A0A060XMQ3_ONCMY Loading...

Splicing factor U2AF subunit

Necessary for the splicing of pre-mRNA.

AlphaFold DB (A0A4W5LWT9), UniProt , Accession A0A060XMQ3, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene u2af2a, Length 480 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	51.3	Low	65.9	Low	220 Å²	220	126.5 Å²	126.5	100%	1.084	61%	0.61	S	S	*	*				0	145	0	-74.7	73.8	174	0	0	107.5	D5	M1-D5 VanDerWaalsContact CA-OD2 3.29Å; M1-D5 WeakPolarHBondContact CA-OD2 3.38Å; M1-D5 HydrophobicContact CB-CB 4.37Å; M1-D5 WeakPolarHBondContact CB-OD2 3.41Å; M1-D5 WeakPolarHBondContact CG-OD2 3.39Å
2	S	58.5	Low	66.2	Low	75 Å²	75	121.7 Å²	121.7	52%	0.524	60%	0.599	S	S	.	*			trans	-104.2	160.8	177	41.7	0	0	0	0	109.6	F4 D5	S2-F4 PolarHBondContact O-N 3.16Å; S2-D5 PolarHBondContact N-OD2 3.06Å; S2-D5 VanDerWaalsContact N-OD2 3.16Å; S2-D5 WeakPolarHBondContact O-CB 3.17Å; S2-D5 PolarHBondContact O-N 2.9Å
3	D	60.7	Low	66.3	Low	139 Å²	139	122 Å²	122	74%	0.743	60%	0.598	S	S	*	*	H	α-helix	trans	-58	-18.7	-174.4	-44.2	-73.1	0	0	0	113.5	E6 F7	D3-E6 PolarHBondContact O-N 3.29Å; D3-F7 PolarHBondContact O-N 2.91Å; D3-F7 VanDerWaalsContact O-N 3.1Å
4	F	64	Low	66.2	Low	132 Å²	132	121.8 Å²	121.8	58%	0.579	60%	0.601	S	S	*	*	H	α-helix	trans	-60.3	-40.4	171.5	-167.1	-90.3	0	0	0	113.2	S2 E6 F7 E8	S2-F4 PolarHBondContact O-N 3.16Å; F4-E6 PolarHBondContact O-N 3.1Å; F4-F7 PolarHBondContact O-N 3.29Å; F4-E8 HydrophobicContact CD1-CG 4.3Å; F4-E8 HydrophobicContact CE1-CG 3.84Å; F4-E8 HydrophobicContact CZ-CG 4.29Å; F4-E8 PolarHBondContact O-N 3.35Å
5	D	68.6	Low	66.2	Low	82 Å²	82	124.6 Å²	124.6	44%	0.439	61%	0.608	S	S	.	*	H	α-helix	trans	-60.8	-36.3	176.9	-69.9	-56.4	0	0	0	111.2	M1 S2 R9	M1-D5 VanDerWaalsContact CA-OD2 3.29Å; M1-D5 WeakPolarHBondContact CA-OD2 3.38Å; M1-D5 HydrophobicContact CB-CB 4.37Å; M1-D5 WeakPolarHBondContact CB-OD2 3.41Å; M1-D5 WeakPolarHBondContact CG-OD2 3.39Å; S2-D5 PolarHBondContact N-OD2 3.06Å; S2-D5 VanDerWaalsContact N-OD2 3.16Å; S2-D5 WeakPolarHBondContact O-CB 3.17Å; S2-D5 PolarHBondContact O-N 2.9Å; D5-R9 WeakPolarHBondContact O-CB 3.29Å; D5-R9 PolarHBondContact O-N 3.31Å
6	E	69.8	Low	65.7	Low	123 Å²	123	123.7 Å²	123.7	58%	0.575	60%	0.603	S	S	*	*	H	α-helix	trans	-77.9	-34.8	-179.6	-169.4	162.3	-168.8	0	0	111.9	D3 F4 R9 Q10	D3-E6 PolarHBondContact O-N 3.29Å; F4-E6 PolarHBondContact O-N 3.1Å; E6-R9 PolarHBondContact O-N 3.38Å; E6-Q10 WeakPolarHBondContact O-CG 3.47Å; E6-Q10 PolarHBondContact O-N 3.09Å
7	F	72.1	Confident	65.3	Low	126 Å²	126	119.1 Å²	119.1	55%	0.553	59%	0.589	S	S	*	*	H	α-helix	trans	-66.9	-45.2	175.2	-172.2	-107.1	0	0	0	112.9	D3 F4 R9 Q10 L11	D3-F7 PolarHBondContact O-N 2.91Å; D3-F7 VanDerWaalsContact O-N 3.1Å; F4-F7 PolarHBondContact O-N 3.29Å; F7-R9 VanDerWaalsContact C-N 3.26Å; F7-R9 PolarHBondContact O-N 3Å; F7-Q10 PolarHBondContact O-N 2.67Å; F7-L11 HydrophobicContact CD1-CD1 3.84Å; F7-L11 HydrophobicContact CE1-CD1 3.5Å; F7-L11 VanDerWaalsContact CE1-CD1 3.5Å; F7-L11 HydrophobicContact CE1-CG 4.47Å; F7-L11 HydrophobicContact CZ-CD1 4.02Å; F7-L11 PolarHBondContact O-N 3.39Å
8	E	73.2	Confident	64.8	Low	117 Å²	117	120.4 Å²	120.4	55%	0.547	59%	0.593	S	S	.	*	H	α-helix	trans	-62.3	-35.6	173.4	-72.9	-153.6	127.9	0	0	111.8	F4 L11 S12	F4-E8 HydrophobicContact CD1-CG 4.3Å; F4-E8 HydrophobicContact CE1-CG 3.84Å; F4-E8 HydrophobicContact CZ-CG 4.29Å; F4-E8 PolarHBondContact O-N 3.35Å; E8-L11 PolarHBondContact O-N 3.34Å; E8-S12 PolarHBondContact O-N 2.96Å
9	R	71.6	Confident	64.3	Low	171 Å²	171	120.8 Å²	120.8	65%	0.645	59%	0.591	S	S	*	*	H	α-helix	trans	-64.8	-47.3	177.2	-166.9	172.7	-177.7	173.7	-0	112.2	D5 E6 F7 L11 S12 E13	D5-R9 WeakPolarHBondContact O-CB 3.29Å; D5-R9 PolarHBondContact O-N 3.31Å; E6-R9 PolarHBondContact O-N 3.38Å; F7-R9 VanDerWaalsContact C-N 3.26Å; F7-R9 PolarHBondContact O-N 3Å; R9-L11 VanDerWaalsContact C-N 3.31Å; R9-L11 PolarHBondContact O-N 3.41Å; R9-S12 WeakPolarHBondContact O-CB 3.49Å; R9-S12 PolarHBondContact O-N 3.06Å; R9-S12 VanDerWaalsContact O-N 3.07Å; R9-S12 PolarHBondContact O-OG 3.31Å; R9-E13 PolarHBondContact O-N 3.5Å; R9-E13 VanDerWaalsContact O-N 3.09Å
10	Q	68.3	Low	63.9	Low	108 Å²	108	119.6 Å²	119.6	51%	0.505	59%	0.588	S	S	.	*	H	α-helix	trans	-63.2	-35.4	175.4	-70.9	-176.4	12.4	0	0	112.8	E6 F7 S12 N14	E6-Q10 WeakPolarHBondContact O-CG 3.47Å; E6-Q10 PolarHBondContact O-N 3.09Å; F7-Q10 PolarHBondContact O-N 2.67Å; Q10-S12 VanDerWaalsContact C-N 3.33Å; Q10-N14 PolarHBondContact O-N 3.39Å; Q10-N14 PolarHBondContact O-ND2 3.17Å
11	L	67.3	Low	63.6	Low	98 Å²	98	121 Å²	121	51%	0.513	59%	0.59	S	S	.	*	H	α-helix	trans	-63.8	-37.1	171.6	-84.5	166	0	0	0	112.2	F7 E8 R9 K15	F7-L11 HydrophobicContact CD1-CD1 3.84Å; F7-L11 HydrophobicContact CE1-CD1 3.5Å; F7-L11 VanDerWaalsContact CE1-CD1 3.5Å; F7-L11 HydrophobicContact CE1-CG 4.47Å; F7-L11 HydrophobicContact CZ-CD1 4.02Å; F7-L11 PolarHBondContact O-N 3.39Å; E8-L11 PolarHBondContact O-N 3.34Å; R9-L11 VanDerWaalsContact C-N 3.31Å; R9-L11 PolarHBondContact O-N 3.41Å; L11-K15 WeakPolarHBondContact O-CB 3.38Å; L11-K15 PolarHBondContact O-N 3.38Å
12	S	68.6	Low	63.5	Low	69 Å²	69	117.9 Å²	117.9	48%	0.483	57%	0.574	S	S	.	*	H	α-helix	trans	-68.1	-42.6	177.5	79.8	0	0	0	0	112.9	E8 R9 Q10 K15 Q16	E8-S12 PolarHBondContact O-N 2.96Å; R9-S12 WeakPolarHBondContact O-CB 3.49Å; R9-S12 PolarHBondContact O-N 3.06Å; R9-S12 VanDerWaalsContact O-N 3.07Å; R9-S12 PolarHBondContact O-OG 3.31Å; Q10-S12 VanDerWaalsContact C-N 3.33Å; S12-K15 PolarHBondContact O-N 3.42Å; S12-Q16 PolarHBondContact O-N 3.07Å; S12-Q16 VanDerWaalsContact O-N 3.17Å
13	E	68.3	Low	62.9	Low	126 Å²	126	120.6 Å²	120.6	59%	0.589	58%	0.582	S	S	*	*	H	α-helix	trans	-67.9	-44.7	-179.5	-74	-175.6	127.3	0	0	112.2	R9 K15 Q16 A17	R9-E13 PolarHBondContact O-N 3.5Å; R9-E13 VanDerWaalsContact O-N 3.09Å; E13-K15 VanDerWaalsContact C-N 3.28Å; E13-K15 PolarHBondContact O-N 3.28Å; E13-Q16 PolarHBondContact O-N 3.25Å; E13-A17 PolarHBondContact O-N 3.31Å
14	N	65.3	Low	62.3	Low	119 Å²	119	124.5 Å²	124.5	64%	0.636	59%	0.586	S	S	*	*	H	α-helix	trans	-59.3	-39	175.6	-89.8	-45.7	0	0	0	112.3	Q10 Q16 A17 E18	Q10-N14 PolarHBondContact O-N 3.39Å; Q10-N14 PolarHBondContact O-ND2 3.17Å; N14-Q16 VanDerWaalsContact C-N 3.3Å; N14-Q16 PolarHBondContact O-N 2.99Å; N14-A17 PolarHBondContact O-N 3.21Å; N14-E18 PolarHBondContact O-N 3.2Å
15	K	66	Low	61.5	Low	164 Å²	164	126 Å²	126	71%	0.713	60%	0.595	S	S	*	*	H	α-helix	trans	-72.3	-23.7	-179.3	-152.4	168.3	-166.3	170.2	0	113.2	L11 S12 E13	L11-K15 WeakPolarHBondContact O-CB 3.38Å; L11-K15 PolarHBondContact O-N 3.38Å; S12-K15 PolarHBondContact O-N 3.42Å; E13-K15 VanDerWaalsContact C-N 3.28Å; E13-K15 PolarHBondContact O-N 3.28Å
16	Q	57.6	Low	60.4	Low	110 Å²	110	130.5 Å²	130.5	51%	0.514	61%	0.613	S	S	.	*	H	α-helix	trans	-77.6	-40.2	169.7	-165.5	66.8	14.1	0	0	111.2	S12 E13 N14 E18 K19 D20	S12-Q16 PolarHBondContact O-N 3.07Å; S12-Q16 VanDerWaalsContact O-N 3.17Å; E13-Q16 PolarHBondContact O-N 3.25Å; N14-Q16 VanDerWaalsContact C-N 3.3Å; N14-Q16 PolarHBondContact O-N 2.99Å; Q16-E18 VanDerWaalsContact C-N 3.29Å; Q16-E18 PolarHBondContact O-N 3.44Å; Q16-K19 PolarHBondContact O-N 3.18Å; Q16-D20 PolarHBondContact O-N 3.33Å
17	A	58.6	Low	59	Low	45 Å²	45	136 Å²	136	37%	0.372	63%	0.628	S	S	.	*	H	α-helix	trans	-65.8	-22	-178.4	0	0	0	0	0	115	E13 N14	E13-A17 PolarHBondContact O-N 3.31Å; N14-A17 PolarHBondContact O-N 3.21Å
18	E	56.3	Low	57.3	Low	143 Å²	143	142 Å²	142	67%	0.668	65%	0.647	S	S	*	*	H	α-helix	trans	-75.9	-44.1	169.7	-72	-150.6	118	0	0	113	N14 Q16 D20 K21 E22	N14-E18 PolarHBondContact O-N 3.2Å; Q16-E18 VanDerWaalsContact C-N 3.29Å; Q16-E18 PolarHBondContact O-N 3.44Å; E18-D20 PolarHBondContact O-N 3.48Å; E18-K21 WeakPolarHBondContact O-CB 3.41Å; E18-K21 PolarHBondContact O-N 3.09Å; E18-E22 PolarHBondContact O-N 3.25Å
19	K	55.5	Low	55.7	Low	128 Å²	128	142.1 Å²	142.1	56%	0.557	66%	0.661	S	S	*	*	H	α-helix	trans	-60	-33.9	-178.8	-78.4	-177	170.6	-179.3	0	113.2	Q16 K21 N23	Q16-K19 PolarHBondContact O-N 3.18Å; K19-K21 VanDerWaalsContact C-N 3.29Å; K19-K21 PolarHBondContact O-N 3.24Å; K19-N23 PolarHBondContact O-N 3.3Å
20	D	56.8	Low	54.6	Low	97 Å²	97	139.1 Å²	139.1	52%	0.519	66%	0.664	S	S	.	*	H	α-helix	trans	-76.5	-13.9	177.5	-74.3	-14.7	0	0	0	113.7	Q16 E18	Q16-D20 PolarHBondContact O-N 3.33Å; E18-D20 PolarHBondContact O-N 3.48Å
21	K	56.6	Low	53	Low	148 Å²	148	139 Å²	139	64%	0.643	68%	0.675	S	S	*	*	H	α-helix	trans	-82.3	-46.7	169.3	-68.1	171.9	-176.2	169.4	0	111.1	E18 K19 N23 R24	E18-K21 WeakPolarHBondContact O-CB 3.41Å; E18-K21 PolarHBondContact O-N 3.09Å; K19-K21 VanDerWaalsContact C-N 3.29Å; K19-K21 PolarHBondContact O-N 3.24Å; K21-N23 VanDerWaalsContact C-N 3.34Å; K21-N23 PolarHBondContact O-N 2.99Å; K21-R24 PolarHBondContact O-N 2.89Å
22	E	49.5	Very low	51.4	Low	156 Å²	156	146.3 Å²	146.3	73%	0.729	70%	0.696	S	S	*	*	H	α-helix	trans	-58.5	-44.4	-178.5	-168.3	174.3	-153.9	0	0	111.8	E18 R24 H25	E18-E22 PolarHBondContact O-N 3.25Å; E22-R24 PolarHBondContact O-N 3.39Å; E22-H25 PolarHBondContact O-N 3.11Å
23	N	46.2	Very low	49.9	Very low	132 Å²	132	148 Å²	148	71%	0.706	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-62.2	-14.2	179.8	-100.7	-51	0	0	0	115.6	K19 K21	K19-N23 PolarHBondContact O-N 3.3Å; K21-N23 VanDerWaalsContact C-N 3.34Å; K21-N23 PolarHBondContact O-N 2.99Å
24	R	49.1	Very low	48.1	Very low	220 Å²	220	153.3 Å²	153.3	83%	0.83	72%	0.723	S	S	*	*	G	3₁₀ helix	trans	-76.4	-21	179.7	-72.3	-172.4	179.3	-162.9	-0.4	114	K21 E22 H26	K21-R24 PolarHBondContact O-N 2.89Å; E22-R24 PolarHBondContact O-N 3.39Å; R24-H26 PolarHBondContact O-N 3.04Å
25	H	46.7	Very low	46.7	Very low	163 Å²	163	151.8 Å²	151.8	76%	0.755	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-91.6	13.6	-168.3	-79.3	-87.4	0	0	0	115.6	E22	E22-H25 PolarHBondContact O-N 3.11Å
26	H	44.3	Very low	45.1	Very low	178 Å²	178	154.6 Å²	154.6	82%	0.824	73%	0.727	S	S	*	*	G	3₁₀ helix	trans	-127.3	19	-170.9	-101.3	37.9	0	0	0	117	R24	R24-H26 PolarHBondContact O-N 3.04Å
27	R	41.3	Very low	43.9	Very low	238 Å²	238	155 Å²	155	90%	0.898	73%	0.729	S	S	*	*			trans	-142.5	86.8	174.4	-65.7	-170.6	-178.5	-166.5	0.6	114.8
28	R	35.5	Very low	42.7	Very low	252 Å²	252	162.2 Å²	162.2	95%	0.951	75%	0.747	S	S	*	*			trans	-162.8	99.3	144.5	-112.4	163.8	-169.7	-170.8	2.5	115.4
29	S	41.2	Very low	41.6	Very low	119 Å²	119	164 Å²	164	83%	0.832	75%	0.752	S	S	*	*			trans	-156.2	164.1	155.2	-85.1	0	0	0	0	105.8
30	P	47	Very low	40.8	Very low	108 Å²	108	169.3 Å²	169.3	70%	0.701	77%	0.769	S	S	*	*			cis	-137.9	-176.9	14.7	42.6	-25.4	0	0	0	116.1
31	S	34.7	Very low	39.6	Very low	106 Å²	106	176.7 Å²	176.7	74%	0.741	79%	0.789	S	S	*	*			trans	77	130.9	143.3	77.7	0	0	0	0	121.7
32	R	33.5	Very low	38.7	Very low	251 Å²	251	175 Å²	175	95%	0.947	80%	0.796	S	S	*	*				-157.1	152.1	121	-111.2	171.3	-175.8	176.3	1.9	110.6
33	S	37.1	Very low	38	Very low	106 Å²	106	178.7 Å²	178.7	74%	0.741	80%	0.803	S	S	*	*			trans	-130.8	167.2	-174.6	61.6	0	0	0	0	111.7
34	R	32.1	Very low	37.6	Very low	237 Å²	237	179.4 Å²	179.4	89%	0.894	81%	0.807	S	S	*	*			trans	111.1	148	175.1	-67	160.5	-179	-179.2	0	113.3
35	S	34.8	Very low	37.1	Very low	86 Å²	86	178.3 Å²	178.3	60%	0.601	81%	0.808	S	S	*	*			cis	170.5	160.3	-26.9	54.5	0	0	0	0	107.8
36	R	32.8	Very low	36.6	Very low	223 Å²	223	175.8 Å²	175.8	84%	0.842	80%	0.8	S	S	*	*			trans	78.1	157.6	164.6	-64.4	-178.2	179.9	146.1	-0.8	117.5
37	E	33.2	Very low	36.2	Very low	120 Å²	120	177.1 Å²	177.1	56%	0.561	80%	0.798	S	S	*	*			cis	-176	132.1	-24.3	-179.8	178.5	142.6	0	0	113.4
38	R	31.7	Very low	35.8	Very low	195 Å²	195	177.8 Å²	177.8	74%	0.736	80%	0.801	S	S	*	*			trans	67	152.1	152.6	-77.7	173.6	-178.3	155.9	-8.4	123.7
39	K	34.6	Very low	35.8	Very low	180 Å²	180	170.5 Å²	170.5	78%	0.783	79%	0.788	S	S	*	*			trans	74.5	117.7	155.4	-71.8	154	-177.5	174.6	0	116
40	R	38.3	Very low	35.6	Very low	240 Å²	240	176.6 Å²	176.6	91%	0.906	79%	0.793	S	S	*	*				57.6	109.6	56.5	-68.8	-168.5	175.5	-175.6	-0.3	114.6
41	R	32.7	Very low	35.1	Very low	253 Å²	253	177.8 Å²	177.8	96%	0.955	79%	0.794	S	S	*	*			trans	-160.7	124.7	137.1	-113.9	166.5	-176.7	164.8	-0.1	111.6
42	S	37.6	Very low	35.2	Very low	111 Å²	111	183.3 Å²	183.3	78%	0.776	80%	0.798	S	S	*	*			trans	-81.7	158.8	167.3	47.9	0	0	0	0	110.7
43	R	34.6	Very low	35.3	Very low	235 Å²	235	182.7 Å²	182.7	89%	0.887	80%	0.796	S	S	*	*			trans	-156.5	86.4	163.7	-150.1	175.1	-155	175.9	6.2	114.1
44	D	38.1	Very low	35	Very low	147 Å²	147	181.2 Å²	181.2	79%	0.786	80%	0.798	S	S	*	*			trans	-57.1	145.3	156.8	-80	-77.2	0	0	0	111.7
45	K	37.6	Very low	35.2	Very low	196 Å²	196	177.5 Å²	177.5	85%	0.852	80%	0.796	S	S	*	*			trans	-155.1	68.8	154.1	-123.3	-178.6	-177.4	-167.3	0	114.7
46	D	36.2	Very low	35.2	Very low	110 Å²	110	178 Å²	178	59%	0.588	80%	0.798	S	S	*	*			trans	-16.4	152.8	148.8	-173.2	20.9	0	0	0	118
47	R	34.8	Very low	35.3	Very low	206 Å²	206	176.4 Å²	176.4	78%	0.777	80%	0.798	S	S	*	*			trans	81.5	119.4	164.3	-44.1	-174	-171.4	168.7	8.9	120.4
48	R	33	Very low	35.4	Very low	253 Å²	253	177.4 Å²	177.4	96%	0.955	80%	0.803	S	S	*	*				-160	139.6	91.7	-102.7	169.9	-178	-174.3	-0.2	113.4
49	S	35.4	Very low	35.5	Very low	99 Å²	99	178.2 Å²	178.2	69%	0.692	81%	0.806	S	S	*	*			trans	-88	157.7	175.6	179.5	0	0	0	0	112.1
50	R	37.1	Very low	35.5	Very low	247 Å²	247	180.9 Å²	180.9	93%	0.932	81%	0.811	S	S	*	*			trans	-149.4	125.3	147	-129.8	176.2	-168.6	173	3.9	111.6
51	D	37.6	Very low	36	Very low	133 Å²	133	174.5 Å²	174.5	71%	0.711	80%	0.8	S	S	*	*			trans	-80.1	163	-173.2	-37.7	-99.2	0	0	0	113.7
52	R	35.7	Very low	36	Very low	221 Å²	221	173.6 Å²	173.6	83%	0.834	80%	0.797	S	S	*	*				177	121.7	116.4	-94	153.8	-175.4	-157	-0.1	114.3
53	R	35.7	Very low	35.7	Very low	238 Å²	238	179.1 Å²	179.1	90%	0.898	80%	0.801	S	S	*	*			trans	62.6	135.6	146.6	-56.1	173.8	179.4	-177.4	-4	115.8
54	G	32.1	Very low	35.5	Very low	76 Å²	76	173.1 Å²	173.1	78%	0.784	80%	0.795	S	S	*	*			cis	102.2	135.1	45.6	0	0	0	0	0	108
55	D	35.3	Very low	35.1	Very low	159 Å²	159	171.6 Å²	171.6	85%	0.85	80%	0.796	S	S	*	*			cis	-137.4	-148.8	16.6	-158.1	-94.3	0	0	0	112.5
56	S	34.9	Very low	35.6	Very low	95 Å²	95	168 Å²	168	66%	0.664	79%	0.792	S	S	*	*			trans	-128.5	178.3	-156.6	-54.7	0	0	0	0	116.1
57	K	35.3	Very low	35.5	Very low	191 Å²	191	167.2 Å²	167.2	83%	0.83	80%	0.796	S	S	*	*			trans	85.4	104.3	158	-69.4	-178.9	175.7	175.5	0	120.9
58	E	36.2	Very low	35.5	Very low	141 Å²	141	165.8 Å²	165.8	66%	0.659	80%	0.798	S	S	*	*				52.6	133.6	111.1	-84.4	-155.2	118.4	0	0	123.9
59	R	33.7	Very low	35.5	Very low	212 Å²	212	162.4 Å²	162.4	80%	0.8	79%	0.793	S	S	*	*			trans	87.3	127.8	143.8	-70.3	172.5	-162	-159.8	8.5	121.2
60	R	34.7	Very low	35.4	Very low	235 Å²	235	166.5 Å²	166.5	89%	0.887	80%	0.801	S	S	*	*			trans	-71.6	174.5	161.7	-65.6	175.2	169.8	179.3	-4	109.9
61	P	47.8	Very low	35.6	Very low	106 Å²	106	159.6 Å²	159.6	69%	0.688	79%	0.788	S	S	*	*			cis	-148.2	-179.5	21.4	45.1	-25.2	0	0	0	118.7
62	R	33	Very low	35.3	Very low	235 Å²	235	162.7 Å²	162.7	89%	0.887	80%	0.798	S	S	*	*			trans	40.5	143.8	138.2	-70.2	172.9	-179.6	-179.4	0.2	119.7
63	R	32.1	Very low	35	Very low	227 Å²	227	160.7 Å²	160.7	86%	0.857	80%	0.798	S	S	*	*			cis	-167.8	178.4	13.4	-144.2	-174.5	-178.6	-179.6	-1	110.7
64	S	28.8	Very low	34.7	Very low	109 Å²	109	156.9 Å²	156.9	76%	0.762	79%	0.794	S	S	*	*			trans	104.8	141	150.4	-57.5	0	0	0	0	118.9
65	S	30.7	Very low	34.7	Very low	115 Å²	115	157.4 Å²	157.4	80%	0.804	79%	0.791	S	S	*	*			trans	-117.2	-154.8	-171.2	-26.2	0	0	0	0	109.2
66	P	48.3	Very low	34.5	Very low	120 Å²	120	157.1 Å²	157.1	78%	0.779	80%	0.795	S	S	*	*			cis	-116.1	-149.3	2.2	23.5	4.4	0	0	0	110.8
67	S	33.3	Very low	34.4	Very low	94 Å²	94	157.3 Å²	157.3	66%	0.657	80%	0.796	S	S	*	*			cis	-161.7	169.2	15.8	-40.6	0	0	0	0	113.1
68	Q	34.5	Very low	34.4	Very low	175 Å²	175	159.9 Å²	159.9	82%	0.818	80%	0.801	S	S	*	*			trans	70.5	140.9	167.1	-57.9	-167.6	23.8	0	0	116.7
69	Q	32.8	Very low	34.1	Very low	183 Å²	183	158.3 Å²	158.3	86%	0.855	81%	0.805	S	S	*	*			cis	-118.3	-170.9	6.5	-118	161	37.2	0	0	113.2
70	Q	33.1	Very low	34.2	Very low	185 Å²	185	154 Å²	154	86%	0.864	81%	0.805	S	S	*	*			trans	-132.2	-172.7	-158.8	-134	-165.3	29.7	0	0	112.4
71	P	42.6	Very low	34.2	Very low	101 Å²	101	150.9 Å²	150.9	66%	0.656	80%	0.8	S	S	*	*				-122.5	170.4	-112.1	42.1	-27.2	0	0	0	116
72	Q	31.7	Very low	33.6	Very low	198 Å²	198	156.7 Å²	156.7	93%	0.925	81%	0.808	S	S	*	*			trans	-138	138.6	148.1	-75.1	-168.1	-26.8	0	0	110.2
73	E	29.1	Very low	33.9	Very low	180 Å²	180	151.7 Å²	151.7	84%	0.841	80%	0.795	S	S	*	*			trans	-86.3	156.2	166.5	-58.8	179.2	145.8	0	0	107.8
74	I	29.8	Very low	34	Very low	157 Å²	157	146.9 Å²	146.9	81%	0.805	79%	0.791	S	S	*	*				-165	160.4	65.2	-81.9	172.1	0	0	0	109.3
75	A	31	Very low	34.4	Very low	87 Å²	87	149.9 Å²	149.9	72%	0.719	79%	0.79	S	S	*	*			trans	67.6	101.8	166.1	0	0	0	0	0	118.4	S77	A75-S77 PolarHBondContact O-N 3.13Å; A75-S77 VanDerWaalsContact O-N 3.07Å
76	V	30.4	Very low	34.7	Very low	153 Å²	153	153.6 Å²	153.6	93%	0.927	79%	0.792	S	S	*	*			trans	-71.3	96.7	164.9	-179.2	0	0	0	0	109.8
77	S	33	Very low	34	Very low	100 Å²	100	157.3 Å²	157.3	70%	0.699	80%	0.796	S	S	*	*			trans	-76	140.3	168.9	54.3	0	0	0	0	110.7	A75 S79	A75-S77 PolarHBondContact O-N 3.13Å; A75-S77 VanDerWaalsContact O-N 3.07Å; S77-S79 PolarHBondContact O-N 3.3Å
78	R	35.9	Very low	34.5	Very low	244 Å²	244	160.1 Å²	160.1	92%	0.921	80%	0.804	S	S	*	*			trans	-66.8	105.9	179.2	-72.4	175.9	172.8	168.6	-4	109.8
79	S	30.7	Very low	35	Very low	109 Å²	109	159.4 Å²	159.4	76%	0.762	80%	0.798	S	S	*	*			trans	-56.8	135.3	166.8	-56.2	0	0	0	0	109.7	S77 H81	S77-S79 PolarHBondContact O-N 3.3Å; S79-H81 PolarHBondContact O-N 3.34Å
80	P	35.2	Very low	35.7	Very low	122 Å²	122	157 Å²	157	79%	0.792	80%	0.795	S	S	*	*			trans	-61.5	133.8	-174	-23.7	33.7	0	0	0	111.7	R82	P80-R82 PolarHBondContact O-N 3.31Å
81	H	34.3	Very low	36.7	Very low	168 Å²	168	151 Å²	151	78%	0.778	77%	0.766	S	S	*	*			trans	-59.7	113.7	161.9	-173.5	60.9	0	0	0	106.8	S79 E83	S79-H81 PolarHBondContact O-N 3.34Å; H81-E83 PolarHBondContact O-N 3.25Å
82	R	35.8	Very low	37.6	Very low	228 Å²	228	152.2 Å²	152.2	86%	0.86	76%	0.761	S	S	*	*			trans	-74.4	76	177.7	-171.5	-178	-177.5	-179.7	1.8	108.3	P80 T84	P80-R82 PolarHBondContact O-N 3.31Å; R82-T84 PolarHBondContact O-N 3.18Å
83	E	37.8	Very low	38.9	Very low	131 Å²	131	143.9 Å²	143.9	61%	0.612	72%	0.721	S	S	*	*			trans	-48.3	111.7	163.3	-69.9	-174.7	156.2	0	0	107.6	H81 K85	H81-E83 PolarHBondContact O-N 3.25Å; E83-K85 HydrophobicContact CB-CG 4.49Å; E83-K85 PolarHBondContact O-N 2.82Å
84	T	34.8	Very low	40.5	Very low	126 Å²	126	135.9 Å²	135.9	77%	0.773	68%	0.684	S	S	*	*			trans	-70.5	75.1	161.9	37.4	0	0	0	0	107	R82 K86	R82-T84 PolarHBondContact O-N 3.18Å; T84-K86 PolarHBondContact O-N 3.45Å
85	K	36.9	Very low	42	Very low	171 Å²	171	130.9 Å²	130.9	74%	0.743	66%	0.658	S	S	*	*			trans	-45.7	106.9	168	-75.2	-171.4	175.2	-174.9	0	106.5	E83 K87	E83-K85 HydrophobicContact CB-CG 4.49Å; E83-K85 PolarHBondContact O-N 2.82Å; K85-K87 PolarHBondContact O-N 3.47Å
86	K	37.4	Very low	43.4	Very low	193 Å²	193	131.3 Å²	131.3	84%	0.839	65%	0.652	S	S	*	*			trans	-52.9	115.2	171.3	-77.1	-173.3	172.9	-172.2	0	104.5	T84 N88	T84-K86 PolarHBondContact O-N 3.45Å; K86-N88 PolarHBondContact O-N 3.18Å
87	K	34.8	Very low	44.5	Very low	198 Å²	198	126.6 Å²	126.6	86%	0.861	62%	0.624	S	S	*	*			trans	-53.4	129.7	169.2	-66.3	-178.5	179.5	-179	0	105.1	K85 K89	K85-K87 PolarHBondContact O-N 3.47Å; K87-K89 PolarHBondContact O-N 3.2Å
88	N	42.1	Very low	45.5	Very low	154 Å²	154	124.1 Å²	124.1	82%	0.824	61%	0.606	S	S	*	*			trans	-57.3	106.8	169.5	-80.7	-5.9	0	0	0	106.4	K86 V90	K86-N88 PolarHBondContact O-N 3.18Å; N88-V90 PolarHBondContact O-N 3.05Å
89	K	45.5	Very low	46.1	Very low	160 Å²	160	118.2 Å²	118.2	70%	0.696	60%	0.599	S	S	*	*			trans	-54.4	113.4	160.9	-92	-173.6	169.7	-175.2	0	103.7	K87 K91 E405	K87-K89 PolarHBondContact O-N 3.2Å; K89-K91 PolarHBondContact O-N 3.39Å; K89-E405 IonicContact NZ-OE2 3.76Å
90	V	47.9	Very low	47.2	Very low	131 Å²	131	115.5 Å²	115.5	79%	0.794	59%	0.589	S	S	*	*			trans	-59.3	115.8	167.2	176.7	0	0	0	0	104.7	N88 K92	N88-V90 PolarHBondContact O-N 3.05Å; V90-K92 PolarHBondContact O-N 3.32Å
91	K	54	Low	48.1	Very low	61 Å²	61	112.6 Å²	112.6	27%	0.265	56%	0.564	S	S	.	*			trans	-66.4	103.1	-173.3	-81.4	179.4	160.5	-85.7	0	108.5	K89 Y93 W94 V96 D406 E410	K89-K91 PolarHBondContact O-N 3.39Å; K91-Y93 PolarHBondContact O-N 3.21Å; K91-Y93 VanDerWaalsContact O-N 3.14Å; K91-W94 HydrophobicContact CB-CB 4.05Å; K91-W94 HydrophobicContact CD-CB 4.05Å; K91-W94 HydrophobicContact CD-CG 4.47Å; K91-V96 WeakPolarHBondContact O-CG2 3.4Å; K91-D406 IonicContact NZ-OD1 2.73Å; K91-D406 PolarHBondContact NZ-OD1 2.88Å; K91-E410 WeakPolarHBondContact CE-OE2 3.42Å; K91-E410 IonicContact NZ-OE2 3.83Å; K91-E410 PolarHBondContact NZ-OE2 2.97Å
92	K	60.7	Low	49.3	Very low	125 Å²	125	111.5 Å²	111.5	54%	0.543	56%	0.559	S	S	.	*	S	Bend	trans	-54.1	-32.1	-176.2	-176.1	177.9	167.9	-161.3	0	111.9	V90 E402	V90-K92 PolarHBondContact O-N 3.32Å; K92-E402 IonicContact NZ-OE1 2.76Å; K92-E402 IonicContact NZ-OE2 2.73Å; K92-E402 PolarHBondContact NZ-OE2 3.15Å
93	Y	59	Low	50	Low	24 Å²	24	108 Å²	108	9%	0.094	55%	0.552	C	S	.	*	S	Bend	trans	-114.3	-25.2	-172.4	-54.3	-71.5	0	0	0	115.4	K91 E399 E402 F459 A460	K91-Y93 PolarHBondContact O-N 3.21Å; K91-Y93 VanDerWaalsContact O-N 3.14Å; Y93-E399 PolarHBondContact OH-OE1 3.09Å; Y93-E402 HydrophobicContact CE2-CB 4.48Å; Y93-E402 WeakPolarHBondContact CE2-OE2 3.5Å; Y93-E402 PolarHBondContact OH-OE2 2.81Å; Y93-E402 VanDerWaalsContact OH-OE2 3.13Å; Y93-F459 HydrophobicContact CD1-CZ 4.46Å; Y93-F459 HydrophobicContact CD2-CE2 4.48Å; Y93-F459 HydrophobicContact CD2-CZ 4.21Å; Y93-F459 HydrophobicContact CG-CE1 4.35Å; Y93-F459 HydrophobicContact CG-CE2 4.17Å; Y93-F459 AromaticContact CG-CZ 3.89Å; Y93-F459 HydrophobicContact CG-CZ 3.89Å; Y93-F459 CarbonylContact O-C 3.58Å; Y93-F459 VanDerWaalsContact O-CA 3.31Å; Y93-F459 WeakPolarHBondContact O-CA 3.23Å; Y93-A460 HydrophobicContact CD1-CB 4.07Å; Y93-A460 PolarHBondContact O-N 3.48Å
94	W	64	Low	50.6	Low	12 Å²	12	103.4 Å²	103.4	5%	0.045	53%	0.531	C	S	.	.	B	Isolated β-bridge	trans	-101.4	129.8	-174.1	-72.1	101.8	0	0	0	113.6	K91 V96 M388 D406 E410 L454 R457 K458 F459 V464	K91-W94 HydrophobicContact CB-CB 4.05Å; K91-W94 HydrophobicContact CD-CB 4.05Å; K91-W94 HydrophobicContact CD-CG 4.47Å; W94-V96 VanDerWaalsContact C-N 3.26Å; W94-V96 PolarHBondContact O-N 2.77Å; W94-M388 HydrophobicContact CH2-CE 3.72Å; W94-M388 HydrophobicContact CZ2-CE 3.68Å; W94-D406 PolarHBondContact NE1-O 3.27Å; W94-E410 HydrophobicContact CD2-CG 4.21Å; W94-E410 HydrophobicContact CH2-CG 4.24Å; W94-E410 HydrophobicContact CZ2-CB 3.89Å; W94-E410 HydrophobicContact CZ2-CG 3.78Å; W94-L454 HydrophobicContact CH2-CD2 3.92Å; W94-R457 HydrophobicContact CE3-CB 4.44Å; W94-R457 HydrophobicContact CZ3-CB 3.83Å; W94-K458 VanDerWaalsContact CE3-O 3.29Å; W94-F459 HydrophobicContact CD2-CD2 4.02Å; W94-F459 AromaticContact CE2-CD2 3.6Å; W94-F459 HydrophobicContact CG-CD2 4.36Å; W94-F459 HydrophobicContact CH2-CD2 4.46Å; W94-F459 AromaticContact CZ2-CD2 3.86Å; W94-F459 HydrophobicContact CZ2-CD2 3.86Å; W94-F459 HydrophobicContact CZ3-CB 4.47Å; W94-F459 AromaticContact NE1-CD2 3.7Å; W94-F459 AromaticContact NE1-CE2 3.86Å; W94-V464 HydrophobicContact CH2-CG2 4.15Å; W94-V464 HydrophobicContact CZ3-CG2 4.05Å
95	D	60.3	Low	51.6	Low	52 Å²	52	100.4 Å²	100.4	28%	0.278	52%	0.515	S	S	.	.			trans	48.4	34.9	161.5	-66.3	-35.9	0	0	0	116.8	P97 V106 R457	D95-P97 WeakPolarHBondContact O-CD 3.23Å; D95-V106 HydrophobicContact CB-CG2 3.84Å; D95-V106 WeakPolarHBondContact O-CG2 3.25Å; D95-R457 IonicContact OD2-NH1 3.09Å
96	V	60.8	Low	52.1	Low	96 Å²	96	94 Å²	94	58%	0.582	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-61.9	120.1	177.1	-176.4	0	0	0	0	111.1	K91 W94	K91-V96 WeakPolarHBondContact O-CG2 3.4Å; W94-V96 VanDerWaalsContact C-N 3.26Å; W94-V96 PolarHBondContact O-N 2.77Å
97	P	54.2	Low	52.8	Low	53 Å²	53	92.2 Å²	92.2	34%	0.344	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-83.2	154.1	-177	33.3	-35.1	0	0	0	112.7	D95 E102	D95-P97 WeakPolarHBondContact O-CD 3.23Å; P97-E102 HydrophobicContact CG-CG 4.45Å
98	P	53.3	Low	53.7	Low	49 Å²	49	87.9 Å²	87.9	32%	0.318	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-73.4	153.4	172.6	30.4	-32.5	0	0	0	111.9	G100 F101 Y109	P98-G100 PolarHBondContact O-N 2.8Å; P98-F101 HydrophobicContact CG-CB 4.33Å; P98-F101 PolarHBondContact O-N 3.14Å; P98-Y109 HydrophobicContact CG-CD2 4.39Å; P98-Y109 HydrophobicContact CG-CE1 4.01Å; P98-Y109 HydrophobicContact CG-CE2 3.85Å
99	P	48	Very low	54.3	Low	119 Å²	119	82.7 Å²	82.7	77%	0.773	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	136.3	-177.9	-27.9	35.5	0	0	0	113.5	F101	P99-F101 VanDerWaalsContact C-N 3.3Å; P99-F101 PolarHBondContact O-N 3.22Å
100	G	53.7	Low	54.8	Low	53 Å²	53	79.7 Å²	79.7	55%	0.546	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.6	-14.3	180	0	0	0	0	0	115.7	P98 H103	P98-G100 PolarHBondContact O-N 2.8Å; G100-H103 PolarHBondContact O-CE1 2.87Å
101	F	54.1	Low	55.1	Low	61 Å²	61	76.1 Å²	76.1	27%	0.268	41%	0.41	S	S	.	.			trans	-108.8	18.8	177.8	-70.9	-95.8	0	0	0	113.2	P98 P99 H103 I104 Y109 I118	P98-F101 HydrophobicContact CG-CB 4.33Å; P98-F101 PolarHBondContact O-N 3.14Å; P99-F101 VanDerWaalsContact C-N 3.3Å; P99-F101 PolarHBondContact O-N 3.22Å; F101-H103 PolarHBondContact O-N 3.45Å; F101-I104 HydrophobicContact CD1-CD1 3.89Å; F101-I104 PolarHBondContact O-N 2.85Å; F101-Y109 HydrophobicContact CB-CD2 3.83Å; F101-Y109 HydrophobicContact CB-CE2 3.92Å; F101-Y109 AromaticContact CD1-CD2 3.52Å; F101-Y109 HydrophobicContact CD1-CD2 3.52Å; F101-Y109 AromaticContact CD1-CE2 3.54Å; F101-Y109 HydrophobicContact CD1-CE2 3.54Å; F101-Y109 HydrophobicContact CD2-CD2 4.38Å; F101-Y109 AromaticContact CD2-CE2 3.69Å; F101-Y109 HydrophobicContact CD2-CE2 3.69Å; F101-Y109 HydrophobicContact CE1-CD2 4.15Å; F101-Y109 AromaticContact CE1-CE2 3.9Å; F101-Y109 HydrophobicContact CE1-CE2 3.9Å; F101-Y109 HydrophobicContact CE2-CE2 4.04Å; F101-Y109 AromaticContact CG-CD2 3.65Å; F101-Y109 HydrophobicContact CG-CD2 3.65Å; F101-Y109 AromaticContact CG-CE2 3.42Å; F101-Y109 HydrophobicContact CG-CE2 3.42Å; F101-Y109 VanDerWaalsContact CG-CE2 3.42Å; F101-Y109 HydrophobicContact CZ-CE2 4.14Å; F101-I118 HydrophobicContact CD1-CD1 4.38Å; F101-I118 HydrophobicContact CE1-CD1 3.78Å; F101-I118 HydrophobicContact CE1-CG1 4.21Å; F101-I118 HydrophobicContact CZ-CD1 4.2Å; F101-I118 HydrophobicContact CZ-CG1 4.44Å; F101-I118 HydrophobicContact CZ-CG2 4.2Å
102	E	59.1	Low	55.3	Low	145 Å²	145	75.3 Å²	75.3	68%	0.678	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-15.2	-174.6	-65.6	162.8	-144.6	0	0	115.4	P97	P97-E102 HydrophobicContact CG-CG 4.45Å
103	H	51.1	Low	54.9	Low	154 Å²	154	74.5 Å²	74.5	71%	0.713	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	4.2	-178.9	54.3	-83.8	0	0	0	113.6	G100 F101	G100-H103 PolarHBondContact O-CE1 2.87Å; F101-H103 PolarHBondContact O-N 3.45Å
104	I	50.9	Low	54.5	Low	34 Å²	34	77.2 Å²	77.2	17%	0.174	43%	0.434	C	S	.	.	S	Bend	trans	-119.4	135.4	-178.2	-68.1	161.1	0	0	0	109.4	F101 Q108 M112	F101-I104 HydrophobicContact CD1-CD1 3.89Å; F101-I104 PolarHBondContact O-N 2.85Å; I104-Q108 HydrophobicContact CG2-CB 3.92Å; I104-Q108 HydrophobicContact CG2-CG 3.94Å; I104-M112 HydrophobicContact CD1-SD 4.42Å; I104-M112 HydrophobicContact CG2-SD 4.26Å
105	S	55.7	Low	54	Low	63 Å²	63	78.6 Å²	78.6	44%	0.441	45%	0.447	S	S	.	.			trans	-68.2	148.5	-178.4	71.3	0	0	0	0	112.3	M107 Q108 Y109	S105-M107 PolarHBondContact O-N 3.14Å; S105-M107 VanDerWaalsContact O-N 3.15Å; S105-Q108 CarbonylContact O-C 3.57Å; S105-Q108 WeakPolarHBondContact O-CA 3.06Å; S105-Q108 WeakPolarHBondContact O-CB 3.47Å; S105-Q108 PolarHBondContact O-N 3.35Å; S105-Q108 WeakPolarHBondContact OG-CB 3.35Å; S105-Q108 PolarHBondContact OG-N 2.6Å; S105-Y109 PolarHBondContact O-N 3.34Å
106	V	47.6	Very low	53.6	Low	36 Å²	36	78.2 Å²	78.2	22%	0.218	46%	0.456	C	S	.	.	H	α-helix	trans	-56.4	-35	-178.3	176.3	0	0	0	0	112.8	D95 K110	D95-V106 HydrophobicContact CB-CG2 3.84Å; D95-V106 WeakPolarHBondContact O-CG2 3.25Å; V106-K110 WeakPolarHBondContact O-CB 3.47Å; V106-K110 WeakPolarHBondContact O-CG 3.49Å; V106-K110 PolarHBondContact O-N 2.84Å
107	M	52.5	Low	52.7	Low	157 Å²	157	79.8 Å²	79.8	77%	0.773	46%	0.457	S	S	*	.	H	α-helix	trans	-68.3	-42.4	176.2	-167.5	173.5	-172.3	0	0	111.8	S105 K110 A111	S105-M107 PolarHBondContact O-N 3.14Å; S105-M107 VanDerWaalsContact O-N 3.15Å; M107-K110 PolarHBondContact O-N 2.78Å; M107-A111 WeakPolarHBondContact O-CB 3.35Å; M107-A111 PolarHBondContact O-N 3.3Å
108	Q	53.3	Low	52.4	Low	107 Å²	107	78.4 Å²	78.4	50%	0.5	45%	0.447	S	S	.	.	H	α-helix	trans	-70.5	-39.2	177.7	-170.5	174.7	10.6	0	0	111.8	I104 S105 A111 M112	I104-Q108 HydrophobicContact CG2-CB 3.92Å; I104-Q108 HydrophobicContact CG2-CG 3.94Å; S105-Q108 CarbonylContact O-C 3.57Å; S105-Q108 WeakPolarHBondContact O-CA 3.06Å; S105-Q108 WeakPolarHBondContact O-CB 3.47Å; S105-Q108 PolarHBondContact O-N 3.35Å; S105-Q108 WeakPolarHBondContact OG-CB 3.35Å; S105-Q108 PolarHBondContact OG-N 2.6Å; Q108-A111 PolarHBondContact O-N 3.38Å; Q108-M112 HydrophobicContact CG-SD 4.4Å; Q108-M112 WeakPolarHBondContact O-CB 3.14Å; Q108-M112 VanDerWaalsContact O-CG 3.24Å; Q108-M112 WeakPolarHBondContact O-CG 3.25Å; Q108-M112 PolarHBondContact O-N 2.82Å
109	Y	54.7	Low	51.8	Low	45 Å²	45	79.2 Å²	79.2	18%	0.176	45%	0.452	C	S	.	.	H	α-helix	trans	-60.5	-46.7	172.5	-178.5	-92.4	0	0	0	111.7	P98 F101 S105 A111 M112 Q113 I118	P98-Y109 HydrophobicContact CG-CD2 4.39Å; P98-Y109 HydrophobicContact CG-CE1 4.01Å; P98-Y109 HydrophobicContact CG-CE2 3.85Å; F101-Y109 HydrophobicContact CB-CD2 3.83Å; F101-Y109 HydrophobicContact CB-CE2 3.92Å; F101-Y109 AromaticContact CD1-CD2 3.52Å; F101-Y109 HydrophobicContact CD1-CD2 3.52Å; F101-Y109 AromaticContact CD1-CE2 3.54Å; F101-Y109 HydrophobicContact CD1-CE2 3.54Å; F101-Y109 HydrophobicContact CD2-CD2 4.38Å; F101-Y109 AromaticContact CD2-CE2 3.69Å; F101-Y109 HydrophobicContact CD2-CE2 3.69Å; F101-Y109 HydrophobicContact CE1-CD2 4.15Å; F101-Y109 AromaticContact CE1-CE2 3.9Å; F101-Y109 HydrophobicContact CE1-CE2 3.9Å; F101-Y109 HydrophobicContact CE2-CE2 4.04Å; F101-Y109 AromaticContact CG-CD2 3.65Å; F101-Y109 HydrophobicContact CG-CD2 3.65Å; F101-Y109 AromaticContact CG-CE2 3.42Å; F101-Y109 HydrophobicContact CG-CE2 3.42Å; F101-Y109 VanDerWaalsContact CG-CE2 3.42Å; F101-Y109 HydrophobicContact CZ-CE2 4.14Å; S105-Y109 PolarHBondContact O-N 3.34Å; Y109-A111 PolarHBondContact O-N 3.31Å; Y109-M112 PolarHBondContact O-N 3.32Å; Y109-Q113 WeakPolarHBondContact O-CB 3.36Å; Y109-Q113 PolarHBondContact O-N 3.13Å; Y109-Q113 PolarHBondContact OH-NE2 3.35Å; Y109-I118 HydrophobicContact CD2-CD1 3.6Å; Y109-I118 HydrophobicContact CE2-CD1 3.47Å; Y109-I118 VanDerWaalsContact CE2-CD1 3.47Å; Y109-I118 HydrophobicContact CG-CD1 4.28Å
110	K	55.7	Low	51.6	Low	96 Å²	96	76.4 Å²	76.4	42%	0.417	44%	0.438	S	S	.	.	H	α-helix	trans	-60	-43.5	173	-78.1	178.5	178.9	178.5	0	111.9	V106 M107 Q113 A114	V106-K110 WeakPolarHBondContact O-CB 3.47Å; V106-K110 WeakPolarHBondContact O-CG 3.49Å; V106-K110 PolarHBondContact O-N 2.84Å; M107-K110 PolarHBondContact O-N 2.78Å; K110-Q113 PolarHBondContact O-N 3.3Å; K110-A114 VanDerWaalsContact O-CB 3.31Å; K110-A114 WeakPolarHBondContact O-CB 3.47Å; K110-A114 PolarHBondContact O-N 3.06Å
111	A	54.8	Low	51.1	Low	57 Å²	57	78.3 Å²	78.3	47%	0.471	44%	0.439	S	S	.	.	H	α-helix	trans	-62.8	-46.3	177.9	0	0	0	0	0	111.8	M107 Q108 Y109 Q113 A114 A115	M107-A111 WeakPolarHBondContact O-CB 3.35Å; M107-A111 PolarHBondContact O-N 3.3Å; Q108-A111 PolarHBondContact O-N 3.38Å; Y109-A111 PolarHBondContact O-N 3.31Å; A111-Q113 VanDerWaalsContact C-N 3.32Å; A111-Q113 PolarHBondContact O-N 2.86Å; A111-A114 PolarHBondContact O-N 3.42Å; A111-A115 VanDerWaalsContact O-CB 3.22Å; A111-A115 WeakPolarHBondContact O-CB 3.31Å; A111-A115 PolarHBondContact O-N 2.88Å
112	M	56.9	Low	50.6	Low	44 Å²	44	76.9 Å²	76.9	22%	0.217	44%	0.439	C	S	.	.	H	α-helix	trans	-62.1	-37.5	175.9	-68.8	173.1	70	0	0	112.3	I104 Q108 Y109 G116 Q117 I118	I104-M112 HydrophobicContact CD1-SD 4.42Å; I104-M112 HydrophobicContact CG2-SD 4.26Å; Q108-M112 HydrophobicContact CG-SD 4.4Å; Q108-M112 WeakPolarHBondContact O-CB 3.14Å; Q108-M112 VanDerWaalsContact O-CG 3.24Å; Q108-M112 WeakPolarHBondContact O-CG 3.25Å; Q108-M112 PolarHBondContact O-N 2.82Å; Y109-M112 PolarHBondContact O-N 3.32Å; M112-G116 PolarHBondContact O-N 3.39Å; M112-Q117 HydrophobicContact CB-CB 4.2Å; M112-Q117 WeakPolarHBondContact O-CB 3.21Å; M112-Q117 PolarHBondContact O-N 3.08Å; M112-I118 HydrophobicContact CB-CD1 3.84Å; M112-I118 HydrophobicContact CB-CG1 3.89Å; M112-I118 HydrophobicContact CE-CG1 4.37Å; M112-I118 PolarHBondContact O-N 2.95Å
113	Q	53.7	Low	49.8	Very low	108 Å²	108	75.8 Å²	75.8	51%	0.505	44%	0.437	S	S	.	.	H	α-helix	trans	-72.1	-38.4	176.6	-166.7	168.1	95	0	0	112.3	Y109 K110 A111 G116 I118	Y109-Q113 WeakPolarHBondContact O-CB 3.36Å; Y109-Q113 PolarHBondContact O-N 3.13Å; Y109-Q113 PolarHBondContact OH-NE2 3.35Å; K110-Q113 PolarHBondContact O-N 3.3Å; A111-Q113 VanDerWaalsContact C-N 3.32Å; A111-Q113 PolarHBondContact O-N 2.86Å; Q113-G116 PolarHBondContact O-N 3.1Å; Q113-I118 HydrophobicContact CB-CD1 4.37Å
114	A	50.5	Low	49.2	Very low	81 Å²	81	73.2 Å²	73.2	67%	0.669	43%	0.428	S	S	*	.	H	α-helix	trans	-70.8	-35.2	175.4	0	0	0	0	0	112.9	K110 A111 G116	K110-A114 VanDerWaalsContact O-CB 3.31Å; K110-A114 WeakPolarHBondContact O-CB 3.47Å; K110-A114 PolarHBondContact O-N 3.06Å; A111-A114 PolarHBondContact O-N 3.42Å; A114-G116 PolarHBondContact O-N 2.75Å
115	A	52.3	Low	48.7	Very low	40 Å²	40	75.6 Å²	75.6	33%	0.331	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	5	174.4	0	0	0	0	0	113.6	A111 Q117	A111-A115 VanDerWaalsContact O-CB 3.22Å; A111-A115 WeakPolarHBondContact O-CB 3.31Å; A111-A115 PolarHBondContact O-N 2.88Å; A115-Q117 VanDerWaalsContact C-N 3.26Å; A115-Q117 HydrophobicContact CB-CG 4.43Å; A115-Q117 PolarHBondContact O-N 3.42Å
116	G	52.8	Low	48.1	Very low	45 Å²	45	75.4 Å²	75.4	46%	0.464	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.2	10.4	176.7	0	0	0	0	0	115.9	M112 Q113 A114 I118	M112-G116 PolarHBondContact O-N 3.39Å; Q113-G116 PolarHBondContact O-N 3.1Å; A114-G116 PolarHBondContact O-N 2.75Å; G116-I118 VanDerWaalsContact C-N 3.29Å; G116-I118 PolarHBondContact O-N 2.88Å
117	Q	42.5	Very low	47.6	Very low	129 Å²	129	80.3 Å²	80.3	60%	0.603	46%	0.464	S	S	*	.			trans	-74.5	-17.6	178.6	-63.4	-175.4	-9.6	0	0	113.3	M112 A115	M112-Q117 HydrophobicContact CB-CB 4.2Å; M112-Q117 WeakPolarHBondContact O-CB 3.21Å; M112-Q117 PolarHBondContact O-N 3.08Å; A115-Q117 VanDerWaalsContact C-N 3.26Å; A115-Q117 HydrophobicContact CB-CG 4.43Å; A115-Q117 PolarHBondContact O-N 3.42Å
118	I	47.6	Very low	47.4	Very low	24 Å²	24	75.9 Å²	75.9	12%	0.123	45%	0.446	C	S	.	.	S	Bend	trans	-105	106.8	171.2	-57.1	176.8	0	0	0	107.4	F101 Y109 M112 Q113 G116	F101-I118 HydrophobicContact CD1-CD1 4.38Å; F101-I118 HydrophobicContact CE1-CD1 3.78Å; F101-I118 HydrophobicContact CE1-CG1 4.21Å; F101-I118 HydrophobicContact CZ-CD1 4.2Å; F101-I118 HydrophobicContact CZ-CG1 4.44Å; F101-I118 HydrophobicContact CZ-CG2 4.2Å; Y109-I118 HydrophobicContact CD2-CD1 3.6Å; Y109-I118 HydrophobicContact CE2-CD1 3.47Å; Y109-I118 VanDerWaalsContact CE2-CD1 3.47Å; Y109-I118 HydrophobicContact CG-CD1 4.28Å; M112-I118 HydrophobicContact CB-CD1 3.84Å; M112-I118 HydrophobicContact CB-CG1 3.89Å; M112-I118 HydrophobicContact CE-CG1 4.37Å; M112-I118 PolarHBondContact O-N 2.95Å; Q113-I118 HydrophobicContact CB-CD1 4.37Å; G116-I118 VanDerWaalsContact C-N 3.29Å; G116-I118 PolarHBondContact O-N 2.88Å
119	P	40.1	Very low	46.9	Very low	65 Å²	65	77.3 Å²	77.3	42%	0.422	47%	0.465	S	S	.	.			trans	-66.7	136.6	-178	26.9	-33.8	0	0	0	110.8	T121 P138	P119-T121 PolarHBondContact O-N 3.34Å; P119-P138 HydrophobicContact CB-CB 3.87Å; P119-P138 HydrophobicContact CG-CB 4.06Å
120	A	44.6	Very low	46.5	Very low	60 Å²	60	82.9 Å²	82.9	50%	0.496	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	117.7	170.8	0	0	0	0	0	109.1	A122 V141	A120-A122 PolarHBondContact O-N 2.94Å; A120-V141 HydrophobicContact CB-CG2 4.14Å
121	T	41.8	Very low	46.2	Very low	93 Å²	93	79.9 Å²	79.9	57%	0.571	49%	0.494	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.2	97.7	-179.1	-45	0	0	0	0	110.5	P119 L123 P136	P119-T121 PolarHBondContact O-N 3.34Å; T121-L123 PolarHBondContact O-N 3.1Å; T121-P136 HydrophobicContact CG2-CB 3.31Å
122	A	45	Very low	45.4	Very low	32 Å²	32	83.2 Å²	83.2	26%	0.264	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	122.2	175.1	0	0	0	0	0	109.6	A120 L124 T137 V139	A120-A122 PolarHBondContact O-N 2.94Å; A122-L124 HydrophobicContact CB-CG 4.39Å; A122-L124 PolarHBondContact O-N 2.83Å; A122-T137 PolarHBondContact N-O 3.14Å; A122-T137 VanDerWaalsContact N-O 3.09Å; A122-T137 PolarHBondContact O-N 3.48Å; A122-T137 VanDerWaalsContact O-N 3.07Å; A122-T137 PolarHBondContact O-OG1 2.95Å; A122-V139 HydrophobicContact CB-CG2 3.75Å
123	L	42.1	Very low	44.9	Very low	122 Å²	122	82.6 Å²	82.6	64%	0.639	51%	0.505	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.2	82.8	172.6	-68.4	-178.8	0	0	0	108.9	T121 V134 P136	T121-L123 PolarHBondContact O-N 3.1Å; L123-V134 HydrophobicContact CB-CG1 3.65Å; L123-V134 HydrophobicContact CD2-CG1 4.02Å; L123-V134 HydrophobicContact CG-CG1 4.28Å; L123-P136 HydrophobicContact CD2-CB 4.22Å
124	L	38.3	Very low	44.5	Very low	100 Å²	100	81.7 Å²	81.7	52%	0.524	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	132.2	176.4	-72.1	170.3	0	0	0	110.1	A122 T126 T135	A122-L124 HydrophobicContact CB-CG 4.39Å; A122-L124 PolarHBondContact O-N 2.83Å; L124-T126 PolarHBondContact O-N 3.41Å; L124-T135 PolarHBondContact O-N 3.25Å
125	P	39.8	Very low	44.1	Very low	83 Å²	83	80.6 Å²	80.6	54%	0.539	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	119.6	170.8	29.8	-31.9	0	0	0	109.3	L132	P125-L132 HydrophobicContact CB-CD2 4.23Å
126	T	42.6	Very low	43.6	Very low	59 Å²	59	82.9 Å²	82.9	36%	0.362	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	139.9	171.6	-176.3	0	0	0	0	109.9	L124 A133 T135	L124-T126 PolarHBondContact O-N 3.41Å; T126-A133 HydrophobicContact CG2-CB 4.2Å; T126-A133 WeakPolarHBondContact CG2-O 3.2Å; T126-A133 PolarHBondContact N-O 2.87Å; T126-A133 PolarHBondContact O-N 2.93Å; T126-A133 VanDerWaalsContact O-O 3.09Å; T126-T135 HydrophobicContact CG2-CG2 3.86Å
127	M	39	Very low	43.1	Very low	139 Å²	139	83.1 Å²	83.1	69%	0.685	50%	0.495	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.2	113.6	179.2	-63.7	-66.8	177.2	0	0	108.9	L132	M127-L132 HydrophobicContact CE-CD1 3.77Å; M127-L132 HydrophobicContact CE-CD2 4.4Å; M127-L132 HydrophobicContact CE-CG 3.87Å; M127-L132 HydrophobicContact SD-CD1 3.76Å; M127-L132 HydrophobicContact SD-CG 3.86Å
128	T	46.4	Very low	42.8	Very low	64 Å²	64	81.6 Å²	81.6	39%	0.393	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	166.6	168.3	68.8	0	0	0	0	109.5	D130 G131 A133	T128-D130 PolarHBondContact O-N 3.23Å; T128-D130 VanDerWaalsContact O-N 3.07Å; T128-G131 PolarHBondContact N-O 2.74Å; T128-G131 PolarHBondContact O-N 3.24Å; T128-G131 PolarHBondContact OG1-O 2.8Å; T128-A133 HydrophobicContact CG2-CB 4.04Å
129	P	44.5	Very low	42.4	Very low	137 Å²	137	83.5 Å²	83.5	89%	0.89	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-22	179.4	-27.5	37.2	0	0	0	115
130	D	45.8	Very low	42.5	Very low	163 Å²	163	85.4 Å²	85.4	87%	0.872	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.5	4.6	179.3	-69.7	-77.3	0	0	0	114.1	T128	T128-D130 PolarHBondContact O-N 3.23Å; T128-D130 VanDerWaalsContact O-N 3.07Å
131	G	49	Very low	42.6	Very low	32 Å²	32	87 Å²	87	33%	0.33	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	134.7	-160.9	169.1	0	0	0	0	0	116.2	T128 A133	T128-G131 PolarHBondContact N-O 2.74Å; T128-G131 PolarHBondContact O-N 3.24Å; T128-G131 PolarHBondContact OG1-O 2.8Å; G131-A133 PolarHBondContact O-N 2.84Å
132	L	38.2	Very low	42.6	Very low	127 Å²	127	89 Å²	89	67%	0.665	54%	0.537	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.6	113.7	173.4	-85.2	84.8	0	0	0	110.2	P125 M127	P125-L132 HydrophobicContact CB-CD2 4.23Å; M127-L132 HydrophobicContact CE-CD1 3.77Å; M127-L132 HydrophobicContact CE-CD2 4.4Å; M127-L132 HydrophobicContact CE-CG 3.87Å; M127-L132 HydrophobicContact SD-CD1 3.76Å; M127-L132 HydrophobicContact SD-CG 3.86Å
133	A	47.2	Very low	42.7	Very low	31 Å²	31	88.9 Å²	88.9	26%	0.256	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	136.5	164.1	0	0	0	0	0	109.6	T126 T128 G131	T126-A133 HydrophobicContact CG2-CB 4.2Å; T126-A133 WeakPolarHBondContact CG2-O 3.2Å; T126-A133 PolarHBondContact N-O 2.87Å; T126-A133 PolarHBondContact O-N 2.93Å; T126-A133 VanDerWaalsContact O-O 3.09Å; T128-A133 HydrophobicContact CG2-CB 4.04Å; G131-A133 PolarHBondContact O-N 2.84Å
134	V	45.4	Very low	43.1	Very low	89 Å²	89	86.5 Å²	86.5	54%	0.539	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	108.4	174	-176.5	0	0	0	0	107.9	L123	L123-V134 HydrophobicContact CB-CG1 3.65Å; L123-V134 HydrophobicContact CD2-CG1 4.02Å; L123-V134 HydrophobicContact CG-CG1 4.28Å
135	T	41.5	Very low	43.7	Very low	59 Å²	59	88.8 Å²	88.8	36%	0.362	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	130.5	-176.8	52	0	0	0	0	111.5	L124 T126 T137	L124-T135 PolarHBondContact O-N 3.25Å; T126-T135 HydrophobicContact CG2-CG2 3.86Å; T135-T137 PolarHBondContact O-N 2.87Å; T135-T137 VanDerWaalsContact O-N 3.15Å
136	P	41	Very low	44.2	Very low	87 Å²	87	93 Å²	93	57%	0.565	56%	0.555	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-70.6	109.2	175.3	27.7	-32.4	0	0	0	109.8	T121 L123	T121-P136 HydrophobicContact CG2-CB 3.31Å; L123-P136 HydrophobicContact CD2-CB 4.22Å
137	T	42.1	Very low	45.3	Very low	50 Å²	50	92.2 Å²	92.2	31%	0.307	55%	0.55	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.7	128.6	177.3	43.6	0	0	0	0	110.8	A122 T135 V139	A122-T137 PolarHBondContact N-O 3.14Å; A122-T137 VanDerWaalsContact N-O 3.09Å; A122-T137 PolarHBondContact O-N 3.48Å; A122-T137 VanDerWaalsContact O-N 3.07Å; A122-T137 PolarHBondContact O-OG1 2.95Å; T135-T137 PolarHBondContact O-N 2.87Å; T135-T137 VanDerWaalsContact O-N 3.15Å; T137-V139 PolarHBondContact O-N 2.83Å
138	P	37.5	Very low	46.9	Very low	97 Å²	97	89.9 Å²	89.9	63%	0.63	53%	0.534	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78	102.7	175.2	30.5	-31.8	0	0	0	109.2	P119	P119-P138 HydrophobicContact CB-CB 3.87Å; P119-P138 HydrophobicContact CG-CB 4.06Å
139	V	38.8	Very low	48.4	Very low	64 Å²	64	90.6 Å²	90.6	39%	0.388	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	128	176.7	-173.1	0	0	0	0	108.5	A122 T137 V141	A122-V139 HydrophobicContact CB-CG2 3.75Å; T137-V139 PolarHBondContact O-N 2.83Å; V139-V141 PolarHBondContact O-N 3.47Å
140	P	41.6	Very low	50.2	Low	106 Å²	106	84.4 Å²	84.4	69%	0.688	49%	0.493	S	S	*	.			trans	-62.2	132.8	172.5	26.6	-33.5	0	0	0	109.4	V142	P140-V142 PolarHBondContact O-N 2.92Å
141	V	47.1	Very low	52.3	Low	93 Å²	93	77.2 Å²	77.2	56%	0.564	45%	0.453	S	S	*	.			trans	-71.9	91.2	-173.4	-178.6	0	0	0	0	110.2	A120 V139 G143	A120-V141 HydrophobicContact CB-CG2 4.14Å; V139-V141 PolarHBondContact O-N 3.47Å; V141-G143 PolarHBondContact O-N 2.69Å
142	V	40.9	Very low	54.3	Low	136 Å²	136	77.1 Å²	77.1	82%	0.824	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-56.9	120.6	164.9	178.8	0	0	0	0	107.4	P140 S144	P140-V142 PolarHBondContact O-N 2.92Å; V142-S144 PolarHBondContact O-N 3.27Å
143	G	48.1	Very low	57	Low	29 Å²	29	71 Å²	71	30%	0.299	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-58.6	126.2	-156.3	0	0	0	0	0	114.5	V141	V141-G143 PolarHBondContact O-N 2.69Å
144	S	49.5	Very low	59.3	Low	71 Å²	71	73 Å²	73	50%	0.497	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-49.7	144.2	170.9	177.7	0	0	0	0	111.6	V142 M146 T147	V142-S144 PolarHBondContact O-N 3.27Å; S144-M146 PolarHBondContact O-N 3.47Å; S144-M146 VanDerWaalsContact O-N 3.07Å; S144-M146 PolarHBondContact OG-N 3.2Å; S144-T147 PolarHBondContact O-N 2.84Å; S144-T147 PolarHBondContact O-OG1 3.36Å
145	Q	52.8	Low	61.6	Low	149 Å²	149	68.8 Å²	68.8	70%	0.696	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-52.3	-31.1	172.2	-68.9	-68.7	-10.9	0	0	111.6	T147 R148	Q145-T147 PolarHBondContact O-N 2.88Å; Q145-R148 VanDerWaalsContact O-CB 3.23Å; Q145-R148 WeakPolarHBondContact O-CB 3.28Å; Q145-R148 PolarHBondContact O-N 3.28Å; Q145-R148 VanDerWaalsContact O-N 3.08Å
146	M	48.8	Very low	64	Low	170 Å²	170	66.1 Å²	66.1	84%	0.837	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-60.6	-26.6	179	-156.1	73	102.1	0	0	114	S144	S144-M146 PolarHBondContact O-N 3.47Å; S144-M146 VanDerWaalsContact O-N 3.07Å; S144-M146 PolarHBondContact OG-N 3.2Å
147	T	66.6	Low	66.3	Low	44 Å²	44	65.1 Å²	65.1	27%	0.27	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-99.2	-0.6	177.2	65.8	0	0	0	0	113.4	S144 Q145 Q149 A150 R151	S144-T147 PolarHBondContact O-N 2.84Å; S144-T147 PolarHBondContact O-OG1 3.36Å; Q145-T147 PolarHBondContact O-N 2.88Å; T147-Q149 VanDerWaalsContact C-N 3.3Å; T147-Q149 PolarHBondContact O-N 3.41Å; T147-A150 PolarHBondContact O-N 3.47Å; T147-R151 WeakPolarHBondContact O-CG 3.49Å; T147-R151 PolarHBondContact O-N 3.16Å; T147-R151 PolarHBondContact OG1-NE 2.86Å
148	R	72.5	Confident	68.7	Low	89 Å²	89	63 Å²	63	34%	0.336	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-36	-172.1	-171.9	172.2	-174.7	-125.4	-13.5	113.5	Q145 R151 R152 E203	Q145-R148 VanDerWaalsContact O-CB 3.23Å; Q145-R148 WeakPolarHBondContact O-CB 3.28Å; Q145-R148 PolarHBondContact O-N 3.28Å; Q145-R148 VanDerWaalsContact O-N 3.08Å; R148-R151 PolarHBondContact O-N 2.84Å; R148-R152 WeakPolarHBondContact O-CD 3.4Å; R148-R152 VanDerWaalsContact O-CG 3.28Å; R148-R152 WeakPolarHBondContact O-CG 3.26Å; R148-E203 IonicContact CZ-OE2 3.54Å; R148-E203 IonicContact NE-OE1 3.21Å; R148-E203 IonicContact NE-OE2 3.5Å; R148-E203 PolarHBondContact NE-OE2 2.9Å; R148-E203 IonicContact NH2-OE2 2.74Å; R148-E203 PolarHBondContact NH2-OE2 3.16Å
149	Q	78.3	Confident	71.2	Confident	80 Å²	80	58.7 Å²	58.7	37%	0.374	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-40.4	175.6	-61.7	179.3	-62.6	0	0	111.8	T147 R151 R152 D233	T147-Q149 VanDerWaalsContact C-N 3.3Å; T147-Q149 PolarHBondContact O-N 3.41Å; Q149-R151 VanDerWaalsContact C-N 3.26Å; Q149-R151 PolarHBondContact O-N 3.11Å; Q149-R152 PolarHBondContact O-N 3.11Å; Q149-D233 WeakPolarHBondContact CG-OD2 3.49Å; Q149-D233 PolarHBondContact NE2-O 2.92Å; Q149-D233 VanDerWaalsContact NE2-O 3.17Å; Q149-D233 PolarHBondContact NE2-OD2 2.76Å
150	A	82.4	Confident	73.5	Confident	6 Å²	6	63.8 Å²	63.8	5%	0.05	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-25.7	176.3	0	0	0	0	0	113.3	T147 R152 V207 R230 Y234 L237	T147-A150 PolarHBondContact O-N 3.47Å; A150-R152 VanDerWaalsContact C-N 3.34Å; A150-V207 HydrophobicContact CB-CG1 3.99Å; A150-V207 HydrophobicContact CB-CG2 3.74Å; A150-R230 PolarHBondContact O-NH1 3.15Å; A150-Y234 HydrophobicContact CB-CE2 4.13Å; A150-L237 HydrophobicContact CB-CD1 3.94Å; A150-L237 HydrophobicContact CB-CG 4.25Å
151	R	88.9	Confident	75.6	Confident	12 Å²	12	61.1 Å²	61.1	5%	0.045	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	8.4	175.5	-68.8	-170.4	-64.5	97.7	-1.2	114.9	T147 R148 Q149 E203 F204 R205 V207 T210	T147-R151 WeakPolarHBondContact O-CG 3.49Å; T147-R151 PolarHBondContact O-N 3.16Å; T147-R151 PolarHBondContact OG1-NE 2.86Å; R148-R151 PolarHBondContact O-N 2.84Å; Q149-R151 VanDerWaalsContact C-N 3.26Å; Q149-R151 PolarHBondContact O-N 3.11Å; R151-E203 IonicContact CZ-OE1 3.9Å; R151-E203 IonicContact NH1-OE1 2.73Å; R151-E203 PolarHBondContact NH1-OE1 3.39Å; R151-E203 IonicContact NH2-OE1 3.8Å; R151-E203 PolarHBondContact NH2-OE1 3.42Å; R151-E203 WeakPolarHBondContact O-CA 3.5Å; R151-F204 WeakPolarHBondContact CB-O 3.21Å; R151-F204 WeakPolarHBondContact CD-O 3.47Å; R151-F204 PolarHBondContact NH1-O 2.81Å; R151-F204 PolarHBondContact O-N 2.67Å; R151-R205 VanDerWaalsContact CD-O 3.25Å; R151-R205 WeakPolarHBondContact CD-O 3.13Å; R151-V207 HydrophobicContact CG-CG2 3.66Å; R151-T210 WeakPolarHBondContact CA-OG1 3.23Å; R151-T210 PolarHBondContact O-OG1 3.07Å
152	R	92.3	Very high	77.7	Confident	30 Å²	30	57 Å²	57	11%	0.113	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	145.9	-177.9	-76	167.6	74.3	-125.3	3.7	113	R148 Q149 A150 L202 E203 P231 D233	R148-R152 WeakPolarHBondContact O-CD 3.4Å; R148-R152 VanDerWaalsContact O-CG 3.28Å; R148-R152 WeakPolarHBondContact O-CG 3.26Å; Q149-R152 PolarHBondContact O-N 3.11Å; A150-R152 VanDerWaalsContact C-N 3.34Å; R152-L202 CarbonylContact C-O 3.53Å; R152-L202 WeakPolarHBondContact CA-O 3.25Å; R152-E203 HydrophobicContact CG-CB 3.97Å; R152-E203 HydrophobicContact CG-CG 4.03Å; R152-P231 HydrophobicContact CB-CG 3.88Å; R152-P231 WeakPolarHBondContact O-CD 3.39Å; R152-D233 IonicContact NH1-OD1 3.11Å; R152-D233 IonicContact NH1-OD2 3.82Å
153	L	94.1	Very high	80.1	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	146.1	167.2	-66.2	-178.3	0	0	0	110.8	F201 L202 F204 T210 A213 M214 I228	L153-F201 CarbonylContact O-C 3.49Å; L153-F201 VanDerWaalsContact O-CA 3.3Å; L153-F201 WeakPolarHBondContact O-CA 3.48Å; L153-L202 PolarHBondContact N-O 2.9Å; L153-L202 PolarHBondContact O-N 2.82Å; L153-F204 HydrophobicContact CB-CE2 4.3Å; L153-F204 HydrophobicContact CD1-CE2 3.71Å; L153-F204 HydrophobicContact CD1-CZ 4.01Å; L153-F204 HydrophobicContact CG-CE2 3.9Å; L153-T210 HydrophobicContact CD1-CG2 4.37Å; L153-T210 HydrophobicContact CD2-CG2 3.69Å; L153-T210 HydrophobicContact CG-CG2 3.61Å; L153-A213 HydrophobicContact CD1-CB 3.7Å; L153-M214 HydrophobicContact CD2-CG 4.02Å; L153-M214 HydrophobicContact CD2-SD 3.54Å; L153-M214 VanDerWaalsContact CD2-SD 3.54Å; L153-I228 HydrophobicContact CB-CG2 4.36Å; L153-I228 HydrophobicContact CD1-CG2 3.7Å; L153-I228 HydrophobicContact CG-CG2 4.41Å
154	Y	94.6	Very high	82.2	Confident	73 Å²	73	57 Å²	57	29%	0.286	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	133.2	163.4	171.9	-88.4	0	0	0	108.8	F199 F201 I228 R229	Y154-F199 HydrophobicContact CD2-CB 4.44Å; Y154-F199 HydrophobicContact CD2-CD2 4.22Å; Y154-F199 HydrophobicContact CD2-CG 4.39Å; Y154-F199 HydrophobicContact CE2-CB 3.56Å; Y154-F199 AromaticContact CE2-CD1 3.98Å; Y154-F199 HydrophobicContact CE2-CD1 3.98Å; Y154-F199 AromaticContact CE2-CD2 3.73Å; Y154-F199 HydrophobicContact CE2-CD2 3.73Å; Y154-F199 HydrophobicContact CE2-CE2 4.43Å; Y154-F199 AromaticContact CE2-CG 3.5Å; Y154-F199 HydrophobicContact CE2-CG 3.5Å; Y154-F199 VanDerWaalsContact CE2-CG 3.5Å; Y154-F199 WeakPolarHBondContact OH-CB 3.28Å; Y154-F201 AromaticContact CD2-CE1 3.89Å; Y154-F201 HydrophobicContact CD2-CE1 3.89Å; Y154-F201 HydrophobicContact CD2-CZ 4.03Å; Y154-F201 HydrophobicContact CG-CE1 4.46Å; Y154-I228 CarbonylContact O-C 3.59Å; Y154-I228 WeakPolarHBondContact O-CA 3.46Å; Y154-R229 HydrophobicContact CD1-CB 4.25Å; Y154-R229 PolarHBondContact N-O 3.11Å; Y154-R229 PolarHBondContact O-N 2.7Å
155	V	94.8	Very high	84.3	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	101.2	177.7	179.3	0	0	0	0	108.4	I158 F171 F199 A200 L202 L226 K227 I228	V155-I158 HydrophobicContact CG1-CG2 4.22Å; V155-I158 WeakPolarHBondContact O-CG2 3.49Å; V155-F171 HydrophobicContact CG1-CZ 4.45Å; V155-F171 HydrophobicContact CG2-CZ 4.4Å; V155-F199 CarbonylContact O-C 3.59Å; V155-F199 VanDerWaalsContact O-CA 3.26Å; V155-F199 WeakPolarHBondContact O-CA 3.47Å; V155-A200 HydrophobicContact CB-CB 4.48Å; V155-A200 PolarHBondContact N-O 2.82Å; V155-A200 PolarHBondContact O-N 3.3Å; V155-L202 HydrophobicContact CB-CD1 4.15Å; V155-L202 HydrophobicContact CG2-CD1 3.65Å; V155-L202 HydrophobicContact CG2-CD2 4.3Å; V155-L226 HydrophobicContact CG1-CB 4.02Å; V155-L226 HydrophobicContact CG1-CD1 4.04Å; V155-L226 HydrophobicContact CG1-CD2 4.4Å; V155-L226 HydrophobicContact CG1-CG 4.39Å; V155-K227 WeakPolarHBondContact CA-O 3.24Å; V155-I228 HydrophobicContact CG2-CG1 4.18Å; V155-I228 HydrophobicContact CG2-CG2 4.4Å
156	G	91.9	Very high	86.2	Confident	3 Å²	3	55.3 Å²	55.3	3%	0.031	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	172.1	176.1	0	0	0	0	0	112.8	K227	G156-K227 PolarHBondContact N-O 3.33Å; G156-K227 PolarHBondContact O-N 3.24Å
157	N	89.9	Confident	88.4	Confident	66 Å²	66	47.2 Å²	47.2	35%	0.353	24%	0.241	S	C	.	.	S	Bend	trans	61.6	47.5	-179.4	-159.6	100.6	0	0	0	111.7	N198 Q224 S225 L226 K227	N157-N198 PolarHBondContact N-O 3.27Å; N157-Q224 PolarHBondContact O-OE1 3.41Å; N157-S225 PolarHBondContact ND2-O 3.26Å; N157-L226 WeakPolarHBondContact O-CD2 3.24Å; N157-K227 HydrophobicContact CB-CD 4.14Å; N157-K227 HydrophobicContact CB-CG 4.07Å
158	I	92.3	Very high	89.7	Confident	4 Å²	4	47.1 Å²	47.1	2%	0.021	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-84.2	149.9	176.6	78.6	-174.9	0	0	0	110.6	V155 I162 M167 I193 N198 Q224 L226	V155-I158 HydrophobicContact CG1-CG2 4.22Å; V155-I158 WeakPolarHBondContact O-CG2 3.49Å; I158-I162 HydrophobicContact CB-CG2 4.43Å; I158-I162 HydrophobicContact CD1-CG2 3.85Å; I158-I162 HydrophobicContact CG1-CG2 4.08Å; I158-M167 HydrophobicContact CB-CE 4.14Å; I158-M167 HydrophobicContact CG2-CE 3.86Å; I158-I193 HydrophobicContact CD1-CG2 3.68Å; I158-N198 HydrophobicContact CG1-CB 4.2Å; I158-N198 PolarHBondContact N-O 2.73Å; I158-Q224 VanDerWaalsContact C-OE1 3.3Å; I158-Q224 PolarHBondContact O-OE1 3.17Å; I158-L226 HydrophobicContact CG2-CD2 4.33Å
159	P	88.6	Confident	90.7	Very high	8 Å²	8	47.2 Å²	47.2	5%	0.052	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-65.2	148.4	172.9	26.8	-34.4	0	0	0	112.1	I162 F221 Q222	P159-I162 HydrophobicContact CG-CB 4.2Å; P159-I162 HydrophobicContact CG-CD1 4.42Å; P159-I162 HydrophobicContact CG-CG1 4.38Å; P159-I162 WeakPolarHBondContact O-CB 3.14Å; P159-I162 WeakPolarHBondContact O-CG2 3.2Å; P159-F221 HydrophobicContact CG-CD1 4.28Å; P159-Q222 HydrophobicContact CB-CB 4.36Å; P159-Q222 HydrophobicContact CG-CB 4.12Å; P159-Q222 HydrophobicContact CG-CG 4.47Å
160	F	87.5	Confident	91.4	Very high	171 Å²	171	45.1 Å²	45.1	75%	0.75	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.6	145.2	177.5	179.3	-97	0	0	0	111.8	I162	F160-I162 VanDerWaalsContact C-N 3.29Å; F160-I162 PolarHBondContact O-N 3.16Å
161	G	86.1	Confident	92	Very high	50 Å²	50	44.8 Å²	44.8	52%	0.515	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.2	10.2	178.2	0	0	0	0	0	115.3
162	I	90.4	Very high	92.2	Very high	5 Å²	5	44.4 Å²	44.4	3%	0.026	23%	0.231	C	C	.	.			trans	-72.6	144.2	-178.5	-171.6	66.7	0	0	0	113.2	I158 P159 F160 S166 M167 I193 F221	I158-I162 HydrophobicContact CB-CG2 4.43Å; I158-I162 HydrophobicContact CD1-CG2 3.85Å; I158-I162 HydrophobicContact CG1-CG2 4.08Å; P159-I162 HydrophobicContact CG-CB 4.2Å; P159-I162 HydrophobicContact CG-CD1 4.42Å; P159-I162 HydrophobicContact CG-CG1 4.38Å; P159-I162 WeakPolarHBondContact O-CB 3.14Å; P159-I162 WeakPolarHBondContact O-CG2 3.2Å; F160-I162 VanDerWaalsContact C-N 3.29Å; F160-I162 PolarHBondContact O-N 3.16Å; I162-S166 VanDerWaalsContact CD1-OG 3.24Å; I162-S166 WeakPolarHBondContact CD1-OG 3.1Å; I162-M167 HydrophobicContact CG1-CE 4.33Å; I162-I193 HydrophobicContact CG2-CD1 4.19Å; I162-F221 HydrophobicContact CD1-CD1 4.48Å; I162-F221 HydrophobicContact CD1-CE1 3.43Å; I162-F221 VanDerWaalsContact CD1-CE1 3.43Å; I162-F221 HydrophobicContact CD1-CZ 3.62Å; I162-F221 HydrophobicContact CG1-CE1 3.81Å; I162-F221 HydrophobicContact CG1-CZ 4.41Å
163	T	92.8	Very high	92.2	Very high	74 Å²	74	45.6 Å²	45.6	45%	0.454	25%	0.247	S	C	.	.			trans	-99.1	151.7	178.6	68.7	0	0	0	0	112.5	E165 S166 M167	T163-E165 VanDerWaalsContact C-N 3.3Å; T163-E165 PolarHBondContact O-N 2.86Å; T163-S166 PolarHBondContact N-OG 3.29Å; T163-S166 PolarHBondContact O-N 2.91Å; T163-S166 PolarHBondContact O-OG 2.9Å; T163-S166 VanDerWaalsContact O-OG 3.1Å; T163-S166 WeakPolarHBondContact OG1-CB 3.4Å; T163-S166 PolarHBondContact OG1-N 2.88Å; T163-S166 PolarHBondContact OG1-OG 2.82Å; T163-M167 PolarHBondContact O-N 2.85Å; T163-M167 VanDerWaalsContact O-N 3.13Å
164	E	92.2	Very high	92	Very high	93 Å²	93	47.9 Å²	47.9	44%	0.435	26%	0.258	S	S	.	.	H	α-helix	trans	-62	-38.6	177.7	-73	176	165.7	0	0	112	M168 V191 Q192 I193	E164-M168 VanDerWaalsContact O-CB 3.24Å; E164-M168 WeakPolarHBondContact O-CB 3.45Å; E164-M168 PolarHBondContact O-N 2.86Å; E164-V191 HydrophobicContact CB-CB 4.16Å; E164-V191 VanDerWaalsContact CD-O 3.29Å; E164-V191 HydrophobicContact CG-CB 4.33Å; E164-V191 HydrophobicContact CG-CG1 4.34Å; E164-Q192 VanDerWaalsContact OE1-CA 3.28Å; E164-Q192 WeakPolarHBondContact OE1-CA 3.32Å; E164-I193 HydrophobicContact CB-CD1 4.31Å; E164-I193 HydrophobicContact CG-CB 4.09Å; E164-I193 HydrophobicContact CG-CD1 3.61Å; E164-I193 HydrophobicContact CG-CG1 3.71Å; E164-I193 PolarHBondContact OE1-N 2.82Å
165	E	92.9	Very high	91.8	Very high	144 Å²	144	44.4 Å²	44.4	67%	0.673	24%	0.244	S	C	*	.	H	α-helix	trans	-61.3	-52	174.8	-176.2	176	-144.7	0	0	112.3	T163 M167 M168 D169	T163-E165 VanDerWaalsContact C-N 3.3Å; T163-E165 PolarHBondContact O-N 2.86Å; E165-M167 VanDerWaalsContact C-N 3.31Å; E165-M167 PolarHBondContact O-N 2.88Å; E165-M168 WeakPolarHBondContact O-CB 3.3Å; E165-M168 PolarHBondContact O-N 3.46Å; E165-M168 VanDerWaalsContact O-N 3.11Å; E165-D169 PolarHBondContact O-N 3.01Å
166	S	93.6	Very high	91.5	Very high	39 Å²	39	51 Å²	51	27%	0.273	27%	0.269	S	S	.	.	H	α-helix	trans	-66.6	-31.9	-178.5	59.4	0	0	0	0	113.1	I162 T163 F170	I162-S166 VanDerWaalsContact CD1-OG 3.24Å; I162-S166 WeakPolarHBondContact CD1-OG 3.1Å; T163-S166 PolarHBondContact N-OG 3.29Å; T163-S166 PolarHBondContact O-N 2.91Å; T163-S166 PolarHBondContact O-OG 2.9Å; T163-S166 VanDerWaalsContact O-OG 3.1Å; T163-S166 WeakPolarHBondContact OG1-CB 3.4Å; T163-S166 PolarHBondContact OG1-N 2.88Å; T163-S166 PolarHBondContact OG1-OG 2.82Å; S166-F170 VanDerWaalsContact O-CB 3.32Å; S166-F170 WeakPolarHBondContact O-CB 3.39Å; S166-F170 PolarHBondContact O-N 2.81Å; S166-F170 VanDerWaalsContact O-N 3.16Å
167	M	93.1	Very high	91.3	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-71.7	-40.2	170.6	-177.9	163.2	-71.5	0	0	112	I158 I162 T163 E165 F170 F171 V191 A200 L202 F221	I158-M167 HydrophobicContact CB-CE 4.14Å; I158-M167 HydrophobicContact CG2-CE 3.86Å; I162-M167 HydrophobicContact CG1-CE 4.33Å; T163-M167 PolarHBondContact O-N 2.85Å; T163-M167 VanDerWaalsContact O-N 3.13Å; E165-M167 VanDerWaalsContact C-N 3.31Å; E165-M167 PolarHBondContact O-N 2.88Å; M167-F170 PolarHBondContact O-N 3.25Å; M167-F171 HydrophobicContact CG-CD2 3.93Å; M167-F171 HydrophobicContact CG-CE2 4.08Å; M167-F171 WeakPolarHBondContact O-CD2 3.34Å; M167-F171 PolarHBondContact O-N 2.83Å; M167-F171 VanDerWaalsContact O-N 3.11Å; M167-V191 HydrophobicContact CB-CG1 4.33Å; M167-V191 HydrophobicContact CG-CG1 4.16Å; M167-V191 HydrophobicContact SD-CG1 4.04Å; M167-A200 HydrophobicContact SD-CB 3.65Å; M167-L202 HydrophobicContact SD-CD1 4.04Å; M167-F221 HydrophobicContact CB-CE1 4.27Å; M167-F221 HydrophobicContact CE-CD1 4.08Å; M167-F221 HydrophobicContact CE-CE1 3.85Å
168	M	94.2	Very high	90.9	Very high	43 Å²	43	56.6 Å²	56.6	21%	0.212	31%	0.307	C	S	.	.	H	α-helix	trans	-60.6	-49.9	176.9	-175.2	178	-62.5	0	0	111.2	E164 E165 F171 N172 V188 V191	E164-M168 VanDerWaalsContact O-CB 3.24Å; E164-M168 WeakPolarHBondContact O-CB 3.45Å; E164-M168 PolarHBondContact O-N 2.86Å; E165-M168 WeakPolarHBondContact O-CB 3.3Å; E165-M168 PolarHBondContact O-N 3.46Å; E165-M168 VanDerWaalsContact O-N 3.11Å; M168-F171 PolarHBondContact O-N 3.15Å; M168-N172 WeakPolarHBondContact CG-ND2 3.41Å; M168-N172 VanDerWaalsContact O-CB 3.3Å; M168-N172 WeakPolarHBondContact O-CB 3.43Å; M168-N172 VanDerWaalsContact O-CG 3.25Å; M168-N172 PolarHBondContact O-N 2.82Å; M168-N172 PolarHBondContact O-ND2 2.82Å; M168-N172 VanDerWaalsContact O-ND2 3.16Å; M168-V188 HydrophobicContact CG-CB 4.19Å; M168-V188 HydrophobicContact CG-CG1 3.99Å; M168-V191 HydrophobicContact CB-CG2 3.72Å; M168-V191 HydrophobicContact CE-CG2 4.1Å; M168-V191 HydrophobicContact CG-CG2 4.32Å
169	D	93.9	Very high	90.5	Very high	91 Å²	91	59.1 Å²	59.1	49%	0.487	33%	0.334	S	S	.	.	H	α-helix	trans	-65.8	-38.3	180	-83.8	-13.2	0	0	0	112.4	E165 N172 A173	E165-D169 PolarHBondContact O-N 3.01Å; D169-N172 PolarHBondContact O-N 3.08Å; D169-A173 VanDerWaalsContact O-CB 3.22Å; D169-A173 WeakPolarHBondContact O-CB 3.24Å; D169-A173 PolarHBondContact O-N 3.4Å
170	F	94.1	Very high	90.2	Very high	35 Å²	35	59.2 Å²	59.2	15%	0.154	33%	0.334	C	S	.	.	H	α-helix	trans	-58.6	-53	173.8	177.6	-104.3	0	0	0	111.8	S166 M167 N172 A173 Q174 I219 I220 F221 L226	S166-F170 VanDerWaalsContact O-CB 3.32Å; S166-F170 WeakPolarHBondContact O-CB 3.39Å; S166-F170 PolarHBondContact O-N 2.81Å; S166-F170 VanDerWaalsContact O-N 3.16Å; M167-F170 PolarHBondContact O-N 3.25Å; F170-N172 PolarHBondContact O-N 3.08Å; F170-A173 PolarHBondContact O-N 2.85Å; F170-Q174 HydrophobicContact CD1-CG 4.47Å; F170-Q174 HydrophobicContact CD2-CG 4.31Å; F170-Q174 HydrophobicContact CE1-CG 4.19Å; F170-Q174 HydrophobicContact CE2-CG 4.03Å; F170-Q174 HydrophobicContact CZ-CG 3.97Å; F170-Q174 VanDerWaalsContact O-CG 3.27Å; F170-Q174 WeakPolarHBondContact O-CG 3.38Å; F170-Q174 PolarHBondContact O-N 2.8Å; F170-I219 HydrophobicContact CE1-CD1 3.96Å; F170-I219 HydrophobicContact CE1-CG1 4.38Å; F170-I219 HydrophobicContact CE1-CG2 4.03Å; F170-I219 HydrophobicContact CZ-CD1 3.67Å; F170-I219 HydrophobicContact CZ-CG1 3.98Å; F170-I219 HydrophobicContact CZ-CG2 4.41Å; F170-I220 WeakPolarHBondContact CZ-O 3.36Å; F170-F221 HydrophobicContact CB-CD2 4.04Å; F170-F221 HydrophobicContact CB-CE2 3.48Å; F170-F221 VanDerWaalsContact CB-CE2 3.48Å; F170-F221 HydrophobicContact CB-CZ 3.91Å; F170-F221 HydrophobicContact CD1-CB 4.38Å; F170-F221 AromaticContact CD1-CD2 3.62Å; F170-F221 HydrophobicContact CD1-CD2 3.62Å; F170-F221 AromaticContact CD1-CE2 3.95Å; F170-F221 HydrophobicContact CD1-CE2 3.95Å; F170-F221 AromaticContact CD1-CG 3.96Å; F170-F221 HydrophobicContact CD1-CG 3.96Å; F170-F221 AromaticContact CD2-CD2 3.44Å; F170-F221 HydrophobicContact CD2-CD2 3.44Å; F170-F221 VanDerWaalsContact CD2-CD2 3.44Å; F170-F221 AromaticContact CD2-CE2 3.63Å; F170-F221 HydrophobicContact CD2-CE2 3.63Å; F170-F221 HydrophobicContact CD2-CG 4.48Å; F170-F221 HydrophobicContact CE1-CB 3.88Å; F170-F221 AromaticContact CE1-CD2 3.83Å; F170-F221 HydrophobicContact CE1-CD2 3.83Å; F170-F221 AromaticContact CE1-CG 3.97Å; F170-F221 HydrophobicContact CE1-CG 3.97Å; F170-F221 AromaticContact CE2-CD2 3.65Å; F170-F221 HydrophobicContact CE2-CD2 3.65Å; F170-F221 HydrophobicContact CE2-CE2 4.31Å; F170-F221 HydrophobicContact CE2-CG 4.48Å; F170-F221 AromaticContact CG-CD2 3.41Å; F170-F221 HydrophobicContact CG-CD2 3.41Å; F170-F221 VanDerWaalsContact CG-CD2 3.41Å; F170-F221 AromaticContact CG-CE2 3.4Å; F170-F221 HydrophobicContact CG-CE2 3.4Å; F170-F221 VanDerWaalsContact CG-CE2 3.4Å; F170-F221 HydrophobicContact CG-CG 4.22Å; F170-F221 HydrophobicContact CG-CZ 4.17Å; F170-F221 HydrophobicContact CZ-CB 3.97Å; F170-F221 AromaticContact CZ-CD2 3.84Å; F170-F221 HydrophobicContact CZ-CD2 3.84Å; F170-F221 HydrophobicContact CZ-CG 4.23Å; F170-L226 HydrophobicContact CE1-CD1 4.46Å
171	F	93.9	Very high	90.1	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-67.5	-35.3	179.6	-84.3	-81.5	0	0	0	112.8	V155 M167 M168 M175 V188 L202 F216 L226 I228	V155-F171 HydrophobicContact CG1-CZ 4.45Å; V155-F171 HydrophobicContact CG2-CZ 4.4Å; M167-F171 HydrophobicContact CG-CD2 3.93Å; M167-F171 HydrophobicContact CG-CE2 4.08Å; M167-F171 WeakPolarHBondContact O-CD2 3.34Å; M167-F171 PolarHBondContact O-N 2.83Å; M167-F171 VanDerWaalsContact O-N 3.11Å; M168-F171 PolarHBondContact O-N 3.15Å; F171-M175 VanDerWaalsContact O-CB 3.31Å; F171-M175 WeakPolarHBondContact O-CB 3.37Å; F171-M175 WeakPolarHBondContact O-CG 3.48Å; F171-M175 PolarHBondContact O-N 3.45Å; F171-V188 HydrophobicContact CB-CG2 3.88Å; F171-L202 HydrophobicContact CB-CD2 4.14Å; F171-L202 HydrophobicContact CD1-CD2 4.04Å; F171-L202 HydrophobicContact CD2-CD2 3.59Å; F171-L202 HydrophobicContact CE1-CD2 4.35Å; F171-L202 HydrophobicContact CE2-CD2 3.92Å; F171-L202 HydrophobicContact CG-CD2 3.64Å; F171-L202 HydrophobicContact CZ-CD2 4.28Å; F171-F216 HydrophobicContact CD1-CD2 4.41Å; F171-F216 HydrophobicContact CE1-CB 4.21Å; F171-F216 HydrophobicContact CE1-CD2 4.5Å; F171-L226 HydrophobicContact CE2-CD1 3.72Å; F171-L226 HydrophobicContact CZ-CD1 3.69Å; F171-I228 HydrophobicContact CE1-CD1 3.55Å; F171-I228 HydrophobicContact CZ-CD1 3.7Å
172	N	93.1	Very high	89.7	Confident	4 Å²	4	57 Å²	57	2%	0.021	32%	0.315	C	S	.	.	H	α-helix	trans	-63.5	-41.6	172.8	-77.4	-33.7	0	0	0	112.1	M168 D169 F170 R176 N186 P187 V188	M168-N172 WeakPolarHBondContact CG-ND2 3.41Å; M168-N172 VanDerWaalsContact O-CB 3.3Å; M168-N172 WeakPolarHBondContact O-CB 3.43Å; M168-N172 VanDerWaalsContact O-CG 3.25Å; M168-N172 PolarHBondContact O-N 2.82Å; M168-N172 PolarHBondContact O-ND2 2.82Å; M168-N172 VanDerWaalsContact O-ND2 3.16Å; D169-N172 PolarHBondContact O-N 3.08Å; F170-N172 PolarHBondContact O-N 3.08Å; N172-R176 WeakPolarHBondContact O-CD 3.37Å; N172-R176 WeakPolarHBondContact O-CG 3.33Å; N172-R176 PolarHBondContact O-N 3.22Å; N172-R176 VanDerWaalsContact O-N 3.15Å; N172-N186 PolarHBondContact ND2-ND2 2.8Å; N172-P187 WeakPolarHBondContact OD1-CD 3.43Å; N172-P187 WeakPolarHBondContact OD1-CG 3.43Å; N172-V188 WeakPolarHBondContact OD1-CB 3.3Å; N172-V188 PolarHBondContact OD1-N 3.22Å
173	A	92.1	Very high	89.2	Confident	55 Å²	55	59 Å²	59	46%	0.455	33%	0.333	S	S	.	.	H	α-helix	trans	-66.6	-45.3	176.6	0	0	0	0	0	111.8	D169 F170 R176 L177	D169-A173 VanDerWaalsContact O-CB 3.22Å; D169-A173 WeakPolarHBondContact O-CB 3.24Å; D169-A173 PolarHBondContact O-N 3.4Å; F170-A173 PolarHBondContact O-N 2.85Å; A173-R176 PolarHBondContact O-N 2.81Å; A173-L177 WeakPolarHBondContact O-CB 3.44Å; A173-L177 PolarHBondContact O-N 3.16Å
174	Q	90.6	Very high	88.4	Confident	48 Å²	48	61.5 Å²	61.5	22%	0.224	35%	0.351	C	S	.	.	H	α-helix	trans	-65	-43.4	178.7	-66.1	-65.3	-13.9	0	0	112.1	F170 R176 L177 G178 F216 I219	F170-Q174 HydrophobicContact CD1-CG 4.47Å; F170-Q174 HydrophobicContact CD2-CG 4.31Å; F170-Q174 HydrophobicContact CE1-CG 4.19Å; F170-Q174 HydrophobicContact CE2-CG 4.03Å; F170-Q174 HydrophobicContact CZ-CG 3.97Å; F170-Q174 VanDerWaalsContact O-CG 3.27Å; F170-Q174 WeakPolarHBondContact O-CG 3.38Å; F170-Q174 PolarHBondContact O-N 2.8Å; Q174-R176 VanDerWaalsContact C-N 3.3Å; Q174-R176 PolarHBondContact O-N 3.29Å; Q174-L177 PolarHBondContact O-N 3.24Å; Q174-G178 PolarHBondContact O-N 3.45Å; Q174-F216 HydrophobicContact CB-CE1 3.97Å; Q174-F216 HydrophobicContact CB-CE2 4.16Å; Q174-F216 HydrophobicContact CB-CZ 3.77Å; Q174-F216 WeakPolarHBondContact O-CZ 3.19Å; Q174-I219 HydrophobicContact CB-CD1 4.34Å; Q174-I219 HydrophobicContact CG-CD1 3.72Å
175	M	90.1	Very high	88.1	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-59.1	-39.4	174.1	-76.7	-73.5	-75.1	0	0	112.5	F171 G179 L180 T181 P187 F204 E209 A213 F216	F171-M175 VanDerWaalsContact O-CB 3.31Å; F171-M175 WeakPolarHBondContact O-CB 3.37Å; F171-M175 WeakPolarHBondContact O-CG 3.48Å; F171-M175 PolarHBondContact O-N 3.45Å; M175-G179 PolarHBondContact O-N 2.95Å; M175-L180 HydrophobicContact CE-CB 3.88Å; M175-L180 PolarHBondContact O-N 3.18Å; M175-L180 HydrophobicContact SD-CB 3.71Å; M175-L180 HydrophobicContact SD-CD1 3.96Å; M175-L180 HydrophobicContact SD-CG 4.48Å; M175-T181 HydrophobicContact CB-CG2 4.11Å; M175-P187 HydrophobicContact CB-CG 3.68Å; M175-P187 HydrophobicContact CE-CB 4.04Å; M175-P187 HydrophobicContact CE-CG 4.35Å; M175-P187 HydrophobicContact CG-CG 3.95Å; M175-F204 HydrophobicContact CE-CE1 4.46Å; M175-E209 HydrophobicContact CE-CB 3.68Å; M175-E209 HydrophobicContact CE-CG 4.07Å; M175-E209 WeakPolarHBondContact CE-O 3.29Å; M175-A213 HydrophobicContact SD-CB 3.9Å; M175-F216 HydrophobicContact CG-CE2 3.96Å; M175-F216 HydrophobicContact SD-CE2 3.72Å
176	R	88.8	Confident	87.8	Confident	138 Å²	138	55.2 Å²	55.2	52%	0.521	34%	0.335	S	S	.	.	H	α-helix	trans	-69.4	-45.3	175.4	-71.6	169.1	-179.3	-150	9.4	111.8	N172 A173 Q174 G178 G179 T181 N186	N172-R176 WeakPolarHBondContact O-CD 3.37Å; N172-R176 WeakPolarHBondContact O-CG 3.33Å; N172-R176 PolarHBondContact O-N 3.22Å; N172-R176 VanDerWaalsContact O-N 3.15Å; A173-R176 PolarHBondContact O-N 2.81Å; Q174-R176 VanDerWaalsContact C-N 3.3Å; Q174-R176 PolarHBondContact O-N 3.29Å; R176-G178 PolarHBondContact O-N 3.2Å; R176-G179 PolarHBondContact O-N 3.38Å; R176-G179 VanDerWaalsContact O-N 3.12Å; R176-T181 HydrophobicContact CG-CG2 3.96Å; R176-N186 PolarHBondContact NH2-OD1 2.76Å
177	L	87.9	Confident	87.6	Confident	148 Å²	148	53.4 Å²	53.4	78%	0.775	32%	0.322	S	S	*	.	H	α-helix	trans	-63	-40.1	-179.3	-171.3	71.7	0	0	0	112	A173 Q174 G179	A173-L177 WeakPolarHBondContact O-CB 3.44Å; A173-L177 PolarHBondContact O-N 3.16Å; Q174-L177 PolarHBondContact O-N 3.24Å; L177-G179 VanDerWaalsContact C-N 3.26Å; L177-G179 PolarHBondContact O-N 3.25Å
178	G	81.4	Confident	87.5	Confident	39 Å²	39	53.4 Å²	53.4	40%	0.402	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	0.8	175	0	0	0	0	0	115.1	Q174 R176 L180	Q174-G178 PolarHBondContact O-N 3.45Å; R176-G178 PolarHBondContact O-N 3.2Å; G178-L180 PolarHBondContact O-N 3.42Å
179	G	83.7	Confident	87.4	Confident	57 Å²	57	56.1 Å²	56.1	59%	0.588	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.3	20.2	-178.1	0	0	0	0	0	114.8	M175 R176 L177	M175-G179 PolarHBondContact O-N 2.95Å; R176-G179 PolarHBondContact O-N 3.38Å; R176-G179 VanDerWaalsContact O-N 3.12Å; L177-G179 VanDerWaalsContact C-N 3.26Å; L177-G179 PolarHBondContact O-N 3.25Å
180	L	82.6	Confident	87.2	Confident	10 Å²	10	53.6 Å²	53.6	5%	0.052	33%	0.329	C	S	.	.			trans	-86.3	-4.8	-171.9	-55.2	-179.3	0	0	0	113.6	M175 G178 Q212 F216 V246	M175-L180 HydrophobicContact CE-CB 3.88Å; M175-L180 PolarHBondContact O-N 3.18Å; M175-L180 HydrophobicContact SD-CB 3.71Å; M175-L180 HydrophobicContact SD-CD1 3.96Å; M175-L180 HydrophobicContact SD-CG 4.48Å; G178-L180 PolarHBondContact O-N 3.42Å; L180-Q212 HydrophobicContact CB-CB 4.2Å; L180-Q212 HydrophobicContact CD1-CB 4.17Å; L180-Q212 HydrophobicContact CD2-CB 4.24Å; L180-Q212 HydrophobicContact CG-CB 4.43Å; L180-F216 HydrophobicContact CD1-CE2 3.75Å; L180-F216 HydrophobicContact CD1-CZ 3.64Å; L180-V246 HydrophobicContact CD2-CB 4.1Å; L180-V246 HydrophobicContact CD2-CG1 4.15Å; L180-V246 HydrophobicContact CD2-CG2 3.91Å
181	T	84.4	Confident	87.2	Confident	45 Å²	45	52.3 Å²	52.3	28%	0.276	32%	0.324	S	S	.	.			trans	-78	124.4	178.4	51.2	0	0	0	0	112.4	M175 R176 P187 E209	M175-T181 HydrophobicContact CB-CG2 4.11Å; R176-T181 HydrophobicContact CG-CG2 3.96Å; T181-P187 HydrophobicContact CG2-CB 4.35Å; T181-P187 HydrophobicContact CG2-CG 3.86Å; T181-E209 WeakPolarHBondContact CA-OE1 3.5Å
182	Q	78.8	Confident	87.1	Confident	128 Å²	128	57 Å²	57	60%	0.598	35%	0.346	S	S	*	.	S	Bend	trans	-81.9	-18	-179.1	-67.8	-64.6	-51.2	0	0	114.3	E209	Q182-E209 HydrophobicContact CB-CG 4.27Å; Q182-E209 HydrophobicContact CG-CG 3.88Å; Q182-E209 PolarHBondContact N-OE1 3.01Å
183	A	78.4	Confident	87.1	Confident	47 Å²	47	58.2 Å²	58.2	39%	0.388	35%	0.352	S	S	.	.	S	Bend	trans	-149.5	160.3	-174.1	0	0	0	0	0	111.9	R205	A183-R205 PolarHBondContact O-NH1 3.14Å; A183-R205 PolarHBondContact O-NH2 3.16Å
184	P	77.6	Confident	87.1	Confident	128 Å²	128	57.8 Å²	57.8	83%	0.831	34%	0.342	S	S	*	.	S	Bend	trans	-58.6	150.4	169.8	25.4	-35.1	0	0	0	111.9	R205	P184-R205 PolarHBondContact O-NH1 2.65Å
185	G	84.4	Confident	86.9	Confident	44 Å²	44	60.4 Å²	60.4	45%	0.454	35%	0.354	S	S	.	.	S	Bend	trans	99	-173.7	-176.1	0	0	0	0	0	114.2
186	N	87.8	Confident	86.6	Confident	61 Å²	61	67.3 Å²	67.3	33%	0.326	39%	0.391	S	S	.	.			trans	-84.6	129.5	-178.7	-75.6	-4.1	0	0	0	111.5	N172 R176 R205	N172-N186 PolarHBondContact ND2-ND2 2.8Å; R176-N186 PolarHBondContact NH2-OD1 2.76Å; N186-R205 WeakPolarHBondContact O-CD 3.43Å
187	P	87.9	Confident	86.4	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	40%	0.397	C	S	.	.	S	Bend	trans	-71	-37.3	173.6	28.1	-36.7	0	0	0	113.3	N172 M175 T181 F204 R205	N172-P187 WeakPolarHBondContact OD1-CD 3.43Å; N172-P187 WeakPolarHBondContact OD1-CG 3.43Å; M175-P187 HydrophobicContact CB-CG 3.68Å; M175-P187 HydrophobicContact CE-CB 4.04Å; M175-P187 HydrophobicContact CE-CG 4.35Å; M175-P187 HydrophobicContact CG-CG 3.95Å; T181-P187 HydrophobicContact CG2-CB 4.35Å; T181-P187 HydrophobicContact CG2-CG 3.86Å; P187-F204 HydrophobicContact CB-CD1 4.31Å; P187-F204 CarbonylContact O-C 3.53Å; P187-F204 WeakPolarHBondContact O-CA 3.23Å; P187-R205 PolarHBondContact O-N 2.85Å
188	V	92.8	Very high	86.5	Confident	1 Å²	1	64.1 Å²	64.1	1%	0.006	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	125.8	173	-173.8	0	0	0	0	108.9	M168 F171 N172 V191 F204	M168-V188 HydrophobicContact CG-CB 4.19Å; M168-V188 HydrophobicContact CG-CG1 3.99Å; F171-V188 HydrophobicContact CB-CG2 3.88Å; N172-V188 WeakPolarHBondContact OD1-CB 3.3Å; N172-V188 PolarHBondContact OD1-N 3.22Å; V188-V191 HydrophobicContact CG1-CG2 3.95Å; V188-F204 HydrophobicContact CG2-CD1 4.03Å; V188-F204 HydrophobicContact CG2-CE1 3.62Å; V188-F204 HydrophobicContact CG2-CZ 3.97Å
189	L	90.2	Very high	87.1	Confident	100 Å²	100	64.1 Å²	64.1	52%	0.524	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	-34.5	179.6	-64	-178.3	0	0	0	112.8	E203 R205	L189-E203 PolarHBondContact N-O 3.15Å; L189-R205 HydrophobicContact CD1-CB 3.75Å; L189-R205 HydrophobicContact CD2-CB 4.11Å; L189-R205 HydrophobicContact CG-CB 3.91Å
190	A	90.1	Very high	87.6	Confident	38 Å²	38	61.4 Å²	61.4	31%	0.314	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	150.6	-180	0	0	0	0	0	111	E203	A190-E203 HydrophobicContact CB-CB 4.28Å; A190-E203 PolarHBondContact N-O 2.98Å; A190-E203 PolarHBondContact O-N 2.76Å
191	V	94.2	Very high	88.1	Confident	8 Å²	8	63.2 Å²	63.2	5%	0.048	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	141.5	168.2	-173.3	0	0	0	0	106.5	E164 M167 M168 V188 I193 A200 F201 L202	E164-V191 HydrophobicContact CB-CB 4.16Å; E164-V191 VanDerWaalsContact CD-O 3.29Å; E164-V191 HydrophobicContact CG-CB 4.33Å; E164-V191 HydrophobicContact CG-CG1 4.34Å; M167-V191 HydrophobicContact CB-CG1 4.33Å; M167-V191 HydrophobicContact CG-CG1 4.16Å; M167-V191 HydrophobicContact SD-CG1 4.04Å; M168-V191 HydrophobicContact CB-CG2 3.72Å; M168-V191 HydrophobicContact CE-CG2 4.1Å; M168-V191 HydrophobicContact CG-CG2 4.32Å; V188-V191 HydrophobicContact CG1-CG2 3.95Å; V191-I193 HydrophobicContact CG1-CD1 4.22Å; V191-I193 HydrophobicContact CG1-CG1 3.92Å; V191-A200 HydrophobicContact CG1-CB 4.25Å; V191-F201 CarbonylContact C-O 3.53Å; V191-F201 WeakPolarHBondContact CA-O 3.29Å; V191-L202 HydrophobicContact CG1-CD1 4.12Å; V191-L202 HydrophobicContact CG2-CG 4.27Å
192	Q	92.8	Very high	88.6	Confident	98 Å²	98	61.1 Å²	61.1	46%	0.458	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	112.3	175.8	-61.8	-171.2	-55.1	0	0	108.8	E164 A200 F201	E164-Q192 VanDerWaalsContact OE1-CA 3.28Å; E164-Q192 WeakPolarHBondContact OE1-CA 3.32Å; Q192-A200 CarbonylContact O-C 3.5Å; Q192-A200 VanDerWaalsContact O-CA 3.25Å; Q192-A200 WeakPolarHBondContact O-CA 3.49Å; Q192-F201 HydrophobicContact CB-CB 4.47Å; Q192-F201 PolarHBondContact N-O 2.83Å; Q192-F201 PolarHBondContact O-N 2.85Å
193	I	93.4	Very high	89.3	Confident	29 Å²	29	56.2 Å²	56.2	15%	0.149	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	127.5	-172.6	-67.1	173.7	0	0	0	111.7	I158 I162 E164 V191 Q195 A200	I158-I193 HydrophobicContact CD1-CG2 3.68Å; I162-I193 HydrophobicContact CG2-CD1 4.19Å; E164-I193 HydrophobicContact CB-CD1 4.31Å; E164-I193 HydrophobicContact CG-CB 4.09Å; E164-I193 HydrophobicContact CG-CD1 3.61Å; E164-I193 HydrophobicContact CG-CG1 3.71Å; E164-I193 PolarHBondContact OE1-N 2.82Å; V191-I193 HydrophobicContact CG1-CD1 4.22Å; V191-I193 HydrophobicContact CG1-CG1 3.92Å; I193-Q195 HydrophobicContact CG2-CG 3.81Å; I193-A200 HydrophobicContact CG1-CB 3.84Å
194	N	91.3	Very high	89.9	Confident	46 Å²	46	54 Å²	54	25%	0.246	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	99	166.4	-172.6	-90.3	0	0	0	109.4	K197 N198 F199	N194-K197 VanDerWaalsContact OD1-CB 3.23Å; N194-K197 WeakPolarHBondContact OD1-CB 3.47Å; N194-K197 WeakPolarHBondContact OD1-CG 3.36Å; N194-K197 PolarHBondContact OD1-N 3.47Å; N194-N198 PolarHBondContact O-N 3.49Å; N194-F199 HydrophobicContact CB-CD1 4.45Å; N194-F199 HydrophobicContact CB-CD2 4.03Å; N194-F199 HydrophobicContact CB-CE1 4.13Å; N194-F199 HydrophobicContact CB-CE2 3.63Å; N194-F199 HydrophobicContact CB-CG 4.4Å; N194-F199 HydrophobicContact CB-CZ 3.69Å; N194-F199 PolarHBondContact N-O 3.24Å; N194-F199 PolarHBondContact O-N 2.95Å
195	Q	86.1	Confident	90.4	Very high	104 Å²	104	50.7 Å²	50.7	49%	0.486	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-68.2	-35.7	-178.2	-60.2	-173.1	10.2	0	0	111.9	I193 K197 N198	I193-Q195 HydrophobicContact CG2-CG 3.81Å; Q195-K197 PolarHBondContact O-N 2.94Å; Q195-K197 VanDerWaalsContact O-N 3.13Å; Q195-N198 PolarHBondContact O-N 2.91Å; Q195-N198 PolarHBondContact O-OD1 3.43Å
196	D	84.5	Confident	90.5	Very high	144 Å²	144	50 Å²	50	77%	0.77	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-58.2	-30	-179	-44.5	-54.6	0	0	0	113.6
197	K	84.8	Confident	90.3	Very high	150 Å²	150	47.7 Å²	47.7	65%	0.652	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-121	10.7	-174.6	-59.7	174.3	-179.8	176.8	0	113.2	N194 Q195 F199	N194-K197 VanDerWaalsContact OD1-CB 3.23Å; N194-K197 WeakPolarHBondContact OD1-CB 3.47Å; N194-K197 WeakPolarHBondContact OD1-CG 3.36Å; N194-K197 PolarHBondContact OD1-N 3.47Å; Q195-K197 PolarHBondContact O-N 2.94Å; Q195-K197 VanDerWaalsContact O-N 3.13Å; K197-F199 VanDerWaalsContact C-N 3.33Å; K197-F199 HydrophobicContact CB-CD1 3.58Å; K197-F199 HydrophobicContact CB-CE1 3.53Å; K197-F199 HydrophobicContact CD-CE1 3.8Å; K197-F199 HydrophobicContact CG-CE1 4.28Å; K197-F199 PolarHBondContact O-N 2.93Å
198	N	89	Confident	90.2	Very high	70 Å²	70	50.1 Å²	50.1	37%	0.374	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.5	49.6	178.9	-61.7	-49.8	0	0	0	113.8	N157 I158 N194 Q195	N157-N198 PolarHBondContact N-O 3.27Å; I158-N198 HydrophobicContact CG1-CB 4.2Å; I158-N198 PolarHBondContact N-O 2.73Å; N194-N198 PolarHBondContact O-N 3.49Å; Q195-N198 PolarHBondContact O-N 2.91Å; Q195-N198 PolarHBondContact O-OD1 3.43Å
199	F	93.3	Very high	89.9	Confident	38 Å²	38	50.1 Å²	50.1	17%	0.167	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	159.1	171	72.3	-108.1	0	0	0	113.1	Y154 V155 N194 K197 F201	Y154-F199 HydrophobicContact CD2-CB 4.44Å; Y154-F199 HydrophobicContact CD2-CD2 4.22Å; Y154-F199 HydrophobicContact CD2-CG 4.39Å; Y154-F199 HydrophobicContact CE2-CB 3.56Å; Y154-F199 AromaticContact CE2-CD1 3.98Å; Y154-F199 HydrophobicContact CE2-CD1 3.98Å; Y154-F199 AromaticContact CE2-CD2 3.73Å; Y154-F199 HydrophobicContact CE2-CD2 3.73Å; Y154-F199 HydrophobicContact CE2-CE2 4.43Å; Y154-F199 AromaticContact CE2-CG 3.5Å; Y154-F199 HydrophobicContact CE2-CG 3.5Å; Y154-F199 VanDerWaalsContact CE2-CG 3.5Å; Y154-F199 WeakPolarHBondContact OH-CB 3.28Å; V155-F199 CarbonylContact O-C 3.59Å; V155-F199 VanDerWaalsContact O-CA 3.26Å; V155-F199 WeakPolarHBondContact O-CA 3.47Å; N194-F199 HydrophobicContact CB-CD1 4.45Å; N194-F199 HydrophobicContact CB-CD2 4.03Å; N194-F199 HydrophobicContact CB-CE1 4.13Å; N194-F199 HydrophobicContact CB-CE2 3.63Å; N194-F199 HydrophobicContact CB-CG 4.4Å; N194-F199 HydrophobicContact CB-CZ 3.69Å; N194-F199 PolarHBondContact N-O 3.24Å; N194-F199 PolarHBondContact O-N 2.95Å; K197-F199 VanDerWaalsContact C-N 3.33Å; K197-F199 HydrophobicContact CB-CD1 3.58Å; K197-F199 HydrophobicContact CB-CE1 3.53Å; K197-F199 HydrophobicContact CD-CE1 3.8Å; K197-F199 HydrophobicContact CG-CE1 4.28Å; K197-F199 PolarHBondContact O-N 2.93Å; F199-F201 HydrophobicContact CD2-CD2 4.46Å; F199-F201 HydrophobicContact CD2-CE2 4.25Å; F199-F201 HydrophobicContact CE2-CD2 4.09Å; F199-F201 AromaticContact CE2-CE2 3.65Å; F199-F201 HydrophobicContact CE2-CE2 3.65Å; F199-F201 HydrophobicContact CE2-CZ 4.42Å
200	A	94.3	Very high	89.9	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	156.6	173.4	0	0	0	0	0	111.2	V155 M167 V191 Q192 I193 L202	V155-A200 HydrophobicContact CB-CB 4.48Å; V155-A200 PolarHBondContact N-O 2.82Å; V155-A200 PolarHBondContact O-N 3.3Å; M167-A200 HydrophobicContact SD-CB 3.65Å; V191-A200 HydrophobicContact CG1-CB 4.25Å; Q192-A200 CarbonylContact O-C 3.5Å; Q192-A200 VanDerWaalsContact O-CA 3.25Å; Q192-A200 WeakPolarHBondContact O-CA 3.49Å; I193-A200 HydrophobicContact CG1-CB 3.84Å; A200-L202 HydrophobicContact CB-CD1 4.13Å
201	F	94.8	Very high	89.9	Confident	49 Å²	49	43.8 Å²	43.8	22%	0.215	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	130	159.5	-71.9	-75.2	0	0	0	109.8	L153 Y154 V191 Q192 F199 P231	L153-F201 CarbonylContact O-C 3.49Å; L153-F201 VanDerWaalsContact O-CA 3.3Å; L153-F201 WeakPolarHBondContact O-CA 3.48Å; Y154-F201 AromaticContact CD2-CE1 3.89Å; Y154-F201 HydrophobicContact CD2-CE1 3.89Å; Y154-F201 HydrophobicContact CD2-CZ 4.03Å; Y154-F201 HydrophobicContact CG-CE1 4.46Å; V191-F201 CarbonylContact C-O 3.53Å; V191-F201 WeakPolarHBondContact CA-O 3.29Å; Q192-F201 HydrophobicContact CB-CB 4.47Å; Q192-F201 PolarHBondContact N-O 2.83Å; Q192-F201 PolarHBondContact O-N 2.85Å; F199-F201 HydrophobicContact CD2-CD2 4.46Å; F199-F201 HydrophobicContact CD2-CE2 4.25Å; F199-F201 HydrophobicContact CE2-CD2 4.09Å; F199-F201 AromaticContact CE2-CE2 3.65Å; F199-F201 HydrophobicContact CE2-CE2 3.65Å; F199-F201 HydrophobicContact CE2-CZ 4.42Å; F201-P231 HydrophobicContact CD1-CG 4.32Å; F201-P231 HydrophobicContact CE1-CB 4.09Å; F201-P231 HydrophobicContact CE1-CG 4.21Å
202	L	94.8	Very high	89.6	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	137.4	171.7	-78.6	60.8	0	0	0	108.4	R152 L153 V155 M167 F171 V191 A200 F204	R152-L202 CarbonylContact C-O 3.53Å; R152-L202 WeakPolarHBondContact CA-O 3.25Å; L153-L202 PolarHBondContact N-O 2.9Å; L153-L202 PolarHBondContact O-N 2.82Å; V155-L202 HydrophobicContact CB-CD1 4.15Å; V155-L202 HydrophobicContact CG2-CD1 3.65Å; V155-L202 HydrophobicContact CG2-CD2 4.3Å; M167-L202 HydrophobicContact SD-CD1 4.04Å; F171-L202 HydrophobicContact CB-CD2 4.14Å; F171-L202 HydrophobicContact CD1-CD2 4.04Å; F171-L202 HydrophobicContact CD2-CD2 3.59Å; F171-L202 HydrophobicContact CE1-CD2 4.35Å; F171-L202 HydrophobicContact CE2-CD2 3.92Å; F171-L202 HydrophobicContact CG-CD2 3.64Å; F171-L202 HydrophobicContact CZ-CD2 4.28Å; V191-L202 HydrophobicContact CG1-CD1 4.12Å; V191-L202 HydrophobicContact CG2-CG 4.27Å; A200-L202 HydrophobicContact CB-CD1 4.13Å; L202-F204 HydrophobicContact CB-CD2 4.42Å; L202-F204 HydrophobicContact CB-CE2 3.75Å; L202-F204 HydrophobicContact CB-CZ 4.42Å; L202-F204 HydrophobicContact CD2-CE2 4.25Å; L202-F204 HydrophobicContact CD2-CZ 4.12Å
203	E	91.8	Very high	89.5	Confident	25 Å²	25	40.1 Å²	40.1	12%	0.117	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	125.1	168.8	-173.6	172.1	160.5	0	0	110	R148 R151 R152 L189 A190	R148-E203 IonicContact CZ-OE2 3.54Å; R148-E203 IonicContact NE-OE1 3.21Å; R148-E203 IonicContact NE-OE2 3.5Å; R148-E203 PolarHBondContact NE-OE2 2.9Å; R148-E203 IonicContact NH2-OE2 2.74Å; R148-E203 PolarHBondContact NH2-OE2 3.16Å; R151-E203 IonicContact CZ-OE1 3.9Å; R151-E203 IonicContact NH1-OE1 2.73Å; R151-E203 PolarHBondContact NH1-OE1 3.39Å; R151-E203 IonicContact NH2-OE1 3.8Å; R151-E203 PolarHBondContact NH2-OE1 3.42Å; R151-E203 WeakPolarHBondContact O-CA 3.5Å; R152-E203 HydrophobicContact CG-CB 3.97Å; R152-E203 HydrophobicContact CG-CG 4.03Å; L189-E203 PolarHBondContact N-O 3.15Å; A190-E203 HydrophobicContact CB-CB 4.28Å; A190-E203 PolarHBondContact N-O 2.98Å; A190-E203 PolarHBondContact O-N 2.76Å
204	F	92.1	Very high	89.4	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	163.5	179.8	-65.8	-104.5	0	0	0	111.2	R151 L153 M175 P187 V188 L202 E209 T210 A213	R151-F204 WeakPolarHBondContact CB-O 3.21Å; R151-F204 WeakPolarHBondContact CD-O 3.47Å; R151-F204 PolarHBondContact NH1-O 2.81Å; R151-F204 PolarHBondContact O-N 2.67Å; L153-F204 HydrophobicContact CB-CE2 4.3Å; L153-F204 HydrophobicContact CD1-CE2 3.71Å; L153-F204 HydrophobicContact CD1-CZ 4.01Å; L153-F204 HydrophobicContact CG-CE2 3.9Å; M175-F204 HydrophobicContact CE-CE1 4.46Å; P187-F204 HydrophobicContact CB-CD1 4.31Å; P187-F204 CarbonylContact O-C 3.53Å; P187-F204 WeakPolarHBondContact O-CA 3.23Å; V188-F204 HydrophobicContact CG2-CD1 4.03Å; V188-F204 HydrophobicContact CG2-CE1 3.62Å; V188-F204 HydrophobicContact CG2-CZ 3.97Å; L202-F204 HydrophobicContact CB-CD2 4.42Å; L202-F204 HydrophobicContact CB-CE2 3.75Å; L202-F204 HydrophobicContact CB-CZ 4.42Å; L202-F204 HydrophobicContact CD2-CE2 4.25Å; L202-F204 HydrophobicContact CD2-CZ 4.12Å; F204-E209 HydrophobicContact CD1-CB 4.39Å; F204-T210 WeakPolarHBondContact CB-OG1 3.35Å; F204-T210 HydrophobicContact CD2-CG2 3.99Å; F204-T210 HydrophobicContact CE2-CG2 4.45Å; F204-A213 HydrophobicContact CE1-CB 3.61Å; F204-A213 HydrophobicContact CE2-CB 4.26Å; F204-A213 HydrophobicContact CZ-CB 3.4Å
205	R	88	Confident	89.2	Confident	59 Å²	59	39 Å²	39	22%	0.223	19%	0.192	C	C	.	.	S	Bend	trans	-74.6	-30	173.5	66.1	-175.4	175.5	-175.4	-5.6	113.9	R151 A183 P184 N186 P187 L189 E209	R151-R205 VanDerWaalsContact CD-O 3.25Å; R151-R205 WeakPolarHBondContact CD-O 3.13Å; A183-R205 PolarHBondContact O-NH1 3.14Å; A183-R205 PolarHBondContact O-NH2 3.16Å; P184-R205 PolarHBondContact O-NH1 2.65Å; N186-R205 WeakPolarHBondContact O-CD 3.43Å; P187-R205 PolarHBondContact O-N 2.85Å; L189-R205 HydrophobicContact CD1-CB 3.75Å; L189-R205 HydrophobicContact CD2-CB 4.11Å; L189-R205 HydrophobicContact CG-CB 3.91Å; R205-E209 WeakPolarHBondContact CG-OE2 3.19Å; R205-E209 IonicContact CZ-OE1 2.61Å; R205-E209 IonicContact CZ-OE2 3.73Å; R205-E209 IonicContact NE-OE1 2.76Å; R205-E209 PolarHBondContact NE-OE1 2.85Å; R205-E209 IonicContact NE-OE2 3.51Å; R205-E209 PolarHBondContact NE-OE2 3.47Å; R205-E209 IonicContact NH2-OE1 3.82Å; R205-E209 PolarHBondContact NH2-OE1 2.87Å; R205-E209 IonicContact NH2-OE2 2.67Å
206	S	85.6	Confident	89.4	Confident	30 Å²	30	34.1 Å²	34.1	21%	0.21	17%	0.169	C	C	.	.			trans	-129.8	148.7	-179	-176.8	0	0	0	0	112.6	D208 T210	S206-D208 PolarHBondContact OG-N 2.87Å; S206-D208 PolarHBondContact OG-OD2 3.14Å; S206-T210 PolarHBondContact O-N 2.75Å; S206-T210 VanDerWaalsContact O-N 3.11Å; S206-T210 PolarHBondContact O-OG1 2.95Å
207	V	84.3	Confident	89.7	Confident	11 Å²	11	27.6 Å²	27.6	7%	0.067	13%	0.134	C	C	.	.	H	α-helix	trans	-67.4	-39.4	176.1	-177.7	0	0	0	0	110.5	A150 R151 E209 T210 T211 L237 M240	A150-V207 HydrophobicContact CB-CG1 3.99Å; A150-V207 HydrophobicContact CB-CG2 3.74Å; R151-V207 HydrophobicContact CG-CG2 3.66Å; V207-E209 VanDerWaalsContact C-N 3.35Å; V207-E209 PolarHBondContact O-N 2.99Å; V207-T210 CarbonylContact O-C 3.51Å; V207-T210 WeakPolarHBondContact O-CA 3.47Å; V207-T210 WeakPolarHBondContact O-CB 3.23Å; V207-T210 PolarHBondContact O-N 3.43Å; V207-T210 VanDerWaalsContact O-N 3.07Å; V207-T211 PolarHBondContact O-N 3.11Å; V207-T211 PolarHBondContact O-OG1 3.07Å; V207-L237 HydrophobicContact CG1-CD1 4.21Å; V207-L237 HydrophobicContact CG2-CD1 4.2Å; V207-M240 HydrophobicContact CB-CE 4.3Å; V207-M240 HydrophobicContact CB-SD 4.03Å; V207-M240 HydrophobicContact CG1-SD 3.62Å
208	D	85	Confident	89.9	Confident	52 Å²	52	20.7 Å²	20.7	28%	0.278	11%	0.106	S	C	.	.	H	α-helix	trans	-60.9	-43.6	177.5	-57.4	-89.5	0	0	0	111.8	S206 T210 T211 Q212 M240	S206-D208 PolarHBondContact OG-N 2.87Å; S206-D208 PolarHBondContact OG-OD2 3.14Å; D208-T210 VanDerWaalsContact C-N 3.28Å; D208-T210 PolarHBondContact O-N 2.83Å; D208-T211 WeakPolarHBondContact O-CB 3.28Å; D208-T211 PolarHBondContact O-N 3.1Å; D208-T211 VanDerWaalsContact O-N 3.13Å; D208-Q212 WeakPolarHBondContact O-CG 3.42Å; D208-Q212 PolarHBondContact O-N 3.24Å; D208-M240 WeakPolarHBondContact OD1-CE 3.41Å; D208-M240 VanDerWaalsContact OD2-CE 3.3Å; D208-M240 WeakPolarHBondContact OD2-CE 2.99Å
209	E	88.5	Confident	90	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.005	9%	0.091	C	C	.	.	H	α-helix	trans	-65.8	-33	174.9	-68.8	-177.4	140.7	0	0	111.8	M175 T181 Q182 F204 R205 V207 A213	M175-E209 HydrophobicContact CE-CB 3.68Å; M175-E209 HydrophobicContact CE-CG 4.07Å; M175-E209 WeakPolarHBondContact CE-O 3.29Å; T181-E209 WeakPolarHBondContact CA-OE1 3.5Å; Q182-E209 HydrophobicContact CB-CG 4.27Å; Q182-E209 HydrophobicContact CG-CG 3.88Å; Q182-E209 PolarHBondContact N-OE1 3.01Å; F204-E209 HydrophobicContact CD1-CB 4.39Å; R205-E209 WeakPolarHBondContact CG-OE2 3.19Å; R205-E209 IonicContact CZ-OE1 2.61Å; R205-E209 IonicContact CZ-OE2 3.73Å; R205-E209 IonicContact NE-OE1 2.76Å; R205-E209 PolarHBondContact NE-OE1 2.85Å; R205-E209 IonicContact NE-OE2 3.51Å; R205-E209 PolarHBondContact NE-OE2 3.47Å; R205-E209 IonicContact NH2-OE1 3.82Å; R205-E209 PolarHBondContact NH2-OE1 2.87Å; R205-E209 IonicContact NH2-OE2 2.67Å; V207-E209 VanDerWaalsContact C-N 3.35Å; V207-E209 PolarHBondContact O-N 2.99Å; E209-A213 VanDerWaalsContact O-CB 3.27Å; E209-A213 WeakPolarHBondContact O-CB 3.39Å; E209-A213 PolarHBondContact O-N 2.96Å
210	T	90.1	Very high	89.9	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-65.7	-38.8	171.6	-45.7	0	0	0	0	111.3	R151 L153 F204 S206 V207 D208	R151-T210 WeakPolarHBondContact CA-OG1 3.23Å; R151-T210 PolarHBondContact O-OG1 3.07Å; L153-T210 HydrophobicContact CD1-CG2 4.37Å; L153-T210 HydrophobicContact CD2-CG2 3.69Å; L153-T210 HydrophobicContact CG-CG2 3.61Å; F204-T210 WeakPolarHBondContact CB-OG1 3.35Å; F204-T210 HydrophobicContact CD2-CG2 3.99Å; F204-T210 HydrophobicContact CE2-CG2 4.45Å; S206-T210 PolarHBondContact O-N 2.75Å; S206-T210 VanDerWaalsContact O-N 3.11Å; S206-T210 PolarHBondContact O-OG1 2.95Å; V207-T210 CarbonylContact O-C 3.51Å; V207-T210 WeakPolarHBondContact O-CA 3.47Å; V207-T210 WeakPolarHBondContact O-CB 3.23Å; V207-T210 PolarHBondContact O-N 3.43Å; V207-T210 VanDerWaalsContact O-N 3.07Å; D208-T210 VanDerWaalsContact C-N 3.28Å; D208-T210 PolarHBondContact O-N 2.83Å
211	T	88.7	Confident	89.7	Confident	5 Å²	5	22 Å²	22	3%	0.031	11%	0.112	C	C	.	.	H	α-helix	trans	-67	-47.2	175	-59.3	0	0	0	0	111.5	V207 D208 A213 M214 R230 S241 N243	V207-T211 PolarHBondContact O-N 3.11Å; V207-T211 PolarHBondContact O-OG1 3.07Å; D208-T211 WeakPolarHBondContact O-CB 3.28Å; D208-T211 PolarHBondContact O-N 3.1Å; D208-T211 VanDerWaalsContact O-N 3.13Å; T211-A213 VanDerWaalsContact C-N 3.32Å; T211-A213 PolarHBondContact O-N 3.27Å; T211-M214 VanDerWaalsContact O-CB 3.28Å; T211-M214 WeakPolarHBondContact O-CB 3.17Å; T211-M214 PolarHBondContact O-N 3.04Å; T211-R230 PolarHBondContact OG1-NH2 3.34Å; T211-S241 VanDerWaalsContact CG2-O 3.23Å; T211-S241 WeakPolarHBondContact CG2-O 3.26Å; T211-N243 WeakPolarHBondContact CG2-O 3.38Å
212	Q	88.6	Confident	89.4	Confident	29 Å²	29	25.5 Å²	25.5	14%	0.136	13%	0.129	C	C	.	.	H	α-helix	trans	-67.9	-32.4	179.4	-59.3	-57.9	-10.3	0	0	112.1	L180 D208 M214 A215 S245	L180-Q212 HydrophobicContact CB-CB 4.2Å; L180-Q212 HydrophobicContact CD1-CB 4.17Å; L180-Q212 HydrophobicContact CD2-CB 4.24Å; L180-Q212 HydrophobicContact CG-CB 4.43Å; D208-Q212 WeakPolarHBondContact O-CG 3.42Å; D208-Q212 PolarHBondContact O-N 3.24Å; Q212-M214 PolarHBondContact O-N 2.8Å; Q212-A215 WeakPolarHBondContact O-CB 3.2Å; Q212-A215 PolarHBondContact O-N 3.18Å; Q212-S245 PolarHBondContact NE2-OG 3.22Å; Q212-S245 VanDerWaalsContact OE1-N 3.17Å; Q212-S245 PolarHBondContact OE1-OG 3.03Å
213	A	91.1	Very high	88.9	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-64.3	-16.1	174.4	0	0	0	0	0	114.3	L153 M175 F204 E209 T211 A215 F216	L153-A213 HydrophobicContact CD1-CB 3.7Å; M175-A213 HydrophobicContact SD-CB 3.9Å; F204-A213 HydrophobicContact CE1-CB 3.61Å; F204-A213 HydrophobicContact CE2-CB 4.26Å; F204-A213 HydrophobicContact CZ-CB 3.4Å; E209-A213 VanDerWaalsContact O-CB 3.27Å; E209-A213 WeakPolarHBondContact O-CB 3.39Å; E209-A213 PolarHBondContact O-N 2.96Å; T211-A213 VanDerWaalsContact C-N 3.32Å; T211-A213 PolarHBondContact O-N 3.27Å; A213-A215 PolarHBondContact O-N 3.17Å; A213-F216 HydrophobicContact CB-CD2 4.47Å; A213-F216 PolarHBondContact O-N 3.13Å
214	M	90.1	Very high	88.7	Confident	37 Å²	37	30.6 Å²	30.6	18%	0.182	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-63.3	-21.7	167.6	-69.3	-75.4	-59.3	0	0	112.7	L153 T211 Q212 F216 D217 I228 P244	L153-M214 HydrophobicContact CD2-CG 4.02Å; L153-M214 HydrophobicContact CD2-SD 3.54Å; L153-M214 VanDerWaalsContact CD2-SD 3.54Å; T211-M214 VanDerWaalsContact O-CB 3.28Å; T211-M214 WeakPolarHBondContact O-CB 3.17Å; T211-M214 PolarHBondContact O-N 3.04Å; Q212-M214 PolarHBondContact O-N 2.8Å; M214-F216 PolarHBondContact O-N 3.2Å; M214-D217 PolarHBondContact O-N 2.84Å; M214-D217 VanDerWaalsContact O-N 3.16Å; M214-I228 HydrophobicContact SD-CG2 4.04Å; M214-P244 HydrophobicContact CB-CG 4.28Å
215	A	87.4	Confident	88.5	Confident	14 Å²	14	31 Å²	31	12%	0.116	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-65.5	-15.1	175.5	0	0	0	0	0	113.3	Q212 A213 D217 P244 V246 V248 V251	Q212-A215 WeakPolarHBondContact O-CB 3.2Å; Q212-A215 PolarHBondContact O-N 3.18Å; A213-A215 PolarHBondContact O-N 3.17Å; A215-D217 VanDerWaalsContact C-N 3.31Å; A215-P244 HydrophobicContact CB-CB 3.78Å; A215-P244 HydrophobicContact CB-CG 4.13Å; A215-V246 WeakPolarHBondContact CB-O 3.32Å; A215-V248 HydrophobicContact CB-CG2 3.83Å; A215-V251 WeakPolarHBondContact O-CG1 3.27Å
216	F	90.9	Very high	88.8	Confident	1 Å²	1	28.2 Å²	28.2	0%	0.004	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-87.6	10.2	174.8	-60.6	-56.3	0	0	0	113.5	F171 Q174 M175 L180 A213 M214 G218 I219 I228 V248	F171-F216 HydrophobicContact CD1-CD2 4.41Å; F171-F216 HydrophobicContact CE1-CB 4.21Å; F171-F216 HydrophobicContact CE1-CD2 4.5Å; Q174-F216 HydrophobicContact CB-CE1 3.97Å; Q174-F216 HydrophobicContact CB-CE2 4.16Å; Q174-F216 HydrophobicContact CB-CZ 3.77Å; Q174-F216 WeakPolarHBondContact O-CZ 3.19Å; M175-F216 HydrophobicContact CG-CE2 3.96Å; M175-F216 HydrophobicContact SD-CE2 3.72Å; L180-F216 HydrophobicContact CD1-CE2 3.75Å; L180-F216 HydrophobicContact CD1-CZ 3.64Å; A213-F216 HydrophobicContact CB-CD2 4.47Å; A213-F216 PolarHBondContact O-N 3.13Å; M214-F216 PolarHBondContact O-N 3.2Å; F216-G218 PolarHBondContact O-N 3.31Å; F216-I219 HydrophobicContact CB-CB 4.17Å; F216-I219 HydrophobicContact CB-CD1 4.39Å; F216-I219 HydrophobicContact CB-CG2 4.07Å; F216-I219 HydrophobicContact CD1-CD1 3.78Å; F216-I219 HydrophobicContact CE1-CD1 4.41Å; F216-I219 HydrophobicContact CG-CD1 4.29Å; F216-I219 VanDerWaalsContact O-CB 3.24Å; F216-I219 WeakPolarHBondContact O-CB 3.18Å; F216-I219 WeakPolarHBondContact O-CG2 3.24Å; F216-I219 PolarHBondContact O-N 2.94Å; F216-I228 VanDerWaalsContact C-CD1 3.47Å; F216-I228 HydrophobicContact CB-CD1 3.75Å; F216-I228 VanDerWaalsContact O-CD1 3.3Å; F216-I228 WeakPolarHBondContact O-CD1 3.22Å; F216-V248 HydrophobicContact CD1-CB 4.5Å; F216-V248 HydrophobicContact CD1-CG1 4.23Å; F216-V248 HydrophobicContact CD1-CG2 4.04Å; F216-V248 HydrophobicContact CE1-CB 4.4Å; F216-V248 HydrophobicContact CE1-CG1 3.92Å; F216-V248 HydrophobicContact CE1-CG2 3.76Å; F216-V248 HydrophobicContact CZ-CG2 4.47Å
217	D	91.2	Very high	89	Confident	7 Å²	7	29.9 Å²	29.9	4%	0.037	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	121.7	173.7	-175.1	40.5	0	0	0	111.2	M214 A215 K227 I228 R229 V251 V252 S253 T254 V255	M214-D217 PolarHBondContact O-N 2.84Å; M214-D217 VanDerWaalsContact O-N 3.16Å; A215-D217 VanDerWaalsContact C-N 3.31Å; D217-K227 WeakPolarHBondContact OD1-CA 3.46Å; D217-I228 HydrophobicContact CB-CB 4.13Å; D217-I228 PolarHBondContact OD1-N 3.2Å; D217-R229 IonicContact OD1-CZ 2.69Å; D217-R229 IonicContact OD1-NH1 3.72Å; D217-R229 PolarHBondContact OD1-NH1 3.42Å; D217-R229 IonicContact OD2-CZ 4Å; D217-R229 IonicContact OD2-NH1 2.88Å; D217-R229 PolarHBondContact OD2-NH1 2.96Å; D217-R229 IonicContact OD2-NH2 2.83Å; D217-V251 WeakPolarHBondContact O-CG1 3.5Å; D217-V252 CarbonylContact O-C 3.59Å; D217-S253 WeakPolarHBondContact O-CA 3.3Å; D217-T254 VanDerWaalsContact CG-OG1 3.23Å; D217-T254 PolarHBondContact OD1-OG1 3.48Å; D217-T254 WeakPolarHBondContact OD2-CA 3.44Å; D217-T254 PolarHBondContact OD2-N 3.26Å; D217-T254 PolarHBondContact OD2-OG1 2.87Å; D217-V255 PolarHBondContact OD2-N 2.9Å
218	G	87.7	Confident	89.5	Confident	5 Å²	5	29.3 Å²	29.3	5%	0.052	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.8	2.5	-173.1	0	0	0	0	0	115.3	F216 S225 L226	F216-G218 PolarHBondContact O-N 3.31Å; G218-S225 WeakPolarHBondContact O-CB 3.27Å; G218-L226 VanDerWaalsContact CA-O 3.24Å; G218-L226 WeakPolarHBondContact CA-O 3.11Å; G218-L226 PolarHBondContact N-O 3.11Å
219	I	91.8	Very high	89.8	Confident	12 Å²	12	30.3 Å²	30.3	6%	0.062	16%	0.162	C	C	.	.			trans	-58.6	138.3	175.6	-163.8	171.5	0	0	0	111.1	F170 Q174 F216 S225 L226 V251	F170-I219 HydrophobicContact CE1-CD1 3.96Å; F170-I219 HydrophobicContact CE1-CG1 4.38Å; F170-I219 HydrophobicContact CE1-CG2 4.03Å; F170-I219 HydrophobicContact CZ-CD1 3.67Å; F170-I219 HydrophobicContact CZ-CG1 3.98Å; F170-I219 HydrophobicContact CZ-CG2 4.41Å; Q174-I219 HydrophobicContact CB-CD1 4.34Å; Q174-I219 HydrophobicContact CG-CD1 3.72Å; F216-I219 HydrophobicContact CB-CB 4.17Å; F216-I219 HydrophobicContact CB-CD1 4.39Å; F216-I219 HydrophobicContact CB-CG2 4.07Å; F216-I219 HydrophobicContact CD1-CD1 3.78Å; F216-I219 HydrophobicContact CE1-CD1 4.41Å; F216-I219 HydrophobicContact CG-CD1 4.29Å; F216-I219 VanDerWaalsContact O-CB 3.24Å; F216-I219 WeakPolarHBondContact O-CB 3.18Å; F216-I219 WeakPolarHBondContact O-CG2 3.24Å; F216-I219 PolarHBondContact O-N 2.94Å; I219-S225 WeakPolarHBondContact O-CA 3.31Å; I219-L226 HydrophobicContact CG2-CB 4.32Å; I219-L226 HydrophobicContact CG2-CD1 4.11Å; I219-L226 HydrophobicContact CG2-CG 4.41Å; I219-L226 PolarHBondContact O-N 3.14Å; I219-V251 HydrophobicContact CB-CG1 4.44Å; I219-V251 HydrophobicContact CB-CG2 4.21Å; I219-V251 HydrophobicContact CG1-CG2 4.11Å
220	I	90.1	Very high	89.8	Confident	107 Å²	107	32.2 Å²	32.2	55%	0.549	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	122.4	179.1	-58.9	172.4	0	0	0	109.4	F170 Q224	F170-I220 WeakPolarHBondContact CZ-O 3.36Å; I220-Q224 WeakPolarHBondContact CA-O 3.22Å
221	F	91.3	Very high	89.7	Confident	16 Å²	16	32.6 Å²	32.6	7%	0.07	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	122.4	174.3	-174.8	-133.9	0	0	0	109.6	P159 I162 M167 F170 G223 Q224 L226	P159-F221 HydrophobicContact CG-CD1 4.28Å; I162-F221 HydrophobicContact CD1-CD1 4.48Å; I162-F221 HydrophobicContact CD1-CE1 3.43Å; I162-F221 VanDerWaalsContact CD1-CE1 3.43Å; I162-F221 HydrophobicContact CD1-CZ 3.62Å; I162-F221 HydrophobicContact CG1-CE1 3.81Å; I162-F221 HydrophobicContact CG1-CZ 4.41Å; M167-F221 HydrophobicContact CB-CE1 4.27Å; M167-F221 HydrophobicContact CE-CD1 4.08Å; M167-F221 HydrophobicContact CE-CE1 3.85Å; F170-F221 HydrophobicContact CB-CD2 4.04Å; F170-F221 HydrophobicContact CB-CE2 3.48Å; F170-F221 VanDerWaalsContact CB-CE2 3.48Å; F170-F221 HydrophobicContact CB-CZ 3.91Å; F170-F221 HydrophobicContact CD1-CB 4.38Å; F170-F221 AromaticContact CD1-CD2 3.62Å; F170-F221 HydrophobicContact CD1-CD2 3.62Å; F170-F221 AromaticContact CD1-CE2 3.95Å; F170-F221 HydrophobicContact CD1-CE2 3.95Å; F170-F221 AromaticContact CD1-CG 3.96Å; F170-F221 HydrophobicContact CD1-CG 3.96Å; F170-F221 AromaticContact CD2-CD2 3.44Å; F170-F221 HydrophobicContact CD2-CD2 3.44Å; F170-F221 VanDerWaalsContact CD2-CD2 3.44Å; F170-F221 AromaticContact CD2-CE2 3.63Å; F170-F221 HydrophobicContact CD2-CE2 3.63Å; F170-F221 HydrophobicContact CD2-CG 4.48Å; F170-F221 HydrophobicContact CE1-CB 3.88Å; F170-F221 AromaticContact CE1-CD2 3.83Å; F170-F221 HydrophobicContact CE1-CD2 3.83Å; F170-F221 AromaticContact CE1-CG 3.97Å; F170-F221 HydrophobicContact CE1-CG 3.97Å; F170-F221 AromaticContact CE2-CD2 3.65Å; F170-F221 HydrophobicContact CE2-CD2 3.65Å; F170-F221 HydrophobicContact CE2-CE2 4.31Å; F170-F221 HydrophobicContact CE2-CG 4.48Å; F170-F221 AromaticContact CG-CD2 3.41Å; F170-F221 HydrophobicContact CG-CD2 3.41Å; F170-F221 VanDerWaalsContact CG-CD2 3.41Å; F170-F221 AromaticContact CG-CE2 3.4Å; F170-F221 HydrophobicContact CG-CE2 3.4Å; F170-F221 VanDerWaalsContact CG-CE2 3.4Å; F170-F221 HydrophobicContact CG-CG 4.22Å; F170-F221 HydrophobicContact CG-CZ 4.17Å; F170-F221 HydrophobicContact CZ-CB 3.97Å; F170-F221 AromaticContact CZ-CD2 3.84Å; F170-F221 HydrophobicContact CZ-CD2 3.84Å; F170-F221 HydrophobicContact CZ-CG 4.23Å; F221-G223 PolarHBondContact O-N 3.2Å; F221-G223 VanDerWaalsContact O-N 3.08Å; F221-Q224 PolarHBondContact N-O 3.47Å; F221-Q224 PolarHBondContact O-N 3.07Å; F221-L226 HydrophobicContact CB-CD1 3.73Å; F221-L226 HydrophobicContact CB-CD2 4.21Å; F221-L226 HydrophobicContact CB-CG 3.89Å; F221-L226 HydrophobicContact CD1-CD1 4.1Å; F221-L226 HydrophobicContact CD1-CD2 4.4Å; F221-L226 HydrophobicContact CG-CD1 4.25Å
222	Q	87.9	Confident	89.4	Confident	123 Å²	123	41.9 Å²	41.9	58%	0.575	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.6	34.6	-173.6	-55.2	-174.8	-18.6	0	0	114.2	P159	P159-Q222 HydrophobicContact CB-CB 4.36Å; P159-Q222 HydrophobicContact CG-CB 4.12Å; P159-Q222 HydrophobicContact CG-CG 4.47Å
223	G	84.6	Confident	89	Confident	60 Å²	60	43.6 Å²	43.6	62%	0.619	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.2	3.6	-179.6	0	0	0	0	0	115.8	F221	F221-G223 PolarHBondContact O-N 3.2Å; F221-G223 VanDerWaalsContact O-N 3.08Å
224	Q	86.8	Confident	88.5	Confident	73 Å²	73	45 Å²	45	34%	0.341	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	138.1	171.8	-62.9	-165.9	3.6	0	0	111.6	N157 I158 I220 F221 L226	N157-Q224 PolarHBondContact O-OE1 3.41Å; I158-Q224 VanDerWaalsContact C-OE1 3.3Å; I158-Q224 PolarHBondContact O-OE1 3.17Å; I220-Q224 WeakPolarHBondContact CA-O 3.22Å; F221-Q224 PolarHBondContact N-O 3.47Å; F221-Q224 PolarHBondContact O-N 3.07Å; Q224-L226 PolarHBondContact O-N 3.16Å
225	S	89.4	Confident	87.6	Confident	10 Å²	10	50.1 Å²	50.1	7%	0.07	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	114.5	171.6	60.6	0	0	0	0	111.2	N157 G218 I219 K278	N157-S225 PolarHBondContact ND2-O 3.26Å; G218-S225 WeakPolarHBondContact O-CB 3.27Å; I219-S225 WeakPolarHBondContact O-CA 3.31Å; S225-K278 PolarHBondContact OG-NZ 3.41Å
226	L	92.7	Very high	86.8	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.272	C	S	.	.			trans	-71.2	147.9	-178.2	-58.5	-177.9	0	0	0	112	V155 N157 I158 F170 F171 G218 I219 F221 Q224	V155-L226 HydrophobicContact CG1-CB 4.02Å; V155-L226 HydrophobicContact CG1-CD1 4.04Å; V155-L226 HydrophobicContact CG1-CD2 4.4Å; V155-L226 HydrophobicContact CG1-CG 4.39Å; N157-L226 WeakPolarHBondContact O-CD2 3.24Å; I158-L226 HydrophobicContact CG2-CD2 4.33Å; F170-L226 HydrophobicContact CE1-CD1 4.46Å; F171-L226 HydrophobicContact CE2-CD1 3.72Å; F171-L226 HydrophobicContact CZ-CD1 3.69Å; G218-L226 VanDerWaalsContact CA-O 3.24Å; G218-L226 WeakPolarHBondContact CA-O 3.11Å; G218-L226 PolarHBondContact N-O 3.11Å; I219-L226 HydrophobicContact CG2-CB 4.32Å; I219-L226 HydrophobicContact CG2-CD1 4.11Å; I219-L226 HydrophobicContact CG2-CG 4.41Å; I219-L226 PolarHBondContact O-N 3.14Å; F221-L226 HydrophobicContact CB-CD1 3.73Å; F221-L226 HydrophobicContact CB-CD2 4.21Å; F221-L226 HydrophobicContact CB-CG 3.89Å; F221-L226 HydrophobicContact CD1-CD1 4.1Å; F221-L226 HydrophobicContact CD1-CD2 4.4Å; F221-L226 HydrophobicContact CG-CD1 4.25Å; Q224-L226 PolarHBondContact O-N 3.16Å
227	K	91.2	Very high	85.7	Confident	64 Å²	64	56.1 Å²	56.1	28%	0.278	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	103.6	179.6	-66.8	-176.2	178.7	178.5	0	111.2	V155 G156 N157 D217 T254	V155-K227 WeakPolarHBondContact CA-O 3.24Å; G156-K227 PolarHBondContact N-O 3.33Å; G156-K227 PolarHBondContact O-N 3.24Å; N157-K227 HydrophobicContact CB-CD 4.14Å; N157-K227 HydrophobicContact CB-CG 4.07Å; D217-K227 WeakPolarHBondContact OD1-CA 3.46Å; K227-T254 HydrophobicContact CG-CG2 4.16Å
228	I	93.8	Very high	84.3	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	124.9	-170.1	-52.2	-169.4	0	0	0	111.1	L153 Y154 V155 F171 M214 F216 D217	L153-I228 HydrophobicContact CB-CG2 4.36Å; L153-I228 HydrophobicContact CD1-CG2 3.7Å; L153-I228 HydrophobicContact CG-CG2 4.41Å; Y154-I228 CarbonylContact O-C 3.59Å; Y154-I228 WeakPolarHBondContact O-CA 3.46Å; V155-I228 HydrophobicContact CG2-CG1 4.18Å; V155-I228 HydrophobicContact CG2-CG2 4.4Å; F171-I228 HydrophobicContact CE1-CD1 3.55Å; F171-I228 HydrophobicContact CZ-CD1 3.7Å; M214-I228 HydrophobicContact SD-CG2 4.04Å; F216-I228 VanDerWaalsContact C-CD1 3.47Å; F216-I228 HydrophobicContact CB-CD1 3.75Å; F216-I228 VanDerWaalsContact O-CD1 3.3Å; F216-I228 WeakPolarHBondContact O-CD1 3.22Å; D217-I228 HydrophobicContact CB-CB 4.13Å; D217-I228 PolarHBondContact OD1-N 3.2Å
229	R	91.4	Very high	83.1	Confident	73 Å²	73	65.9 Å²	65.9	28%	0.275	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	162.2	-178	-60.2	-66.5	179.2	-87.1	-2.7	111.3	Y154 D217 T254 V255	Y154-R229 HydrophobicContact CD1-CB 4.25Å; Y154-R229 PolarHBondContact N-O 3.11Å; Y154-R229 PolarHBondContact O-N 2.7Å; D217-R229 IonicContact OD1-CZ 2.69Å; D217-R229 IonicContact OD1-NH1 3.72Å; D217-R229 PolarHBondContact OD1-NH1 3.42Å; D217-R229 IonicContact OD2-CZ 4Å; D217-R229 IonicContact OD2-NH1 2.88Å; D217-R229 PolarHBondContact OD2-NH1 2.96Å; D217-R229 IonicContact OD2-NH2 2.83Å; R229-T254 PolarHBondContact NH1-OG1 3.22Å; R229-T254 PolarHBondContact NH2-OG1 3.41Å; R229-V255 VanDerWaalsContact NH2-CG2 3.27Å
230	R	89.9	Confident	81.7	Confident	40 Å²	40	68 Å²	68	15%	0.151	38%	0.375	C	S	.	.			trans	-65.2	143.4	160.1	-64.8	-63.4	-177.5	169	0.7	109.8	A150 T211 Y234	A150-R230 PolarHBondContact O-NH1 3.15Å; T211-R230 PolarHBondContact OG1-NH2 3.34Å; R230-Y234 HydrophobicContact CB-CD1 3.92Å; R230-Y234 HydrophobicContact CB-CG 3.9Å; R230-Y234 HydrophobicContact CG-CD1 3.89Å; R230-Y234 HydrophobicContact CG-CD2 4.41Å; R230-Y234 HydrophobicContact CG-CE1 4.02Å; R230-Y234 HydrophobicContact CG-CG 4.1Å
231	P	87.4	Confident	80.5	Confident	8 Å²	8	66.5 Å²	66.5	5%	0.052	37%	0.374	C	S	.	.			trans	-56.8	156	169.2	-25.9	35.9	0	0	0	112.4	R152 F201 D233 Y234	R152-P231 HydrophobicContact CB-CG 3.88Å; R152-P231 WeakPolarHBondContact O-CD 3.39Å; F201-P231 HydrophobicContact CD1-CG 4.32Å; F201-P231 HydrophobicContact CE1-CB 4.09Å; F201-P231 HydrophobicContact CE1-CG 4.21Å; P231-D233 WeakPolarHBondContact CB-OD1 3.36Å; P231-D233 PolarHBondContact O-N 2.85Å; P231-Y234 WeakPolarHBondContact O-CB 3.22Å; P231-Y234 PolarHBondContact O-N 3.32Å; P231-Y234 VanDerWaalsContact O-N 3.16Å
232	H	81.5	Confident	79.4	Confident	201 Å²	201	70.5 Å²	70.5	93%	0.931	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-21.1	180	-168.9	60.9	0	0	0	113.3
233	D	80.4	Confident	78.8	Confident	64 Å²	64	70.8 Å²	70.8	34%	0.342	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	6	175.9	64.5	-55.5	0	0	0	113.8	Q149 R152 P231	Q149-D233 WeakPolarHBondContact CG-OD2 3.49Å; Q149-D233 PolarHBondContact NE2-O 2.92Å; Q149-D233 VanDerWaalsContact NE2-O 3.17Å; Q149-D233 PolarHBondContact NE2-OD2 2.76Å; R152-D233 IonicContact NH1-OD1 3.11Å; R152-D233 IonicContact NH1-OD2 3.82Å; P231-D233 WeakPolarHBondContact CB-OD1 3.36Å; P231-D233 PolarHBondContact O-N 2.85Å
234	Y	81.8	Confident	78.3	Confident	30 Å²	30	70 Å²	70	12%	0.118	38%	0.383	C	S	.	.			trans	-71.5	135.9	177.9	173	-95.4	0	0	0	112.4	A150 R230 P231 P236 E242	A150-Y234 HydrophobicContact CB-CE2 4.13Å; R230-Y234 HydrophobicContact CB-CD1 3.92Å; R230-Y234 HydrophobicContact CB-CG 3.9Å; R230-Y234 HydrophobicContact CG-CD1 3.89Å; R230-Y234 HydrophobicContact CG-CD2 4.41Å; R230-Y234 HydrophobicContact CG-CE1 4.02Å; R230-Y234 HydrophobicContact CG-CG 4.1Å; P231-Y234 WeakPolarHBondContact O-CB 3.22Å; P231-Y234 PolarHBondContact O-N 3.32Å; P231-Y234 VanDerWaalsContact O-N 3.16Å; Y234-P236 HydrophobicContact CE1-CB 4.17Å; Y234-E242 WeakPolarHBondContact CE1-OE1 3.3Å
235	Q	71.4	Confident	77.3	Confident	144 Å²	144	71.1 Å²	71.1	67%	0.673	40%	0.399	S	S	*	.			trans	-117.3	129.3	171.3	-62.2	-177.2	1.5	0	0	109.3	L237	Q235-L237 PolarHBondContact O-N 2.91Å
236	P	69.1	Low	76.4	Confident	78 Å²	78	73.6 Å²	73.6	51%	0.506	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-67.9	130.8	-179.4	26.3	-33.4	0	0	0	111.7	Y234 E242	Y234-P236 HydrophobicContact CE1-CB 4.17Å; P236-E242 HydrophobicContact CB-CG 4.3Å
237	L	69.1	Low	75.3	Confident	63 Å²	63	78.6 Å²	78.6	33%	0.33	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-79.6	125.5	178	-65.4	-179.4	0	0	0	110.7	A150 V207 Q235 G239 M240	A150-L237 HydrophobicContact CB-CD1 3.94Å; A150-L237 HydrophobicContact CB-CG 4.25Å; V207-L237 HydrophobicContact CG1-CD1 4.21Å; V207-L237 HydrophobicContact CG2-CD1 4.2Å; Q235-L237 PolarHBondContact O-N 2.91Å; L237-G239 PolarHBondContact O-N 3.38Å; L237-G239 VanDerWaalsContact O-N 3.15Å; L237-M240 HydrophobicContact CB-SD 4.45Å; L237-M240 HydrophobicContact CD1-SD 4.06Å; L237-M240 PolarHBondContact O-N 3.28Å; L237-M240 VanDerWaalsContact O-N 3.15Å
238	P	61.7	Low	74.5	Confident	137 Å²	137	76.5 Å²	76.5	89%	0.89	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	119	-179.2	-26.6	35.1	0	0	0	112.8
239	G	61.5	Low	73.6	Confident	81 Å²	81	81.9 Å²	81.9	84%	0.835	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.1	-4.4	178.2	0	0	0	0	0	115.7	L237	L237-G239 PolarHBondContact O-N 3.38Å; L237-G239 VanDerWaalsContact O-N 3.15Å
240	M	63.6	Low	73	Confident	57 Å²	57	81.7 Å²	81.7	28%	0.281	48%	0.481	S	S	.	.	S	Bend	trans	-93.1	144.9	166.1	-80.2	-176	162	0	0	111.2	V207 D208 L237	V207-M240 HydrophobicContact CB-CE 4.3Å; V207-M240 HydrophobicContact CB-SD 4.03Å; V207-M240 HydrophobicContact CG1-SD 3.62Å; D208-M240 WeakPolarHBondContact OD1-CE 3.41Å; D208-M240 VanDerWaalsContact OD2-CE 3.3Å; D208-M240 WeakPolarHBondContact OD2-CE 2.99Å; L237-M240 HydrophobicContact CB-SD 4.45Å; L237-M240 HydrophobicContact CD1-SD 4.06Å; L237-M240 PolarHBondContact O-N 3.28Å; L237-M240 VanDerWaalsContact O-N 3.15Å
241	S	63.9	Low	72.6	Confident	75 Å²	75	80.5 Å²	80.5	52%	0.524	48%	0.478	S	S	.	.			trans	-77.4	131.4	170.7	53.4	0	0	0	0	110.7	T211	T211-S241 VanDerWaalsContact CG2-O 3.23Å; T211-S241 WeakPolarHBondContact CG2-O 3.26Å
242	E	69.3	Low	72.6	Confident	100 Å²	100	81.3 Å²	81.3	47%	0.467	48%	0.483	S	S	.	.	S	Bend	trans	-77.5	-29.6	176.8	-61.2	-168.1	88.2	0	0	113.2	Y234 P236	Y234-E242 WeakPolarHBondContact CE1-OE1 3.3Å; P236-E242 HydrophobicContact CB-CG 4.3Å
243	N	74.1	Confident	72.8	Confident	129 Å²	129	73.5 Å²	73.5	69%	0.69	45%	0.451	S	S	*	.	S	Bend	trans	-81.2	144.5	178.9	-63.3	-36.6	0	0	0	110.9	T211	T211-N243 WeakPolarHBondContact CG2-O 3.38Å
244	P	75.4	Confident	73.1	Confident	44 Å²	44	71 Å²	71	29%	0.286	44%	0.438	S	S	.	.			trans	-63.5	144.3	168.6	28.3	-33.7	0	0	0	110.5	M214 A215	M214-P244 HydrophobicContact CB-CG 4.28Å; A215-P244 HydrophobicContact CB-CB 3.78Å; A215-P244 HydrophobicContact CB-CG 4.13Å
245	S	65.5	Low	73.3	Confident	96 Å²	96	72.9 Å²	72.9	67%	0.671	45%	0.452	S	S	*	.	S	Bend	trans	-93.4	1.3	177.7	64.8	0	0	0	0	113.2	Q212	Q212-S245 PolarHBondContact NE2-OG 3.22Å; Q212-S245 VanDerWaalsContact OE1-N 3.17Å; Q212-S245 PolarHBondContact OE1-OG 3.03Å
246	V	69.8	Low	73.9	Confident	61 Å²	61	66.5 Å²	66.5	37%	0.37	42%	0.423	S	S	.	.			trans	-124.4	134.5	-176	-175.2	0	0	0	0	109.3	L180 A215	L180-V246 HydrophobicContact CD2-CB 4.1Å; L180-V246 HydrophobicContact CD2-CG1 4.15Å; L180-V246 HydrophobicContact CD2-CG2 3.91Å; A215-V246 WeakPolarHBondContact CB-O 3.32Å
247	Y	69.2	Low	74.5	Confident	105 Å²	105	65.8 Å²	65.8	41%	0.412	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-94	127.4	167	173.9	-104	0	0	0	109.2	P249 L287 V310	Y247-P249 WeakPolarHBondContact O-CD 3.22Å; Y247-L287 PolarHBondContact OH-O 3.07Å; Y247-V310 HydrophobicContact CE1-CG2 4.23Å; Y247-V310 HydrophobicContact CE2-CG2 4.29Å; Y247-V310 VanDerWaalsContact OH-CG2 3.29Å; Y247-V310 WeakPolarHBondContact OH-CG2 3.4Å
248	V	75.8	Confident	75	Confident	21 Å²	21	68.4 Å²	68.4	13%	0.127	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-93.1	116.7	178.8	179.1	0	0	0	0	109.1	A215 F216 G250 V251	A215-V248 HydrophobicContact CB-CG2 3.83Å; F216-V248 HydrophobicContact CD1-CB 4.5Å; F216-V248 HydrophobicContact CD1-CG1 4.23Å; F216-V248 HydrophobicContact CD1-CG2 4.04Å; F216-V248 HydrophobicContact CE1-CB 4.4Å; F216-V248 HydrophobicContact CE1-CG1 3.92Å; F216-V248 HydrophobicContact CE1-CG2 3.76Å; F216-V248 HydrophobicContact CZ-CG2 4.47Å; V248-G250 PolarHBondContact O-N 2.79Å; V248-V251 HydrophobicContact CB-CB 4.17Å; V248-V251 HydrophobicContact CB-CG2 3.99Å; V248-V251 HydrophobicContact CG1-CB 4.32Å; V248-V251 HydrophobicContact CG1-CG2 3.63Å; V248-V251 PolarHBondContact O-N 2.73Å; V248-V251 VanDerWaalsContact O-N 3.15Å
249	P	74.8	Confident	75.9	Confident	112 Å²	112	63.2 Å²	63.2	73%	0.727	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	131	179.9	-25.7	35.4	0	0	0	112.4	Y247 V251	Y247-P249 WeakPolarHBondContact O-CD 3.22Å; P249-V251 VanDerWaalsContact C-N 3.33Å
250	G	76.9	Confident	76.9	Confident	70 Å²	70	62.6 Å²	62.6	72%	0.722	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.4	-4.2	-179.7	0	0	0	0	0	115.3	V248	V248-G250 PolarHBondContact O-N 2.79Å
251	V	83.1	Confident	77.8	Confident	14 Å²	14	61.6 Å²	61.6	9%	0.085	38%	0.381	C	S	.	.			trans	-96	130.2	171.6	179.3	0	0	0	0	109.9	A215 D217 I219 V248 P249	A215-V251 WeakPolarHBondContact O-CG1 3.27Å; D217-V251 WeakPolarHBondContact O-CG1 3.5Å; I219-V251 HydrophobicContact CB-CG1 4.44Å; I219-V251 HydrophobicContact CB-CG2 4.21Å; I219-V251 HydrophobicContact CG1-CG2 4.11Å; V248-V251 HydrophobicContact CB-CB 4.17Å; V248-V251 HydrophobicContact CB-CG2 3.99Å; V248-V251 HydrophobicContact CG1-CB 4.32Å; V248-V251 HydrophobicContact CG1-CG2 3.63Å; V248-V251 PolarHBondContact O-N 2.73Å; V248-V251 VanDerWaalsContact O-N 3.15Å; P249-V251 VanDerWaalsContact C-N 3.33Å
252	V	86.1	Confident	79	Confident	25 Å²	25	59 Å²	59	15%	0.152	36%	0.36	C	S	.	.			trans	-115.4	109.5	-177.2	-174.1	0	0	0	0	109.6	D217 T254 L287 F290	D217-V252 CarbonylContact O-C 3.59Å; V252-T254 PolarHBondContact O-N 3.29Å; V252-L287 HydrophobicContact CG1-CB 3.64Å; V252-L287 HydrophobicContact CG2-CB 4.05Å; V252-F290 HydrophobicContact CG1-CB 3.67Å
253	S	86.7	Confident	80	Confident	38 Å²	38	54.2 Å²	54.2	27%	0.266	34%	0.338	S	S	.	.	B	Isolated β-bridge	trans	-51.4	134.2	-177.8	169.7	0	0	0	0	112.2	D217 V255 K288 A289 F290	D217-S253 WeakPolarHBondContact O-CA 3.3Å; S253-V255 VanDerWaalsContact C-N 3.27Å; S253-V255 PolarHBondContact OG-N 2.98Å; S253-V255 VanDerWaalsContact OG-N 3.15Å; S253-V255 PolarHBondContact OG-O 3.21Å; S253-K288 WeakPolarHBondContact CB-O 3.33Å; S253-K288 PolarHBondContact N-O 3.27Å; S253-K288 VanDerWaalsContact N-O 3.07Å; S253-A289 CarbonylContact O-C 3.53Å; S253-A289 VanDerWaalsContact O-CA 3.27Å; S253-A289 WeakPolarHBondContact O-CA 3.03Å; S253-F290 PolarHBondContact O-N 3.12Å
254	T	86.6	Confident	80.9	Confident	11 Å²	11	50.3 Å²	50.3	7%	0.067	32%	0.315	C	S	.	.	S	Bend	trans	-85	-2.4	175.7	72.3	0	0	0	0	112.8	D217 K227 R229 V252 F290	D217-T254 VanDerWaalsContact CG-OG1 3.23Å; D217-T254 PolarHBondContact OD1-OG1 3.48Å; D217-T254 WeakPolarHBondContact OD2-CA 3.44Å; D217-T254 PolarHBondContact OD2-N 3.26Å; D217-T254 PolarHBondContact OD2-OG1 2.87Å; K227-T254 HydrophobicContact CG-CG2 4.16Å; R229-T254 PolarHBondContact NH1-OG1 3.22Å; R229-T254 PolarHBondContact NH2-OG1 3.41Å; V252-T254 PolarHBondContact O-N 3.29Å; T254-F290 WeakPolarHBondContact CA-O 3.19Å
255	V	85.1	Confident	81.7	Confident	69 Å²	69	48.3 Å²	48.3	42%	0.418	30%	0.302	S	S	.	.			trans	-101.9	121.7	162.8	-173.3	0	0	0	0	109.4	D217 R229 S253 P257 A289	D217-V255 PolarHBondContact OD2-N 2.9Å; R229-V255 VanDerWaalsContact NH2-CG2 3.27Å; S253-V255 VanDerWaalsContact C-N 3.27Å; S253-V255 PolarHBondContact OG-N 2.98Å; S253-V255 VanDerWaalsContact OG-N 3.15Å; S253-V255 PolarHBondContact OG-O 3.21Å; V255-P257 WeakPolarHBondContact O-CD 3.44Å; V255-A289 VanDerWaalsContact O-CB 3.3Å; V255-A289 WeakPolarHBondContact O-CB 3.28Å
256	V	85.1	Confident	82.9	Confident	11 Å²	11	44 Å²	44	7%	0.067	27%	0.273	C	S	.	.			trans	-96.6	105.9	166.8	-171.5	0	0	0	0	108	K262 A289 N291 F306 E308	V256-K262 HydrophobicContact CG1-CD 4.23Å; V256-K262 HydrophobicContact CG1-CG 3.83Å; V256-K262 PolarHBondContact O-NZ 3.49Å; V256-A289 HydrophobicContact CB-CB 4.24Å; V256-A289 HydrophobicContact CG1-CB 4.37Å; V256-A289 HydrophobicContact CG2-CB 3.85Å; V256-N291 HydrophobicContact CG2-CB 3.92Å; V256-F306 HydrophobicContact CB-CB 4.12Å; V256-F306 HydrophobicContact CG1-CB 4.2Å; V256-F306 HydrophobicContact CG2-CB 4.04Å; V256-E308 HydrophobicContact CG1-CB 4.18Å
257	P	81.1	Confident	83.8	Confident	62 Å²	62	42.4 Å²	42.4	40%	0.403	27%	0.268	S	S	.	.			trans	-62.7	159.5	-179.5	29.2	-35.6	0	0	0	111.1	V255 S259 K262	V255-P257 WeakPolarHBondContact O-CD 3.44Å; P257-S259 PolarHBondContact O-N 3.28Å; P257-K262 WeakPolarHBondContact O-CD 3.42Å
258	D	79	Confident	84.9	Confident	119 Å²	119	37.4 Å²	37.4	64%	0.636	25%	0.249	S	C	*	.			trans	-79	103.2	173.1	-70.4	-29.6	0	0	0	109.5	K262	D258-K262 IonicContact OD1-NZ 3.22Å; D258-K262 PolarHBondContact OD1-NZ 2.88Å
259	S	82	Confident	85.6	Confident	28 Å²	28	36.5 Å²	36.5	20%	0.196	24%	0.244	C	C	.	.			trans	-133.1	168.5	-177.7	81.9	0	0	0	0	111.3	P257 H261 K262 E308	P257-S259 PolarHBondContact O-N 3.28Å; S259-H261 PolarHBondContact O-N 3.4Å; S259-H261 PolarHBondContact OG-N 2.81Å; S259-H261 VanDerWaalsContact OG-N 3.17Å; S259-K262 WeakPolarHBondContact O-CB 3.35Å; S259-K262 PolarHBondContact O-N 3.26Å; S259-K262 PolarHBondContact OG-N 2.57Å; S259-K262 VanDerWaalsContact OG-N 3.14Å; S259-E308 VanDerWaalsContact CB-OE2 3.32Å; S259-E308 WeakPolarHBondContact CB-OE2 3.49Å; S259-E308 PolarHBondContact OG-OE2 3.04Å
260	A	81	Confident	86.2	Confident	67 Å²	67	35.4 Å²	35.4	55%	0.554	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-9.4	174.1	0	0	0	0	0	114.2	R342	A260-R342 PolarHBondContact O-NH1 3.17Å
261	H	82.8	Confident	86.7	Confident	37 Å²	37	39.1 Å²	39.1	17%	0.171	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.8	5	-178.7	-55	-67.3	0	0	0	112.6	S259 L263 E308 Q317 E321	S259-H261 PolarHBondContact O-N 3.4Å; S259-H261 PolarHBondContact OG-N 2.81Å; S259-H261 VanDerWaalsContact OG-N 3.17Å; H261-L263 PolarHBondContact O-N 2.89Å; H261-E308 HydrophobicContact CB-CG 4.3Å; H261-Q317 PolarHBondContact CD2-OE1 3.14Å; H261-E321 IonicContact ND1-OE2 2.67Å; H261-E321 PolarHBondContact ND1-OE2 3.34Å; H261-E321 VanDerWaalsContact ND1-OE2 3.09Å
262	K	88.9	Confident	87	Confident	19 Å²	19	39.6 Å²	39.6	8%	0.083	23%	0.227	C	C	.	.			trans	-69.3	118	173.7	-179.1	177.4	-162.6	146.9	0	109.4	V256 P257 D258 S259 F306 A343	V256-K262 HydrophobicContact CG1-CD 4.23Å; V256-K262 HydrophobicContact CG1-CG 3.83Å; V256-K262 PolarHBondContact O-NZ 3.49Å; P257-K262 WeakPolarHBondContact O-CD 3.42Å; D258-K262 IonicContact OD1-NZ 3.22Å; D258-K262 PolarHBondContact OD1-NZ 2.88Å; S259-K262 WeakPolarHBondContact O-CB 3.35Å; S259-K262 PolarHBondContact O-N 3.26Å; S259-K262 PolarHBondContact OG-N 2.57Å; S259-K262 VanDerWaalsContact OG-N 3.14Å; K262-F306 HydrophobicContact CD-CD1 4.26Å; K262-F306 VanDerWaalsContact CE-CD1 3.48Å; K262-F306 HydrophobicContact CG-CD1 4.24Å; K262-A343 HydrophobicContact CB-CB 4.19Å; K262-A343 HydrophobicContact CD-CB 3.96Å; K262-A343 HydrophobicContact CG-CB 3.79Å; K262-A343 WeakPolarHBondContact O-CB 3.46Å; K262-A343 PolarHBondContact O-N 3.42Å
263	L	90.7	Very high	87.1	Confident	0 Å²	0	43 Å²	43	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	144.6	171.6	-66.3	-179.6	0	0	0	111.2	H261 I265 F306 C307 Y309 E321 A324 I325 R342	H261-L263 PolarHBondContact O-N 2.89Å; L263-I265 HydrophobicContact CB-CD1 4.11Å; L263-F306 VanDerWaalsContact O-CA 3.23Å; L263-F306 WeakPolarHBondContact O-CA 3.23Å; L263-F306 WeakPolarHBondContact O-CD1 3.46Å; L263-C307 PolarHBondContact N-O 3.39Å; L263-C307 PolarHBondContact O-N 2.84Å; L263-C307 VanDerWaalsContact O-N 3.14Å; L263-Y309 HydrophobicContact CD1-CD2 4.26Å; L263-Y309 HydrophobicContact CD1-CE2 3.73Å; L263-E321 HydrophobicContact CD1-CG 4.35Å; L263-E321 HydrophobicContact CD2-CG 3.72Å; L263-E321 HydrophobicContact CG-CG 4.17Å; L263-A324 HydrophobicContact CD1-CB 4.21Å; L263-I325 HydrophobicContact CD2-CD1 3.71Å; L263-I325 HydrophobicContact CD2-CG1 3.73Å; L263-R342 HydrophobicContact CD2-CG 4.45Å
264	F	92.8	Very high	87.2	Confident	48 Å²	48	42.5 Å²	42.5	21%	0.211	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	133.2	163.5	169	-93.4	0	0	0	108.8	Y304 F306 L339 V340 Q341 A343	F264-Y304 HydrophobicContact CD2-CD2 4.29Å; F264-Y304 AromaticContact CE2-CD2 3.63Å; F264-Y304 HydrophobicContact CE2-CD2 3.63Å; F264-Y304 HydrophobicContact CE2-CE2 4.47Å; F264-Y304 AromaticContact CE2-CG 3.91Å; F264-Y304 HydrophobicContact CE2-CG 3.91Å; F264-Y304 HydrophobicContact CZ-CG 4.45Å; F264-F306 HydrophobicContact CB-CD1 4.23Å; F264-F306 HydrophobicContact CB-CE1 4.1Å; F264-F306 HydrophobicContact CD2-CD1 4.35Å; F264-F306 AromaticContact CD2-CE1 3.76Å; F264-F306 HydrophobicContact CD2-CE1 3.76Å; F264-F306 HydrophobicContact CD2-CZ 4.04Å; F264-F306 HydrophobicContact CG-CE1 4.43Å; F264-L339 HydrophobicContact CE1-CD2 4.32Å; F264-V340 WeakPolarHBondContact O-CA 3.25Å; F264-Q341 HydrophobicContact CB-CG 4.41Å; F264-Q341 HydrophobicContact CD1-CG 4.04Å; F264-Q341 PolarHBondContact N-O 3.38Å; F264-Q341 PolarHBondContact O-N 2.88Å; F264-Q341 VanDerWaalsContact O-N 3.14Å; F264-A343 HydrophobicContact CB-CB 4.37Å
265	I	92.6	Very high	87.3	Confident	2 Å²	2	45.3 Å²	45.3	1%	0.01	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	93.6	178.4	-57.7	92.7	0	0	0	107.4	L263 L268 L281 Y304 A305 C307 L339 V340	L263-I265 HydrophobicContact CB-CD1 4.11Å; I265-L268 HydrophobicContact CG2-CD1 4.12Å; I265-L268 HydrophobicContact CG2-CD2 4.07Å; I265-L268 HydrophobicContact CG2-CG 4.07Å; I265-L281 HydrophobicContact CD1-CD1 4.36Å; I265-L281 HydrophobicContact CD1-CD2 4.37Å; I265-L281 HydrophobicContact CG1-CD2 4.18Å; I265-Y304 CarbonylContact O-C 3.55Å; I265-Y304 WeakPolarHBondContact O-CA 3.41Å; I265-Y304 WeakPolarHBondContact O-CB 3.48Å; I265-A305 HydrophobicContact CB-CB 4.47Å; I265-A305 PolarHBondContact N-O 3.15Å; I265-A305 PolarHBondContact O-N 3.15Å; I265-C307 HydrophobicContact CD1-CB 4.31Å; I265-L339 CarbonylContact C-O 3.51Å; I265-L339 WeakPolarHBondContact CA-O 3.29Å; I265-V340 HydrophobicContact CB-CG2 4.37Å; I265-V340 HydrophobicContact CG1-CG1 4.32Å; I265-V340 HydrophobicContact CG1-CG2 4.08Å; I265-V340 HydrophobicContact CG2-CG2 4.02Å
266	G	91.8	Very high	87.5	Confident	5 Å²	5	46.6 Å²	46.6	5%	0.052	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	171.8	174	0	0	0	0	0	112.8	L268 L338 L339	G266-L268 VanDerWaalsContact C-N 3.3Å; G266-L268 PolarHBondContact O-N 2.99Å; G266-L338 WeakPolarHBondContact O-CA 3.48Å; G266-L339 PolarHBondContact N-O 3.3Å; G266-L339 PolarHBondContact O-N 3.46Å
267	G	88.4	Confident	87.8	Confident	27 Å²	27	46.1 Å²	46.1	28%	0.278	25%	0.252	S	S	.	.			trans	79.1	6.8	174.9	0	0	0	0	0	114.9	G303 K336	G267-G303 PolarHBondContact N-O 3.34Å; G267-G303 VanDerWaalsContact N-O 3.1Å; G267-K336 WeakPolarHBondContact O-CB 3.41Å; G267-K336 WeakPolarHBondContact O-CD 3.46Å
268	L	91.8	Very high	88.2	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.238	C	C	.	.			trans	-62	139.4	177.4	-66.1	165.5	0	0	0	110.7	I265 G266 L272 V277 L292 G303 A305 K336 L338	I265-L268 HydrophobicContact CG2-CD1 4.12Å; I265-L268 HydrophobicContact CG2-CD2 4.07Å; I265-L268 HydrophobicContact CG2-CG 4.07Å; G266-L268 VanDerWaalsContact C-N 3.3Å; G266-L268 PolarHBondContact O-N 2.99Å; L268-L272 HydrophobicContact CD2-CD1 4.48Å; L268-V277 HydrophobicContact CD1-CG1 3.97Å; L268-V277 HydrophobicContact CD1-CG2 4.32Å; L268-V277 HydrophobicContact CD2-CG1 4.08Å; L268-V277 HydrophobicContact CD2-CG2 4.15Å; L268-L292 HydrophobicContact CD1-CD1 3.81Å; L268-G303 PolarHBondContact N-O 3Å; L268-G303 WeakPolarHBondContact O-CA 3.3Å; L268-A305 HydrophobicContact CD1-CB 3.77Å; L268-K336 PolarHBondContact O-NZ 2.84Å; L268-L338 HydrophobicContact CD2-CD1 4.43Å; L268-L338 HydrophobicContact CD2-CD2 3.79Å; L268-L338 HydrophobicContact CG-CD2 4.28Å
269	P	89.3	Confident	88.7	Confident	3 Å²	3	45.7 Å²	45.7	2%	0.019	24%	0.24	C	C	.	.			trans	-59.3	141.5	164.1	-22.4	31.7	0	0	0	111.5	Y271 L272 L333	P269-Y271 VanDerWaalsContact C-N 3.25Å; P269-Y271 HydrophobicContact CB-CD1 3.85Å; P269-Y271 HydrophobicContact CB-CD2 4.19Å; P269-Y271 HydrophobicContact CB-CE1 3.4Å; P269-Y271 HydrophobicContact CB-CE2 3.76Å; P269-Y271 HydrophobicContact CB-CG 4.22Å; P269-Y271 HydrophobicContact CG-CE1 4.31Å; P269-Y271 HydrophobicContact CG-CE2 4.36Å; P269-Y271 PolarHBondContact O-N 2.92Å; P269-L272 HydrophobicContact CB-CD1 4.42Å; P269-L272 HydrophobicContact CB-CG 4.22Å; P269-L272 HydrophobicContact CG-CD1 4.16Å; P269-L272 HydrophobicContact CG-CG 4.44Å; P269-L272 PolarHBondContact O-N 2.67Å; P269-L333 HydrophobicContact CG-CG 4.22Å; P269-L333 VanDerWaalsContact CG-O 3.31Å; P269-L333 WeakPolarHBondContact CG-O 3.5Å
270	N	88.5	Confident	89	Confident	89 Å²	89	46.6 Å²	46.6	48%	0.476	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-13.6	-175.9	58.3	-33.3	0	0	0	113.6	S301	N270-S301 WeakPolarHBondContact CB-O 3.3Å
271	Y	87.7	Confident	89.4	Confident	147 Å²	147	43.5 Å²	43.5	58%	0.576	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-4.6	174	58.7	-107.3	0	0	0	113.9	P269	P269-Y271 VanDerWaalsContact C-N 3.25Å; P269-Y271 HydrophobicContact CB-CD1 3.85Å; P269-Y271 HydrophobicContact CB-CD2 4.19Å; P269-Y271 HydrophobicContact CB-CE1 3.4Å; P269-Y271 HydrophobicContact CB-CE2 3.76Å; P269-Y271 HydrophobicContact CB-CG 4.22Å; P269-Y271 HydrophobicContact CG-CE1 4.31Å; P269-Y271 HydrophobicContact CG-CE2 4.36Å; P269-Y271 PolarHBondContact O-N 2.92Å
272	L	88.8	Confident	89.7	Confident	25 Å²	25	45.1 Å²	45.1	13%	0.131	23%	0.229	C	C	.	.			trans	-82.1	131.7	176	-66.3	-179.2	0	0	0	111.2	L268 P269 V277 L333	L268-L272 HydrophobicContact CD2-CD1 4.48Å; P269-L272 HydrophobicContact CB-CD1 4.42Å; P269-L272 HydrophobicContact CB-CG 4.22Å; P269-L272 HydrophobicContact CG-CD1 4.16Å; P269-L272 HydrophobicContact CG-CG 4.44Å; P269-L272 PolarHBondContact O-N 2.67Å; L272-V277 HydrophobicContact CB-CG2 3.94Å; L272-V277 HydrophobicContact CD1-CG2 4.29Å; L272-L333 HydrophobicContact CD1-CD2 3.56Å; L272-L333 HydrophobicContact CD1-CG 4.29Å
273	N	88.6	Confident	89.6	Confident	97 Å²	97	48.5 Å²	48.5	52%	0.519	26%	0.255	S	S	.	.			trans	-86.4	164.2	175.8	-71.8	-22	0	0	0	111.8	D275 Q276 V277	N273-D275 VanDerWaalsContact C-N 3.27Å; N273-D275 PolarHBondContact O-N 3.41Å; N273-Q276 PolarHBondContact O-N 2.85Å; N273-V277 PolarHBondContact O-N 2.89Å
274	D	88.6	Confident	89.3	Confident	26 Å²	26	50.5 Å²	50.5	14%	0.139	26%	0.264	C	S	.	.	H	α-helix	trans	-53.2	-46.4	-174.4	-42.4	-106.3	0	0	0	111.1	V277 K278 F290 L292 K294	D274-V277 PolarHBondContact O-N 3.47Å; D274-K278 WeakPolarHBondContact O-CG 3.5Å; D274-K278 PolarHBondContact O-N 2.83Å; D274-F290 HydrophobicContact CB-CE1 4.14Å; D274-L292 HydrophobicContact CB-CD2 4.43Å; D274-K294 VanDerWaalsContact CG-NZ 3.35Å; D274-K294 VanDerWaalsContact OD1-CE 3.23Å; D274-K294 WeakPolarHBondContact OD1-CE 3.46Å; D274-K294 IonicContact OD1-NZ 3.32Å; D274-K294 PolarHBondContact OD1-NZ 2.98Å; D274-K294 VanDerWaalsContact OD2-CE 3.28Å; D274-K294 WeakPolarHBondContact OD2-CE 3.38Å; D274-K294 IonicContact OD2-NZ 2.6Å; D274-K294 PolarHBondContact OD2-NZ 3.07Å
275	D	88.1	Confident	89	Confident	70 Å²	70	48.8 Å²	48.8	37%	0.374	26%	0.26	S	S	.	.	H	α-helix	trans	-73.5	-32.1	-174	-52.8	-63.3	0	0	0	113.2	N273 V277 K278 E279	N273-D275 VanDerWaalsContact C-N 3.27Å; N273-D275 PolarHBondContact O-N 3.41Å; D275-V277 VanDerWaalsContact C-N 3.31Å; D275-V277 PolarHBondContact O-N 3.44Å; D275-K278 PolarHBondContact O-N 3.33Å; D275-K278 WeakPolarHBondContact OD1-CE 3.39Å; D275-K278 IonicContact OD1-NZ 2.8Å; D275-K278 PolarHBondContact OD1-NZ 3.42Å; D275-E279 WeakPolarHBondContact O-CB 3.46Å; D275-E279 PolarHBondContact O-N 2.88Å
276	Q	90.2	Very high	88.7	Confident	96 Å²	96	51.5 Å²	51.5	45%	0.449	28%	0.278	S	S	.	.	H	α-helix	trans	-65.7	-36.1	172.3	-65.6	173.4	-46.7	0	0	111.5	N273 L280	N273-Q276 PolarHBondContact O-N 2.85Å; Q276-L280 PolarHBondContact O-N 3.16Å
277	V	90.4	Very high	88.5	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.006	28%	0.276	C	S	.	.	H	α-helix	trans	-76.7	-36.7	176.4	-175.8	0	0	0	0	110.8	L268 L272 N273 D274 D275 L281 F290	L268-V277 HydrophobicContact CD1-CG1 3.97Å; L268-V277 HydrophobicContact CD1-CG2 4.32Å; L268-V277 HydrophobicContact CD2-CG1 4.08Å; L268-V277 HydrophobicContact CD2-CG2 4.15Å; L272-V277 HydrophobicContact CB-CG2 3.94Å; L272-V277 HydrophobicContact CD1-CG2 4.29Å; N273-V277 PolarHBondContact O-N 2.89Å; D274-V277 PolarHBondContact O-N 3.47Å; D275-V277 VanDerWaalsContact C-N 3.31Å; D275-V277 PolarHBondContact O-N 3.44Å; V277-L281 HydrophobicContact CG1-CD1 4.09Å; V277-L281 WeakPolarHBondContact O-CB 3.13Å; V277-L281 VanDerWaalsContact O-CG 3.29Å; V277-L281 WeakPolarHBondContact O-CG 3.49Å; V277-L281 PolarHBondContact O-N 3.07Å; V277-L281 VanDerWaalsContact O-N 3.08Å; V277-F290 HydrophobicContact CB-CE2 4.21Å; V277-F290 HydrophobicContact CB-CZ 3.79Å; V277-F290 HydrophobicContact CG1-CE2 3.66Å; V277-F290 HydrophobicContact CG1-CZ 3.69Å
278	K	89.8	Confident	88.5	Confident	26 Å²	26	54 Å²	54	11%	0.113	28%	0.279	C	S	.	.	H	α-helix	trans	-59.2	-46.7	169.8	-70	172.1	-160	163.8	0	111.2	S225 D274 D275 L281 T282 L287 F290	S225-K278 PolarHBondContact OG-NZ 3.41Å; D274-K278 WeakPolarHBondContact O-CG 3.5Å; D274-K278 PolarHBondContact O-N 2.83Å; D275-K278 PolarHBondContact O-N 3.33Å; D275-K278 WeakPolarHBondContact OD1-CE 3.39Å; D275-K278 IonicContact OD1-NZ 2.8Å; D275-K278 PolarHBondContact OD1-NZ 3.42Å; K278-L281 PolarHBondContact O-N 2.81Å; K278-T282 VanDerWaalsContact O-CB 3.32Å; K278-T282 WeakPolarHBondContact O-CB 3.27Å; K278-T282 PolarHBondContact O-N 3.44Å; K278-T282 PolarHBondContact O-OG1 2.91Å; K278-L287 HydrophobicContact CB-CD1 4.29Å; K278-L287 HydrophobicContact CG-CD1 4.46Å; K278-F290 HydrophobicContact CD-CD1 4.19Å; K278-F290 HydrophobicContact CG-CB 4.29Å; K278-F290 HydrophobicContact CG-CD1 3.5Å; K278-F290 VanDerWaalsContact CG-CD1 3.5Å; K278-F290 HydrophobicContact CG-CD2 4.35Å; K278-F290 HydrophobicContact CG-CE1 3.85Å; K278-F290 HydrophobicContact CG-CG 3.77Å; K278-F290 HydrophobicContact CG-CZ 4.43Å
279	E	89.6	Confident	88.4	Confident	146 Å²	146	54.1 Å²	54.1	68%	0.682	28%	0.28	S	S	*	.	H	α-helix	trans	-59.2	-49.2	-179.6	-175	176.9	-168	0	0	111.3	D275 L281 T282 S283	D275-E279 WeakPolarHBondContact O-CB 3.46Å; D275-E279 PolarHBondContact O-N 2.88Å; E279-L281 VanDerWaalsContact C-N 3.34Å; E279-L281 PolarHBondContact O-N 2.71Å; E279-T282 PolarHBondContact O-N 2.88Å; E279-S283 PolarHBondContact O-N 3.45Å
280	L	88.8	Confident	88.5	Confident	47 Å²	47	54.2 Å²	54.2	25%	0.246	28%	0.281	C	S	.	.	H	α-helix	trans	-55.9	-46.1	174.7	175	60.8	0	0	0	112.2	Q276 S283 L328 M331 L333 L338	Q276-L280 PolarHBondContact O-N 3.16Å; L280-S283 PolarHBondContact O-OG 3.4Å; L280-L328 HydrophobicContact CD1-CD2 4Å; L280-L328 HydrophobicContact CD2-CD2 4.27Å; L280-L328 HydrophobicContact CG-CD2 4.09Å; L280-M331 HydrophobicContact CD1-CE 4.02Å; L280-M331 HydrophobicContact CD2-CE 3.91Å; L280-L333 HydrophobicContact CD2-CD2 4.15Å; L280-L338 HydrophobicContact CD2-CD1 4.18Å
281	L	89.8	Confident	88.7	Confident	2 Å²	2	52.7 Å²	52.7	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-70.2	-33.1	179.4	-69.6	168.3	0	0	0	112.6	I265 V277 K278 E279 S283 F284 L287 F290 C307 Y309 L328	I265-L281 HydrophobicContact CD1-CD1 4.36Å; I265-L281 HydrophobicContact CD1-CD2 4.37Å; I265-L281 HydrophobicContact CG1-CD2 4.18Å; V277-L281 HydrophobicContact CG1-CD1 4.09Å; V277-L281 WeakPolarHBondContact O-CB 3.13Å; V277-L281 VanDerWaalsContact O-CG 3.29Å; V277-L281 WeakPolarHBondContact O-CG 3.49Å; V277-L281 PolarHBondContact O-N 3.07Å; V277-L281 VanDerWaalsContact O-N 3.08Å; K278-L281 PolarHBondContact O-N 2.81Å; E279-L281 VanDerWaalsContact C-N 3.34Å; E279-L281 PolarHBondContact O-N 2.71Å; L281-S283 PolarHBondContact O-N 2.88Å; L281-F284 PolarHBondContact O-N 3.3Å; L281-F284 VanDerWaalsContact O-N 3.11Å; L281-L287 HydrophobicContact CB-CD1 3.9Å; L281-L287 HydrophobicContact CB-CD2 4.15Å; L281-L287 HydrophobicContact CB-CG 4.44Å; L281-F290 HydrophobicContact CD1-CD2 3.67Å; L281-F290 HydrophobicContact CD1-CE2 3.56Å; L281-C307 HydrophobicContact CD1-CB 4.15Å; L281-Y309 PolarHBondContact O-OH 3.42Å; L281-Y309 VanDerWaalsContact O-OH 3.1Å; L281-L328 HydrophobicContact CD2-CD1 3.62Å
282	T	88.7	Confident	88.9	Confident	72 Å²	72	45.9 Å²	45.9	44%	0.442	25%	0.246	S	C	.	.	H	α-helix	trans	-66.3	-23.7	-177.8	-58.3	0	0	0	0	112.2	K278 E279 F284 G285	K278-T282 VanDerWaalsContact O-CB 3.32Å; K278-T282 WeakPolarHBondContact O-CB 3.27Å; K278-T282 PolarHBondContact O-N 3.44Å; K278-T282 PolarHBondContact O-OG1 2.91Å; E279-T282 PolarHBondContact O-N 2.88Å; T282-F284 PolarHBondContact O-N 3.35Å; T282-F284 VanDerWaalsContact O-N 3.16Å; T282-G285 WeakPolarHBondContact CA-O 3.5Å; T282-G285 PolarHBondContact O-N 3.38Å; T282-G285 VanDerWaalsContact O-N 3.14Å
283	S	86.6	Confident	88.9	Confident	90 Å²	90	45.9 Å²	45.9	63%	0.629	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-14.5	174.3	69.1	0	0	0	0	114.5	E279 L280 L281	E279-S283 PolarHBondContact O-N 3.45Å; L280-S283 PolarHBondContact O-OG 3.4Å; L281-S283 PolarHBondContact O-N 2.88Å
284	F	84.8	Confident	88.9	Confident	42 Å²	42	44.7 Å²	44.7	18%	0.184	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-11.6	175.6	-62.3	-92.9	0	0	0	113.5	L281 T282 Y309 Q323 A324 L328	L281-F284 PolarHBondContact O-N 3.3Å; L281-F284 VanDerWaalsContact O-N 3.11Å; T282-F284 PolarHBondContact O-N 3.35Å; T282-F284 VanDerWaalsContact O-N 3.16Å; F284-Y309 HydrophobicContact CB-CE1 4.44Å; F284-Q323 HydrophobicContact CD1-CG 4.4Å; F284-A324 HydrophobicContact CB-CB 4.02Å; F284-A324 HydrophobicContact CD1-CB 4.29Å; F284-A324 HydrophobicContact CG-CB 4.15Å; F284-L328 HydrophobicContact CD2-CD1 4.03Å; F284-L328 HydrophobicContact CD2-CG 4.3Å; F284-L328 HydrophobicContact CE1-CG 4.44Å; F284-L328 HydrophobicContact CE2-CD1 3.85Å; F284-L328 HydrophobicContact CE2-CD2 3.61Å; F284-L328 HydrophobicContact CE2-CG 3.64Å; F284-L328 HydrophobicContact CZ-CD1 4.34Å; F284-L328 HydrophobicContact CZ-CD2 3.85Å; F284-L328 HydrophobicContact CZ-CG 3.72Å
285	G	85.2	Confident	88.7	Confident	11 Å²	11	45.7 Å²	45.7	11%	0.113	24%	0.242	C	C	.	.	S	Bend	trans	156.5	163.9	179.4	0	0	0	0	0	113.4	T282 L287 Y309	T282-G285 WeakPolarHBondContact CA-O 3.5Å; T282-G285 PolarHBondContact O-N 3.38Å; T282-G285 VanDerWaalsContact O-N 3.14Å; G285-L287 PolarHBondContact O-N 3.28Å; G285-Y309 WeakPolarHBondContact O-CE1 3.35Å
286	P	86.8	Confident	88.2	Confident	60 Å²	60	48.4 Å²	48.4	39%	0.39	27%	0.267	S	S	.	.			trans	-65.5	128.4	176	27.1	-33.9	0	0	0	111.4	V310	P286-V310 HydrophobicContact CB-CB 4.44Å; P286-V310 HydrophobicContact CB-CG2 4Å; P286-V310 HydrophobicContact CG-CB 4.11Å; P286-V310 HydrophobicContact CG-CG2 4.23Å; P286-V310 WeakPolarHBondContact O-CG2 3.47Å; P286-V310 PolarHBondContact O-N 3.36Å
287	L	88.9	Confident	87.8	Confident	4 Å²	4	48.4 Å²	48.4	2%	0.021	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	130.7	177.3	-66.9	174.4	0	0	0	111.3	Y247 V252 K278 L281 G285 F290 C307 Y309	Y247-L287 PolarHBondContact OH-O 3.07Å; V252-L287 HydrophobicContact CG1-CB 3.64Å; V252-L287 HydrophobicContact CG2-CB 4.05Å; K278-L287 HydrophobicContact CB-CD1 4.29Å; K278-L287 HydrophobicContact CG-CD1 4.46Å; L281-L287 HydrophobicContact CB-CD1 3.9Å; L281-L287 HydrophobicContact CB-CD2 4.15Å; L281-L287 HydrophobicContact CB-CG 4.44Å; G285-L287 PolarHBondContact O-N 3.28Å; L287-F290 HydrophobicContact CD1-CB 4.35Å; L287-C307 HydrophobicContact CD2-CB 3.96Å; L287-Y309 HydrophobicContact CD2-CD1 3.79Å; L287-Y309 HydrophobicContact CD2-CE1 3.52Å; L287-Y309 HydrophobicContact CD2-CG 4.47Å; L287-Y309 HydrophobicContact CG-CE1 4.36Å
288	K	87.3	Confident	87.5	Confident	80 Å²	80	52.7 Å²	52.7	35%	0.348	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	-39.1	170.4	174.7	-179.8	171.5	-168.1	0	111	S253 E308 V310	S253-K288 WeakPolarHBondContact CB-O 3.33Å; S253-K288 PolarHBondContact N-O 3.27Å; S253-K288 VanDerWaalsContact N-O 3.07Å; K288-E308 WeakPolarHBondContact CB-O 3.29Å; K288-E308 HydrophobicContact CD-CG 4.48Å; K288-E308 WeakPolarHBondContact CD-OE1 3.43Å; K288-E308 VanDerWaalsContact CE-OE1 3.27Å; K288-E308 WeakPolarHBondContact CE-OE1 3.41Å; K288-E308 PolarHBondContact N-O 3.04Å; K288-E308 IonicContact NZ-OE1 3.78Å; K288-E308 PolarHBondContact NZ-OE1 3.16Å; K288-V310 HydrophobicContact CB-CG2 3.92Å
289	A	88.9	Confident	87.1	Confident	2 Å²	2	53.5 Å²	53.5	2%	0.017	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	147.3	178.2	0	0	0	0	0	111.8	S253 V255 V256 C307 E308	S253-A289 CarbonylContact O-C 3.53Å; S253-A289 VanDerWaalsContact O-CA 3.27Å; S253-A289 WeakPolarHBondContact O-CA 3.03Å; V255-A289 VanDerWaalsContact O-CB 3.3Å; V255-A289 WeakPolarHBondContact O-CB 3.28Å; V256-A289 HydrophobicContact CB-CB 4.24Å; V256-A289 HydrophobicContact CG1-CB 4.37Å; V256-A289 HydrophobicContact CG2-CB 3.85Å; A289-C307 CarbonylContact O-C 3.57Å; A289-C307 VanDerWaalsContact O-CA 3.22Å; A289-C307 WeakPolarHBondContact O-CA 3.36Å; A289-C307 WeakPolarHBondContact O-CB 3.45Å; A289-E308 HydrophobicContact CB-CB 4.41Å; A289-E308 PolarHBondContact N-O 3.21Å; A289-E308 VanDerWaalsContact N-O 3.11Å; A289-E308 PolarHBondContact O-N 3.41Å
290	F	92.9	Very high	86.9	Confident	6 Å²	6	51.5 Å²	51.5	3%	0.026	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	136.4	177.1	175.4	-96	0	0	0	111.4	V252 S253 T254 D274 V277 K278 L281 L287 L292 A305 F306 C307	V252-F290 HydrophobicContact CG1-CB 3.67Å; S253-F290 PolarHBondContact O-N 3.12Å; T254-F290 WeakPolarHBondContact CA-O 3.19Å; D274-F290 HydrophobicContact CB-CE1 4.14Å; V277-F290 HydrophobicContact CB-CE2 4.21Å; V277-F290 HydrophobicContact CB-CZ 3.79Å; V277-F290 HydrophobicContact CG1-CE2 3.66Å; V277-F290 HydrophobicContact CG1-CZ 3.69Å; K278-F290 HydrophobicContact CD-CD1 4.19Å; K278-F290 HydrophobicContact CG-CB 4.29Å; K278-F290 HydrophobicContact CG-CD1 3.5Å; K278-F290 VanDerWaalsContact CG-CD1 3.5Å; K278-F290 HydrophobicContact CG-CD2 4.35Å; K278-F290 HydrophobicContact CG-CE1 3.85Å; K278-F290 HydrophobicContact CG-CG 3.77Å; K278-F290 HydrophobicContact CG-CZ 4.43Å; L281-F290 HydrophobicContact CD1-CD2 3.67Å; L281-F290 HydrophobicContact CD1-CE2 3.56Å; L287-F290 HydrophobicContact CD1-CB 4.35Å; F290-L292 HydrophobicContact CE1-CB 3.77Å; F290-L292 HydrophobicContact CZ-CB 3.77Å; F290-A305 HydrophobicContact CE2-CB 3.8Å; F290-A305 HydrophobicContact CZ-CB 4.04Å; F290-F306 WeakPolarHBondContact CA-O 3.38Å; F290-C307 HydrophobicContact CD2-CB 4.12Å
291	N	92.2	Very high	86.9	Confident	57 Å²	57	49.8 Å²	49.8	31%	0.305	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	105.4	174.1	-178.9	31.9	0	0	0	111.1	V256 V293 A305 F306	V256-N291 HydrophobicContact CG2-CB 3.92Å; N291-V293 PolarHBondContact O-N 2.96Å; N291-A305 CarbonylContact O-C 3.48Å; N291-A305 VanDerWaalsContact O-CA 3.29Å; N291-A305 WeakPolarHBondContact O-CA 3.35Å; N291-F306 PolarHBondContact N-O 3.42Å; N291-F306 PolarHBondContact O-N 3.32Å
292	L	91.1	Very high	86.9	Confident	4 Å²	4	54.8 Å²	54.8	2%	0.021	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	117.6	167.5	-177.3	61.4	0	0	0	109	L268 D274 F290 K294 A305	L268-L292 HydrophobicContact CD1-CD1 3.81Å; D274-L292 HydrophobicContact CB-CD2 4.43Å; F290-L292 HydrophobicContact CE1-CB 3.77Å; F290-L292 HydrophobicContact CZ-CB 3.77Å; L292-K294 PolarHBondContact O-N 3.27Å; L292-K294 VanDerWaalsContact O-N 3.14Å; L292-A305 HydrophobicContact CD1-CB 3.95Å
293	V	89.2	Confident	87	Confident	25 Å²	25	51.7 Å²	51.7	15%	0.152	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	108.2	-176.3	-174.6	0	0	0	0	109.7	N291 K302 Y304 F306	N291-V293 PolarHBondContact O-N 2.96Å; V293-K302 HydrophobicContact CG1-CD 4.33Å; V293-K302 WeakPolarHBondContact O-CB 3.27Å; V293-K302 WeakPolarHBondContact O-CG 3.36Å; V293-K302 PolarHBondContact O-N 3.37Å; V293-Y304 HydrophobicContact CB-CD2 4.01Å; V293-Y304 HydrophobicContact CB-CE1 4.33Å; V293-Y304 HydrophobicContact CB-CE2 3.65Å; V293-Y304 HydrophobicContact CG1-CE1 4.33Å; V293-Y304 HydrophobicContact CG1-CE2 3.95Å; V293-Y304 HydrophobicContact CG2-CD2 3.88Å; V293-Y304 HydrophobicContact CG2-CE2 3.53Å; V293-Y304 PolarHBondContact N-O 2.82Å; V293-F306 HydrophobicContact CG2-CD2 3.95Å; V293-F306 HydrophobicContact CG2-CE2 3.92Å
294	K	88.1	Confident	87.2	Confident	71 Å²	71	50.8 Å²	50.8	31%	0.309	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	160.2	175.6	-68.2	173.6	175.5	-171.2	0	111.3	D274 L292 G299 L300 K302	D274-K294 VanDerWaalsContact CG-NZ 3.35Å; D274-K294 VanDerWaalsContact OD1-CE 3.23Å; D274-K294 WeakPolarHBondContact OD1-CE 3.46Å; D274-K294 IonicContact OD1-NZ 3.32Å; D274-K294 PolarHBondContact OD1-NZ 2.98Å; D274-K294 VanDerWaalsContact OD2-CE 3.28Å; D274-K294 WeakPolarHBondContact OD2-CE 3.38Å; D274-K294 IonicContact OD2-NZ 2.6Å; D274-K294 PolarHBondContact OD2-NZ 3.07Å; L292-K294 PolarHBondContact O-N 3.27Å; L292-K294 VanDerWaalsContact O-N 3.14Å; K294-G299 WeakPolarHBondContact CD-O 3.32Å; K294-L300 CarbonylContact C-O 3.49Å; K294-L300 VanDerWaalsContact CA-O 3.25Å; K294-L300 WeakPolarHBondContact CA-O 3.29Å; K294-K302 WeakPolarHBondContact O-CE 3.44Å
295	D	84.9	Confident	87.6	Confident	47 Å²	47	48.8 Å²	48.8	25%	0.251	29%	0.289	S	S	.	.			trans	-78.1	137.6	168.6	-172.1	-102.1	0	0	0	112.1	A297 T298 G299 L300 K302	D295-A297 PolarHBondContact OD1-N 3.38Å; D295-T298 WeakPolarHBondContact CB-OG1 3.38Å; D295-T298 PolarHBondContact OD1-N 3.2Å; D295-T298 VanDerWaalsContact OD1-N 3.09Å; D295-T298 PolarHBondContact OD1-OG1 3.3Å; D295-G299 VanDerWaalsContact O-CA 3.23Å; D295-G299 WeakPolarHBondContact O-CA 3.47Å; D295-G299 PolarHBondContact O-N 3.09Å; D295-L300 PolarHBondContact N-O 3.07Å; D295-K302 HydrophobicContact CB-CG 4.41Å; D295-K302 VanDerWaalsContact OD2-CE 3.25Å; D295-K302 WeakPolarHBondContact OD2-CE 3.3Å; D295-K302 IonicContact OD2-NZ 2.77Å; D295-K302 PolarHBondContact OD2-NZ 2.83Å
296	S	78.4	Confident	88	Confident	128 Å²	128	50.4 Å²	50.4	90%	0.895	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-12.7	-172.9	-166.4	0	0	0	0	114.1
297	A	81.3	Confident	88.3	Confident	96 Å²	96	47.6 Å²	47.6	79%	0.793	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	-35.3	176.3	0	0	0	0	0	111.9	D295	D295-A297 PolarHBondContact OD1-N 3.38Å
298	T	84.3	Confident	88.3	Confident	91 Å²	91	47.6 Å²	47.6	56%	0.558	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.8	-13.5	-176.2	60.8	0	0	0	0	114.8	D295 L300	D295-T298 WeakPolarHBondContact CB-OG1 3.38Å; D295-T298 PolarHBondContact OD1-N 3.2Å; D295-T298 VanDerWaalsContact OD1-N 3.09Å; D295-T298 PolarHBondContact OD1-OG1 3.3Å; T298-L300 PolarHBondContact O-N 3.42Å; T298-L300 VanDerWaalsContact O-N 3.11Å
299	G	80.1	Confident	88.4	Confident	43 Å²	43	44 Å²	44	44%	0.443	26%	0.259	S	S	.	.			trans	70.5	-4.9	-175	0	0	0	0	0	115.1	K294 D295	K294-G299 WeakPolarHBondContact CD-O 3.32Å; D295-G299 VanDerWaalsContact O-CA 3.23Å; D295-G299 WeakPolarHBondContact O-CA 3.47Å; D295-G299 PolarHBondContact O-N 3.09Å
300	L	85.4	Confident	88.1	Confident	103 Å²	103	45 Å²	45	54%	0.539	27%	0.265	S	S	.	.			trans	-74.3	146.9	-176.7	-63.4	175.2	0	0	0	111.9	K294 D295 T298 K302	K294-L300 CarbonylContact C-O 3.49Å; K294-L300 VanDerWaalsContact CA-O 3.25Å; K294-L300 WeakPolarHBondContact CA-O 3.29Å; D295-L300 PolarHBondContact N-O 3.07Å; T298-L300 PolarHBondContact O-N 3.42Å; T298-L300 VanDerWaalsContact O-N 3.11Å; L300-K302 PolarHBondContact O-N 2.88Å
301	S	89.8	Confident	87	Confident	12 Å²	12	48.3 Å²	48.3	8%	0.084	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	130.5	174.6	171.3	0	0	0	0	111.2	N270 G303	N270-S301 WeakPolarHBondContact CB-O 3.3Å; S301-G303 PolarHBondContact O-N 2.77Å; S301-G303 PolarHBondContact OG-N 3.12Å; S301-G303 VanDerWaalsContact OG-N 3.14Å
302	K	89.7	Confident	85.5	Confident	107 Å²	107	49.8 Å²	49.8	47%	0.465	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	3.6	172.8	-58	-159.6	-178.9	-146.4	0	113	V293 K294 D295 L300 Y304	V293-K302 HydrophobicContact CG1-CD 4.33Å; V293-K302 WeakPolarHBondContact O-CB 3.27Å; V293-K302 WeakPolarHBondContact O-CG 3.36Å; V293-K302 PolarHBondContact O-N 3.37Å; K294-K302 WeakPolarHBondContact O-CE 3.44Å; D295-K302 HydrophobicContact CB-CG 4.41Å; D295-K302 VanDerWaalsContact OD2-CE 3.25Å; D295-K302 WeakPolarHBondContact OD2-CE 3.3Å; D295-K302 IonicContact OD2-NZ 2.77Å; D295-K302 PolarHBondContact OD2-NZ 2.83Å; L300-K302 PolarHBondContact O-N 2.88Å; K302-Y304 HydrophobicContact CB-CD1 3.81Å; K302-Y304 HydrophobicContact CB-CE1 3.53Å; K302-Y304 HydrophobicContact CD-CE1 4.28Å; K302-Y304 HydrophobicContact CG-CE1 4.46Å
303	G	90	Very high	84.4	Confident	7 Å²	7	54.1 Å²	54.1	7%	0.072	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	76.7	20.3	-179.4	0	0	0	0	0	114.2	G267 L268 S301	G267-G303 PolarHBondContact N-O 3.34Å; G267-G303 VanDerWaalsContact N-O 3.1Å; L268-G303 PolarHBondContact N-O 3Å; L268-G303 WeakPolarHBondContact O-CA 3.3Å; S301-G303 PolarHBondContact O-N 2.77Å; S301-G303 PolarHBondContact OG-N 3.12Å; S301-G303 VanDerWaalsContact OG-N 3.14Å
304	Y	92.4	Very high	83	Confident	70 Å²	70	57.9 Å²	57.9	28%	0.275	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	151.5	170	68.7	-83.7	0	0	0	113.2	F264 I265 V293 K302 F306	F264-Y304 HydrophobicContact CD2-CD2 4.29Å; F264-Y304 AromaticContact CE2-CD2 3.63Å; F264-Y304 HydrophobicContact CE2-CD2 3.63Å; F264-Y304 HydrophobicContact CE2-CE2 4.47Å; F264-Y304 AromaticContact CE2-CG 3.91Å; F264-Y304 HydrophobicContact CE2-CG 3.91Å; F264-Y304 HydrophobicContact CZ-CG 4.45Å; I265-Y304 CarbonylContact O-C 3.55Å; I265-Y304 WeakPolarHBondContact O-CA 3.41Å; I265-Y304 WeakPolarHBondContact O-CB 3.48Å; V293-Y304 HydrophobicContact CB-CD2 4.01Å; V293-Y304 HydrophobicContact CB-CE1 4.33Å; V293-Y304 HydrophobicContact CB-CE2 3.65Å; V293-Y304 HydrophobicContact CG1-CE1 4.33Å; V293-Y304 HydrophobicContact CG1-CE2 3.95Å; V293-Y304 HydrophobicContact CG2-CD2 3.88Å; V293-Y304 HydrophobicContact CG2-CE2 3.53Å; V293-Y304 PolarHBondContact N-O 2.82Å; K302-Y304 HydrophobicContact CB-CD1 3.81Å; K302-Y304 HydrophobicContact CB-CE1 3.53Å; K302-Y304 HydrophobicContact CD-CE1 4.28Å; K302-Y304 HydrophobicContact CG-CE1 4.46Å; Y304-F306 HydrophobicContact CD2-CE2 4.18Å; Y304-F306 AromaticContact CE2-CE2 3.96Å; Y304-F306 HydrophobicContact CE2-CE2 3.96Å; Y304-F306 HydrophobicContact CE2-CZ 4.38Å
305	A	93.1	Very high	81.6	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	166.1	177.3	0	0	0	0	0	111.2	I265 L268 F290 N291 L292	I265-A305 HydrophobicContact CB-CB 4.47Å; I265-A305 PolarHBondContact N-O 3.15Å; I265-A305 PolarHBondContact O-N 3.15Å; L268-A305 HydrophobicContact CD1-CB 3.77Å; F290-A305 HydrophobicContact CE2-CB 3.8Å; F290-A305 HydrophobicContact CZ-CB 4.04Å; N291-A305 CarbonylContact O-C 3.48Å; N291-A305 VanDerWaalsContact O-CA 3.29Å; N291-A305 WeakPolarHBondContact O-CA 3.35Å; L292-A305 HydrophobicContact CD1-CB 3.95Å
306	F	93.9	Very high	80.7	Confident	46 Å²	46	61.3 Å²	61.3	20%	0.202	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	151.9	164.1	-61.7	-84.7	0	0	0	110.1	V256 K262 L263 F264 F290 N291 V293 Y304 A343	V256-F306 HydrophobicContact CB-CB 4.12Å; V256-F306 HydrophobicContact CG1-CB 4.2Å; V256-F306 HydrophobicContact CG2-CB 4.04Å; K262-F306 HydrophobicContact CD-CD1 4.26Å; K262-F306 VanDerWaalsContact CE-CD1 3.48Å; K262-F306 HydrophobicContact CG-CD1 4.24Å; L263-F306 VanDerWaalsContact O-CA 3.23Å; L263-F306 WeakPolarHBondContact O-CA 3.23Å; L263-F306 WeakPolarHBondContact O-CD1 3.46Å; F264-F306 HydrophobicContact CB-CD1 4.23Å; F264-F306 HydrophobicContact CB-CE1 4.1Å; F264-F306 HydrophobicContact CD2-CD1 4.35Å; F264-F306 AromaticContact CD2-CE1 3.76Å; F264-F306 HydrophobicContact CD2-CE1 3.76Å; F264-F306 HydrophobicContact CD2-CZ 4.04Å; F264-F306 HydrophobicContact CG-CE1 4.43Å; F290-F306 WeakPolarHBondContact CA-O 3.38Å; N291-F306 PolarHBondContact N-O 3.42Å; N291-F306 PolarHBondContact O-N 3.32Å; V293-F306 HydrophobicContact CG2-CD2 3.95Å; V293-F306 HydrophobicContact CG2-CE2 3.92Å; Y304-F306 HydrophobicContact CD2-CE2 4.18Å; Y304-F306 AromaticContact CE2-CE2 3.96Å; Y304-F306 HydrophobicContact CE2-CE2 3.96Å; Y304-F306 HydrophobicContact CE2-CZ 4.38Å; F306-A343 HydrophobicContact CD1-CB 4.42Å; F306-A343 HydrophobicContact CE1-CB 4.28Å
307	C	92.4	Very high	80.1	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	168.2	166.9	76.4	0	0	0	0	112.7	L263 I265 L281 L287 A289 F290	L263-C307 PolarHBondContact N-O 3.39Å; L263-C307 PolarHBondContact O-N 2.84Å; L263-C307 VanDerWaalsContact O-N 3.14Å; I265-C307 HydrophobicContact CD1-CB 4.31Å; L281-C307 HydrophobicContact CD1-CB 4.15Å; L287-C307 HydrophobicContact CD2-CB 3.96Å; A289-C307 CarbonylContact O-C 3.57Å; A289-C307 VanDerWaalsContact O-CA 3.22Å; A289-C307 WeakPolarHBondContact O-CA 3.36Å; A289-C307 WeakPolarHBondContact O-CB 3.45Å; F290-C307 HydrophobicContact CD2-CB 4.12Å
308	E	89	Confident	79.4	Confident	5 Å²	5	53.9 Å²	53.9	2%	0.023	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	134.7	167.2	-171.2	177.3	117.8	0	0	108	V256 S259 H261 K288 A289	V256-E308 HydrophobicContact CG1-CB 4.18Å; S259-E308 VanDerWaalsContact CB-OE2 3.32Å; S259-E308 WeakPolarHBondContact CB-OE2 3.49Å; S259-E308 PolarHBondContact OG-OE2 3.04Å; H261-E308 HydrophobicContact CB-CG 4.3Å; K288-E308 WeakPolarHBondContact CB-O 3.29Å; K288-E308 HydrophobicContact CD-CG 4.48Å; K288-E308 WeakPolarHBondContact CD-OE1 3.43Å; K288-E308 VanDerWaalsContact CE-OE1 3.27Å; K288-E308 WeakPolarHBondContact CE-OE1 3.41Å; K288-E308 PolarHBondContact N-O 3.04Å; K288-E308 IonicContact NZ-OE1 3.78Å; K288-E308 PolarHBondContact NZ-OE1 3.16Å; A289-E308 HydrophobicContact CB-CB 4.41Å; A289-E308 PolarHBondContact N-O 3.21Å; A289-E308 VanDerWaalsContact N-O 3.11Å; A289-E308 PolarHBondContact O-N 3.41Å
309	Y	88.7	Confident	78.8	Confident	3 Å²	3	53.4 Å²	53.4	1%	0.012	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	156.2	177.1	-70.3	-77.8	0	0	0	111.6	L263 L281 F284 G285 L287 D311 Q317 A324	L263-Y309 HydrophobicContact CD1-CD2 4.26Å; L263-Y309 HydrophobicContact CD1-CE2 3.73Å; L281-Y309 PolarHBondContact O-OH 3.42Å; L281-Y309 VanDerWaalsContact O-OH 3.1Å; F284-Y309 HydrophobicContact CB-CE1 4.44Å; G285-Y309 WeakPolarHBondContact O-CE1 3.35Å; L287-Y309 HydrophobicContact CD2-CD1 3.79Å; L287-Y309 HydrophobicContact CD2-CE1 3.52Å; L287-Y309 HydrophobicContact CD2-CG 4.47Å; L287-Y309 HydrophobicContact CG-CE1 4.36Å; Y309-D311 PolarHBondContact O-N 2.85Å; Y309-Q317 PolarHBondContact O-NE2 3.17Å; Y309-A324 HydrophobicContact CE2-CB 3.7Å
310	V	82.9	Confident	78.6	Confident	23 Å²	23	53.6 Å²	53.6	14%	0.139	28%	0.281	C	S	.	.			trans	-62.9	129.8	176	179.8	0	0	0	0	110.4	Y247 P286 K288 V312	Y247-V310 HydrophobicContact CE1-CG2 4.23Å; Y247-V310 HydrophobicContact CE2-CG2 4.29Å; Y247-V310 VanDerWaalsContact OH-CG2 3.29Å; Y247-V310 WeakPolarHBondContact OH-CG2 3.4Å; P286-V310 HydrophobicContact CB-CB 4.44Å; P286-V310 HydrophobicContact CB-CG2 4Å; P286-V310 HydrophobicContact CG-CB 4.11Å; P286-V310 HydrophobicContact CG-CG2 4.23Å; P286-V310 WeakPolarHBondContact O-CG2 3.47Å; P286-V310 PolarHBondContact O-N 3.36Å; K288-V310 HydrophobicContact CB-CG2 3.92Å; V310-V312 HydrophobicContact CG1-CG2 4.11Å; V310-V312 PolarHBondContact O-N 3.25Å; V310-V312 VanDerWaalsContact O-N 3.17Å
311	D	70.4	Confident	78.3	Confident	76 Å²	76	48.8 Å²	48.8	41%	0.406	26%	0.256	S	S	.	.			trans	-77	96.7	169.1	-173.5	7.6	0	0	0	108.8	Y309 N313 L314	Y309-D311 PolarHBondContact O-N 2.85Å; D311-N313 WeakPolarHBondContact OD1-CA 3.19Å; D311-N313 PolarHBondContact OD1-N 3.3Å; D311-L314 PolarHBondContact OD1-N 2.83Å; D311-L314 VanDerWaalsContact OD1-N 3.12Å
312	V	61.5	Low	77.9	Confident	88 Å²	88	51.8 Å²	51.8	53%	0.533	27%	0.271	S	S	.	.	S	Bend	trans	-86.9	-40	170	-178.4	0	0	0	0	109.6	V310	V310-V312 HydrophobicContact CG1-CG2 4.11Å; V310-V312 PolarHBondContact O-N 3.25Å; V310-V312 VanDerWaalsContact O-N 3.17Å
313	N	66.1	Low	77.5	Confident	96 Å²	96	52.1 Å²	52.1	51%	0.513	27%	0.274	S	S	.	.			trans	-152.3	150.2	159.8	-62.3	-77.2	0	0	0	107.7	D311 N315 D316 Q317	D311-N313 WeakPolarHBondContact OD1-CA 3.19Å; D311-N313 PolarHBondContact OD1-N 3.3Å; N313-N315 PolarHBondContact O-N 2.84Å; N313-N315 VanDerWaalsContact O-N 3.11Å; N313-D316 HydrophobicContact CB-CB 4.38Å; N313-D316 WeakPolarHBondContact CB-OD2 3.32Å; N313-D316 PolarHBondContact ND2-OD2 2.89Å; N313-D316 WeakPolarHBondContact O-CA 3.38Å; N313-D316 PolarHBondContact O-N 3.41Å; N313-Q317 PolarHBondContact O-N 3.02Å
314	L	60.6	Low	77.2	Confident	103 Å²	103	51.8 Å²	51.8	54%	0.539	27%	0.271	S	S	.	.	H	α-helix	trans	-49.7	-41.2	176.9	-79.6	166.9	0	0	0	113.7	D311 I318	D311-L314 PolarHBondContact OD1-N 2.83Å; D311-L314 VanDerWaalsContact OD1-N 3.12Å; L314-I318 WeakPolarHBondContact O-CB 3.49Å; L314-I318 WeakPolarHBondContact O-CD1 3.49Å; L314-I318 VanDerWaalsContact O-CG1 3.24Å; L314-I318 WeakPolarHBondContact O-CG1 3.31Å; L314-I318 PolarHBondContact O-N 3.09Å
315	N	59.4	Low	76.9	Confident	126 Å²	126	50.1 Å²	50.1	67%	0.674	27%	0.266	S	S	*	.	H	α-helix	trans	-67.1	-39.2	178.5	-67.2	-16.8	0	0	0	112.1	N313 T319	N313-N315 PolarHBondContact O-N 2.84Å; N313-N315 VanDerWaalsContact O-N 3.11Å; N315-T319 WeakPolarHBondContact O-CB 3.3Å; N315-T319 PolarHBondContact O-N 3.43Å; N315-T319 PolarHBondContact O-OG1 3.41Å
316	D	65.4	Low	76.6	Confident	65 Å²	65	54.1 Å²	54.1	35%	0.348	30%	0.299	S	S	.	.	H	α-helix	trans	-74	-39.7	-179.9	-59.2	-30.1	0	0	0	110.3	N313 T319 M320	N313-D316 HydrophobicContact CB-CB 4.38Å; N313-D316 WeakPolarHBondContact CB-OD2 3.32Å; N313-D316 PolarHBondContact ND2-OD2 2.89Å; N313-D316 WeakPolarHBondContact O-CA 3.38Å; N313-D316 PolarHBondContact O-N 3.41Å; D316-T319 WeakPolarHBondContact O-CB 3.4Å; D316-T319 PolarHBondContact O-N 3.33Å; D316-T319 VanDerWaalsContact O-N 3.16Å; D316-M320 WeakPolarHBondContact O-CG 3.49Å; D316-M320 PolarHBondContact O-N 3.47Å
317	Q	64.9	Low	76.1	Confident	6 Å²	6	53.8 Å²	53.8	3%	0.028	31%	0.309	C	S	.	.	H	α-helix	trans	-61.5	-47.1	175.5	-162.7	-171	34.4	0	0	111.2	H261 Y309 N313 T319 M320 E321	H261-Q317 PolarHBondContact CD2-OE1 3.14Å; Y309-Q317 PolarHBondContact O-NE2 3.17Å; N313-Q317 PolarHBondContact O-N 3.02Å; Q317-T319 VanDerWaalsContact C-N 3.26Å; Q317-T319 PolarHBondContact O-N 3.26Å; Q317-M320 PolarHBondContact O-N 3.15Å; Q317-E321 WeakPolarHBondContact O-CB 3.22Å; Q317-E321 PolarHBondContact O-N 2.91Å
318	I	67.6	Low	75.8	Confident	62 Å²	62	53.9 Å²	53.9	32%	0.318	31%	0.309	S	S	.	.	H	α-helix	trans	-62.5	-35.1	175	-69.8	166.9	0	0	0	111.2	L314 N322	L314-I318 WeakPolarHBondContact O-CB 3.49Å; L314-I318 WeakPolarHBondContact O-CD1 3.49Å; L314-I318 VanDerWaalsContact O-CG1 3.24Å; L314-I318 WeakPolarHBondContact O-CG1 3.31Å; L314-I318 PolarHBondContact O-N 3.09Å; I318-N322 WeakPolarHBondContact O-CB 3.38Å; I318-N322 PolarHBondContact O-N 2.84Å; I318-N322 PolarHBondContact O-ND2 2.71Å; I318-N322 VanDerWaalsContact O-ND2 3.12Å
319	T	72.4	Confident	75.8	Confident	81 Å²	81	57.3 Å²	57.3	50%	0.497	33%	0.328	S	S	.	.	H	α-helix	trans	-68.8	-49.1	177.5	-59.6	0	0	0	0	111.5	N315 D316 Q317 E321 N322 Q323	N315-T319 WeakPolarHBondContact O-CB 3.3Å; N315-T319 PolarHBondContact O-N 3.43Å; N315-T319 PolarHBondContact O-OG1 3.41Å; D316-T319 WeakPolarHBondContact O-CB 3.4Å; D316-T319 PolarHBondContact O-N 3.33Å; D316-T319 VanDerWaalsContact O-N 3.16Å; Q317-T319 VanDerWaalsContact C-N 3.26Å; Q317-T319 PolarHBondContact O-N 3.26Å; T319-E321 VanDerWaalsContact C-N 3.35Å; T319-E321 PolarHBondContact O-N 2.7Å; T319-N322 PolarHBondContact O-N 3.32Å; T319-Q323 VanDerWaalsContact O-CB 3.3Å; T319-Q323 WeakPolarHBondContact O-CB 3.44Å; T319-Q323 PolarHBondContact O-N 3.12Å
320	M	75.9	Confident	75.6	Confident	47 Å²	47	59 Å²	59	23%	0.232	35%	0.346	C	S	.	.	H	α-helix	trans	-60.3	-43	174.8	-68.8	178.3	-171.3	0	0	111.7	D316 Q317 Q323 A324	D316-M320 WeakPolarHBondContact O-CG 3.49Å; D316-M320 PolarHBondContact O-N 3.47Å; Q317-M320 PolarHBondContact O-N 3.15Å; M320-Q323 PolarHBondContact O-N 2.72Å; M320-A324 VanDerWaalsContact O-CB 3.3Å; M320-A324 WeakPolarHBondContact O-CB 3.24Å; M320-A324 PolarHBondContact O-N 3.11Å
321	E	78.4	Confident	75.9	Confident	2 Å²	2	60.9 Å²	60.9	1%	0.009	35%	0.354	C	S	.	.	H	α-helix	trans	-58.3	-49.7	176.6	-173.9	-171.5	-179.3	0	0	111.5	H261 L263 Q317 T319 A324 I325 R342	H261-E321 IonicContact ND1-OE2 2.67Å; H261-E321 PolarHBondContact ND1-OE2 3.34Å; H261-E321 VanDerWaalsContact ND1-OE2 3.09Å; L263-E321 HydrophobicContact CD1-CG 4.35Å; L263-E321 HydrophobicContact CD2-CG 3.72Å; L263-E321 HydrophobicContact CG-CG 4.17Å; Q317-E321 WeakPolarHBondContact O-CB 3.22Å; Q317-E321 PolarHBondContact O-N 2.91Å; T319-E321 VanDerWaalsContact C-N 3.35Å; T319-E321 PolarHBondContact O-N 2.7Å; E321-A324 PolarHBondContact O-N 2.71Å; E321-I325 HydrophobicContact CG-CD1 4.3Å; E321-I325 VanDerWaalsContact O-CG1 3.29Å; E321-I325 WeakPolarHBondContact O-CG1 3.43Å; E321-I325 PolarHBondContact O-N 3.24Å; E321-R342 WeakPolarHBondContact OE1-CD 3.44Å; E321-R342 WeakPolarHBondContact OE1-CG 3.49Å; E321-R342 IonicContact OE1-CZ 2.76Å; E321-R342 IonicContact OE1-NE 3.43Å; E321-R342 PolarHBondContact OE1-NE 3.16Å; E321-R342 IonicContact OE1-NH1 2.69Å; E321-R342 PolarHBondContact OE1-NH1 2.87Å; E321-R342 IonicContact OE1-NH2 3.7Å; E321-R342 PolarHBondContact OE1-NH2 3.05Å; E321-R342 IonicContact OE2-CZ 2.76Å; E321-R342 IonicContact OE2-NH1 3.7Å; E321-R342 PolarHBondContact OE2-NH1 3.18Å; E321-R342 IonicContact OE2-NH2 3.67Å; E321-R342 PolarHBondContact OE2-NH2 3.34Å
322	N	80.9	Confident	76.7	Confident	74 Å²	74	62.9 Å²	62.9	40%	0.396	36%	0.361	S	S	.	.	H	α-helix	trans	-68.5	-35.3	179.1	-69.2	-23.7	0	0	0	112.3	I318 T319 A326 R342	I318-N322 WeakPolarHBondContact O-CB 3.38Å; I318-N322 PolarHBondContact O-N 2.84Å; I318-N322 PolarHBondContact O-ND2 2.71Å; I318-N322 VanDerWaalsContact O-ND2 3.12Å; T319-N322 PolarHBondContact O-N 3.32Å; N322-A326 VanDerWaalsContact O-CB 3.3Å; N322-A326 WeakPolarHBondContact O-CB 3.43Å; N322-A326 PolarHBondContact O-N 3.35Å; N322-R342 PolarHBondContact OD1-NH2 3.21Å
323	Q	82.3	Confident	77.8	Confident	115 Å²	115	60.9 Å²	60.9	54%	0.537	35%	0.347	S	S	.	.	H	α-helix	trans	-69.4	-39.9	176.1	-173.7	175.4	-15.9	0	0	111.9	F284 T319 M320 A326 G327	F284-Q323 HydrophobicContact CD1-CG 4.4Å; T319-Q323 VanDerWaalsContact O-CB 3.3Å; T319-Q323 WeakPolarHBondContact O-CB 3.44Å; T319-Q323 PolarHBondContact O-N 3.12Å; M320-Q323 PolarHBondContact O-N 2.72Å; Q323-A326 PolarHBondContact O-N 2.87Å; Q323-G327 PolarHBondContact O-N 3.05Å
324	A	83.3	Confident	78.7	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-64.6	-42.9	173.3	0	0	0	0	0	111.6	L263 F284 Y309 M320 E321 L328	L263-A324 HydrophobicContact CD1-CB 4.21Å; F284-A324 HydrophobicContact CB-CB 4.02Å; F284-A324 HydrophobicContact CD1-CB 4.29Å; F284-A324 HydrophobicContact CG-CB 4.15Å; Y309-A324 HydrophobicContact CE2-CB 3.7Å; M320-A324 VanDerWaalsContact O-CB 3.3Å; M320-A324 WeakPolarHBondContact O-CB 3.24Å; M320-A324 PolarHBondContact O-N 3.11Å; E321-A324 PolarHBondContact O-N 2.71Å; A324-L328 VanDerWaalsContact O-CB 3.26Å; A324-L328 WeakPolarHBondContact O-CB 3.37Å; A324-L328 PolarHBondContact O-N 3.49Å
325	I	86.2	Confident	79.8	Confident	34 Å²	34	61.3 Å²	61.3	17%	0.174	36%	0.36	C	S	.	.	H	α-helix	trans	-58	-52.8	171.3	-69.8	163.7	0	0	0	110.2	L263 E321 G327 N329 V340 R342	L263-I325 HydrophobicContact CD2-CD1 3.71Å; L263-I325 HydrophobicContact CD2-CG1 3.73Å; E321-I325 HydrophobicContact CG-CD1 4.3Å; E321-I325 VanDerWaalsContact O-CG1 3.29Å; E321-I325 WeakPolarHBondContact O-CG1 3.43Å; E321-I325 PolarHBondContact O-N 3.24Å; I325-G327 PolarHBondContact O-N 2.95Å; I325-N329 WeakPolarHBondContact O-CB 3.42Å; I325-N329 PolarHBondContact O-N 2.92Å; I325-V340 HydrophobicContact CG1-CG1 4.08Å; I325-R342 HydrophobicContact CD1-CG 3.87Å
326	A	85.8	Confident	81.2	Confident	84 Å²	84	59.1 Å²	59.1	69%	0.694	34%	0.344	S	S	*	.	H	α-helix	trans	-67.1	-33.5	-174.9	0	0	0	0	0	113.9	N322 Q323	N322-A326 VanDerWaalsContact O-CB 3.3Å; N322-A326 WeakPolarHBondContact O-CB 3.43Å; N322-A326 PolarHBondContact O-N 3.35Å; Q323-A326 PolarHBondContact O-N 2.87Å
327	G	84.2	Confident	82.3	Confident	40 Å²	40	62.5 Å²	62.5	41%	0.412	36%	0.356	S	S	.	.	H	α-helix	trans	-84.8	-32.8	-179	0	0	0	0	0	114.7	Q323 I325	Q323-G327 PolarHBondContact O-N 3.05Å; I325-G327 PolarHBondContact O-N 2.95Å
328	L	87	Confident	83.6	Confident	1 Å²	1	62.4 Å²	62.4	1%	0.005	36%	0.355	C	S	.	.	H	α-helix	trans	-98.3	-27	-176.9	-65.3	167.7	0	0	0	113.6	L280 L281 F284 A324 G330 M331 L338 V340	L280-L328 HydrophobicContact CD1-CD2 4Å; L280-L328 HydrophobicContact CD2-CD2 4.27Å; L280-L328 HydrophobicContact CG-CD2 4.09Å; L281-L328 HydrophobicContact CD2-CD1 3.62Å; F284-L328 HydrophobicContact CD2-CD1 4.03Å; F284-L328 HydrophobicContact CD2-CG 4.3Å; F284-L328 HydrophobicContact CE1-CG 4.44Å; F284-L328 HydrophobicContact CE2-CD1 3.85Å; F284-L328 HydrophobicContact CE2-CD2 3.61Å; F284-L328 HydrophobicContact CE2-CG 3.64Å; F284-L328 HydrophobicContact CZ-CD1 4.34Å; F284-L328 HydrophobicContact CZ-CD2 3.85Å; F284-L328 HydrophobicContact CZ-CG 3.72Å; A324-L328 VanDerWaalsContact O-CB 3.26Å; A324-L328 WeakPolarHBondContact O-CB 3.37Å; A324-L328 PolarHBondContact O-N 3.49Å; L328-G330 PolarHBondContact O-N 3.44Å; L328-M331 HydrophobicContact CD2-CE 3.86Å; L328-M331 HydrophobicContact CD2-SD 3.98Å; L328-M331 WeakPolarHBondContact O-CB 3.47Å; L328-M331 PolarHBondContact O-N 3.5Å; L328-L338 HydrophobicContact CD2-CD1 4.46Å; L328-V340 HydrophobicContact CB-CB 4.21Å; L328-V340 HydrophobicContact CB-CG2 3.55Å
329	N	87.8	Confident	84.6	Confident	78 Å²	78	63.1 Å²	63.1	42%	0.417	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	121.1	-177.7	-168.1	24.3	0	0	0	111	I325 M331 L339 V340	I325-N329 WeakPolarHBondContact O-CB 3.42Å; I325-N329 PolarHBondContact O-N 2.92Å; N329-M331 VanDerWaalsContact C-N 3.28Å; N329-L339 WeakPolarHBondContact OD1-CA 3.46Å; N329-V340 HydrophobicContact CB-CB 4.16Å; N329-V340 PolarHBondContact OD1-N 3.16Å; N329-V340 VanDerWaalsContact OD1-N 3.16Å
330	G	84.9	Confident	85.5	Confident	39 Å²	39	59.3 Å²	59.3	40%	0.402	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	82	-4.9	-171.7	0	0	0	0	0	115	L328 Q332 L338	L328-G330 PolarHBondContact O-N 3.44Å; G330-Q332 PolarHBondContact O-N 2.77Å; G330-L338 WeakPolarHBondContact CA-O 3.48Å; G330-L338 PolarHBondContact N-O 2.98Å
331	M	88.9	Confident	86.1	Confident	61 Å²	61	61.1 Å²	61.1	30%	0.3	34%	0.344	S	S	.	.			trans	-60.9	131.7	176	-168.5	-173.4	75.3	0	0	109.9	L280 L328 N329 K337 L338	L280-M331 HydrophobicContact CD1-CE 4.02Å; L280-M331 HydrophobicContact CD2-CE 3.91Å; L328-M331 HydrophobicContact CD2-CE 3.86Å; L328-M331 HydrophobicContact CD2-SD 3.98Å; L328-M331 WeakPolarHBondContact O-CB 3.47Å; L328-M331 PolarHBondContact O-N 3.5Å; N329-M331 VanDerWaalsContact C-N 3.28Å; M331-K337 WeakPolarHBondContact O-CA 3.24Å; M331-L338 HydrophobicContact CE-CD1 3.79Å; M331-L338 PolarHBondContact O-N 3.44Å
332	Q	87.1	Confident	86.5	Confident	118 Å²	118	65.5 Å²	65.5	55%	0.551	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.7	128.1	-178.2	-174.4	152.5	-12.9	0	0	111.1	G330 G334 K336 K337	G330-Q332 PolarHBondContact O-N 2.77Å; Q332-G334 WeakPolarHBondContact CG-O 3.44Å; Q332-G334 PolarHBondContact NE2-O 3.27Å; Q332-G334 VanDerWaalsContact NE2-O 3.14Å; Q332-K336 WeakPolarHBondContact CA-O 3.38Å; Q332-K337 HydrophobicContact CB-CG 4.21Å; Q332-K337 HydrophobicContact CG-CG 4.38Å
333	L	85.5	Confident	86.6	Confident	47 Å²	47	63 Å²	63	25%	0.246	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	91.4	-175.7	-168.3	56.7	0	0	0	108.5	P269 L272 L280 K336 L338	P269-L333 HydrophobicContact CG-CG 4.22Å; P269-L333 VanDerWaalsContact CG-O 3.31Å; P269-L333 WeakPolarHBondContact CG-O 3.5Å; L272-L333 HydrophobicContact CD1-CD2 3.56Å; L272-L333 HydrophobicContact CD1-CG 4.29Å; L280-L333 HydrophobicContact CD2-CD2 4.15Å; L333-K336 PolarHBondContact N-O 3.41Å; L333-L338 HydrophobicContact CB-CD2 4.26Å; L333-L338 HydrophobicContact CB-CG 4.42Å; L333-L338 HydrophobicContact CD2-CD1 4.24Å; L333-L338 HydrophobicContact CD2-CD2 4.11Å
334	G	83.3	Confident	85.8	Confident	41 Å²	41	61.2 Å²	61.2	42%	0.423	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.2	-136.2	-163	0	0	0	0	0	111.3	Q332 K336	Q332-G334 WeakPolarHBondContact CG-O 3.44Å; Q332-G334 PolarHBondContact NE2-O 3.27Å; Q332-G334 VanDerWaalsContact NE2-O 3.14Å; G334-K336 PolarHBondContact O-N 2.94Å
335	D	85.3	Confident	84.3	Confident	166 Å²	166	66.2 Å²	66.2	89%	0.888	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-5.1	-178.4	-47.4	-51.9	0	0	0	113.5
336	K	87.8	Confident	82.3	Confident	81 Å²	81	67.9 Å²	67.9	35%	0.352	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	152.9	-178	-59.6	-170.1	-174.7	-174.5	0	111.8	G267 L268 Q332 L333 G334	G267-K336 WeakPolarHBondContact O-CB 3.41Å; G267-K336 WeakPolarHBondContact O-CD 3.46Å; L268-K336 PolarHBondContact O-NZ 2.84Å; Q332-K336 WeakPolarHBondContact CA-O 3.38Å; L333-K336 PolarHBondContact N-O 3.41Å; G334-K336 PolarHBondContact O-N 2.94Å
337	K	88.8	Confident	80	Confident	135 Å²	135	68.1 Å²	68.1	59%	0.587	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.8	136.5	165.3	-64.1	-173.4	178.5	-173.2	0	109.5	M331 Q332	M331-K337 WeakPolarHBondContact O-CA 3.24Å; Q332-K337 HydrophobicContact CB-CG 4.21Å; Q332-K337 HydrophobicContact CG-CG 4.38Å
338	L	91.6	Very high	77.8	Confident	4 Å²	4	75.4 Å²	75.4	2%	0.021	42%	0.423	C	S	.	.			trans	-73	146.9	175.8	-56.2	-169.4	0	0	0	110.4	G266 L268 L280 L328 G330 M331 L333	G266-L338 WeakPolarHBondContact O-CA 3.48Å; L268-L338 HydrophobicContact CD2-CD1 4.43Å; L268-L338 HydrophobicContact CD2-CD2 3.79Å; L268-L338 HydrophobicContact CG-CD2 4.28Å; L280-L338 HydrophobicContact CD2-CD1 4.18Å; L328-L338 HydrophobicContact CD2-CD1 4.46Å; G330-L338 WeakPolarHBondContact CA-O 3.48Å; G330-L338 PolarHBondContact N-O 2.98Å; M331-L338 HydrophobicContact CE-CD1 3.79Å; M331-L338 PolarHBondContact O-N 3.44Å; L333-L338 HydrophobicContact CB-CD2 4.26Å; L333-L338 HydrophobicContact CB-CG 4.42Å; L333-L338 HydrophobicContact CD2-CD1 4.24Å; L333-L338 HydrophobicContact CD2-CD2 4.11Å
339	L	89.3	Confident	75.7	Confident	77 Å²	77	83.3 Å²	83.3	40%	0.403	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	107.1	172.3	172.9	60.8	0	0	0	107.6	F264 I265 G266 N329	F264-L339 HydrophobicContact CE1-CD2 4.32Å; I265-L339 CarbonylContact C-O 3.51Å; I265-L339 WeakPolarHBondContact CA-O 3.29Å; G266-L339 PolarHBondContact N-O 3.3Å; G266-L339 PolarHBondContact O-N 3.46Å; N329-L339 WeakPolarHBondContact OD1-CA 3.46Å
340	V	90.9	Very high	72.9	Confident	1 Å²	1	84.1 Å²	84.1	1%	0.006	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	123.7	-179.5	-175.7	0	0	0	0	110.2	F264 I265 I325 L328 N329	F264-V340 WeakPolarHBondContact O-CA 3.25Å; I265-V340 HydrophobicContact CB-CG2 4.37Å; I265-V340 HydrophobicContact CG1-CG1 4.32Å; I265-V340 HydrophobicContact CG1-CG2 4.08Å; I265-V340 HydrophobicContact CG2-CG2 4.02Å; I325-V340 HydrophobicContact CG1-CG1 4.08Å; L328-V340 HydrophobicContact CB-CB 4.21Å; L328-V340 HydrophobicContact CB-CG2 3.55Å; N329-V340 HydrophobicContact CB-CB 4.16Å; N329-V340 PolarHBondContact OD1-N 3.16Å; N329-V340 VanDerWaalsContact OD1-N 3.16Å
341	Q	88.3	Confident	70.5	Confident	86 Å²	86	88.8 Å²	88.8	40%	0.402	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	163.2	-176.9	57.6	174.9	66.5	0	0	110.8	F264	F264-Q341 HydrophobicContact CB-CG 4.41Å; F264-Q341 HydrophobicContact CD1-CG 4.04Å; F264-Q341 PolarHBondContact N-O 3.38Å; F264-Q341 PolarHBondContact O-N 2.88Å; F264-Q341 VanDerWaalsContact O-N 3.14Å
342	R	87.1	Confident	67.9	Low	94 Å²	94	93.9 Å²	93.9	36%	0.355	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	135.8	167.9	-55.1	-172.1	177.9	-115.4	-10	109.6	A260 L263 E321 N322 I325	A260-R342 PolarHBondContact O-NH1 3.17Å; L263-R342 HydrophobicContact CD2-CG 4.45Å; E321-R342 WeakPolarHBondContact OE1-CD 3.44Å; E321-R342 WeakPolarHBondContact OE1-CG 3.49Å; E321-R342 IonicContact OE1-CZ 2.76Å; E321-R342 IonicContact OE1-NE 3.43Å; E321-R342 PolarHBondContact OE1-NE 3.16Å; E321-R342 IonicContact OE1-NH1 2.69Å; E321-R342 PolarHBondContact OE1-NH1 2.87Å; E321-R342 IonicContact OE1-NH2 3.7Å; E321-R342 PolarHBondContact OE1-NH2 3.05Å; E321-R342 IonicContact OE2-CZ 2.76Å; E321-R342 IonicContact OE2-NH1 3.7Å; E321-R342 PolarHBondContact OE2-NH1 3.18Å; E321-R342 IonicContact OE2-NH2 3.67Å; E321-R342 PolarHBondContact OE2-NH2 3.34Å; N322-R342 PolarHBondContact OD1-NH2 3.21Å; I325-R342 HydrophobicContact CD1-CG 3.87Å
343	A	82.5	Confident	65.1	Low	20 Å²	20	94.4 Å²	94.4	17%	0.165	54%	0.543	C	S	.	.			trans	-74.3	134.5	176.3	0	0	0	0	0	110.2	K262 F264 F306 V345	K262-A343 HydrophobicContact CB-CB 4.19Å; K262-A343 HydrophobicContact CD-CB 3.96Å; K262-A343 HydrophobicContact CG-CB 3.79Å; K262-A343 WeakPolarHBondContact O-CB 3.46Å; K262-A343 PolarHBondContact O-N 3.42Å; F264-A343 HydrophobicContact CB-CB 4.37Å; F306-A343 HydrophobicContact CD1-CB 4.42Å; F306-A343 HydrophobicContact CE1-CB 4.28Å; A343-V345 PolarHBondContact O-N 3.48Å
344	S	65.8	Low	62.6	Low	78 Å²	78	97 Å²	97	55%	0.545	57%	0.565	S	S	.	*			trans	-75.2	109	179	49.8	0	0	0	0	111.1	G346 S347	S344-G346 PolarHBondContact O-N 2.62Å; S344-S347 PolarHBondContact O-N 3.38Å; S344-S347 PolarHBondContact OG-OG 2.84Å
345	V	51.3	Low	60.1	Low	105 Å²	105	102.2 Å²	102.2	64%	0.636	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.3	104.2	178.3	-171.5	0	0	0	0	109.7	A343	A343-V345 PolarHBondContact O-N 3.48Å
346	G	45.4	Very low	57.4	Low	70 Å²	70	101.1 Å²	101.1	72%	0.722	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	132	-16.7	175.7	0	0	0	0	0	116	S344 K348	S344-G346 PolarHBondContact O-N 2.62Å; G346-K348 VanDerWaalsContact C-N 3.34Å; G346-K348 PolarHBondContact O-N 2.96Å
347	S	37.8	Very low	54.7	Low	88 Å²	88	105.9 Å²	105.9	62%	0.615	60%	0.599	S	S	*	*			trans	-79	70.2	-174.7	-55.1	0	0	0	0	113.8	S344	S344-S347 PolarHBondContact O-N 3.38Å; S344-S347 PolarHBondContact OG-OG 2.84Å
348	K	38	Very low	51.8	Low	193 Å²	193	105.7 Å²	105.7	84%	0.839	61%	0.609	S	S	*	*			trans	-67.8	138.4	163.5	-69.1	-176.1	-179.9	178.4	0	109.5	G346 A350	G346-K348 VanDerWaalsContact C-N 3.34Å; G346-K348 PolarHBondContact O-N 2.96Å; K348-A350 PolarHBondContact O-N 2.89Å
349	N	41.8	Very low	49.1	Very low	168 Å²	168	110.7 Å²	110.7	90%	0.898	64%	0.642	S	S	*	*			trans	-44.9	108.8	-169.5	-67.4	-18.1	0	0	0	114.5
350	A	29.8	Very low	46.3	Very low	94 Å²	94	112.4 Å²	112.4	78%	0.777	66%	0.655	S	S	*	*			trans	-111.5	130.3	157.6	0	0	0	0	0	108.2	K348	K348-A350 PolarHBondContact O-N 2.89Å
351	T	33.4	Very low	43.4	Very low	138 Å²	138	119.3 Å²	119.3	85%	0.847	70%	0.698	S	S	*	*			trans	-71.8	147.6	-178.5	38.1	0	0	0	0	112.2	T353	T351-T353 PolarHBondContact O-N 3.12Å
352	L	35	Very low	40.4	Very low	168 Å²	168	121.1 Å²	121.1	88%	0.88	71%	0.709	S	S	*	*			trans	-60.3	124.1	175.3	-80.8	69.2	0	0	0	111.4
353	T	29.2	Very low	37.6	Very low	129 Å²	129	124.6 Å²	124.6	79%	0.791	73%	0.73	S	S	*	*			trans	-160.6	132.4	141.8	26.6	0	0	0	0	111.7	T351	T351-T353 PolarHBondContact O-N 3.12Å
354	S	31.5	Very low	34.9	Very low	101 Å²	101	129.9 Å²	129.9	71%	0.706	76%	0.76	S	S	*	*			trans	49.8	93.2	148.6	-55.3	0	0	0	0	121.7
355	I	31.2	Very low	33.3	Very low	151 Å²	151	132.1 Å²	132.1	77%	0.774	77%	0.772	S	S	*	*				56.7	127.1	107.3	-66.4	159.7	0	0	0	120.1
356	N	28	Very low	32.4	Very low	143 Å²	143	130.7 Å²	130.7	77%	0.765	78%	0.779	S	S	*	*			trans	102.9	131.2	146.9	-88	-13.3	0	0	0	123
357	Q	32.7	Very low	31.9	Very low	180 Å²	180	135.2 Å²	135.2	84%	0.841	79%	0.786	S	S	*	*			trans	81.8	151.7	158.1	-67	178.1	5.8	0	0	119.9
358	T	27.8	Very low	31.6	Very low	132 Å²	132	138.2 Å²	138.2	81%	0.81	79%	0.792	S	S	*	*			trans	-125.6	-178	-154.4	52	0	0	0	0	109.9
359	P	34.8	Very low	31.4	Very low	109 Å²	109	136 Å²	136	71%	0.708	79%	0.789	S	S	*	*			cis	-134.7	153.3	2.7	35.5	-15.3	0	0	0	117.9
360	V	30.3	Very low	31.2	Very low	112 Å²	112	133.5 Å²	133.5	68%	0.679	79%	0.785	S	S	*	*			trans	23.6	124	134.4	-168.7	0	0	0	0	120.3	L362	V360-L362 HydrophobicContact CG1-CD1 3.4Å; V360-L362 VanDerWaalsContact CG1-CD1 3.4Å
361	T	28.7	Very low	31.4	Very low	146 Å²	146	134.1 Å²	134.1	90%	0.896	78%	0.784	S	S	*	*			trans	-128.9	148.7	140.5	52.1	0	0	0	0	110.1
362	L	27.1	Very low	31.8	Very low	124 Å²	124	135.3 Å²	135.3	65%	0.649	78%	0.782	S	S	*	*			trans	-106.4	134.5	-164.8	-118	68.5	0	0	0	114	V360	V360-L362 HydrophobicContact CG1-CD1 3.4Å; V360-L362 VanDerWaalsContact CG1-CD1 3.4Å
363	Q	26.5	Very low	31.9	Very low	167 Å²	167	130.6 Å²	130.6	78%	0.78	76%	0.76	S	S	*	*			trans	62.1	164.4	145.6	-65.2	166.3	-13.1	0	0	117
364	V	27.6	Very low	32.4	Very low	131 Å²	131	133.9 Å²	133.9	79%	0.794	77%	0.767	S	S	*	*			cis	-130.3	152.3	13.2	179.1	0	0	0	0	109.7
365	P	31	Very low	32.8	Very low	125 Å²	125	137.5 Å²	137.5	81%	0.812	78%	0.775	S	S	*	*			trans	-80.4	154.3	-174.8	-11.7	29.2	0	0	0	115.3
366	G	33.4	Very low	33.7	Very low	76 Å²	76	131 Å²	131	78%	0.784	74%	0.743	S	S	*	*			trans	146.4	72.3	154.4	0	0	0	0	0	118.2
367	L	33.5	Very low	35.1	Very low	165 Å²	165	126 Å²	126	86%	0.864	73%	0.725	S	S	*	*			trans	-150.2	149.8	152.5	-158.1	57.3	0	0	0	112.6
368	M	32.2	Very low	36.9	Very low	151 Å²	151	124.1 Å²	124.1	74%	0.744	72%	0.72	S	S	*	*			trans	-117.3	156.9	-161.9	56.9	-152.3	123.5	0	0	113.7
369	N	34.5	Very low	39.4	Very low	145 Å²	145	120.3 Å²	120.3	78%	0.775	70%	0.697	S	S	*	*			trans	58.2	86.2	167.9	-65.9	1.2	0	0	0	118.4
370	S	37.3	Very low	41.9	Very low	117 Å²	117	116.4 Å²	116.4	82%	0.818	67%	0.672	S	S	*	*			trans	-101	68.2	170	-64.8	0	0	0	0	112.9
371	S	34.5	Very low	44.6	Very low	107 Å²	107	114.1 Å²	114.1	75%	0.748	65%	0.654	S	S	*	*	S	Bend	trans	-134.7	8.4	-178	56.9	0	0	0	0	116.3
372	M	40.1	Very low	47.4	Very low	162 Å²	162	107.2 Å²	107.2	80%	0.798	61%	0.611	S	S	*	*	S	Bend	trans	-125.4	-1	172.3	-80.6	-165.5	144.8	0	0	114.8	Q374	M372-Q374 VanDerWaalsContact C-N 3.31Å; M372-Q374 PolarHBondContact O-N 3.43Å
373	T	38.7	Very low	50.3	Low	70 Å²	70	101.3 Å²	101.3	43%	0.429	58%	0.58	S	S	.	*	H	α-helix	trans	-76	-7.3	-164.7	-22.4	0	0	0	0	115.3	M375	T373-M375 PolarHBondContact O-N 3.43Å
374	Q	38.4	Very low	53.2	Low	198 Å²	198	93.7 Å²	93.7	93%	0.925	55%	0.546	S	S	*	.	H	α-helix	trans	-80.1	-5.3	-170.3	-73.2	-159.1	-28.4	0	0	116.4	M372	M372-Q374 VanDerWaalsContact C-N 3.31Å; M372-Q374 PolarHBondContact O-N 3.43Å
375	M	41.2	Very low	56	Low	177 Å²	177	87.6 Å²	87.6	87%	0.872	51%	0.508	S	S	*	.	H	α-helix	trans	-123.2	-23.6	173.4	-80.4	-70.7	-73.1	0	0	114.5	T373	T373-M375 PolarHBondContact O-N 3.43Å
376	A	49.3	Very low	58.4	Low	14 Å²	14	84.9 Å²	84.9	12%	0.116	49%	0.486	C	S	.	.	H	α-helix	trans	-82.5	-26.4	-173.6	0	0	0	0	0	114.3	M451 Y468	A376-M451 HydrophobicContact CB-SD 3.73Å; A376-Y468 HydrophobicContact CB-CD2 3.83Å; A376-Y468 HydrophobicContact CB-CE2 3.82Å; A376-Y468 WeakPolarHBondContact O-CD2 3.29Å; A376-Y468 PolarHBondContact O-N 3.44Å
377	G	57.7	Low	60.4	Low	37 Å²	37	85.5 Å²	85.5	38%	0.381	47%	0.471	S	S	.	.			trans	89.1	-174.7	-164.2	0	0	0	0	0	112.5
378	L	69.9	Low	62.4	Low	142 Å²	142	77.7 Å²	77.7	74%	0.743	43%	0.43	S	S	*	.	S	Bend	trans	-70.6	143.2	169.3	-66.9	175.3	0	0	0	109.6	T380 Y468	L378-T380 PolarHBondContact O-N 2.8Å; L378-Y468 VanDerWaalsContact O-CB 3.25Å; L378-Y468 WeakPolarHBondContact O-CB 3.27Å; L378-Y468 WeakPolarHBondContact O-CD2 3.44Å
379	P	80	Confident	64.6	Low	51 Å²	51	70.9 Å²	70.9	33%	0.331	40%	0.397	S	S	.	.			trans	-61.7	130.1	176.3	-23.8	34.9	0	0	0	112.9	V444 Q448 Y468	P379-V444 HydrophobicContact CB-CG1 3.58Å; P379-Q448 HydrophobicContact CB-CG 3.92Å; P379-Q448 HydrophobicContact CG-CG 4.39Å; P379-Y468 HydrophobicContact CB-CE1 4.26Å; P379-Y468 HydrophobicContact CB-CE2 4.18Å; P379-Y468 HydrophobicContact CG-CE2 4.19Å
380	T	88	Confident	66.6	Low	27 Å²	27	65.3 Å²	65.3	17%	0.166	37%	0.371	C	S	.	.			trans	-134.1	166.7	178.4	62.6	0	0	0	0	111	L378 V382 S447 C469	L378-T380 PolarHBondContact O-N 2.8Å; T380-V382 PolarHBondContact O-N 2.95Å; T380-V382 PolarHBondContact OG1-O 2.78Å; T380-V382 VanDerWaalsContact OG1-O 3.12Å; T380-S447 WeakPolarHBondContact O-CB 3.26Å; T380-S447 PolarHBondContact O-OG 3.37Å; T380-C469 VanDerWaalsContact CB-O 3.29Å; T380-C469 WeakPolarHBondContact CB-O 3.36Å; T380-C469 PolarHBondContact OG1-O 3.49Å
381	E	86.5	Confident	68.1	Low	65 Å²	65	62.8 Å²	62.8	30%	0.304	35%	0.35	S	S	.	.	S	Bend	trans	-68.4	-15.2	178.2	-58.1	-169.9	155.2	0	0	113.8	F441 V444	E381-F441 PolarHBondContact O-N 2.67Å; E381-V444 HydrophobicContact CG-CG2 3.57Å
382	V	87.7	Confident	70	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	121.5	-177.2	-173.4	0	0	0	0	111.1	T380 V439 E440 C469 P471 Y474	T380-V382 PolarHBondContact O-N 2.95Å; T380-V382 PolarHBondContact OG1-O 2.78Å; T380-V382 VanDerWaalsContact OG1-O 3.12Å; V382-V439 WeakPolarHBondContact CA-O 3.42Å; V382-E440 HydrophobicContact CG2-CB 4.2Å; V382-E440 HydrophobicContact CG2-CG 4.08Å; V382-C469 HydrophobicContact CB-CB 4.13Å; V382-C469 HydrophobicContact CG1-CB 3.85Å; V382-C469 PolarHBondContact O-N 3.07Å; V382-P471 HydrophobicContact CG2-CB 4.24Å; V382-P471 HydrophobicContact CG2-CG 4.3Å; V382-Y474 HydrophobicContact CB-CG 4.42Å; V382-Y474 HydrophobicContact CG1-CD1 4.17Å; V382-Y474 HydrophobicContact CG1-CD2 3.8Å; V382-Y474 HydrophobicContact CG1-CE2 4.34Å; V382-Y474 HydrophobicContact CG1-CG 3.71Å; V382-Y474 HydrophobicContact CG2-CD1 3.69Å; V382-Y474 HydrophobicContact CG2-CE1 4.4Å; V382-Y474 HydrophobicContact CG2-CG 3.9Å
383	L	89	Confident	71.6	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	123.9	175.2	-170.6	64.6	0	0	0	110	L385 V439 F441 A450 M451 L454 Y468	L383-L385 HydrophobicContact CD2-CD2 3.69Å; L383-L385 HydrophobicContact CG-CD2 3.88Å; L383-V439 PolarHBondContact N-O 3.2Å; L383-V439 PolarHBondContact O-N 3.46Å; L383-F441 HydrophobicContact CB-CE2 4.15Å; L383-F441 HydrophobicContact CD2-CE2 4.49Å; L383-A450 HydrophobicContact CD2-CB 3.98Å; L383-M451 HydrophobicContact CD1-CB 3.87Å; L383-M451 HydrophobicContact CD1-CG 3.94Å; L383-M451 HydrophobicContact CD2-CB 4.26Å; L383-L454 HydrophobicContact CD2-CD1 4.36Å; L383-Y468 HydrophobicContact CD1-CD1 4.4Å; L383-Y468 HydrophobicContact CD1-CE1 4.47Å
384	C	85.9	Confident	73.5	Confident	8 Å²	8	56.4 Å²	56.4	5%	0.054	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	121.7	167.6	-174.9	0	0	0	0	108.8	F438 T466 K467 C469	C384-F438 HydrophobicContact CB-CD1 3.94Å; C384-F438 HydrophobicContact CB-CE1 3.89Å; C384-F438 VanDerWaalsContact SG-CE1 3.56Å; C384-T466 CarbonylContact O-C 3.48Å; C384-T466 VanDerWaalsContact O-CA 3.26Å; C384-T466 WeakPolarHBondContact O-CA 3.41Å; C384-K467 WeakPolarHBondContact CB-O 3.5Å; C384-K467 PolarHBondContact N-O 2.72Å; C384-K467 PolarHBondContact O-N 2.91Å; C384-C469 HydrophobicContact CB-CB 4.41Å
385	L	86.6	Confident	75.3	Confident	2 Å²	2	52.2 Å²	52.2	1%	0.01	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	136.9	169.1	-44.6	174.8	0	0	0	108.4	L383 M388 V407 K436 I437 V439 L454 T466	L383-L385 HydrophobicContact CD2-CD2 3.69Å; L383-L385 HydrophobicContact CG-CD2 3.88Å; L385-M388 HydrophobicContact CB-CG 4.39Å; L385-M388 HydrophobicContact CB-SD 3.53Å; L385-M388 VanDerWaalsContact CB-SD 3.53Å; L385-M388 HydrophobicContact CD1-SD 3.66Å; L385-M388 HydrophobicContact CG-SD 4.2Å; L385-V407 HydrophobicContact CD1-CG1 4.38Å; L385-K436 WeakPolarHBondContact O-CA 3.36Å; L385-I437 HydrophobicContact CB-CB 4.24Å; L385-I437 HydrophobicContact CD1-CG2 4.24Å; L385-I437 PolarHBondContact N-O 3.42Å; L385-I437 PolarHBondContact O-N 2.99Å; L385-V439 HydrophobicContact CD1-CG2 4.07Å; L385-L454 HydrophobicContact CD1-CD1 4.35Å; L385-L454 HydrophobicContact CD2-CD1 3.99Å; L385-T466 HydrophobicContact CD2-CG2 3.48Å; L385-T466 VanDerWaalsContact CD2-CG2 3.48Å
386	M	81.1	Confident	77.1	Confident	68 Å²	68	47.8 Å²	47.8	34%	0.335	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	154.5	-172.4	-61.3	178.7	69.1	0	0	109.8	M388 K436 V465	M386-M388 VanDerWaalsContact C-N 3.25Å; M386-M388 PolarHBondContact O-N 2.95Å; M386-K436 HydrophobicContact CG-CG 4.43Å; M386-V465 HydrophobicContact CB-CB 4.24Å; M386-V465 PolarHBondContact N-O 3.26Å; M386-V465 PolarHBondContact O-N 2.67Å
387	N	75.2	Confident	78.4	Confident	89 Å²	89	53.4 Å²	53.4	48%	0.476	29%	0.294	S	S	.	.	S	Bend	trans	59.1	33.6	179.6	-168.4	54.2	0	0	0	113.6	R462 V463	N387-R462 WeakPolarHBondContact O-CB 3.48Å; N387-V463 PolarHBondContact ND2-O 3.14Å
388	M	77.3	Confident	79.3	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.005	31%	0.309	C	S	.	.	S	Bend	trans	-94.4	-56.1	172.5	-63	-169.3	67.9	0	0	111.1	W94 L385 M386 V407 I437 F459 R462 V464	W94-M388 HydrophobicContact CH2-CE 3.72Å; W94-M388 HydrophobicContact CZ2-CE 3.68Å; L385-M388 HydrophobicContact CB-CG 4.39Å; L385-M388 HydrophobicContact CB-SD 3.53Å; L385-M388 VanDerWaalsContact CB-SD 3.53Å; L385-M388 HydrophobicContact CD1-SD 3.66Å; L385-M388 HydrophobicContact CG-SD 4.2Å; M386-M388 VanDerWaalsContact C-N 3.25Å; M386-M388 PolarHBondContact O-N 2.95Å; M388-V407 HydrophobicContact CE-CG2 4.1Å; M388-I437 HydrophobicContact CB-CD1 4.17Å; M388-I437 HydrophobicContact SD-CD1 4.22Å; M388-F459 HydrophobicContact CB-CB 4.49Å; M388-F459 HydrophobicContact CB-CD1 4.05Å; M388-F459 HydrophobicContact CB-CG 4.4Å; M388-F459 HydrophobicContact CE-CB 3.7Å; M388-F459 HydrophobicContact CE-CD1 4.21Å; M388-F459 HydrophobicContact CE-CD2 3.6Å; M388-F459 HydrophobicContact CE-CE2 4.27Å; M388-F459 HydrophobicContact CE-CG 3.56Å; M388-F459 WeakPolarHBondContact O-CD1 3.25Å; M388-R462 WeakPolarHBondContact O-CD 3.43Å; M388-R462 PolarHBondContact O-NH1 3.06Å; M388-V464 HydrophobicContact CE-CG2 4.21Å; M388-V464 HydrophobicContact CG-CB 4.42Å; M388-V464 HydrophobicContact CG-CG1 4.01Å; M388-V464 HydrophobicContact CG-CG2 4.04Å; M388-V464 HydrophobicContact SD-CG1 3.94Å; M388-V464 HydrophobicContact SD-CG2 4.33Å
389	V	78.2	Confident	79.8	Confident	9 Å²	9	54.8 Å²	54.8	6%	0.055	29%	0.286	C	S	.	.			trans	-117.1	144	-169.4	-66.6	0	0	0	0	111.3	E393 L394 I403 I437 F459	V389-E393 WeakPolarHBondContact CA-OE2 3.37Å; V389-L394 HydrophobicContact CB-CD2 4.44Å; V389-L394 HydrophobicContact CG2-CD1 3.99Å; V389-L394 HydrophobicContact CG2-CD2 4.17Å; V389-L394 HydrophobicContact CG2-CG 4.28Å; V389-I403 HydrophobicContact CG1-CD1 3.82Å; V389-I403 HydrophobicContact CG1-CG1 4.21Å; V389-I403 HydrophobicContact CG1-CG2 3.85Å; V389-I437 HydrophobicContact CG1-CD1 4.02Å; V389-I437 HydrophobicContact CG2-CD1 3.91Å; V389-I437 HydrophobicContact CG2-CG1 4.03Å; V389-F459 HydrophobicContact CG1-CD1 4.5Å; V389-F459 HydrophobicContact CG1-CE1 3.85Å
390	A	75.1	Confident	79.9	Confident	27 Å²	27	54.6 Å²	54.6	22%	0.223	28%	0.279	C	S	.	.			trans	-82.2	161.9	169.6	0	0	0	0	0	110.8	E392 E393	A390-E392 VanDerWaalsContact C-N 3.26Å; A390-E392 PolarHBondContact O-N 2.93Å; A390-E393 HydrophobicContact CB-CG 4.1Å; A390-E393 PolarHBondContact N-OE2 2.76Å; A390-E393 PolarHBondContact O-N 3Å
391	V	70.4	Confident	79.6	Confident	64 Å²	64	59.7 Å²	59.7	39%	0.388	30%	0.301	S	S	.	.	S	Bend	trans	-67.2	-31.8	178.2	-176	0	0	0	0	111.4	L394 P425	V391-L394 PolarHBondContact O-N 3.34Å; V391-P425 HydrophobicContact CG1-CB 3.67Å; V391-P425 HydrophobicContact CG1-CG 3.71Å
392	E	72.9	Confident	79.4	Confident	167 Å²	167	59.8 Å²	59.8	78%	0.78	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-65.6	-42	177.7	-65.9	164.4	-160.9	0	0	112.1	A390 L394 V395	A390-E392 VanDerWaalsContact C-N 3.26Å; A390-E392 PolarHBondContact O-N 2.93Å; E392-L394 PolarHBondContact O-N 3.01Å; E392-L394 VanDerWaalsContact O-N 3.08Å; E392-V395 WeakPolarHBondContact O-CB 3.26Å; E392-V395 PolarHBondContact O-N 2.86Å; E392-V395 VanDerWaalsContact O-N 3.11Å
393	E	75.6	Confident	79.2	Confident	36 Å²	36	59.9 Å²	59.9	17%	0.168	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-66.9	-5.6	176.8	-61.7	164.1	-177.9	0	0	113.3	V389 A390 I403 R462	V389-E393 WeakPolarHBondContact CA-OE2 3.37Å; A390-E393 HydrophobicContact CB-CG 4.1Å; A390-E393 PolarHBondContact N-OE2 2.76Å; A390-E393 PolarHBondContact O-N 3Å; E393-I403 HydrophobicContact CB-CD1 4.21Å; E393-R462 VanDerWaalsContact CD-NH1 3.28Å; E393-R462 IonicContact OE1-CZ 3.32Å; E393-R462 VanDerWaalsContact OE1-CZ 3.26Å; E393-R462 IonicContact OE1-NH1 2.67Å; E393-R462 PolarHBondContact OE1-NH1 2.82Å; E393-R462 IonicContact OE1-NH2 3.49Å; E393-R462 PolarHBondContact OE1-NH2 2.61Å; E393-R462 IonicContact OE2-CZ 2.98Å; E393-R462 IonicContact OE2-NH1 3.44Å; E393-R462 PolarHBondContact OE2-NH1 3.13Å; E393-R462 IonicContact OE2-NH2 2.88Å
394	L	76.9	Confident	79.1	Confident	2 Å²	2	61.8 Å²	61.8	1%	0.01	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-108	2.7	177.5	-61.1	176.5	0	0	0	113.1	V389 V391 E392 Y400 I403 I422 R424	V389-L394 HydrophobicContact CB-CD2 4.44Å; V389-L394 HydrophobicContact CG2-CD1 3.99Å; V389-L394 HydrophobicContact CG2-CD2 4.17Å; V389-L394 HydrophobicContact CG2-CG 4.28Å; V391-L394 PolarHBondContact O-N 3.34Å; E392-L394 PolarHBondContact O-N 3.01Å; E392-L394 VanDerWaalsContact O-N 3.08Å; L394-Y400 HydrophobicContact CD2-CD2 3.95Å; L394-Y400 HydrophobicContact CD2-CE2 4.46Å; L394-I403 HydrophobicContact CD2-CD1 4.38Å; L394-I422 HydrophobicContact CD1-CG2 3.92Å; L394-I422 HydrophobicContact CD2-CG2 3.62Å; L394-I422 HydrophobicContact CG-CG2 4.43Å; L394-R424 WeakPolarHBondContact O-CD 3.44Å
395	V	76.5	Confident	79	Confident	110 Å²	110	67.2 Å²	67.2	67%	0.667	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-35.4	174.9	-176.8	0	0	0	0	111.2	E392 P425	E392-V395 WeakPolarHBondContact O-CB 3.26Å; E392-V395 PolarHBondContact O-N 2.86Å; E392-V395 VanDerWaalsContact O-N 3.11Å; V395-P425 HydrophobicContact CG2-CG 3.8Å
396	D	78.7	Confident	79	Confident	85 Å²	85	68.4 Å²	68.4	46%	0.455	35%	0.345	S	S	.	.	S	Bend	trans	-77.2	136.8	176.7	-169.7	-80.7	0	0	0	111.3	E398 E399 Y400	D396-E398 WeakPolarHBondContact OD1-CA 3.41Å; D396-E398 WeakPolarHBondContact OD1-CB 3.4Å; D396-E398 PolarHBondContact OD1-N 3.4Å; D396-E399 HydrophobicContact CB-CB 4.19Å; D396-E399 PolarHBondContact OD1-N 2.65Å; D396-Y400 WeakPolarHBondContact O-CB 3.17Å; D396-Y400 PolarHBondContact O-N 3.32Å; D396-Y400 VanDerWaalsContact O-N 3.13Å
397	E	76.3	Confident	79.3	Confident	131 Å²	131	65.2 Å²	65.2	61%	0.612	33%	0.329	S	S	*	.	H	α-helix	trans	-82.8	-28.4	-175.1	-167.7	152.3	-117.4	0	0	112.7	E401 R424	E397-E401 PolarHBondContact O-N 2.99Å; E397-R424 IonicContact OE1-NH1 2.95Å
398	E	77.9	Confident	79.9	Confident	153 Å²	153	68 Å²	68	72%	0.715	33%	0.333	S	S	*	.	H	α-helix	trans	-77.1	-43	176.2	-172.2	172.2	-174.4	0	0	110.6	D396 E401 E402	D396-E398 WeakPolarHBondContact OD1-CA 3.41Å; D396-E398 WeakPolarHBondContact OD1-CB 3.4Å; D396-E398 PolarHBondContact OD1-N 3.4Å; E398-E401 PolarHBondContact O-N 2.87Å; E398-E402 PolarHBondContact O-N 3Å
399	E	80.3	Confident	80.3	Confident	55 Å²	55	73.1 Å²	73.1	26%	0.257	36%	0.36	S	S	.	.	H	α-helix	trans	-68.4	-36.3	174.9	-172.9	154.6	-126.8	0	0	112.2	Y93 D396 E401 E402 I403	Y93-E399 PolarHBondContact OH-OE1 3.09Å; D396-E399 HydrophobicContact CB-CB 4.19Å; D396-E399 PolarHBondContact OD1-N 2.65Å; E399-E401 PolarHBondContact O-N 3.12Å; E399-E402 PolarHBondContact O-N 3.18Å; E399-I403 HydrophobicContact CG-CD1 3.85Å; E399-I403 HydrophobicContact CG-CG1 4.4Å; E399-I403 WeakPolarHBondContact O-CB 3.35Å; E399-I403 WeakPolarHBondContact O-CD1 3.21Å; E399-I403 VanDerWaalsContact O-CG1 3.24Å; E399-I403 WeakPolarHBondContact O-CG1 3.43Å; E399-I403 PolarHBondContact O-N 3.4Å
400	Y	81.4	Confident	80.7	Confident	48 Å²	48	73 Å²	73	19%	0.188	36%	0.359	C	S	.	.	H	α-helix	trans	-60.3	-43.9	172.6	178.2	-91.7	0	0	0	112.4	L394 D396 I403 V404 I422 R424	L394-Y400 HydrophobicContact CD2-CD2 3.95Å; L394-Y400 HydrophobicContact CD2-CE2 4.46Å; D396-Y400 WeakPolarHBondContact O-CB 3.17Å; D396-Y400 PolarHBondContact O-N 3.32Å; D396-Y400 VanDerWaalsContact O-N 3.13Å; Y400-I403 PolarHBondContact O-N 3.47Å; Y400-V404 HydrophobicContact CD1-CG2 4.26Å; Y400-V404 HydrophobicContact CE1-CG2 3.81Å; Y400-V404 HydrophobicContact CE2-CG2 4.31Å; Y400-V404 WeakPolarHBondContact O-CG2 3.43Å; Y400-V404 PolarHBondContact O-N 2.75Å; Y400-I422 HydrophobicContact CE2-CB 3.95Å; Y400-I422 HydrophobicContact CE2-CG2 4.19Å; Y400-R424 HydrophobicContact CD2-CG 3.79Å; Y400-R424 HydrophobicContact CE2-CG 3.49Å; Y400-R424 VanDerWaalsContact CE2-CG 3.49Å
401	E	81.5	Confident	81.3	Confident	133 Å²	133	71.8 Å²	71.8	62%	0.621	35%	0.349	S	S	*	.	H	α-helix	trans	-67.1	-40.2	176.4	-73.9	-166.4	166.3	0	0	112.3	E397 E398 E399 I403 V404 E405	E397-E401 PolarHBondContact O-N 2.99Å; E398-E401 PolarHBondContact O-N 2.87Å; E399-E401 PolarHBondContact O-N 3.12Å; E401-I403 PolarHBondContact O-N 2.99Å; E401-V404 PolarHBondContact O-N 3.48Å; E401-E405 PolarHBondContact O-N 2.95Å
402	E	82.6	Confident	82.1	Confident	68 Å²	68	71.6 Å²	71.6	32%	0.318	35%	0.351	S	S	.	.	H	α-helix	trans	-57.9	-45.8	172	-78.8	-156.8	150.9	0	0	112.1	K92 Y93 E398 E399 E405 D406	K92-E402 IonicContact NZ-OE1 2.76Å; K92-E402 IonicContact NZ-OE2 2.73Å; K92-E402 PolarHBondContact NZ-OE2 3.15Å; Y93-E402 HydrophobicContact CE2-CB 4.48Å; Y93-E402 WeakPolarHBondContact CE2-OE2 3.5Å; Y93-E402 PolarHBondContact OH-OE2 2.81Å; Y93-E402 VanDerWaalsContact OH-OE2 3.13Å; E398-E402 PolarHBondContact O-N 3Å; E399-E402 PolarHBondContact O-N 3.18Å; E402-E405 PolarHBondContact O-N 3.12Å; E402-D406 WeakPolarHBondContact O-CB 3.46Å; E402-D406 PolarHBondContact O-N 3.36Å
403	I	84.3	Confident	82.7	Confident	1 Å²	1	69.4 Å²	69.4	1%	0.005	34%	0.338	C	S	.	.	H	α-helix	trans	-61.1	-46.4	178.9	-74.1	163.6	0	0	0	110.9	V389 E393 L394 E399 Y400 E401 D406 V407 I422 I437 F459	V389-I403 HydrophobicContact CG1-CD1 3.82Å; V389-I403 HydrophobicContact CG1-CG1 4.21Å; V389-I403 HydrophobicContact CG1-CG2 3.85Å; E393-I403 HydrophobicContact CB-CD1 4.21Å; L394-I403 HydrophobicContact CD2-CD1 4.38Å; E399-I403 HydrophobicContact CG-CD1 3.85Å; E399-I403 HydrophobicContact CG-CG1 4.4Å; E399-I403 WeakPolarHBondContact O-CB 3.35Å; E399-I403 WeakPolarHBondContact O-CD1 3.21Å; E399-I403 VanDerWaalsContact O-CG1 3.24Å; E399-I403 WeakPolarHBondContact O-CG1 3.43Å; E399-I403 PolarHBondContact O-N 3.4Å; Y400-I403 PolarHBondContact O-N 3.47Å; E401-I403 PolarHBondContact O-N 2.99Å; I403-D406 PolarHBondContact O-N 3.39Å; I403-V407 HydrophobicContact CG2-CG2 4.45Å; I403-V407 WeakPolarHBondContact O-CB 3.35Å; I403-V407 VanDerWaalsContact O-CG2 3.25Å; I403-V407 WeakPolarHBondContact O-CG2 3.46Å; I403-V407 PolarHBondContact O-N 3.41Å; I403-I422 HydrophobicContact CG2-CD1 3.82Å; I403-I437 HydrophobicContact CG2-CD1 4.29Å; I403-F459 HydrophobicContact CG1-CZ 4.3Å
404	V	85.4	Confident	83.1	Confident	40 Å²	40	69 Å²	69	24%	0.242	34%	0.336	C	S	.	.	H	α-helix	trans	-64.6	-41.9	-179.8	171.6	0	0	0	0	111.3	Y400 E401 R408 I422	Y400-V404 HydrophobicContact CD1-CG2 4.26Å; Y400-V404 HydrophobicContact CE1-CG2 3.81Å; Y400-V404 HydrophobicContact CE2-CG2 4.31Å; Y400-V404 WeakPolarHBondContact O-CG2 3.43Å; Y400-V404 PolarHBondContact O-N 2.75Å; E401-V404 PolarHBondContact O-N 3.48Å; V404-R408 WeakPolarHBondContact O-CB 3.32Å; V404-R408 PolarHBondContact O-N 2.96Å; V404-R408 VanDerWaalsContact O-N 3.09Å; V404-I422 HydrophobicContact CG2-CD1 3.73Å; V404-I422 HydrophobicContact CG2-CG1 4.5Å
405	E	84.9	Confident	83.5	Confident	123 Å²	123	69.6 Å²	69.6	58%	0.575	34%	0.342	S	S	*	.	H	α-helix	trans	-63.2	-51.7	174.2	-74.9	-151.5	143.8	0	0	112.1	K89 E401 E402 V407 R408 D409	K89-E405 IonicContact NZ-OE2 3.76Å; E401-E405 PolarHBondContact O-N 2.95Å; E402-E405 PolarHBondContact O-N 3.12Å; E405-V407 VanDerWaalsContact C-N 3.33Å; E405-V407 PolarHBondContact O-N 2.95Å; E405-R408 PolarHBondContact O-N 3.27Å; E405-R408 VanDerWaalsContact O-N 3.11Å; E405-D409 PolarHBondContact O-N 3.33Å
406	D	86.3	Confident	83.9	Confident	26 Å²	26	70.4 Å²	70.4	14%	0.139	34%	0.338	C	S	.	.	H	α-helix	trans	-72.2	-26.5	-171	-143.2	22.6	0	0	0	112.4	K91 W94 E402 I403 E410	K91-D406 IonicContact NZ-OD1 2.73Å; K91-D406 PolarHBondContact NZ-OD1 2.88Å; W94-D406 PolarHBondContact NE1-O 3.27Å; E402-D406 WeakPolarHBondContact O-CB 3.46Å; E402-D406 PolarHBondContact O-N 3.36Å; I403-D406 PolarHBondContact O-N 3.39Å; D406-E410 WeakPolarHBondContact O-CB 3.41Å; D406-E410 PolarHBondContact O-N 3.31Å
407	V	87.7	Confident	84.5	Confident	1 Å²	1	67.4 Å²	67.4	1%	0.006	32%	0.323	C	S	.	.	H	α-helix	trans	-70.6	-44.8	167.3	168.6	0	0	0	0	111.2	L385 M388 I403 E405 E410 C411 I420 I437 V439	L385-V407 HydrophobicContact CD1-CG1 4.38Å; M388-V407 HydrophobicContact CE-CG2 4.1Å; I403-V407 HydrophobicContact CG2-CG2 4.45Å; I403-V407 WeakPolarHBondContact O-CB 3.35Å; I403-V407 VanDerWaalsContact O-CG2 3.25Å; I403-V407 WeakPolarHBondContact O-CG2 3.46Å; I403-V407 PolarHBondContact O-N 3.41Å; E405-V407 VanDerWaalsContact C-N 3.33Å; E405-V407 PolarHBondContact O-N 2.95Å; V407-E410 PolarHBondContact O-N 3.05Å; V407-C411 WeakPolarHBondContact O-CB 3.5Å; V407-C411 PolarHBondContact O-N 3.02Å; V407-C411 PolarHBondContact O-SG 2.89Å; V407-I420 HydrophobicContact CG1-CD1 4.42Å; V407-I437 HydrophobicContact CG1-CG2 3.99Å; V407-I437 HydrophobicContact CG2-CD1 4.04Å; V407-V439 HydrophobicContact CG1-CG2 4.26Å
408	R	87.8	Confident	85	Confident	149 Å²	149	66.5 Å²	66.5	56%	0.562	32%	0.317	S	S	*	.	H	α-helix	trans	-63.4	-45.7	-179.4	-171.7	179.9	-174	-166.5	3.8	111.8	V404 E405 E410 C411 S412 I420	V404-R408 WeakPolarHBondContact O-CB 3.32Å; V404-R408 PolarHBondContact O-N 2.96Å; V404-R408 VanDerWaalsContact O-N 3.09Å; E405-R408 PolarHBondContact O-N 3.27Å; E405-R408 VanDerWaalsContact O-N 3.11Å; R408-E410 VanDerWaalsContact C-N 3.33Å; R408-E410 PolarHBondContact O-N 3.43Å; R408-C411 PolarHBondContact O-N 2.89Å; R408-S412 VanDerWaalsContact O-CB 3.26Å; R408-S412 WeakPolarHBondContact O-CB 3.47Å; R408-S412 PolarHBondContact O-N 2.85Å; R408-S412 PolarHBondContact O-OG 2.9Å; R408-I420 HydrophobicContact CB-CD1 3.58Å; R408-I420 HydrophobicContact CG-CD1 3.85Å
409	D	86.3	Confident	85.5	Confident	108 Å²	108	61.1 Å²	61.1	58%	0.578	30%	0.296	S	S	*	.	H	α-helix	trans	-66.6	-33.2	178.8	-103.6	23.2	0	0	0	112.1	E405	E405-D409 PolarHBondContact O-N 3.33Å
410	E	86	Confident	85.9	Confident	5 Å²	5	60.3 Å²	60.3	2%	0.023	29%	0.293	C	S	.	.	H	α-helix	trans	-76.8	-41.8	175.9	-156.2	65	-147.7	0	0	112	K91 W94 D406 V407 R408 S412 K413 Y414 L454 R457	K91-E410 WeakPolarHBondContact CE-OE2 3.42Å; K91-E410 IonicContact NZ-OE2 3.83Å; K91-E410 PolarHBondContact NZ-OE2 2.97Å; W94-E410 HydrophobicContact CD2-CG 4.21Å; W94-E410 HydrophobicContact CH2-CG 4.24Å; W94-E410 HydrophobicContact CZ2-CB 3.89Å; W94-E410 HydrophobicContact CZ2-CG 3.78Å; D406-E410 WeakPolarHBondContact O-CB 3.41Å; D406-E410 PolarHBondContact O-N 3.31Å; V407-E410 PolarHBondContact O-N 3.05Å; R408-E410 VanDerWaalsContact C-N 3.33Å; R408-E410 PolarHBondContact O-N 3.43Å; E410-S412 PolarHBondContact O-N 3.29Å; E410-K413 WeakPolarHBondContact O-CB 3.41Å; E410-K413 PolarHBondContact O-N 3.36Å; E410-K413 WeakPolarHBondContact OE1-CD 3.38Å; E410-K413 IonicContact OE1-NZ 3.99Å; E410-K413 PolarHBondContact OE1-NZ 3.26Å; E410-K413 WeakPolarHBondContact OE2-CE 3.22Å; E410-K413 IonicContact OE2-NZ 2.74Å; E410-K413 PolarHBondContact OE2-NZ 2.58Å; E410-Y414 VanDerWaalsContact O-CD2 3.25Å; E410-Y414 WeakPolarHBondContact O-CD2 3.4Å; E410-Y414 VanDerWaalsContact O-CE2 3.27Å; E410-Y414 WeakPolarHBondContact O-CE2 3.44Å; E410-L454 HydrophobicContact CG-CD2 4.11Å; E410-R457 IonicContact OE1-CZ 2.71Å; E410-R457 IonicContact OE1-NH1 3.3Å; E410-R457 PolarHBondContact OE1-NH1 3.18Å
411	C	87.1	Confident	86.1	Confident	2 Å²	2	60.2 Å²	60.2	1%	0.014	29%	0.294	C	S	.	.	H	α-helix	trans	-64.9	-38	176.6	-67.5	0	0	0	0	112.5	V407 R408 K413 Y414 V417 V439 F441	V407-C411 WeakPolarHBondContact O-CB 3.5Å; V407-C411 PolarHBondContact O-N 3.02Å; V407-C411 PolarHBondContact O-SG 2.89Å; R408-C411 PolarHBondContact O-N 2.89Å; C411-K413 PolarHBondContact O-N 2.76Å; C411-Y414 PolarHBondContact O-N 2.94Å; C411-V417 HydrophobicContact CB-CG2 3.63Å; C411-V439 HydrophobicContact CB-CG1 4.21Å; C411-F441 HydrophobicContact CB-CE1 4.25Å; C411-F441 HydrophobicContact CB-CZ 3.99Å
412	S	88.1	Confident	86.4	Confident	61 Å²	61	54.1 Å²	54.1	43%	0.427	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-11.2	-179.2	-59.4	0	0	0	0	114.3	R408 E410 G415	R408-S412 VanDerWaalsContact O-CB 3.26Å; R408-S412 WeakPolarHBondContact O-CB 3.47Å; R408-S412 PolarHBondContact O-N 2.85Å; R408-S412 PolarHBondContact O-OG 2.9Å; E410-S412 PolarHBondContact O-N 3.29Å; S412-G415 WeakPolarHBondContact CA-O 3.5Å
413	K	85.6	Confident	86.3	Confident	120 Å²	120	51.3 Å²	51.3	52%	0.522	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-27.2	171.6	-63.3	172.8	179	-179.3	0	113.1	E410 C411	E410-K413 WeakPolarHBondContact O-CB 3.41Å; E410-K413 PolarHBondContact O-N 3.36Å; E410-K413 WeakPolarHBondContact OE1-CD 3.38Å; E410-K413 IonicContact OE1-NZ 3.99Å; E410-K413 PolarHBondContact OE1-NZ 3.26Å; E410-K413 WeakPolarHBondContact OE2-CE 3.22Å; E410-K413 IonicContact OE2-NZ 2.74Å; E410-K413 PolarHBondContact OE2-NZ 2.58Å; C411-K413 PolarHBondContact O-N 2.76Å
414	Y	84.4	Confident	86.1	Confident	29 Å²	29	56.3 Å²	56.3	11%	0.114	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-39	-173.2	-61.4	-78.6	0	0	0	111.2	E410 C411 K449 A450 G453 L454 R457	E410-Y414 VanDerWaalsContact O-CD2 3.25Å; E410-Y414 WeakPolarHBondContact O-CD2 3.4Å; E410-Y414 VanDerWaalsContact O-CE2 3.27Å; E410-Y414 WeakPolarHBondContact O-CE2 3.44Å; C411-Y414 PolarHBondContact O-N 2.94Å; Y414-K449 HydrophobicContact CD1-CG 4.29Å; Y414-K449 WeakPolarHBondContact CD1-O 3.31Å; Y414-K449 WeakPolarHBondContact O-CD 3.28Å; Y414-K449 WeakPolarHBondContact O-CE 3.24Å; Y414-K449 PolarHBondContact O-NZ 3.13Å; Y414-A450 HydrophobicContact CD2-CB 4.48Å; Y414-A450 HydrophobicContact CG-CB 4.18Å; Y414-G453 PolarHBondContact OH-O 2.93Å; Y414-L454 HydrophobicContact CD2-CD2 4.43Å; Y414-L454 HydrophobicContact CD2-CG 4.4Å; Y414-L454 HydrophobicContact CE2-CD2 3.76Å; Y414-L454 HydrophobicContact CE2-CG 4.06Å; Y414-R457 PolarHBondContact OH-NH2 2.89Å
415	G	84.4	Confident	85.5	Confident	13 Å²	13	56.2 Å²	56.2	13%	0.134	27%	0.273	C	S	.	.	S	Bend	trans	-171.5	-178.1	176.4	0	0	0	0	0	112.7	S412 V417 D446	S412-G415 WeakPolarHBondContact CA-O 3.5Å; G415-V417 PolarHBondContact O-N 3.11Å; G415-D446 VanDerWaalsContact CA-CG 3.42Å; G415-D446 WeakPolarHBondContact CA-OD2 3.49Å
416	Q	85.7	Confident	84.8	Confident	128 Å²	128	54.6 Å²	54.6	60%	0.598	27%	0.271	S	S	*	.			trans	-80.8	110.4	-174.6	-171.9	166.7	-6.5	0	0	111.2	K418 F441 M442 D446	Q416-K418 PolarHBondContact O-N 3.08Å; Q416-F441 CarbonylContact O-C 3.59Å; Q416-F441 WeakPolarHBondContact O-CA 3.35Å; Q416-M442 HydrophobicContact CB-CB 4.33Å; Q416-M442 HydrophobicContact CB-CG 4.27Å; Q416-M442 HydrophobicContact CB-SD 4.25Å; Q416-M442 HydrophobicContact CG-CG 4.14Å; Q416-M442 HydrophobicContact CG-SD 3.7Å; Q416-M442 PolarHBondContact O-N 2.62Å; Q416-D446 PolarHBondContact N-OD2 3.29Å
417	V	90.6	Very high	83.5	Confident	22 Å²	22	61.6 Å²	61.6	13%	0.133	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	125.1	177.2	-177.9	0	0	0	0	110.3	C411 G415 I420 V439 F441	C411-V417 HydrophobicContact CB-CG2 3.63Å; G415-V417 PolarHBondContact O-N 3.11Å; V417-I420 HydrophobicContact CG1-CD1 4.02Å; V417-I420 HydrophobicContact CG1-CG1 3.65Å; V417-V439 HydrophobicContact CG1-CG1 3.85Å; V417-V439 HydrophobicContact CG2-CG1 4.14Å; V417-F441 HydrophobicContact CG2-CD1 4.21Å; V417-F441 HydrophobicContact CG2-CE1 3.81Å; V417-F441 HydrophobicContact CG2-CZ 4.41Å
418	K	87.1	Confident	82	Confident	111 Å²	111	65.7 Å²	65.7	48%	0.483	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	-44.9	-177.9	-178.3	179.5	157.3	-156.5	0	111.4	Q416 E440 M442	Q416-K418 PolarHBondContact O-N 3.08Å; K418-E440 HydrophobicContact CB-CB 4.49Å; K418-E440 HydrophobicContact CB-CG 4.15Å; K418-E440 WeakPolarHBondContact CB-O 3.39Å; K418-E440 VanDerWaalsContact CD-CD 3.45Å; K418-E440 HydrophobicContact CD-CG 3.94Å; K418-E440 VanDerWaalsContact CD-OE2 3.31Å; K418-E440 WeakPolarHBondContact CD-OE2 3.38Å; K418-E440 VanDerWaalsContact CE-CD 3.4Å; K418-E440 VanDerWaalsContact CE-OE1 3.24Å; K418-E440 WeakPolarHBondContact CE-OE1 3.26Å; K418-E440 VanDerWaalsContact CE-OE2 3.28Å; K418-E440 WeakPolarHBondContact CE-OE2 3.31Å; K418-E440 HydrophobicContact CG-CG 4.37Å; K418-E440 VanDerWaalsContact CG-OE2 3.28Å; K418-E440 WeakPolarHBondContact CG-OE2 3.28Å; K418-E440 PolarHBondContact N-O 2.95Å; K418-E440 VanDerWaalsContact NZ-CD 3.31Å; K418-E440 IonicContact NZ-OE1 2.97Å; K418-E440 PolarHBondContact NZ-OE1 2.73Å; K418-E440 IonicContact NZ-OE2 2.91Å; K418-M442 HydrophobicContact CB-CG 3.96Å; K418-M442 HydrophobicContact CG-CG 4.44Å
419	S	87.9	Confident	80.7	Confident	40 Å²	40	64.5 Å²	64.5	28%	0.28	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	159.9	171.8	64.1	0	0	0	0	112.2	E440 Y474	S419-E440 PolarHBondContact N-O 3.37Å; S419-E440 PolarHBondContact O-N 3Å; S419-E440 VanDerWaalsContact OG-CB 3.3Å; S419-E440 WeakPolarHBondContact OG-CB 3.28Å; S419-E440 PolarHBondContact OG-OE2 3.3Å; S419-Y474 WeakPolarHBondContact OG-CE1 3.41Å; S419-Y474 PolarHBondContact OG-OH 3.05Å
420	I	88.4	Confident	79.2	Confident	39 Å²	39	68.6 Å²	68.6	20%	0.2	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	136.2	174.3	-59.7	177.3	0	0	0	107.2	V407 R408 V417 I422 I437 F438 V439	V407-I420 HydrophobicContact CG1-CD1 4.42Å; R408-I420 HydrophobicContact CB-CD1 3.58Å; R408-I420 HydrophobicContact CG-CD1 3.85Å; V417-I420 HydrophobicContact CG1-CD1 4.02Å; V417-I420 HydrophobicContact CG1-CG1 3.65Å; I420-I422 HydrophobicContact CG2-CG1 4.24Å; I420-I437 HydrophobicContact CG2-CG2 4.49Å; I420-F438 CarbonylContact C-O 3.59Å; I420-F438 WeakPolarHBondContact CA-O 3.36Å; I420-V439 HydrophobicContact CG1-CG1 4.26Å; I420-V439 HydrophobicContact CG1-CG2 4.37Å
421	E	85.3	Confident	78.2	Confident	45 Å²	45	70.2 Å²	70.2	21%	0.21	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	134	172.5	-178.8	92.8	140	0	0	109.6	F438 Y474 R477 F479	E421-F438 PolarHBondContact N-O 3.47Å; E421-F438 PolarHBondContact O-N 3.03Å; E421-Y474 HydrophobicContact CB-CE2 3.87Å; E421-R477 IonicContact OE1-CZ 3.05Å; E421-R477 IonicContact OE1-NE 2.88Å; E421-R477 PolarHBondContact OE1-NE 2.94Å; E421-R477 IonicContact OE1-NH2 2.67Å; E421-R477 PolarHBondContact OE1-NH2 2.82Å; E421-R477 IonicContact OE2-NH2 3.64Å; E421-F479 HydrophobicContact CB-CZ 4.48Å; E421-F479 HydrophobicContact CG-CE1 4.46Å; E421-F479 HydrophobicContact CG-CE2 4.03Å; E421-F479 HydrophobicContact CG-CZ 3.64Å
422	I	87.8	Confident	76.8	Confident	6 Å²	6	74.1 Å²	74.1	3%	0.031	41%	0.406	C	S	.	.			trans	-127.2	106.8	173.3	-54.1	-174.9	0	0	0	108.2	L394 Y400 I403 V404 I420 R424 I437	L394-I422 HydrophobicContact CD1-CG2 3.92Å; L394-I422 HydrophobicContact CD2-CG2 3.62Å; L394-I422 HydrophobicContact CG-CG2 4.43Å; Y400-I422 HydrophobicContact CE2-CB 3.95Å; Y400-I422 HydrophobicContact CE2-CG2 4.19Å; I403-I422 HydrophobicContact CG2-CD1 3.82Å; V404-I422 HydrophobicContact CG2-CD1 3.73Å; V404-I422 HydrophobicContact CG2-CG1 4.5Å; I420-I422 HydrophobicContact CG2-CG1 4.24Å; I422-R424 PolarHBondContact O-N 3.03Å; I422-I437 HydrophobicContact CD1-CD1 3.93Å; I422-I437 HydrophobicContact CD1-CG1 3.93Å; I422-I437 HydrophobicContact CD1-CG2 4.18Å; I422-I437 HydrophobicContact CG1-CB 4.34Å; I422-I437 HydrophobicContact CG1-CG1 3.97Å; I422-I437 HydrophobicContact CG1-CG2 4.02Å; I422-I437 HydrophobicContact CG2-CG1 4.18Å
423	P	81.9	Confident	75.6	Confident	9 Å²	9	71.6 Å²	71.6	6%	0.058	39%	0.39	C	S	.	.			trans	-64.5	107.1	179.3	-23.6	35.5	0	0	0	111.3	V431 K436 F438 F479	P423-V431 HydrophobicContact CB-CG1 4.16Å; P423-K436 WeakPolarHBondContact CD-O 3.23Å; P423-F438 HydrophobicContact CG-CD2 4.36Å; P423-F438 HydrophobicContact CG-CE2 4.11Å; P423-F479 HydrophobicContact CB-CD2 4.36Å; P423-F479 HydrophobicContact CG-CB 4.43Å; P423-F479 HydrophobicContact CG-CD2 3.58Å; P423-F479 HydrophobicContact CG-CE2 3.97Å; P423-F479 HydrophobicContact CG-CG 4.06Å
424	R	79.4	Confident	74.7	Confident	105 Å²	105	68 Å²	68	40%	0.396	38%	0.378	S	S	.	.			trans	-74.1	146	172.7	-65.8	-161.8	-71.8	-162.1	6	110.9	L394 E397 Y400 I422	L394-R424 WeakPolarHBondContact O-CD 3.44Å; E397-R424 IonicContact OE1-NH1 2.95Å; Y400-R424 HydrophobicContact CD2-CG 3.79Å; Y400-R424 HydrophobicContact CE2-CG 3.49Å; Y400-R424 VanDerWaalsContact CE2-CG 3.49Å; I422-R424 PolarHBondContact O-N 3.03Å
425	P	73.1	Confident	74	Confident	38 Å²	38	67.4 Å²	67.4	25%	0.247	38%	0.38	C	S	.	.			trans	-62.8	159.2	169.3	29.9	-36.7	0	0	0	111.4	V391 V395 T434	V391-P425 HydrophobicContact CG1-CB 3.67Å; V391-P425 HydrophobicContact CG1-CG 3.71Å; V395-P425 HydrophobicContact CG2-CG 3.8Å; P425-T434 HydrophobicContact CB-CG2 4.32Å
426	V	70.9	Confident	74	Confident	89 Å²	89	68.2 Å²	68.2	54%	0.539	38%	0.38	S	S	.	.	B	Isolated β-bridge	trans	-132.6	130.4	172.7	177.1	0	0	0	0	108.2	G428 L429 V431	V426-G428 PolarHBondContact O-N 3.33Å; V426-G428 VanDerWaalsContact O-N 3.16Å; V426-L429 PolarHBondContact O-N 2.81Å; V426-L429 VanDerWaalsContact O-O 3.12Å; V426-V431 HydrophobicContact CB-CG2 4.2Å; V426-V431 HydrophobicContact CG2-CG2 4.02Å
427	D	57.5	Low	74	Confident	174 Å²	174	62.1 Å²	62.1	93%	0.93	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	121.1	-176	-80.3	-44.2	0	0	0	112.6
428	G	56	Low	74	Confident	87 Å²	87	61.3 Å²	61.3	90%	0.897	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	9.4	-179.8	0	0	0	0	0	115.9	V426	V426-G428 PolarHBondContact O-N 3.33Å; V426-G428 VanDerWaalsContact O-N 3.16Å
429	L	61.8	Low	74.1	Confident	124 Å²	124	56 Å²	56	65%	0.649	32%	0.323	S	S	*	.	B	Isolated β-bridge	trans	-136.5	122.9	177.5	-147.6	77.5	0	0	0	112.4	V426 V431	V426-L429 PolarHBondContact O-N 2.81Å; V426-L429 VanDerWaalsContact O-O 3.12Å; L429-V431 PolarHBondContact O-N 3.04Å
430	E	55.1	Low	74.3	Confident	194 Å²	194	54.4 Å²	54.4	91%	0.907	31%	0.312	S	S	*	.			trans	-68.9	111.8	169.9	-67.2	-175.7	138.1	0	0	109.6
431	V	63.2	Low	74.4	Confident	39 Å²	39	52.6 Å²	52.6	24%	0.236	30%	0.302	C	S	.	.			trans	-92.7	120	176.7	174.7	0	0	0	0	108.7	P423 V426 L429 G433 T434	P423-V431 HydrophobicContact CB-CG1 4.16Å; V426-V431 HydrophobicContact CB-CG2 4.2Å; V426-V431 HydrophobicContact CG2-CG2 4.02Å; L429-V431 PolarHBondContact O-N 3.04Å; V431-G433 PolarHBondContact O-N 3.11Å; V431-T434 HydrophobicContact CB-CG2 3.86Å; V431-T434 HydrophobicContact CG1-CG2 4.29Å; V431-T434 WeakPolarHBondContact O-CG2 3.47Å; V431-T434 PolarHBondContact O-N 2.87Å; V431-T434 PolarHBondContact O-OG1 3.15Å
432	P	59.5	Low	74.3	Confident	83 Å²	83	55.5 Å²	55.5	54%	0.539	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	132.7	175.2	-26.6	35.6	0	0	0	111.5	F479	P432-F479 CarbonylContact C-O 3.56Å; P432-F479 WeakPolarHBondContact O-CB 3.49Å
433	G	61.7	Low	74.1	Confident	8 Å²	8	57.2 Å²	57.2	8%	0.082	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.6	6.4	175.1	0	0	0	0	0	116.7	V431 G435 K436 F479	V431-G433 PolarHBondContact O-N 3.11Å; G433-G435 PolarHBondContact O-N 2.84Å; G433-K436 VanDerWaalsContact O-CB 3.26Å; G433-K436 WeakPolarHBondContact O-CB 3.43Å; G433-K436 PolarHBondContact O-N 2.74Å; G433-F479 VanDerWaalsContact CA-O 3.29Å; G433-F479 WeakPolarHBondContact CA-O 3.48Å; G433-F479 PolarHBondContact N-O 3.34Å
434	T	68	Low	74.2	Confident	46 Å²	46	59.2 Å²	59.2	28%	0.282	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	132.9	168.4	49.8	0	0	0	0	111.3	P425 V431 K436	P425-T434 HydrophobicContact CB-CG2 4.32Å; V431-T434 HydrophobicContact CB-CG2 3.86Å; V431-T434 HydrophobicContact CG1-CG2 4.29Å; V431-T434 WeakPolarHBondContact O-CG2 3.47Å; V431-T434 PolarHBondContact O-N 2.87Å; V431-T434 PolarHBondContact O-OG1 3.15Å; T434-K436 VanDerWaalsContact C-N 3.29Å
435	G	69.3	Low	74.4	Confident	15 Å²	15	60.7 Å²	60.7	16%	0.155	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.3	-2.7	-173.9	0	0	0	0	0	114.9	G433	G433-G435 PolarHBondContact O-N 2.84Å
436	K	83.5	Confident	75.1	Confident	31 Å²	31	60.5 Å²	60.5	14%	0.135	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	153.9	164.5	-52.4	176.3	-168.9	161	0	109.6	L385 M386 P423 G433 T434 F438 F479 W480	L385-K436 WeakPolarHBondContact O-CA 3.36Å; M386-K436 HydrophobicContact CG-CG 4.43Å; P423-K436 WeakPolarHBondContact CD-O 3.23Å; G433-K436 VanDerWaalsContact O-CB 3.26Å; G433-K436 WeakPolarHBondContact O-CB 3.43Å; G433-K436 PolarHBondContact O-N 2.74Å; T434-K436 VanDerWaalsContact C-N 3.29Å; K436-F438 HydrophobicContact CB-CD2 4.44Å; K436-F438 HydrophobicContact CB-CE2 3.73Å; K436-F438 HydrophobicContact CB-CZ 4.05Å; K436-F438 HydrophobicContact CD-CE2 4.18Å; K436-F438 HydrophobicContact CD-CZ 3.74Å; K436-F479 PolarHBondContact NZ-O 2.93Å; K436-W480 PolarHBondContact NZ-O 3.37Å; K436-W480 PolarHBondContact NZ-OXT 3.07Å
437	I	86.8	Confident	75.9	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	129	175.3	-64.4	-178.7	0	0	0	107.1	L385 M388 V389 I403 V407 I420 I422 V439	L385-I437 HydrophobicContact CB-CB 4.24Å; L385-I437 HydrophobicContact CD1-CG2 4.24Å; L385-I437 PolarHBondContact N-O 3.42Å; L385-I437 PolarHBondContact O-N 2.99Å; M388-I437 HydrophobicContact CB-CD1 4.17Å; M388-I437 HydrophobicContact SD-CD1 4.22Å; V389-I437 HydrophobicContact CG1-CD1 4.02Å; V389-I437 HydrophobicContact CG2-CD1 3.91Å; V389-I437 HydrophobicContact CG2-CG1 4.03Å; I403-I437 HydrophobicContact CG2-CD1 4.29Å; V407-I437 HydrophobicContact CG1-CG2 3.99Å; V407-I437 HydrophobicContact CG2-CD1 4.04Å; I420-I437 HydrophobicContact CG2-CG2 4.49Å; I422-I437 HydrophobicContact CD1-CD1 3.93Å; I422-I437 HydrophobicContact CD1-CG1 3.93Å; I422-I437 HydrophobicContact CD1-CG2 4.18Å; I422-I437 HydrophobicContact CG1-CB 4.34Å; I422-I437 HydrophobicContact CG1-CG1 3.97Å; I422-I437 HydrophobicContact CG1-CG2 4.02Å; I422-I437 HydrophobicContact CG2-CG1 4.18Å; I437-V439 HydrophobicContact CG2-CG2 4.18Å
438	F	88.9	Confident	77.2	Confident	4 Å²	4	51 Å²	51	2%	0.018	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	128.4	-178	-62.8	-92.5	0	0	0	110	C384 I420 E421 P423 K436 C469 Y474 F479	C384-F438 HydrophobicContact CB-CD1 3.94Å; C384-F438 HydrophobicContact CB-CE1 3.89Å; C384-F438 VanDerWaalsContact SG-CE1 3.56Å; I420-F438 CarbonylContact C-O 3.59Å; I420-F438 WeakPolarHBondContact CA-O 3.36Å; E421-F438 PolarHBondContact N-O 3.47Å; E421-F438 PolarHBondContact O-N 3.03Å; P423-F438 HydrophobicContact CG-CD2 4.36Å; P423-F438 HydrophobicContact CG-CE2 4.11Å; K436-F438 HydrophobicContact CB-CD2 4.44Å; K436-F438 HydrophobicContact CB-CE2 3.73Å; K436-F438 HydrophobicContact CB-CZ 4.05Å; K436-F438 HydrophobicContact CD-CE2 4.18Å; K436-F438 HydrophobicContact CD-CZ 3.74Å; F438-C469 HydrophobicContact CD1-CB 4.41Å; F438-Y474 HydrophobicContact CB-CD2 3.75Å; F438-Y474 HydrophobicContact CB-CE2 3.45Å; F438-Y474 VanDerWaalsContact CB-CE2 3.45Å; F438-Y474 HydrophobicContact CD1-CD2 4.39Å; F438-Y474 HydrophobicContact CG-CD2 4.25Å; F438-Y474 HydrophobicContact CG-CE2 4.35Å; F438-F479 HydrophobicContact CD1-CD1 4.4Å; F438-F479 AromaticContact CD2-CD1 3.88Å; F438-F479 HydrophobicContact CD2-CD1 3.88Å; F438-F479 HydrophobicContact CD2-CE1 4.14Å; F438-F479 HydrophobicContact CD2-CG 4.43Å; F438-F479 HydrophobicContact CE1-CD1 4.09Å; F438-F479 HydrophobicContact CE2-CB 3.86Å; F438-F479 AromaticContact CE2-CD1 3.55Å; F438-F479 HydrophobicContact CE2-CD1 3.55Å; F438-F479 HydrophobicContact CE2-CE1 4.27Å; F438-F479 AromaticContact CE2-CG 3.81Å; F438-F479 HydrophobicContact CE2-CG 3.81Å; F438-F479 HydrophobicContact CG-CD1 4.3Å; F438-F479 HydrophobicContact CG-CE1 4.38Å; F438-F479 HydrophobicContact CZ-CB 3.83Å; F438-F479 AromaticContact CZ-CD1 3.65Å; F438-F479 HydrophobicContact CZ-CD1 3.65Å; F438-F479 HydrophobicContact CZ-CG 4.06Å
439	V	91.3	Very high	78.6	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	117.3	-176.5	-175.2	0	0	0	0	109.3	V382 L383 L385 V407 C411 V417 I420 I437 F441	V382-V439 WeakPolarHBondContact CA-O 3.42Å; L383-V439 PolarHBondContact N-O 3.2Å; L383-V439 PolarHBondContact O-N 3.46Å; L385-V439 HydrophobicContact CD1-CG2 4.07Å; V407-V439 HydrophobicContact CG1-CG2 4.26Å; C411-V439 HydrophobicContact CB-CG1 4.21Å; V417-V439 HydrophobicContact CG1-CG1 3.85Å; V417-V439 HydrophobicContact CG2-CG1 4.14Å; I420-V439 HydrophobicContact CG1-CG1 4.26Å; I420-V439 HydrophobicContact CG1-CG2 4.37Å; I437-V439 HydrophobicContact CG2-CG2 4.18Å; V439-F441 HydrophobicContact CB-CE2 4.02Å; V439-F441 HydrophobicContact CB-CZ 4.5Å; V439-F441 HydrophobicContact CG1-CD2 4.13Å; V439-F441 HydrophobicContact CG1-CE1 4.38Å; V439-F441 HydrophobicContact CG1-CE2 3.51Å; V439-F441 HydrophobicContact CG1-CZ 3.65Å
440	E	90.1	Very high	79.7	Confident	7 Å²	7	45.5 Å²	45.5	3%	0.033	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	127.7	173.5	-174.5	-171.1	-142.7	0	0	109.6	V382 K418 S419 Y474 H475	V382-E440 HydrophobicContact CG2-CB 4.2Å; V382-E440 HydrophobicContact CG2-CG 4.08Å; K418-E440 HydrophobicContact CB-CB 4.49Å; K418-E440 HydrophobicContact CB-CG 4.15Å; K418-E440 WeakPolarHBondContact CB-O 3.39Å; K418-E440 VanDerWaalsContact CD-CD 3.45Å; K418-E440 HydrophobicContact CD-CG 3.94Å; K418-E440 VanDerWaalsContact CD-OE2 3.31Å; K418-E440 WeakPolarHBondContact CD-OE2 3.38Å; K418-E440 VanDerWaalsContact CE-CD 3.4Å; K418-E440 VanDerWaalsContact CE-OE1 3.24Å; K418-E440 WeakPolarHBondContact CE-OE1 3.26Å; K418-E440 VanDerWaalsContact CE-OE2 3.28Å; K418-E440 WeakPolarHBondContact CE-OE2 3.31Å; K418-E440 HydrophobicContact CG-CG 4.37Å; K418-E440 VanDerWaalsContact CG-OE2 3.28Å; K418-E440 WeakPolarHBondContact CG-OE2 3.28Å; K418-E440 PolarHBondContact N-O 2.95Å; K418-E440 VanDerWaalsContact NZ-CD 3.31Å; K418-E440 IonicContact NZ-OE1 2.97Å; K418-E440 PolarHBondContact NZ-OE1 2.73Å; K418-E440 IonicContact NZ-OE2 2.91Å; S419-E440 PolarHBondContact N-O 3.37Å; S419-E440 PolarHBondContact O-N 3Å; S419-E440 VanDerWaalsContact OG-CB 3.3Å; S419-E440 WeakPolarHBondContact OG-CB 3.28Å; S419-E440 PolarHBondContact OG-OE2 3.3Å; E440-Y474 HydrophobicContact CB-CD1 4.44Å; E440-Y474 HydrophobicContact CB-CE1 3.73Å; E440-Y474 HydrophobicContact CG-CE1 4.28Å; E440-H475 IonicContact OE1-CD2 2.77Å; E440-H475 IonicContact OE1-CE1 3.26Å; E440-H475 IonicContact OE1-NE2 3.71Å; E440-H475 PolarHBondContact OE1-NE2 3.02Å
441	F	91.1	Very high	81.1	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	163.8	174.6	-67.4	-92.3	0	0	0	111	E381 L383 C411 Q416 V417 V439 S443 D446 A450	E381-F441 PolarHBondContact O-N 2.67Å; L383-F441 HydrophobicContact CB-CE2 4.15Å; L383-F441 HydrophobicContact CD2-CE2 4.49Å; C411-F441 HydrophobicContact CB-CE1 4.25Å; C411-F441 HydrophobicContact CB-CZ 3.99Å; Q416-F441 CarbonylContact O-C 3.59Å; Q416-F441 WeakPolarHBondContact O-CA 3.35Å; V417-F441 HydrophobicContact CG2-CD1 4.21Å; V417-F441 HydrophobicContact CG2-CE1 3.81Å; V417-F441 HydrophobicContact CG2-CZ 4.41Å; V439-F441 HydrophobicContact CB-CE2 4.02Å; V439-F441 HydrophobicContact CB-CZ 4.5Å; V439-F441 HydrophobicContact CG1-CD2 4.13Å; V439-F441 HydrophobicContact CG1-CE1 4.38Å; V439-F441 HydrophobicContact CG1-CE2 3.51Å; V439-F441 HydrophobicContact CG1-CZ 3.65Å; F441-S443 PolarHBondContact O-N 2.97Å; F441-D446 HydrophobicContact CB-CB 3.93Å; F441-D446 HydrophobicContact CD1-CB 4Å; F441-D446 HydrophobicContact CG-CB 4.21Å; F441-A450 HydrophobicContact CE1-CB 3.97Å; F441-A450 HydrophobicContact CE2-CB 3.85Å; F441-A450 HydrophobicContact CZ-CB 3.37Å
442	M	83.4	Confident	81.9	Confident	107 Å²	107	42.7 Å²	42.7	53%	0.527	22%	0.223	S	C	.	.	S	Bend	trans	-76.9	0.5	172.6	-71	-164.8	59.3	0	0	114.2	Q416 K418	Q416-M442 HydrophobicContact CB-CB 4.33Å; Q416-M442 HydrophobicContact CB-CG 4.27Å; Q416-M442 HydrophobicContact CB-SD 4.25Å; Q416-M442 HydrophobicContact CG-CG 4.14Å; Q416-M442 HydrophobicContact CG-SD 3.7Å; Q416-M442 PolarHBondContact O-N 2.62Å; K418-M442 HydrophobicContact CB-CG 3.96Å; K418-M442 HydrophobicContact CG-CG 4.44Å
443	S	83	Confident	82.7	Confident	42 Å²	42	39.7 Å²	39.7	29%	0.294	21%	0.207	S	C	.	.			trans	-159.6	145.8	-178.3	174.7	0	0	0	0	111.6	F441 F445 D446 S447	F441-S443 PolarHBondContact O-N 2.97Å; S443-F445 PolarHBondContact O-N 2.76Å; S443-F445 PolarHBondContact OG-N 2.89Å; S443-F445 VanDerWaalsContact OG-N 3.1Å; S443-D446 WeakPolarHBondContact O-CB 3.47Å; S443-D446 PolarHBondContact O-N 2.69Å; S443-S447 PolarHBondContact O-N 2.9Å
444	V	84.1	Confident	83.7	Confident	51 Å²	51	39.4 Å²	39.4	31%	0.309	20%	0.203	S	C	.	.	H	α-helix	trans	-62.8	-28.8	169.9	-175.9	0	0	0	0	111.8	P379 E381 S447 Q448	P379-V444 HydrophobicContact CB-CG1 3.58Å; E381-V444 HydrophobicContact CG-CG2 3.57Å; V444-S447 PolarHBondContact O-OG 3.1Å; V444-Q448 WeakPolarHBondContact O-CB 3.3Å; V444-Q448 VanDerWaalsContact O-CG 3.23Å; V444-Q448 WeakPolarHBondContact O-CG 3.28Å; V444-Q448 PolarHBondContact O-N 2.86Å
445	F	83.8	Confident	84.2	Confident	136 Å²	136	40.5 Å²	40.5	60%	0.596	21%	0.21	S	C	*	.	H	α-helix	trans	-71.3	-35.5	176.7	-173.8	-102.2	0	0	0	111.9	S443 Q448 K449	S443-F445 PolarHBondContact O-N 2.76Å; S443-F445 PolarHBondContact OG-N 2.89Å; S443-F445 VanDerWaalsContact OG-N 3.1Å; F445-Q448 PolarHBondContact O-N 2.98Å; F445-K449 WeakPolarHBondContact O-CB 3.43Å; F445-K449 PolarHBondContact O-N 3.36Å
446	D	88.4	Confident	84.2	Confident	33 Å²	33	41.6 Å²	41.6	18%	0.176	22%	0.221	C	C	.	.	H	α-helix	trans	-68.2	-43.5	177.6	-78.8	15	0	0	0	110.9	G415 Q416 F441 S443 K449 A450	G415-D446 VanDerWaalsContact CA-CG 3.42Å; G415-D446 WeakPolarHBondContact CA-OD2 3.49Å; Q416-D446 PolarHBondContact N-OD2 3.29Å; F441-D446 HydrophobicContact CB-CB 3.93Å; F441-D446 HydrophobicContact CD1-CB 4Å; F441-D446 HydrophobicContact CG-CB 4.21Å; S443-D446 WeakPolarHBondContact O-CB 3.47Å; S443-D446 PolarHBondContact O-N 2.69Å; D446-K449 PolarHBondContact O-N 2.87Å; D446-A450 WeakPolarHBondContact O-CB 3.19Å; D446-A450 PolarHBondContact O-N 2.78Å
447	S	86.7	Confident	83.9	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-67.5	-36.7	175	69.8	0	0	0	0	112.5	T380 S443 V444 A450 M451	T380-S447 WeakPolarHBondContact O-CB 3.26Å; T380-S447 PolarHBondContact O-OG 3.37Å; S443-S447 PolarHBondContact O-N 2.9Å; V444-S447 PolarHBondContact O-OG 3.1Å; S447-A450 PolarHBondContact O-N 3.23Å; S447-M451 WeakPolarHBondContact O-CB 3.4Å; S447-M451 PolarHBondContact O-N 3.19Å
448	Q	85.1	Confident	83.2	Confident	63 Å²	63	46.2 Å²	46.2	29%	0.294	24%	0.24	S	C	.	.	H	α-helix	trans	-58.8	-47	171.9	-81.3	175.2	-26.1	0	0	111.8	P379 V444 F445 A450 M451 Q452 Y468	P379-Q448 HydrophobicContact CB-CG 3.92Å; P379-Q448 HydrophobicContact CG-CG 4.39Å; V444-Q448 WeakPolarHBondContact O-CB 3.3Å; V444-Q448 VanDerWaalsContact O-CG 3.23Å; V444-Q448 WeakPolarHBondContact O-CG 3.28Å; V444-Q448 PolarHBondContact O-N 2.86Å; F445-Q448 PolarHBondContact O-N 2.98Å; Q448-A450 VanDerWaalsContact C-N 3.35Å; Q448-M451 PolarHBondContact O-N 3.01Å; Q448-Q452 WeakPolarHBondContact O-CG 3.46Å; Q448-Q452 PolarHBondContact O-N 2.91Å; Q448-Q452 VanDerWaalsContact O-N 3.09Å; Q448-Y468 WeakPolarHBondContact CA-OH 3.25Å; Q448-Y468 WeakPolarHBondContact CG-OH 3.38Å
449	K	86.1	Confident	82.5	Confident	96 Å²	96	46.1 Å²	46.1	42%	0.417	24%	0.239	S	C	.	.	H	α-helix	trans	-67.5	-35.6	178.9	-174.4	174.3	160.4	-141.3	0	111.7	Y414 F445 D446 G453	Y414-K449 HydrophobicContact CD1-CG 4.29Å; Y414-K449 WeakPolarHBondContact CD1-O 3.31Å; Y414-K449 WeakPolarHBondContact O-CD 3.28Å; Y414-K449 WeakPolarHBondContact O-CE 3.24Å; Y414-K449 PolarHBondContact O-NZ 3.13Å; F445-K449 WeakPolarHBondContact O-CB 3.43Å; F445-K449 PolarHBondContact O-N 3.36Å; D446-K449 PolarHBondContact O-N 2.87Å; K449-G453 PolarHBondContact O-N 2.8Å; K449-G453 VanDerWaalsContact O-N 3.11Å
450	A	85.3	Confident	81.6	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-66.5	-44.7	171.5	0	0	0	0	0	112.2	L383 Y414 F441 D446 S447 Q448 Q452 G453 L454	L383-A450 HydrophobicContact CD2-CB 3.98Å; Y414-A450 HydrophobicContact CD2-CB 4.48Å; Y414-A450 HydrophobicContact CG-CB 4.18Å; F441-A450 HydrophobicContact CE1-CB 3.97Å; F441-A450 HydrophobicContact CE2-CB 3.85Å; F441-A450 HydrophobicContact CZ-CB 3.37Å; D446-A450 WeakPolarHBondContact O-CB 3.19Å; D446-A450 PolarHBondContact O-N 2.78Å; S447-A450 PolarHBondContact O-N 3.23Å; Q448-A450 VanDerWaalsContact C-N 3.35Å; A450-Q452 VanDerWaalsContact C-N 3.35Å; A450-Q452 PolarHBondContact O-N 3.37Å; A450-G453 PolarHBondContact O-N 3.35Å; A450-G453 VanDerWaalsContact O-N 3.15Å; A450-L454 HydrophobicContact CB-CD1 4.18Å; A450-L454 VanDerWaalsContact O-CB 3.28Å; A450-L454 WeakPolarHBondContact O-CB 3.48Å; A450-L454 VanDerWaalsContact O-CG 3.26Å; A450-L454 WeakPolarHBondContact O-CG 3.46Å; A450-L454 PolarHBondContact O-N 3.46Å
451	M	84.8	Confident	80.3	Confident	27 Å²	27	53 Å²	53	13%	0.133	28%	0.281	C	S	.	.	H	α-helix	trans	-56.4	-48.5	177.1	-170.2	-160.1	69	0	0	111	A376 L383 S447 Q448 G453 T455 T466 Y468	A376-M451 HydrophobicContact CB-SD 3.73Å; L383-M451 HydrophobicContact CD1-CB 3.87Å; L383-M451 HydrophobicContact CD1-CG 3.94Å; L383-M451 HydrophobicContact CD2-CB 4.26Å; S447-M451 WeakPolarHBondContact O-CB 3.4Å; S447-M451 PolarHBondContact O-N 3.19Å; Q448-M451 PolarHBondContact O-N 3.01Å; M451-G453 VanDerWaalsContact C-N 3.34Å; M451-G453 PolarHBondContact O-N 3.36Å; M451-T455 VanDerWaalsContact O-CB 3.32Å; M451-T455 WeakPolarHBondContact O-CB 3.46Å; M451-T455 PolarHBondContact O-N 3.11Å; M451-T455 PolarHBondContact O-OG1 3.38Å; M451-T466 WeakPolarHBondContact CG-OG1 3.35Å; M451-Y468 HydrophobicContact CE-CE2 4.34Å; M451-Y468 HydrophobicContact SD-CD2 4.26Å; M451-Y468 HydrophobicContact SD-CE1 4.31Å; M451-Y468 HydrophobicContact SD-CE2 3.41Å; M451-Y468 WeakPolarHBondContact SD-CE2 3.34Å; M451-Y468 PolarHBondContact SD-OH 3.41Å
452	Q	78.6	Confident	79.1	Confident	148 Å²	148	56.6 Å²	56.6	69%	0.692	29%	0.294	S	S	*	.	H	α-helix	trans	-63.8	-37	177.6	-69.1	175.2	13.9	0	0	112.7	Q448 A450	Q448-Q452 WeakPolarHBondContact O-CG 3.46Å; Q448-Q452 PolarHBondContact O-N 2.91Å; Q448-Q452 VanDerWaalsContact O-N 3.09Å; A450-Q452 VanDerWaalsContact C-N 3.35Å; A450-Q452 PolarHBondContact O-N 3.37Å
453	G	77	Confident	78.5	Confident	20 Å²	20	54.4 Å²	54.4	21%	0.206	29%	0.287	C	S	.	.	H	α-helix	trans	-81.3	-29.4	-177.1	0	0	0	0	0	115.7	Y414 K449 A450 M451 R457	Y414-G453 PolarHBondContact OH-O 2.93Å; K449-G453 PolarHBondContact O-N 2.8Å; K449-G453 VanDerWaalsContact O-N 3.11Å; A450-G453 PolarHBondContact O-N 3.35Å; A450-G453 VanDerWaalsContact O-N 3.15Å; M451-G453 VanDerWaalsContact C-N 3.34Å; M451-G453 PolarHBondContact O-N 3.36Å; G453-R457 WeakPolarHBondContact O-CD 3.15Å; G453-R457 PolarHBondContact O-NE 3.3Å
454	L	82.2	Confident	78.2	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-96.9	-29.9	-173.9	-63.5	172.2	0	0	0	113.4	W94 L383 L385 E410 Y414 A450 G456 R457 V464 T466	W94-L454 HydrophobicContact CH2-CD2 3.92Å; L383-L454 HydrophobicContact CD2-CD1 4.36Å; L385-L454 HydrophobicContact CD1-CD1 4.35Å; L385-L454 HydrophobicContact CD2-CD1 3.99Å; E410-L454 HydrophobicContact CG-CD2 4.11Å; Y414-L454 HydrophobicContact CD2-CD2 4.43Å; Y414-L454 HydrophobicContact CD2-CG 4.4Å; Y414-L454 HydrophobicContact CE2-CD2 3.76Å; Y414-L454 HydrophobicContact CE2-CG 4.06Å; A450-L454 HydrophobicContact CB-CD1 4.18Å; A450-L454 VanDerWaalsContact O-CB 3.28Å; A450-L454 WeakPolarHBondContact O-CB 3.48Å; A450-L454 VanDerWaalsContact O-CG 3.26Å; A450-L454 WeakPolarHBondContact O-CG 3.46Å; A450-L454 PolarHBondContact O-N 3.46Å; L454-G456 PolarHBondContact O-N 3Å; L454-R457 WeakPolarHBondContact O-CB 3.46Å; L454-R457 PolarHBondContact O-N 3.45Å; L454-V464 WeakPolarHBondContact O-CB 3.33Å; L454-T466 HydrophobicContact CB-CG2 4.36Å
455	T	79.8	Confident	77.8	Confident	70 Å²	70	53.5 Å²	53.5	43%	0.429	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	130.4	-178.1	-56.8	0	0	0	0	111.8	M451 R457 T466	M451-T455 VanDerWaalsContact O-CB 3.32Å; M451-T455 WeakPolarHBondContact O-CB 3.46Å; M451-T455 PolarHBondContact O-N 3.11Å; M451-T455 PolarHBondContact O-OG1 3.38Å; T455-R457 VanDerWaalsContact C-N 3.26Å; T455-R457 PolarHBondContact O-N 3.41Å; T455-T466 WeakPolarHBondContact OG1-CG2 3.44Å; T455-T466 PolarHBondContact OG1-OG1 2.73Å
456	G	69	Low	77.7	Confident	37 Å²	37	47.8 Å²	47.8	38%	0.381	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.9	-2.7	177.6	0	0	0	0	0	115.5	L454 V464	L454-G456 PolarHBondContact O-N 3Å; G456-V464 PolarHBondContact N-O 2.73Å
457	R	77	Confident	77.5	Confident	65 Å²	65	51.2 Å²	51.2	25%	0.245	27%	0.269	C	S	.	.			trans	-67.3	170.9	169	-73.3	-165.3	167.7	-161.2	-6.4	112.1	W94 D95 E410 Y414 G453 L454 T455 V463 V464	W94-R457 HydrophobicContact CE3-CB 4.44Å; W94-R457 HydrophobicContact CZ3-CB 3.83Å; D95-R457 IonicContact OD2-NH1 3.09Å; E410-R457 IonicContact OE1-CZ 2.71Å; E410-R457 IonicContact OE1-NH1 3.3Å; E410-R457 PolarHBondContact OE1-NH1 3.18Å; Y414-R457 PolarHBondContact OH-NH2 2.89Å; G453-R457 WeakPolarHBondContact O-CD 3.15Å; G453-R457 PolarHBondContact O-NE 3.3Å; L454-R457 WeakPolarHBondContact O-CB 3.46Å; L454-R457 PolarHBondContact O-N 3.45Å; T455-R457 VanDerWaalsContact C-N 3.26Å; T455-R457 PolarHBondContact O-N 3.41Å; R457-V463 WeakPolarHBondContact O-CA 3.25Å; R457-V464 HydrophobicContact CB-CG2 4.32Å; R457-V464 PolarHBondContact O-N 2.97Å
458	K	70.8	Confident	77.5	Confident	64 Å²	64	52.2 Å²	52.2	28%	0.278	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	130.1	171.3	-78.8	-169.6	165.1	-167.3	0	113.1	W94 N461 R462	W94-K458 VanDerWaalsContact CE3-O 3.29Å; K458-N461 WeakPolarHBondContact CE-O 3.35Å; K458-N461 PolarHBondContact NZ-OD1 3.48Å; K458-R462 VanDerWaalsContact CA-O 3.22Å; K458-R462 WeakPolarHBondContact CA-O 3.24Å
459	F	75.2	Confident	77.3	Confident	1 Å²	1	50.2 Å²	50.2	0%	0.004	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	128.7	165.6	-175.7	-86.4	0	0	0	108.3	Y93 W94 M388 V389 I403 N461 R462 V464	Y93-F459 HydrophobicContact CD1-CZ 4.46Å; Y93-F459 HydrophobicContact CD2-CE2 4.48Å; Y93-F459 HydrophobicContact CD2-CZ 4.21Å; Y93-F459 HydrophobicContact CG-CE1 4.35Å; Y93-F459 HydrophobicContact CG-CE2 4.17Å; Y93-F459 AromaticContact CG-CZ 3.89Å; Y93-F459 HydrophobicContact CG-CZ 3.89Å; Y93-F459 CarbonylContact O-C 3.58Å; Y93-F459 VanDerWaalsContact O-CA 3.31Å; Y93-F459 WeakPolarHBondContact O-CA 3.23Å; W94-F459 HydrophobicContact CD2-CD2 4.02Å; W94-F459 AromaticContact CE2-CD2 3.6Å; W94-F459 HydrophobicContact CG-CD2 4.36Å; W94-F459 HydrophobicContact CH2-CD2 4.46Å; W94-F459 AromaticContact CZ2-CD2 3.86Å; W94-F459 HydrophobicContact CZ2-CD2 3.86Å; W94-F459 HydrophobicContact CZ3-CB 4.47Å; W94-F459 AromaticContact NE1-CD2 3.7Å; W94-F459 AromaticContact NE1-CE2 3.86Å; M388-F459 HydrophobicContact CB-CB 4.49Å; M388-F459 HydrophobicContact CB-CD1 4.05Å; M388-F459 HydrophobicContact CB-CG 4.4Å; M388-F459 HydrophobicContact CE-CB 3.7Å; M388-F459 HydrophobicContact CE-CD1 4.21Å; M388-F459 HydrophobicContact CE-CD2 3.6Å; M388-F459 HydrophobicContact CE-CE2 4.27Å; M388-F459 HydrophobicContact CE-CG 3.56Å; M388-F459 WeakPolarHBondContact O-CD1 3.25Å; V389-F459 HydrophobicContact CG1-CD1 4.5Å; V389-F459 HydrophobicContact CG1-CE1 3.85Å; I403-F459 HydrophobicContact CG1-CZ 4.3Å; F459-N461 PolarHBondContact O-N 3.39Å; F459-N461 VanDerWaalsContact O-N 3.12Å; F459-R462 PolarHBondContact N-O 3Å; F459-R462 WeakPolarHBondContact O-CA 3.42Å; F459-R462 WeakPolarHBondContact O-CB 3.44Å; F459-R462 PolarHBondContact O-N 3.37Å; F459-V464 HydrophobicContact CB-CG2 4.01Å
460	A	71.5	Confident	77.1	Confident	31 Å²	31	49.9 Å²	49.9	26%	0.256	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.6	39.3	-175.5	0	0	0	0	0	113.1	Y93 R462	Y93-A460 HydrophobicContact CD1-CB 4.07Å; Y93-A460 PolarHBondContact O-N 3.48Å; A460-R462 PolarHBondContact O-N 3.49Å
461	N	64.4	Low	76.8	Confident	122 Å²	122	51.4 Å²	51.4	65%	0.652	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.8	-13	-171.9	-161.1	24.4	0	0	0	116.3	K458 F459	K458-N461 WeakPolarHBondContact CE-O 3.35Å; K458-N461 PolarHBondContact NZ-OD1 3.48Å; F459-N461 PolarHBondContact O-N 3.39Å; F459-N461 VanDerWaalsContact O-N 3.12Å
462	R	64.1	Low	76.4	Confident	75 Å²	75	55.3 Å²	55.3	28%	0.283	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	156.6	171.6	-50.6	-172.3	-175.5	98.8	6.1	110.9	N387 M388 E393 K458 F459 A460	N387-R462 WeakPolarHBondContact O-CB 3.48Å; M388-R462 WeakPolarHBondContact O-CD 3.43Å; M388-R462 PolarHBondContact O-NH1 3.06Å; E393-R462 VanDerWaalsContact CD-NH1 3.28Å; E393-R462 IonicContact OE1-CZ 3.32Å; E393-R462 VanDerWaalsContact OE1-CZ 3.26Å; E393-R462 IonicContact OE1-NH1 2.67Å; E393-R462 PolarHBondContact OE1-NH1 2.82Å; E393-R462 IonicContact OE1-NH2 3.49Å; E393-R462 PolarHBondContact OE1-NH2 2.61Å; E393-R462 IonicContact OE2-CZ 2.98Å; E393-R462 IonicContact OE2-NH1 3.44Å; E393-R462 PolarHBondContact OE2-NH1 3.13Å; E393-R462 IonicContact OE2-NH2 2.88Å; K458-R462 VanDerWaalsContact CA-O 3.22Å; K458-R462 WeakPolarHBondContact CA-O 3.24Å; F459-R462 PolarHBondContact N-O 3Å; F459-R462 WeakPolarHBondContact O-CA 3.42Å; F459-R462 WeakPolarHBondContact O-CB 3.44Å; F459-R462 PolarHBondContact O-N 3.37Å; A460-R462 PolarHBondContact O-N 3.49Å
463	V	71.1	Confident	76.4	Confident	60 Å²	60	48.6 Å²	48.6	36%	0.364	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	121.1	-178.2	177.9	0	0	0	0	110.3	N387 R457 V465	N387-V463 PolarHBondContact ND2-O 3.14Å; R457-V463 WeakPolarHBondContact O-CA 3.25Å; V463-V465 PolarHBondContact O-N 2.91Å
464	V	77.8	Confident	76.7	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.006	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-67.1	119.8	179.4	-172.8	0	0	0	0	110.1	W94 M388 L454 G456 R457 F459 T466	W94-V464 HydrophobicContact CH2-CG2 4.15Å; W94-V464 HydrophobicContact CZ3-CG2 4.05Å; M388-V464 HydrophobicContact CE-CG2 4.21Å; M388-V464 HydrophobicContact CG-CB 4.42Å; M388-V464 HydrophobicContact CG-CG1 4.01Å; M388-V464 HydrophobicContact CG-CG2 4.04Å; M388-V464 HydrophobicContact SD-CG1 3.94Å; M388-V464 HydrophobicContact SD-CG2 4.33Å; L454-V464 WeakPolarHBondContact O-CB 3.33Å; G456-V464 PolarHBondContact N-O 2.73Å; R457-V464 HydrophobicContact CB-CG2 4.32Å; R457-V464 PolarHBondContact O-N 2.97Å; F459-V464 HydrophobicContact CB-CG2 4.01Å; V464-T466 HydrophobicContact CG1-CG2 3.98Å
465	V	76.1	Confident	76.7	Confident	74 Å²	74	53.2 Å²	53.2	45%	0.448	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	143.4	169.2	177.8	0	0	0	0	107.8	M386 V463	M386-V465 HydrophobicContact CB-CB 4.24Å; M386-V465 PolarHBondContact N-O 3.26Å; M386-V465 PolarHBondContact O-N 2.67Å; V463-V465 PolarHBondContact O-N 2.91Å
466	T	81.6	Confident	76.7	Confident	16 Å²	16	57.7 Å²	57.7	10%	0.098	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	155.1	-180	81.6	0	0	0	0	112.5	C384 L385 M451 L454 T455 V464	C384-T466 CarbonylContact O-C 3.48Å; C384-T466 VanDerWaalsContact O-CA 3.26Å; C384-T466 WeakPolarHBondContact O-CA 3.41Å; L385-T466 HydrophobicContact CD2-CG2 3.48Å; L385-T466 VanDerWaalsContact CD2-CG2 3.48Å; M451-T466 WeakPolarHBondContact CG-OG1 3.35Å; L454-T466 HydrophobicContact CB-CG2 4.36Å; T455-T466 WeakPolarHBondContact OG1-CG2 3.44Å; T455-T466 PolarHBondContact OG1-OG1 2.73Å; V464-T466 HydrophobicContact CG1-CG2 3.98Å
467	K	84.2	Confident	76.9	Confident	105 Å²	105	63.9 Å²	63.9	46%	0.457	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	144.2	-179	-171.8	-165.7	171.1	-168.8	0	109.7	C384	C384-K467 WeakPolarHBondContact CB-O 3.5Å; C384-K467 PolarHBondContact N-O 2.72Å; C384-K467 PolarHBondContact O-N 2.91Å
468	Y	85.7	Confident	76.6	Confident	20 Å²	20	64.2 Å²	64.2	8%	0.078	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	140.4	170.1	-65.2	-66	0	0	0	111	A376 L378 P379 L383 Q448 M451	A376-Y468 HydrophobicContact CB-CD2 3.83Å; A376-Y468 HydrophobicContact CB-CE2 3.82Å; A376-Y468 WeakPolarHBondContact O-CD2 3.29Å; A376-Y468 PolarHBondContact O-N 3.44Å; L378-Y468 VanDerWaalsContact O-CB 3.25Å; L378-Y468 WeakPolarHBondContact O-CB 3.27Å; L378-Y468 WeakPolarHBondContact O-CD2 3.44Å; P379-Y468 HydrophobicContact CB-CE1 4.26Å; P379-Y468 HydrophobicContact CB-CE2 4.18Å; P379-Y468 HydrophobicContact CG-CE2 4.19Å; L383-Y468 HydrophobicContact CD1-CD1 4.4Å; L383-Y468 HydrophobicContact CD1-CE1 4.47Å; Q448-Y468 WeakPolarHBondContact CA-OH 3.25Å; Q448-Y468 WeakPolarHBondContact CG-OH 3.38Å; M451-Y468 HydrophobicContact CE-CE2 4.34Å; M451-Y468 HydrophobicContact SD-CD2 4.26Å; M451-Y468 HydrophobicContact SD-CE1 4.31Å; M451-Y468 HydrophobicContact SD-CE2 3.41Å; M451-Y468 WeakPolarHBondContact SD-CE2 3.34Å; M451-Y468 PolarHBondContact SD-OH 3.41Å
469	C	80.5	Confident	76.6	Confident	22 Å²	22	62 Å²	62	15%	0.149	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	146	175.4	-165.7	0	0	0	0	109.7	T380 V382 C384 F438 P471	T380-C469 VanDerWaalsContact CB-O 3.29Å; T380-C469 WeakPolarHBondContact CB-O 3.36Å; T380-C469 PolarHBondContact OG1-O 3.49Å; V382-C469 HydrophobicContact CB-CB 4.13Å; V382-C469 HydrophobicContact CG1-CB 3.85Å; V382-C469 PolarHBondContact O-N 3.07Å; C384-C469 HydrophobicContact CB-CB 4.41Å; F438-C469 HydrophobicContact CD1-CB 4.41Å; C469-P471 WeakPolarHBondContact O-CD 3.5Å
470	D	82.1	Confident	75.6	Confident	88 Å²	88	72.7 Å²	72.7	47%	0.471	34%	0.344	S	S	.	.			trans	-68.4	123.3	174.7	-173.3	-31.7	0	0	0	109.6	D472 A473 Y474	D470-D472 PolarHBondContact O-N 3.39Å; D470-D472 WeakPolarHBondContact OD1-CB 3.37Å; D470-D472 PolarHBondContact OD1-N 2.88Å; D470-A473 HydrophobicContact CB-CB 3.94Å; D470-A473 WeakPolarHBondContact O-CB 3.41Å; D470-A473 PolarHBondContact O-N 3.49Å; D470-Y474 PolarHBondContact O-N 3.3Å
471	P	79.9	Confident	75.8	Confident	32 Å²	32	74.8 Å²	74.8	21%	0.208	35%	0.348	C	S	.	.	H	α-helix	trans	-55.9	-37.3	177.6	-24.9	35.3	0	0	0	113.1	V382 C469 A473 Y474 H475	V382-P471 HydrophobicContact CG2-CB 4.24Å; V382-P471 HydrophobicContact CG2-CG 4.3Å; C469-P471 WeakPolarHBondContact O-CD 3.5Å; P471-A473 VanDerWaalsContact C-N 3.31Å; P471-A473 PolarHBondContact O-N 3.09Å; P471-Y474 PolarHBondContact O-N 2.82Å; P471-H475 VanDerWaalsContact O-CG 3.32Å; P471-H475 PolarHBondContact O-N 3.43Å; P471-H475 PolarHBondContact O-ND1 3.22Å
472	D	75.6	Confident	76.4	Confident	109 Å²	109	72.3 Å²	72.3	58%	0.583	33%	0.332	S	S	*	.	H	α-helix	trans	-69.1	-30.8	178.1	-77.8	-37.9	0	0	0	111.6	D470 R476	D470-D472 PolarHBondContact O-N 3.39Å; D470-D472 WeakPolarHBondContact OD1-CB 3.37Å; D470-D472 PolarHBondContact OD1-N 2.88Å; D472-R476 WeakPolarHBondContact O-CB 3.21Å; D472-R476 VanDerWaalsContact O-CG 3.28Å; D472-R476 WeakPolarHBondContact O-CG 3.43Å; D472-R476 PolarHBondContact O-N 2.95Å; D472-R476 PolarHBondContact O-NE 2.94Å; D472-R476 PolarHBondContact O-NH2 3.02Å
473	A	79.5	Confident	77	Confident	8 Å²	8	72.2 Å²	72.2	7%	0.066	34%	0.335	C	S	.	.	H	α-helix	trans	-72.4	-42.2	172.7	0	0	0	0	0	111.1	D470 P471 R476 R477 D478	D470-A473 HydrophobicContact CB-CB 3.94Å; D470-A473 WeakPolarHBondContact O-CB 3.41Å; D470-A473 PolarHBondContact O-N 3.49Å; P471-A473 VanDerWaalsContact C-N 3.31Å; P471-A473 PolarHBondContact O-N 3.09Å; A473-R476 CarbonylContact O-C 3.56Å; A473-R476 PolarHBondContact O-N 2.88Å; A473-R477 PolarHBondContact O-N 2.83Å; A473-R477 VanDerWaalsContact O-N 3.12Å; A473-D478 HydrophobicContact CB-CB 4.37Å; A473-D478 PolarHBondContact O-N 2.8Å
474	Y	83.2	Confident	77.4	Confident	16 Å²	16	72.9 Å²	72.9	6%	0.063	33%	0.333	C	S	.	.	H	α-helix	trans	-59.8	-50.1	176.5	176.3	-109.6	0	0	0	112.4	V382 S419 E421 F438 E440 D470 P471 R476 R477 F479	V382-Y474 HydrophobicContact CB-CG 4.42Å; V382-Y474 HydrophobicContact CG1-CD1 4.17Å; V382-Y474 HydrophobicContact CG1-CD2 3.8Å; V382-Y474 HydrophobicContact CG1-CE2 4.34Å; V382-Y474 HydrophobicContact CG1-CG 3.71Å; V382-Y474 HydrophobicContact CG2-CD1 3.69Å; V382-Y474 HydrophobicContact CG2-CE1 4.4Å; V382-Y474 HydrophobicContact CG2-CG 3.9Å; S419-Y474 WeakPolarHBondContact OG-CE1 3.41Å; S419-Y474 PolarHBondContact OG-OH 3.05Å; E421-Y474 HydrophobicContact CB-CE2 3.87Å; F438-Y474 HydrophobicContact CB-CD2 3.75Å; F438-Y474 HydrophobicContact CB-CE2 3.45Å; F438-Y474 VanDerWaalsContact CB-CE2 3.45Å; F438-Y474 HydrophobicContact CD1-CD2 4.39Å; F438-Y474 HydrophobicContact CG-CD2 4.25Å; F438-Y474 HydrophobicContact CG-CE2 4.35Å; E440-Y474 HydrophobicContact CB-CD1 4.44Å; E440-Y474 HydrophobicContact CB-CE1 3.73Å; E440-Y474 HydrophobicContact CG-CE1 4.28Å; D470-Y474 PolarHBondContact O-N 3.3Å; P471-Y474 PolarHBondContact O-N 2.82Å; Y474-R476 VanDerWaalsContact C-N 3.26Å; Y474-R476 PolarHBondContact O-N 2.66Å; Y474-R477 WeakPolarHBondContact O-CA 3.12Å; Y474-R477 PolarHBondContact O-N 3.2Å; Y474-F479 AromaticContact CD2-CE1 3.97Å; Y474-F479 HydrophobicContact CD2-CE1 3.97Å; Y474-F479 HydrophobicContact CE2-CE1 4.43Å
475	H	81.1	Confident	77.4	Confident	102 Å²	102	77.4 Å²	77.4	47%	0.472	35%	0.353	S	S	.	.	H	α-helix	trans	-67	-25.5	178	-61	151.1	0	0	0	113.2	E440 P471 R477	E440-H475 IonicContact OE1-CD2 2.77Å; E440-H475 IonicContact OE1-CE1 3.26Å; E440-H475 IonicContact OE1-NE2 3.71Å; E440-H475 PolarHBondContact OE1-NE2 3.02Å; P471-H475 VanDerWaalsContact O-CG 3.32Å; P471-H475 PolarHBondContact O-N 3.43Å; P471-H475 PolarHBondContact O-ND1 3.22Å; H475-R477 VanDerWaalsContact C-N 3.29Å
476	R	79.8	Confident	77.4	Confident	164 Å²	164	77.6 Å²	77.6	62%	0.619	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-5.3	170.3	-75.9	-179.9	-72.5	145.6	-0.7	114	D472 A473 Y474 D478	D472-R476 WeakPolarHBondContact O-CB 3.21Å; D472-R476 VanDerWaalsContact O-CG 3.28Å; D472-R476 WeakPolarHBondContact O-CG 3.43Å; D472-R476 PolarHBondContact O-N 2.95Å; D472-R476 PolarHBondContact O-NE 2.94Å; D472-R476 PolarHBondContact O-NH2 3.02Å; A473-R476 CarbonylContact O-C 3.56Å; A473-R476 PolarHBondContact O-N 2.88Å; Y474-R476 VanDerWaalsContact C-N 3.26Å; Y474-R476 PolarHBondContact O-N 2.66Å; R476-D478 VanDerWaalsContact C-N 3.27Å; R476-D478 HydrophobicContact CB-CB 4.35Å; R476-D478 PolarHBondContact O-N 2.96Å
477	R	73	Confident	77.1	Confident	167 Å²	167	82 Å²	82	63%	0.63	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.1	35.6	-174.7	-54.6	176.8	87.2	-172.3	9	113.2	E421 A473 Y474 H475 F479	E421-R477 IonicContact OE1-CZ 3.05Å; E421-R477 IonicContact OE1-NE 2.88Å; E421-R477 PolarHBondContact OE1-NE 2.94Å; E421-R477 IonicContact OE1-NH2 2.67Å; E421-R477 PolarHBondContact OE1-NH2 2.82Å; E421-R477 IonicContact OE2-NH2 3.64Å; A473-R477 PolarHBondContact O-N 2.83Å; A473-R477 VanDerWaalsContact O-N 3.12Å; Y474-R477 WeakPolarHBondContact O-CA 3.12Å; Y474-R477 PolarHBondContact O-N 3.2Å; H475-R477 VanDerWaalsContact C-N 3.29Å; R477-F479 VanDerWaalsContact CA-CZ 3.41Å; R477-F479 HydrophobicContact CB-CD2 4.4Å; R477-F479 HydrophobicContact CB-CE1 4.45Å; R477-F479 HydrophobicContact CB-CE2 3.6Å; R477-F479 HydrophobicContact CB-CZ 3.62Å; R477-F479 HydrophobicContact CG-CE2 4.2Å; R477-F479 HydrophobicContact CG-CZ 3.9Å; R477-F479 WeakPolarHBondContact O-CD2 3.26Å; R477-F479 PolarHBondContact O-N 3.04Å
478	D	71.8	Confident	76.6	Confident	71 Å²	71	80.2 Å²	80.2	38%	0.38	36%	0.358	S	S	.	.			trans	-93.2	70.7	-174	-168.1	32.3	0	0	0	110.8	A473 R476 W480	A473-D478 HydrophobicContact CB-CB 4.37Å; A473-D478 PolarHBondContact O-N 2.8Å; R476-D478 VanDerWaalsContact C-N 3.27Å; R476-D478 HydrophobicContact CB-CB 4.35Å; R476-D478 PolarHBondContact O-N 2.96Å; D478-W480 VanDerWaalsContact O-CD1 3.28Å; D478-W480 PolarHBondContact O-N 2.79Å; D478-W480 VanDerWaalsContact O-N 3.16Å; D478-W480 PolarHBondContact OD2-NE1 3.06Å
479	F	70.5	Confident	75.8	Confident	17 Å²	17	85.3 Å²	85.3	8%	0.075	38%	0.381	C	S	.	.			trans	-88.2	39.9	-163	-53.5	-52	0	0	0	116.3	E421 P423 P432 G433 K436 F438 Y474 R477	E421-F479 HydrophobicContact CB-CZ 4.48Å; E421-F479 HydrophobicContact CG-CE1 4.46Å; E421-F479 HydrophobicContact CG-CE2 4.03Å; E421-F479 HydrophobicContact CG-CZ 3.64Å; P423-F479 HydrophobicContact CB-CD2 4.36Å; P423-F479 HydrophobicContact CG-CB 4.43Å; P423-F479 HydrophobicContact CG-CD2 3.58Å; P423-F479 HydrophobicContact CG-CE2 3.97Å; P423-F479 HydrophobicContact CG-CG 4.06Å; P432-F479 CarbonylContact C-O 3.56Å; P432-F479 WeakPolarHBondContact O-CB 3.49Å; G433-F479 VanDerWaalsContact CA-O 3.29Å; G433-F479 WeakPolarHBondContact CA-O 3.48Å; G433-F479 PolarHBondContact N-O 3.34Å; K436-F479 PolarHBondContact NZ-O 2.93Å; F438-F479 HydrophobicContact CD1-CD1 4.4Å; F438-F479 AromaticContact CD2-CD1 3.88Å; F438-F479 HydrophobicContact CD2-CD1 3.88Å; F438-F479 HydrophobicContact CD2-CE1 4.14Å; F438-F479 HydrophobicContact CD2-CG 4.43Å; F438-F479 HydrophobicContact CE1-CD1 4.09Å; F438-F479 HydrophobicContact CE2-CB 3.86Å; F438-F479 AromaticContact CE2-CD1 3.55Å; F438-F479 HydrophobicContact CE2-CD1 3.55Å; F438-F479 HydrophobicContact CE2-CE1 4.27Å; F438-F479 AromaticContact CE2-CG 3.81Å; F438-F479 HydrophobicContact CE2-CG 3.81Å; F438-F479 HydrophobicContact CG-CD1 4.3Å; F438-F479 HydrophobicContact CG-CE1 4.38Å; F438-F479 HydrophobicContact CZ-CB 3.83Å; F438-F479 AromaticContact CZ-CD1 3.65Å; F438-F479 HydrophobicContact CZ-CD1 3.65Å; F438-F479 HydrophobicContact CZ-CG 4.06Å; Y474-F479 AromaticContact CD2-CE1 3.97Å; Y474-F479 HydrophobicContact CD2-CE1 3.97Å; Y474-F479 HydrophobicContact CE2-CE1 4.43Å; R477-F479 VanDerWaalsContact CA-CZ 3.41Å; R477-F479 HydrophobicContact CB-CD2 4.4Å; R477-F479 HydrophobicContact CB-CE1 4.45Å; R477-F479 HydrophobicContact CB-CE2 3.6Å; R477-F479 HydrophobicContact CB-CZ 3.62Å; R477-F479 HydrophobicContact CG-CE2 4.2Å; R477-F479 HydrophobicContact CG-CZ 3.9Å; R477-F479 WeakPolarHBondContact O-CD2 3.26Å; R477-F479 PolarHBondContact O-N 3.04Å
480	W	53.2	Low	75.4	Confident	227 Å²	227	91 Å²	91	86%	0.86	40%	0.402	S	S	*	.			trans	-64.8	0	180	47	-87.6	0	0	0	114.6	K436 D478	K436-W480 PolarHBondContact NZ-O 3.37Å; K436-W480 PolarHBondContact NZ-OXT 3.07Å; D478-W480 VanDerWaalsContact O-CD1 3.28Å; D478-W480 PolarHBondContact O-N 2.79Å; D478-W480 VanDerWaalsContact O-N 3.16Å; D478-W480 PolarHBondContact OD2-NE1 3.06Å

Retrieved 480 of 480 residues in 1657 ms (Link to these results)

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