	K	27.8	Very low	28.6	Very low	158 Å²	158	154.3 Å²	154.3	69%	0.687	79%	0.794	S	S	*	*			trans	67.8	165.8	176.5	-68.1	159.5	138.6	-85.1	0	113.5
251	E	22.9	Very low	28.9	Very low	151 Å²	151	160.3 Å²	160.3	71%	0.706	80%	0.798	S	S	*	*			cis	-130.4	-177.9	6.2	-153	73.2	-93.1	0	0	110.6
252	A	29.9	Very low	29	Very low	82 Å²	82	161.7 Å²	161.7	68%	0.678	80%	0.796	S	S	*	*			trans	-106.8	158	178.2	0	0	0	0	0	112
253	V	23.8	Very low	29.7	Very low	144 Å²	144	158.9 Å²	158.9	87%	0.873	79%	0.791	S	S	*	*			trans	-131.8	127.9	167.8	-179.5	0	0	0	0	108.2
254	H	27.2	Very low	30.9	Very low	153 Å²	153	149.2 Å²	149.2	71%	0.708	77%	0.771	S	S	*	*			trans	-88.9	152.1	162.3	-83.2	54.6	0	0	0	108.7
255	F	23.9	Very low	32.5	Very low	205 Å²	205	152.6 Å²	152.6	90%	0.899	77%	0.767	S	S	*	*				-151.5	154	116.6	-122.7	-82	0	0	0	110.9
256	N	25.1	Very low	34.1	Very low	109 Å²	109	145 Å²	145	58%	0.583	75%	0.746	S	S	*	*			trans	-86.1	151.5	-178.3	-57.9	-47.7	0	0	0	110.8
257	H	25.4	Very low	36.4	Very low	192 Å²	192	144.9 Å²	144.9	89%	0.889	73%	0.726	S	S	*	*				-143.5	135.9	115.4	-126.3	-75.9	0	0	0	111.6
258	I	28.9	Very low	38	Very low	114 Å²	114	137.4 Å²	137.4	59%	0.585	71%	0.709	S	S	*	*			trans	-102.6	135.9	171.7	-65.6	172.2	0	0	0	107	Q260	I258-Q260 HydrophobicContact CG2-CG 3.8Å
259	N	24.7	Very low	40.4	Very low	163 Å²	163	131.7 Å²	131.7	87%	0.872	67%	0.672	S	S	*	*			trans	-140	134.7	130.7	-149.1	-24.7	0	0	0	108.7
260	Q	33.3	Very low	42.4	Very low	140 Å²	140	126.5 Å²	126.5	65%	0.654	67%	0.671	S	S	*	*			trans	-103.9	145.8	-171.7	-75.6	166.7	-4.9	0	0	110.5	I258	I258-Q260 HydrophobicContact CG2-CG 3.8Å
261	K	31.7	Very low	44.6	Very low	205 Å²	205	122.2 Å²	122.2	89%	0.891	67%	0.665	S	S	*	*			trans	-159.6	82.3	134.7	-116.6	174.9	-176.7	-178.6	0	111.2
262	D	34.4	Very low	47.2	Very low	152 Å²	152	117.5 Å²	117.5	81%	0.813	65%	0.648	S	S	*	*			trans	-150.4	126.1	146.9	-149.5	-25.8	0	0	0	109.2	G264	D262-G264 PolarHBondContact O-N 2.89Å
263	N	46.9	Very low	49.3	Very low	156 Å²	156	116.7 Å²	116.7	83%	0.834	65%	0.648	S	S	*	*			trans	-89.8	52.5	-167.3	-87.7	8.8	0	0	0	112.3	Q265	N263-Q265 PolarHBondContact O-N 3.12Å
264	G	52.3	Low	51.9	Low	53 Å²	53	115.7 Å²	115.7	55%	0.546	63%	0.632	S	S	.	*			trans	-78.5	108.7	162.9	0	0	0	0	0	110.2	D262 L266	D262-G264 PolarHBondContact O-N 2.89Å; G264-L266 VanDerWaalsContact C-N 3.32Å; G264-L266 PolarHBondContact O-N 3.49Å
265	Q	64.1	Low	54.2	Low	143 Å²	143	111.3 Å²	111.3	67%	0.668	62%	0.622	S	S	*	*			trans	-64.6	89.8	174.6	-169.1	81	20.9	0	0	109.8	N263 F267	N263-Q265 PolarHBondContact O-N 3.12Å; Q265-F267 HydrophobicContact CB-CE2 4.06Å; Q265-F267 HydrophobicContact CB-CZ 4.2Å; Q265-F267 HydrophobicContact CG-CE1 4Å; Q265-F267 HydrophobicContact CG-CE2 3.76Å; Q265-F267 HydrophobicContact CG-CZ 3.45Å; Q265-F267 VanDerWaalsContact CG-CZ 3.45Å; Q265-F267 WeakPolarHBondContact O-CD2 3.45Å; Q265-F267 WeakPolarHBondContact O-CE2 3.41Å
266	L	67	Low	56.9	Low	106 Å²	106	103.7 Å²	103.7	56%	0.555	59%	0.589	S	S	*	*			trans	-78.8	127.7	177.8	-71.7	175.2	0	0	0	110.2	G264 P268 T277	G264-L266 VanDerWaalsContact C-N 3.32Å; G264-L266 PolarHBondContact O-N 3.49Å; L266-P268 WeakPolarHBondContact O-CD 3.49Å; L266-T277 HydrophobicContact CD2-CG2 3.86Å
267	F	74.9	Confident	59.6	Low	65 Å²	65	103.6 Å²	103.6	29%	0.285	59%	0.592	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.2	98	-178.5	-65.4	-83.7	0	0	0	110.1	Q265 F276 A279 L282	Q265-F267 HydrophobicContact CB-CE2 4.06Å; Q265-F267 HydrophobicContact CB-CZ 4.2Å; Q265-F267 HydrophobicContact CG-CE1 4Å; Q265-F267 HydrophobicContact CG-CE2 3.76Å; Q265-F267 HydrophobicContact CG-CZ 3.45Å; Q265-F267 VanDerWaalsContact CG-CZ 3.45Å; Q265-F267 WeakPolarHBondContact O-CD2 3.45Å; Q265-F267 WeakPolarHBondContact O-CE2 3.41Å; F267-F276 PolarHBondContact N-O 3.01Å; F267-F276 PolarHBondContact O-N 3.28Å; F267-A279 HydrophobicContact CD1-CB 4.19Å; F267-A279 HydrophobicContact CD2-CB 4.15Å; F267-A279 HydrophobicContact CE1-CB 3.93Å; F267-A279 HydrophobicContact CE2-CB 3.89Å; F267-A279 HydrophobicContact CG-CB 4.3Å; F267-A279 HydrophobicContact CZ-CB 3.77Å; F267-L282 HydrophobicContact CB-CB 3.97Å; F267-L282 HydrophobicContact CB-CD2 3.66Å; F267-L282 HydrophobicContact CB-CG 4.37Å
268	P	74.2	Confident	62.1	Low	86 Å²	86	98.1 Å²	98.1	56%	0.558	57%	0.567	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-80.5	131	178.6	32.1	-35	0	0	0	112.5	L266 G270	L266-P268 WeakPolarHBondContact O-CD 3.49Å; P268-G270 PolarHBondContact O-N 3.24Å
269	C	79.9	Confident	64.2	Low	2 Å²	2	95 Å²	95	1%	0.014	56%	0.558	C	S	.	*			trans	-72.3	111.1	175.7	179.6	0	0	0	0	112	A271 C272 G273 K274 F276 L282 H289	C269-A271 PolarHBondContact O-N 3.35Å; C269-C272 PolarHBondContact O-N 3.02Å; C269-G273 PolarHBondContact O-N 2.85Å; C269-K274 WeakPolarHBondContact CB-O 3.08Å; C269-K274 PolarHBondContact N-O 2.84Å; C269-F276 HydrophobicContact CB-CE2 4.23Å; C269-L282 VanDerWaalsContact CA-CD1 3.43Å; C269-L282 HydrophobicContact CB-CD1 3.41Å; C269-L282 VanDerWaalsContact CB-CD1 3.41Å; C269-H289 PolarHBondContact SG-CD2 3.07Å; C269-H289 PolarHBondContact SG-NE2 3.39Å
270	G	73.1	Confident	66.6	Low	77 Å²	77	91.4 Å²	91.4	79%	0.794	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-28.1	-176.9	0	0	0	0	0	114.2	P268	P268-G270 PolarHBondContact O-N 3.24Å
271	A	73	Confident	68.7	Low	69 Å²	69	91.6 Å²	91.6	57%	0.57	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-13	178.9	0	0	0	0	0	115.6	C269 H289	C269-A271 PolarHBondContact O-N 3.35Å; A271-H289 HydrophobicContact CB-CB 3.89Å
272	C	77.9	Confident	71	Confident	51 Å²	51	82.6 Å²	82.6	35%	0.345	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-152.3	-0.1	-172.9	78.9	0	0	0	0	116.9	C269 K274 H285	C269-C272 PolarHBondContact O-N 3.02Å; C272-K274 VanDerWaalsContact C-N 3.26Å; C272-K274 PolarHBondContact O-N 2.87Å; C272-H285 PolarHBondContact SG-NE2 3.04Å
273	G	73.6	Confident	72.9	Confident	65 Å²	65	83 Å²	83	67%	0.67	50%	0.496	S	S	*	.			trans	72.7	6.9	177.1	0	0	0	0	0	115.9	C269	C269-G273 PolarHBondContact O-N 2.85Å
274	K	78.1	Confident	74.2	Confident	124 Å²	124	81.1 Å²	81.1	54%	0.539	49%	0.486	S	S	.	.			trans	-82.1	122.2	178.5	-66.9	-178.9	-178.6	-176.6	0	111.1	C269 C272 F276	C269-K274 WeakPolarHBondContact CB-O 3.08Å; C269-K274 PolarHBondContact N-O 2.84Å; C272-K274 VanDerWaalsContact C-N 3.26Å; C272-K274 PolarHBondContact O-N 2.87Å; K274-F276 HydrophobicContact CB-CE2 3.84Å; K274-F276 HydrophobicContact CB-CZ 4.17Å; K274-F276 WeakPolarHBondContact O-CD2 3.37Å; K274-F276 WeakPolarHBondContact O-CE2 3.31Å
275	A	76.6	Confident	75.5	Confident	60 Å²	60	79.7 Å²	79.7	50%	0.496	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	142.3	173.1	0	0	0	0	0	112.1
276	F	80.9	Confident	76.1	Confident	46 Å²	46	76.4 Å²	76.4	20%	0.202	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	143.9	175	-61.9	-93	0	0	0	109.8	F267 C269 K274 E278 R281 L282 H285	F267-F276 PolarHBondContact N-O 3.01Å; F267-F276 PolarHBondContact O-N 3.28Å; C269-F276 HydrophobicContact CB-CE2 4.23Å; K274-F276 HydrophobicContact CB-CE2 3.84Å; K274-F276 HydrophobicContact CB-CZ 4.17Å; K274-F276 WeakPolarHBondContact O-CD2 3.37Å; K274-F276 WeakPolarHBondContact O-CE2 3.31Å; F276-E278 PolarHBondContact O-N 3.35Å; F276-R281 HydrophobicContact CB-CB 4.36Å; F276-R281 HydrophobicContact CD1-CB 3.9Å; F276-R281 HydrophobicContact CG-CB 4.39Å; F276-L282 HydrophobicContact CB-CB 4.32Å; F276-L282 HydrophobicContact CD2-CB 4.13Å; F276-L282 HydrophobicContact CD2-CD1 3.8Å; F276-L282 HydrophobicContact CE2-CD1 4.07Å; F276-L282 HydrophobicContact CG-CB 4.42Å; F276-H285 HydrophobicContact CE1-CB 4.38Å; F276-H285 HydrophobicContact CE2-CB 4.01Å; F276-H285 AromaticContact CE2-CD2 3.55Å; F276-H285 AromaticContact CE2-CG 3.96Å; F276-H285 HydrophobicContact CZ-CB 3.71Å; F276-H285 AromaticContact CZ-CD2 3.48Å; F276-H285 VanDerWaalsContact CZ-CD2 3.48Å; F276-H285 WeakPolarHBondContact CZ-CD2 3.19Å; F276-H285 AromaticContact CZ-CG 3.57Å
277	T	80.6	Confident	76.5	Confident	106 Å²	106	75 Å²	75	65%	0.65	45%	0.453	S	S	*	.	S	Bend	trans	-79.2	-3.8	176	52.3	0	0	0	0	113.7	L266	L266-T277 HydrophobicContact CD2-CG2 3.86Å
278	E	77.3	Confident	76.3	Confident	78 Å²	78	78.2 Å²	78.2	36%	0.364	47%	0.47	S	S	.	.	S	Bend	trans	-137.6	124.7	-175.4	-70	170.3	-147.3	0	0	109.6	F276 S280 R281 L282	F276-E278 PolarHBondContact O-N 3.35Å; E278-S280 PolarHBondContact O-N 3.28Å; E278-R281 HydrophobicContact CB-CB 4.19Å; E278-R281 HydrophobicContact CB-CG 4.06Å; E278-R281 PolarHBondContact O-N 3.42Å; E278-R281 IonicContact OE1-CZ 3.2Å; E278-R281 IonicContact OE1-NE 3.6Å; E278-R281 PolarHBondContact OE1-NE 3.2Å; E278-R281 VanDerWaalsContact OE1-NE 3.09Å; E278-R281 IonicContact OE1-NH2 2.75Å; E278-R281 PolarHBondContact OE1-NH2 2.75Å; E278-R281 WeakPolarHBondContact OE2-CD 3.08Å; E278-R281 WeakPolarHBondContact OE2-CG 3.4Å; E278-R281 IonicContact OE2-CZ 3.24Å; E278-R281 IonicContact OE2-NE 3.55Å; E278-R281 PolarHBondContact OE2-NE 3.05Å; E278-R281 IonicContact OE2-NH2 3.96Å; E278-L282 PolarHBondContact O-N 2.8Å
279	A	73.2	Confident	76.2	Confident	49 Å²	49	77.6 Å²	77.6	41%	0.405	46%	0.459	S	S	.	.	H	α-helix	trans	-55.9	-36.6	175.7	0	0	0	0	0	112.4	F267 R281 L282 K283	F267-A279 HydrophobicContact CD1-CB 4.19Å; F267-A279 HydrophobicContact CD2-CB 4.15Å; F267-A279 HydrophobicContact CE1-CB 3.93Å; F267-A279 HydrophobicContact CE2-CB 3.89Å; F267-A279 HydrophobicContact CG-CB 4.3Å; F267-A279 HydrophobicContact CZ-CB 3.77Å; A279-R281 VanDerWaalsContact C-N 3.34Å; A279-R281 PolarHBondContact O-N 3.39Å; A279-L282 PolarHBondContact O-N 2.89Å; A279-K283 WeakPolarHBondContact O-CB 3.49Å; A279-K283 PolarHBondContact O-N 3.14Å
280	S	75.6	Confident	75	Confident	86 Å²	86	80.8 Å²	80.8	60%	0.601	49%	0.492	S	S	*	.	H	α-helix	trans	-63.6	-35.7	176.8	-54.3	0	0	0	0	113	E278 N284	E278-S280 PolarHBondContact O-N 3.28Å; S280-N284 WeakPolarHBondContact O-CB 3.32Å; S280-N284 PolarHBondContact O-N 3.1Å; S280-N284 VanDerWaalsContact O-N 3.09Å
281	R	77.4	Confident	73.9	Confident	144 Å²	144	80.6 Å²	80.6	54%	0.543	48%	0.483	S	S	.	.	H	α-helix	trans	-74.1	-36.9	173.9	-69.1	-175.1	-163.1	-161.8	11.8	111.8	F276 E278 A279 H285	F276-R281 HydrophobicContact CB-CB 4.36Å; F276-R281 HydrophobicContact CD1-CB 3.9Å; F276-R281 HydrophobicContact CG-CB 4.39Å; E278-R281 HydrophobicContact CB-CB 4.19Å; E278-R281 HydrophobicContact CB-CG 4.06Å; E278-R281 PolarHBondContact O-N 3.42Å; E278-R281 IonicContact OE1-CZ 3.2Å; E278-R281 IonicContact OE1-NE 3.6Å; E278-R281 PolarHBondContact OE1-NE 3.2Å; E278-R281 VanDerWaalsContact OE1-NE 3.09Å; E278-R281 IonicContact OE1-NH2 2.75Å; E278-R281 PolarHBondContact OE1-NH2 2.75Å; E278-R281 WeakPolarHBondContact OE2-CD 3.08Å; E278-R281 WeakPolarHBondContact OE2-CG 3.4Å; E278-R281 IonicContact OE2-CZ 3.24Å; E278-R281 IonicContact OE2-NE 3.55Å; E278-R281 PolarHBondContact OE2-NE 3.05Å; E278-R281 IonicContact OE2-NH2 3.96Å; A279-R281 VanDerWaalsContact C-N 3.34Å; A279-R281 PolarHBondContact O-N 3.39Å; R281-H285 WeakPolarHBondContact O-CB 3.39Å; R281-H285 PolarHBondContact O-N 3.14Å
282	L	79.5	Confident	72.4	Confident	17 Å²	17	81.3 Å²	81.3	9%	0.089	48%	0.484	C	S	.	.	H	α-helix	trans	-60.1	-52.4	171.2	175.4	61.6	0	0	0	110.4	F267 C269 F276 E278 A279 N284 H285 E286	F267-L282 HydrophobicContact CB-CB 3.97Å; F267-L282 HydrophobicContact CB-CD2 3.66Å; F267-L282 HydrophobicContact CB-CG 4.37Å; C269-L282 VanDerWaalsContact CA-CD1 3.43Å; C269-L282 HydrophobicContact CB-CD1 3.41Å; C269-L282 VanDerWaalsContact CB-CD1 3.41Å; F276-L282 HydrophobicContact CB-CB 4.32Å; F276-L282 HydrophobicContact CD2-CB 4.13Å; F276-L282 HydrophobicContact CD2-CD1 3.8Å; F276-L282 HydrophobicContact CE2-CD1 4.07Å; F276-L282 HydrophobicContact CG-CB 4.42Å; E278-L282 PolarHBondContact O-N 2.8Å; A279-L282 PolarHBondContact O-N 2.89Å; L282-N284 VanDerWaalsContact C-N 3.3Å; L282-N284 PolarHBondContact O-N 2.71Å; L282-H285 CarbonylContact O-C 3.52Å; L282-H285 VanDerWaalsContact O-CA 3.32Å; L282-H285 WeakPolarHBondContact O-CA 3.32Å; L282-H285 WeakPolarHBondContact O-CB 3.4Å; L282-H285 PolarHBondContact O-N 3.23Å; L282-E286 HydrophobicContact CD1-CG 3.69Å; L282-E286 HydrophobicContact CG-CG 4.1Å; L282-E286 PolarHBondContact O-N 3.44Å
283	K	75.4	Confident	70.4	Confident	160 Å²	160	85.8 Å²	85.8	70%	0.696	51%	0.51	S	S	*	.	H	α-helix	trans	-59.7	-40.1	-177	-160	168	-173.1	173.4	0	112.1	A279 H285 E286 A287	A279-K283 WeakPolarHBondContact O-CB 3.49Å; A279-K283 PolarHBondContact O-N 3.14Å; K283-H285 VanDerWaalsContact C-N 3.28Å; K283-H285 PolarHBondContact O-N 2.85Å; K283-E286 PolarHBondContact O-N 3.19Å; K283-A287 WeakPolarHBondContact O-CB 3.37Å; K283-A287 PolarHBondContact O-N 3.24Å
284	N	73.9	Confident	68.4	Low	116 Å²	116	86.4 Å²	86.4	62%	0.62	52%	0.516	S	S	*	.	H	α-helix	trans	-69.6	-18.8	171.9	-80.4	-5.1	0	0	0	114.2	S280 L282 Q288	S280-N284 WeakPolarHBondContact O-CB 3.32Å; S280-N284 PolarHBondContact O-N 3.1Å; S280-N284 VanDerWaalsContact O-N 3.09Å; L282-N284 VanDerWaalsContact C-N 3.3Å; L282-N284 PolarHBondContact O-N 2.71Å; N284-Q288 WeakPolarHBondContact O-CG 3.36Å; N284-Q288 PolarHBondContact O-NE2 2.84Å
285	H	79.4	Confident	66.1	Low	23 Å²	23	84 Å²	84	11%	0.106	53%	0.526	C	S	.	.	H	α-helix	trans	-87.1	-37.6	171.1	-171.4	50.1	0	0	0	112.4	C272 F276 R281 L282 K283 A287 Q288 H289	C272-H285 PolarHBondContact SG-NE2 3.04Å; F276-H285 HydrophobicContact CE1-CB 4.38Å; F276-H285 HydrophobicContact CE2-CB 4.01Å; F276-H285 AromaticContact CE2-CD2 3.55Å; F276-H285 AromaticContact CE2-CG 3.96Å; F276-H285 HydrophobicContact CZ-CB 3.71Å; F276-H285 AromaticContact CZ-CD2 3.48Å; F276-H285 VanDerWaalsContact CZ-CD2 3.48Å; F276-H285 WeakPolarHBondContact CZ-CD2 3.19Å; F276-H285 AromaticContact CZ-CG 3.57Å; R281-H285 WeakPolarHBondContact O-CB 3.39Å; R281-H285 PolarHBondContact O-N 3.14Å; L282-H285 CarbonylContact O-C 3.52Å; L282-H285 VanDerWaalsContact O-CA 3.32Å; L282-H285 WeakPolarHBondContact O-CA 3.32Å; L282-H285 WeakPolarHBondContact O-CB 3.4Å; L282-H285 PolarHBondContact O-N 3.23Å; K283-H285 VanDerWaalsContact C-N 3.28Å; K283-H285 PolarHBondContact O-N 2.85Å; H285-A287 VanDerWaalsContact C-N 3.35Å; H285-Q288 PolarHBondContact ND1-OE1 3.24Å; H285-Q288 WeakPolarHBondContact O-CA 3.33Å; H285-Q288 VanDerWaalsContact O-CB 3.22Å; H285-Q288 WeakPolarHBondContact O-CB 3.42Å; H285-Q288 PolarHBondContact O-N 3.45Å; H285-H289 AromaticContact CD2-NE2 3.53Å; H285-H289 AromaticContact CE1-NE2 3.5Å; H285-H289 AromaticContact NE2-CE1 3.81Å; H285-H289 AromaticContact NE2-NE2 3.06Å; H285-H289 PolarHBondContact NE2-NE2 3.13Å; H285-H289 PolarHBondContact O-CD2 2.92Å
286	E	76.8	Confident	63.9	Low	75 Å²	75	86.6 Å²	86.6	35%	0.35	54%	0.536	S	S	.	.	H	α-helix	trans	-68.3	-34.4	176.8	-71.9	-179.4	147.5	0	0	112.2	L282 K283 Q288 H289 G290	L282-E286 HydrophobicContact CD1-CG 3.69Å; L282-E286 HydrophobicContact CG-CG 4.1Å; L282-E286 PolarHBondContact O-N 3.44Å; K283-E286 PolarHBondContact O-N 3.19Å; E286-Q288 PolarHBondContact O-N 3Å; E286-H289 PolarHBondContact O-N 3.47Å; E286-G290 PolarHBondContact O-N 2.87Å; E286-G290 VanDerWaalsContact O-N 3.07Å
287	A	75.6	Confident	61.5	Low	75 Å²	75	92.8 Å²	92.8	62%	0.62	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.9	-16.2	166.1	0	0	0	0	0	114.2	K283 H285	K283-A287 WeakPolarHBondContact O-CB 3.37Å; K283-A287 PolarHBondContact O-N 3.24Å; H285-A287 VanDerWaalsContact C-N 3.35Å
288	Q	69.3	Low	59.1	Low	134 Å²	134	92.7 Å²	92.7	63%	0.626	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-18	174.6	-55.2	166	29.4	0	0	112.6	N284 H285 E286	N284-Q288 WeakPolarHBondContact O-CG 3.36Å; N284-Q288 PolarHBondContact O-NE2 2.84Å; H285-Q288 PolarHBondContact ND1-OE1 3.24Å; H285-Q288 WeakPolarHBondContact O-CA 3.33Å; H285-Q288 VanDerWaalsContact O-CB 3.22Å; H285-Q288 WeakPolarHBondContact O-CB 3.42Å; H285-Q288 PolarHBondContact O-N 3.45Å; E286-Q288 PolarHBondContact O-N 3Å
289	H	72.8	Confident	57	Low	73 Å²	73	97.3 Å²	97.3	34%	0.338	60%	0.595	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.6	-33.4	175	-61.3	-64	0	0	0	112.3	C269 A271 H285 E286 A291	C269-H289 PolarHBondContact SG-CD2 3.07Å; C269-H289 PolarHBondContact SG-NE2 3.39Å; A271-H289 HydrophobicContact CB-CB 3.89Å; H285-H289 AromaticContact CD2-NE2 3.53Å; H285-H289 AromaticContact CE1-NE2 3.5Å; H285-H289 AromaticContact NE2-CE1 3.81Å; H285-H289 AromaticContact NE2-NE2 3.06Å; H285-H289 PolarHBondContact NE2-NE2 3.13Å; H285-H289 PolarHBondContact O-CD2 2.92Å; E286-H289 PolarHBondContact O-N 3.47Å; H289-A291 PolarHBondContact O-N 3.42Å
290	G	54.4	Low	54.8	Low	68 Å²	68	98.2 Å²	98.2	70%	0.701	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	29.9	-177.3	0	0	0	0	0	117.2	E286	E286-G290 PolarHBondContact O-N 2.87Å; E286-G290 VanDerWaalsContact O-N 3.07Å
291	A	49.8	Very low	52.6	Low	74 Å²	74	102.3 Å²	102.3	61%	0.612	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.8	12.8	-176.4	0	0	0	0	0	114.1	H289	H289-A291 PolarHBondContact O-N 3.42Å
292	S	42.6	Very low	50.2	Low	83 Å²	83	98.8 Å²	98.8	58%	0.58	63%	0.633	S	S	*	*	S	Bend	trans	-158.1	53.6	177	-67.4	0	0	0	0	114.6	R336	S292-R336 PolarHBondContact OG-NH2 3.44Å; S292-R336 VanDerWaalsContact OG-NH2 3.12Å
293	T	34.5	Very low	47.8	Very low	145 Å²	145	106 Å²	106	89%	0.89	67%	0.67	S	S	*	*			trans	-136.9	153.3	155.8	44	0	0	0	0	109.4
294	G	32.2	Very low	45.6	Very low	78 Å²	78	102.7 Å²	102.7	80%	0.804	67%	0.667	S	S	*	*			trans	-165.9	138	178.4	0	0	0	0	0	111.4
295	G	30.5	Very low	43.7	Very low	73 Å²	73	103.8 Å²	103.8	75%	0.753	68%	0.679	S	S	*	*			trans	85.3	145.5	-168.5	0	0	0	0	0	112.8
296	V	29.6	Very low	42.4	Very low	115 Å²	115	108.9 Å²	108.9	70%	0.697	71%	0.714	S	S	*	*			cis	-153.8	159	6.3	-72.5	0	0	0	0	112.1
297	H	31.7	Very low	40.1	Very low	177 Å²	177	109.3 Å²	109.3	82%	0.819	74%	0.738	S	S	*	*			trans	70.9	148.1	163.8	-50.2	147.9	0	0	0	118
298	S	29.7	Very low	37.7	Very low	103 Å²	103	109.1 Å²	109.1	72%	0.72	74%	0.744	S	S	*	*			cis	-167.6	175	-24.1	-164.1	0	0	0	0	110.7
299	L	33.5	Very low	35.8	Very low	176 Å²	176	111.4 Å²	111.4	92%	0.921	76%	0.759	S	S	*	*			trans	80.3	141.9	170.8	-50.6	177.7	0	0	0	118.7
300	G	27.1	Very low	33.8	Very low	67 Å²	67	113.2 Å²	113.2	69%	0.691	78%	0.78	S	S	*	*			trans	127	69.1	162.8	0	0	0	0	0	118.7
301	D	28.5	Very low	32.5	Very low	172 Å²	172	118.2 Å²	118.2	92%	0.92	79%	0.79	S	S	*	*			trans	38.3	154.3	148.7	-56.4	-67.7	0	0	0	124.2
302	G	28.3	Very low	31.7	Very low	71 Å²	71	122.6 Å²	122.6	73%	0.732	80%	0.802	S	S	*	*			trans	139.2	42.7	152.3	0	0	0	0	0	123.9
303	L	28.4	Very low	31	Very low	167 Å²	167	124.4 Å²	124.4	87%	0.874	81%	0.814	S	S	*	*			trans	56.8	146.5	148.4	-109.2	70.3	0	0	0	124.6
304	S	29.3	Very low	31	Very low	91 Å²	91	126.3 Å²	126.3	64%	0.636	81%	0.813	S	S	*	*			trans	87.8	92	142.3	-61.2	0	0	0	0	124.4
305	T	34.3	Very low	30.9	Very low	140 Å²	140	128.4 Å²	128.4	86%	0.859	82%	0.816	S	S	*	*			trans	70.4	156	133.3	40.4	0	0	0	0	122.9
306	P	50.6	Low	30.8	Very low	130 Å²	130	128.7 Å²	128.7	84%	0.844	82%	0.819	S	S	*	*			trans	-120.9	164.3	-160.5	42.9	-30.7	0	0	0	117.3
307	G	28.5	Very low	31	Very low	84 Å²	84	131.1 Å²	131.1	87%	0.866	83%	0.827	S	S	*	*			trans	149.5	143.6	166.2	0	0	0	0	0	111.4
308	G	27.2	Very low	31.1	Very low	71 Å²	71	130.4 Å²	130.4	73%	0.732	83%	0.828	S	S	*	*			cis	175.2	-179.4	-4.8	0	0	0	0	0	111.2
309	L	29	Very low	31.2	Very low	181 Å²	181	133.5 Å²	133.5	95%	0.948	83%	0.831	S	S	*	*			trans	69	109.1	170.1	-53.1	-178.5	0	0	0	118.7
310	S	29.9	Very low	31.4	Very low	111 Å²	111	131.9 Å²	131.9	78%	0.776	82%	0.824	S	S	*	*			trans	-67.9	162.5	158.6	-40.6	0	0	0	0	112.2
311	L	27.7	Very low	31.6	Very low	174 Å²	174	132.2 Å²	132.2	91%	0.911	83%	0.827	S	S	*	*				-146.4	136.4	129.1	-142	86.5	0	0	0	111.4
312	L	32.5	Very low	31.8	Very low	166 Å²	166	130.6 Å²	130.6	87%	0.869	82%	0.823	S	S	*	*			trans	-98	140.5	168.4	-73.7	162	0	0	0	108.7
313	S	27.6	Very low	31.8	Very low	120 Å²	120	135.7 Å²	135.7	84%	0.839	83%	0.828	S	S	*	*			trans	-123.8	128	158.8	60.6	0	0	0	0	109.8
314	Q	36.1	Very low	32	Very low	185 Å²	185	135.2 Å²	135.2	86%	0.864	83%	0.825	S	S	*	*			trans	-76.1	153.9	-168.7	-54.8	160.3	36.4	0	0	111.6
315	S	29.1	Very low	32.6	Very low	123 Å²	123	136.9 Å²	136.9	86%	0.86	83%	0.834	S	S	*	*				-174.3	123.5	111.4	-76.8	0	0	0	0	110.3
316	G	28.9	Very low	32.4	Very low	79 Å²	79	134.1 Å²	134.1	81%	0.814	83%	0.833	S	S	*	*			trans	-90.4	163.3	175.7	0	0	0	0	0	112.6
317	L	34.1	Very low	31.4	Very low	165 Å²	165	131.5 Å²	131.5	86%	0.864	83%	0.83	S	S	*	*			trans	-96.1	157.2	168.1	-75.1	171.6	0	0	0	111.3
318	L	34	Very low	31.7	Very low	163 Å²	163	136 Å²	136	85%	0.853	83%	0.833	S	S	*	*			trans	-36.9	156.5	175	41.4	142.4	0	0	0	118
319	E	30.2	Very low	31.7	Very low	167 Å²	167	137.9 Å²	137.9	78%	0.78	84%	0.842	S	S	*	*			trans	-89.9	154.8	-164.6	-122.1	179.5	101.3	0	0	116.4
320	N	37.5	Very low	32.6	Very low	143 Å²	143	137.1 Å²	137.1	77%	0.765	84%	0.838	S	S	*	*			trans	65.5	135	153.2	-59.4	-33.8	0	0	0	121.4
321	G	32.6	Very low	32.9	Very low	73 Å²	73	138.1 Å²	138.1	75%	0.753	84%	0.835	S	S	*	*			trans	-179	6.6	-180	0	0	0	0	0	121.3
322	V	31.8	Very low	33.6	Very low	138 Å²	138	138.1 Å²	138.1	84%	0.836	84%	0.835	S	S	*	*			trans	56.3	112.1	162.3	-172.4	0	0	0	0	120.6
323	Q	28.6	Very low	34	Very low	179 Å²	179	136.1 Å²	136.1	84%	0.836	83%	0.826	S	S	*	*			trans	54.1	146.2	144.8	-123.2	64.1	10.9	0	0	125.6
324	L	32	Very low	35.1	Very low	156 Å²	156	142.7 Å²	142.7	82%	0.817	83%	0.832	S	S	*	*			trans	-85.8	179	175	-71.5	165.1	0	0	0	111.9
325	P	43.5	Very low	35.7	Very low	126 Å²	126	143 Å²	143	82%	0.818	83%	0.83	S	S	*	*			cis	-145.8	170.9	17.5	43.2	-23.8	0	0	0	119.9
326	G	29.1	Very low	36.4	Very low	82 Å²	82	145.9 Å²	145.9	85%	0.845	82%	0.822	S	S	*	*			trans	109.3	115.3	141.4	0	0	0	0	0	118.2
327	G	30.1	Very low	37.2	Very low	76 Å²	76	149 Å²	149	78%	0.784	82%	0.816	S	S	*	*			trans	160.7	92.4	168.1	0	0	0	0	0	117
328	L	33.3	Very low	37.9	Very low	178 Å²	178	151.1 Å²	151.1	93%	0.932	81%	0.813	S	S	*	*			trans	44.9	87.6	155.6	-55.5	-179.4	0	0	0	118.8	L330	L328-L330 PolarHBondContact O-N 2.84Å
329	A	29	Very low	39	Very low	110 Å²	110	149.1 Å²	149.1	91%	0.909	81%	0.807	S	S	*	*			trans	-86	102.3	167	0	0	0	0	0	112.3
330	L	46.8	Very low	40.2	Very low	166 Å²	166	148.1 Å²	148.1	87%	0.869	80%	0.796	S	S	*	*			trans	-128.4	96.8	166.7	-107.9	174.5	0	0	0	109.8	L328	L328-L330 PolarHBondContact O-N 2.84Å
331	D	35.5	Very low	41.4	Very low	132 Å²	132	152.1 Å²	152.1	71%	0.706	80%	0.801	S	S	*	*			trans	-172.2	104.4	131.5	-125.8	-46.2	0	0	0	112.8	N333	D331-N333 VanDerWaalsContact C-N 3.33Å; D331-N333 PolarHBondContact O-N 3.27Å; D331-N333 VanDerWaalsContact O-N 3.11Å; D331-N333 PolarHBondContact OD1-ND2 2.95Å
332	N	43.5	Very low	43.5	Very low	173 Å²	173	153.5 Å²	153.5	93%	0.925	79%	0.787	S	S	*	*			trans	-86.9	70.2	176.1	-112.4	-29.2	0	0	0	110.7
333	N	40.5	Very low	45.7	Very low	125 Å²	125	148.9 Å²	148.9	67%	0.668	76%	0.759	S	S	*	*			trans	-124.7	19.2	-175.8	-99	-57.5	0	0	0	116.3	D331 K335	D331-N333 VanDerWaalsContact C-N 3.33Å; D331-N333 PolarHBondContact O-N 3.27Å; D331-N333 VanDerWaalsContact O-N 3.11Å; D331-N333 PolarHBondContact OD1-ND2 2.95Å; N333-K335 PolarHBondContact O-N 3.2Å
334	R	50.4	Low	48.4	Very low	257 Å²	257	141.8 Å²	141.8	97%	0.97	73%	0.734	S	S	*	*			trans	-74.4	45.1	169.2	-73.8	-173.3	170.4	179.7	-2.1	113.4	R336	R334-R336 PolarHBondContact O-N 3.07Å
335	K	48.6	Very low	50.9	Low	191 Å²	191	134.4 Å²	134.4	83%	0.83	70%	0.696	S	S	*	*			trans	-90.2	85	-175.3	-163.8	161.3	-171.9	166.7	0	113.2	N333	N333-K335 PolarHBondContact O-N 3.2Å
336	R	45.3	Very low	52.8	Low	184 Å²	184	134.6 Å²	134.6	69%	0.694	69%	0.69	S	S	*	*			trans	65.3	72	157.9	-152.3	177.1	-153.5	163.4	8.4	114.7	S292 R334 R338	S292-R336 PolarHBondContact OG-NH2 3.44Å; S292-R336 VanDerWaalsContact OG-NH2 3.12Å; R334-R336 PolarHBondContact O-N 3.07Å; R336-R338 PolarHBondContact O-N 3.39Å
337	E	44.6	Very low	55.3	Low	146 Å²	146	135.7 Å²	135.7	68%	0.682	68%	0.675	S	S	*	*			trans	-62.8	77.8	155	-173.4	61.1	-133.6	0	0	108.8	T339 H342	E337-T339 PolarHBondContact O-N 2.92Å; E337-T339 VanDerWaalsContact O-N 3.11Å; E337-H342 IonicContact OE1-CE1 4Å
338	R	49.8	Very low	57.9	Low	209 Å²	209	134.4 Å²	134.4	79%	0.789	65%	0.654	S	S	*	*			trans	-64.6	111.4	166.1	-177.7	-174.5	-163.4	174	7.8	105.4	R336 R340	R336-R338 PolarHBondContact O-N 3.39Å; R338-R340 PolarHBondContact O-N 3.23Å
339	T	55.8	Low	60.3	Low	120 Å²	120	128.7 Å²	128.7	74%	0.736	64%	0.638	S	S	*	*			trans	-60	74.8	-175.3	46.8	0	0	0	0	112.7	E337 R341	E337-T339 PolarHBondContact O-N 2.92Å; E337-T339 VanDerWaalsContact O-N 3.11Å; T339-R341 PolarHBondContact O-N 3.19Å; T339-R341 VanDerWaalsContact O-N 3.12Å
340	R	56	Low	62.9	Low	146 Å²	146	129.2 Å²	129.2	55%	0.551	62%	0.619	S	S	*	*			trans	-57.4	117.4	154.8	-61.9	-173.6	-169.6	-104.5	2.9	104.7	R338 H342	R338-R340 PolarHBondContact O-N 3.23Å; R340-H342 PolarHBondContact O-N 2.77Å; R340-H342 PolarHBondContact O-ND1 3.15Å
341	R	63.7	Low	64.8	Low	228 Å²	228	125.8 Å²	125.8	86%	0.86	61%	0.605	S	S	*	*			trans	-64.5	94.2	168.5	-70.2	-174.3	-179.8	-179.9	0.1	106.6	T339 V343	T339-R341 PolarHBondContact O-N 3.19Å; T339-R341 VanDerWaalsContact O-N 3.12Å; R341-V343 WeakPolarHBondContact O-CG2 3.23Å; R341-V343 PolarHBondContact O-N 3.42Å
342	H	76.7	Confident	67.2	Low	102 Å²	102	121.4 Å²	121.4	47%	0.472	58%	0.58	S	S	.	*			trans	-67.2	109.2	179.4	-85.1	115.9	0	0	0	107.7	E337 R340 V351 F352	E337-H342 IonicContact OE1-CE1 4Å; R340-H342 PolarHBondContact O-N 2.77Å; R340-H342 PolarHBondContact O-ND1 3.15Å; H342-V351 HydrophobicContact CB-CG1 3.57Å; H342-F352 CarbonylContact C-O 3.47Å; H342-F352 WeakPolarHBondContact CA-O 3.24Å
343	V	77.3	Confident	69.2	Low	41 Å²	41	119.8 Å²	119.8	25%	0.248	56%	0.561	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.4	115.5	-168.3	-151	0	0	0	0	109.1	R341 F352 V355 L358	R341-V343 WeakPolarHBondContact O-CG2 3.23Å; R341-V343 PolarHBondContact O-N 3.42Å; V343-F352 PolarHBondContact N-O 3.15Å; V343-F352 PolarHBondContact O-N 3.24Å; V343-V355 HydrophobicContact CG2-CG2 3.93Å; V343-L358 HydrophobicContact CB-CD2 3.9Å; V343-L358 HydrophobicContact CG1-CD2 3.42Å; V343-L358 VanDerWaalsContact CG1-CD2 3.42Å
344	G	84.4	Confident	71.2	Confident	30 Å²	30	115.9 Å²	115.9	31%	0.309	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	155.4	178	0	0	0	0	0	112.8	K350 L358	G344-K350 CarbonylContact C-O 3.54Å; G344-L358 WeakPolarHBondContact O-CD1 3.42Å; G344-L358 WeakPolarHBondContact O-CD2 3.24Å
345	C	86	Confident	72.8	Confident	1 Å²	1	107.5 Å²	107.5	1%	0.007	52%	0.517	C	S	.	.			trans	-94.8	110.4	165.5	-173.3	0	0	0	0	109.6	I347 C348 G349 K350 F352 L358 H361	C345-I347 PolarHBondContact O-N 3.24Å; C345-C348 PolarHBondContact O-N 2.75Å; C345-G349 WeakPolarHBondContact O-CA 3.34Å; C345-G349 PolarHBondContact O-N 2.74Å; C345-K350 HydrophobicContact CB-CB 4.47Å; C345-K350 WeakPolarHBondContact CB-O 3.49Å; C345-K350 PolarHBondContact N-O 2.94Å; C345-F352 HydrophobicContact CB-CE2 4.06Å; C345-L358 HydrophobicContact CB-CD1 3.58Å; C345-H361 PolarHBondContact SG-CD2 3.45Å; C345-H361 PolarHBondContact SG-NE2 3.23Å; C345-H361 VanDerWaalsContact SG-NE2 3.44Å
346	D	82.8	Confident	74.3	Confident	130 Å²	130	106.1 Å²	106.1	70%	0.695	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-22.2	-175.6	-30.3	-69.5	0	0	0	113	K362	D346-K362 WeakPolarHBondContact OD2-CE 3.34Å; D346-K362 IonicContact OD2-NZ 3.42Å; D346-K362 PolarHBondContact OD2-NZ 2.92Å
347	I	82.1	Confident	76.1	Confident	105 Å²	105	99.7 Å²	99.7	54%	0.538	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-21	-177.1	-51.8	171.1	0	0	0	112.5	C345 H365	C345-I347 PolarHBondContact O-N 3.24Å; I347-H365 HydrophobicContact CD1-CB 3.74Å; I347-H365 HydrophobicContact CG2-CB 4.18Å; I347-H365 WeakPolarHBondContact CG2-ND1 3.45Å
348	C	83.8	Confident	78	Confident	49 Å²	49	93.1 Å²	93.1	33%	0.331	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-153.6	18.1	-178.4	72.1	0	0	0	0	116.7	C345 K350 H361 H365	C345-C348 PolarHBondContact O-N 2.75Å; C348-K350 PolarHBondContact O-N 3.09Å; C348-H361 PolarHBondContact SG-NE2 2.84Å; C348-H365 VanDerWaalsContact SG-CE1 3.56Å; C348-H365 PolarHBondContact SG-NE2 2.91Å
349	G	83.3	Confident	79.5	Confident	58 Å²	58	87.4 Å²	87.4	60%	0.598	44%	0.44	S	S	*	.			trans	66.9	-5.2	177.3	0	0	0	0	0	116.1	C345 V351	C345-G349 WeakPolarHBondContact O-CA 3.34Å; C345-G349 PolarHBondContact O-N 2.74Å; G349-V351 PolarHBondContact O-N 3.12Å
350	K	84.8	Confident	80.7	Confident	121 Å²	121	85.9 Å²	85.9	53%	0.526	42%	0.421	S	S	.	.			trans	-65.2	126.2	-175.5	-73	175.6	-171	161.8	0	111	G344 C345 C348 F352	G344-K350 CarbonylContact C-O 3.54Å; C345-K350 HydrophobicContact CB-CB 4.47Å; C345-K350 WeakPolarHBondContact CB-O 3.49Å; C345-K350 PolarHBondContact N-O 2.94Å; C348-K350 PolarHBondContact O-N 3.09Å; K350-F352 HydrophobicContact CB-CE2 3.64Å; K350-F352 HydrophobicContact CB-CZ 3.88Å; K350-F352 WeakPolarHBondContact O-CD2 3.04Å; K350-F352 WeakPolarHBondContact O-CE2 3.23Å
351	V	85.9	Confident	82	Confident	94 Å²	94	80.2 Å²	80.2	57%	0.57	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.6	130.9	-173.7	-179.5	0	0	0	0	110.7	H342 G349	H342-V351 HydrophobicContact CB-CG1 3.57Å; G349-V351 PolarHBondContact O-N 3.12Å
352	F	86.6	Confident	82.8	Confident	40 Å²	40	72.7 Å²	72.7	18%	0.175	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	150.2	-179.3	-63.8	-83.7	0	0	0	112.3	H342 V343 C345 K350 D354 H357 L358 H361	H342-F352 CarbonylContact C-O 3.47Å; H342-F352 WeakPolarHBondContact CA-O 3.24Å; V343-F352 PolarHBondContact N-O 3.15Å; V343-F352 PolarHBondContact O-N 3.24Å; C345-F352 HydrophobicContact CB-CE2 4.06Å; K350-F352 HydrophobicContact CB-CE2 3.64Å; K350-F352 HydrophobicContact CB-CZ 3.88Å; K350-F352 WeakPolarHBondContact O-CD2 3.04Å; K350-F352 WeakPolarHBondContact O-CE2 3.23Å; F352-D354 VanDerWaalsContact C-N 3.27Å; F352-D354 PolarHBondContact O-N 3.41Å; F352-H357 HydrophobicContact CB-CB 4.15Å; F352-H357 HydrophobicContact CD1-CB 3.99Å; F352-H357 HydrophobicContact CG-CB 4.39Å; F352-L358 HydrophobicContact CB-CB 4.19Å; F352-L358 HydrophobicContact CD2-CB 4.18Å; F352-L358 HydrophobicContact CD2-CD1 3.93Å; F352-L358 HydrophobicContact CE2-CD1 4.32Å; F352-L358 HydrophobicContact CG-CB 4.33Å; F352-H361 HydrophobicContact CE1-CB 3.98Å; F352-H361 HydrophobicContact CE2-CB 3.99Å; F352-H361 AromaticContact CE2-CD2 3.13Å; F352-H361 WeakPolarHBondContact CE2-CD2 3.27Å; F352-H361 AromaticContact CE2-CG 3.68Å; F352-H361 AromaticContact CE2-NE2 3.91Å; F352-H361 HydrophobicContact CZ-CB 3.57Å; F352-H361 AromaticContact CZ-CD2 3.22Å; F352-H361 WeakPolarHBondContact CZ-CD2 3.41Å; F352-H361 AromaticContact CZ-CG 3.3Å; F352-H361 AromaticContact CZ-NE2 3.93Å
353	R	84.9	Confident	83	Confident	138 Å²	138	69.6 Å²	69.6	52%	0.521	36%	0.361	S	S	.	.	S	Bend	trans	-73	-17.5	-176.3	-166.6	-171.7	64.5	-172.3	-3.5	113.8
354	D	82.8	Confident	83	Confident	43 Å²	43	70.5 Å²	70.5	23%	0.23	37%	0.369	C	S	.	.	S	Bend	trans	-162.5	157.9	-177.1	53.8	74.4	0	0	0	111	F352 Y356 H357 L358	F352-D354 VanDerWaalsContact C-N 3.27Å; F352-D354 PolarHBondContact O-N 3.41Å; D354-Y356 VanDerWaalsContact C-N 3.28Å; D354-Y356 PolarHBondContact O-N 2.81Å; D354-Y356 PolarHBondContact OD1-N 3.27Å; D354-H357 VanDerWaalsContact CG-ND1 3.29Å; D354-H357 PolarHBondContact O-N 3.43Å; D354-H357 WeakPolarHBondContact OD1-CB 3.32Å; D354-H357 IonicContact OD1-CE1 3.58Å; D354-H357 IonicContact OD1-CG 2.75Å; D354-H357 PolarHBondContact OD1-N 2.88Å; D354-H357 IonicContact OD1-ND1 3.57Å; D354-H357 PolarHBondContact OD1-ND1 2.89Å; D354-H357 IonicContact OD2-CE1 2.71Å; D354-H357 IonicContact OD2-CG 3.07Å; D354-H357 IonicContact OD2-ND1 3.14Å; D354-H357 PolarHBondContact OD2-ND1 3.39Å; D354-H357 VanDerWaalsContact OD2-ND1 3.11Å; D354-L358 PolarHBondContact O-N 3.07Å
355	V	83.3	Confident	82.8	Confident	81 Å²	81	72.5 Å²	72.5	49%	0.491	37%	0.37	S	S	.	.	H	α-helix	trans	-62	-32.9	-177.6	-179.4	0	0	0	0	112.2	V343 L358 N359	V343-V355 HydrophobicContact CG2-CG2 3.93Å; V355-L358 WeakPolarHBondContact O-CB 3.12Å; V355-L358 PolarHBondContact O-N 3Å; V355-N359 PolarHBondContact O-N 2.83Å
356	Y	81.5	Confident	82.1	Confident	163 Å²	163	75.4 Å²	75.4	64%	0.639	39%	0.39	S	S	*	.	H	α-helix	trans	-63.6	-43.9	177.7	171.4	-98	0	0	0	111.7	D354 L358 R360	D354-Y356 VanDerWaalsContact C-N 3.28Å; D354-Y356 PolarHBondContact O-N 2.81Å; D354-Y356 PolarHBondContact OD1-N 3.27Å; Y356-L358 VanDerWaalsContact C-N 3.33Å; Y356-R360 VanDerWaalsContact O-CB 3.3Å; Y356-R360 WeakPolarHBondContact O-CB 3.14Å; Y356-R360 PolarHBondContact O-N 2.99Å
357	H	82.1	Confident	81.6	Confident	49 Å²	49	71.1 Å²	71.1	23%	0.227	38%	0.377	C	S	.	.	H	α-helix	trans	-65.4	-35.4	174.2	-80	78.3	0	0	0	112.6	F352 D354 R360 H361	F352-H357 HydrophobicContact CB-CB 4.15Å; F352-H357 HydrophobicContact CD1-CB 3.99Å; F352-H357 HydrophobicContact CG-CB 4.39Å; D354-H357 VanDerWaalsContact CG-ND1 3.29Å; D354-H357 PolarHBondContact O-N 3.43Å; D354-H357 WeakPolarHBondContact OD1-CB 3.32Å; D354-H357 IonicContact OD1-CE1 3.58Å; D354-H357 IonicContact OD1-CG 2.75Å; D354-H357 PolarHBondContact OD1-N 2.88Å; D354-H357 IonicContact OD1-ND1 3.57Å; D354-H357 PolarHBondContact OD1-ND1 2.89Å; D354-H357 IonicContact OD2-CE1 2.71Å; D354-H357 IonicContact OD2-CG 3.07Å; D354-H357 IonicContact OD2-ND1 3.14Å; D354-H357 PolarHBondContact OD2-ND1 3.39Å; D354-H357 VanDerWaalsContact OD2-ND1 3.11Å; H357-R360 PolarHBondContact CD2-NH1 3.42Å; H357-R360 VanDerWaalsContact CD2-NH1 3.27Å; H357-R360 PolarHBondContact CD2-NH2 2.78Å; H357-R360 PolarHBondContact NE2-NH1 3.47Å; H357-H361 WeakPolarHBondContact O-CB 3.06Å; H357-H361 PolarHBondContact O-N 3.27Å
358	L	85	Confident	81.1	Confident	7 Å²	7	71.4 Å²	71.4	4%	0.037	38%	0.376	C	S	.	.	H	α-helix	trans	-64.8	-52.8	172.8	171.7	59.6	0	0	0	112.1	V343 G344 C345 F352 D354 V355 Y356 R360 H361 K362	V343-L358 HydrophobicContact CB-CD2 3.9Å; V343-L358 HydrophobicContact CG1-CD2 3.42Å; V343-L358 VanDerWaalsContact CG1-CD2 3.42Å; G344-L358 WeakPolarHBondContact O-CD1 3.42Å; G344-L358 WeakPolarHBondContact O-CD2 3.24Å; C345-L358 HydrophobicContact CB-CD1 3.58Å; F352-L358 HydrophobicContact CB-CB 4.19Å; F352-L358 HydrophobicContact CD2-CB 4.18Å; F352-L358 HydrophobicContact CD2-CD1 3.93Å; F352-L358 HydrophobicContact CE2-CD1 4.32Å; F352-L358 HydrophobicContact CG-CB 4.33Å; D354-L358 PolarHBondContact O-N 3.07Å; V355-L358 WeakPolarHBondContact O-CB 3.12Å; V355-L358 PolarHBondContact O-N 3Å; Y356-L358 VanDerWaalsContact C-N 3.33Å; L358-R360 VanDerWaalsContact C-N 3.29Å; L358-R360 PolarHBondContact O-N 3.08Å; L358-H361 CarbonylContact O-C 3.52Å; L358-H361 VanDerWaalsContact O-CA 3.29Å; L358-H361 WeakPolarHBondContact O-CA 3.28Å; L358-H361 WeakPolarHBondContact O-CB 3.47Å; L358-H361 PolarHBondContact O-N 3.23Å; L358-K362 HydrophobicContact CD1-CD 4.49Å; L358-K362 HydrophobicContact CD1-CG 4.08Å; L358-K362 HydrophobicContact CG-CD 4.49Å; L358-K362 HydrophobicContact CG-CG 4.42Å; L358-K362 PolarHBondContact O-N 3.48Å
359	N	80.9	Confident	80.9	Confident	89 Å²	89	73.8 Å²	73.8	48%	0.476	38%	0.381	S	S	.	.	H	α-helix	trans	-62.1	-38.8	-178.7	-73.8	-0.7	0	0	0	111.4	V355 H361 K362 L363	V355-N359 PolarHBondContact O-N 2.83Å; N359-H361 PolarHBondContact O-N 3.17Å; N359-K362 PolarHBondContact O-N 3.01Å; N359-L363 PolarHBondContact O-N 3.31Å
360	R	80.4	Confident	80.7	Confident	88 Å²	88	74.1 Å²	74.1	33%	0.332	37%	0.372	S	S	.	.	H	α-helix	trans	-62.2	-22.4	171.3	-162.2	-170.6	73.9	-152.3	-0.5	113.2	Y356 H357 L358	Y356-R360 VanDerWaalsContact O-CB 3.3Å; Y356-R360 WeakPolarHBondContact O-CB 3.14Å; Y356-R360 PolarHBondContact O-N 2.99Å; H357-R360 PolarHBondContact CD2-NH1 3.42Å; H357-R360 VanDerWaalsContact CD2-NH1 3.27Å; H357-R360 PolarHBondContact CD2-NH2 2.78Å; H357-R360 PolarHBondContact NE2-NH1 3.47Å; L358-R360 VanDerWaalsContact C-N 3.29Å; L358-R360 PolarHBondContact O-N 3.08Å
361	H	83.6	Confident	80.5	Confident	27 Å²	27	72.8 Å²	72.8	13%	0.125	37%	0.365	C	S	.	.	H	α-helix	trans	-92.2	-29.8	173.1	170.7	57.1	0	0	0	113.2	C345 C348 F352 H357 L358 N359 L363 S364 H365	C345-H361 PolarHBondContact SG-CD2 3.45Å; C345-H361 PolarHBondContact SG-NE2 3.23Å; C345-H361 VanDerWaalsContact SG-NE2 3.44Å; C348-H361 PolarHBondContact SG-NE2 2.84Å; F352-H361 HydrophobicContact CE1-CB 3.98Å; F352-H361 HydrophobicContact CE2-CB 3.99Å; F352-H361 AromaticContact CE2-CD2 3.13Å; F352-H361 WeakPolarHBondContact CE2-CD2 3.27Å; F352-H361 AromaticContact CE2-CG 3.68Å; F352-H361 AromaticContact CE2-NE2 3.91Å; F352-H361 HydrophobicContact CZ-CB 3.57Å; F352-H361 AromaticContact CZ-CD2 3.22Å; F352-H361 WeakPolarHBondContact CZ-CD2 3.41Å; F352-H361 AromaticContact CZ-CG 3.3Å; F352-H361 AromaticContact CZ-NE2 3.93Å; H357-H361 WeakPolarHBondContact O-CB 3.06Å; H357-H361 PolarHBondContact O-N 3.27Å; L358-H361 CarbonylContact O-C 3.52Å; L358-H361 VanDerWaalsContact O-CA 3.29Å; L358-H361 WeakPolarHBondContact O-CA 3.28Å; L358-H361 WeakPolarHBondContact O-CB 3.47Å; L358-H361 PolarHBondContact O-N 3.23Å; N359-H361 PolarHBondContact O-N 3.17Å; H361-L363 VanDerWaalsContact C-N 3.25Å; H361-L363 PolarHBondContact O-N 3.32Å; H361-S364 PolarHBondContact CE1-OG 2.83Å; H361-S364 VanDerWaalsContact CE1-OG 3.26Å; H361-S364 PolarHBondContact ND1-OG 2.85Å; H361-S364 WeakPolarHBondContact O-CA 3.49Å; H361-S364 WeakPolarHBondContact O-CB 3.44Å; H361-S364 PolarHBondContact O-N 2.98Å; H361-S364 PolarHBondContact O-OG 3.38Å; H361-H365 AromaticContact CE1-CD2 3.94Å; H361-H365 AromaticContact CE1-NE2 3.37Å; H361-H365 PolarHBondContact CE1-NE2 2.86Å; H361-H365 AromaticContact NE2-CD2 3.86Å; H361-H365 AromaticContact NE2-NE2 3.24Å; H361-H365 PolarHBondContact NE2-NE2 2.89Å
362	K	81.1	Confident	80.4	Confident	70 Å²	70	70.4 Å²	70.4	30%	0.304	36%	0.355	S	S	.	.	H	α-helix	trans	-59	-38	170.3	-72	-170.3	171.6	-170.2	0	111.5	D346 L358 N359 S364 H365 S366	D346-K362 WeakPolarHBondContact OD2-CE 3.34Å; D346-K362 IonicContact OD2-NZ 3.42Å; D346-K362 PolarHBondContact OD2-NZ 2.92Å; L358-K362 HydrophobicContact CD1-CD 4.49Å; L358-K362 HydrophobicContact CD1-CG 4.08Å; L358-K362 HydrophobicContact CG-CD 4.49Å; L358-K362 HydrophobicContact CG-CG 4.42Å; L358-K362 PolarHBondContact O-N 3.48Å; N359-K362 PolarHBondContact O-N 3.01Å; K362-S364 PolarHBondContact O-N 2.73Å; K362-H365 WeakPolarHBondContact O-CB 3.44Å; K362-H365 PolarHBondContact O-N 3.06Å; K362-S366 PolarHBondContact O-N 2.99Å; K362-S366 VanDerWaalsContact O-N 3.13Å; K362-S366 PolarHBondContact O-OG 3.23Å
363	L	79.9	Confident	80.3	Confident	38 Å²	38	68.6 Å²	68.6	20%	0.199	35%	0.347	C	S	.	.	H	α-helix	trans	-52.2	-25.5	166.6	-73.2	174	0	0	0	114.1	N359 H361 E368 P370 K381	N359-L363 PolarHBondContact O-N 3.31Å; H361-L363 VanDerWaalsContact C-N 3.25Å; H361-L363 PolarHBondContact O-N 3.32Å; L363-E368 HydrophobicContact CD2-CB 3.95Å; L363-P370 HydrophobicContact CD2-CG 4.1Å; L363-K381 VanDerWaalsContact O-CD 3.31Å; L363-K381 WeakPolarHBondContact O-CD 3.39Å; L363-K381 WeakPolarHBondContact O-CE 3.3Å; L363-K381 PolarHBondContact O-NZ 3.41Å
364	S	78.9	Confident	79.9	Confident	59 Å²	59	67.4 Å²	67.4	41%	0.413	36%	0.357	S	S	.	.	H	α-helix	trans	-71.2	-33.8	175.8	76.8	0	0	0	0	112.3	H361 K362 K381	H361-S364 PolarHBondContact CE1-OG 2.83Å; H361-S364 VanDerWaalsContact CE1-OG 3.26Å; H361-S364 PolarHBondContact ND1-OG 2.85Å; H361-S364 WeakPolarHBondContact O-CA 3.49Å; H361-S364 WeakPolarHBondContact O-CB 3.44Å; H361-S364 PolarHBondContact O-N 2.98Å; H361-S364 PolarHBondContact O-OG 3.38Å; K362-S364 PolarHBondContact O-N 2.73Å; S364-K381 PolarHBondContact O-NZ 3.19Å; S364-K381 VanDerWaalsContact O-NZ 3.12Å
365	H	78.4	Confident	79.7	Confident	72 Å²	72	69.8 Å²	69.8	33%	0.333	37%	0.373	S	S	.	.	H	α-helix	trans	-81	-48.1	178.9	-67.3	-70.6	0	0	0	113.4	I347 C348 H361 K362 G367	I347-H365 HydrophobicContact CD1-CB 3.74Å; I347-H365 HydrophobicContact CG2-CB 4.18Å; I347-H365 WeakPolarHBondContact CG2-ND1 3.45Å; C348-H365 VanDerWaalsContact SG-CE1 3.56Å; C348-H365 PolarHBondContact SG-NE2 2.91Å; H361-H365 AromaticContact CE1-CD2 3.94Å; H361-H365 AromaticContact CE1-NE2 3.37Å; H361-H365 PolarHBondContact CE1-NE2 2.86Å; H361-H365 AromaticContact NE2-CD2 3.86Å; H361-H365 AromaticContact NE2-NE2 3.24Å; H361-H365 PolarHBondContact NE2-NE2 2.89Å; K362-H365 WeakPolarHBondContact O-CB 3.44Å; K362-H365 PolarHBondContact O-N 3.06Å; H365-G367 PolarHBondContact O-N 3.24Å
366	S	72.9	Confident	79.6	Confident	62 Å²	62	69 Å²	69	43%	0.434	37%	0.371	S	S	.	.	S	Bend	trans	-65.5	-2.3	-177	58.6	0	0	0	0	114.6	K362 E368	K362-S366 PolarHBondContact O-N 2.99Å; K362-S366 VanDerWaalsContact O-N 3.13Å; K362-S366 PolarHBondContact O-OG 3.23Å; S366-E368 WeakPolarHBondContact CB-OE2 3.47Å; S366-E368 PolarHBondContact O-N 3.28Å; S366-E368 WeakPolarHBondContact OG-CG 3.5Å; S366-E368 PolarHBondContact OG-OE2 3.26Å
367	G	71.2	Confident	79.6	Confident	40 Å²	40	63.5 Å²	63.5	41%	0.412	36%	0.364	S	S	.	.			trans	74.1	-30	-174.6	0	0	0	0	0	114	H365 K369 K381	H365-G367 PolarHBondContact O-N 3.24Å; G367-K369 VanDerWaalsContact O-CG 3.31Å; G367-K369 WeakPolarHBondContact O-CG 3.32Å; G367-K381 VanDerWaalsContact C-NZ 3.35Å; G367-K381 WeakPolarHBondContact O-CE 3.36Å; G367-K381 PolarHBondContact O-NZ 3.22Å
368	E	72.3	Confident	79.7	Confident	111 Å²	111	65.2 Å²	65.2	52%	0.519	37%	0.374	S	S	.	.			trans	-43.5	137.5	-171.5	-67.1	169.8	129.3	0	0	114.7	L363 S366 K381	L363-E368 HydrophobicContact CD2-CB 3.95Å; S366-E368 WeakPolarHBondContact CB-OE2 3.47Å; S366-E368 PolarHBondContact O-N 3.28Å; S366-E368 WeakPolarHBondContact OG-CG 3.5Å; S366-E368 PolarHBondContact OG-OE2 3.26Å; E368-K381 WeakPolarHBondContact O-CE 3.39Å; E368-K381 WeakPolarHBondContact O-CG 3.39Å
369	K	79.6	Confident	79.6	Confident	99 Å²	99	71.5 Å²	71.5	43%	0.43	40%	0.397	S	S	.	.			trans	-133.6	83	179.7	-52.4	-166.2	-161.2	166.1	0	108.4	G367 Y371 R379 F380 K381	G367-K369 VanDerWaalsContact O-CG 3.31Å; G367-K369 WeakPolarHBondContact O-CG 3.32Å; K369-Y371 PolarHBondContact O-N 3.36Å; K369-R379 HydrophobicContact CB-CB 3.42Å; K369-R379 VanDerWaalsContact CB-CB 3.42Å; K369-R379 HydrophobicContact CD-CB 4.1Å; K369-R379 WeakPolarHBondContact CD-O 3.15Å; K369-R379 HydrophobicContact CG-CB 4.36Å; K369-R379 PolarHBondContact O-NE 2.64Å; K369-R379 PolarHBondContact O-NH2 2.96Å; K369-F380 CarbonylContact C-O 3.58Å; K369-F380 VanDerWaalsContact C-O 3.31Å; K369-F380 WeakPolarHBondContact CA-O 3.25Å; K369-K381 HydrophobicContact CG-CG 4.09Å
370	P	79	Confident	79.7	Confident	66 Å²	66	69.2 Å²	69.2	43%	0.429	38%	0.383	S	S	.	.			trans	-62.1	-29.9	-171.7	-25.4	35.4	0	0	0	113.7	L363	L363-P370 HydrophobicContact CD2-CG 4.1Å
371	Y	80.3	Confident	79.7	Confident	92 Å²	92	68.2 Å²	68.2	36%	0.361	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	98.8	-168.6	-54.5	-75.5	0	0	0	111.4	K369 R379 F380 K383	K369-Y371 PolarHBondContact O-N 3.36Å; Y371-R379 CarbonylContact O-C 3.56Å; Y371-R379 WeakPolarHBondContact O-CA 3.48Å; Y371-F380 PolarHBondContact N-O 2.87Å; Y371-F380 PolarHBondContact O-N 2.87Å; Y371-K383 HydrophobicContact CD1-CB 3.85Å; Y371-K383 HydrophobicContact CD1-CG 4.2Å; Y371-K383 VanDerWaalsContact CD2-N 3.3Å; Y371-K383 HydrophobicContact CE1-CB 3.74Å; Y371-K383 HydrophobicContact CE1-CD 4.47Å; Y371-K383 HydrophobicContact CE1-CG 4.25Å; Y371-K383 HydrophobicContact CE2-CB 4.4Å; Y371-K383 HydrophobicContact CG-CB 4.25Å
372	A	84.8	Confident	79.5	Confident	45 Å²	45	71.1 Å²	71.1	37%	0.372	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	140.1	175.3	0	0	0	0	0	111.8	R379	A372-R379 HydrophobicContact CB-CG 4.05Å
373	C	83.3	Confident	79.4	Confident	2 Å²	2	74.6 Å²	74.6	1%	0.014	41%	0.406	C	S	.	.			trans	-72.4	124.9	169	-174.5	0	0	0	0	109.7	V375 G377 L378 F380	C373-V375 PolarHBondContact O-N 3.15Å; C373-G377 VanDerWaalsContact O-CA 3.25Å; C373-G377 WeakPolarHBondContact O-CA 3.25Å; C373-G377 PolarHBondContact O-N 3.29Å; C373-L378 HydrophobicContact CB-CB 4.46Å; C373-L378 VanDerWaalsContact CB-O 3.32Å; C373-L378 WeakPolarHBondContact CB-O 3.49Å; C373-L378 PolarHBondContact N-O 3.44Å; C373-F380 HydrophobicContact CB-CE2 4.4Å
374	P	77.2	Confident	79.3	Confident	112 Å²	112	75 Å²	75	73%	0.727	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-17.4	179.1	26.8	-35.6	0	0	0	114	V390	P374-V390 HydrophobicContact CG-CG2 4.31Å
375	V	78.4	Confident	79.3	Confident	93 Å²	93	76 Å²	76	56%	0.564	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-34.1	-176.2	-171.5	0	0	0	0	113	C373 H393	C373-V375 PolarHBondContact O-N 3.15Å; V375-H393 HydrophobicContact CB-CB 4.28Å; V375-H393 HydrophobicContact CG1-CB 3.87Å; V375-H393 HydrophobicContact CG2-CB 4.34Å
376	C	81.6	Confident	79.6	Confident	65 Å²	65	74.2 Å²	74.2	44%	0.439	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.5	10.9	-174.1	70.1	0	0	0	0	114.4	L378 H389 H393	C376-L378 PolarHBondContact O-N 3Å; C376-L378 WeakPolarHBondContact SG-CB 3.5Å; C376-H389 PolarHBondContact SG-NE2 2.86Å; C376-H393 VanDerWaalsContact SG-CE1 3.5Å; C376-H393 PolarHBondContact SG-NE2 3.14Å
377	G	80.6	Confident	79.9	Confident	48 Å²	48	73.5 Å²	73.5	50%	0.495	39%	0.391	S	S	.	.			trans	68	-14.7	-177.1	0	0	0	0	0	115.8	C373 R379	C373-G377 VanDerWaalsContact O-CA 3.25Å; C373-G377 WeakPolarHBondContact O-CA 3.25Å; C373-G377 PolarHBondContact O-N 3.29Å; G377-R379 VanDerWaalsContact O-CG 3.23Å; G377-R379 WeakPolarHBondContact O-CG 3.09Å; G377-R379 PolarHBondContact O-N 3.13Å; G377-R379 VanDerWaalsContact O-N 3.15Å
378	L	84.8	Confident	80.1	Confident	84 Å²	84	74 Å²	74	44%	0.44	38%	0.381	S	S	.	.			trans	-56.2	121	-172.7	-177.6	59.6	0	0	0	111.4	C373 C376 F380	C373-L378 HydrophobicContact CB-CB 4.46Å; C373-L378 VanDerWaalsContact CB-O 3.32Å; C373-L378 WeakPolarHBondContact CB-O 3.49Å; C373-L378 PolarHBondContact N-O 3.44Å; C376-L378 PolarHBondContact O-N 3Å; C376-L378 WeakPolarHBondContact SG-CB 3.5Å; L378-F380 HydrophobicContact CB-CE2 4.19Å; L378-F380 HydrophobicContact CD2-CE2 4.18Å; L378-F380 HydrophobicContact CD2-CZ 3.75Å; L378-F380 HydrophobicContact CG-CE2 3.86Å; L378-F380 HydrophobicContact CG-CZ 3.9Å; L378-F380 VanDerWaalsContact O-CD2 3.25Å; L378-F380 WeakPolarHBondContact O-CD2 3.49Å; L378-F380 WeakPolarHBondContact O-CE2 3.49Å
379	R	83	Confident	80.5	Confident	139 Å²	139	70.5 Å²	70.5	53%	0.525	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	143.7	-172.4	-51.2	-175	69.9	134.8	2.9	112.4	K369 Y371 A372 G377	K369-R379 HydrophobicContact CB-CB 3.42Å; K369-R379 VanDerWaalsContact CB-CB 3.42Å; K369-R379 HydrophobicContact CD-CB 4.1Å; K369-R379 WeakPolarHBondContact CD-O 3.15Å; K369-R379 HydrophobicContact CG-CB 4.36Å; K369-R379 PolarHBondContact O-NE 2.64Å; K369-R379 PolarHBondContact O-NH2 2.96Å; Y371-R379 CarbonylContact O-C 3.56Å; Y371-R379 WeakPolarHBondContact O-CA 3.48Å; A372-R379 HydrophobicContact CB-CG 4.05Å; G377-R379 VanDerWaalsContact O-CG 3.23Å; G377-R379 WeakPolarHBondContact O-CG 3.09Å; G377-R379 PolarHBondContact O-N 3.13Å; G377-R379 VanDerWaalsContact O-N 3.15Å
380	F	82.4	Confident	80.3	Confident	41 Å²	41	67.8 Å²	67.8	18%	0.18	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	150.4	-177.8	-65.2	-92.4	0	0	0	112.7	K369 Y371 C373 L378 R382 R385 M386 H389	K369-F380 CarbonylContact C-O 3.58Å; K369-F380 VanDerWaalsContact C-O 3.31Å; K369-F380 WeakPolarHBondContact CA-O 3.25Å; Y371-F380 PolarHBondContact N-O 2.87Å; Y371-F380 PolarHBondContact O-N 2.87Å; C373-F380 HydrophobicContact CB-CE2 4.4Å; L378-F380 HydrophobicContact CB-CE2 4.19Å; L378-F380 HydrophobicContact CD2-CE2 4.18Å; L378-F380 HydrophobicContact CD2-CZ 3.75Å; L378-F380 HydrophobicContact CG-CE2 3.86Å; L378-F380 HydrophobicContact CG-CZ 3.9Å; L378-F380 VanDerWaalsContact O-CD2 3.25Å; L378-F380 WeakPolarHBondContact O-CD2 3.49Å; L378-F380 WeakPolarHBondContact O-CE2 3.49Å; F380-R382 VanDerWaalsContact C-N 3.25Å; F380-R382 PolarHBondContact O-N 3.13Å; F380-R385 HydrophobicContact CB-CB 4.47Å; F380-R385 HydrophobicContact CD1-CB 3.91Å; F380-R385 HydrophobicContact CG-CB 4.47Å; F380-M386 HydrophobicContact CB-CB 4.13Å; F380-M386 HydrophobicContact CD2-CB 3.88Å; F380-M386 HydrophobicContact CD2-CG 4.2Å; F380-M386 HydrophobicContact CG-CB 4.14Å; F380-H389 HydrophobicContact CE1-CB 4.15Å; F380-H389 HydrophobicContact CE2-CB 3.99Å; F380-H389 AromaticContact CE2-CD2 3.34Å; F380-H389 WeakPolarHBondContact CE2-CD2 3.36Å; F380-H389 AromaticContact CE2-CG 3.85Å; F380-H389 HydrophobicContact CZ-CB 3.53Å; F380-H389 AromaticContact CZ-CD2 3.34Å; F380-H389 WeakPolarHBondContact CZ-CD2 3.23Å; F380-H389 AromaticContact CZ-CG 3.41Å; F380-H389 VanDerWaalsContact CZ-CG 3.41Å
381	K	81.1	Confident	80	Confident	67 Å²	67	70 Å²	70	29%	0.291	36%	0.355	S	S	.	.	S	Bend	trans	-77.9	-3.3	175.4	-53.6	-155.3	168	-161.1	0	114	L363 S364 G367 E368 K369	L363-K381 VanDerWaalsContact O-CD 3.31Å; L363-K381 WeakPolarHBondContact O-CD 3.39Å; L363-K381 WeakPolarHBondContact O-CE 3.3Å; L363-K381 PolarHBondContact O-NZ 3.41Å; S364-K381 PolarHBondContact O-NZ 3.19Å; S364-K381 VanDerWaalsContact O-NZ 3.12Å; G367-K381 VanDerWaalsContact C-NZ 3.35Å; G367-K381 WeakPolarHBondContact O-CE 3.36Å; G367-K381 PolarHBondContact O-NZ 3.22Å; E368-K381 WeakPolarHBondContact O-CE 3.39Å; E368-K381 WeakPolarHBondContact O-CG 3.39Å; K369-K381 HydrophobicContact CG-CG 4.09Å
382	R	78.8	Confident	79.6	Confident	89 Å²	89	69.1 Å²	69.1	34%	0.336	36%	0.363	S	S	.	.	S	Bend	trans	-151.3	140.6	-177.6	-60.7	167.1	48.6	128.3	-6.7	112.2	F380 D384 R385 M386	F380-R382 VanDerWaalsContact C-N 3.25Å; F380-R382 PolarHBondContact O-N 3.13Å; R382-D384 WeakPolarHBondContact CB-OD1 3.46Å; R382-D384 IonicContact CZ-OD1 3.09Å; R382-D384 IonicContact CZ-OD2 3.87Å; R382-D384 IonicContact NE-OD1 2.67Å; R382-D384 PolarHBondContact NE-OD1 3.27Å; R382-D384 IonicContact NE-OD2 3.95Å; R382-D384 IonicContact NH2-OD1 2.65Å; R382-D384 PolarHBondContact NH2-OD1 3.05Å; R382-D384 IonicContact NH2-OD2 3.11Å; R382-D384 PolarHBondContact NH2-OD2 3.04Å; R382-D384 PolarHBondContact O-N 3.11Å; R382-R385 HydrophobicContact CB-CB 4.37Å; R382-R385 HydrophobicContact CB-CG 4.13Å; R382-R385 PolarHBondContact O-N 3.14Å; R382-M386 PolarHBondContact O-N 3.19Å; R382-M386 VanDerWaalsContact O-N 3.15Å
383	K	78.2	Confident	78.9	Confident	143 Å²	143	70.7 Å²	70.7	62%	0.622	36%	0.362	S	S	*	.	H	α-helix	trans	-60.4	-38.1	178.4	-167.8	175.5	-179.4	177.4	0	113.5	Y371 M386 S387	Y371-K383 HydrophobicContact CD1-CB 3.85Å; Y371-K383 HydrophobicContact CD1-CG 4.2Å; Y371-K383 VanDerWaalsContact CD2-N 3.3Å; Y371-K383 HydrophobicContact CE1-CB 3.74Å; Y371-K383 HydrophobicContact CE1-CD 4.47Å; Y371-K383 HydrophobicContact CE1-CG 4.25Å; Y371-K383 HydrophobicContact CE2-CB 4.4Å; Y371-K383 HydrophobicContact CG-CB 4.25Å; K383-M386 HydrophobicContact CG-CE 4.41Å; K383-M386 PolarHBondContact O-N 3.31Å; K383-S387 WeakPolarHBondContact O-CB 3.36Å; K383-S387 PolarHBondContact O-N 3.37Å
384	D	78.4	Confident	78	Confident	46 Å²	46	72.3 Å²	72.3	25%	0.246	37%	0.371	C	S	.	.	H	α-helix	trans	-64.3	-42.3	176.9	72	-48.8	0	0	0	111.7	R382 S387 Y388	R382-D384 WeakPolarHBondContact CB-OD1 3.46Å; R382-D384 IonicContact CZ-OD1 3.09Å; R382-D384 IonicContact CZ-OD2 3.87Å; R382-D384 IonicContact NE-OD1 2.67Å; R382-D384 PolarHBondContact NE-OD1 3.27Å; R382-D384 IonicContact NE-OD2 3.95Å; R382-D384 IonicContact NH2-OD1 2.65Å; R382-D384 PolarHBondContact NH2-OD1 3.05Å; R382-D384 IonicContact NH2-OD2 3.11Å; R382-D384 PolarHBondContact NH2-OD2 3.04Å; R382-D384 PolarHBondContact O-N 3.11Å; D384-S387 PolarHBondContact O-N 3.17Å; D384-Y388 HydrophobicContact CB-CD2 4.48Å; D384-Y388 HydrophobicContact CB-CE2 4.29Å; D384-Y388 WeakPolarHBondContact O-CD2 3.4Å; D384-Y388 PolarHBondContact O-N 3.08Å
385	R	78.9	Confident	77.1	Confident	79 Å²	79	70.6 Å²	70.6	30%	0.298	37%	0.373	S	S	.	.	H	α-helix	trans	-67.3	-37.9	179.1	-62.8	-53.6	-169.5	-132.2	17.3	112.3	F380 R382 H389 R412	F380-R385 HydrophobicContact CB-CB 4.47Å; F380-R385 HydrophobicContact CD1-CB 3.91Å; F380-R385 HydrophobicContact CG-CB 4.47Å; R382-R385 HydrophobicContact CB-CB 4.37Å; R382-R385 HydrophobicContact CB-CG 4.13Å; R382-R385 PolarHBondContact O-N 3.14Å; R385-H389 WeakPolarHBondContact O-CB 3.33Å; R385-H389 PolarHBondContact O-N 3.43Å; R385-R412 VanDerWaalsContact NH2-NH2 3.11Å
386	M	85	Confident	75.7	Confident	35 Å²	35	69.4 Å²	69.4	17%	0.172	37%	0.369	C	S	.	.	H	α-helix	trans	-60.5	-49.7	169	-177.7	-154.6	77.1	0	0	111.1	F380 R382 K383 Y388 H389 V390	F380-M386 HydrophobicContact CB-CB 4.13Å; F380-M386 HydrophobicContact CD2-CB 3.88Å; F380-M386 HydrophobicContact CD2-CG 4.2Å; F380-M386 HydrophobicContact CG-CB 4.14Å; R382-M386 PolarHBondContact O-N 3.19Å; R382-M386 VanDerWaalsContact O-N 3.15Å; K383-M386 HydrophobicContact CG-CE 4.41Å; K383-M386 PolarHBondContact O-N 3.31Å; M386-Y388 PolarHBondContact O-N 3.36Å; M386-H389 CarbonylContact O-C 3.2Å; M386-H389 WeakPolarHBondContact O-CA 3.32Å; M386-H389 WeakPolarHBondContact O-CB 3.32Å; M386-H389 PolarHBondContact O-N 3.05Å; M386-V390 WeakPolarHBondContact O-CG2 3.14Å; M386-V390 PolarHBondContact O-N 3.1Å
387	S	78.4	Confident	74.3	Confident	48 Å²	48	69.6 Å²	69.6	34%	0.336	37%	0.368	S	S	.	.	H	α-helix	trans	-60.8	-43.1	-179.3	178.2	0	0	0	0	113.1	K383 D384 H389 V390 R391	K383-S387 WeakPolarHBondContact O-CB 3.36Å; K383-S387 PolarHBondContact O-N 3.37Å; D384-S387 PolarHBondContact O-N 3.17Å; S387-H389 PolarHBondContact O-N 3.04Å; S387-V390 PolarHBondContact O-N 2.83Å; S387-R391 WeakPolarHBondContact O-CG 3.36Å; S387-R391 PolarHBondContact O-N 3.25Å; S387-R391 VanDerWaalsContact O-N 3.15Å
388	Y	75.8	Confident	73.2	Confident	51 Å²	51	70 Å²	70	20%	0.2	37%	0.373	C	S	.	.	H	α-helix	trans	-65.7	-20.4	173.5	-71.9	-59.5	0	0	0	113.9	D384 M386 S411 R412	D384-Y388 HydrophobicContact CB-CD2 4.48Å; D384-Y388 HydrophobicContact CB-CE2 4.29Å; D384-Y388 WeakPolarHBondContact O-CD2 3.4Å; D384-Y388 PolarHBondContact O-N 3.08Å; M386-Y388 PolarHBondContact O-N 3.36Å; Y388-S411 VanDerWaalsContact CD1-O 3.27Å; Y388-S411 WeakPolarHBondContact CD1-O 3.41Å; Y388-S411 VanDerWaalsContact CE1-O 3.23Å; Y388-S411 WeakPolarHBondContact CE1-O 2.99Å; Y388-R412 HydrophobicContact CD1-CG 3.61Å; Y388-R412 HydrophobicContact CD2-CG 3.83Å; Y388-R412 HydrophobicContact CE1-CG 3.68Å; Y388-R412 HydrophobicContact CE2-CG 3.89Å; Y388-R412 HydrophobicContact CG-CG 3.71Å
389	H	81.5	Confident	72.4	Confident	37 Å²	37	72.2 Å²	72.2	17%	0.171	38%	0.378	C	S	.	.	H	α-helix	trans	-90.1	-32.5	175.2	173.2	59.8	0	0	0	112.9	C376 F380 R385 M386 S387 R391 S392 H393	C376-H389 PolarHBondContact SG-NE2 2.86Å; F380-H389 HydrophobicContact CE1-CB 4.15Å; F380-H389 HydrophobicContact CE2-CB 3.99Å; F380-H389 AromaticContact CE2-CD2 3.34Å; F380-H389 WeakPolarHBondContact CE2-CD2 3.36Å; F380-H389 AromaticContact CE2-CG 3.85Å; F380-H389 HydrophobicContact CZ-CB 3.53Å; F380-H389 AromaticContact CZ-CD2 3.34Å; F380-H389 WeakPolarHBondContact CZ-CD2 3.23Å; F380-H389 AromaticContact CZ-CG 3.41Å; F380-H389 VanDerWaalsContact CZ-CG 3.41Å; R385-H389 WeakPolarHBondContact O-CB 3.33Å; R385-H389 PolarHBondContact O-N 3.43Å; M386-H389 CarbonylContact O-C 3.2Å; M386-H389 WeakPolarHBondContact O-CA 3.32Å; M386-H389 WeakPolarHBondContact O-CB 3.32Å; M386-H389 PolarHBondContact O-N 3.05Å; S387-H389 PolarHBondContact O-N 3.04Å; H389-R391 PolarHBondContact O-N 3.22Å; H389-S392 PolarHBondContact ND1-OG 3.23Å; H389-S392 VanDerWaalsContact ND1-OG 3.13Å; H389-S392 PolarHBondContact O-N 3.16Å; H389-S392 PolarHBondContact O-OG 3.24Å; H389-H393 AromaticContact CD2-NE2 3.73Å; H389-H393 AromaticContact CE1-CE1 3.79Å; H389-H393 AromaticContact CE1-NE2 3.23Å; H389-H393 PolarHBondContact CE1-NE2 2.83Å; H389-H393 AromaticContact NE2-CD2 3.96Å; H389-H393 AromaticContact NE2-CE1 3.8Å; H389-H393 AromaticContact NE2-NE2 2.99Å; H389-H393 PolarHBondContact NE2-NE2 3.3Å; H389-H393 PolarHBondContact O-CD2 2.75Å
390	V	75.4	Confident	71.6	Confident	42 Å²	42	69.1 Å²	69.1	26%	0.255	38%	0.376	S	S	.	.	H	α-helix	trans	-56.1	-44.7	166.8	175.9	0	0	0	0	109.4	P374 M386 S387 S392 H393	P374-V390 HydrophobicContact CG-CG2 4.31Å; M386-V390 WeakPolarHBondContact O-CG2 3.14Å; M386-V390 PolarHBondContact O-N 3.1Å; S387-V390 PolarHBondContact O-N 2.83Å; V390-S392 PolarHBondContact O-N 3.19Å; V390-H393 PolarHBondContact O-N 3.41Å
391	R	73	Confident	71.1	Confident	112 Å²	112	70.8 Å²	70.8	42%	0.423	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	25.7	168.4	-64.5	175.6	170.8	-179.3	-4.8	115.6	S387 H389 D394 V397	S387-R391 WeakPolarHBondContact O-CG 3.36Å; S387-R391 PolarHBondContact O-N 3.25Å; S387-R391 VanDerWaalsContact O-N 3.15Å; H389-R391 PolarHBondContact O-N 3.22Å; R391-D394 WeakPolarHBondContact CA-OD2 3.4Å; R391-V397 HydrophobicContact CG-CG1 4.29Å
392	S	71.6	Confident	70.8	Confident	74 Å²	74	71.3 Å²	71.3	52%	0.517	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.3	-6.3	166.9	64	0	0	0	0	113.4	H389 V390	H389-S392 PolarHBondContact ND1-OG 3.23Å; H389-S392 VanDerWaalsContact ND1-OG 3.13Å; H389-S392 PolarHBondContact O-N 3.16Å; H389-S392 PolarHBondContact O-OG 3.24Å; V390-S392 PolarHBondContact O-N 3.19Å
393	H	70.5	Confident	71	Confident	77 Å²	77	67.1 Å²	67.1	36%	0.356	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	-33.4	170.3	-65.6	-73.2	0	0	0	112.6	V375 C376 H389 V390 G395	V375-H393 HydrophobicContact CB-CB 4.28Å; V375-H393 HydrophobicContact CG1-CB 3.87Å; V375-H393 HydrophobicContact CG2-CB 4.34Å; C376-H393 VanDerWaalsContact SG-CE1 3.5Å; C376-H393 PolarHBondContact SG-NE2 3.14Å; H389-H393 AromaticContact CD2-NE2 3.73Å; H389-H393 AromaticContact CE1-CE1 3.79Å; H389-H393 AromaticContact CE1-NE2 3.23Å; H389-H393 PolarHBondContact CE1-NE2 2.83Å; H389-H393 AromaticContact NE2-CD2 3.96Å; H389-H393 AromaticContact NE2-CE1 3.8Å; H389-H393 AromaticContact NE2-NE2 2.99Å; H389-H393 PolarHBondContact NE2-NE2 3.3Å; H389-H393 PolarHBondContact O-CD2 2.75Å; V390-H393 PolarHBondContact O-N 3.41Å; H393-G395 VanDerWaalsContact C-N 3.28Å; H393-G395 PolarHBondContact O-N 3.17Å
394	D	64	Low	71	Confident	37 Å²	37	69.7 Å²	69.7	20%	0.198	39%	0.389	C	S	.	.	S	Bend	trans	-66	-29.3	-179	48.8	28	0	0	0	113.4	R102 R391 S396 V397	R102-D394 PolarHBondContact NH1-O 3.41Å; R102-D394 PolarHBondContact NH2-O 3.11Å; R391-D394 WeakPolarHBondContact CA-OD2 3.4Å; D394-S396 PolarHBondContact O-N 2.65Å; D394-S396 PolarHBondContact O-OG 3.03Å; D394-V397 HydrophobicContact CB-CG2 4.3Å; D394-V397 WeakPolarHBondContact OD2-CG2 3.4Å
395	G	58.8	Low	70.9	Confident	75 Å²	75	71.1 Å²	71.1	77%	0.773	40%	0.403	S	S	*	.	S	Bend	trans	70.7	-27.6	177	0	0	0	0	0	114.6	H393	H393-G395 VanDerWaalsContact C-N 3.28Å; H393-G395 PolarHBondContact O-N 3.17Å
396	S	47.1	Very low	70.8	Confident	68 Å²	68	70 Å²	70	48%	0.476	41%	0.406	S	S	.	.			trans	-103.3	-12	-171.8	66	0	0	0	0	114.6	R102 D394 G398	R102-S396 PolarHBondContact NH1-OG 3.33Å; D394-S396 PolarHBondContact O-N 2.65Å; D394-S396 PolarHBondContact O-OG 3.03Å; S396-G398 VanDerWaalsContact C-N 3.26Å; S396-G398 PolarHBondContact O-N 3.39Å
397	V	53.3	Low	70.3	Confident	70 Å²	70	71.1 Å²	71.1	42%	0.424	43%	0.427	S	S	.	.	S	Bend	trans	-74.6	89.3	175.2	176.5	0	0	0	0	108.1	R391 D394 K399	R391-V397 HydrophobicContact CG-CG1 4.29Å; D394-V397 HydrophobicContact CB-CG2 4.3Å; D394-V397 WeakPolarHBondContact OD2-CG2 3.4Å; V397-K399 PolarHBondContact O-N 3.06Å
398	G	58.3	Low	70.1	Confident	57 Å²	57	74.8 Å²	74.8	59%	0.588	44%	0.437	S	S	*	.			trans	-47.9	127.2	-173.3	0	0	0	0	0	112.1	S396 P400	S396-G398 VanDerWaalsContact C-N 3.26Å; S396-G398 PolarHBondContact O-N 3.39Å; G398-P400 WeakPolarHBondContact O-CD 3.38Å
399	K	66.7	Low	70.2	Confident	129 Å²	129	72.9 Å²	72.9	56%	0.561	43%	0.433	S	S	*	.			trans	-41.8	95.9	175.9	-70.8	150.1	153.3	-153.8	0	111.8	V397 Y401 G409 F410	V397-K399 PolarHBondContact O-N 3.06Å; K399-Y401 PolarHBondContact O-N 2.85Å; K399-Y401 VanDerWaalsContact O-N 3.11Å; K399-G409 VanDerWaalsContact CB-C 3.47Å; K399-G409 VanDerWaalsContact CD-O 3.23Å; K399-G409 WeakPolarHBondContact CD-O 3.43Å; K399-G409 WeakPolarHBondContact CE-O 3.29Å; K399-G409 PolarHBondContact NZ-O 3.31Å; K399-F410 CarbonylContact C-O 3.4Å
400	P	66.6	Low	70	Confident	74 Å²	74	73.3 Å²	73.3	48%	0.481	43%	0.434	S	S	.	.	S	Bend	trans	-79.2	-6.4	-160.4	29.9	-33.3	0	0	0	113.2	G398	G398-P400 WeakPolarHBondContact O-CD 3.38Å
401	Y	71.2	Confident	69.9	Low	76 Å²	76	73.6 Å²	73.6	30%	0.298	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	81.9	176.5	-53.9	-73.3	0	0	0	109	K399 F410 P413	K399-Y401 PolarHBondContact O-N 2.85Å; K399-Y401 VanDerWaalsContact O-N 3.11Å; Y401-F410 PolarHBondContact N-O 2.87Å; Y401-F410 PolarHBondContact O-N 3.07Å; Y401-P413 HydrophobicContact CD1-CB 3.81Å; Y401-P413 HydrophobicContact CD2-CB 4.44Å; Y401-P413 HydrophobicContact CE1-CB 3.73Å; Y401-P413 HydrophobicContact CE1-CG 4.23Å; Y401-P413 HydrophobicContact CE2-CB 4.35Å; Y401-P413 VanDerWaalsContact CE2-CD 3.45Å; Y401-P413 HydrophobicContact CE2-CG 4.28Å; Y401-P413 HydrophobicContact CG-CB 4.16Å
402	V	76.3	Confident	70	Confident	78 Å²	78	70.3 Å²	70.3	47%	0.473	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	133.1	179	-176.2	0	0	0	0	111.1	Q404	V402-Q404 PolarHBondContact O-N 3.2Å
403	C	83	Confident	70.1	Confident	1 Å²	1	69.4 Å²	69.4	1%	0.007	42%	0.418	C	S	.	.			trans	-76.5	105.7	169.9	-171.5	0	0	0	0	110.4	S405 C406 G407 K408 F410 L416 H419 H424	C403-S405 PolarHBondContact O-N 2.72Å; C403-S405 VanDerWaalsContact O-N 3.08Å; C403-C406 PolarHBondContact O-N 2.78Å; C403-C406 VanDerWaalsContact O-N 3.07Å; C403-G407 WeakPolarHBondContact O-CA 3.32Å; C403-G407 PolarHBondContact O-N 3.11Å; C403-K408 WeakPolarHBondContact CB-O 3.45Å; C403-K408 PolarHBondContact N-O 2.67Å; C403-F410 HydrophobicContact CB-CE2 4.43Å; C403-L416 HydrophobicContact CB-CD1 3.56Å; C403-H419 PolarHBondContact SG-NE2 3.49Å; C403-H419 VanDerWaalsContact SG-NE2 3.42Å; C403-H424 VanDerWaalsContact SG-CD2 3.58Å
404	Q	77.6	Confident	70.6	Confident	198 Å²	198	69.1 Å²	69.1	93%	0.925	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-30	175	-68	174.7	-19.7	0	0	112.6	V402	V402-Q404 PolarHBondContact O-N 3.2Å
405	S	75.2	Confident	71.3	Confident	76 Å²	76	71 Å²	71	53%	0.531	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-6.5	-178.9	-45.7	0	0	0	0	115.6	C403 H424	C403-S405 PolarHBondContact O-N 2.72Å; C403-S405 VanDerWaalsContact O-N 3.08Å; S405-H424 WeakPolarHBondContact CB-ND1 3.46Å; S405-H424 PolarHBondContact O-CE1 3.45Å
406	C	77.7	Confident	72.4	Confident	55 Å²	55	68.7 Å²	68.7	37%	0.372	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-158.7	14.2	173.4	67.6	0	0	0	0	116.5	C403 K408 H419 H424	C403-C406 PolarHBondContact O-N 2.78Å; C403-C406 VanDerWaalsContact O-N 3.07Å; C406-K408 PolarHBondContact O-N 3.45Å; C406-H419 PolarHBondContact SG-NE2 3.43Å; C406-H424 PolarHBondContact SG-NE2 2.82Å
407	G	73.6	Confident	74.1	Confident	58 Å²	58	69.2 Å²	69.2	60%	0.598	39%	0.394	S	S	*	.			trans	67.9	-2.1	-178.4	0	0	0	0	0	115.7	C403 G409	C403-G407 WeakPolarHBondContact O-CA 3.32Å; C403-G407 PolarHBondContact O-N 3.11Å; G407-G409 PolarHBondContact O-N 2.8Å; G407-G409 VanDerWaalsContact O-N 3.14Å
408	K	75.9	Confident	75.4	Confident	125 Å²	125	66.9 Å²	66.9	54%	0.543	38%	0.383	S	S	.	.			trans	-73.3	110.6	-176	-70.4	-179.6	-176.7	175.2	0	111.4	C403 C406 F410	C403-K408 WeakPolarHBondContact CB-O 3.45Å; C403-K408 PolarHBondContact N-O 2.67Å; C406-K408 PolarHBondContact O-N 3.45Å; K408-F410 HydrophobicContact CB-CE2 3.91Å; K408-F410 HydrophobicContact CB-CZ 4.16Å; K408-F410 VanDerWaalsContact O-CD2 3.28Å; K408-F410 WeakPolarHBondContact O-CD2 3.1Å; K408-F410 WeakPolarHBondContact O-CE2 3.39Å
409	G	77.1	Confident	76.6	Confident	11 Å²	11	65 Å²	65	11%	0.113	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	138.3	170	0	0	0	0	0	113.8	K399 G407	K399-G409 VanDerWaalsContact CB-C 3.47Å; K399-G409 VanDerWaalsContact CD-O 3.23Å; K399-G409 WeakPolarHBondContact CD-O 3.43Å; K399-G409 WeakPolarHBondContact CE-O 3.29Å; K399-G409 PolarHBondContact NZ-O 3.31Å; G407-G409 PolarHBondContact O-N 2.8Å; G407-G409 VanDerWaalsContact O-N 3.14Å
410	F	77.5	Confident	77.3	Confident	47 Å²	47	61.7 Å²	61.7	21%	0.206	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	147.5	169.5	-59.5	-90.7	0	0	0	111.2	K399 Y401 C403 K408 R412 H415 L416 H419	K399-F410 CarbonylContact C-O 3.4Å; Y401-F410 PolarHBondContact N-O 2.87Å; Y401-F410 PolarHBondContact O-N 3.07Å; C403-F410 HydrophobicContact CB-CE2 4.43Å; K408-F410 HydrophobicContact CB-CE2 3.91Å; K408-F410 HydrophobicContact CB-CZ 4.16Å; K408-F410 VanDerWaalsContact O-CD2 3.28Å; K408-F410 WeakPolarHBondContact O-CD2 3.1Å; K408-F410 WeakPolarHBondContact O-CE2 3.39Å; F410-R412 PolarHBondContact O-N 3.32Å; F410-H415 HydrophobicContact CB-CB 4.17Å; F410-H415 HydrophobicContact CD1-CB 4Å; F410-H415 HydrophobicContact CG-CB 4.34Å; F410-L416 HydrophobicContact CB-CB 4.31Å; F410-L416 HydrophobicContact CD2-CB 4.03Å; F410-L416 HydrophobicContact CD2-CD1 3.83Å; F410-L416 HydrophobicContact CE2-CD1 4.15Å; F410-L416 HydrophobicContact CG-CB 4.37Å; F410-H419 HydrophobicContact CE1-CB 3.92Å; F410-H419 HydrophobicContact CE2-CB 3.79Å; F410-H419 AromaticContact CE2-CD2 3.24Å; F410-H419 WeakPolarHBondContact CE2-CD2 3.48Å; F410-H419 AromaticContact CE2-CG 3.51Å; F410-H419 AromaticContact CE2-NE2 3.94Å; F410-H419 HydrophobicContact CZ-CB 3.41Å; F410-H419 VanDerWaalsContact CZ-CB 3.41Å; F410-H419 AromaticContact CZ-CD2 3.47Å; F410-H419 VanDerWaalsContact CZ-CD2 3.47Å; F410-H419 WeakPolarHBondContact CZ-CD2 3.42Å; F410-H419 AromaticContact CZ-CG 3.22Å; F410-H419 AromaticContact CZ-ND1 3.76Å
411	S	72.4	Confident	77.8	Confident	48 Å²	48	63 Å²	63	34%	0.336	35%	0.346	S	S	.	.	S	Bend	trans	-75.2	-10.7	175.7	54.3	0	0	0	0	113.9	Y388	Y388-S411 VanDerWaalsContact CD1-O 3.27Å; Y388-S411 WeakPolarHBondContact CD1-O 3.41Å; Y388-S411 VanDerWaalsContact CE1-O 3.23Å; Y388-S411 WeakPolarHBondContact CE1-O 2.99Å
412	R	75.1	Confident	78	Confident	43 Å²	43	64.3 Å²	64.3	16%	0.162	35%	0.354	C	S	.	.	S	Bend	trans	-138.5	143.5	-174.3	-83.2	166.3	54.9	-171.4	-8.2	112.6	R385 Y388 F410 D414 H415 L416	R385-R412 VanDerWaalsContact NH2-NH2 3.11Å; Y388-R412 HydrophobicContact CD1-CG 3.61Å; Y388-R412 HydrophobicContact CD2-CG 3.83Å; Y388-R412 HydrophobicContact CE1-CG 3.68Å; Y388-R412 HydrophobicContact CE2-CG 3.89Å; Y388-R412 HydrophobicContact CG-CG 3.71Å; F410-R412 PolarHBondContact O-N 3.32Å; R412-D414 IonicContact CZ-OD1 2.65Å; R412-D414 IonicContact CZ-OD2 3.41Å; R412-D414 IonicContact NE-OD1 3.87Å; R412-D414 PolarHBondContact NE-OD1 2.94Å; R412-D414 IonicContact NE-OD2 2.72Å; R412-D414 VanDerWaalsContact NH2-CG 3.32Å; R412-D414 IonicContact NH2-OD1 3.58Å; R412-D414 PolarHBondContact NH2-OD1 2.85Å; R412-D414 VanDerWaalsContact NH2-OD1 3.14Å; R412-D414 IonicContact NH2-OD2 2.78Å; R412-D414 PolarHBondContact NH2-OD2 2.93Å; R412-D414 PolarHBondContact O-N 2.68Å; R412-H415 HydrophobicContact CB-CB 4.16Å; R412-H415 PolarHBondContact NH1-NE2 3.4Å; R412-H415 VanDerWaalsContact NH1-NE2 3.19Å; R412-H415 PolarHBondContact NH2-CE1 3.35Å; R412-H415 PolarHBondContact O-N 2.83Å; R412-L416 PolarHBondContact O-N 3.46Å; R412-L416 VanDerWaalsContact O-N 3.12Å
413	P	75.4	Confident	78	Confident	54 Å²	54	64.7 Å²	64.7	35%	0.351	36%	0.357	S	S	.	.	H	α-helix	trans	-71.6	-31.7	-178.7	29.3	-32	0	0	0	111.8	Y401 H415 L416 N417	Y401-P413 HydrophobicContact CD1-CB 3.81Å; Y401-P413 HydrophobicContact CD2-CB 4.44Å; Y401-P413 HydrophobicContact CE1-CB 3.73Å; Y401-P413 HydrophobicContact CE1-CG 4.23Å; Y401-P413 HydrophobicContact CE2-CB 4.35Å; Y401-P413 VanDerWaalsContact CE2-CD 3.45Å; Y401-P413 HydrophobicContact CE2-CG 4.28Å; Y401-P413 HydrophobicContact CG-CB 4.16Å; P413-H415 VanDerWaalsContact C-N 3.28Å; P413-H415 PolarHBondContact O-N 3.43Å; P413-L416 PolarHBondContact O-N 2.85Å; P413-N417 WeakPolarHBondContact O-CB 3.28Å; P413-N417 PolarHBondContact O-N 3.4Å
414	D	79.8	Confident	77.6	Confident	71 Å²	71	67.6 Å²	67.6	38%	0.38	37%	0.37	S	S	.	.	H	α-helix	trans	-68.9	-28.5	176	72.1	-87	0	0	0	112.4	R412 G418	R412-D414 IonicContact CZ-OD1 2.65Å; R412-D414 IonicContact CZ-OD2 3.41Å; R412-D414 IonicContact NE-OD1 3.87Å; R412-D414 PolarHBondContact NE-OD1 2.94Å; R412-D414 IonicContact NE-OD2 2.72Å; R412-D414 VanDerWaalsContact NH2-CG 3.32Å; R412-D414 IonicContact NH2-OD1 3.58Å; R412-D414 PolarHBondContact NH2-OD1 2.85Å; R412-D414 VanDerWaalsContact NH2-OD1 3.14Å; R412-D414 IonicContact NH2-OD2 2.78Å; R412-D414 PolarHBondContact NH2-OD2 2.93Å; R412-D414 PolarHBondContact O-N 2.68Å; D414-G418 PolarHBondContact O-N 3.29Å
415	H	79.9	Confident	77.4	Confident	78 Å²	78	60.8 Å²	60.8	36%	0.361	34%	0.342	S	S	.	.	H	α-helix	trans	-75.7	-40.9	173.2	-68	-10.1	0	0	0	111.9	F410 R412 P413 G418 H419	F410-H415 HydrophobicContact CB-CB 4.17Å; F410-H415 HydrophobicContact CD1-CB 4Å; F410-H415 HydrophobicContact CG-CB 4.34Å; R412-H415 HydrophobicContact CB-CB 4.16Å; R412-H415 PolarHBondContact NH1-NE2 3.4Å; R412-H415 VanDerWaalsContact NH1-NE2 3.19Å; R412-H415 PolarHBondContact NH2-CE1 3.35Å; R412-H415 PolarHBondContact O-N 2.83Å; P413-H415 VanDerWaalsContact C-N 3.28Å; P413-H415 PolarHBondContact O-N 3.43Å; H415-G418 PolarHBondContact O-N 3.43Å; H415-H419 VanDerWaalsContact O-CB 3.32Å; H415-H419 WeakPolarHBondContact O-CB 3.35Å; H415-H419 PolarHBondContact O-N 3.28Å
416	L	81.3	Confident	76.8	Confident	26 Å²	26	63.6 Å²	63.6	14%	0.136	36%	0.356	C	S	.	.	H	α-helix	trans	-59.8	-49.9	171	173.6	62	0	0	0	111.7	C403 F410 R412 P413 G418 H419 I420	C403-L416 HydrophobicContact CB-CD1 3.56Å; F410-L416 HydrophobicContact CB-CB 4.31Å; F410-L416 HydrophobicContact CD2-CB 4.03Å; F410-L416 HydrophobicContact CD2-CD1 3.83Å; F410-L416 HydrophobicContact CE2-CD1 4.15Å; F410-L416 HydrophobicContact CG-CB 4.37Å; R412-L416 PolarHBondContact O-N 3.46Å; R412-L416 VanDerWaalsContact O-N 3.12Å; P413-L416 PolarHBondContact O-N 2.85Å; L416-G418 VanDerWaalsContact C-N 3.33Å; L416-G418 PolarHBondContact O-N 2.94Å; L416-H419 WeakPolarHBondContact O-CB 3.43Å; L416-H419 PolarHBondContact O-N 2.85Å; L416-H419 VanDerWaalsContact O-N 3.13Å; L416-I420 HydrophobicContact CD1-CD1 3.75Å; L416-I420 HydrophobicContact CD1-CG1 3.94Å; L416-I420 HydrophobicContact CD2-CD1 4.38Å; L416-I420 HydrophobicContact CG-CD1 3.8Å; L416-I420 HydrophobicContact CG-CG1 4.38Å; L416-I420 WeakPolarHBondContact O-CG1 3.19Å; L416-I420 PolarHBondContact O-N 2.88Å
417	N	82.2	Confident	76.3	Confident	79 Å²	79	67.8 Å²	67.8	42%	0.422	37%	0.37	S	S	.	.	H	α-helix	trans	-61.8	-40.7	179.5	-170.6	-12.8	0	0	0	111.5	P413 K421	P413-N417 WeakPolarHBondContact O-CB 3.28Å; P413-N417 PolarHBondContact O-N 3.4Å; N417-K421 WeakPolarHBondContact O-CB 3.4Å; N417-K421 WeakPolarHBondContact O-CG 3.35Å; N417-K421 PolarHBondContact O-N 3.25Å; N417-K421 VanDerWaalsContact O-N 3.12Å; N417-K421 WeakPolarHBondContact OD1-CD 3.18Å; N417-K421 WeakPolarHBondContact OD1-CE 3.35Å; N417-K421 PolarHBondContact OD1-NZ 3.07Å
418	G	81.3	Confident	76.1	Confident	20 Å²	20	70.4 Å²	70.4	21%	0.206	36%	0.362	C	S	.	.	H	α-helix	trans	-61.2	-43.3	171.8	0	0	0	0	0	112.9	D414 H415 L416 Q422	D414-G418 PolarHBondContact O-N 3.29Å; H415-G418 PolarHBondContact O-N 3.43Å; L416-G418 VanDerWaalsContact C-N 3.33Å; L416-G418 PolarHBondContact O-N 2.94Å; G418-Q422 VanDerWaalsContact O-CB 3.32Å; G418-Q422 WeakPolarHBondContact O-CB 3.26Å; G418-Q422 WeakPolarHBondContact O-CG 3.36Å; G418-Q422 PolarHBondContact O-N 3.47Å; G418-Q422 PolarHBondContact O-NE2 3.24Å
419	H	82.8	Confident	76	Confident	17 Å²	17	68.6 Å²	68.6	8%	0.079	36%	0.363	C	S	.	.	H	α-helix	trans	-66.4	-48.6	177.5	161.4	66.8	0	0	0	112.9	C403 C406 F410 H415 L416 K421 Q422 V423 H424	C403-H419 PolarHBondContact SG-NE2 3.49Å; C403-H419 VanDerWaalsContact SG-NE2 3.42Å; C406-H419 PolarHBondContact SG-NE2 3.43Å; F410-H419 HydrophobicContact CE1-CB 3.92Å; F410-H419 HydrophobicContact CE2-CB 3.79Å; F410-H419 AromaticContact CE2-CD2 3.24Å; F410-H419 WeakPolarHBondContact CE2-CD2 3.48Å; F410-H419 AromaticContact CE2-CG 3.51Å; F410-H419 AromaticContact CE2-NE2 3.94Å; F410-H419 HydrophobicContact CZ-CB 3.41Å; F410-H419 VanDerWaalsContact CZ-CB 3.41Å; F410-H419 AromaticContact CZ-CD2 3.47Å; F410-H419 VanDerWaalsContact CZ-CD2 3.47Å; F410-H419 WeakPolarHBondContact CZ-CD2 3.42Å; F410-H419 AromaticContact CZ-CG 3.22Å; F410-H419 AromaticContact CZ-ND1 3.76Å; H415-H419 VanDerWaalsContact O-CB 3.32Å; H415-H419 WeakPolarHBondContact O-CB 3.35Å; H415-H419 PolarHBondContact O-N 3.28Å; L416-H419 WeakPolarHBondContact O-CB 3.43Å; L416-H419 PolarHBondContact O-N 2.85Å; L416-H419 VanDerWaalsContact O-N 3.13Å; H419-K421 VanDerWaalsContact C-N 3.28Å; H419-K421 PolarHBondContact O-N 3.01Å; H419-Q422 PolarHBondContact O-N 3.15Å; H419-V423 WeakPolarHBondContact ND1-CG2 3.4Å; H419-V423 WeakPolarHBondContact O-CB 3.41Å; H419-V423 PolarHBondContact O-N 2.63Å; H419-H424 AromaticContact CE1-CD2 4Å; H419-H424 AromaticContact CE1-NE2 3.78Å; H419-H424 AromaticContact NE2-CD2 3.69Å; H419-H424 AromaticContact NE2-NE2 3.54Å
420	I	81.1	Confident	76	Confident	61 Å²	61	70.2 Å²	70.2	31%	0.313	37%	0.367	S	S	.	.	I	π-helix	trans	-53.7	-49.9	176.3	-69.8	168.1	0	0	0	109.4	L416 Q422 H424 T425	L416-I420 HydrophobicContact CD1-CD1 3.75Å; L416-I420 HydrophobicContact CD1-CG1 3.94Å; L416-I420 HydrophobicContact CD2-CD1 4.38Å; L416-I420 HydrophobicContact CG-CD1 3.8Å; L416-I420 HydrophobicContact CG-CG1 4.38Å; L416-I420 WeakPolarHBondContact O-CG1 3.19Å; L416-I420 PolarHBondContact O-N 2.88Å; I420-Q422 VanDerWaalsContact C-N 3.31Å; I420-Q422 PolarHBondContact O-N 3.41Å; I420-H424 WeakPolarHBondContact O-CA 2.95Å; I420-H424 WeakPolarHBondContact O-CB 3.29Å; I420-H424 PolarHBondContact O-N 2.9Å; I420-T425 PolarHBondContact O-N 3.45Å; I420-T425 VanDerWaalsContact O-N 3.14Å
421	K	78.5	Confident	75.8	Confident	102 Å²	102	74 Å²	74	44%	0.443	38%	0.384	S	S	.	.	I	π-helix	trans	-61.9	-35	177.9	-74.8	172	174.9	160.1	0	113.6	N417 H419 T425 A440	N417-K421 WeakPolarHBondContact O-CB 3.4Å; N417-K421 WeakPolarHBondContact O-CG 3.35Å; N417-K421 PolarHBondContact O-N 3.25Å; N417-K421 VanDerWaalsContact O-N 3.12Å; N417-K421 WeakPolarHBondContact OD1-CD 3.18Å; N417-K421 WeakPolarHBondContact OD1-CE 3.35Å; N417-K421 PolarHBondContact OD1-NZ 3.07Å; H419-K421 VanDerWaalsContact C-N 3.28Å; H419-K421 PolarHBondContact O-N 3.01Å; K421-T425 WeakPolarHBondContact CA-OG1 3.39Å; K421-T425 WeakPolarHBondContact O-CB 3.28Å; K421-A440 WeakPolarHBondContact O-CB 3.27Å
422	Q	74.6	Confident	75.9	Confident	103 Å²	103	71.8 Å²	71.8	48%	0.481	37%	0.368	S	S	.	.	I	π-helix	trans	-86.8	-25.8	-175.7	-72.6	170.5	33.4	0	0	114.7	G418 H419 I420 T441	G418-Q422 VanDerWaalsContact O-CB 3.32Å; G418-Q422 WeakPolarHBondContact O-CB 3.26Å; G418-Q422 WeakPolarHBondContact O-CG 3.36Å; G418-Q422 PolarHBondContact O-N 3.47Å; G418-Q422 PolarHBondContact O-NE2 3.24Å; H419-Q422 PolarHBondContact O-N 3.15Å; I420-Q422 VanDerWaalsContact C-N 3.31Å; I420-Q422 PolarHBondContact O-N 3.41Å; Q422-T441 HydrophobicContact CG-CG2 4.23Å
423	V	75.4	Confident	75.7	Confident	86 Å²	86	77.6 Å²	77.6	52%	0.521	40%	0.397	S	S	.	.	I	π-helix	trans	-116.9	-32.9	-170.2	-178.3	0	0	0	0	112.8	H419	H419-V423 WeakPolarHBondContact ND1-CG2 3.4Å; H419-V423 WeakPolarHBondContact O-CB 3.41Å; H419-V423 PolarHBondContact O-N 2.63Å
424	H	75.5	Confident	75.3	Confident	62 Å²	62	80.2 Å²	80.2	29%	0.287	41%	0.407	S	S	.	.	I	π-helix	trans	-109.2	-15.9	-174.6	-66	-70.1	0	0	0	114	C403 S405 C406 H419 I420 T426	C403-H424 VanDerWaalsContact SG-CD2 3.58Å; S405-H424 WeakPolarHBondContact CB-ND1 3.46Å; S405-H424 PolarHBondContact O-CE1 3.45Å; C406-H424 PolarHBondContact SG-NE2 2.82Å; H419-H424 AromaticContact CE1-CD2 4Å; H419-H424 AromaticContact CE1-NE2 3.78Å; H419-H424 AromaticContact NE2-CD2 3.69Å; H419-H424 AromaticContact NE2-NE2 3.54Å; I420-H424 WeakPolarHBondContact O-CA 2.95Å; I420-H424 WeakPolarHBondContact O-CB 3.29Å; I420-H424 PolarHBondContact O-N 2.9Å; H424-T426 PolarHBondContact O-N 3.41Å
425	T	72.3	Confident	74.6	Confident	55 Å²	55	79.9 Å²	79.9	34%	0.337	41%	0.409	S	S	.	.			trans	-81.3	111.1	167.8	-49.7	0	0	0	0	110.1	I420 K421 E427	I420-T425 PolarHBondContact O-N 3.45Å; I420-T425 VanDerWaalsContact O-N 3.14Å; K421-T425 WeakPolarHBondContact CA-OG1 3.39Å; K421-T425 WeakPolarHBondContact O-CB 3.28Å; T425-E427 VanDerWaalsContact C-N 3.33Å; T425-E427 HydrophobicContact CG2-CB 3.96Å; T425-E427 WeakPolarHBondContact CG2-O 3.2Å
426	T	63.7	Low	74	Confident	134 Å²	134	81.7 Å²	81.7	82%	0.822	42%	0.422	S	S	*	.			trans	-69.7	-30.6	173.7	48	0	0	0	0	112.1	H424 R428	H424-T426 PolarHBondContact O-N 3.41Å; T426-R428 PolarHBondContact O-N 2.78Å
427	E	67	Low	73.4	Confident	144 Å²	144	82 Å²	82	67%	0.673	43%	0.428	S	S	*	.			trans	-66.2	121.1	170.8	-61.6	-174.8	176.2	0	0	111	T425 P429	T425-E427 VanDerWaalsContact C-N 3.33Å; T425-E427 HydrophobicContact CG2-CB 3.96Å; T425-E427 WeakPolarHBondContact CG2-O 3.2Å; E427-P429 VanDerWaalsContact C-CD 3.4Å; E427-P429 WeakPolarHBondContact O-CD 3.41Å
428	R	70.4	Confident	73	Confident	113 Å²	113	80.1 Å²	80.1	43%	0.426	42%	0.421	S	S	.	.			trans	-118.2	69.5	178.8	-63.1	175.6	73.5	94.9	-3.8	109.5	T426 H430 S438 F439	T426-R428 PolarHBondContact O-N 2.78Å; R428-H430 PolarHBondContact O-N 3.43Å; R428-H430 VanDerWaalsContact O-N 3.08Å; R428-S438 VanDerWaalsContact CZ-O 3.26Å; R428-S438 PolarHBondContact NE-O 2.87Å; R428-S438 PolarHBondContact NH2-O 3.15Å; R428-F439 CarbonylContact C-O 3.49Å; R428-F439 WeakPolarHBondContact CA-O 3.29Å
429	P	73.4	Confident	72.9	Confident	86 Å²	86	80.4 Å²	80.4	56%	0.558	42%	0.417	S	S	*	.			trans	-69.1	-9	-165	28.5	-37.6	0	0	0	114.7	E427	E427-P429 VanDerWaalsContact C-CD 3.4Å; E427-P429 WeakPolarHBondContact O-CD 3.41Å
430	H	75.8	Confident	72.6	Confident	46 Å²	46	80.6 Å²	80.6	21%	0.213	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	84.6	-176.6	-56.8	-43.8	0	0	0	110.5	R428 F439 R442 L445	R428-H430 PolarHBondContact O-N 3.43Å; R428-H430 VanDerWaalsContact O-N 3.08Å; H430-F439 HydrophobicContact CB-CB 4.41Å; H430-F439 WeakPolarHBondContact CB-O 3.48Å; H430-F439 PolarHBondContact N-O 3.21Å; H430-F439 WeakPolarHBondContact O-CB 3.48Å; H430-F439 PolarHBondContact O-N 2.89Å; H430-R442 PolarHBondContact CD2-N 2.97Å; H430-R442 VanDerWaalsContact CE1-CG 3.5Å; H430-R442 WeakPolarHBondContact CE1-CG 3.48Å; H430-R442 WeakPolarHBondContact NE2-CG 3.22Å; H430-L445 HydrophobicContact CB-CB 4.17Å; H430-L445 HydrophobicContact CB-CD2 3.88Å
431	K	74.3	Confident	72.4	Confident	127 Å²	127	78.9 Å²	78.9	55%	0.552	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.7	141	176.2	-56.4	-167.3	176.2	-179.8	0	111.5
432	C	73.2	Confident	72.4	Confident	0 Å²	0	81.5 Å²	81.5	0%	0	42%	0.421	C	S	.	.			trans	-83.2	123	166.7	-179.9	0	0	0	0	109.9	I434 N436 A437 F439 L445 H448 H452	C432-I434 PolarHBondContact O-N 3.5Å; C432-N436 WeakPolarHBondContact O-CA 3.47Å; C432-N436 PolarHBondContact O-N 2.95Å; C432-A437 HydrophobicContact CB-CB 4.41Å; C432-A437 WeakPolarHBondContact CB-O 2.97Å; C432-A437 PolarHBondContact N-O 3.26Å; C432-F439 HydrophobicContact CB-CE2 4.23Å; C432-L445 HydrophobicContact CB-CD1 3.75Å; C432-H448 PolarHBondContact SG-NE2 3.5Å; C432-H448 VanDerWaalsContact SG-NE2 3.42Å; C432-H452 PolarHBondContact SG-NE2 3.41Å
433	Q	71.4	Confident	72.6	Confident	166 Å²	166	81 Å²	81	78%	0.776	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-15.3	-179.6	-53.3	-63.2	16.2	0	0	113.6
434	I	67.3	Low	72.6	Confident	108 Å²	108	83.2 Å²	83.2	55%	0.554	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-29.5	-175.7	-57	171.3	0	0	0	111.8	C432 L449 H452	C432-I434 PolarHBondContact O-N 3.5Å; I434-L449 HydrophobicContact CD1-CD2 4.21Å; I434-H452 HydrophobicContact CD1-CB 3.76Å; I434-H452 HydrophobicContact CG2-CB 4.21Å
435	C	64.6	Low	72.8	Confident	64 Å²	64	81.4 Å²	81.4	43%	0.432	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.3	14.8	-178.1	68.3	0	0	0	0	115	A437 H448 H452	C435-A437 PolarHBondContact O-N 2.85Å; C435-A437 VanDerWaalsContact SG-CB 3.58Å; C435-H448 PolarHBondContact SG-NE2 2.74Å; C435-H452 VanDerWaalsContact SG-CE1 3.54Å
436	N	68.9	Low	73.2	Confident	116 Å²	116	85.3 Å²	85.3	62%	0.62	42%	0.421	S	S	*	.			trans	55.7	3.3	-177.3	-73.8	-39.7	0	0	0	116.9	C432 S438	C432-N436 WeakPolarHBondContact O-CA 3.47Å; C432-N436 PolarHBondContact O-N 2.95Å; N436-S438 PolarHBondContact O-N 2.9Å; N436-S438 VanDerWaalsContact O-N 3.16Å; N436-S438 PolarHBondContact O-OG 3.47Å
437	A	67.3	Low	73.8	Confident	33 Å²	33	81.5 Å²	81.5	27%	0.273	40%	0.4	S	S	.	.			trans	-56	121.3	174.8	0	0	0	0	0	110.5	C432 C435 F439	C432-A437 HydrophobicContact CB-CB 4.41Å; C432-A437 WeakPolarHBondContact CB-O 2.97Å; C432-A437 PolarHBondContact N-O 3.26Å; C435-A437 PolarHBondContact O-N 2.85Å; C435-A437 VanDerWaalsContact SG-CB 3.58Å; A437-F439 HydrophobicContact CB-CE2 3.68Å; A437-F439 HydrophobicContact CB-CZ 3.83Å; A437-F439 WeakPolarHBondContact O-CD2 3.49Å; A437-F439 WeakPolarHBondContact O-CE2 3.22Å
438	S	74.7	Confident	74.1	Confident	39 Å²	39	76.1 Å²	76.1	27%	0.273	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	136.7	-175.5	-59.8	0	0	0	0	111	R428 N436	R428-S438 VanDerWaalsContact CZ-O 3.26Å; R428-S438 PolarHBondContact NE-O 2.87Å; R428-S438 PolarHBondContact NH2-O 3.15Å; N436-S438 PolarHBondContact O-N 2.9Å; N436-S438 VanDerWaalsContact O-N 3.16Å; N436-S438 PolarHBondContact O-OG 3.47Å
439	F	77.9	Confident	74.1	Confident	27 Å²	27	73.3 Å²	73.3	12%	0.118	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	151.2	-176.8	-60.4	-83.9	0	0	0	112.4	R428 H430 C432 A437 R444 L445 H448	R428-F439 CarbonylContact C-O 3.49Å; R428-F439 WeakPolarHBondContact CA-O 3.29Å; H430-F439 HydrophobicContact CB-CB 4.41Å; H430-F439 WeakPolarHBondContact CB-O 3.48Å; H430-F439 PolarHBondContact N-O 3.21Å; H430-F439 WeakPolarHBondContact O-CB 3.48Å; H430-F439 PolarHBondContact O-N 2.89Å; C432-F439 HydrophobicContact CB-CE2 4.23Å; A437-F439 HydrophobicContact CB-CE2 3.68Å; A437-F439 HydrophobicContact CB-CZ 3.83Å; A437-F439 WeakPolarHBondContact O-CD2 3.49Å; A437-F439 WeakPolarHBondContact O-CE2 3.22Å; F439-R444 HydrophobicContact CD1-CB 4.41Å; F439-R444 HydrophobicContact CD1-CG 3.8Å; F439-R444 HydrophobicContact CE1-CG 4.28Å; F439-L445 HydrophobicContact CB-CB 4.41Å; F439-L445 HydrophobicContact CD2-CB 4.25Å; F439-L445 HydrophobicContact CD2-CD1 3.96Å; F439-L445 HydrophobicContact CE2-CD1 4.29Å; F439-H448 HydrophobicContact CE1-CB 4.24Å; F439-H448 HydrophobicContact CE2-CB 4.01Å; F439-H448 AromaticContact CE2-CD2 3.3Å; F439-H448 WeakPolarHBondContact CE2-CD2 3.39Å; F439-H448 AromaticContact CE2-CG 3.55Å; F439-H448 AromaticContact CE2-NE2 3.8Å; F439-H448 HydrophobicContact CZ-CB 3.72Å; F439-H448 AromaticContact CZ-CD2 3.53Å; F439-H448 AromaticContact CZ-CE1 3.93Å; F439-H448 AromaticContact CZ-CG 3.29Å; F439-H448 AromaticContact CZ-ND1 3.59Å; F439-H448 AromaticContact CZ-NE2 3.9Å
440	A	77.4	Confident	74	Confident	20 Å²	20	70.1 Å²	70.1	17%	0.165	35%	0.349	C	S	.	.	S	Bend	trans	-84.5	-15	179.2	0	0	0	0	0	114.5	K421	K421-A440 WeakPolarHBondContact O-CB 3.27Å
441	T	76.8	Confident	73.4	Confident	25 Å²	25	69.8 Å²	69.8	15%	0.153	35%	0.351	C	S	.	.	S	Bend	trans	-135.9	142.9	178.7	67	0	0	0	0	112	Q422 D443 R444 L445	Q422-T441 HydrophobicContact CG-CG2 4.23Å; T441-D443 PolarHBondContact O-N 2.86Å; T441-R444 PolarHBondContact O-N 3.08Å; T441-R444 WeakPolarHBondContact OG1-CB 3.46Å; T441-R444 PolarHBondContact OG1-N 3.4Å; T441-L445 PolarHBondContact O-N 3.01Å; T441-L445 VanDerWaalsContact O-N 3.1Å
442	R	78.8	Confident	72.9	Confident	158 Å²	158	66 Å²	66	60%	0.596	34%	0.335	S	S	*	.	H	α-helix	trans	-59.1	-32.4	175.5	-68.6	-172	69.3	92.6	-2.9	111.9	H430 L445 R446	H430-R442 PolarHBondContact CD2-N 2.97Å; H430-R442 VanDerWaalsContact CE1-CG 3.5Å; H430-R442 WeakPolarHBondContact CE1-CG 3.48Å; H430-R442 WeakPolarHBondContact NE2-CG 3.22Å; R442-L445 PolarHBondContact O-N 3.14Å; R442-R446 PolarHBondContact O-N 3.44Å
443	D	79.5	Confident	72.5	Confident	92 Å²	92	72.5 Å²	72.5	49%	0.492	37%	0.366	S	S	.	.	H	α-helix	trans	-69.4	-40.4	179.8	-50.9	-69.6	0	0	0	112	T441 R446 S447	T441-D443 PolarHBondContact O-N 2.86Å; D443-R446 PolarHBondContact O-N 2.89Å; D443-R446 IonicContact OD1-CZ 2.63Å; D443-R446 IonicContact OD1-NH1 2.75Å; D443-R446 PolarHBondContact OD1-NH1 2.71Å; D443-R446 IonicContact OD1-NH2 3.2Å; D443-R446 PolarHBondContact OD1-NH2 3.25Å; D443-S447 PolarHBondContact O-N 3.45Å; D443-S447 PolarHBondContact O-OG 3.3Å; D443-S447 VanDerWaalsContact O-OG 3.13Å
444	R	74.6	Confident	72.1	Confident	133 Å²	133	69.1 Å²	69.1	50%	0.502	35%	0.353	S	S	.	.	H	α-helix	trans	-70.7	-33.9	174.8	-169	58.3	177.4	164.5	2.2	111.9	F439 T441 S447 H448	F439-R444 HydrophobicContact CD1-CB 4.41Å; F439-R444 HydrophobicContact CD1-CG 3.8Å; F439-R444 HydrophobicContact CE1-CG 4.28Å; T441-R444 PolarHBondContact O-N 3.08Å; T441-R444 WeakPolarHBondContact OG1-CB 3.46Å; T441-R444 PolarHBondContact OG1-N 3.4Å; R444-S447 PolarHBondContact O-N 3.5Å; R444-H448 VanDerWaalsContact O-CB 3.27Å; R444-H448 WeakPolarHBondContact O-CB 3.43Å; R444-H448 PolarHBondContact O-N 3.32Å
445	L	79.4	Confident	71.8	Confident	23 Å²	23	70.3 Å²	70.3	12%	0.12	35%	0.354	C	S	.	.	H	α-helix	trans	-60.8	-47.6	168.6	174.9	60.3	0	0	0	111.1	H430 C432 F439 T441 R442 S447 H448 L449	H430-L445 HydrophobicContact CB-CB 4.17Å; H430-L445 HydrophobicContact CB-CD2 3.88Å; C432-L445 HydrophobicContact CB-CD1 3.75Å; F439-L445 HydrophobicContact CB-CB 4.41Å; F439-L445 HydrophobicContact CD2-CB 4.25Å; F439-L445 HydrophobicContact CD2-CD1 3.96Å; F439-L445 HydrophobicContact CE2-CD1 4.29Å; T441-L445 PolarHBondContact O-N 3.01Å; T441-L445 VanDerWaalsContact O-N 3.1Å; R442-L445 PolarHBondContact O-N 3.14Å; L445-S447 PolarHBondContact O-N 3.41Å; L445-H448 CarbonylContact O-C 3.31Å; L445-H448 WeakPolarHBondContact O-CA 3.37Å; L445-H448 PolarHBondContact O-N 2.63Å; L445-L449 HydrophobicContact CD1-CD1 4.23Å; L445-L449 HydrophobicContact CD1-CD2 4.31Å; L445-L449 HydrophobicContact CD1-CG 3.96Å; L445-L449 HydrophobicContact CG-CD1 4.07Å; L445-L449 HydrophobicContact CG-CG 4.28Å; L445-L449 WeakPolarHBondContact O-CG 3.3Å; L445-L449 PolarHBondContact O-N 2.92Å
446	R	80.6	Confident	71.8	Confident	137 Å²	137	70.3 Å²	70.3	52%	0.517	35%	0.349	S	S	.	.	H	α-helix	trans	-59.8	-43.7	175.9	-80	-167.9	-102.3	85.4	3.4	112.5	R442 D443 H448 L449 A450	R442-R446 PolarHBondContact O-N 3.44Å; D443-R446 PolarHBondContact O-N 2.89Å; D443-R446 IonicContact OD1-CZ 2.63Å; D443-R446 IonicContact OD1-NH1 2.75Å; D443-R446 PolarHBondContact OD1-NH1 2.71Å; D443-R446 IonicContact OD1-NH2 3.2Å; D443-R446 PolarHBondContact OD1-NH2 3.25Å; R446-H448 PolarHBondContact O-N 2.96Å; R446-L449 PolarHBondContact O-N 3.44Å; R446-A450 PolarHBondContact O-N 3.37Å
447	S	76.5	Confident	71.4	Confident	55 Å²	55	67.9 Å²	67.9	39%	0.385	34%	0.339	S	S	.	.	H	α-helix	trans	-60.8	-32.6	173	-56.1	0	0	0	0	113.1	D443 R444 L445 R466	D443-S447 PolarHBondContact O-N 3.45Å; D443-S447 PolarHBondContact O-OG 3.3Å; D443-S447 VanDerWaalsContact O-OG 3.13Å; R444-S447 PolarHBondContact O-N 3.5Å; L445-S447 PolarHBondContact O-N 3.41Å; S447-R466 PolarHBondContact O-NH1 3.01Å
448	H	73.3	Confident	71.3	Confident	31 Å²	31	66.3 Å²	66.3	14%	0.144	33%	0.327	C	S	.	.	H	α-helix	trans	-82.6	-31.7	-179.9	169.6	77.3	0	0	0	113.6	C432 C435 F439 R444 L445 R446 A450 C451 H452	C432-H448 PolarHBondContact SG-NE2 3.5Å; C432-H448 VanDerWaalsContact SG-NE2 3.42Å; C435-H448 PolarHBondContact SG-NE2 2.74Å; F439-H448 HydrophobicContact CE1-CB 4.24Å; F439-H448 HydrophobicContact CE2-CB 4.01Å; F439-H448 AromaticContact CE2-CD2 3.3Å; F439-H448 WeakPolarHBondContact CE2-CD2 3.39Å; F439-H448 AromaticContact CE2-CG 3.55Å; F439-H448 AromaticContact CE2-NE2 3.8Å; F439-H448 HydrophobicContact CZ-CB 3.72Å; F439-H448 AromaticContact CZ-CD2 3.53Å; F439-H448 AromaticContact CZ-CE1 3.93Å; F439-H448 AromaticContact CZ-CG 3.29Å; F439-H448 AromaticContact CZ-ND1 3.59Å; F439-H448 AromaticContact CZ-NE2 3.9Å; R444-H448 VanDerWaalsContact O-CB 3.27Å; R444-H448 WeakPolarHBondContact O-CB 3.43Å; R444-H448 PolarHBondContact O-N 3.32Å; L445-H448 CarbonylContact O-C 3.31Å; L445-H448 WeakPolarHBondContact O-CA 3.37Å; L445-H448 PolarHBondContact O-N 2.63Å; R446-H448 PolarHBondContact O-N 2.96Å; H448-A450 VanDerWaalsContact C-N 3.27Å; H448-A450 PolarHBondContact O-N 2.78Å; H448-C451 WeakPolarHBondContact O-CA 3.35Å; H448-C451 WeakPolarHBondContact O-CB 3.47Å; H448-C451 PolarHBondContact O-N 3.21Å; H448-H452 AromaticContact CD2-NE2 3.78Å; H448-H452 AromaticContact CE1-NE2 3.45Å; H448-H452 PolarHBondContact CE1-NE2 2.96Å; H448-H452 AromaticContact NE2-CE1 3.92Å; H448-H452 AromaticContact NE2-NE2 3.04Å; H448-H452 PolarHBondContact NE2-NE2 3.11Å; H448-H452 PolarHBondContact O-CD2 3.43Å
449	L	71.4	Confident	70.8	Confident	53 Å²	53	74.5 Å²	74.5	28%	0.277	36%	0.357	S	S	.	.	H	α-helix	trans	-58.6	-44.6	174	-74.6	168.3	0	0	0	110.3	I434 L445 R446 C451 H452	I434-L449 HydrophobicContact CD1-CD2 4.21Å; L445-L449 HydrophobicContact CD1-CD1 4.23Å; L445-L449 HydrophobicContact CD1-CD2 4.31Å; L445-L449 HydrophobicContact CD1-CG 3.96Å; L445-L449 HydrophobicContact CG-CD1 4.07Å; L445-L449 HydrophobicContact CG-CG 4.28Å; L445-L449 WeakPolarHBondContact O-CG 3.3Å; L445-L449 PolarHBondContact O-N 2.92Å; R446-L449 PolarHBondContact O-N 3.44Å; L449-C451 PolarHBondContact O-N 3.49Å; L449-H452 WeakPolarHBondContact O-CB 3.32Å; L449-H452 PolarHBondContact O-N 2.88Å
450	A	70.7	Confident	70.2	Confident	19 Å²	19	76.5 Å²	76.5	16%	0.157	37%	0.372	C	S	.	.	H	α-helix	trans	-69	6.4	171.5	0	0	0	0	0	115.4	R446 H448 E453 R466	R446-A450 PolarHBondContact O-N 3.37Å; H448-A450 VanDerWaalsContact C-N 3.27Å; H448-A450 PolarHBondContact O-N 2.78Å; A450-E453 WeakPolarHBondContact CA-OE2 3.4Å; A450-E453 VanDerWaalsContact CB-OE2 3.27Å; A450-E453 WeakPolarHBondContact CB-OE2 3.21Å; A450-R466 VanDerWaalsContact C-CZ 3.41Å; A450-R466 PolarHBondContact O-NE 2.9Å; A450-R466 PolarHBondContact O-NH1 3.37Å; A450-R466 PolarHBondContact O-NH2 3.14Å; A450-R466 VanDerWaalsContact O-NH2 3.11Å
451	C	62.6	Low	69.6	Low	39 Å²	39	77.9 Å²	77.9	26%	0.264	38%	0.379	S	S	.	.	H	α-helix	trans	-86.9	-13.8	161.5	-65.5	0	0	0	0	113.2	H448 L449 R466	H448-C451 WeakPolarHBondContact O-CA 3.35Å; H448-C451 WeakPolarHBondContact O-CB 3.47Å; H448-C451 PolarHBondContact O-N 3.21Å; L449-C451 PolarHBondContact O-N 3.49Å; C451-R466 PolarHBondContact SG-NH1 3.37Å
452	H	64.1	Low	68.7	Low	48 Å²	48	79 Å²	79	22%	0.222	40%	0.396	C	S	.	.	H	α-helix	trans	-94.5	-24.7	177.2	-59	-71.7	0	0	0	112.4	C432 I434 C435 H448 L449	C432-H452 PolarHBondContact SG-NE2 3.41Å; I434-H452 HydrophobicContact CD1-CB 3.76Å; I434-H452 HydrophobicContact CG2-CB 4.21Å; C435-H452 VanDerWaalsContact SG-CE1 3.54Å; H448-H452 AromaticContact CD2-NE2 3.78Å; H448-H452 AromaticContact CE1-NE2 3.45Å; H448-H452 PolarHBondContact CE1-NE2 2.96Å; H448-H452 AromaticContact NE2-CE1 3.92Å; H448-H452 AromaticContact NE2-NE2 3.04Å; H448-H452 PolarHBondContact NE2-NE2 3.11Å; H448-H452 PolarHBondContact O-CD2 3.43Å; L449-H452 WeakPolarHBondContact O-CB 3.32Å; L449-H452 PolarHBondContact O-N 2.88Å
453	E	64.6	Low	67.6	Low	136 Å²	136	77.7 Å²	77.7	64%	0.636	40%	0.395	S	S	*	.	H	α-helix	trans	-69.6	-47.6	-177.8	-70.2	154.5	-167.1	0	0	112	A450	A450-E453 WeakPolarHBondContact CA-OE2 3.4Å; A450-E453 VanDerWaalsContact CB-OE2 3.27Å; A450-E453 WeakPolarHBondContact CB-OE2 3.21Å
454	D	62.3	Low	66.6	Low	95 Å²	95	80 Å²	80	51%	0.508	40%	0.401	S	S	.	.			trans	-121.7	95.3	179.7	-68.3	-62.8	0	0	0	113.1	R466	D454-R466 WeakPolarHBondContact O-CA 3.48Å
455	K	62.8	Low	66	Low	134 Å²	134	75.8 Å²	75.8	58%	0.583	39%	0.387	S	S	*	.			trans	-101.5	93.9	163.4	-74.6	-179.9	-175.2	168.8	0	109.4	F464	K455-F464 HydrophobicContact CB-CB 4.38Å; K455-F464 HydrophobicContact CB-CD1 4.43Å
456	I	63.7	Low	65.2	Low	64 Å²	64	77.8 Å²	77.8	33%	0.328	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	130.8	179.9	-47.2	-178	0	0	0	108.9	C458 L465 A467 M470	I456-C458 PolarHBondContact O-N 3.17Å; I456-L465 PolarHBondContact N-O 2.85Å; I456-L465 PolarHBondContact O-N 2.89Å; I456-A467 HydrophobicContact CD1-CB 3.86Å; I456-M470 HydrophobicContact CB-CE 3.88Å; I456-M470 HydrophobicContact CB-SD 4.48Å; I456-M470 HydrophobicContact CD1-CE 4.2Å; I456-M470 HydrophobicContact CG2-CE 3.75Å; I456-M470 HydrophobicContact CG2-SD 4.48Å
457	P	60.6	Low	64.3	Low	64 Å²	64	73.3 Å²	73.3	42%	0.416	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	130.3	173.7	26.8	-33	0	0	0	110.8	K459 F464	P457-K459 PolarHBondContact O-N 2.72Å; P457-F464 HydrophobicContact CB-CD1 4.05Å; P457-F464 HydrophobicContact CB-CE1 3.81Å; P457-F464 HydrophobicContact CB-CZ 4.15Å; P457-F464 HydrophobicContact CG-CE1 4.08Å
458	C	66	Low	63.5	Low	1 Å²	1	74.3 Å²	74.3	1%	0.007	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-66.2	119.7	171.3	178.6	0	0	0	0	110.3	I456 V460 C461 G462 K463 H473	I456-C458 PolarHBondContact O-N 3.17Å; C458-V460 PolarHBondContact O-N 3.43Å; C458-V460 VanDerWaalsContact O-N 3.07Å; C458-C461 PolarHBondContact O-N 3Å; C458-G462 WeakPolarHBondContact O-CA 3.29Å; C458-G462 PolarHBondContact O-N 3.07Å; C458-K463 VanDerWaalsContact CB-O 3.29Å; C458-K463 WeakPolarHBondContact CB-O 3.35Å; C458-K463 PolarHBondContact N-O 3.35Å; C458-H473 PolarHBondContact SG-CD2 2.85Å; C458-H473 PolarHBondContact SG-NE2 3.36Å
459	K	63.6	Low	63	Low	210 Å²	210	78.7 Å²	78.7	91%	0.913	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-24.4	-178.6	-66.6	-168.7	176.1	-169.9	0	114.5	P457	P457-K459 PolarHBondContact O-N 2.72Å
460	V	65.3	Low	62.8	Low	70 Å²	70	77.8 Å²	77.8	42%	0.424	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-25.8	-175.4	-170.9	0	0	0	0	113	C458 L474 H477	C458-V460 PolarHBondContact O-N 3.43Å; C458-V460 VanDerWaalsContact O-N 3.07Å; V460-L474 HydrophobicContact CG2-CD2 3.96Å; V460-H477 HydrophobicContact CG1-CB 4.15Å; V460-H477 WeakPolarHBondContact CG1-ND1 3.43Å; V460-H477 HydrophobicContact CG2-CB 4.47Å
461	C	65.4	Low	62.7	Low	48 Å²	48	81.7 Å²	81.7	32%	0.324	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-146.4	14.1	-174.9	70.4	0	0	0	0	116	C458 K463 H473 H477	C458-C461 PolarHBondContact O-N 3Å; C461-K463 PolarHBondContact O-N 3.22Å; C461-H473 PolarHBondContact SG-NE2 3.05Å; C461-H477 VanDerWaalsContact SG-CE1 3.56Å; C461-H477 PolarHBondContact SG-NE2 2.99Å; C461-H477 VanDerWaalsContact SG-NE2 3.38Å
462	G	57.1	Low	63	Low	48 Å²	48	83.7 Å²	83.7	50%	0.495	44%	0.439	S	S	.	.			trans	67.6	-7.8	176.3	0	0	0	0	0	115.9	C458 F464	C458-G462 WeakPolarHBondContact O-CA 3.29Å; C458-G462 PolarHBondContact O-N 3.07Å; G462-F464 PolarHBondContact O-N 3.35Å
463	K	55.2	Low	63.3	Low	132 Å²	132	82.7 Å²	82.7	57%	0.574	43%	0.434	S	S	*	.			trans	-67	122.3	-177.4	-66	176.4	-173	172.5	0	110.1	C458 C461 L465	C458-K463 VanDerWaalsContact CB-O 3.29Å; C458-K463 WeakPolarHBondContact CB-O 3.35Å; C458-K463 PolarHBondContact N-O 3.35Å; C461-K463 PolarHBondContact O-N 3.22Å; K463-L465 HydrophobicContact CB-CD1 3.58Å; K463-L465 VanDerWaalsContact O-CD1 3.3Å; K463-L465 WeakPolarHBondContact O-CD1 3.26Å; K463-L465 PolarHBondContact O-N 3.21Å
464	F	58	Low	63.5	Low	141 Å²	141	79.7 Å²	79.7	62%	0.618	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.2	110.1	176.6	-70.9	-89.9	0	0	0	110.6	K455 P457 G462	K455-F464 HydrophobicContact CB-CB 4.38Å; K455-F464 HydrophobicContact CB-CD1 4.43Å; P457-F464 HydrophobicContact CB-CD1 4.05Å; P457-F464 HydrophobicContact CB-CE1 3.81Å; P457-F464 HydrophobicContact CB-CZ 4.15Å; P457-F464 HydrophobicContact CG-CE1 4.08Å; G462-F464 PolarHBondContact O-N 3.35Å
465	L	62.3	Low	63.9	Low	43 Å²	43	80.3 Å²	80.3	23%	0.225	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	156.8	177.9	-83.5	85.5	0	0	0	110.8	I456 K463 H473	I456-L465 PolarHBondContact N-O 2.85Å; I456-L465 PolarHBondContact O-N 2.89Å; K463-L465 HydrophobicContact CB-CD1 3.58Å; K463-L465 VanDerWaalsContact O-CD1 3.3Å; K463-L465 WeakPolarHBondContact O-CD1 3.26Å; K463-L465 PolarHBondContact O-N 3.21Å; L465-H473 HydrophobicContact CD2-CB 3.54Å
466	R	62.2	Low	64.2	Low	65 Å²	65	78.9 Å²	78.9	25%	0.245	41%	0.414	C	S	.	.			trans	-71.4	139.4	171.8	-172.5	-175	177.8	164.1	1.3	110.1	S447 A450 C451 D454 A468 Y469 M470	S447-R466 PolarHBondContact O-NH1 3.01Å; A450-R466 VanDerWaalsContact C-CZ 3.41Å; A450-R466 PolarHBondContact O-NE 2.9Å; A450-R466 PolarHBondContact O-NH1 3.37Å; A450-R466 PolarHBondContact O-NH2 3.14Å; A450-R466 VanDerWaalsContact O-NH2 3.11Å; C451-R466 PolarHBondContact SG-NH1 3.37Å; D454-R466 WeakPolarHBondContact O-CA 3.48Å; R466-A468 PolarHBondContact O-N 3.31Å; R466-A468 VanDerWaalsContact O-N 3.1Å; R466-Y469 HydrophobicContact CB-CD2 4.2Å; R466-Y469 PolarHBondContact O-N 3.2Å; R466-M470 PolarHBondContact O-N 3.46Å; R466-M470 VanDerWaalsContact O-N 3.07Å
467	A	61.8	Low	64.3	Low	44 Å²	44	76.8 Å²	76.8	36%	0.364	40%	0.402	S	S	.	.	H	α-helix	trans	-43.6	-47.6	177.2	0	0	0	0	0	113.7	I456 Y469 M470	I456-A467 HydrophobicContact CD1-CB 3.86Å; A467-Y469 PolarHBondContact O-N 3.1Å; A467-Y469 VanDerWaalsContact O-N 3.12Å; A467-M470 WeakPolarHBondContact O-CB 3.28Å; A467-M470 PolarHBondContact O-N 3.32Å
468	A	60.5	Low	64.5	Low	75 Å²	75	78.3 Å²	78.3	62%	0.62	42%	0.415	S	S	*	.	H	α-helix	trans	-63.4	-15.3	179.8	0	0	0	0	0	115.7	R466	R466-A468 PolarHBondContact O-N 3.31Å; R466-A468 VanDerWaalsContact O-N 3.1Å
469	Y	63.4	Low	64.2	Low	123 Å²	123	84.5 Å²	84.5	48%	0.482	44%	0.443	S	S	.	.	H	α-helix	trans	-109.7	-7.7	172.4	-64.1	-59.1	0	0	0	112.6	R466 A467 T471 D472 H473	R466-Y469 HydrophobicContact CB-CD2 4.2Å; R466-Y469 PolarHBondContact O-N 3.2Å; A467-Y469 PolarHBondContact O-N 3.1Å; A467-Y469 VanDerWaalsContact O-N 3.12Å; Y469-T471 PolarHBondContact O-N 2.88Å; Y469-D472 PolarHBondContact O-N 3.07Å; Y469-H473 WeakPolarHBondContact O-CB 3.32Å; Y469-H473 PolarHBondContact O-N 2.97Å
470	M	66.8	Low	63.3	Low	35 Å²	35	75.5 Å²	75.5	17%	0.172	41%	0.411	C	S	.	.	H	α-helix	trans	-70.1	-31.2	-176.8	-169.2	151.1	60.8	0	0	112.2	I456 R466 A467 H473 L474	I456-M470 HydrophobicContact CB-CE 3.88Å; I456-M470 HydrophobicContact CB-SD 4.48Å; I456-M470 HydrophobicContact CD1-CE 4.2Å; I456-M470 HydrophobicContact CG2-CE 3.75Å; I456-M470 HydrophobicContact CG2-SD 4.48Å; R466-M470 PolarHBondContact O-N 3.46Å; R466-M470 VanDerWaalsContact O-N 3.07Å; A467-M470 WeakPolarHBondContact O-CB 3.28Å; A467-M470 PolarHBondContact O-N 3.32Å; M470-H473 PolarHBondContact O-N 2.9Å; M470-L474 HydrophobicContact CG-CD1 3.89Å; M470-L474 HydrophobicContact CG-CG 4.07Å; M470-L474 WeakPolarHBondContact O-CB 3.44Å; M470-L474 VanDerWaalsContact O-CG 3.24Å; M470-L474 WeakPolarHBondContact O-CG 3.46Å; M470-L474 PolarHBondContact O-N 3.47Å
471	T	69.3	Low	62.6	Low	101 Å²	101	79 Å²	79	62%	0.62	43%	0.432	S	S	*	.	H	α-helix	trans	-64.4	-43.3	174.4	-42	0	0	0	0	112.5	Y469 H473 L474 K475	Y469-T471 PolarHBondContact O-N 2.88Å; T471-H473 VanDerWaalsContact C-N 3.33Å; T471-L474 PolarHBondContact O-N 3.26Å; T471-K475 WeakPolarHBondContact O-CG 3.41Å; T471-K475 PolarHBondContact O-N 3.47Å
472	D	68.6	Low	61.9	Low	81 Å²	81	82 Å²	82	43%	0.433	44%	0.441	S	S	.	.	H	α-helix	trans	-68.3	-32.5	174.9	165.9	81.1	0	0	0	112	Y469 K476	Y469-D472 PolarHBondContact O-N 3.07Å; D472-K476 WeakPolarHBondContact O-CD 3.46Å; D472-K476 PolarHBondContact O-N 2.96Å; D472-K476 WeakPolarHBondContact OD1-CE 3.3Å; D472-K476 IonicContact OD1-NZ 2.74Å; D472-K476 PolarHBondContact OD1-NZ 3.19Å; D472-K476 IonicContact OD2-NZ 3.18Å; D472-K476 PolarHBondContact OD2-NZ 3.45Å
473	H	70.8	Confident	61.5	Low	26 Å²	26	85.1 Å²	85.1	12%	0.12	45%	0.447	C	S	.	.	H	α-helix	trans	-73.1	-39.5	174.4	-179.8	50	0	0	0	113.2	C458 C461 L465 Y469 M470 T471 K476 H477	C458-H473 PolarHBondContact SG-CD2 2.85Å; C458-H473 PolarHBondContact SG-NE2 3.36Å; C461-H473 PolarHBondContact SG-NE2 3.05Å; L465-H473 HydrophobicContact CD2-CB 3.54Å; Y469-H473 WeakPolarHBondContact O-CB 3.32Å; Y469-H473 PolarHBondContact O-N 2.97Å; M470-H473 PolarHBondContact O-N 2.9Å; T471-H473 VanDerWaalsContact C-N 3.33Å; H473-K476 WeakPolarHBondContact O-CB 3.35Å; H473-K476 PolarHBondContact O-N 3.34Å; H473-H477 AromaticContact CE1-NE2 3.29Å; H473-H477 PolarHBondContact CE1-NE2 3.02Å; H473-H477 VanDerWaalsContact CE1-NE2 3.29Å; H473-H477 AromaticContact NE2-CD2 3.99Å; H473-H477 AromaticContact NE2-NE2 3.28Å; H473-H477 PolarHBondContact NE2-NE2 3.17Å; H473-H477 PolarHBondContact O-CD2 2.98Å; H473-H477 PolarHBondContact O-N 3.36Å
474	L	66.9	Low	60.8	Low	73 Å²	73	86 Å²	86	38%	0.382	45%	0.448	S	S	.	.	H	α-helix	trans	-68.6	-35	174.5	-72.6	169.9	0	0	0	111.5	V460 M470 T471 K476 H477 S478	V460-L474 HydrophobicContact CG2-CD2 3.96Å; M470-L474 HydrophobicContact CG-CD1 3.89Å; M470-L474 HydrophobicContact CG-CG 4.07Å; M470-L474 WeakPolarHBondContact O-CB 3.44Å; M470-L474 VanDerWaalsContact O-CG 3.24Å; M470-L474 WeakPolarHBondContact O-CG 3.46Å; M470-L474 PolarHBondContact O-N 3.47Å; T471-L474 PolarHBondContact O-N 3.26Å; L474-K476 PolarHBondContact O-N 3.21Å; L474-H477 WeakPolarHBondContact O-CA 3.47Å; L474-H477 WeakPolarHBondContact O-CB 3.5Å; L474-H477 PolarHBondContact O-N 3.12Å; L474-S478 PolarHBondContact O-N 2.95Å; L474-S478 VanDerWaalsContact O-N 3.09Å
475	K	72.6	Confident	59.8	Low	109 Å²	109	81.3 Å²	81.3	47%	0.474	43%	0.431	S	S	.	.	H	α-helix	trans	-55.1	-40.6	167.2	-84.5	-178.5	162.8	-111	0	112.4	T471 H477 S478 E479	T471-K475 WeakPolarHBondContact O-CG 3.41Å; T471-K475 PolarHBondContact O-N 3.47Å; K475-H477 PolarHBondContact O-N 2.91Å; K475-H477 VanDerWaalsContact O-N 3.16Å; K475-S478 WeakPolarHBondContact CA-OG 3.48Å; K475-S478 PolarHBondContact O-N 3.39Å; K475-S478 PolarHBondContact O-OG 3.12Å; K475-E479 IonicContact NZ-OE1 2.74Å; K475-E479 VanDerWaalsContact O-CB 3.23Å; K475-E479 WeakPolarHBondContact O-CB 3.29Å; K475-E479 VanDerWaalsContact O-CG 3.3Å; K475-E479 WeakPolarHBondContact O-CG 3.37Å; K475-E479 PolarHBondContact O-N 2.81Å
476	K	67.7	Low	58.9	Low	104 Å²	104	82.1 Å²	82.1	45%	0.452	45%	0.45	S	S	.	.	H	α-helix	trans	-71	-4.5	174.3	-70.4	153.9	-165.9	162.9	0	114.2	D472 H473 L474 H482	D472-K476 WeakPolarHBondContact O-CD 3.46Å; D472-K476 PolarHBondContact O-N 2.96Å; D472-K476 WeakPolarHBondContact OD1-CE 3.3Å; D472-K476 IonicContact OD1-NZ 2.74Å; D472-K476 PolarHBondContact OD1-NZ 3.19Å; D472-K476 IonicContact OD2-NZ 3.18Å; D472-K476 PolarHBondContact OD2-NZ 3.45Å; H473-K476 WeakPolarHBondContact O-CB 3.35Å; H473-K476 PolarHBondContact O-N 3.34Å; L474-K476 PolarHBondContact O-N 3.21Å; K476-H482 PolarHBondContact O-CE1 3.14Å; K476-H482 PolarHBondContact O-NE2 3.11Å
477	H	66.6	Low	57.9	Low	19 Å²	19	86 Å²	86	9%	0.088	47%	0.474	C	S	.	.	H	α-helix	trans	-98.9	-21.8	166.9	-68.7	-71	0	0	0	113.5	V460 C461 H473 L474 K475 H482 N483	V460-H477 HydrophobicContact CG1-CB 4.15Å; V460-H477 WeakPolarHBondContact CG1-ND1 3.43Å; V460-H477 HydrophobicContact CG2-CB 4.47Å; C461-H477 VanDerWaalsContact SG-CE1 3.56Å; C461-H477 PolarHBondContact SG-NE2 2.99Å; C461-H477 VanDerWaalsContact SG-NE2 3.38Å; H473-H477 AromaticContact CE1-NE2 3.29Å; H473-H477 PolarHBondContact CE1-NE2 3.02Å; H473-H477 VanDerWaalsContact CE1-NE2 3.29Å; H473-H477 AromaticContact NE2-CD2 3.99Å; H473-H477 AromaticContact NE2-NE2 3.28Å; H473-H477 PolarHBondContact NE2-NE2 3.17Å; H473-H477 PolarHBondContact O-CD2 2.98Å; H473-H477 PolarHBondContact O-N 3.36Å; L474-H477 WeakPolarHBondContact O-CA 3.47Å; L474-H477 WeakPolarHBondContact O-CB 3.5Å; L474-H477 PolarHBondContact O-N 3.12Å; K475-H477 PolarHBondContact O-N 2.91Å; K475-H477 VanDerWaalsContact O-N 3.16Å; H477-H482 AromaticContact CE1-NE2 3.8Å; H477-H482 AromaticContact CG-NE2 3.8Å; H477-H482 AromaticContact ND1-CD2 3.62Å; H477-H482 AromaticContact ND1-NE2 2.95Å; H477-H482 PolarHBondContact ND1-NE2 3.47Å; H477-N483 PolarHBondContact O-ND2 3.33Å
478	S	64.8	Low	56.9	Low	97 Å²	97	86.8 Å²	86.8	68%	0.678	48%	0.476	S	S	*	.	H	α-helix	trans	-92	-29.2	172.6	58.5	0	0	0	0	113.7	L474 K475	L474-S478 PolarHBondContact O-N 2.95Å; L474-S478 VanDerWaalsContact O-N 3.09Å; K475-S478 WeakPolarHBondContact CA-OG 3.48Å; K475-S478 PolarHBondContact O-N 3.39Å; K475-S478 PolarHBondContact O-OG 3.12Å
479	E	60.1	Low	56.1	Low	130 Å²	130	88.7 Å²	88.7	61%	0.607	48%	0.476	S	S	*	.	S	Bend	trans	-93.1	-9.4	178.5	-61.4	163.3	-168.2	0	0	111.6	K475	K475-E479 IonicContact NZ-OE1 2.74Å; K475-E479 VanDerWaalsContact O-CB 3.23Å; K475-E479 WeakPolarHBondContact O-CB 3.29Å; K475-E479 VanDerWaalsContact O-CG 3.3Å; K475-E479 WeakPolarHBondContact O-CG 3.37Å; K475-E479 PolarHBondContact O-N 2.81Å
480	G	43.4	Very low	55	Low	22 Å²	22	91.8 Å²	91.8	23%	0.227	49%	0.492	C	S	.	.	S	Bend	trans	-104.1	132.7	180	0	0	0	0	0	112.6	H482	G480-H482 PolarHBondContact O-N 3.39Å
481	T	51.6	Low	53.6	Low	142 Å²	142	97.9 Å²	97.9	87%	0.871	53%	0.526	S	S	*	.	S	Bend	trans	-76.1	57.8	-178.4	56.9	0	0	0	0	112.8
482	H	50	Low	52	Low	111 Å²	111	97.3 Å²	97.3	51%	0.514	54%	0.539	S	S	.	.			trans	-135.4	23.8	177.7	55.5	-106.3	0	0	0	113.3	K476 H477 G480	K476-H482 PolarHBondContact O-CE1 3.14Å; K476-H482 PolarHBondContact O-NE2 3.11Å; H477-H482 AromaticContact CE1-NE2 3.8Å; H477-H482 AromaticContact CG-NE2 3.8Å; H477-H482 AromaticContact ND1-CD2 3.62Å; H477-H482 AromaticContact ND1-NE2 2.95Å; H477-H482 PolarHBondContact ND1-NE2 3.47Å; G480-H482 PolarHBondContact O-N 3.39Å
483	N	48.6	Very low	50.4	Low	114 Å²	114	101.5 Å²	101.5	61%	0.61	56%	0.556	S	S	*	*	S	Bend	trans	-116	17.3	159.9	-73.7	-63.5	0	0	0	111.9	H477	H477-N483 PolarHBondContact O-ND2 3.33Å
484	Y	41.4	Very low	48.9	Very low	152 Å²	152	108 Å²	108	60%	0.596	59%	0.587	S	S	*	*			trans	-125.8	110.3	175.6	-176	-108.9	0	0	0	111.1	G486 N489	Y484-G486 VanDerWaalsContact CE1-CA 3.45Å; Y484-G486 PolarHBondContact O-N 3.45Å; Y484-N489 WeakPolarHBondContact CE2-OD1 3.37Å
485	C	37.6	Very low	47.2	Very low	41 Å²	41	112.1 Å²	112.1	28%	0.277	61%	0.609	S	S	.	*			trans	-82.3	93.5	169.6	175.7	0	0	0	0	109	I487 C488 N489	C485-I487 PolarHBondContact O-N 3.29Å; C485-C488 HydrophobicContact CB-CB 4.32Å; C485-C488 WeakPolarHBondContact CB-SG 3.28Å; C485-C488 PolarHBondContact O-N 2.91Å; C485-C488 WeakPolarHBondContact SG-CB 3.31Å; C485-C488 PolarHBondContact SG-N 3.35Å; C485-C488 CovalentContact SG-SG 2.04Å; C485-C488 PolarHBondContact SG-SG 2.98Å; C485-N489 PolarHBondContact O-N 2.83Å
486	G	43.3	Very low	45.9	Very low	60 Å²	60	112.2 Å²	112.2	62%	0.619	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	-4.8	-180	0	0	0	0	0	115.8	Y484	Y484-G486 VanDerWaalsContact CE1-CA 3.45Å; Y484-G486 PolarHBondContact O-N 3.45Å
487	I	41.2	Very low	44.4	Very low	146 Å²	146	110.6 Å²	110.6	75%	0.749	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	-29.1	174.7	-59.2	171.5	0	0	0	111.4	C485	C485-I487 PolarHBondContact O-N 3.29Å
488	C	39.6	Very low	43.1	Very low	61 Å²	61	119.6 Å²	119.6	41%	0.412	68%	0.682	S	S	.	*	T	Hydrogen-bonded Turn	trans	-126.6	-2.4	-164.1	67.9	0	0	0	0	116.3	C485 K490	C485-C488 HydrophobicContact CB-CB 4.32Å; C485-C488 WeakPolarHBondContact CB-SG 3.28Å; C485-C488 PolarHBondContact O-N 2.91Å; C485-C488 WeakPolarHBondContact SG-CB 3.31Å; C485-C488 PolarHBondContact SG-N 3.35Å; C485-C488 CovalentContact SG-SG 2.04Å; C485-C488 PolarHBondContact SG-SG 2.98Å; C488-K490 PolarHBondContact O-N 2.96Å
489	N	44.4	Very low	41.6	Very low	115 Å²	115	119 Å²	119	62%	0.615	68%	0.677	S	S	*	*			trans	28.2	60.3	162	-163.6	32.7	0	0	0	116.8	Y484 C485	Y484-N489 WeakPolarHBondContact CE2-OD1 3.37Å; C485-N489 PolarHBondContact O-N 2.83Å
490	K	38.9	Very low	40.5	Very low	189 Å²	189	118.3 Å²	118.3	82%	0.822	68%	0.684	S	S	*	*			trans	-142.3	144.7	170.2	-77.7	-168.8	174.3	-176	0	110.4	C488 G492	C488-K490 PolarHBondContact O-N 2.96Å; K490-G492 PolarHBondContact O-N 3.39Å
491	D	37.9	Very low	40.4	Very low	163 Å²	163	122.5 Å²	122.5	87%	0.872	70%	0.697	S	S	*	*			trans	-69.2	119.9	-178.7	-53	-84.8	0	0	0	111.6	Q493	D491-Q493 VanDerWaalsContact C-N 3.3Å; D491-Q493 PolarHBondContact O-N 2.87Å
492	G	35.3	Very low	39.8	Very low	88 Å²	88	123.4 Å²	123.4	91%	0.907	70%	0.696	S	S	*	*			trans	-77.7	67.2	-176.1	0	0	0	0	0	113.9	K490	K490-G492 PolarHBondContact O-N 3.39Å
493	Q	36.6	Very low	38.7	Very low	170 Å²	170	127.2 Å²	127.2	79%	0.794	71%	0.714	S	S	*	*			trans	-73.7	126.7	163.2	-86.8	-162.7	-47.6	0	0	111.2	D491	D491-Q493 VanDerWaalsContact C-N 3.3Å; D491-Q493 PolarHBondContact O-N 2.87Å
494	E	39.2	Very low	37.8	Very low	161 Å²	161	126.8 Å²	126.8	75%	0.752	72%	0.72	S	S	*	*	S	Bend	trans	48	82.5	149.4	-53.5	-166.6	176.4	0	0	118.4
495	N	31	Very low	37.2	Very low	161 Å²	161	127.9 Å²	127.9	86%	0.861	73%	0.731	S	S	*	*				174.5	172	115.1	-98	-73.4	0	0	0	112.5	G497	N495-G497 PolarHBondContact O-N 3.45Å
496	A	44.3	Very low	37	Very low	111 Å²	111	134.6 Å²	134.6	92%	0.917	76%	0.758	S	S	*	*			trans	-76.8	99.2	-178.1	0	0	0	0	0	112.7
497	G	36.8	Very low	36.2	Very low	70 Å²	70	138 Å²	138	72%	0.722	77%	0.772	S	S	*	*			trans	-143.7	141.2	169	0	0	0	0	0	111	N495	N495-G497 PolarHBondContact O-N 3.45Å
498	K	38.2	Very low	35.7	Very low	207 Å²	207	138.1 Å²	138.1	90%	0.9	77%	0.774	S	S	*	*			trans	-78.5	132.3	172.7	-62.2	176.5	-177.9	176.2	0	108.9
499	C	33.4	Very low	35.1	Very low	84 Å²	84	141.1 Å²	141.1	57%	0.568	79%	0.791	S	S	*	*			trans	-64.2	134.5	165.8	-68.8	0	0	0	0	109.9	H501	C499-H501 PolarHBondContact O-N 2.79Å
500	P	36.9	Very low	34.4	Very low	117 Å²	117	140.2 Å²	140.2	76%	0.76	79%	0.794	S	S	*	*	S	Bend	trans	-83.7	48.4	-170.5	36.4	-38.2	0	0	0	112.3
501	H	41.6	Very low	33.9	Very low	109 Å²	109	138.4 Å²	138.4	51%	0.505	79%	0.792	S	S	.	*			trans	-125.2	25.5	-173.5	-53.8	-27.5	0	0	0	112.2	C499	C499-H501 PolarHBondContact O-N 2.79Å
502	L	38.8	Very low	33.6	Very low	162 Å²	162	140.4 Å²	140.4	85%	0.848	79%	0.788	S	S	*	*			trans	-138.2	78.3	176.7	-83.4	173.3	0	0	0	110.1
503	E	27.6	Very low	33.3	Very low	190 Å²	190	142.6 Å²	142.6	89%	0.888	77%	0.774	S	S	*	*			trans	-160.1	135.4	148.2	-114.9	152.2	-156.6	0	0	111.3
504	S	29	Very low	33	Very low	106 Å²	106	141.5 Å²	141.5	74%	0.741	77%	0.773	S	S	*	*			trans	58.5	106	154.3	-52.1	0	0	0	0	122
505	E	30.6	Very low	32.5	Very low	175 Å²	175	138.5 Å²	138.5	82%	0.818	77%	0.77	S	S	*	*				34.5	138.2	120.1	-45.4	-66	83.9	0	0	122
506	E	31.8	Very low	32.6	Very low	182 Å²	182	136.8 Å²	136.8	85%	0.85	76%	0.761	S	S	*	*			trans	64.8	104.1	155.7	-38.9	-150.3	122.9	0	0	121
507	S	27.9	Very low	32	Very low	130 Å²	130	137.4 Å²	137.4	91%	0.909	75%	0.753	S	S	*	*				179.4	161.2	114.2	36	0	0	0	0	111.7
508	D	29	Very low	31.6	Very low	149 Å²	149	140.3 Å²	140.3	80%	0.797	75%	0.752	S	S	*	*			trans	-111.7	-178.3	-169.1	-152.2	-28.9	0	0	0	111.7
509	T	28.1	Very low	31.4	Very low	125 Å²	125	138 Å²	138	77%	0.767	74%	0.744	S	S	*	*			trans	81.5	136.7	176.7	74.5	0	0	0	0	116.6
510	S	28.6	Very low	31.2	Very low	96 Å²	96	139.3 Å²	139.3	67%	0.671	75%	0.745	S	S	*	*			cis	-160.9	152.5	-14	51.5	0	0	0	0	114.6
511	L	29.9	Very low	30.7	Very low	150 Å²	150	142.7 Å²	142.7	79%	0.785	75%	0.747	S	S	*	*			trans	70.8	135.3	136.4	-86.5	170.7	0	0	0	123.4
512	R	30.3	Very low	30.3	Very low	206 Å²	206	142.4 Å²	142.4	78%	0.777	76%	0.758	S	S	*	*			trans	80.9	139.2	154.1	-64.4	-175.4	170.8	-173	-2.9	119.8
513	E	29.5	Very low	30.1	Very low	133 Å²	133	140.1 Å²	140.1	62%	0.621	75%	0.753	S	S	*	*			cis	-165.1	139	-18.6	-120.2	173.3	128	0	0	110.1
514	L	30.1	Very low	30	Very low	147 Å²	147	138 Å²	138	77%	0.77	75%	0.753	S	S	*	*			trans	62	157.8	150.6	-60.5	170.3	0	0	0	118.8
515	S	28.5	Very low	29.9	Very low	98 Å²	98	141.3 Å²	141.3	69%	0.685	75%	0.754	S	S	*	*			cis	-147.8	142.8	4.7	40.8	0	0	0	0	114.4
516	N	33.2	Very low	30.1	Very low	126 Å²	126	137.7 Å²	137.7	67%	0.674	75%	0.746	S	S	*	*				62.3	112.6	128.3	-58.7	0.9	0	0	0	125.5
517	V	32.5	Very low	29.7	Very low	124 Å²	124	136.9 Å²	136.9	75%	0.752	74%	0.742	S	S	*	*				66.7	146.3	119	-45.9	0	0	0	0	122.2
518	D	28.4	Very low	29.6	Very low	131 Å²	131	133.5 Å²	133.5	70%	0.701	73%	0.727	S	S	*	*			cis	-137.3	-133	0.5	-140.4	-45.9	0	0	0	112.6
519	E	33.3	Very low	30.1	Very low	157 Å²	157	131.8 Å²	131.8	73%	0.734	73%	0.725	S	S	*	*			cis	-150.9	-155.9	6.1	-141.8	-80.8	135.1	0	0	110.9
520	L	29.8	Very low	30	Very low	112 Å²	112	134 Å²	134	59%	0.586	73%	0.726	S	S	*	*			trans	-124.1	-172.7	-156.2	-88.4	74.4	0	0	0	112.7
521	K	27	Very low	29.8	Very low	188 Å²	188	135.8 Å²	135.8	82%	0.817	73%	0.727	S	S	*	*			cis	-172.3	165.7	-46.9	-174.2	164.6	-179.6	177.3	0	109.5
522	S	31.7	Very low	29.4	Very low	103 Å²	103	136.8 Å²	136.8	72%	0.72	73%	0.728	S	S	*	*			trans	-124.1	139.1	179.6	60.1	0	0	0	0	114
523	P	35.8	Very low	29.3	Very low	115 Å²	115	133.6 Å²	133.6	75%	0.747	72%	0.724	S	S	*	*			trans	-131.9	175.8	162.9	22.5	-0.4	0	0	0	113.8
524	T	25.2	Very low	29.6	Very low	145 Å²	145	133.4 Å²	133.4	89%	0.89	73%	0.734	S	S	*	*			cis	-160	-176.8	-46.4	18.5	0	0	0	0	109.3
525	K	27	Very low	29.4	Very low	175 Å²	175	130.9 Å²	130.9	76%	0.761	73%	0.729	S	S	*	*			trans	-94	174.2	-172.5	-140	-159.1	172.7	-157.4	0	114.1
526	P	34.7	Very low	29.3	Very low	99 Å²	99	134.6 Å²	134.6	64%	0.643	74%	0.74	S	S	*	*				-146.4	-150.4	82.9	41.5	-20.2	0	0	0	112.5
527	E	23.9	Very low	28.8	Very low	166 Å²	166	133 Å²	133	78%	0.776	74%	0.744	S	S	*	*			cis	-151.4	-153.7	-13.7	-144.5	9.2	80.8	0	0	113.1
528	G	24.2	Very low	28.6	Very low	58 Å²	58	131.8 Å²	131.8	60%	0.598	75%	0.747	S	S	*	*			trans	-114.1	-153.7	177.2	0	0	0	0	0	116.4
529	P	40.3	Very low	28.4	Very low	114 Å²	114	130.9 Å²	130.9	74%	0.74	75%	0.75	S	S	*	*			cis	-137.2	173.4	18.7	44.4	-27.3	0	0	0	118.7
530	E	25.4	Very low	28	Very low	171 Å²	171	131 Å²	131	80%	0.799	76%	0.756	S	S	*	*			trans	54.7	156.4	145.4	-71.2	-176.6	132.9	0	0	122.8
531	L	25.5	Very low	27.8	Very low	134 Å²	134	129.3 Å²	129.3	70%	0.702	77%	0.765	S	S	*	*			cis	-159.2	-177.5	0.2	-124.8	171	0	0	0	112.5
532	E	21.8	Very low	27.8	Very low	170 Å²	170	125.1 Å²	125.1	79%	0.794	77%	0.765	S	S	*	*			trans	78.8	154.8	162.7	-69.4	-65.3	84.7	0	0	123.9
533	M	27.8	Very low	28.1	Very low	140 Å²	140	126.1 Å²	126.1	69%	0.69	77%	0.769	S	S	*	*			trans	-154.6	156.4	-175.9	-119.9	-160.4	79.4	0	0	112.5	S535	M533-S535 VanDerWaalsContact CE-OG 3.29Å; M533-S535 WeakPolarHBondContact CE-OG 3.49Å
534	P	36.1	Very low	27.8	Very low	129 Å²	129	128 Å²	128	84%	0.838	78%	0.779	S	S	*	*				-147.2	-177	123.2	33.8	-15.2	0	0	0	115.6
535	S	24.9	Very low	28	Very low	94 Å²	94	124.4 Å²	124.4	66%	0.657	77%	0.771	S	S	*	*			trans	-121.9	165.9	-170.3	-61.1	0	0	0	0	114.6	M533	M533-S535 VanDerWaalsContact CE-OG 3.29Å; M533-S535 WeakPolarHBondContact CE-OG 3.49Å
536	L	26.2	Very low	28	Very low	176 Å²	176	123.8 Å²	123.8	92%	0.921	77%	0.774	S	S	*	*			trans	149.7	151.4	149	-83.7	163.4	0	0	0	110.2
537	A	24	Very low	27.7	Very low	92 Å²	92	126.9 Å²	126.9	76%	0.76	79%	0.785	S	S	*	*			cis	-149.7	179.3	-7.6	0	0	0	0	0	109.9
538	A	26.8	Very low	27.7	Very low	98 Å²	98	122.6 Å²	122.6	81%	0.81	79%	0.785	S	S	*	*			trans	-147.8	144.3	-178.4	0	0	0	0	0	114.9
539	C	24	Very low	27.9	Very low	113 Å²	113	125.6 Å²	125.6	76%	0.764	80%	0.796	S	S	*	*			trans	-176.4	159.4	164.5	53.9	0	0	0	0	110.6
540	N	26.9	Very low	28.1	Very low	160 Å²	160	125.7 Å²	125.7	86%	0.856	80%	0.797	S	S	*	*			cis	-162.9	150.6	-22.8	-104.4	-19.3	0	0	0	112.5
541	G	24.8	Very low	28.1	Very low	76 Å²	76	124.8 Å²	124.8	78%	0.784	80%	0.798	S	S	*	*			trans	75.1	160.2	143.2	0	0	0	0	0	120.5
542	A	27.3	Very low	28.1	Very low	99 Å²	99	122 Å²	122	82%	0.818	80%	0.795	S	S	*	*			cis	-161	155	-16.1	0	0	0	0	0	111
543	P	38.5	Very low	28.4	Very low	124 Å²	124	119.5 Å²	119.5	81%	0.805	80%	0.796	S	S	*	*			trans	-104.6	174.1	178.3	40.1	-34.2	0	0	0	113.8
544	T	28.1	Very low	28.3	Very low	154 Å²	154	122.7 Å²	122.7	95%	0.945	81%	0.805	S	S	*	*			trans	-138.5	147.9	168.9	47.6	0	0	0	0	113
545	G	30.1	Very low	27.9	Very low	71 Å²	71	120.4 Å²	120.4	73%	0.732	80%	0.797	S	S	*	*			trans	-178	152.1	178.5	0	0	0	0	0	110.6
546	I	27	Very low	28.1	Very low	161 Å²	161	123.9 Å²	123.9	83%	0.826	81%	0.809	S	S	*	*			trans	-157.4	162.5	-170.3	42	166.6	0	0	0	109.5
547	L	28.6	Very low	28.3	Very low	165 Å²	165	119 Å²	119	86%	0.864	80%	0.802	S	S	*	*			cis	-127.6	166.2	9	-68.8	163.1	0	0	0	111
548	G	24.2	Very low	28.7	Very low	75 Å²	75	120.8 Å²	120.8	77%	0.773	80%	0.798	S	S	*	*			trans	147.6	118.1	158.6	0	0	0	0	0	115.6
549	S	27	Very low	29.5	Very low	121 Å²	121	120.5 Å²	120.5	85%	0.846	79%	0.788	S	S	*	*			trans	-149.5	168.7	172.3	-55.6	0	0	0	0	107.7
550	P	45.6	Very low	30.8	Very low	116 Å²	116	120.9 Å²	120.9	75%	0.753	78%	0.778	S	S	*	*			cis	-121.3	-162.9	3.7	45.8	-30.8	0	0	0	111.2
551	D	25.2	Very low	32.1	Very low	152 Å²	152	120.9 Å²	120.9	81%	0.813	77%	0.771	S	S	*	*			cis	-154.1	179.6	1.2	-143.5	-44.8	0	0	0	110.8
552	A	26.1	Very low	34	Very low	77 Å²	77	122 Å²	122	64%	0.636	75%	0.754	S	S	*	*			trans	63.8	82.5	155.1	0	0	0	0	0	120.6
553	S	27	Very low	36.2	Very low	117 Å²	117	121.3 Å²	121.3	82%	0.818	73%	0.733	S	S	*	*				48.9	95.6	120.1	-56.3	0	0	0	0	121.6
554	K	25.6	Very low	37.6	Very low	206 Å²	206	120.2 Å²	120.2	90%	0.896	72%	0.719	S	S	*	*				177.5	142.2	107.6	-103	175.8	176.9	175.2	0	115.6
555	A	27.5	Very low	40	Very low	81 Å²	81	112.9 Å²	112.9	67%	0.669	67%	0.674	S	S	*	*			trans	62.8	134.9	145	0	0	0	0	0	122
556	N	29.6	Very low	42.2	Very low	167 Å²	167	113.1 Å²	113.1	89%	0.893	68%	0.677	S	S	*	*			trans	69.9	135.2	158.9	-56.3	-23.8	0	0	0	117.9
557	G	30.2	Very low	44.3	Very low	75 Å²	75	108.8 Å²	108.8	77%	0.773	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-91.9	147.4	-176.2	0	0	0	0	0	114.1
558	D	33.3	Very low	46.7	Very low	129 Å²	129	103.5 Å²	103.5	69%	0.69	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-65.5	135.4	174.7	-154.1	-118.2	0	0	0	110.3	K561	D558-K561 VanDerWaalsContact OD1-CE 3.24Å; D558-K561 WeakPolarHBondContact OD1-CE 3.17Å; D558-K561 IonicContact OD1-NZ 3.4Å; D558-K561 PolarHBondContact OD1-NZ 3.27Å
559	P	42	Very low	49	Very low	92 Å²	92	102.3 Å²	102.3	60%	0.597	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-78.6	160.5	-167.3	30.6	-36.5	0	0	0	113.9	K561	P559-K561 PolarHBondContact O-N 2.91Å
560	E	51.8	Low	51.4	Low	120 Å²	120	101.6 Å²	101.6	56%	0.561	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-48.3	117.7	159.9	-73.1	-177.8	96.2	0	0	109.5	K562	E560-K562 HydrophobicContact CB-CD 4.25Å; E560-K562 HydrophobicContact CB-CG 4.24Å; E560-K562 PolarHBondContact O-N 2.96Å; E560-K562 WeakPolarHBondContact OE2-CE 3.32Å; E560-K562 IonicContact OE2-NZ 3.41Å; E560-K562 PolarHBondContact OE2-NZ 3.49Å
561	K	55.4	Low	52.8	Low	161 Å²	161	98.8 Å²	98.8	70%	0.7	59%	0.588	S	S	*	*			trans	-73.5	71.2	179.3	-73	179.9	179.6	163.3	0	111.5	D558 P559 F563	D558-K561 VanDerWaalsContact OD1-CE 3.24Å; D558-K561 WeakPolarHBondContact OD1-CE 3.17Å; D558-K561 IonicContact OD1-NZ 3.4Å; D558-K561 PolarHBondContact OD1-NZ 3.27Å; P559-K561 PolarHBondContact O-N 2.91Å; K561-F563 PolarHBondContact O-N 3.49Å
562	K	64.6	Low	55.3	Low	100 Å²	100	93.3 Å²	93.3	44%	0.435	56%	0.557	S	S	.	*			trans	-63.6	122.3	175.3	-78.2	155.9	-180	158.4	0	109.5	E560 I564 A571	E560-K562 HydrophobicContact CB-CD 4.25Å; E560-K562 HydrophobicContact CB-CG 4.24Å; E560-K562 PolarHBondContact O-N 2.96Å; E560-K562 WeakPolarHBondContact OE2-CE 3.32Å; E560-K562 IonicContact OE2-NZ 3.41Å; E560-K562 PolarHBondContact OE2-NZ 3.49Å; K562-I564 VanDerWaalsContact C-N 3.35Å; K562-I564 HydrophobicContact CB-CG1 4.45Å; K562-I564 PolarHBondContact O-N 3.35Å; K562-A571 HydrophobicContact CB-CB 3.92Å; K562-A571 HydrophobicContact CD-CB 4.11Å; K562-A571 HydrophobicContact CG-CB 4.09Å
563	F	72.6	Confident	57.6	Low	83 Å²	83	99.8 Å²	99.8	36%	0.364	57%	0.565	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-77.9	88.4	174.4	-67.4	-83.6	0	0	0	108.3	K561 F572 K575 L578	K561-F563 PolarHBondContact O-N 3.49Å; F563-F572 PolarHBondContact N-O 2.96Å; F563-F572 WeakPolarHBondContact O-CB 3.26Å; F563-F572 PolarHBondContact O-N 2.88Å; F563-K575 HydrophobicContact CD1-CB 3.93Å; F563-K575 HydrophobicContact CD1-CD 4.24Å; F563-K575 HydrophobicContact CD1-CG 4.2Å; F563-K575 HydrophobicContact CD2-CB 4.44Å; F563-K575 HydrophobicContact CE1-CB 4.04Å; F563-K575 HydrophobicContact CE1-CD 4.13Å; F563-K575 HydrophobicContact CE1-CG 4.44Å; F563-K575 HydrophobicContact CG-CB 4.13Å; F563-K575 HydrophobicContact CZ-CB 4.35Å; F563-L578 HydrophobicContact CB-CB 4.27Å; F563-L578 HydrophobicContact CB-CD2 3.89Å
564	I	68.9	Low	59.7	Low	101 Å²	101	97.3 Å²	97.3	52%	0.518	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	136.4	-178.8	-68	174.2	0	0	0	110.5	K562 G566 Q570 A571	K562-I564 VanDerWaalsContact C-N 3.35Å; K562-I564 HydrophobicContact CB-CG1 4.45Å; K562-I564 PolarHBondContact O-N 3.35Å; I564-G566 PolarHBondContact O-N 3.25Å; I564-Q570 CarbonylContact C-O 3.39Å; I564-Q570 WeakPolarHBondContact CA-O 3.37Å; I564-A571 HydrophobicContact CG1-CB 4.14Å
565	C	77.9	Confident	62.1	Low	0 Å²	0	93.6 Å²	93.6	0%	0	53%	0.529	C	S	.	.			trans	-77.4	110.7	169.6	-171.1	0	0	0	0	110.6	I567 C568 G569 Q570 F572 L578 Q582 H586	C565-I567 PolarHBondContact O-N 2.96Å; C565-C568 PolarHBondContact O-N 3.41Å; C565-G569 WeakPolarHBondContact O-CA 3.29Å; C565-G569 PolarHBondContact O-N 2.89Å; C565-Q570 PolarHBondContact N-O 3.47Å; C565-F572 HydrophobicContact CB-CE2 4.12Å; C565-L578 HydrophobicContact CB-CD1 3.5Å; C565-Q582 VanDerWaalsContact SG-CG 3.55Å; C565-H586 PolarHBondContact SG-CD2 3.11Å
566	G	76.8	Confident	64.3	Low	77 Å²	77	93.2 Å²	93.2	79%	0.794	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	25.2	177.1	0	0	0	0	0	116.1	I564	I564-G566 PolarHBondContact O-N 3.25Å
567	I	71.4	Confident	66.4	Low	70 Å²	70	92.4 Å²	92.4	36%	0.359	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.9	-32.6	174.7	-54.3	174.9	0	0	0	110.8	C565 H586 Q589	C565-I567 PolarHBondContact O-N 2.96Å; I567-H586 HydrophobicContact CB-CB 4.48Å; I567-H586 HydrophobicContact CD1-CB 3.66Å; I567-H586 HydrophobicContact CG2-CB 4.31Å; I567-H586 VanDerWaalsContact CG2-ND1 3.33Å; I567-H586 WeakPolarHBondContact CG2-ND1 2.8Å; I567-Q589 HydrophobicContact CG2-CB 4.12Å
568	C	77.4	Confident	68.9	Low	54 Å²	54	89.5 Å²	89.5	37%	0.365	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.7	1.9	176.7	66.7	0	0	0	0	115.7	C565 Q570 H581 H586	C565-C568 PolarHBondContact O-N 3.41Å; C568-Q570 PolarHBondContact O-N 3.44Å; C568-Q570 VanDerWaalsContact O-N 3.14Å; C568-H581 VanDerWaalsContact SG-CE1 3.58Å; C568-H581 PolarHBondContact SG-NE2 3.08Å; C568-H586 PolarHBondContact SG-NE2 2.97Å
569	G	73.3	Confident	70.8	Confident	49 Å²	49	87 Å²	87	51%	0.505	46%	0.46	S	S	.	.			trans	72.1	-3.5	-177.5	0	0	0	0	0	115.9	C565 A571	C565-G569 WeakPolarHBondContact O-CA 3.29Å; C565-G569 PolarHBondContact O-N 2.89Å; G569-A571 PolarHBondContact O-N 3.21Å
570	Q	76.5	Confident	72.6	Confident	107 Å²	107	88.4 Å²	88.4	50%	0.5	46%	0.457	S	S	.	.			trans	-65.1	131.8	-177.4	-71.7	-173.3	0.1	0	0	112.7	I564 C565 C568 F572 H581	I564-Q570 CarbonylContact C-O 3.39Å; I564-Q570 WeakPolarHBondContact CA-O 3.37Å; C565-Q570 PolarHBondContact N-O 3.47Å; C568-Q570 PolarHBondContact O-N 3.44Å; C568-Q570 VanDerWaalsContact O-N 3.14Å; Q570-F572 HydrophobicContact CB-CE2 3.6Å; Q570-F572 HydrophobicContact CB-CZ 3.78Å; Q570-F572 WeakPolarHBondContact O-CD2 3.49Å; Q570-F572 WeakPolarHBondContact O-CE2 3.38Å; Q570-H581 PolarHBondContact OE1-CE1 3.13Å
571	A	75.3	Confident	73.9	Confident	56 Å²	56	83.7 Å²	83.7	46%	0.463	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	109.7	-173.2	0	0	0	0	0	112.6	K562 I564 G569	K562-A571 HydrophobicContact CB-CB 3.92Å; K562-A571 HydrophobicContact CD-CB 4.11Å; K562-A571 HydrophobicContact CG-CB 4.09Å; I564-A571 HydrophobicContact CG1-CB 4.14Å; G569-A571 PolarHBondContact O-N 3.21Å
572	F	79.3	Confident	75	Confident	37 Å²	37	79 Å²	79	16%	0.162	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	136.8	-178.9	-63.6	-82.1	0	0	0	113.3	F563 C565 Q570 T574 L578 H581	F563-F572 PolarHBondContact N-O 2.96Å; F563-F572 WeakPolarHBondContact O-CB 3.26Å; F563-F572 PolarHBondContact O-N 2.88Å; C565-F572 HydrophobicContact CB-CE2 4.12Å; Q570-F572 HydrophobicContact CB-CE2 3.6Å; Q570-F572 HydrophobicContact CB-CZ 3.78Å; Q570-F572 WeakPolarHBondContact O-CD2 3.49Å; Q570-F572 WeakPolarHBondContact O-CE2 3.38Å; F572-T574 VanDerWaalsContact C-N 3.28Å; F572-T574 PolarHBondContact O-N 3.02Å; F572-L578 HydrophobicContact CB-CB 4.13Å; F572-L578 HydrophobicContact CD2-CB 4.09Å; F572-L578 HydrophobicContact CD2-CD1 3.82Å; F572-L578 HydrophobicContact CE2-CD1 4.22Å; F572-L578 HydrophobicContact CG-CB 4.25Å; F572-H581 HydrophobicContact CE1-CB 4.01Å; F572-H581 HydrophobicContact CE2-CB 4.09Å; F572-H581 AromaticContact CE2-CD2 3.4Å; F572-H581 VanDerWaalsContact CE2-CD2 3.4Å; F572-H581 WeakPolarHBondContact CE2-CD2 3.33Å; F572-H581 AromaticContact CE2-CG 3.62Å; F572-H581 AromaticContact CE2-NE2 3.72Å; F572-H581 HydrophobicContact CZ-CB 3.67Å; F572-H581 AromaticContact CZ-CD2 3.57Å; F572-H581 AromaticContact CZ-CE1 3.73Å; F572-H581 AromaticContact CZ-CG 3.27Å; F572-H581 AromaticContact CZ-ND1 3.4Å; F572-H581 WeakPolarHBondContact CZ-ND1 3.42Å; F572-H581 AromaticContact CZ-NE2 3.84Å
573	R	73.4	Confident	75.4	Confident	214 Å²	214	80.8 Å²	80.8	81%	0.808	43%	0.425	S	S	*	.	S	Bend	trans	-66.4	-22.2	177.8	-72	-179	172.4	159.8	0.1	114.1
574	T	71.4	Confident	75.3	Confident	65 Å²	65	87.3 Å²	87.3	40%	0.399	45%	0.447	S	S	.	.	S	Bend	trans	-144.5	151.2	170.9	79.8	0	0	0	0	112.9	F572 S576 Y577 L578	F572-T574 VanDerWaalsContact C-N 3.28Å; F572-T574 PolarHBondContact O-N 3.02Å; T574-S576 PolarHBondContact O-N 3.22Å; T574-Y577 PolarHBondContact O-N 3.39Å; T574-Y577 VanDerWaalsContact O-N 3.1Å; T574-Y577 WeakPolarHBondContact OG1-CD2 3.47Å; T574-L578 PolarHBondContact O-N 2.9Å
575	K	75.9	Confident	75.2	Confident	127 Å²	127	86.4 Å²	86.4	55%	0.552	45%	0.446	S	S	*	.	H	α-helix	trans	-60.7	-23.6	-179.9	-164	165.5	-176	170.4	0	114.3	F563 N579	F563-K575 HydrophobicContact CD1-CB 3.93Å; F563-K575 HydrophobicContact CD1-CD 4.24Å; F563-K575 HydrophobicContact CD1-CG 4.2Å; F563-K575 HydrophobicContact CD2-CB 4.44Å; F563-K575 HydrophobicContact CE1-CB 4.04Å; F563-K575 HydrophobicContact CE1-CD 4.13Å; F563-K575 HydrophobicContact CE1-CG 4.44Å; F563-K575 HydrophobicContact CG-CB 4.13Å; F563-K575 HydrophobicContact CZ-CB 4.35Å; K575-N579 PolarHBondContact O-N 3.12Å; K575-N579 PolarHBondContact O-OD1 3Å
576	S	72.9	Confident	74.8	Confident	74 Å²	74	86.9 Å²	86.9	52%	0.517	45%	0.448	S	S	.	.	H	α-helix	trans	-72.3	-34.7	176	-170.7	0	0	0	0	112.4	T574 K580	T574-S576 PolarHBondContact O-N 3.22Å; S576-K580 WeakPolarHBondContact O-CG 3.22Å; S576-K580 PolarHBondContact O-N 2.88Å
577	Y	75	Confident	74.1	Confident	150 Å²	150	91.5 Å²	91.5	59%	0.588	45%	0.447	S	S	*	.	H	α-helix	trans	-72.9	-40	171.3	-74.3	-72	0	0	0	111.7	T574 N579 K580 H581	T574-Y577 PolarHBondContact O-N 3.39Å; T574-Y577 VanDerWaalsContact O-N 3.1Å; T574-Y577 WeakPolarHBondContact OG1-CD2 3.47Å; Y577-N579 PolarHBondContact O-N 3.14Å; Y577-K580 PolarHBondContact O-N 3.43Å; Y577-H581 WeakPolarHBondContact O-CB 3.31Å; Y577-H581 PolarHBondContact O-N 3.04Å
578	L	82.1	Confident	73.1	Confident	14 Å²	14	92 Å²	92	7%	0.073	46%	0.461	C	S	.	.	H	α-helix	trans	-55.3	-51.5	172.7	172.5	59.3	0	0	0	111.7	F563 C565 F572 T574 K580 H581 Q582	F563-L578 HydrophobicContact CB-CB 4.27Å; F563-L578 HydrophobicContact CB-CD2 3.89Å; C565-L578 HydrophobicContact CB-CD1 3.5Å; F572-L578 HydrophobicContact CB-CB 4.13Å; F572-L578 HydrophobicContact CD2-CB 4.09Å; F572-L578 HydrophobicContact CD2-CD1 3.82Å; F572-L578 HydrophobicContact CE2-CD1 4.22Å; F572-L578 HydrophobicContact CG-CB 4.25Å; T574-L578 PolarHBondContact O-N 2.9Å; L578-K580 VanDerWaalsContact C-N 3.32Å; L578-K580 PolarHBondContact O-N 3Å; L578-H581 PolarHBondContact O-N 3.4Å; L578-H581 VanDerWaalsContact O-N 3.16Å; L578-Q582 HydrophobicContact CD1-CG 3.88Å; L578-Q582 HydrophobicContact CG-CG 4.48Å; L578-Q582 WeakPolarHBondContact O-CG 3.46Å; L578-Q582 PolarHBondContact O-N 3.32Å
579	N	73.5	Confident	71.8	Confident	75 Å²	75	94.5 Å²	94.5	40%	0.401	47%	0.468	S	S	.	.	H	α-helix	trans	-60.6	-39.6	179.3	-76	17.6	0	0	0	112.3	K575 Y577 H583	K575-N579 PolarHBondContact O-N 3.12Å; K575-N579 PolarHBondContact O-OD1 3Å; Y577-N579 PolarHBondContact O-N 3.14Å; N579-H583 WeakPolarHBondContact O-CB 3.47Å; N579-H583 PolarHBondContact O-CD2 2.89Å; N579-H583 PolarHBondContact O-N 2.91Å
580	K	79.8	Confident	70.1	Confident	123 Å²	123	103.5 Å²	103.5	54%	0.535	49%	0.486	S	S	.	.	H	α-helix	trans	-66.5	-38.3	175.6	-77.1	178.6	178.8	-178.2	0	112.6	S576 Y577 L578 R584	S576-K580 WeakPolarHBondContact O-CG 3.22Å; S576-K580 PolarHBondContact O-N 2.88Å; Y577-K580 PolarHBondContact O-N 3.43Å; L578-K580 VanDerWaalsContact C-N 3.32Å; L578-K580 PolarHBondContact O-N 3Å; K580-R584 WeakPolarHBondContact O-CB 3.44Å; K580-R584 VanDerWaalsContact O-CG 3.3Å; K580-R584 WeakPolarHBondContact O-CG 3.5Å; K580-R584 PolarHBondContact O-N 2.95Å
581	H	78.5	Confident	68.2	Low	20 Å²	20	101.6 Å²	101.6	9%	0.093	49%	0.489	C	S	.	.	H	α-helix	trans	-66.8	-47.8	175.3	161.1	89.2	0	0	0	110.7	C568 Q570 F572 Y577 L578 H583 R584 V585 H586	C568-H581 VanDerWaalsContact SG-CE1 3.58Å; C568-H581 PolarHBondContact SG-NE2 3.08Å; Q570-H581 PolarHBondContact OE1-CE1 3.13Å; F572-H581 HydrophobicContact CE1-CB 4.01Å; F572-H581 HydrophobicContact CE2-CB 4.09Å; F572-H581 AromaticContact CE2-CD2 3.4Å; F572-H581 VanDerWaalsContact CE2-CD2 3.4Å; F572-H581 WeakPolarHBondContact CE2-CD2 3.33Å; F572-H581 AromaticContact CE2-CG 3.62Å; F572-H581 AromaticContact CE2-NE2 3.72Å; F572-H581 HydrophobicContact CZ-CB 3.67Å; F572-H581 AromaticContact CZ-CD2 3.57Å; F572-H581 AromaticContact CZ-CE1 3.73Å; F572-H581 AromaticContact CZ-CG 3.27Å; F572-H581 AromaticContact CZ-ND1 3.4Å; F572-H581 WeakPolarHBondContact CZ-ND1 3.42Å; F572-H581 AromaticContact CZ-NE2 3.84Å; Y577-H581 WeakPolarHBondContact O-CB 3.31Å; Y577-H581 PolarHBondContact O-N 3.04Å; L578-H581 PolarHBondContact O-N 3.4Å; L578-H581 VanDerWaalsContact O-N 3.16Å; H581-H583 VanDerWaalsContact C-N 3.35Å; H581-H583 PolarHBondContact O-N 3.39Å; H581-R584 PolarHBondContact O-N 2.85Å; H581-V585 WeakPolarHBondContact O-CB 3.39Å; H581-V585 PolarHBondContact O-N 3.07Å; H581-H586 AromaticContact CD2-CD2 3.98Å; H581-H586 AromaticContact CE1-NE2 3.74Å; H581-H586 AromaticContact NE2-CD2 3.51Å; H581-H586 AromaticContact NE2-NE2 3.19Å; H581-H586 PolarHBondContact NE2-NE2 3.19Å; H581-H586 VanDerWaalsContact NE2-NE2 3.19Å
582	Q	79.3	Confident	66.3	Low	62 Å²	62	108 Å²	108	29%	0.29	51%	0.509	S	S	.	.	H	α-helix	trans	-57.5	-44.1	175.1	-75.1	175.1	-37.6	0	0	112.2	C565 L578 R584 H586 K587	C565-Q582 VanDerWaalsContact SG-CG 3.55Å; L578-Q582 HydrophobicContact CD1-CG 3.88Å; L578-Q582 HydrophobicContact CG-CG 4.48Å; L578-Q582 WeakPolarHBondContact O-CG 3.46Å; L578-Q582 PolarHBondContact O-N 3.32Å; Q582-R584 VanDerWaalsContact C-N 3.27Å; Q582-R584 PolarHBondContact O-N 3.04Å; Q582-H586 CarbonylContact O-C 3.29Å; Q582-H586 VanDerWaalsContact O-C 3.29Å; Q582-H586 WeakPolarHBondContact O-CA 3.43Å; Q582-H586 PolarHBondContact O-N 3.13Å; Q582-H586 VanDerWaalsContact O-N 3.08Å; Q582-K587 PolarHBondContact O-N 3.12Å; Q582-K587 VanDerWaalsContact O-N 3.17Å
583	H	72.2	Confident	63.9	Low	139 Å²	139	109.9 Å²	109.9	64%	0.644	54%	0.538	S	S	*	.	H	α-helix	trans	-73.1	-7.5	176.3	-85.5	-67.1	0	0	0	115.8	N579 H581	N579-H583 WeakPolarHBondContact O-CB 3.47Å; N579-H583 PolarHBondContact O-CD2 2.89Å; N579-H583 PolarHBondContact O-N 2.91Å; H581-H583 VanDerWaalsContact C-N 3.35Å; H581-H583 PolarHBondContact O-N 3.39Å
584	R	71.6	Confident	62.1	Low	220 Å²	220	106.3 Å²	106.3	83%	0.83	54%	0.54	S	S	*	.	H	α-helix	trans	-111.7	-42.4	178.6	-76	179.7	170.2	-162.6	-5.9	113.5	K580 H581 Q582	K580-R584 WeakPolarHBondContact O-CB 3.44Å; K580-R584 VanDerWaalsContact O-CG 3.3Å; K580-R584 WeakPolarHBondContact O-CG 3.5Å; K580-R584 PolarHBondContact O-N 2.95Å; H581-R584 PolarHBondContact O-N 2.85Å; Q582-R584 VanDerWaalsContact C-N 3.27Å; Q582-R584 PolarHBondContact O-N 3.04Å
585	V	66	Low	60.7	Low	81 Å²	81	109.2 Å²	109.2	49%	0.491	56%	0.56	S	S	.	*	H	α-helix	trans	-94.2	-39.7	-176.3	-174.5	0	0	0	0	111	H581	H581-V585 WeakPolarHBondContact O-CB 3.39Å; H581-V585 PolarHBondContact O-N 3.07Å
586	H	68.5	Low	58.3	Low	10 Å²	10	106.4 Å²	106.4	5%	0.046	57%	0.567	C	S	.	*	S	Bend	trans	-107.8	12.2	-173.2	-57.3	-56	0	0	0	114.6	C565 I567 C568 H581 Q582 A588 Q589	C565-H586 PolarHBondContact SG-CD2 3.11Å; I567-H586 HydrophobicContact CB-CB 4.48Å; I567-H586 HydrophobicContact CD1-CB 3.66Å; I567-H586 HydrophobicContact CG2-CB 4.31Å; I567-H586 VanDerWaalsContact CG2-ND1 3.33Å; I567-H586 WeakPolarHBondContact CG2-ND1 2.8Å; C568-H586 PolarHBondContact SG-NE2 2.97Å; H581-H586 AromaticContact CD2-CD2 3.98Å; H581-H586 AromaticContact CE1-NE2 3.74Å; H581-H586 AromaticContact NE2-CD2 3.51Å; H581-H586 AromaticContact NE2-NE2 3.19Å; H581-H586 PolarHBondContact NE2-NE2 3.19Å; H581-H586 VanDerWaalsContact NE2-NE2 3.19Å; Q582-H586 CarbonylContact O-C 3.29Å; Q582-H586 VanDerWaalsContact O-C 3.29Å; Q582-H586 WeakPolarHBondContact O-CA 3.43Å; Q582-H586 PolarHBondContact O-N 3.13Å; Q582-H586 VanDerWaalsContact O-N 3.08Å; H586-A588 PolarHBondContact O-N 3.44Å; H586-A588 VanDerWaalsContact O-N 3.13Å; H586-Q589 HydrophobicContact CB-CB 4.33Å; H586-Q589 PolarHBondContact CE1-OE1 3.07Å; H586-Q589 VanDerWaalsContact CE1-OE1 3.23Å; H586-Q589 PolarHBondContact ND1-OE1 3.43Å; H586-Q589 PolarHBondContact O-N 2.92Å
587	K	63.8	Low	57	Low	174 Å²	174	109.6 Å²	109.6	76%	0.757	59%	0.586	S	S	*	*	S	Bend	trans	-59.5	-24	176	-163.6	-174.9	173.9	-165	0	112.7	Q582	Q582-K587 PolarHBondContact O-N 3.12Å; Q582-K587 VanDerWaalsContact O-N 3.17Å
588	A	50.1	Low	54.7	Low	81 Å²	81	105.5 Å²	105.5	67%	0.669	59%	0.59	S	S	*	*	S	Bend	trans	-104.3	-14.9	173	0	0	0	0	0	114	H586 R590	H586-A588 PolarHBondContact O-N 3.44Å; H586-A588 VanDerWaalsContact O-N 3.13Å; A588-R590 VanDerWaalsContact C-N 3.33Å; A588-R590 PolarHBondContact O-N 2.96Å
589	Q	48.5	Very low	52.1	Low	107 Å²	107	113.1 Å²	113.1	50%	0.5	63%	0.629	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.7	42.8	-173.7	-67.9	-175.4	-30.8	0	0	113.2	I567 H586	I567-Q589 HydrophobicContact CG2-CB 4.12Å; H586-Q589 HydrophobicContact CB-CB 4.33Å; H586-Q589 PolarHBondContact CE1-OE1 3.07Å; H586-Q589 VanDerWaalsContact CE1-OE1 3.23Å; H586-Q589 PolarHBondContact ND1-OE1 3.43Å; H586-Q589 PolarHBondContact O-N 2.92Å
590	R	38.5	Very low	50	Low	237 Å²	237	114.1 Å²	114.1	89%	0.894	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.7	1.5	155.2	-92.5	-172.8	166.9	-165.3	-7.6	112.7	A588	A588-R590 VanDerWaalsContact C-N 3.33Å; A588-R590 PolarHBondContact O-N 2.96Å
591	A	36.8	Very low	47.5	Very low	68 Å²	68	116 Å²	116	56%	0.562	65%	0.653	S	S	*	*	S	Bend	trans	-104.8	103.3	168.1	0	0	0	0	0	109.2
592	H	35.8	Very low	45.1	Very low	191 Å²	191	122.7 Å²	122.7	88%	0.884	69%	0.686	S	S	*	*			trans	64.1	157.1	167.8	-54.4	-79.7	0	0	0	119.2
593	G	29	Very low	42.6	Very low	75 Å²	75	124.3 Å²	124.3	77%	0.773	71%	0.71	S	S	*	*			trans	-118.8	-178.1	179.8	0	0	0	0	0	112.8
594	V	34.4	Very low	41.2	Very low	139 Å²	139	123.4 Å²	123.4	84%	0.842	72%	0.717	S	S	*	*			trans	-85.5	160.6	-171.9	-130	0	0	0	0	112.5
595	P	41.8	Very low	39.1	Very low	127 Å²	127	117.5 Å²	117.5	83%	0.825	71%	0.709	S	S	*	*				-136.3	174.2	75.2	23.1	-0.1	0	0	0	116.1
596	G	26.9	Very low	37.2	Very low	67 Å²	67	121.4 Å²	121.4	69%	0.691	73%	0.726	S	S	*	*			trans	-96.3	-149.3	172.1	0	0	0	0	0	113
597	P	45.1	Very low	35.2	Very low	142 Å²	142	127.6 Å²	127.6	92%	0.922	77%	0.765	S	S	*	*			cis	-139.1	-174.4	7.2	43.6	-25	0	0	0	116.8
598	G	26.3	Very low	33.6	Very low	64 Å²	64	124.6 Å²	124.6	66%	0.66	77%	0.766	S	S	*	*			trans	152.9	129.7	171.4	0	0	0	0	0	111.3
599	L	28.2	Very low	33	Very low	174 Å²	174	125.9 Å²	125.9	91%	0.911	77%	0.768	S	S	*	*				59	129.3	66	-58.1	-175.4	0	0	0	112.7
600	S	28.4	Very low	31.9	Very low	96 Å²	96	130.6 Å²	130.6	67%	0.671	79%	0.787	S	S	*	*			cis	-150.4	143.3	10.1	-43.2	0	0	0	0	108.8
601	E	27.1	Very low	31.5	Very low	161 Å²	161	124.1 Å²	124.1	75%	0.752	78%	0.778	S	S	*	*				88	153.7	85.2	-153.9	-161.2	150.5	0	0	115.9
602	M	28.9	Very low	31.6	Very low	162 Å²	162	125.4 Å²	125.4	80%	0.798	78%	0.78	S	S	*	*			trans	75.6	132.6	167.3	-64	176.6	-101.1	0	0	121.5
603	A	26.3	Very low	31.5	Very low	95 Å²	95	124.7 Å²	124.7	79%	0.785	78%	0.777	S	S	*	*			trans	-123.5	-175.5	161.4	0	0	0	0	0	107.5
604	P	44	Very low	31.8	Very low	121 Å²	121	129.9 Å²	129.9	79%	0.786	78%	0.782	S	S	*	*			cis	-126.4	-135.4	35.6	30.9	-4.6	0	0	0	111
605	S	26.2	Very low	31.6	Very low	96 Å²	96	129.8 Å²	129.8	67%	0.671	78%	0.776	S	S	*	*			cis	-164.7	162.3	5.8	14.2	0	0	0	0	113.4
606	L	26.5	Very low	31.3	Very low	162 Å²	162	132.1 Å²	132.1	85%	0.848	78%	0.778	S	S	*	*			trans	14.5	131.2	147.8	-49.8	177.9	0	0	0	118.6
607	T	26.3	Very low	31.9	Very low	140 Å²	140	133.2 Å²	133.2	86%	0.859	78%	0.775	S	S	*	*				-159	165.4	62.3	35	0	0	0	0	113.2
608	S	31.1	Very low	31.6	Very low	111 Å²	111	132.6 Å²	132.6	78%	0.776	76%	0.764	S	S	*	*			trans	-135.4	141.1	171.5	168.2	0	0	0	0	109.9
609	P	37	Very low	32.2	Very low	109 Å²	109	136.9 Å²	136.9	71%	0.708	77%	0.77	S	S	*	*			trans	-139.6	130	143.8	20.9	0.6	0	0	0	115.2
610	F	25.5	Very low	32.7	Very low	206 Å²	206	135.9 Å²	135.9	90%	0.904	76%	0.761	S	S	*	*			trans	68.3	173.5	150.8	-74.7	-87.3	0	0	0	120.7
611	S	29.3	Very low	33.3	Very low	100 Å²	100	134.8 Å²	134.8	70%	0.699	75%	0.754	S	S	*	*			trans	177.9	167.9	-138.6	-175.3	0	0	0	0	108.8
612	P	40.5	Very low	33.8	Very low	96 Å²	96	136.2 Å²	136.2	62%	0.623	76%	0.758	S	S	*	*			cis	-134.7	109	-26	27.7	-5	0	0	0	113.3
613	Q	32.8	Very low	34.4	Very low	176 Å²	176	131.2 Å²	131.2	82%	0.822	75%	0.748	S	S	*	*			trans	-142.4	161.1	162	-81.2	87.9	22.6	0	0	111.2
614	Q	34.4	Very low	35	Very low	184 Å²	184	134.9 Å²	134.9	86%	0.86	75%	0.746	S	S	*	*	S	Bend	trans	65.9	71.7	174.2	-56.2	178.5	-14.5	0	0	117.2
615	N	30.2	Very low	35	Very low	136 Å²	136	136.5 Å²	136.5	73%	0.727	74%	0.743	S	S	*	*			trans	-164.6	50.1	141.2	-110.5	-41.1	0	0	0	115.4
616	M	35.5	Very low	35.6	Very low	177 Å²	177	138.6 Å²	138.6	87%	0.872	75%	0.746	S	S	*	*			trans	-112	36.8	168.4	-82.3	-63.8	-62.1	0	0	112
617	S	41.3	Very low	36.2	Very low	89 Å²	89	135.7 Å²	135.7	62%	0.622	73%	0.734	S	S	*	*			trans	-127.9	36.9	-178.5	-157.4	0	0	0	0	112.8
618	L	37.9	Very low	36.8	Very low	130 Å²	130	136.3 Å²	136.3	68%	0.681	73%	0.727	S	S	*	*	S	Bend	trans	-133.1	24.2	175.4	-74.9	177.2	0	0	0	113
619	L	38.8	Very low	37.3	Very low	153 Å²	153	135.5 Å²	135.5	80%	0.801	72%	0.722	S	S	*	*	S	Bend	trans	-119.2	-8.6	171.9	-144.5	72.4	0	0	0	113.9
620	E	38.6	Very low	37.4	Very low	153 Å²	153	134.3 Å²	134.3	72%	0.715	72%	0.721	S	S	*	*	S	Bend	trans	-85.8	-21.4	174.9	-61	-170.6	125.8	0	0	112.7	F622 G623	E620-F622 VanDerWaalsContact C-N 3.28Å; E620-F622 PolarHBondContact O-N 3.16Å; E620-G623 PolarHBondContact O-N 3.04Å
621	S	40.9	Very low	37.9	Very low	74 Å²	74	133.4 Å²	133.4	52%	0.517	72%	0.717	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.6	-5.4	-173.3	47.3	0	0	0	0	116
622	F	37.8	Very low	38.2	Very low	190 Å²	190	132.7 Å²	132.7	83%	0.833	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.1	-5.1	172.5	-80.9	-79.4	0	0	0	114.3	E620	E620-F622 VanDerWaalsContact C-N 3.28Å; E620-F622 PolarHBondContact O-N 3.16Å
623	G	42.3	Very low	38.2	Very low	57 Å²	57	133.6 Å²	133.6	59%	0.588	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-24.8	-179.2	0	0	0	0	0	115	E620	E620-G623 PolarHBondContact O-N 3.04Å
624	F	38.3	Very low	38.6	Very low	173 Å²	173	130.4 Å²	130.4	76%	0.759	72%	0.723	S	S	*	*	S	Bend	trans	-103.5	-4	-162.1	-100.2	-87	0	0	0	117	I626	F624-I626 PolarHBondContact O-N 3.11Å
625	Q	43	Very low	38.8	Very low	154 Å²	154	129.5 Å²	129.5	72%	0.72	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-14.2	-174.4	-151.3	79	62.4	0	0	114.6
626	I	40.3	Very low	39.1	Very low	141 Å²	141	129.5 Å²	129.5	72%	0.723	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.9	-23.5	-171.7	-66.1	179.1	0	0	0	113.2	F624 S629	F624-I626 PolarHBondContact O-N 3.11Å; I626-S629 PolarHBondContact O-OG 3.13Å
627	V	39.2	Very low	38.8	Very low	100 Å²	100	128.5 Å²	128.5	61%	0.606	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	-28.4	-172	-176.4	0	0	0	0	113.2	S629 A630	V627-S629 VanDerWaalsContact C-N 3.31Å; V627-S629 PolarHBondContact O-N 3.15Å; V627-A630 PolarHBondContact O-N 3.44Å
628	Q	38.8	Very low	38.6	Very low	153 Å²	153	128.6 Å²	128.6	72%	0.715	73%	0.732	S	S	*	*	G	3₁₀ helix	trans	-71.6	-17.5	-176.2	-78.4	-173.5	-29.8	0	0	115	A630	Q628-A630 VanDerWaalsContact C-N 3.32Å; Q628-A630 PolarHBondContact O-N 2.92Å
629	S	40.7	Very low	38.5	Very low	95 Å²	95	131.9 Å²	131.9	66%	0.664	74%	0.744	S	S	*	*	G	3₁₀ helix	trans	-78.4	-13.9	178	59.4	0	0	0	0	114.1	I626 V627	I626-S629 PolarHBondContact O-OG 3.13Å; V627-S629 VanDerWaalsContact C-N 3.31Å; V627-S629 PolarHBondContact O-N 3.15Å
630	A	38.6	Very low	38.2	Very low	84 Å²	84	129.8 Å²	129.8	69%	0.694	75%	0.749	S	S	*	*	G	3₁₀ helix	trans	-94.3	-11.4	-175.4	0	0	0	0	0	114.6	V627 Q628	V627-A630 PolarHBondContact O-N 3.44Å; Q628-A630 VanDerWaalsContact C-N 3.32Å; Q628-A630 PolarHBondContact O-N 2.92Å
631	F	36.3	Very low	37.7	Very low	186 Å²	186	126.4 Å²	126.4	82%	0.816	76%	0.755	S	S	*	*	S	Bend	trans	-109.4	-3.8	-174.5	-119.9	-92.4	0	0	0	114.5	S633	F631-S633 PolarHBondContact O-N 3.2Å
632	A	37	Very low	37.5	Very low	85 Å²	85	132.5 Å²	132.5	70%	0.702	78%	0.776	S	S	*	*	S	Bend	trans	-93.8	20.4	-170.5	0	0	0	0	0	115.2
633	S	39.5	Very low	37.3	Very low	116 Å²	116	129.5 Å²	129.5	81%	0.811	78%	0.778	S	S	*	*	S	Bend	trans	-138.5	30.3	-172.2	-54.2	0	0	0	0	114.4	F631	F631-S633 PolarHBondContact O-N 3.2Å
634	S	41.5	Very low	36.7	Very low	109 Å²	109	130.4 Å²	130.4	76%	0.762	79%	0.787	S	S	*	*	S	Bend	trans	-144.4	6.4	-173.8	-165.6	0	0	0	0	116.6
635	L	38.4	Very low	36.6	Very low	164 Å²	164	130.7 Å²	130.7	86%	0.859	80%	0.795	S	S	*	*	S	Bend	trans	-151.6	47.6	-168.3	-113	170.9	0	0	0	117.4
636	V	35.9	Very low	36.1	Very low	136 Å²	136	131.1 Å²	131.1	82%	0.824	80%	0.797	S	S	*	*			trans	-157.7	145.6	147.8	-117.6	0	0	0	0	105.1
637	D	29.4	Very low	36	Very low	156 Å²	156	133.2 Å²	133.2	83%	0.834	80%	0.801	S	S	*	*			cis	-123.1	168.3	20.9	-66.9	-60.4	0	0	0	114.4
638	A	37.1	Very low	35.8	Very low	91 Å²	91	132.4 Å²	132.4	75%	0.752	81%	0.813	S	S	*	*			trans	-141.2	139.7	169.4	0	0	0	0	0	112.3
639	E	35.3	Very low	35.8	Very low	199 Å²	199	128.9 Å²	128.9	93%	0.93	82%	0.818	S	S	*	*			trans	57.3	107.4	161.7	-56.5	-161	105.2	0	0	121.3
640	A	32.6	Very low	35.9	Very low	110 Å²	110	137.9 Å²	137.9	91%	0.909	85%	0.845	S	S	*	*			trans	-159	113.3	133.5	0	0	0	0	0	110.4
641	G	28.7	Very low	35.8	Very low	82 Å²	82	140.6 Å²	140.6	85%	0.845	85%	0.853	S	S	*	*			trans	163.6	66.9	-180	0	0	0	0	0	114.6
642	Q	36.3	Very low	35.7	Very low	202 Å²	202	138.2 Å²	138.2	94%	0.944	85%	0.854	S	S	*	*			trans	-72	151.2	-179.7	-77.1	-179.7	-21.6	0	0	113.3
643	S	34.3	Very low	35.7	Very low	127 Å²	127	141.2 Å²	141.2	89%	0.888	86%	0.863	S	S	*	*			trans	-82.7	156.8	177.7	48.8	0	0	0	0	112.8
644	G	29.3	Very low	35.4	Very low	75 Å²	75	142.6 Å²	142.6	77%	0.773	87%	0.866	S	S	*	*			trans	165.7	94.2	169.6	0	0	0	0	0	114.3
645	I	36.3	Very low	35.1	Very low	180 Å²	180	144.8 Å²	144.8	92%	0.923	87%	0.872	S	S	*	*			trans	-140.6	128.1	159.6	-55.7	-179.6	0	0	0	107
646	E	33.6	Very low	34.8	Very low	162 Å²	162	143.5 Å²	143.5	76%	0.757	87%	0.873	S	S	*	*			trans	-139.2	155	178.3	-146.7	-172.9	-165.9	0	0	110.8
647	F	37.3	Very low	34.8	Very low	186 Å²	186	144 Å²	144	82%	0.816	88%	0.877	S	S	*	*			trans	60.9	115.6	169.1	-78.5	-74.8	0	0	0	122.1
648	G	34	Very low	35.2	Very low	83 Å²	83	143.1 Å²	143.1	86%	0.856	88%	0.88	S	S	*	*				106.1	119.3	129.2	0	0	0	0	0	117.3
649	G	40.1	Very low	35	Very low	79 Å²	79	147.4 Å²	147.4	81%	0.814	89%	0.891	S	S	*	*			cis	154.4	160.7	-8.2	0	0	0	0	0	112.7
650	K	42.3	Very low	35	Very low	284 Å²	284	142.7 Å²	142.7	100%	1.235	89%	0.887	S	S	*	*			trans	-165.3	0	155.5	-122.7	178.5	-177	-180	0	111.5

Retrieved 650 of 650 residues in 136.1 ms (Link to these results)

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