A0A087XPG5_POEFO Loading...

Endonuclease/exonuclease/phosphatase family domain-containing protein 1

AlphaFold DB , UniProt , Accession A0A087XPG5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 555 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.4	Very low	36.9	Very low	245 Å²	245	141.5 Å²	141.5	100%	1.207	83%	0.83	S	S	*	*				0	104.2	0	-59.4	-169.3	-159.5	0	0	105.5
2	G	34.2	Very low	36.7	Very low	87 Å²	87	140.2 Å²	140.2	90%	0.897	83%	0.829	S	S	*	*				70.9	126.2	78.7	0	0	0	0	0	109
3	G	34.1	Very low	36.6	Very low	71 Å²	71	148.5 Å²	148.5	73%	0.732	84%	0.837	S	S	*	*			cis	168.1	154.3	3.5	0	0	0	0	0	107.2
4	N	38.8	Very low	36.4	Very low	147 Å²	147	148.2 Å²	148.2	79%	0.786	83%	0.832	S	S	*	*			trans	52.9	128.5	145.4	-90.2	10.3	0	0	0	125.6
5	L	36.3	Very low	37.2	Very low	159 Å²	159	146.1 Å²	146.1	83%	0.832	83%	0.828	S	S	*	*				90.2	134.3	126.5	-66.3	168	0	0	0	120.5
6	G	37.7	Very low	37.4	Very low	67 Å²	67	144.3 Å²	144.3	69%	0.691	82%	0.82	S	S	*	*			trans	-91.1	-169.7	-173.7	0	0	0	0	0	115.6
7	C	38.3	Very low	37.4	Very low	122 Å²	122	145.9 Å²	145.9	82%	0.824	83%	0.827	S	S	*	*			trans	167.7	152.2	131.7	-83.2	0	0	0	0	113.8
8	H	37.3	Very low	37.6	Very low	173 Å²	173	147.2 Å²	147.2	80%	0.801	83%	0.829	S	S	*	*			trans	77.5	134.7	156.5	-75.9	-67.1	0	0	0	120.1
9	R	34.3	Very low	37.4	Very low	232 Å²	232	145.7 Å²	145.7	88%	0.875	83%	0.83	S	S	*	*			cis	-164.7	173.4	48.1	-84.8	-169.7	-172.4	-154.1	0.1	110
10	S	37.9	Very low	37	Very low	98 Å²	98	145.3 Å²	145.3	69%	0.685	84%	0.835	S	S	*	*			cis	-175.4	152.7	-37.9	48	0	0	0	0	107.6
11	I	42.2	Very low	36.7	Very low	156 Å²	156	141.5 Å²	141.5	80%	0.8	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-67.9	154.7	-177	-61.1	155.8	0	0	0	114.1
12	P	34.7	Very low	36.6	Very low	125 Å²	125	140 Å²	140	81%	0.812	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-97.7	145.4	155.5	-0.8	21.3	0	0	0	114.4
13	R	36.1	Very low	37.1	Very low	248 Å²	248	147.2 Å²	147.2	94%	0.936	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-97.1	125.7	-179.4	-67.7	168.8	168.9	168.5	-5.1	110.9
14	D	32.6	Very low	37.2	Very low	145 Å²	145	152.3 Å²	152.3	78%	0.775	82%	0.816	S	S	*	*				-171.1	143.6	127.7	-140.3	4.8	0	0	0	111.2
15	P	49.1	Very low	37	Very low	117 Å²	117	154 Å²	154	76%	0.76	82%	0.817	S	S	*	*			trans	-114.7	71.1	-168.3	40.6	-26.6	0	0	0	113.4
16	T	39.9	Very low	36.9	Very low	116 Å²	116	152.3 Å²	152.3	71%	0.712	82%	0.818	S	S	*	*			trans	-140	7	-179.7	4.8	0	0	0	0	117.4	L18	T16-L18 PolarHBondContact O-N 2.91Å
17	D	37.7	Very low	37.2	Very low	173 Å²	173	153.9 Å²	153.9	93%	0.925	83%	0.825	S	S	*	*			trans	-99.2	38.1	176.8	-105.2	-10	0	0	0	114
18	L	41.1	Very low	37	Very low	168 Å²	168	152.8 Å²	152.8	88%	0.88	82%	0.824	S	S	*	*			trans	-123.9	91.1	169.2	-77.7	170.3	0	0	0	111	T16	T16-L18 PolarHBondContact O-N 2.91Å
19	S	33.8	Very low	36.8	Very low	120 Å²	120	150.3 Å²	150.3	84%	0.839	83%	0.825	S	S	*	*			trans	164.7	123	137.6	54.7	0	0	0	0	108.4
20	C	29.5	Very low	37.2	Very low	137 Å²	137	146 Å²	146	93%	0.926	82%	0.819	S	S	*	*				-176.1	139.7	78.5	-168.2	0	0	0	0	109.9
21	G	30.6	Very low	36.9	Very low	65 Å²	65	150.8 Å²	150.8	67%	0.67	83%	0.828	S	S	*	*			trans	121.6	88.2	148.1	0	0	0	0	0	119.8
22	K	32.7	Very low	36.4	Very low	213 Å²	213	147.8 Å²	147.8	93%	0.926	82%	0.821	S	S	*	*			trans	72	109.9	142.9	-61.1	-178.9	-178.6	177.5	0	120.2
23	R	43.8	Very low	36.6	Very low	239 Å²	239	148.5 Å²	148.5	90%	0.902	82%	0.818	S	S	*	*			trans	-56.1	132.8	150.9	-68.9	-177.1	-85.2	-178.9	-7.1	110.7
24	K	36.2	Very low	36.5	Very low	178 Å²	178	144.6 Å²	144.6	77%	0.774	81%	0.814	S	S	*	*				165	129.1	110.5	-92.7	-175	-177.9	-178.4	0	112.3
25	F	35.4	Very low	36.9	Very low	183 Å²	183	144.3 Å²	144.3	80%	0.803	81%	0.812	S	S	*	*			trans	45.4	118	154.4	-63	-79.1	0	0	0	119.7
26	S	33.1	Very low	36.2	Very low	123 Å²	123	144.3 Å²	144.3	86%	0.86	81%	0.809	S	S	*	*				-176.6	159.1	104.3	-76.7	0	0	0	0	112.2
27	A	44.5	Very low	36.1	Very low	101 Å²	101	145.1 Å²	145.1	84%	0.835	81%	0.809	S	S	*	*			trans	-63.4	173	-169.2	0	0	0	0	0	116.1
28	A	33.4	Very low	36.6	Very low	99 Å²	99	143.8 Å²	143.8	82%	0.818	80%	0.797	S	S	*	*			trans	95.7	70.9	170.7	0	0	0	0	0	116.5	N30	A28-N30 PolarHBondContact O-N 3.21Å
29	C	33.7	Very low	37.6	Very low	120 Å²	120	144.6 Å²	144.6	81%	0.811	80%	0.796	S	S	*	*			trans	-84	96.3	145.9	44.3	0	0	0	0	108.5	F31	C29-F31 PolarHBondContact O-N 3.14Å
30	N	43.3	Very low	39.7	Very low	142 Å²	142	146 Å²	146	76%	0.759	78%	0.783	S	S	*	*			trans	-90.3	90.1	161.9	-153	4.2	0	0	0	106.9	A28	A28-N30 PolarHBondContact O-N 3.21Å
31	F	31.4	Very low	42.3	Very low	199 Å²	199	141.2 Å²	141.2	87%	0.873	75%	0.748	S	S	*	*			trans	-103.9	82.1	163	-88.9	-78.8	0	0	0	107.9	C29 N33	C29-F31 PolarHBondContact O-N 3.14Å; F31-N33 PolarHBondContact O-N 3.43Å
32	S	31.5	Very low	45.1	Very low	93 Å²	93	139 Å²	139	65%	0.65	72%	0.721	S	S	*	*			trans	-65.1	109.8	163.7	38.9	0	0	0	0	109.8
33	N	38.6	Very low	47.8	Very low	139 Å²	139	128.9 Å²	128.9	74%	0.743	68%	0.677	S	S	*	*			trans	53	92.2	141.6	-61.5	-20.6	0	0	0	118.4	F31	F31-N33 PolarHBondContact O-N 3.43Å
34	I	34.8	Very low	50	Low	166 Å²	166	119.5 Å²	119.5	85%	0.851	65%	0.645	S	S	*	*			trans	-91.4	106.6	140.7	-69.4	178.7	0	0	0	106.8	V36	I34-V36 PolarHBondContact O-N 3.47Å
35	L	41.2	Very low	52.3	Low	139 Å²	139	115.9 Å²	115.9	73%	0.728	64%	0.638	S	S	*	*			trans	-65.7	109.7	171.1	-82.4	109.8	0	0	0	109.8
36	V	33.7	Very low	54.8	Low	117 Å²	117	107.2 Å²	107.2	71%	0.709	60%	0.6	S	S	*	*			trans	-90.3	102.3	147.5	-175.6	0	0	0	0	105.7	I34 H38	I34-V36 PolarHBondContact O-N 3.47Å; V36-H38 VanDerWaalsContact C-N 3.26Å; V36-H38 PolarHBondContact O-N 2.79Å
37	N	38.8	Very low	57.4	Low	134 Å²	134	104.4 Å²	104.4	72%	0.717	58%	0.578	S	S	*	*			trans	-76	82.9	176.3	-150.5	41.6	0	0	0	107.5	E39	N37-E39 PolarHBondContact O-N 3.44Å
38	H	47	Very low	59.4	Low	145 Å²	145	102.1 Å²	102.1	67%	0.671	55%	0.55	S	S	*	*			trans	-67.7	113.9	162.8	-104.8	-88.5	0	0	0	106.8	V36 R40	V36-H38 VanDerWaalsContact C-N 3.26Å; V36-H38 PolarHBondContact O-N 2.79Å; H38-R40 PolarHBondContact O-N 3.4Å
39	E	61.6	Low	62	Low	184 Å²	184	103.3 Å²	103.3	86%	0.86	54%	0.539	S	S	*	.			trans	-55.7	111.4	170.2	-81.4	-178.5	148.9	0	0	108.2	N37 L41	N37-E39 PolarHBondContact O-N 3.44Å; E39-L41 PolarHBondContact O-N 3.28Å
40	R	78.6	Confident	64.3	Low	150 Å²	150	101.8 Å²	101.8	57%	0.566	52%	0.52	S	S	*	.			trans	-69.7	129	178.9	-67.8	-176.7	-179.1	159.9	2.7	109.2	H38 N42 L97 E98 C100	H38-R40 PolarHBondContact O-N 3.4Å; R40-N42 PolarHBondContact O-N 3.3Å; R40-L97 PolarHBondContact NE-O 3.26Å; R40-E98 CarbonylContact C-O 3.43Å; R40-E98 WeakPolarHBondContact CA-O 3.11Å; R40-C100 HydrophobicContact CB-CB 4Å; R40-C100 PolarHBondContact O-SG 3.28Å
41	L	84.2	Confident	66.4	Low	36 Å²	36	95 Å²	95	19%	0.188	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	124.2	179.4	-173.8	68.9	0	0	0	110.2	E39 I43 A46 E50 L51 L54 E98 I99 C100	E39-L41 PolarHBondContact O-N 3.28Å; L41-I43 PolarHBondContact O-N 3.3Å; L41-A46 HydrophobicContact CD1-CB 3.87Å; L41-A46 HydrophobicContact CD2-CB 4.01Å; L41-A46 HydrophobicContact CG-CB 3.8Å; L41-E50 HydrophobicContact CD1-CB 3.97Å; L41-E50 HydrophobicContact CD2-CB 4.35Å; L41-E50 VanDerWaalsContact CD2-O 3.3Å; L41-E50 WeakPolarHBondContact CD2-O 3.33Å; L41-L51 HydrophobicContact CD2-CD2 4.11Å; L41-L54 HydrophobicContact CD2-CD1 4.07Å; L41-L54 HydrophobicContact CD2-CD2 4.25Å; L41-L54 HydrophobicContact CD2-CG 4.05Å; L41-E98 PolarHBondContact N-O 3.34Å; L41-I99 HydrophobicContact CB-CG2 4.5Å; L41-I99 CarbonylContact O-C 3.49Å; L41-I99 VanDerWaalsContact O-CA 3.24Å; L41-I99 WeakPolarHBondContact O-CA 3.42Å; L41-C100 PolarHBondContact O-N 3.28Å
42	N	88.7	Confident	69.2	Low	20 Å²	20	88.8 Å²	88.8	11%	0.107	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	108.9	179.9	-178.6	-4	0	0	0	110.6	R40 N44 T45 A46 C100	R40-N42 PolarHBondContact O-N 3.3Å; N42-N44 PolarHBondContact O-N 3.14Å; N42-N44 VanDerWaalsContact O-N 3.14Å; N42-N44 WeakPolarHBondContact OD1-CB 3.4Å; N42-N44 PolarHBondContact OD1-N 3.35Å; N42-T45 WeakPolarHBondContact CB-OG1 3.26Å; N42-T45 PolarHBondContact ND2-OG1 3.37Å; N42-T45 PolarHBondContact O-N 3.08Å; N42-T45 PolarHBondContact O-OG1 2.92Å; N42-A46 WeakPolarHBondContact O-CB 3.49Å; N42-A46 PolarHBondContact O-N 3.47Å; N42-C100 CarbonylContact C-O 3.54Å; N42-C100 VanDerWaalsContact CA-O 3.28Å; N42-C100 WeakPolarHBondContact CA-O 3.15Å; N42-C100 PolarHBondContact OD1-O 3.41Å
43	I	90.4	Very high	71.7	Confident	0 Å²	0	89.5 Å²	89.5	0%	0	46%	0.458	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-21.2	-176.4	65.1	-178.1	0	0	0	113.2	L41 T45 L51 R69 F75 L81 I99 C100 V101	L41-I43 PolarHBondContact O-N 3.3Å; I43-T45 VanDerWaalsContact C-N 3.33Å; I43-L51 HydrophobicContact CG2-CD2 4.38Å; I43-R69 WeakPolarHBondContact O-CD 3.16Å; I43-R69 PolarHBondContact O-NH1 3.02Å; I43-F75 HydrophobicContact CD1-CB 3.86Å; I43-F75 HydrophobicContact CD1-CD2 3.76Å; I43-F75 HydrophobicContact CD1-CE2 4.47Å; I43-F75 HydrophobicContact CD1-CG 3.87Å; I43-F75 HydrophobicContact CG1-CB 4.31Å; I43-F75 HydrophobicContact CG1-CD2 3.89Å; I43-F75 HydrophobicContact CG1-CG 4.38Å; I43-L81 HydrophobicContact CD1-CB 4.5Å; I43-L81 HydrophobicContact CD1-CD1 4.28Å; I43-L81 HydrophobicContact CG2-CD2 4.48Å; I43-I99 HydrophobicContact CG2-CB 3.8Å; I43-I99 HydrophobicContact CG2-CD1 4.14Å; I43-I99 HydrophobicContact CG2-CG1 4.47Å; I43-I99 HydrophobicContact CG2-CG2 4Å; I43-C100 WeakPolarHBondContact CG1-O 3.33Å; I43-C100 PolarHBondContact N-O 3.46Å; I43-V101 HydrophobicContact CD1-CG1 3.59Å; I43-V101 HydrophobicContact CG1-CG1 3.81Å
44	N	89.5	Confident	74	Confident	41 Å²	41	83.2 Å²	83.2	22%	0.219	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-18.4	176.9	-73.3	-36.3	0	0	0	113.4	N42 R69 F75 V101	N42-N44 PolarHBondContact O-N 3.14Å; N42-N44 VanDerWaalsContact O-N 3.14Å; N42-N44 WeakPolarHBondContact OD1-CB 3.4Å; N42-N44 PolarHBondContact OD1-N 3.35Å; N44-R69 WeakPolarHBondContact O-CD 3.24Å; N44-R69 PolarHBondContact O-NH1 2.91Å; N44-F75 PolarHBondContact ND2-O 2.92Å; N44-F75 PolarHBondContact OD1-N 3.33Å; N44-V101 PolarHBondContact ND2-O 2.83Å
45	T	84.9	Confident	76.2	Confident	102 Å²	102	78.2 Å²	78.2	63%	0.626	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.2	-13.1	-176.8	59.3	0	0	0	0	113.8	N42 I43	N42-T45 WeakPolarHBondContact CB-OG1 3.26Å; N42-T45 PolarHBondContact ND2-OG1 3.37Å; N42-T45 PolarHBondContact O-N 3.08Å; N42-T45 PolarHBondContact O-OG1 2.92Å; I43-T45 VanDerWaalsContact C-N 3.33Å
46	A	87	Confident	78	Confident	2 Å²	2	73.7 Å²	73.7	2%	0.017	39%	0.39	C	S	.	.			trans	-63.6	140.9	-178.4	0	0	0	0	0	111.6	L41 N42 E50 L51 R69	L41-A46 HydrophobicContact CD1-CB 3.87Å; L41-A46 HydrophobicContact CD2-CB 4.01Å; L41-A46 HydrophobicContact CG-CB 3.8Å; N42-A46 WeakPolarHBondContact O-CB 3.49Å; N42-A46 PolarHBondContact O-N 3.47Å; A46-E50 VanDerWaalsContact CA-OE2 3.31Å; A46-E50 WeakPolarHBondContact CA-OE2 3.24Å; A46-E50 HydrophobicContact CB-CB 4.3Å; A46-L51 HydrophobicContact CB-CD2 3.87Å; A46-L51 HydrophobicContact CB-CG 3.86Å; A46-R69 PolarHBondContact O-NH1 2.81Å; A46-R69 VanDerWaalsContact O-NH1 3.13Å
47	T	89.1	Confident	80.6	Confident	64 Å²	64	68.4 Å²	68.4	39%	0.393	36%	0.358	S	S	.	.			trans	-76.9	165.9	170.7	79.6	0	0	0	0	111	E49 E50 L51	T47-E49 VanDerWaalsContact C-N 3.27Å; T47-E49 WeakPolarHBondContact CB-OE2 3.46Å; T47-E49 PolarHBondContact O-N 3.27Å; T47-E49 PolarHBondContact OG1-OE2 2.96Å; T47-E50 PolarHBondContact N-OE2 2.96Å; T47-E50 PolarHBondContact O-N 2.6Å; T47-E50 WeakPolarHBondContact OG1-CG 3.34Å; T47-E50 PolarHBondContact OG1-N 2.64Å; T47-L51 WeakPolarHBondContact O-CG 3.41Å; T47-L51 PolarHBondContact O-N 3.38Å
48	E	86.2	Confident	83	Confident	53 Å²	53	67.3 Å²	67.3	25%	0.248	35%	0.352	C	S	.	.	H	α-helix	trans	-58.3	-41.7	178	-168.8	-174.5	153.2	0	0	111.4	E50 L51 M52 R59 A62	E48-E50 VanDerWaalsContact C-N 3.35Å; E48-E50 PolarHBondContact O-N 3.32Å; E48-L51 PolarHBondContact O-N 3.48Å; E48-M52 VanDerWaalsContact O-CG 3.31Å; E48-M52 WeakPolarHBondContact O-CG 3.48Å; E48-M52 PolarHBondContact O-N 3.23Å; E48-R59 VanDerWaalsContact OE1-CG 3.22Å; E48-R59 WeakPolarHBondContact OE1-CG 3.32Å; E48-A62 HydrophobicContact CG-CB 3.62Å
49	E	86.9	Confident	85	Confident	123 Å²	123	68.2 Å²	68.2	58%	0.575	35%	0.35	S	S	*	.	H	α-helix	trans	-65.5	-37.5	178.3	-57.6	75.7	-164.2	0	0	112.2	T47 M52	T47-E49 VanDerWaalsContact C-N 3.27Å; T47-E49 WeakPolarHBondContact CB-OE2 3.46Å; T47-E49 PolarHBondContact O-N 3.27Å; T47-E49 PolarHBondContact OG1-OE2 2.96Å; E49-M52 PolarHBondContact O-N 3Å
50	E	83.4	Confident	86.1	Confident	88 Å²	88	63.1 Å²	63.1	41%	0.411	34%	0.335	S	S	.	.	H	α-helix	trans	-70.1	-39.4	176.4	-67.3	174.8	151.7	0	0	111.1	L41 A46 T47 E48 M52 T53	L41-E50 HydrophobicContact CD1-CB 3.97Å; L41-E50 HydrophobicContact CD2-CB 4.35Å; L41-E50 VanDerWaalsContact CD2-O 3.3Å; L41-E50 WeakPolarHBondContact CD2-O 3.33Å; A46-E50 VanDerWaalsContact CA-OE2 3.31Å; A46-E50 WeakPolarHBondContact CA-OE2 3.24Å; A46-E50 HydrophobicContact CB-CB 4.3Å; T47-E50 PolarHBondContact N-OE2 2.96Å; T47-E50 PolarHBondContact O-N 2.6Å; T47-E50 WeakPolarHBondContact OG1-CG 3.34Å; T47-E50 PolarHBondContact OG1-N 2.64Å; E48-E50 VanDerWaalsContact C-N 3.35Å; E48-E50 PolarHBondContact O-N 3.32Å; E50-M52 VanDerWaalsContact C-N 3.28Å; E50-M52 PolarHBondContact O-N 2.98Å; E50-T53 WeakPolarHBondContact O-CB 3.36Å; E50-T53 PolarHBondContact O-N 2.81Å; E50-T53 VanDerWaalsContact O-N 3.1Å; E50-T53 PolarHBondContact O-OG1 2.8Å
51	L	87.8	Confident	86.4	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-64.4	-33.3	175.2	-71.3	170	0	0	0	112.2	L41 I43 A46 T47 E48 T53 L54 V57 A62 I65 V66	L41-L51 HydrophobicContact CD2-CD2 4.11Å; I43-L51 HydrophobicContact CG2-CD2 4.38Å; A46-L51 HydrophobicContact CB-CD2 3.87Å; A46-L51 HydrophobicContact CB-CG 3.86Å; T47-L51 WeakPolarHBondContact O-CG 3.41Å; T47-L51 PolarHBondContact O-N 3.38Å; E48-L51 PolarHBondContact O-N 3.48Å; L51-T53 PolarHBondContact O-N 2.84Å; L51-L54 HydrophobicContact CD2-CD1 4.23Å; L51-L54 WeakPolarHBondContact O-CB 3.41Å; L51-L54 PolarHBondContact O-N 2.78Å; L51-V57 WeakPolarHBondContact O-CB 3.4Å; L51-V57 VanDerWaalsContact O-CG1 3.28Å; L51-V57 WeakPolarHBondContact O-CG1 3.23Å; L51-A62 HydrophobicContact CB-CB 3.89Å; L51-I65 HydrophobicContact CD1-CB 4.15Å; L51-I65 HydrophobicContact CD1-CG2 3.79Å; L51-I65 HydrophobicContact CD2-CG2 4.36Å; L51-V66 HydrophobicContact CD1-CG2 3.88Å
52	M	88.6	Confident	86.7	Confident	69 Å²	69	54.8 Å²	54.8	34%	0.34	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-11.4	174.6	-72	177.2	62.8	0	0	113.9	E48 E49 E50 L54 R59 A62	E48-M52 VanDerWaalsContact O-CG 3.31Å; E48-M52 WeakPolarHBondContact O-CG 3.48Å; E48-M52 PolarHBondContact O-N 3.23Å; E49-M52 PolarHBondContact O-N 3Å; E50-M52 VanDerWaalsContact C-N 3.28Å; E50-M52 PolarHBondContact O-N 2.98Å; M52-L54 PolarHBondContact O-N 3.35Å; M52-R59 HydrophobicContact CE-CB 3.88Å; M52-R59 HydrophobicContact SD-CB 3.8Å; M52-R59 HydrophobicContact SD-CG 4.16Å; M52-A62 HydrophobicContact CG-CB 3.73Å
53	T	85.6	Confident	86.6	Confident	107 Å²	107	58 Å²	58	66%	0.656	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-14.7	173.9	69.4	0	0	0	0	112.8	E50 L51	E50-T53 WeakPolarHBondContact O-CB 3.36Å; E50-T53 PolarHBondContact O-N 2.81Å; E50-T53 VanDerWaalsContact O-N 3.1Å; E50-T53 PolarHBondContact O-OG1 2.8Å; L51-T53 PolarHBondContact O-N 2.84Å
54	L	86	Confident	86.2	Confident	7 Å²	7	60 Å²	60	4%	0.037	33%	0.327	C	S	.	.	S	Bend	trans	-77.7	140.8	-179.6	-62.1	172.5	0	0	0	112	L41 L51 M52 G56 V57 I95 E98 I99	L41-L54 HydrophobicContact CD2-CD1 4.07Å; L41-L54 HydrophobicContact CD2-CD2 4.25Å; L41-L54 HydrophobicContact CD2-CG 4.05Å; L51-L54 HydrophobicContact CD2-CD1 4.23Å; L51-L54 WeakPolarHBondContact O-CB 3.41Å; L51-L54 PolarHBondContact O-N 2.78Å; M52-L54 PolarHBondContact O-N 3.35Å; L54-G56 PolarHBondContact O-N 2.78Å; L54-V57 HydrophobicContact CB-CB 4.11Å; L54-V57 HydrophobicContact CB-CG2 3.7Å; L54-V57 HydrophobicContact CD1-CG2 4.37Å; L54-V57 PolarHBondContact O-N 2.85Å; L54-V57 VanDerWaalsContact O-N 3.09Å; L54-I95 HydrophobicContact CB-CB 4.46Å; L54-I95 HydrophobicContact CB-CG2 3.96Å; L54-I95 HydrophobicContact CD1-CD1 4.38Å; L54-E98 HydrophobicContact CD2-CB 3.88Å; L54-I99 HydrophobicContact CD1-CG2 3.44Å; L54-I99 VanDerWaalsContact CD1-CG2 3.44Å; L54-I99 HydrophobicContact CD2-CG2 3.65Å; L54-I99 HydrophobicContact CG-CG2 4.21Å
55	P	80.1	Confident	86.1	Confident	61 Å²	61	58 Å²	58	40%	0.396	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	120.8	-176.2	21.4	-29.8	0	0	0	111.9	I95 E98	P55-I95 HydrophobicContact CG-CG2 3.92Å; P55-I95 WeakPolarHBondContact O-CG2 3.35Å; P55-E98 WeakPolarHBondContact CD-OE2 3.42Å
56	G	79.1	Confident	86.3	Confident	44 Å²	44	54.7 Å²	54.7	45%	0.454	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.9	5	179.6	0	0	0	0	0	115.2	L54	L54-G56 PolarHBondContact O-N 2.78Å
57	V	88.6	Confident	85.9	Confident	7 Å²	7	59.2 Å²	59.2	4%	0.042	32%	0.317	C	S	.	.			trans	-96.3	104.7	172.8	-176.9	0	0	0	0	109.7	L51 L54 V61 A62 I65 I95	L51-V57 WeakPolarHBondContact O-CB 3.4Å; L51-V57 VanDerWaalsContact O-CG1 3.28Å; L51-V57 WeakPolarHBondContact O-CG1 3.23Å; L54-V57 HydrophobicContact CB-CB 4.11Å; L54-V57 HydrophobicContact CB-CG2 3.7Å; L54-V57 HydrophobicContact CD1-CG2 4.37Å; L54-V57 PolarHBondContact O-N 2.85Å; L54-V57 VanDerWaalsContact O-N 3.09Å; V57-V61 HydrophobicContact CG1-CB 4.15Å; V57-V61 HydrophobicContact CG1-CG1 4.13Å; V57-A62 HydrophobicContact CG1-CB 3.99Å; V57-I65 HydrophobicContact CG1-CD1 4.34Å; V57-I95 HydrophobicContact CG2-CD1 4.2Å; V57-I95 HydrophobicContact CG2-CG2 4.44Å
58	N	88.9	Confident	85.2	Confident	111 Å²	111	59.7 Å²	59.7	59%	0.594	31%	0.312	S	S	*	.			trans	-90.4	168.7	173.6	-61.3	-27.9	0	0	0	110.2	S60 V61 A62	N58-S60 VanDerWaalsContact C-N 3.3Å; N58-S60 PolarHBondContact O-N 3.04Å; N58-S60 VanDerWaalsContact O-N 3.16Å; N58-V61 WeakPolarHBondContact O-CA 3.07Å; N58-V61 PolarHBondContact O-N 2.83Å; N58-A62 PolarHBondContact O-N 2.95Å
59	R	89.1	Confident	85.2	Confident	163 Å²	163	58.8 Å²	58.8	62%	0.615	31%	0.306	S	S	*	.	H	α-helix	trans	-45.2	-49.7	178.9	-176.1	168.2	-85.2	149.9	-3.9	113.9	E48 M52 V61 A62 Q63	E48-R59 VanDerWaalsContact OE1-CG 3.22Å; E48-R59 WeakPolarHBondContact OE1-CG 3.32Å; M52-R59 HydrophobicContact CE-CB 3.88Å; M52-R59 HydrophobicContact SD-CB 3.8Å; M52-R59 HydrophobicContact SD-CG 4.16Å; R59-V61 VanDerWaalsContact C-N 3.31Å; R59-V61 PolarHBondContact O-N 2.75Å; R59-A62 PolarHBondContact O-N 2.63Å; R59-Q63 PolarHBondContact O-N 3.39Å
60	S	84.7	Confident	84.7	Confident	78 Å²	78	58 Å²	58	55%	0.545	31%	0.306	S	S	.	.	H	α-helix	trans	-61.3	-35.7	178.1	169.3	0	0	0	0	113.6	N58 N64	N58-S60 VanDerWaalsContact C-N 3.3Å; N58-S60 PolarHBondContact O-N 3.04Å; N58-S60 VanDerWaalsContact O-N 3.16Å; S60-N64 PolarHBondContact O-N 3.14Å; S60-N64 PolarHBondContact O-ND2 2.66Å; S60-N64 PolarHBondContact O-OD1 3.15Å
61	V	85.8	Confident	83.8	Confident	10 Å²	10	59.3 Å²	59.3	6%	0.061	32%	0.323	C	S	.	.	H	α-helix	trans	-75.1	-39.5	178	-178.6	0	0	0	0	110.5	V57 N58 R59 Q63 N64 I65 V87	V57-V61 HydrophobicContact CG1-CB 4.15Å; V57-V61 HydrophobicContact CG1-CG1 4.13Å; N58-V61 WeakPolarHBondContact O-CA 3.07Å; N58-V61 PolarHBondContact O-N 2.83Å; R59-V61 VanDerWaalsContact C-N 3.31Å; R59-V61 PolarHBondContact O-N 2.75Å; V61-Q63 VanDerWaalsContact C-N 3.34Å; V61-Q63 PolarHBondContact O-N 3.37Å; V61-N64 PolarHBondContact O-N 2.85Å; V61-I65 HydrophobicContact CG1-CD1 4.15Å; V61-I65 VanDerWaalsContact O-CG1 3.26Å; V61-I65 WeakPolarHBondContact O-CG1 3.18Å; V61-I65 PolarHBondContact O-N 3.34Å; V61-V87 HydrophobicContact CG1-CG2 3.57Å
62	A	90.1	Very high	83	Confident	0 Å²	0	63 Å²	63	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-60.5	-43.4	175.4	0	0	0	0	0	111.6	E48 L51 M52 V57 N58 R59 I65 V66	E48-A62 HydrophobicContact CG-CB 3.62Å; L51-A62 HydrophobicContact CB-CB 3.89Å; M52-A62 HydrophobicContact CG-CB 3.73Å; V57-A62 HydrophobicContact CG1-CB 3.99Å; N58-A62 PolarHBondContact O-N 2.95Å; R59-A62 PolarHBondContact O-N 2.63Å; A62-I65 PolarHBondContact O-N 3.17Å; A62-V66 PolarHBondContact O-N 2.69Å
63	Q	86.5	Confident	82.3	Confident	88 Å²	88	63.2 Å²	63.2	41%	0.411	36%	0.362	S	S	.	.	H	α-helix	trans	-60.8	-46	175.1	-170.5	179.2	-11.3	0	0	111.9	R59 V61 I65 V66 E67	R59-Q63 PolarHBondContact O-N 3.39Å; V61-Q63 VanDerWaalsContact C-N 3.34Å; V61-Q63 PolarHBondContact O-N 3.37Å; Q63-I65 VanDerWaalsContact C-N 3.27Å; Q63-I65 PolarHBondContact O-N 2.75Å; Q63-V66 PolarHBondContact O-N 3.22Å; Q63-V66 VanDerWaalsContact O-N 3.17Å; Q63-E67 WeakPolarHBondContact CG-OE1 3.37Å; Q63-E67 PolarHBondContact NE2-OE1 2.99Å; Q63-E67 PolarHBondContact O-N 2.61Å
64	N	83.1	Confident	81.9	Confident	41 Å²	41	58.9 Å²	58.9	22%	0.219	34%	0.339	C	S	.	.	H	α-helix	trans	-60.5	-35.4	177.2	-67.8	-11.8	0	0	0	112.8	S60 V61 Y68 V84 S85	S60-N64 PolarHBondContact O-N 3.14Å; S60-N64 PolarHBondContact O-ND2 2.66Å; S60-N64 PolarHBondContact O-OD1 3.15Å; V61-N64 PolarHBondContact O-N 2.85Å; N64-Y68 VanDerWaalsContact O-CB 3.25Å; N64-Y68 WeakPolarHBondContact O-CB 3.41Å; N64-Y68 PolarHBondContact O-N 3.25Å; N64-V84 HydrophobicContact CB-CG1 3.77Å; N64-V84 WeakPolarHBondContact O-CG1 3.11Å; N64-S85 PolarHBondContact ND2-O 2.94Å
65	I	86.3	Confident	81.8	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-65.8	-42.7	177.5	-68.2	166.7	0	0	0	110.7	L51 V57 V61 A62 Q63 R69 F75 L81 V84 V87	L51-I65 HydrophobicContact CD1-CB 4.15Å; L51-I65 HydrophobicContact CD1-CG2 3.79Å; L51-I65 HydrophobicContact CD2-CG2 4.36Å; V57-I65 HydrophobicContact CG1-CD1 4.34Å; V61-I65 HydrophobicContact CG1-CD1 4.15Å; V61-I65 VanDerWaalsContact O-CG1 3.26Å; V61-I65 WeakPolarHBondContact O-CG1 3.18Å; V61-I65 PolarHBondContact O-N 3.34Å; A62-I65 PolarHBondContact O-N 3.17Å; Q63-I65 VanDerWaalsContact C-N 3.27Å; Q63-I65 PolarHBondContact O-N 2.75Å; I65-R69 VanDerWaalsContact O-CB 3.3Å; I65-R69 WeakPolarHBondContact O-CB 3.35Å; I65-R69 PolarHBondContact O-N 3.14Å; I65-F75 HydrophobicContact CG2-CE2 4.08Å; I65-F75 HydrophobicContact CG2-CZ 4.37Å; I65-L81 HydrophobicContact CB-CD1 4.28Å; I65-L81 HydrophobicContact CD1-CD1 4.08Å; I65-L81 HydrophobicContact CG1-CD1 3.77Å; I65-L81 HydrophobicContact CG2-CD1 3.62Å; I65-V84 HydrophobicContact CB-CG1 4.43Å; I65-V84 HydrophobicContact CG1-CB 4.39Å; I65-V84 HydrophobicContact CG1-CG1 3.79Å; I65-V87 HydrophobicContact CD1-CG2 3.9Å; I65-V87 HydrophobicContact CG1-CG2 3.97Å
66	V	88.9	Confident	81.9	Confident	32 Å²	32	64.6 Å²	64.6	19%	0.194	36%	0.357	C	S	.	.	H	α-helix	trans	-66	-49.1	177.8	173.1	0	0	0	0	111	L51 A62 Q63 Y68 R69 D70	L51-V66 HydrophobicContact CD1-CG2 3.88Å; A62-V66 PolarHBondContact O-N 2.69Å; Q63-V66 PolarHBondContact O-N 3.22Å; Q63-V66 VanDerWaalsContact O-N 3.17Å; V66-Y68 PolarHBondContact O-N 3.25Å; V66-R69 WeakPolarHBondContact O-CB 3.46Å; V66-R69 PolarHBondContact O-N 2.73Å; V66-D70 VanDerWaalsContact O-CG 3.27Å; V66-D70 PolarHBondContact O-N 2.79Å; V66-D70 VanDerWaalsContact O-N 3.08Å
67	E	78.3	Confident	82.2	Confident	98 Å²	98	68.6 Å²	68.6	46%	0.458	36%	0.362	S	S	.	.	H	α-helix	trans	-61.2	-42.8	-179.9	-71.7	177.6	-168.7	0	0	112.1	Q63 D70 C71	Q63-E67 WeakPolarHBondContact CG-OE1 3.37Å; Q63-E67 PolarHBondContact NE2-OE1 2.99Å; Q63-E67 PolarHBondContact O-N 2.61Å; E67-D70 PolarHBondContact O-N 3.35Å; E67-C71 PolarHBondContact O-N 2.89Å; E67-C71 PolarHBondContact O-SG 3.07Å
68	Y	75.9	Confident	82.1	Confident	74 Å²	74	69.2 Å²	69.2	29%	0.29	37%	0.366	S	S	.	.	H	α-helix	trans	-66.8	-41.6	178.5	-170.7	-92.5	0	0	0	112.1	N64 V66 D70 C71 I72 F75 L83 V84	N64-Y68 VanDerWaalsContact O-CB 3.25Å; N64-Y68 WeakPolarHBondContact O-CB 3.41Å; N64-Y68 PolarHBondContact O-N 3.25Å; V66-Y68 PolarHBondContact O-N 3.25Å; Y68-D70 VanDerWaalsContact C-N 3.3Å; Y68-D70 PolarHBondContact O-N 3.15Å; Y68-C71 PolarHBondContact O-N 2.97Å; Y68-I72 HydrophobicContact CD1-CD1 3.95Å; Y68-I72 HydrophobicContact CD1-CG2 4.38Å; Y68-I72 HydrophobicContact CE1-CD1 3.73Å; Y68-I72 HydrophobicContact CE1-CG2 4.05Å; Y68-I72 WeakPolarHBondContact O-CG1 3.43Å; Y68-I72 PolarHBondContact O-N 2.82Å; Y68-F75 HydrophobicContact CD1-CD1 4.43Å; Y68-F75 AromaticContact CD1-CE1 3.38Å; Y68-F75 HydrophobicContact CD1-CE1 3.38Å; Y68-F75 AromaticContact CD1-CZ 3.64Å; Y68-F75 HydrophobicContact CD1-CZ 3.64Å; Y68-F75 HydrophobicContact CE1-CD1 4.48Å; Y68-F75 AromaticContact CE1-CE1 3.69Å; Y68-F75 HydrophobicContact CE1-CE1 3.69Å; Y68-F75 HydrophobicContact CE1-CZ 4.4Å; Y68-L83 HydrophobicContact CE1-CB 4.34Å; Y68-L83 WeakPolarHBondContact OH-CB 3.43Å; Y68-V84 HydrophobicContact CD1-CG2 3.65Å; Y68-V84 HydrophobicContact CE1-CG2 4.25Å; Y68-V84 HydrophobicContact CG-CG2 3.8Å
69	R	85.8	Confident	82	Confident	34 Å²	34	68.1 Å²	68.1	13%	0.128	36%	0.357	C	S	.	.	H	α-helix	trans	-55.7	-46.8	175	-176.9	-174.9	59.7	-159.6	4.9	111.3	I43 N44 A46 I65 V66 C71 I72 G73 G74 F75	I43-R69 WeakPolarHBondContact O-CD 3.16Å; I43-R69 PolarHBondContact O-NH1 3.02Å; N44-R69 WeakPolarHBondContact O-CD 3.24Å; N44-R69 PolarHBondContact O-NH1 2.91Å; A46-R69 PolarHBondContact O-NH1 2.81Å; A46-R69 VanDerWaalsContact O-NH1 3.13Å; I65-R69 VanDerWaalsContact O-CB 3.3Å; I65-R69 WeakPolarHBondContact O-CB 3.35Å; I65-R69 PolarHBondContact O-N 3.14Å; V66-R69 WeakPolarHBondContact O-CB 3.46Å; V66-R69 PolarHBondContact O-N 2.73Å; R69-C71 VanDerWaalsContact C-N 3.3Å; R69-C71 PolarHBondContact O-N 3.05Å; R69-I72 PolarHBondContact O-N 2.85Å; R69-G73 PolarHBondContact O-N 3.23Å; R69-G74 PolarHBondContact O-N 3.3Å; R69-F75 HydrophobicContact CB-CD2 4.14Å; R69-F75 HydrophobicContact CB-CE2 3.59Å; R69-F75 HydrophobicContact CB-CZ 4.27Å; R69-F75 HydrophobicContact CG-CD2 4.08Å; R69-F75 HydrophobicContact CG-CE2 4.05Å
70	D	76	Confident	81.7	Confident	106 Å²	106	62.5 Å²	62.5	57%	0.567	34%	0.34	S	S	*	.	H	α-helix	trans	-69.1	-32.1	-175.2	-66	-7.2	0	0	0	111.2	V66 E67 Y68	V66-D70 VanDerWaalsContact O-CG 3.27Å; V66-D70 PolarHBondContact O-N 2.79Å; V66-D70 VanDerWaalsContact O-N 3.08Å; E67-D70 PolarHBondContact O-N 3.35Å; Y68-D70 VanDerWaalsContact C-N 3.3Å; Y68-D70 PolarHBondContact O-N 3.15Å
71	C	64.4	Low	81.6	Confident	115 Å²	115	58.8 Å²	58.8	78%	0.777	31%	0.314	S	S	*	.	H	α-helix	trans	-70.1	-37.3	175.3	-68.1	0	0	0	0	113.9	E67 Y68 R69	E67-C71 PolarHBondContact O-N 2.89Å; E67-C71 PolarHBondContact O-SG 3.07Å; Y68-C71 PolarHBondContact O-N 2.97Å; R69-C71 VanDerWaalsContact C-N 3.3Å; R69-C71 PolarHBondContact O-N 3.05Å
72	I	72	Confident	81.5	Confident	77 Å²	77	60 Å²	60	40%	0.395	33%	0.325	S	S	.	.	H	α-helix	trans	-93	-6.2	-178.2	69.6	173.7	0	0	0	113.3	Y68 R69 F75	Y68-I72 HydrophobicContact CD1-CD1 3.95Å; Y68-I72 HydrophobicContact CD1-CG2 4.38Å; Y68-I72 HydrophobicContact CE1-CD1 3.73Å; Y68-I72 HydrophobicContact CE1-CG2 4.05Å; Y68-I72 WeakPolarHBondContact O-CG1 3.43Å; Y68-I72 PolarHBondContact O-N 2.82Å; R69-I72 PolarHBondContact O-N 2.85Å; I72-F75 HydrophobicContact CD1-CD1 3.73Å; I72-F75 HydrophobicContact CD1-CE1 3.98Å; I72-F75 HydrophobicContact CD1-CG 4.25Å
73	G	72.6	Confident	80.9	Confident	74 Å²	74	65.6 Å²	65.6	76%	0.763	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.7	27.2	-175.9	0	0	0	0	0	114.2	R69	R69-G73 PolarHBondContact O-N 3.23Å
74	G	77	Confident	80.8	Confident	17 Å²	17	61.6 Å²	61.6	18%	0.175	34%	0.335	C	S	.	.	S	Bend	trans	106.8	145.6	-179.1	0	0	0	0	0	115	R69	R69-G74 PolarHBondContact O-N 3.3Å
75	F	84.8	Confident	80.6	Confident	4 Å²	4	64 Å²	64	2%	0.018	36%	0.355	C	S	.	.			trans	-75.1	132.4	175.4	-61.6	-79.1	0	0	0	111.1	I43 N44 I65 Y68 R69 I72 D80 L81 V84 V101	I43-F75 HydrophobicContact CD1-CB 3.86Å; I43-F75 HydrophobicContact CD1-CD2 3.76Å; I43-F75 HydrophobicContact CD1-CE2 4.47Å; I43-F75 HydrophobicContact CD1-CG 3.87Å; I43-F75 HydrophobicContact CG1-CB 4.31Å; I43-F75 HydrophobicContact CG1-CD2 3.89Å; I43-F75 HydrophobicContact CG1-CG 4.38Å; N44-F75 PolarHBondContact ND2-O 2.92Å; N44-F75 PolarHBondContact OD1-N 3.33Å; I65-F75 HydrophobicContact CG2-CE2 4.08Å; I65-F75 HydrophobicContact CG2-CZ 4.37Å; Y68-F75 HydrophobicContact CD1-CD1 4.43Å; Y68-F75 AromaticContact CD1-CE1 3.38Å; Y68-F75 HydrophobicContact CD1-CE1 3.38Å; Y68-F75 AromaticContact CD1-CZ 3.64Å; Y68-F75 HydrophobicContact CD1-CZ 3.64Å; Y68-F75 HydrophobicContact CE1-CD1 4.48Å; Y68-F75 AromaticContact CE1-CE1 3.69Å; Y68-F75 HydrophobicContact CE1-CE1 3.69Å; Y68-F75 HydrophobicContact CE1-CZ 4.4Å; R69-F75 HydrophobicContact CB-CD2 4.14Å; R69-F75 HydrophobicContact CB-CE2 3.59Å; R69-F75 HydrophobicContact CB-CZ 4.27Å; R69-F75 HydrophobicContact CG-CD2 4.08Å; R69-F75 HydrophobicContact CG-CE2 4.05Å; I72-F75 HydrophobicContact CD1-CD1 3.73Å; I72-F75 HydrophobicContact CD1-CE1 3.98Å; I72-F75 HydrophobicContact CD1-CG 4.25Å; F75-D80 HydrophobicContact CD1-CB 3.82Å; F75-L81 HydrophobicContact CE1-CD1 4.14Å; F75-L81 HydrophobicContact CE2-CD1 4.01Å; F75-L81 HydrophobicContact CZ-CD1 3.74Å; F75-V84 HydrophobicContact CE1-CG2 3.83Å; F75-V84 HydrophobicContact CZ-CG2 3.68Å; F75-V101 HydrophobicContact CB-CG1 3.95Å
76	K	82.4	Confident	80.1	Confident	184 Å²	184	65.8 Å²	65.8	80%	0.8	37%	0.374	S	S	*	.	S	Bend	trans	-92	-23.3	177	-68	178.7	-177.6	170.4	0	111.8	D80	K76-D80 PolarHBondContact N-OD2 2.88Å
77	K	86.1	Confident	79.8	Confident	128 Å²	128	64.5 Å²	64.5	56%	0.557	37%	0.366	S	S	*	.	S	Bend	trans	-137.8	154.8	176.3	-64.1	-176.2	-178.6	179.4	0	110.8	E79 D80	K77-E79 WeakPolarHBondContact CB-OE2 3.4Å; K77-E79 PolarHBondContact O-N 3.28Å; K77-D80 PolarHBondContact N-OD2 3.36Å; K77-D80 WeakPolarHBondContact O-CB 3.23Å; K77-D80 PolarHBondContact O-N 3.05Å
78	V	85.6	Confident	79.8	Confident	19 Å²	19	61.2 Å²	61.2	12%	0.115	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-64.8	-33	174.8	171	0	0	0	0	110.2	D80 L81 L92 K96 I99 V101	V78-D80 PolarHBondContact O-N 3.28Å; V78-L81 WeakPolarHBondContact O-CB 3.35Å; V78-L81 PolarHBondContact O-N 2.9Å; V78-L81 VanDerWaalsContact O-N 3.11Å; V78-L92 HydrophobicContact CG1-CD1 4.05Å; V78-L92 WeakPolarHBondContact O-CD1 3.27Å; V78-K96 HydrophobicContact CG1-CG 4.15Å; V78-I99 HydrophobicContact CG1-CD1 3.46Å; V78-I99 VanDerWaalsContact CG1-CD1 3.46Å; V78-I99 HydrophobicContact CG1-CG1 3.57Å; V78-I99 HydrophobicContact CG2-CG1 4.37Å; V78-V101 HydrophobicContact CG2-CG1 4.11Å
79	E	87.1	Confident	79.8	Confident	89 Å²	89	61 Å²	61	42%	0.416	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-65.2	-24.7	178.9	-64.3	71.8	-155.4	0	0	113.6	K77 L81 A82 K96	K77-E79 WeakPolarHBondContact CB-OE2 3.4Å; K77-E79 PolarHBondContact O-N 3.28Å; E79-L81 PolarHBondContact O-N 2.91Å; E79-A82 WeakPolarHBondContact O-CB 3.11Å; E79-A82 PolarHBondContact O-N 3.28Å; E79-A82 VanDerWaalsContact O-N 3.09Å; E79-K96 WeakPolarHBondContact OE1-CE 3.36Å; E79-K96 IonicContact OE1-NZ 2.86Å
80	D	82.1	Confident	79.5	Confident	45 Å²	45	65.3 Å²	65.3	24%	0.241	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	-64.6	-19.7	176.5	-59.6	-21.7	0	0	0	111.2	F75 K76 K77 V78 A82 L83	F75-D80 HydrophobicContact CD1-CB 3.82Å; K76-D80 PolarHBondContact N-OD2 2.88Å; K77-D80 PolarHBondContact N-OD2 3.36Å; K77-D80 WeakPolarHBondContact O-CB 3.23Å; K77-D80 PolarHBondContact O-N 3.05Å; V78-D80 PolarHBondContact O-N 3.28Å; D80-A82 PolarHBondContact O-N 3.35Å; D80-L83 VanDerWaalsContact O-CB 3.28Å; D80-L83 WeakPolarHBondContact O-CB 3.48Å; D80-L83 PolarHBondContact O-N 3.48Å; D80-L83 VanDerWaalsContact O-N 3.09Å
81	L	83.5	Confident	79.7	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-66.6	-21.6	175.5	-163.1	70.6	0	0	0	112.5	I43 I65 F75 V78 E79 L83 V84 V87 L92 I95 I99	I43-L81 HydrophobicContact CD1-CB 4.5Å; I43-L81 HydrophobicContact CD1-CD1 4.28Å; I43-L81 HydrophobicContact CG2-CD2 4.48Å; I65-L81 HydrophobicContact CB-CD1 4.28Å; I65-L81 HydrophobicContact CD1-CD1 4.08Å; I65-L81 HydrophobicContact CG1-CD1 3.77Å; I65-L81 HydrophobicContact CG2-CD1 3.62Å; F75-L81 HydrophobicContact CE1-CD1 4.14Å; F75-L81 HydrophobicContact CE2-CD1 4.01Å; F75-L81 HydrophobicContact CZ-CD1 3.74Å; V78-L81 WeakPolarHBondContact O-CB 3.35Å; V78-L81 PolarHBondContact O-N 2.9Å; V78-L81 VanDerWaalsContact O-N 3.11Å; E79-L81 PolarHBondContact O-N 2.91Å; L81-L83 PolarHBondContact O-N 2.87Å; L81-V84 HydrophobicContact CD1-CG2 4.01Å; L81-V84 WeakPolarHBondContact O-CB 3.43Å; L81-V84 PolarHBondContact O-N 2.96Å; L81-V84 VanDerWaalsContact O-N 3.13Å; L81-V87 HydrophobicContact CD2-CG1 4.45Å; L81-V87 HydrophobicContact CG-CG1 4.23Å; L81-V87 HydrophobicContact CG-CG2 4.4Å; L81-V87 WeakPolarHBondContact O-CB 3.47Å; L81-L92 HydrophobicContact CB-CD1 4.09Å; L81-L92 HydrophobicContact CD2-CD1 4.33Å; L81-I95 HydrophobicContact CD2-CD1 3.8Å; L81-I99 HydrophobicContact CD2-CD1 3.51Å
82	A	83.6	Confident	80.8	Confident	36 Å²	36	58.5 Å²	58.5	30%	0.298	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-67.6	-17.7	172.5	0	0	0	0	0	113.1	E79 D80 L92	E79-A82 WeakPolarHBondContact O-CB 3.11Å; E79-A82 PolarHBondContact O-N 3.28Å; E79-A82 VanDerWaalsContact O-N 3.09Å; D80-A82 PolarHBondContact O-N 3.35Å; A82-L92 HydrophobicContact CB-CB 4.49Å; A82-L92 HydrophobicContact CB-CD2 3.66Å
83	L	78	Confident	81.4	Confident	116 Å²	116	60.2 Å²	60.2	61%	0.607	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-79.4	-8.9	175.1	-55	174	0	0	0	112.2	Y68 D80 L81	Y68-L83 HydrophobicContact CE1-CB 4.34Å; Y68-L83 WeakPolarHBondContact OH-CB 3.43Å; D80-L83 VanDerWaalsContact O-CB 3.28Å; D80-L83 WeakPolarHBondContact O-CB 3.48Å; D80-L83 PolarHBondContact O-N 3.48Å; D80-L83 VanDerWaalsContact O-N 3.09Å; L81-L83 PolarHBondContact O-N 2.87Å
84	V	83.6	Confident	81.8	Confident	4 Å²	4	59.6 Å²	59.6	2%	0.024	35%	0.349	C	S	.	.	S	Bend	trans	-81.7	130.5	176.9	-176.7	0	0	0	0	110.6	N64 I65 Y68 F75 L81 G86 V87	N64-V84 HydrophobicContact CB-CG1 3.77Å; N64-V84 WeakPolarHBondContact O-CG1 3.11Å; I65-V84 HydrophobicContact CB-CG1 4.43Å; I65-V84 HydrophobicContact CG1-CB 4.39Å; I65-V84 HydrophobicContact CG1-CG1 3.79Å; Y68-V84 HydrophobicContact CD1-CG2 3.65Å; Y68-V84 HydrophobicContact CE1-CG2 4.25Å; Y68-V84 HydrophobicContact CG-CG2 3.8Å; F75-V84 HydrophobicContact CE1-CG2 3.83Å; F75-V84 HydrophobicContact CZ-CG2 3.68Å; L81-V84 HydrophobicContact CD1-CG2 4.01Å; L81-V84 WeakPolarHBondContact O-CB 3.43Å; L81-V84 PolarHBondContact O-N 2.96Å; L81-V84 VanDerWaalsContact O-N 3.13Å; V84-G86 PolarHBondContact O-N 3.01Å; V84-V87 HydrophobicContact CB-CG2 4.04Å; V84-V87 HydrophobicContact CG1-CG2 4.23Å; V84-V87 PolarHBondContact O-N 2.83Å
85	S	79.1	Confident	82.3	Confident	92 Å²	92	58.8 Å²	58.8	64%	0.643	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	123.2	178.3	-171.5	0	0	0	0	111.5	N64	N64-S85 PolarHBondContact ND2-O 2.94Å
86	G	76.1	Confident	82.3	Confident	38 Å²	38	61.6 Å²	61.6	39%	0.392	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.7	-4.3	179	0	0	0	0	0	116.1	V84 K91	V84-G86 PolarHBondContact O-N 3.01Å; G86-K91 WeakPolarHBondContact O-CD 3.21Å; G86-K91 WeakPolarHBondContact O-CE 3.43Å; G86-K91 PolarHBondContact O-NZ 2.64Å
87	V	82.5	Confident	82.3	Confident	4 Å²	4	59.3 Å²	59.3	2%	0.024	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-61.8	170.8	-177.3	0	0	0	0	110.1	V61 I65 L81 V84 K91 L92 I95	V61-V87 HydrophobicContact CG1-CG2 3.57Å; I65-V87 HydrophobicContact CD1-CG2 3.9Å; I65-V87 HydrophobicContact CG1-CG2 3.97Å; L81-V87 HydrophobicContact CD2-CG1 4.45Å; L81-V87 HydrophobicContact CG-CG1 4.23Å; L81-V87 HydrophobicContact CG-CG2 4.4Å; L81-V87 WeakPolarHBondContact O-CB 3.47Å; V84-V87 HydrophobicContact CB-CG2 4.04Å; V84-V87 HydrophobicContact CG1-CG2 4.23Å; V84-V87 PolarHBondContact O-N 2.83Å; V87-K91 HydrophobicContact CG1-CB 4.46Å; V87-K91 WeakPolarHBondContact O-CB 3.33Å; V87-K91 VanDerWaalsContact O-CG 3.29Å; V87-K91 WeakPolarHBondContact O-CG 3.43Å; V87-L92 HydrophobicContact CG1-CB 4.2Å; V87-I95 HydrophobicContact CG1-CD1 4.36Å
88	G	76.9	Confident	82.2	Confident	29 Å²	29	57 Å²	57	30%	0.299	34%	0.34	S	S	.	.	H	α-helix	trans	59.1	177.1	-179.5	0	0	0	0	0	114.3	T90 L92	G88-T90 VanDerWaalsContact C-N 3.34Å; G88-T90 PolarHBondContact O-N 3.05Å; G88-L92 VanDerWaalsContact O-CB 3.23Å; G88-L92 WeakPolarHBondContact O-CB 3.44Å; G88-L92 PolarHBondContact O-N 3.15Å; G88-L92 VanDerWaalsContact O-N 3.13Å
89	A	76.8	Confident	82.2	Confident	71 Å²	71	56.3 Å²	56.3	59%	0.587	34%	0.335	S	S	*	.	H	α-helix	trans	-65.9	-35.6	-176.6	0	0	0	0	0	113	E93	A89-E93 WeakPolarHBondContact O-CG 3.49Å; A89-E93 PolarHBondContact O-N 3.11Å; A89-E93 VanDerWaalsContact O-N 3.16Å
90	T	79	Confident	82.2	Confident	123 Å²	123	53.2 Å²	53.2	76%	0.755	32%	0.324	S	S	*	.	H	α-helix	trans	-69.6	-44.3	-176.3	44.8	0	0	0	0	113.1	G88	G88-T90 VanDerWaalsContact C-N 3.34Å; G88-T90 PolarHBondContact O-N 3.05Å
91	K	80.2	Confident	82.3	Confident	71 Å²	71	52.7 Å²	52.7	31%	0.309	32%	0.322	S	S	.	.	H	α-helix	trans	-78.4	-32.2	177.3	-50.5	-179.3	-176	173.3	0	111.9	G86 V87 E93 A94 I95	G86-K91 WeakPolarHBondContact O-CD 3.21Å; G86-K91 WeakPolarHBondContact O-CE 3.43Å; G86-K91 PolarHBondContact O-NZ 2.64Å; V87-K91 HydrophobicContact CG1-CB 4.46Å; V87-K91 WeakPolarHBondContact O-CB 3.33Å; V87-K91 VanDerWaalsContact O-CG 3.29Å; V87-K91 WeakPolarHBondContact O-CG 3.43Å; K91-E93 VanDerWaalsContact C-N 3.32Å; K91-E93 PolarHBondContact O-N 2.83Å; K91-A94 WeakPolarHBondContact O-CB 3.46Å; K91-A94 PolarHBondContact O-N 2.81Å; K91-A94 VanDerWaalsContact O-N 3.14Å; K91-I95 WeakPolarHBondContact O-CG1 3.31Å; K91-I95 PolarHBondContact O-N 2.93Å; K91-I95 VanDerWaalsContact O-N 3.15Å
92	L	87.6	Confident	81.9	Confident	7 Å²	7	56.7 Å²	56.7	4%	0.037	35%	0.35	C	S	.	.	H	α-helix	trans	-54.9	-49.5	173	177.2	63	0	0	0	110.7	V78 L81 A82 V87 G88 A94 I95 K96 I99	V78-L92 HydrophobicContact CG1-CD1 4.05Å; V78-L92 WeakPolarHBondContact O-CD1 3.27Å; L81-L92 HydrophobicContact CB-CD1 4.09Å; L81-L92 HydrophobicContact CD2-CD1 4.33Å; A82-L92 HydrophobicContact CB-CB 4.49Å; A82-L92 HydrophobicContact CB-CD2 3.66Å; V87-L92 HydrophobicContact CG1-CB 4.2Å; G88-L92 VanDerWaalsContact O-CB 3.23Å; G88-L92 WeakPolarHBondContact O-CB 3.44Å; G88-L92 PolarHBondContact O-N 3.15Å; G88-L92 VanDerWaalsContact O-N 3.13Å; L92-A94 PolarHBondContact O-N 3.28Å; L92-I95 PolarHBondContact O-N 2.82Å; L92-I95 VanDerWaalsContact O-N 3.15Å; L92-K96 WeakPolarHBondContact O-CA 3.45Å; L92-K96 VanDerWaalsContact O-CB 3.25Å; L92-K96 WeakPolarHBondContact O-CB 3.31Å; L92-K96 PolarHBondContact O-N 2.85Å; L92-I99 HydrophobicContact CD1-CD1 4.33Å
93	E	84.1	Confident	80.6	Confident	113 Å²	113	59.4 Å²	59.4	53%	0.528	37%	0.367	S	S	.	.	H	α-helix	trans	-62.5	-28.3	-179.7	-71.2	-59.7	140.2	0	0	113.2	A89 K91 K96	A89-E93 WeakPolarHBondContact O-CG 3.49Å; A89-E93 PolarHBondContact O-N 3.11Å; A89-E93 VanDerWaalsContact O-N 3.16Å; K91-E93 VanDerWaalsContact C-N 3.32Å; K91-E93 PolarHBondContact O-N 2.83Å; E93-K96 IonicContact OE1-NZ 3.66Å; E93-K96 PolarHBondContact OE1-NZ 3.25Å; E93-K96 IonicContact OE2-NZ 2.73Å
94	A	81.9	Confident	79.3	Confident	61 Å²	61	64.7 Å²	64.7	50%	0.504	38%	0.379	S	S	.	.	H	α-helix	trans	-72.7	-35.4	175.3	0	0	0	0	0	113.2	K91 L92	K91-A94 WeakPolarHBondContact O-CB 3.46Å; K91-A94 PolarHBondContact O-N 2.81Å; K91-A94 VanDerWaalsContact O-N 3.14Å; L92-A94 PolarHBondContact O-N 3.28Å
95	I	88	Confident	77.1	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	42%	0.415	C	S	.	.	H	α-helix	trans	-99.6	-12.2	-175.7	67.8	-177	0	0	0	113.4	L54 P55 V57 L81 V87 K91 L92 L97 E98 I99	L54-I95 HydrophobicContact CB-CB 4.46Å; L54-I95 HydrophobicContact CB-CG2 3.96Å; L54-I95 HydrophobicContact CD1-CD1 4.38Å; P55-I95 HydrophobicContact CG-CG2 3.92Å; P55-I95 WeakPolarHBondContact O-CG2 3.35Å; V57-I95 HydrophobicContact CG2-CD1 4.2Å; V57-I95 HydrophobicContact CG2-CG2 4.44Å; L81-I95 HydrophobicContact CD2-CD1 3.8Å; V87-I95 HydrophobicContact CG1-CD1 4.36Å; K91-I95 WeakPolarHBondContact O-CG1 3.31Å; K91-I95 PolarHBondContact O-N 2.93Å; K91-I95 VanDerWaalsContact O-N 3.15Å; L92-I95 PolarHBondContact O-N 2.82Å; L92-I95 VanDerWaalsContact O-N 3.15Å; I95-L97 PolarHBondContact O-N 3.18Å; I95-E98 PolarHBondContact O-N 3.17Å; I95-I99 HydrophobicContact CD1-CD1 4.13Å; I95-I99 HydrophobicContact CG1-CD1 3.91Å; I95-I99 WeakPolarHBondContact O-CG1 3.4Å; I95-I99 PolarHBondContact O-N 3.45Å
96	K	83.8	Confident	75.5	Confident	64 Å²	64	73 Å²	73	28%	0.278	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-33.5	-172.7	-166	174.4	-171.1	173	0	114.3	V78 E79 L92 E93 E98	V78-K96 HydrophobicContact CG1-CG 4.15Å; E79-K96 WeakPolarHBondContact OE1-CE 3.36Å; E79-K96 IonicContact OE1-NZ 2.86Å; L92-K96 WeakPolarHBondContact O-CA 3.45Å; L92-K96 VanDerWaalsContact O-CB 3.25Å; L92-K96 WeakPolarHBondContact O-CB 3.31Å; L92-K96 PolarHBondContact O-N 2.85Å; E93-K96 IonicContact OE1-NZ 3.66Å; E93-K96 PolarHBondContact OE1-NZ 3.25Å; E93-K96 IonicContact OE2-NZ 2.73Å; K96-E98 VanDerWaalsContact C-N 3.33Å
97	L	82.3	Confident	73.6	Confident	135 Å²	135	77.2 Å²	77.2	71%	0.707	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-18.4	-179.3	-66	177.1	0	0	0	113.2	R40 I95	R40-L97 PolarHBondContact NE-O 3.26Å; I95-L97 PolarHBondContact O-N 3.18Å
98	E	83.8	Confident	71.6	Confident	81 Å²	81	82.2 Å²	82.2	38%	0.379	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-6.9	-175.9	-61.8	-176.3	-178.9	0	0	113.1	R40 L41 L54 P55 I95 K96	R40-E98 CarbonylContact C-O 3.43Å; R40-E98 WeakPolarHBondContact CA-O 3.11Å; L41-E98 PolarHBondContact N-O 3.34Å; L54-E98 HydrophobicContact CD2-CB 3.88Å; P55-E98 WeakPolarHBondContact CD-OE2 3.42Å; I95-E98 PolarHBondContact O-N 3.17Å; K96-E98 VanDerWaalsContact C-N 3.33Å
99	I	87	Confident	70.1	Confident	3 Å²	3	89 Å²	89	2%	0.015	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	156.2	-173.9	63.8	177.2	0	0	0	114.2	L41 I43 L54 V78 L81 L92 I95	L41-I99 HydrophobicContact CB-CG2 4.5Å; L41-I99 CarbonylContact O-C 3.49Å; L41-I99 VanDerWaalsContact O-CA 3.24Å; L41-I99 WeakPolarHBondContact O-CA 3.42Å; I43-I99 HydrophobicContact CG2-CB 3.8Å; I43-I99 HydrophobicContact CG2-CD1 4.14Å; I43-I99 HydrophobicContact CG2-CG1 4.47Å; I43-I99 HydrophobicContact CG2-CG2 4Å; L54-I99 HydrophobicContact CD1-CG2 3.44Å; L54-I99 VanDerWaalsContact CD1-CG2 3.44Å; L54-I99 HydrophobicContact CD2-CG2 3.65Å; L54-I99 HydrophobicContact CG-CG2 4.21Å; V78-I99 HydrophobicContact CG1-CD1 3.46Å; V78-I99 VanDerWaalsContact CG1-CD1 3.46Å; V78-I99 HydrophobicContact CG1-CG1 3.57Å; V78-I99 HydrophobicContact CG2-CG1 4.37Å; L81-I99 HydrophobicContact CD2-CD1 3.51Å; L92-I99 HydrophobicContact CD1-CD1 4.33Å; I95-I99 HydrophobicContact CD1-CD1 4.13Å; I95-I99 HydrophobicContact CG1-CD1 3.91Å; I95-I99 WeakPolarHBondContact O-CG1 3.4Å; I95-I99 PolarHBondContact O-N 3.45Å
100	C	85.3	Confident	67.8	Low	25 Å²	25	94.4 Å²	94.4	17%	0.169	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	167	174.8	72.6	0	0	0	0	112.3	R40 L41 N42 I43	R40-C100 HydrophobicContact CB-CB 4Å; R40-C100 PolarHBondContact O-SG 3.28Å; L41-C100 PolarHBondContact O-N 3.28Å; N42-C100 CarbonylContact C-O 3.54Å; N42-C100 VanDerWaalsContact CA-O 3.28Å; N42-C100 WeakPolarHBondContact CA-O 3.15Å; N42-C100 PolarHBondContact OD1-O 3.41Å; I43-C100 WeakPolarHBondContact CG1-O 3.33Å; I43-C100 PolarHBondContact N-O 3.46Å
101	V	84.5	Confident	65.9	Low	33 Å²	33	94 Å²	94	20%	0.2	52%	0.518	C	S	.	.	S	Bend	trans	-110.6	-2.2	-179.8	-73.1	0	0	0	0	114	I43 N44 F75 V78	I43-V101 HydrophobicContact CD1-CG1 3.59Å; I43-V101 HydrophobicContact CG1-CG1 3.81Å; N44-V101 PolarHBondContact ND2-O 2.83Å; F75-V101 HydrophobicContact CB-CG1 3.95Å; V78-V101 HydrophobicContact CG2-CG1 4.11Å
102	S	76.2	Confident	64.6	Low	84 Å²	84	96.2 Å²	96.2	59%	0.587	54%	0.54	S	S	*	.	S	Bend	trans	-149.5	129.9	-174.8	52.7	0	0	0	0	110.9	R104	S102-R104 PolarHBondContact O-N 2.91Å
103	S	56.6	Low	61.8	Low	94 Å²	94	101.2 Å²	101.2	66%	0.657	58%	0.575	S	S	*	*			trans	-71	127.5	174.8	56.9	0	0	0	0	110.2	T105	S103-T105 PolarHBondContact O-N 2.83Å
104	R	49.2	Very low	59.5	Low	227 Å²	227	100.7 Å²	100.7	86%	0.857	58%	0.584	S	S	*	*			trans	-93.9	95.3	178.2	-165.7	170.4	169.3	-175.5	-4.2	107.9	S102 N106	S102-R104 PolarHBondContact O-N 2.91Å; R104-N106 PolarHBondContact O-N 3.21Å
105	T	38.1	Very low	57.1	Low	129 Å²	129	105.5 Å²	105.5	79%	0.791	60%	0.6	S	S	*	*			trans	-77.5	115.3	169	47.9	0	0	0	0	109.1	S103 S107	S103-T105 PolarHBondContact O-N 2.83Å; T105-S107 PolarHBondContact O-N 3.31Å
106	N	46.5	Very low	54.4	Low	140 Å²	140	117.5 Å²	117.5	75%	0.749	65%	0.646	S	S	*	*			trans	-72.4	114.5	168.9	-85.3	-20.4	0	0	0	108.9	R104	R104-N106 PolarHBondContact O-N 3.21Å
107	S	34.6	Very low	52	Low	128 Å²	128	124.9 Å²	124.9	90%	0.895	67%	0.672	S	S	*	*			trans	-158.9	133.3	153.5	-78.6	0	0	0	0	110.3	T105	T105-S107 PolarHBondContact O-N 3.31Å
108	S	41.5	Very low	49.3	Very low	108 Å²	108	126.6 Å²	126.6	76%	0.755	68%	0.682	S	S	*	*			trans	-109.7	148.5	-160.2	44	0	0	0	0	112.9
109	Q	45	Very low	46.9	Very low	171 Å²	171	127.7 Å²	127.7	80%	0.799	69%	0.694	S	S	*	*			trans	71.6	99	155.5	-62.8	-179.6	16.6	0	0	119.8
110	H	29.4	Very low	44	Very low	185 Å²	185	137 Å²	137	86%	0.856	74%	0.737	S	S	*	*				-179.5	133	105.9	-101.8	-79.7	0	0	0	109
111	S	37.7	Very low	41.8	Very low	115 Å²	115	144.2 Å²	144.2	80%	0.804	77%	0.768	S	S	*	*			trans	-82.8	156.9	-177.2	-45.9	0	0	0	0	111.2
112	P	52.8	Low	39.2	Very low	118 Å²	118	150.9 Å²	150.9	77%	0.766	80%	0.797	S	S	*	*				-139.6	171.1	70.7	32	-12	0	0	0	114
113	S	30.2	Very low	37.4	Very low	111 Å²	111	152.1 Å²	152.1	78%	0.776	80%	0.803	S	S	*	*			trans	97.2	125.5	154.3	77	0	0	0	0	120.5
114	S	34.4	Very low	36.5	Very low	103 Å²	103	153.1 Å²	153.1	72%	0.72	81%	0.809	S	S	*	*			trans	80.7	106.4	138.4	-60.1	0	0	0	0	121.6
115	L	32.6	Very low	36.8	Very low	162 Å²	162	148 Å²	148	85%	0.848	80%	0.803	S	S	*	*			trans	72.2	88.8	130.8	-56.7	179.2	0	0	0	117.2
116	R	31.5	Very low	38	Very low	251 Å²	251	143.3 Å²	143.3	95%	0.947	78%	0.781	S	S	*	*			trans	-67.4	130.6	150.5	-74.5	-172.8	176.8	-178.2	-0.2	109.9
117	R	32.7	Very low	39.7	Very low	220 Å²	220	138.5 Å²	138.5	83%	0.83	75%	0.754	S	S	*	*			trans	-43.7	148.5	152.6	-70.9	163.4	-128.3	162.9	0.1	111.1
118	D	26.1	Very low	42	Very low	170 Å²	170	132.8 Å²	132.8	91%	0.909	71%	0.714	S	S	*	*			trans	-122.2	148.1	132.2	-97.6	-39.7	0	0	0	110.8
119	V	33	Very low	44.1	Very low	105 Å²	105	127.8 Å²	127.8	64%	0.636	68%	0.679	S	S	*	*			trans	-102.1	128.5	-178.2	166.7	0	0	0	0	106.7
120	E	26.7	Very low	46	Very low	198 Å²	198	121.1 Å²	121.1	93%	0.925	65%	0.648	S	S	*	*			trans	-136	144.7	152.3	-77.1	-164.5	152.6	0	0	110.3
121	H	37.7	Very low	48.5	Very low	176 Å²	176	117 Å²	117	82%	0.815	64%	0.636	S	S	*	*			trans	-82.8	146.4	-172	-77.3	-63.3	0	0	0	113.2
122	Q	31.1	Very low	50.6	Low	173 Å²	173	111.7 Å²	111.7	81%	0.808	60%	0.599	S	S	*	*			trans	-154.8	142.8	155.7	-118.4	142.5	2	0	0	112.4	C124	Q122-C124 PolarHBondContact O-N 3.05Å
123	P	38.2	Very low	52.2	Low	111 Å²	111	109.5 Å²	109.5	72%	0.721	58%	0.584	S	S	*	*			trans	-75.9	119.1	-175.5	31.2	-30.1	0	0	0	108.9	T125	P123-T125 PolarHBondContact O-N 2.92Å
124	C	38.3	Very low	54.5	Low	115 Å²	115	106.6 Å²	106.6	78%	0.777	57%	0.567	S	S	*	*			trans	-81.6	77.5	179.5	-70.1	0	0	0	0	110.4	Q122	Q122-C124 PolarHBondContact O-N 3.05Å
125	T	54.9	Low	56.5	Low	118 Å²	118	105.3 Å²	105.3	72%	0.724	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-58.5	128.5	140.9	42.3	0	0	0	0	106.3	P123	P123-T125 PolarHBondContact O-N 2.92Å
126	G	63.9	Low	58.7	Low	32 Å²	32	102.3 Å²	102.3	33%	0.33	54%	0.544	S	S	.	.	P	Polyproline II helix	trans	-54	151.2	178.4	0	0	0	0	0	111	Q184 Y186	G126-Q184 CarbonylContact C-O 3.6Å; G126-Q184 WeakPolarHBondContact CA-O 3.39Å; G126-Y186 WeakPolarHBondContact O-CE1 3.4Å
127	I	80.4	Confident	61	Low	39 Å²	39	90.4 Å²	90.4	20%	0.2	50%	0.499	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	126.1	-175.6	-68.2	162.4	0	0	0	109.7	I129 A132 Q136 L137 I140 Q184 V185 Y186	I127-I129 PolarHBondContact O-N 2.77Å; I127-A132 HydrophobicContact CG2-CB 3.48Å; I127-A132 VanDerWaalsContact CG2-CB 3.48Å; I127-Q136 WeakPolarHBondContact CD1-O 3.29Å; I127-L137 HydrophobicContact CG2-CD2 4.17Å; I127-I140 HydrophobicContact CB-CD1 4.15Å; I127-I140 HydrophobicContact CB-CG1 4.35Å; I127-I140 HydrophobicContact CD1-CD1 4.18Å; I127-I140 HydrophobicContact CD1-CG1 3.53Å; I127-I140 HydrophobicContact CG2-CD1 4.09Å; I127-Q184 PolarHBondContact N-O 3.06Å; I127-V185 CarbonylContact O-C 3.57Å; I127-V185 VanDerWaalsContact O-CA 3.25Å; I127-V185 WeakPolarHBondContact O-CA 3.4Å; I127-Y186 PolarHBondContact O-N 2.85Å
128	N	83.2	Confident	63	Low	8 Å²	8	84 Å²	84	4%	0.043	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	116.4	178.6	-174.9	-29.4	0	0	0	110.8	N130 T131 A132 Y186 E188	N128-N130 VanDerWaalsContact C-N 3.27Å; N128-N130 PolarHBondContact O-N 2.74Å; N128-N130 WeakPolarHBondContact OD1-CB 3.12Å; N128-N130 PolarHBondContact OD1-N 3.08Å; N128-T131 VanDerWaalsContact CB-OG1 3.29Å; N128-T131 WeakPolarHBondContact CB-OG1 3.49Å; N128-T131 VanDerWaalsContact CG-OG1 3.25Å; N128-T131 PolarHBondContact ND2-OG1 2.89Å; N128-T131 PolarHBondContact O-N 3.44Å; N128-T131 PolarHBondContact OD1-N 3.46Å; N128-A132 WeakPolarHBondContact O-CB 3.42Å; N128-A132 PolarHBondContact O-N 3.43Å; N128-Y186 WeakPolarHBondContact CA-O 3.25Å; N128-Y186 HydrophobicContact CB-CD1 4.48Å; N128-Y186 HydrophobicContact CB-CD2 4.46Å; N128-Y186 HydrophobicContact CB-CE1 3.91Å; N128-Y186 HydrophobicContact CB-CE2 3.87Å; N128-E188 WeakPolarHBondContact ND2-CB 3.19Å; N128-E188 PolarHBondContact ND2-OE2 2.87Å
129	I	87.2	Confident	65.3	Low	3 Å²	3	79.7 Å²	79.7	2%	0.015	46%	0.463	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-29.2	-174.9	-62	153	0	0	0	112.3	I127 I151 R155 F161 I164 L167 V185 Y186 V187	I127-I129 PolarHBondContact O-N 2.77Å; I129-I151 HydrophobicContact CG2-CG2 3.91Å; I129-R155 PolarHBondContact O-NH1 3.4Å; I129-F161 HydrophobicContact CG2-CD2 3.65Å; I129-F161 HydrophobicContact CG2-CE2 3.87Å; I129-I164 HydrophobicContact CD1-CG1 4.45Å; I129-L167 HydrophobicContact CD1-CD1 3.48Å; I129-L167 VanDerWaalsContact CD1-CD1 3.48Å; I129-L167 HydrophobicContact CD1-CG 4.26Å; I129-L167 HydrophobicContact CG1-CD1 4.3Å; I129-L167 HydrophobicContact CG2-CD1 4.48Å; I129-L167 HydrophobicContact CG2-CD2 3.94Å; I129-L167 HydrophobicContact CG2-CG 4.49Å; I129-V185 HydrophobicContact CD1-CB 3.7Å; I129-V185 HydrophobicContact CD1-CG2 3.61Å; I129-V185 HydrophobicContact CG1-CB 3.78Å; I129-V185 HydrophobicContact CG1-CG1 4.32Å; I129-V185 HydrophobicContact CG1-CG2 4.23Å; I129-Y186 PolarHBondContact N-O 3.17Å; I129-V187 HydrophobicContact CB-CG2 4.38Å; I129-V187 HydrophobicContact CD1-CG2 3.86Å
130	N	84.4	Confident	67.5	Low	31 Å²	31	74.8 Å²	74.8	17%	0.166	43%	0.433	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-30.6	-178.1	-73.5	-25.2	0	0	0	112.7	N128 R155 P160 F161	N128-N130 VanDerWaalsContact C-N 3.27Å; N128-N130 PolarHBondContact O-N 2.74Å; N128-N130 WeakPolarHBondContact OD1-CB 3.12Å; N128-N130 PolarHBondContact OD1-N 3.08Å; N130-R155 PolarHBondContact O-NH1 3.43Å; N130-P160 HydrophobicContact CB-CB 4.35Å; N130-F161 PolarHBondContact ND2-O 2.89Å; N130-F161 WeakPolarHBondContact OD1-CD2 3.38Å; N130-F161 PolarHBondContact OD1-N 3.46Å
131	T	81.5	Confident	69.2	Low	97 Å²	97	75.3 Å²	75.3	60%	0.595	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.7	-17.4	-175.3	60.3	0	0	0	0	114	N128	N128-T131 VanDerWaalsContact CB-OG1 3.29Å; N128-T131 WeakPolarHBondContact CB-OG1 3.49Å; N128-T131 VanDerWaalsContact CG-OG1 3.25Å; N128-T131 PolarHBondContact ND2-OG1 2.89Å; N128-T131 PolarHBondContact O-N 3.44Å; N128-T131 PolarHBondContact OD1-N 3.46Å
132	A	82.8	Confident	70.6	Confident	4 Å²	4	69 Å²	69	3%	0.033	41%	0.409	C	S	.	.			trans	-63.5	139.3	-178.6	0	0	0	0	0	112.7	I127 N128 Q136 L137 R155	I127-A132 HydrophobicContact CG2-CB 3.48Å; I127-A132 VanDerWaalsContact CG2-CB 3.48Å; N128-A132 WeakPolarHBondContact O-CB 3.42Å; N128-A132 PolarHBondContact O-N 3.43Å; A132-Q136 HydrophobicContact CB-CB 4.11Å; A132-L137 HydrophobicContact CB-CD2 3.77Å; A132-L137 HydrophobicContact CB-CG 3.82Å; A132-R155 VanDerWaalsContact O-CZ 3.23Å; A132-R155 PolarHBondContact O-NH1 2.81Å; A132-R155 PolarHBondContact O-NH2 2.79Å
133	T	84.4	Confident	72.9	Confident	72 Å²	72	61.5 Å²	61.5	44%	0.442	37%	0.374	S	S	.	.			trans	-72.2	162	170.7	60.3	0	0	0	0	111.2	A135 Q136 L137	T133-A135 PolarHBondContact O-N 2.89Å; T133-Q136 PolarHBondContact O-N 2.91Å; T133-Q136 VanDerWaalsContact OG1-CD 3.29Å; T133-Q136 VanDerWaalsContact OG1-CG 3.28Å; T133-Q136 WeakPolarHBondContact OG1-CG 3.37Å; T133-Q136 PolarHBondContact OG1-N 3.29Å; T133-Q136 PolarHBondContact OG1-OE1 3.12Å; T133-L137 PolarHBondContact O-N 3.13Å
134	A	79.4	Confident	75	Confident	50 Å²	50	59.8 Å²	59.8	41%	0.413	36%	0.362	S	S	.	.	H	α-helix	trans	-56.2	-38.2	176.3	0	0	0	0	0	112	L137 M138 V148 V152	A134-L137 PolarHBondContact O-N 3.42Å; A134-M138 VanDerWaalsContact O-CG 3.27Å; A134-M138 WeakPolarHBondContact O-CG 3.45Å; A134-M138 PolarHBondContact O-N 2.84Å; A134-V148 HydrophobicContact CB-CG1 3.94Å; A134-V148 WeakPolarHBondContact O-CG1 3.44Å; A134-V152 HydrophobicContact CB-CG2 4.39Å
135	A	76.9	Confident	77	Confident	77 Å²	77	60 Å²	60	64%	0.636	35%	0.352	S	S	*	.	H	α-helix	trans	-64.4	-39.3	175.8	0	0	0	0	0	112.7	T133 M138	T133-A135 PolarHBondContact O-N 2.89Å; A135-M138 PolarHBondContact O-N 3.16Å
136	Q	78.2	Confident	78.3	Confident	98 Å²	98	59.7 Å²	59.7	46%	0.458	34%	0.34	S	S	.	.	H	α-helix	trans	-72	-31.7	176.1	-71.9	165.6	-39.8	0	0	112.4	I127 A132 T133 M138 S139	I127-Q136 WeakPolarHBondContact CD1-O 3.29Å; A132-Q136 HydrophobicContact CB-CB 4.11Å; T133-Q136 PolarHBondContact O-N 2.91Å; T133-Q136 VanDerWaalsContact OG1-CD 3.29Å; T133-Q136 VanDerWaalsContact OG1-CG 3.28Å; T133-Q136 WeakPolarHBondContact OG1-CG 3.37Å; T133-Q136 PolarHBondContact OG1-N 3.29Å; T133-Q136 PolarHBondContact OG1-OE1 3.12Å; Q136-M138 VanDerWaalsContact C-N 3.34Å; Q136-S139 PolarHBondContact O-N 3.01Å; Q136-S139 PolarHBondContact O-OG 3.17Å
137	L	79.9	Confident	79.3	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.005	33%	0.327	C	S	.	.	H	α-helix	trans	-72	-31.2	173.7	-69.7	174.5	0	0	0	111.8	I127 A132 T133 A134 S139 I140 V148 I151 V152	I127-L137 HydrophobicContact CG2-CD2 4.17Å; A132-L137 HydrophobicContact CB-CD2 3.77Å; A132-L137 HydrophobicContact CB-CG 3.82Å; T133-L137 PolarHBondContact O-N 3.13Å; A134-L137 PolarHBondContact O-N 3.42Å; L137-S139 PolarHBondContact O-N 3.04Å; L137-I140 HydrophobicContact CD2-CD1 3.69Å; L137-I140 WeakPolarHBondContact O-CB 3.47Å; L137-I140 PolarHBondContact O-N 2.95Å; L137-V148 HydrophobicContact CB-CB 4.41Å; L137-V148 HydrophobicContact CB-CG1 3.69Å; L137-V148 HydrophobicContact CB-CG2 3.91Å; L137-V148 HydrophobicContact CD1-CG1 4.21Å; L137-I151 HydrophobicContact CD1-CG2 4Å; L137-V152 HydrophobicContact CD1-CG2 4Å
138	M	75	Confident	79.6	Confident	87 Å²	87	57 Å²	57	43%	0.429	32%	0.319	S	S	.	.	H	α-helix	trans	-67	-17.6	175.3	-74.3	-65.6	-70.1	0	0	113.8	A134 A135 Q136 I140 E145 V148	A134-M138 VanDerWaalsContact O-CG 3.27Å; A134-M138 WeakPolarHBondContact O-CG 3.45Å; A134-M138 PolarHBondContact O-N 2.84Å; A135-M138 PolarHBondContact O-N 3.16Å; Q136-M138 VanDerWaalsContact C-N 3.34Å; M138-I140 VanDerWaalsContact C-N 3.3Å; M138-E145 HydrophobicContact CE-CB 4.03Å; M138-E145 VanDerWaalsContact SD-CA 3.54Å; M138-E145 HydrophobicContact SD-CB 4.08Å; M138-E145 HydrophobicContact SD-CG 4.43Å; M138-V148 HydrophobicContact CG-CB 4.42Å; M138-V148 HydrophobicContact CG-CG1 4.28Å; M138-V148 HydrophobicContact CG-CG2 4.09Å; M138-V148 HydrophobicContact SD-CB 4.05Å; M138-V148 HydrophobicContact SD-CG2 3.62Å
139	S	73.4	Confident	79.8	Confident	78 Å²	78	63.3 Å²	63.3	55%	0.545	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-8.3	173.7	55.7	0	0	0	0	114.2	Q136 L137	Q136-S139 PolarHBondContact O-N 3.01Å; Q136-S139 PolarHBondContact O-OG 3.17Å; L137-S139 PolarHBondContact O-N 3.04Å
140	I	79	Confident	79.8	Confident	3 Å²	3	65 Å²	65	2%	0.015	35%	0.351	C	S	.	.	S	Bend	trans	-79.7	123.5	176.9	-59.9	158.3	0	0	0	109.5	I127 L137 M138 G142 L143 I181 Q184 V185	I127-I140 HydrophobicContact CB-CD1 4.15Å; I127-I140 HydrophobicContact CB-CG1 4.35Å; I127-I140 HydrophobicContact CD1-CD1 4.18Å; I127-I140 HydrophobicContact CD1-CG1 3.53Å; I127-I140 HydrophobicContact CG2-CD1 4.09Å; L137-I140 HydrophobicContact CD2-CD1 3.69Å; L137-I140 WeakPolarHBondContact O-CB 3.47Å; L137-I140 PolarHBondContact O-N 2.95Å; M138-I140 VanDerWaalsContact C-N 3.3Å; I140-G142 PolarHBondContact O-N 2.9Å; I140-G142 VanDerWaalsContact O-N 3.09Å; I140-L143 HydrophobicContact CB-CD1 3.95Å; I140-L143 HydrophobicContact CB-CG 4.18Å; I140-L143 HydrophobicContact CD1-CD1 3.7Å; I140-L143 HydrophobicContact CG1-CD1 4.44Å; I140-L143 HydrophobicContact CG2-CD1 4.2Å; I140-L143 HydrophobicContact CG2-CG 4.17Å; I140-L143 PolarHBondContact O-N 2.78Å; I140-I181 HydrophobicContact CG2-CB 3.84Å; I140-I181 HydrophobicContact CG2-CG2 3.66Å; I140-Q184 HydrophobicContact CG2-CB 4.01Å; I140-V185 HydrophobicContact CD1-CG1 3.37Å; I140-V185 HydrophobicContact CG1-CG1 4.05Å; I140-V185 HydrophobicContact CG2-CG1 4.11Å
141	R	64	Low	79.9	Confident	209 Å²	209	63.7 Å²	63.7	79%	0.789	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	112.6	-177.5	-69.1	-172.1	-176.6	-176.3	2.6	110.9
142	G	67.3	Low	80.3	Confident	43 Å²	43	61.1 Å²	61.1	44%	0.443	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	119.8	-14.5	177.2	0	0	0	0	0	114.3	I140 L177	I140-G142 PolarHBondContact O-N 2.9Å; I140-G142 VanDerWaalsContact O-N 3.09Å; G142-L177 WeakPolarHBondContact O-CD1 3.48Å
143	L	77.9	Confident	80.5	Confident	16 Å²	16	63.2 Å²	63.2	8%	0.084	35%	0.345	C	S	.	.			trans	-84.2	130.6	175.1	-63	-173.3	0	0	0	110.9	I140 I147 V148 I151 L177 I181	I140-L143 HydrophobicContact CB-CD1 3.95Å; I140-L143 HydrophobicContact CB-CG 4.18Å; I140-L143 HydrophobicContact CD1-CD1 3.7Å; I140-L143 HydrophobicContact CG1-CD1 4.44Å; I140-L143 HydrophobicContact CG2-CD1 4.2Å; I140-L143 HydrophobicContact CG2-CG 4.17Å; I140-L143 PolarHBondContact O-N 2.78Å; L143-I147 HydrophobicContact CD2-CG2 3.82Å; L143-V148 HydrophobicContact CB-CG2 3.83Å; L143-V148 HydrophobicContact CD1-CG2 4.24Å; L143-I151 HydrophobicContact CD1-CD1 4.15Å; L143-I151 HydrophobicContact CD2-CD1 4.27Å; L143-L177 HydrophobicContact CD2-CD2 4.23Å; L143-I181 HydrophobicContact CD2-CD1 3.78Å; L143-I181 HydrophobicContact CD2-CG2 4.45Å; L143-I181 HydrophobicContact CG-CD1 4.48Å; L143-I181 HydrophobicContact CG-CG2 4.48Å
144	T	82	Confident	80.8	Confident	74 Å²	74	61.9 Å²	61.9	45%	0.454	33%	0.332	S	S	.	.			trans	-94.9	159	172.8	60.9	0	0	0	0	110.2	K146 I147 V148	T144-K146 PolarHBondContact O-N 2.97Å; T144-K146 VanDerWaalsContact O-N 3.15Å; T144-I147 WeakPolarHBondContact O-CA 3.48Å; T144-I147 PolarHBondContact O-N 2.8Å; T144-I147 WeakPolarHBondContact OG1-CD1 3.38Å; T144-I147 VanDerWaalsContact OG1-CG1 3.29Å; T144-I147 WeakPolarHBondContact OG1-CG1 2.93Å; T144-I147 PolarHBondContact OG1-N 2.93Å; T144-V148 PolarHBondContact O-N 2.94Å
145	E	81.3	Confident	81.2	Confident	121 Å²	121	62 Å²	62	57%	0.565	32%	0.322	S	S	*	.	H	α-helix	trans	-55.3	-36.7	179.1	-164.6	-169.2	162.4	0	0	112.6	M138 V148 R149	M138-E145 HydrophobicContact CE-CB 4.03Å; M138-E145 VanDerWaalsContact SD-CA 3.54Å; M138-E145 HydrophobicContact SD-CB 4.08Å; M138-E145 HydrophobicContact SD-CG 4.43Å; E145-V148 PolarHBondContact O-N 2.53Å; E145-R149 VanDerWaalsContact CD-NH2 3.34Å; E145-R149 VanDerWaalsContact O-CB 3.29Å; E145-R149 WeakPolarHBondContact O-CB 3.44Å; E145-R149 PolarHBondContact O-N 2.81Å; E145-R149 IonicContact OE1-NH2 3.85Å; E145-R149 PolarHBondContact OE1-NH2 3.48Å
146	K	81.8	Confident	81.5	Confident	110 Å²	110	62.4 Å²	62.4	48%	0.478	33%	0.326	S	S	.	.	H	α-helix	trans	-62.7	-44	174.9	-166.9	-178.1	-173.1	-167.7	0	111.6	T144 N150 H172	T144-K146 PolarHBondContact O-N 2.97Å; T144-K146 VanDerWaalsContact O-N 3.15Å; K146-N150 WeakPolarHBondContact O-CB 3.38Å; K146-N150 PolarHBondContact O-N 2.84Å; K146-N150 PolarHBondContact O-ND2 2.86Å; K146-N150 PolarHBondContact O-OD1 2.85Å; K146-H172 PolarHBondContact NZ-NE2 3.45Å
147	I	84.8	Confident	81.9	Confident	13 Å²	13	64.1 Å²	64.1	7%	0.067	33%	0.334	C	S	.	.	H	α-helix	trans	-69.1	-43.5	178.6	-65	169.9	0	0	0	110.5	L143 T144 R149 N150 I151 H172 V173 L177	L143-I147 HydrophobicContact CD2-CG2 3.82Å; T144-I147 WeakPolarHBondContact O-CA 3.48Å; T144-I147 PolarHBondContact O-N 2.8Å; T144-I147 WeakPolarHBondContact OG1-CD1 3.38Å; T144-I147 VanDerWaalsContact OG1-CG1 3.29Å; T144-I147 WeakPolarHBondContact OG1-CG1 2.93Å; T144-I147 PolarHBondContact OG1-N 2.93Å; I147-R149 VanDerWaalsContact C-N 3.34Å; I147-R149 PolarHBondContact O-N 3.28Å; I147-N150 CarbonylContact O-C 3.54Å; I147-N150 WeakPolarHBondContact O-CB 3.12Å; I147-N150 PolarHBondContact O-N 3.31Å; I147-N150 VanDerWaalsContact O-N 3.14Å; I147-I151 HydrophobicContact CG2-CD1 3.82Å; I147-I151 HydrophobicContact CG2-CG1 4.26Å; I147-I151 VanDerWaalsContact O-CG1 3.29Å; I147-I151 WeakPolarHBondContact O-CG1 3.49Å; I147-I151 PolarHBondContact O-N 2.85Å; I147-H172 WeakPolarHBondContact CD1-O 3.08Å; I147-H172 HydrophobicContact CG1-CB 4.25Å; I147-V173 HydrophobicContact CG2-CG2 3.65Å; I147-L177 HydrophobicContact CD1-CD2 3.57Å
148	V	87	Confident	82.1	Confident	3 Å²	3	71.3 Å²	71.3	2%	0.018	36%	0.362	C	S	.	.	H	α-helix	trans	-60.4	-44.3	176.8	172.3	0	0	0	0	111.2	A134 L137 M138 L143 T144 E145 N150 I151 V152	A134-V148 HydrophobicContact CB-CG1 3.94Å; A134-V148 WeakPolarHBondContact O-CG1 3.44Å; L137-V148 HydrophobicContact CB-CB 4.41Å; L137-V148 HydrophobicContact CB-CG1 3.69Å; L137-V148 HydrophobicContact CB-CG2 3.91Å; L137-V148 HydrophobicContact CD1-CG1 4.21Å; M138-V148 HydrophobicContact CG-CB 4.42Å; M138-V148 HydrophobicContact CG-CG1 4.28Å; M138-V148 HydrophobicContact CG-CG2 4.09Å; M138-V148 HydrophobicContact SD-CB 4.05Å; M138-V148 HydrophobicContact SD-CG2 3.62Å; L143-V148 HydrophobicContact CB-CG2 3.83Å; L143-V148 HydrophobicContact CD1-CG2 4.24Å; T144-V148 PolarHBondContact O-N 2.94Å; E145-V148 PolarHBondContact O-N 2.53Å; V148-N150 VanDerWaalsContact C-N 3.3Å; V148-N150 PolarHBondContact O-N 3.2Å; V148-I151 PolarHBondContact O-N 2.8Å; V148-V152 WeakPolarHBondContact O-CG2 3.08Å; V148-V152 PolarHBondContact O-N 3.21Å
149	R	87.5	Confident	82.3	Confident	139 Å²	139	68.4 Å²	68.4	53%	0.525	35%	0.354	S	S	.	.	H	α-helix	trans	-60.4	-41.5	174.9	-165	-178.9	-58.2	128.1	1.7	111.4	E145 I147 V152 A153	E145-R149 VanDerWaalsContact CD-NH2 3.34Å; E145-R149 VanDerWaalsContact O-CB 3.29Å; E145-R149 WeakPolarHBondContact O-CB 3.44Å; E145-R149 PolarHBondContact O-N 2.81Å; E145-R149 IonicContact OE1-NH2 3.85Å; E145-R149 PolarHBondContact OE1-NH2 3.48Å; I147-R149 VanDerWaalsContact C-N 3.34Å; I147-R149 PolarHBondContact O-N 3.28Å; R149-V152 PolarHBondContact O-N 3.19Å; R149-A153 VanDerWaalsContact O-CB 3.24Å; R149-A153 WeakPolarHBondContact O-CB 3.48Å; R149-A153 PolarHBondContact O-N 3.08Å
150	N	87.1	Confident	82.9	Confident	40 Å²	40	68.9 Å²	68.9	21%	0.214	36%	0.355	C	S	.	.	H	α-helix	trans	-67	-39.1	176.5	-67	-8.8	0	0	0	112.4	K146 I147 V148 A153 Y154 V170 S171	K146-N150 WeakPolarHBondContact O-CB 3.38Å; K146-N150 PolarHBondContact O-N 2.84Å; K146-N150 PolarHBondContact O-ND2 2.86Å; K146-N150 PolarHBondContact O-OD1 2.85Å; I147-N150 CarbonylContact O-C 3.54Å; I147-N150 WeakPolarHBondContact O-CB 3.12Å; I147-N150 PolarHBondContact O-N 3.31Å; I147-N150 VanDerWaalsContact O-N 3.14Å; V148-N150 VanDerWaalsContact C-N 3.3Å; V148-N150 PolarHBondContact O-N 3.2Å; N150-A153 PolarHBondContact O-N 2.79Å; N150-Y154 WeakPolarHBondContact O-CB 3.36Å; N150-Y154 PolarHBondContact O-N 3.37Å; N150-V170 HydrophobicContact CB-CG1 3.51Å; N150-S171 PolarHBondContact ND2-O 3Å
151	I	87.6	Confident	83.1	Confident	3 Å²	3	69 Å²	69	2%	0.015	36%	0.355	C	S	.	.	H	α-helix	trans	-63.7	-44.7	176.3	-68.5	168.8	0	0	0	110.3	I129 L137 L143 I147 V148 R155 F161 L167 V170	I129-I151 HydrophobicContact CG2-CG2 3.91Å; L137-I151 HydrophobicContact CD1-CG2 4Å; L143-I151 HydrophobicContact CD1-CD1 4.15Å; L143-I151 HydrophobicContact CD2-CD1 4.27Å; I147-I151 HydrophobicContact CG2-CD1 3.82Å; I147-I151 HydrophobicContact CG2-CG1 4.26Å; I147-I151 VanDerWaalsContact O-CG1 3.29Å; I147-I151 WeakPolarHBondContact O-CG1 3.49Å; I147-I151 PolarHBondContact O-N 2.85Å; V148-I151 PolarHBondContact O-N 2.8Å; I151-R155 WeakPolarHBondContact O-CG 3.39Å; I151-R155 PolarHBondContact O-N 3.22Å; I151-R155 VanDerWaalsContact O-N 3.07Å; I151-F161 HydrophobicContact CG2-CE2 3.94Å; I151-F161 HydrophobicContact CG2-CZ 4.33Å; I151-L167 HydrophobicContact CD1-CD2 4.1Å; I151-L167 HydrophobicContact CG1-CD2 3.97Å; I151-L167 HydrophobicContact CG2-CD2 4.22Å; I151-V170 HydrophobicContact CG1-CB 4.49Å; I151-V170 HydrophobicContact CG1-CG1 3.94Å; I151-V170 HydrophobicContact CG1-CG2 4.32Å
152	V	89.8	Confident	84	Confident	43 Å²	43	69.5 Å²	69.5	26%	0.261	36%	0.357	S	S	.	.	H	α-helix	trans	-68.3	-41.3	178.8	175.2	0	0	0	0	111.6	A134 L137 V148 R149 R155 A156	A134-V152 HydrophobicContact CB-CG2 4.39Å; L137-V152 HydrophobicContact CD1-CG2 4Å; V148-V152 WeakPolarHBondContact O-CG2 3.08Å; V148-V152 PolarHBondContact O-N 3.21Å; R149-V152 PolarHBondContact O-N 3.19Å; V152-R155 VanDerWaalsContact O-CG 3.32Å; V152-R155 WeakPolarHBondContact O-CG 3.45Å; V152-A156 WeakPolarHBondContact O-CB 3.41Å; V152-A156 PolarHBondContact O-N 2.78Å
153	A	86.9	Confident	84.7	Confident	47 Å²	47	69.2 Å²	69.2	39%	0.388	35%	0.348	S	S	.	.	H	α-helix	trans	-66	-45.7	175.5	0	0	0	0	0	111.4	R149 N150 R155 A156 E157	R149-A153 VanDerWaalsContact O-CB 3.24Å; R149-A153 WeakPolarHBondContact O-CB 3.48Å; R149-A153 PolarHBondContact O-N 3.08Å; N150-A153 PolarHBondContact O-N 2.79Å; A153-R155 PolarHBondContact O-N 2.91Å; A153-A156 WeakPolarHBondContact O-CB 3.24Å; A153-A156 PolarHBondContact O-N 3.23Å; A153-A156 VanDerWaalsContact O-N 3.09Å; A153-E157 WeakPolarHBondContact O-CB 3.41Å; A153-E157 PolarHBondContact O-N 3.33Å
154	Y	89.4	Confident	84.9	Confident	45 Å²	45	69.9 Å²	69.9	18%	0.176	35%	0.352	C	S	.	.	H	α-helix	trans	-60.2	-45	179.9	-173.7	-78.9	0	0	0	111.7	N150 A156 E157 Y158 F161 R169 V170	N150-Y154 WeakPolarHBondContact O-CB 3.36Å; N150-Y154 PolarHBondContact O-N 3.37Å; Y154-A156 VanDerWaalsContact C-N 3.29Å; Y154-A156 PolarHBondContact O-N 3.2Å; Y154-E157 PolarHBondContact O-N 3.26Å; Y154-Y158 HydrophobicContact CD1-CD2 4.4Å; Y154-Y158 AromaticContact CD2-CD2 3.82Å; Y154-Y158 HydrophobicContact CD2-CD2 3.82Å; Y154-Y158 HydrophobicContact CD2-CE2 4.28Å; Y154-Y158 HydrophobicContact CE1-CD2 4.48Å; Y154-Y158 HydrophobicContact CE1-CG 4.49Å; Y154-Y158 AromaticContact CE2-CD2 3.94Å; Y154-Y158 HydrophobicContact CE2-CD2 3.94Å; Y154-Y158 HydrophobicContact CE2-CE2 4.44Å; Y154-Y158 HydrophobicContact CE2-CG 4.39Å; Y154-Y158 HydrophobicContact CG-CD2 4.06Å; Y154-Y158 WeakPolarHBondContact O-CB 3.3Å; Y154-Y158 PolarHBondContact O-N 2.86Å; Y154-F161 HydrophobicContact CD1-CD1 4.35Å; Y154-F161 AromaticContact CD1-CE1 3.33Å; Y154-F161 HydrophobicContact CD1-CE1 3.33Å; Y154-F161 HydrophobicContact CD1-CE2 4.45Å; Y154-F161 AromaticContact CD1-CZ 3.4Å; Y154-F161 HydrophobicContact CD1-CZ 3.4Å; Y154-F161 HydrophobicContact CE1-CD1 4.22Å; Y154-F161 AromaticContact CE1-CE1 3.5Å; Y154-F161 HydrophobicContact CE1-CE1 3.5Å; Y154-F161 VanDerWaalsContact CE1-CE1 3.5Å; Y154-F161 HydrophobicContact CE1-CZ 4.07Å; Y154-F161 HydrophobicContact CG-CE1 4.28Å; Y154-F161 HydrophobicContact CG-CZ 4.13Å; Y154-R169 HydrophobicContact CE2-CB 4Å; Y154-R169 WeakPolarHBondContact CE2-O 3.36Å; Y154-R169 WeakPolarHBondContact OH-CB 3.43Å; Y154-R169 PolarHBondContact OH-NE 2.98Å; Y154-V170 HydrophobicContact CD1-CG2 4.14Å; Y154-V170 HydrophobicContact CD2-CG2 4.13Å; Y154-V170 HydrophobicContact CG-CG2 3.83Å
155	R	88.1	Confident	85	Confident	52 Å²	52	70.5 Å²	70.5	20%	0.196	35%	0.35	C	S	.	.	H	α-helix	trans	-70.1	-25.2	177	73.4	-178.7	-173.9	-172.6	3.1	113.6	I129 N130 A132 I151 V152 A153 G159 F161	I129-R155 PolarHBondContact O-NH1 3.4Å; N130-R155 PolarHBondContact O-NH1 3.43Å; A132-R155 VanDerWaalsContact O-CZ 3.23Å; A132-R155 PolarHBondContact O-NH1 2.81Å; A132-R155 PolarHBondContact O-NH2 2.79Å; I151-R155 WeakPolarHBondContact O-CG 3.39Å; I151-R155 PolarHBondContact O-N 3.22Å; I151-R155 VanDerWaalsContact O-N 3.07Å; V152-R155 VanDerWaalsContact O-CG 3.32Å; V152-R155 WeakPolarHBondContact O-CG 3.45Å; A153-R155 PolarHBondContact O-N 2.91Å; R155-G159 WeakPolarHBondContact CA-O 3.37Å; R155-G159 CarbonylContact O-C 3.59Å; R155-G159 VanDerWaalsContact O-CA 3.25Å; R155-G159 WeakPolarHBondContact O-CA 3.47Å; R155-G159 PolarHBondContact O-N 3.35Å; R155-F161 HydrophobicContact CB-CD2 4.43Å; R155-F161 HydrophobicContact CB-CE2 3.92Å
156	A	83.8	Confident	85.1	Confident	86 Å²	86	65.9 Å²	65.9	71%	0.711	33%	0.329	S	S	*	.	H	α-helix	trans	-76.5	-32.7	175.3	0	0	0	0	0	112.1	V152 A153 Y154	V152-A156 WeakPolarHBondContact O-CB 3.41Å; V152-A156 PolarHBondContact O-N 2.78Å; A153-A156 WeakPolarHBondContact O-CB 3.24Å; A153-A156 PolarHBondContact O-N 3.23Å; A153-A156 VanDerWaalsContact O-N 3.09Å; Y154-A156 VanDerWaalsContact C-N 3.29Å; Y154-A156 PolarHBondContact O-N 3.2Å
157	E	85.6	Confident	85.2	Confident	134 Å²	134	60.7 Å²	60.7	63%	0.626	31%	0.306	S	S	*	.	H	α-helix	trans	-90.1	-40.3	-177.5	-169.8	-179	158.8	0	0	112.9	A153 Y154	A153-E157 WeakPolarHBondContact O-CB 3.41Å; A153-E157 PolarHBondContact O-N 3.33Å; Y154-E157 PolarHBondContact O-N 3.26Å
158	Y	84.3	Confident	85.2	Confident	152 Å²	152	63.3 Å²	63.3	60%	0.596	32%	0.322	S	S	*	.	H	α-helix	trans	-111.9	-2.5	-173.7	-59.7	-83.7	0	0	0	114.2	Y154	Y154-Y158 HydrophobicContact CD1-CD2 4.4Å; Y154-Y158 AromaticContact CD2-CD2 3.82Å; Y154-Y158 HydrophobicContact CD2-CD2 3.82Å; Y154-Y158 HydrophobicContact CD2-CE2 4.28Å; Y154-Y158 HydrophobicContact CE1-CD2 4.48Å; Y154-Y158 HydrophobicContact CE1-CG 4.49Å; Y154-Y158 AromaticContact CE2-CD2 3.94Å; Y154-Y158 HydrophobicContact CE2-CD2 3.94Å; Y154-Y158 HydrophobicContact CE2-CE2 4.44Å; Y154-Y158 HydrophobicContact CE2-CG 4.39Å; Y154-Y158 HydrophobicContact CG-CD2 4.06Å; Y154-Y158 WeakPolarHBondContact O-CB 3.3Å; Y154-Y158 PolarHBondContact O-N 2.86Å
159	G	80.4	Confident	85	Confident	25 Å²	25	69.9 Å²	69.9	26%	0.258	35%	0.347	S	S	.	.			trans	88.4	179.2	-179.3	0	0	0	0	0	114.7	R155	R155-G159 WeakPolarHBondContact CA-O 3.37Å; R155-G159 CarbonylContact O-C 3.59Å; R155-G159 VanDerWaalsContact O-CA 3.25Å; R155-G159 WeakPolarHBondContact O-CA 3.47Å; R155-G159 PolarHBondContact O-N 3.35Å
160	P	85.4	Confident	84.8	Confident	88 Å²	88	63.4 Å²	63.4	57%	0.571	32%	0.323	S	S	*	.			trans	-65.7	145.8	-174.4	27.4	-34.4	0	0	0	112.5	N130	N130-P160 HydrophobicContact CB-CB 4.35Å
161	F	84	Confident	84.2	Confident	6 Å²	6	65.4 Å²	65.4	3%	0.026	34%	0.34	C	S	.	.			trans	-65.5	141.2	172.9	-59.6	-80.7	0	0	0	109.9	I129 N130 I151 Y154 R155 D166 L167 V170 V187	I129-F161 HydrophobicContact CG2-CD2 3.65Å; I129-F161 HydrophobicContact CG2-CE2 3.87Å; N130-F161 PolarHBondContact ND2-O 2.89Å; N130-F161 WeakPolarHBondContact OD1-CD2 3.38Å; N130-F161 PolarHBondContact OD1-N 3.46Å; I151-F161 HydrophobicContact CG2-CE2 3.94Å; I151-F161 HydrophobicContact CG2-CZ 4.33Å; Y154-F161 HydrophobicContact CD1-CD1 4.35Å; Y154-F161 AromaticContact CD1-CE1 3.33Å; Y154-F161 HydrophobicContact CD1-CE1 3.33Å; Y154-F161 HydrophobicContact CD1-CE2 4.45Å; Y154-F161 AromaticContact CD1-CZ 3.4Å; Y154-F161 HydrophobicContact CD1-CZ 3.4Å; Y154-F161 HydrophobicContact CE1-CD1 4.22Å; Y154-F161 AromaticContact CE1-CE1 3.5Å; Y154-F161 HydrophobicContact CE1-CE1 3.5Å; Y154-F161 VanDerWaalsContact CE1-CE1 3.5Å; Y154-F161 HydrophobicContact CE1-CZ 4.07Å; Y154-F161 HydrophobicContact CG-CE1 4.28Å; Y154-F161 HydrophobicContact CG-CZ 4.13Å; R155-F161 HydrophobicContact CB-CD2 4.43Å; R155-F161 HydrophobicContact CB-CE2 3.92Å; F161-D166 HydrophobicContact CB-CB 4.33Å; F161-D166 HydrophobicContact CD1-CB 3.81Å; F161-L167 HydrophobicContact CD1-CD2 4.39Å; F161-L167 HydrophobicContact CD2-CD2 4.44Å; F161-L167 HydrophobicContact CE1-CD2 4.01Å; F161-L167 HydrophobicContact CE2-CD2 4.07Å; F161-L167 HydrophobicContact CZ-CD2 3.84Å; F161-V170 HydrophobicContact CE1-CG2 3.64Å; F161-V170 HydrophobicContact CZ-CG2 3.54Å; F161-V187 HydrophobicContact CB-CG2 4.22Å; F161-V187 WeakPolarHBondContact O-CG1 3.35Å
162	R	81.7	Confident	83.4	Confident	219 Å²	219	70.6 Å²	70.6	83%	0.826	36%	0.364	S	S	*	.	S	Bend	trans	-97.7	-25.6	179.9	-65.5	179.8	175.2	-98.4	0.1	112	D166	R162-D166 WeakPolarHBondContact CA-OD2 3.3Å; R162-D166 WeakPolarHBondContact CB-OD2 3.44Å; R162-D166 PolarHBondContact N-OD2 3.4Å
163	S	83.1	Confident	82.9	Confident	37 Å²	37	68.9 Å²	68.9	26%	0.259	35%	0.354	S	S	.	.	S	Bend	trans	-139.2	165.2	173.3	70.7	0	0	0	0	110.8	E165 D166	S163-E165 WeakPolarHBondContact CB-OE2 3.13Å; S163-E165 PolarHBondContact O-N 3.09Å; S163-E165 PolarHBondContact OG-N 3.3Å; S163-D166 PolarHBondContact N-OD2 2.94Å; S163-D166 WeakPolarHBondContact O-CB 3.35Å; S163-D166 PolarHBondContact O-N 2.9Å; S163-D166 PolarHBondContact OG-N 2.97Å; S163-D166 PolarHBondContact OG-OD1 2.93Å
164	I	82.3	Confident	82.3	Confident	30 Å²	30	71.8 Å²	71.8	15%	0.154	36%	0.363	C	S	.	.	S	Bend	trans	-68.8	-31.6	174.9	-63.4	168.3	0	0	0	109.5	I129 D166 L167 L178 V185 V187	I129-I164 HydrophobicContact CD1-CG1 4.45Å; I164-D166 PolarHBondContact O-N 3.39Å; I164-L167 VanDerWaalsContact O-CB 3.31Å; I164-L167 WeakPolarHBondContact O-CB 3.39Å; I164-L167 PolarHBondContact O-N 2.75Å; I164-L167 VanDerWaalsContact O-N 3.17Å; I164-L178 HydrophobicContact CG2-CD1 3.81Å; I164-V185 HydrophobicContact CG2-CG2 4.18Å; I164-V187 HydrophobicContact CG1-CB 4.46Å; I164-V187 HydrophobicContact CG1-CG2 3.99Å
165	E	83.9	Confident	81.6	Confident	88 Å²	88	73.2 Å²	73.2	41%	0.411	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-63	-25.1	177.6	-65.4	69.4	-152.2	0	0	112.7	S163 L167 V168 R182	S163-E165 WeakPolarHBondContact CB-OE2 3.13Å; S163-E165 PolarHBondContact O-N 3.09Å; S163-E165 PolarHBondContact OG-N 3.3Å; E165-L167 PolarHBondContact O-N 3.09Å; E165-L167 VanDerWaalsContact O-N 3.17Å; E165-V168 PolarHBondContact O-N 2.94Å; E165-R182 IonicContact OE1-CZ 2.74Å; E165-R182 VanDerWaalsContact OE1-CZ 3.27Å; E165-R182 IonicContact OE1-NH1 3.97Å; E165-R182 PolarHBondContact OE1-NH1 3Å; E165-R182 IonicContact OE1-NH2 2.8Å; E165-R182 PolarHBondContact OE1-NH2 3.17Å
166	D	82.4	Confident	80.7	Confident	24 Å²	24	74.3 Å²	74.3	13%	0.128	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-64	-18.3	176.3	-70.5	-29.4	0	0	0	113.4	F161 R162 S163 I164 V168 R169	F161-D166 HydrophobicContact CB-CB 4.33Å; F161-D166 HydrophobicContact CD1-CB 3.81Å; R162-D166 WeakPolarHBondContact CA-OD2 3.3Å; R162-D166 WeakPolarHBondContact CB-OD2 3.44Å; R162-D166 PolarHBondContact N-OD2 3.4Å; S163-D166 PolarHBondContact N-OD2 2.94Å; S163-D166 WeakPolarHBondContact O-CB 3.35Å; S163-D166 PolarHBondContact O-N 2.9Å; S163-D166 PolarHBondContact OG-N 2.97Å; S163-D166 PolarHBondContact OG-OD1 2.93Å; I164-D166 PolarHBondContact O-N 3.39Å; D166-V168 PolarHBondContact O-N 3.49Å; D166-R169 VanDerWaalsContact CB-NH2 3.26Å; D166-R169 WeakPolarHBondContact O-CB 3.49Å; D166-R169 PolarHBondContact O-N 3.13Å; D166-R169 VanDerWaalsContact O-N 3.13Å; D166-R169 IonicContact OD1-CZ 3.46Å; D166-R169 VanDerWaalsContact OD1-CZ 3.26Å; D166-R169 IonicContact OD1-NH1 2.75Å; D166-R169 IonicContact OD1-NH2 2.94Å; D166-R169 PolarHBondContact OD1-NH2 3.22Å; D166-R169 IonicContact OD2-NH2 3.97Å; D166-R169 PolarHBondContact OD2-NH2 2.77Å; D166-R169 VanDerWaalsContact OD2-NH2 3.12Å
167	L	83.6	Confident	80.2	Confident	1 Å²	1	71.4 Å²	71.4	1%	0.005	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-63.3	-22.7	178	-82.6	176	0	0	0	113.3	I129 I151 F161 I164 E165 R169 V170 V173 L178 I181	I129-L167 HydrophobicContact CD1-CD1 3.48Å; I129-L167 VanDerWaalsContact CD1-CD1 3.48Å; I129-L167 HydrophobicContact CD1-CG 4.26Å; I129-L167 HydrophobicContact CG1-CD1 4.3Å; I129-L167 HydrophobicContact CG2-CD1 4.48Å; I129-L167 HydrophobicContact CG2-CD2 3.94Å; I129-L167 HydrophobicContact CG2-CG 4.49Å; I151-L167 HydrophobicContact CD1-CD2 4.1Å; I151-L167 HydrophobicContact CG1-CD2 3.97Å; I151-L167 HydrophobicContact CG2-CD2 4.22Å; F161-L167 HydrophobicContact CD1-CD2 4.39Å; F161-L167 HydrophobicContact CD2-CD2 4.44Å; F161-L167 HydrophobicContact CE1-CD2 4.01Å; F161-L167 HydrophobicContact CE2-CD2 4.07Å; F161-L167 HydrophobicContact CZ-CD2 3.84Å; I164-L167 VanDerWaalsContact O-CB 3.31Å; I164-L167 WeakPolarHBondContact O-CB 3.39Å; I164-L167 PolarHBondContact O-N 2.75Å; I164-L167 VanDerWaalsContact O-N 3.17Å; E165-L167 PolarHBondContact O-N 3.09Å; E165-L167 VanDerWaalsContact O-N 3.17Å; L167-R169 PolarHBondContact O-N 3.1Å; L167-V170 HydrophobicContact CD2-CG2 4.16Å; L167-V170 VanDerWaalsContact O-CB 3.31Å; L167-V170 WeakPolarHBondContact O-CB 3.36Å; L167-V170 WeakPolarHBondContact O-CG2 3.24Å; L167-V170 PolarHBondContact O-N 3.48Å; L167-V173 HydrophobicContact CB-CG1 4.27Å; L167-V173 VanDerWaalsContact O-CB 3.25Å; L167-V173 WeakPolarHBondContact O-CB 3.46Å; L167-V173 WeakPolarHBondContact O-CG1 3.36Å; L167-L178 HydrophobicContact CB-CD1 3.98Å; L167-L178 HydrophobicContact CD1-CD1 3.97Å; L167-I181 HydrophobicContact CD1-CD1 4.46Å
168	V	85.3	Confident	79.8	Confident	67 Å²	67	65.6 Å²	65.6	41%	0.406	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-63.6	-20.5	175.9	-176.2	0	0	0	0	111.7	E165 D166 V170 L178	E165-V168 PolarHBondContact O-N 2.94Å; D166-V168 PolarHBondContact O-N 3.49Å; V168-V170 PolarHBondContact O-N 3.36Å; V168-L178 HydrophobicContact CG2-CD2 3.78Å
169	R	82.1	Confident	79.2	Confident	141 Å²	141	63 Å²	63	53%	0.532	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-74.9	-12.7	174.8	-60.7	-172.7	-71.1	-145.6	1.6	113.4	Y154 D166 L167	Y154-R169 HydrophobicContact CE2-CB 4Å; Y154-R169 WeakPolarHBondContact CE2-O 3.36Å; Y154-R169 WeakPolarHBondContact OH-CB 3.43Å; Y154-R169 PolarHBondContact OH-NE 2.98Å; D166-R169 VanDerWaalsContact CB-NH2 3.26Å; D166-R169 WeakPolarHBondContact O-CB 3.49Å; D166-R169 PolarHBondContact O-N 3.13Å; D166-R169 VanDerWaalsContact O-N 3.13Å; D166-R169 IonicContact OD1-CZ 3.46Å; D166-R169 VanDerWaalsContact OD1-CZ 3.26Å; D166-R169 IonicContact OD1-NH1 2.75Å; D166-R169 IonicContact OD1-NH2 2.94Å; D166-R169 PolarHBondContact OD1-NH2 3.22Å; D166-R169 IonicContact OD2-NH2 3.97Å; D166-R169 PolarHBondContact OD2-NH2 2.77Å; D166-R169 VanDerWaalsContact OD2-NH2 3.12Å; L167-R169 PolarHBondContact O-N 3.1Å
170	V	84.6	Confident	78.7	Confident	3 Å²	3	68.9 Å²	68.9	2%	0.018	36%	0.355	C	S	.	.	S	Bend	trans	-80	130.5	176.5	-177.3	0	0	0	0	109.5	N150 I151 Y154 F161 L167 V168 H172 V173	N150-V170 HydrophobicContact CB-CG1 3.51Å; I151-V170 HydrophobicContact CG1-CB 4.49Å; I151-V170 HydrophobicContact CG1-CG1 3.94Å; I151-V170 HydrophobicContact CG1-CG2 4.32Å; Y154-V170 HydrophobicContact CD1-CG2 4.14Å; Y154-V170 HydrophobicContact CD2-CG2 4.13Å; Y154-V170 HydrophobicContact CG-CG2 3.83Å; F161-V170 HydrophobicContact CE1-CG2 3.64Å; F161-V170 HydrophobicContact CZ-CG2 3.54Å; L167-V170 HydrophobicContact CD2-CG2 4.16Å; L167-V170 VanDerWaalsContact O-CB 3.31Å; L167-V170 WeakPolarHBondContact O-CB 3.36Å; L167-V170 WeakPolarHBondContact O-CG2 3.24Å; L167-V170 PolarHBondContact O-N 3.48Å; V168-V170 PolarHBondContact O-N 3.36Å; V170-H172 PolarHBondContact O-N 3.21Å; V170-V173 HydrophobicContact CB-CB 4.42Å; V170-V173 HydrophobicContact CB-CG2 3.82Å; V170-V173 HydrophobicContact CG1-CG2 4.09Å; V170-V173 PolarHBondContact O-N 2.73Å
171	S	74.9	Confident	78.3	Confident	83 Å²	83	64.8 Å²	64.8	58%	0.58	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	127.8	-179.5	-51.5	0	0	0	0	111.8	N150	N150-S171 PolarHBondContact ND2-O 3Å
172	H	70.9	Confident	77.9	Confident	111 Å²	111	69.5 Å²	69.5	51%	0.514	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.2	19.7	-176.9	-51.9	-70.9	0	0	0	116.4	K146 I147 V170	K146-H172 PolarHBondContact NZ-NE2 3.45Å; I147-H172 WeakPolarHBondContact CD1-O 3.08Å; I147-H172 HydrophobicContact CG1-CB 4.25Å; V170-H172 PolarHBondContact O-N 3.21Å
173	V	79.1	Confident	77.1	Confident	7 Å²	7	68 Å²	68	4%	0.042	35%	0.346	C	S	.	.			trans	-99.4	111.8	164.6	-180	0	0	0	0	109.8	I147 L167 V170	I147-V173 HydrophobicContact CG2-CG2 3.65Å; L167-V173 HydrophobicContact CB-CG1 4.27Å; L167-V173 VanDerWaalsContact O-CB 3.25Å; L167-V173 WeakPolarHBondContact O-CB 3.46Å; L167-V173 WeakPolarHBondContact O-CG1 3.36Å; V170-V173 HydrophobicContact CB-CB 4.42Å; V170-V173 HydrophobicContact CB-CG2 3.82Å; V170-V173 HydrophobicContact CG1-CG2 4.09Å; V170-V173 PolarHBondContact O-N 2.73Å
174	N	73.4	Confident	76.6	Confident	108 Å²	108	68.5 Å²	68.5	58%	0.578	34%	0.344	S	S	*	.			trans	-102.2	156.6	177.5	-62.3	-12.2	0	0	0	110.8	S176 L177 L178	N174-S176 VanDerWaalsContact C-N 3.27Å; N174-S176 PolarHBondContact O-N 3.1Å; N174-L177 WeakPolarHBondContact O-CB 3.16Å; N174-L177 PolarHBondContact O-N 3.23Å; N174-L178 PolarHBondContact O-N 3.01Å; N174-L178 VanDerWaalsContact O-N 3.11Å
175	S	74	Confident	76.5	Confident	75 Å²	75	67.4 Å²	67.4	52%	0.524	34%	0.339	S	S	.	.	H	α-helix	trans	-55.4	-37.3	-177.8	-48	0	0	0	0	113.9	L177 L178 D179	S175-L177 VanDerWaalsContact C-N 3.27Å; S175-L177 PolarHBondContact O-N 3.21Å; S175-L178 WeakPolarHBondContact O-CB 3.46Å; S175-L178 PolarHBondContact O-N 2.61Å; S175-L178 VanDerWaalsContact O-N 3.13Å; S175-D179 PolarHBondContact O-N 3.09Å
176	S	69.6	Low	76.5	Confident	75 Å²	75	68.3 Å²	68.3	52%	0.524	34%	0.34	S	S	.	.	H	α-helix	trans	-68.7	-22.8	177.6	60.7	0	0	0	0	114.3	N174 K180	N174-S176 VanDerWaalsContact C-N 3.27Å; N174-S176 PolarHBondContact O-N 3.1Å; S176-K180 WeakPolarHBondContact O-CD 3.47Å; S176-K180 WeakPolarHBondContact O-CG 3.44Å
177	L	72.9	Confident	76.5	Confident	26 Å²	26	68.4 Å²	68.4	14%	0.136	34%	0.341	C	S	.	.	H	α-helix	trans	-80	-40.7	170.9	175.5	61.2	0	0	0	110.1	G142 L143 I147 N174 S175 D179 K180 I181	G142-L177 WeakPolarHBondContact O-CD1 3.48Å; L143-L177 HydrophobicContact CD2-CD2 4.23Å; I147-L177 HydrophobicContact CD1-CD2 3.57Å; N174-L177 WeakPolarHBondContact O-CB 3.16Å; N174-L177 PolarHBondContact O-N 3.23Å; S175-L177 VanDerWaalsContact C-N 3.27Å; S175-L177 PolarHBondContact O-N 3.21Å; L177-D179 VanDerWaalsContact C-N 3.31Å; L177-D179 PolarHBondContact O-N 3.41Å; L177-K180 PolarHBondContact O-N 3.41Å; L177-I181 HydrophobicContact CD1-CG2 4.15Å; L177-I181 WeakPolarHBondContact O-CG1 3.47Å; L177-I181 PolarHBondContact O-N 3.36Å
178	L	77.8	Confident	75.9	Confident	11 Å²	11	74.1 Å²	74.1	6%	0.058	37%	0.368	C	S	.	.	H	α-helix	trans	-57.8	-43.8	176.8	-168.7	65.7	0	0	0	111.6	I164 L167 V168 N174 S175 K180 I181 R182	I164-L178 HydrophobicContact CG2-CD1 3.81Å; L167-L178 HydrophobicContact CB-CD1 3.98Å; L167-L178 HydrophobicContact CD1-CD1 3.97Å; V168-L178 HydrophobicContact CG2-CD2 3.78Å; N174-L178 PolarHBondContact O-N 3.01Å; N174-L178 VanDerWaalsContact O-N 3.11Å; S175-L178 WeakPolarHBondContact O-CB 3.46Å; S175-L178 PolarHBondContact O-N 2.61Å; S175-L178 VanDerWaalsContact O-N 3.13Å; L178-K180 VanDerWaalsContact C-N 3.27Å; L178-K180 PolarHBondContact O-N 3.18Å; L178-I181 HydrophobicContact CD1-CD1 4.47Å; L178-I181 HydrophobicContact CD1-CG1 4.48Å; L178-I181 WeakPolarHBondContact O-CG1 3.48Å; L178-I181 PolarHBondContact O-N 2.84Å; L178-R182 WeakPolarHBondContact O-CB 3.43Å; L178-R182 PolarHBondContact O-N 3.24Å
179	D	71.3	Confident	74	Confident	97 Å²	97	82.1 Å²	82.1	52%	0.519	39%	0.391	S	S	.	.	H	α-helix	trans	-62.5	-32.1	179.2	-67.1	-28.8	0	0	0	113.3	S175 L177	S175-D179 PolarHBondContact O-N 3.09Å; L177-D179 VanDerWaalsContact C-N 3.31Å; L177-D179 PolarHBondContact O-N 3.41Å
180	K	70.9	Confident	71.7	Confident	149 Å²	149	80.7 Å²	80.7	65%	0.648	40%	0.402	S	S	*	.	H	α-helix	trans	-77.9	-33.3	179.5	-69.5	174.4	-176.9	179.1	0	112.9	S176 L177 L178 Q184	S176-K180 WeakPolarHBondContact O-CD 3.47Å; S176-K180 WeakPolarHBondContact O-CG 3.44Å; L177-K180 PolarHBondContact O-N 3.41Å; L178-K180 VanDerWaalsContact C-N 3.27Å; L178-K180 PolarHBondContact O-N 3.18Å; K180-Q184 PolarHBondContact O-NE2 3.39Å
181	I	76.2	Confident	69.4	Low	2 Å²	2	92 Å²	92	1%	0.01	44%	0.444	C	S	.	.	H	α-helix	trans	-93.1	-10.7	-179.5	70.2	-179.2	0	0	0	112.4	I140 L143 L167 L177 L178 F183 Q184 V185	I140-I181 HydrophobicContact CG2-CB 3.84Å; I140-I181 HydrophobicContact CG2-CG2 3.66Å; L143-I181 HydrophobicContact CD2-CD1 3.78Å; L143-I181 HydrophobicContact CD2-CG2 4.45Å; L143-I181 HydrophobicContact CG-CD1 4.48Å; L143-I181 HydrophobicContact CG-CG2 4.48Å; L167-I181 HydrophobicContact CD1-CD1 4.46Å; L177-I181 HydrophobicContact CD1-CG2 4.15Å; L177-I181 WeakPolarHBondContact O-CG1 3.47Å; L177-I181 PolarHBondContact O-N 3.36Å; L178-I181 HydrophobicContact CD1-CD1 4.47Å; L178-I181 HydrophobicContact CD1-CG1 4.48Å; L178-I181 WeakPolarHBondContact O-CG1 3.48Å; L178-I181 PolarHBondContact O-N 2.84Å; I181-F183 PolarHBondContact O-N 3.22Å; I181-F183 VanDerWaalsContact O-N 3.13Å; I181-Q184 WeakPolarHBondContact O-CA 3.48Å; I181-Q184 WeakPolarHBondContact O-CB 3.26Å; I181-Q184 PolarHBondContact O-N 3.49Å; I181-V185 HydrophobicContact CG1-CG2 4.35Å; I181-V185 WeakPolarHBondContact O-CG2 3.42Å; I181-V185 PolarHBondContact O-N 2.89Å
182	R	76.8	Confident	67.2	Low	106 Å²	106	94.3 Å²	94.3	40%	0.4	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-37.3	-176.6	-166	176.3	-175.9	82.8	6.8	113.8	E165 L178 Q184	E165-R182 IonicContact OE1-CZ 2.74Å; E165-R182 VanDerWaalsContact OE1-CZ 3.27Å; E165-R182 IonicContact OE1-NH1 3.97Å; E165-R182 PolarHBondContact OE1-NH1 3Å; E165-R182 IonicContact OE1-NH2 2.8Å; E165-R182 PolarHBondContact OE1-NH2 3.17Å; L178-R182 WeakPolarHBondContact O-CB 3.43Å; L178-R182 PolarHBondContact O-N 3.24Å; R182-Q184 VanDerWaalsContact C-N 3.31Å
183	F	65	Low	65.5	Low	188 Å²	188	95 Å²	95	83%	0.825	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-2.9	179.3	-56.1	-78.1	0	0	0	113.7	I181	I181-F183 PolarHBondContact O-N 3.22Å; I181-F183 VanDerWaalsContact O-N 3.13Å
184	Q	72.6	Confident	63.2	Low	46 Å²	46	100.1 Å²	100.1	22%	0.215	51%	0.506	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.3	-9.5	-177.1	-64.4	174.4	65.9	0	0	112.9	G126 I127 I140 K180 I181 R182	G126-Q184 CarbonylContact C-O 3.6Å; G126-Q184 WeakPolarHBondContact CA-O 3.39Å; I127-Q184 PolarHBondContact N-O 3.06Å; I140-Q184 HydrophobicContact CG2-CB 4.01Å; K180-Q184 PolarHBondContact O-NE2 3.39Å; I181-Q184 WeakPolarHBondContact O-CA 3.48Å; I181-Q184 WeakPolarHBondContact O-CB 3.26Å; I181-Q184 PolarHBondContact O-N 3.49Å; R182-Q184 VanDerWaalsContact C-N 3.31Å
185	V	78.8	Confident	61.2	Low	8 Å²	8	101.6 Å²	101.6	5%	0.048	52%	0.519	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	150.8	-172.5	-56.3	0	0	0	0	113.1	I127 I129 I140 I164 I181	I127-V185 CarbonylContact O-C 3.57Å; I127-V185 VanDerWaalsContact O-CA 3.25Å; I127-V185 WeakPolarHBondContact O-CA 3.4Å; I129-V185 HydrophobicContact CD1-CB 3.7Å; I129-V185 HydrophobicContact CD1-CG2 3.61Å; I129-V185 HydrophobicContact CG1-CB 3.78Å; I129-V185 HydrophobicContact CG1-CG1 4.32Å; I129-V185 HydrophobicContact CG1-CG2 4.23Å; I140-V185 HydrophobicContact CD1-CG1 3.37Å; I140-V185 HydrophobicContact CG1-CG1 4.05Å; I140-V185 HydrophobicContact CG2-CG1 4.11Å; I164-V185 HydrophobicContact CG2-CG2 4.18Å; I181-V185 HydrophobicContact CG1-CG2 4.35Å; I181-V185 WeakPolarHBondContact O-CG2 3.42Å; I181-V185 PolarHBondContact O-N 2.89Å
186	Y	84.3	Confident	59.2	Low	107 Å²	107	105.3 Å²	105.3	42%	0.42	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	166.4	172.7	75.2	-87.1	0	0	0	112.8	G126 I127 N128 I129 E188	G126-Y186 WeakPolarHBondContact O-CE1 3.4Å; I127-Y186 PolarHBondContact O-N 2.85Å; N128-Y186 WeakPolarHBondContact CA-O 3.25Å; N128-Y186 HydrophobicContact CB-CD1 4.48Å; N128-Y186 HydrophobicContact CB-CD2 4.46Å; N128-Y186 HydrophobicContact CB-CE1 3.91Å; N128-Y186 HydrophobicContact CB-CE2 3.87Å; I129-Y186 PolarHBondContact N-O 3.17Å; Y186-E188 HydrophobicContact CE2-CB 4.25Å
187	V	81.7	Confident	57.3	Low	26 Å²	26	108.1 Å²	108.1	16%	0.158	55%	0.547	C	S	.	.			trans	-124	119.6	176.5	171.3	0	0	0	0	108.4	I129 F161 I164	I129-V187 HydrophobicContact CB-CG2 4.38Å; I129-V187 HydrophobicContact CD1-CG2 3.86Å; F161-V187 HydrophobicContact CB-CG2 4.22Å; F161-V187 WeakPolarHBondContact O-CG1 3.35Å; I164-V187 HydrophobicContact CG1-CB 4.46Å; I164-V187 HydrophobicContact CG1-CG2 3.99Å
188	E	71.4	Confident	55.5	Low	121 Å²	121	115.2 Å²	115.2	57%	0.565	59%	0.585	S	S	*	*			trans	-80.5	130.8	178.3	-168.2	166.9	-160.9	0	0	110.9	N128 Y186 S190	N128-E188 WeakPolarHBondContact ND2-CB 3.19Å; N128-E188 PolarHBondContact ND2-OE2 2.87Å; Y186-E188 HydrophobicContact CE2-CB 4.25Å; E188-S190 PolarHBondContact O-N 3.42Å
189	R	46.2	Very low	53.2	Low	235 Å²	235	117.9 Å²	117.9	89%	0.887	62%	0.615	S	S	*	*			trans	-70.7	111.3	173.4	-71.9	-178.7	-179.8	170.8	0.8	108.2	R191	R189-R191 PolarHBondContact O-N 2.87Å
190	S	34.3	Very low	51.1	Low	111 Å²	111	117.1 Å²	117.1	78%	0.776	63%	0.63	S	S	*	*			trans	-52.2	107.5	-179.8	40.8	0	0	0	0	112.3	E188	E188-S190 PolarHBondContact O-N 3.42Å
191	R	34.3	Very low	49.2	Very low	240 Å²	240	118.1 Å²	118.1	91%	0.906	64%	0.642	S	S	*	*			trans	-81	136.3	144.3	-84.7	-175.8	175.3	-175.4	-0.4	107.4	R189	R189-R191 PolarHBondContact O-N 2.87Å
192	T	30.1	Very low	47	Very low	131 Å²	131	124.9 Å²	124.9	80%	0.804	68%	0.683	S	S	*	*			trans	-55.4	137.1	178	44.6	0	0	0	0	111.7	S194	T192-S194 PolarHBondContact O-N 3.12Å
193	P	35.3	Very low	44.6	Very low	127 Å²	127	123.1 Å²	123.1	83%	0.825	70%	0.698	S	S	*	*			trans	-79	114.2	-176.5	28.6	-29.3	0	0	0	110.9
194	S	30.8	Very low	42.9	Very low	114 Å²	114	120.4 Å²	120.4	80%	0.797	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-71	124.5	161.5	35.9	0	0	0	0	109.1	T192	T192-S194 PolarHBondContact O-N 3.12Å
195	T	30.5	Very low	40.8	Very low	139 Å²	139	125.1 Å²	125.1	85%	0.853	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-61	135.4	-179.3	37	0	0	0	0	112.5
196	N	33.2	Very low	38.4	Very low	153 Å²	153	134.3 Å²	134.3	82%	0.818	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-56.2	142.1	170.6	-57.3	-38.9	0	0	0	111.6
197	T	28.1	Very low	35.5	Very low	133 Å²	133	134.8 Å²	134.8	82%	0.816	79%	0.787	S	S	*	*			trans	-151.5	110.2	132.9	-46.2	0	0	0	0	109.1	G199	T197-G199 PolarHBondContact O-N 2.99Å
198	N	36.5	Very low	32.9	Very low	175 Å²	175	142.6 Å²	142.6	94%	0.936	82%	0.822	S	S	*	*			trans	-69.6	114	155.6	-77.2	-36.3	0	0	0	107
199	G	28.6	Very low	31.4	Very low	68 Å²	68	141.7 Å²	141.7	70%	0.701	83%	0.827	S	S	*	*			trans	-145.7	122.8	172.5	0	0	0	0	0	108.7	T197	T197-G199 PolarHBondContact O-N 2.99Å
200	G	27.1	Very low	30.4	Very low	80 Å²	80	136.2 Å²	136.2	83%	0.825	83%	0.825	S	S	*	*			trans	-67.6	172.7	-167.6	0	0	0	0	0	116.6
201	L	31.4	Very low	30.6	Very low	170 Å²	170	136.3 Å²	136.3	89%	0.89	82%	0.823	S	S	*	*			trans	-50	127.5	168.3	-73.4	145	0	0	0	112.2
202	T	29.9	Very low	30.5	Very low	145 Å²	145	130.9 Å²	130.9	89%	0.89	82%	0.816	S	S	*	*				161.9	140.4	119.7	42.4	0	0	0	0	111.4
203	G	26.8	Very low	30.4	Very low	69 Å²	69	130 Å²	130	71%	0.711	82%	0.816	S	S	*	*			trans	110.9	92.1	151.6	0	0	0	0	0	119.4
204	T	30	Very low	30	Very low	130 Å²	130	133.3 Å²	133.3	80%	0.798	82%	0.817	S	S	*	*			trans	26.2	127.5	137.5	61.6	0	0	0	0	121.7
205	T	26.7	Very low	29.9	Very low	145 Å²	145	132.5 Å²	132.5	89%	0.89	81%	0.812	S	S	*	*				166.3	151.3	113.5	39.3	0	0	0	0	112.8
206	K	28.4	Very low	29.9	Very low	202 Å²	202	133.9 Å²	133.9	88%	0.878	81%	0.813	S	S	*	*			trans	-76.3	146.6	-176.3	-71.3	173.9	172.1	176.6	0	113.4
207	S	24.2	Very low	29.8	Very low	116 Å²	116	134.6 Å²	134.6	81%	0.811	81%	0.809	S	S	*	*				154.7	109.4	112.8	55.4	0	0	0	0	115.4
208	Q	26.5	Very low	30.2	Very low	190 Å²	190	133.6 Å²	133.6	89%	0.888	81%	0.807	S	S	*	*			trans	60.1	164.1	130.9	-106.9	-162.2	-4.7	0	0	123.3
209	P	41	Very low	30.3	Very low	103 Å²	103	131.6 Å²	131.6	67%	0.669	80%	0.797	S	S	*	*				-121.3	168.8	-108.2	40.3	-24.6	0	0	0	114.9
210	S	24.2	Very low	31	Very low	120 Å²	120	136 Å²	136	84%	0.839	80%	0.804	S	S	*	*			trans	-168.5	158.6	153.4	-86.2	0	0	0	0	112.2
211	P	39	Very low	32.3	Very low	113 Å²	113	135.6 Å²	135.6	73%	0.734	78%	0.783	S	S	*	*			trans	-106.9	179	-132.4	39.6	-35.5	0	0	0	114.4
212	T	32.3	Very low	33.4	Very low	125 Å²	125	135.4 Å²	135.4	77%	0.767	78%	0.783	S	S	*	*			trans	92.2	83.6	163.4	-15.3	0	0	0	0	115.9
213	S	27.7	Very low	34.8	Very low	114 Å²	114	131.7 Å²	131.7	80%	0.797	76%	0.757	S	S	*	*			trans	-152.4	113.4	145.7	175.4	0	0	0	0	107.8	S215	S213-S215 PolarHBondContact O-N 2.89Å
214	F	27.5	Very low	36.3	Very low	196 Å²	196	130.3 Å²	130.3	86%	0.86	74%	0.736	S	S	*	*			trans	-61.3	98	171.1	-82.5	-95.8	0	0	0	108.4	L216	F214-L216 PolarHBondContact O-N 2.82Å; F214-L216 VanDerWaalsContact O-N 3.1Å
215	S	27.9	Very low	37.5	Very low	97 Å²	97	130.5 Å²	130.5	68%	0.678	74%	0.739	S	S	*	*			trans	-72.3	96.8	166.5	-169.4	0	0	0	0	107.6	S213 K217	S213-S215 PolarHBondContact O-N 2.89Å; S215-K217 PolarHBondContact O-N 2.98Å
216	L	32	Very low	39.1	Very low	167 Å²	167	127 Å²	127	87%	0.874	73%	0.731	S	S	*	*			trans	-64.9	97.5	154.5	-74.2	173.4	0	0	0	106	F214 S218	F214-L216 PolarHBondContact O-N 2.82Å; F214-L216 VanDerWaalsContact O-N 3.1Å; L216-S218 PolarHBondContact O-N 3.07Å; L216-S218 VanDerWaalsContact O-N 3.09Å
217	K	29.6	Very low	40.6	Very low	168 Å²	168	118.5 Å²	118.5	73%	0.73	70%	0.701	S	S	*	*			trans	-62.1	108	163.1	-69.4	-177.9	174.8	-176.5	0	106	S215 D219	S215-K217 PolarHBondContact O-N 2.98Å; K217-D219 VanDerWaalsContact C-N 3.27Å; K217-D219 PolarHBondContact O-N 3.22Å; K217-D219 VanDerWaalsContact O-N 3.1Å
218	S	36.6	Very low	42.6	Very low	113 Å²	113	115.2 Å²	115.2	79%	0.79	68%	0.677	S	S	*	*			trans	-65.1	100.2	152.9	51.5	0	0	0	0	105.2	L216	L216-S218 PolarHBondContact O-N 3.07Å; L216-S218 VanDerWaalsContact O-N 3.09Å
219	D	40.1	Very low	44.1	Very low	133 Å²	133	111 Å²	111	71%	0.711	67%	0.674	S	S	*	*			trans	-57.1	139.3	166.8	-78	-29.7	0	0	0	108.2	K217 L221	K217-D219 VanDerWaalsContact C-N 3.27Å; K217-D219 PolarHBondContact O-N 3.22Å; K217-D219 VanDerWaalsContact O-N 3.1Å; D219-L221 PolarHBondContact O-N 3.11Å
220	D	43	Very low	45	Very low	161 Å²	161	112.6 Å²	112.6	86%	0.861	67%	0.673	S	S	*	*			trans	-43.9	99.8	179.3	-91.3	-39.5	0	0	0	110.8
221	L	53.7	Low	46.7	Very low	71 Å²	71	109.1 Å²	109.1	37%	0.372	64%	0.644	S	S	.	*			trans	-79.6	124.3	156.2	-68.7	172.2	0	0	0	105.2	D219 L223 I231 P269 L310	D219-L221 PolarHBondContact O-N 3.11Å; L221-L223 HydrophobicContact CB-CD2 4.24Å; L221-L223 HydrophobicContact CB-CG 4.23Å; L221-L223 WeakPolarHBondContact O-CG 3.26Å; L221-L223 PolarHBondContact O-N 3.44Å; L221-I231 HydrophobicContact CD1-CD1 3.61Å; L221-P269 HydrophobicContact CD1-CB 4.48Å; L221-L310 HydrophobicContact CD1-CD2 4.38Å
222	D	54.7	Low	47.8	Very low	166 Å²	166	108.8 Å²	108.8	89%	0.888	64%	0.636	S	S	*	*			trans	-63.3	82.8	169.9	-79.7	-38	0	0	0	108.7
223	L	59.9	Low	49.2	Very low	66 Å²	66	104.5 Å²	104.5	35%	0.346	61%	0.611	S	S	.	*	P	Polyproline II helix	trans	-76.5	136.5	-178.4	-69.6	169.5	0	0	0	109.3	L221 I231 P269 W507	L221-L223 HydrophobicContact CB-CD2 4.24Å; L221-L223 HydrophobicContact CB-CG 4.23Å; L221-L223 WeakPolarHBondContact O-CG 3.26Å; L221-L223 PolarHBondContact O-N 3.44Å; L223-I231 HydrophobicContact CD2-CD1 3.97Å; L223-I231 HydrophobicContact CD2-CG1 4.3Å; L223-P269 HydrophobicContact CD2-CG 3.74Å; L223-W507 HydrophobicContact CB-CH2 3.56Å; L223-W507 HydrophobicContact CB-CZ2 4.38Å; L223-W507 HydrophobicContact CB-CZ3 3.72Å; L223-W507 HydrophobicContact CD1-CH2 3.58Å; L223-W507 HydrophobicContact CD1-CZ2 3.61Å; L223-W507 HydrophobicContact CD1-CZ3 4.47Å; L223-W507 HydrophobicContact CD2-CD2 4.13Å; L223-W507 HydrophobicContact CD2-CE3 4.03Å; L223-W507 HydrophobicContact CD2-CH2 3.66Å; L223-W507 HydrophobicContact CD2-CZ2 3.7Å; L223-W507 HydrophobicContact CD2-CZ3 3.82Å; L223-W507 HydrophobicContact CG-CH2 3.76Å; L223-W507 HydrophobicContact CG-CZ2 4.07Å; L223-W507 HydrophobicContact CG-CZ3 4.18Å
224	P	56.6	Low	51	Low	41 Å²	41	106.4 Å²	106.4	27%	0.266	61%	0.609	S	S	.	*	P	Polyproline II helix	trans	-60.9	140	178.1	24	-32.5	0	0	0	110.8	G226 G227 W507 W514	P224-G226 PolarHBondContact O-N 3.18Å; P224-G227 PolarHBondContact O-N 2.89Å; P224-W507 HydrophobicContact CG-CE3 3.98Å; P224-W507 HydrophobicContact CG-CZ3 3.97Å; P224-W514 HydrophobicContact CB-CH2 4.27Å; P224-W514 HydrophobicContact CG-CH2 3.93Å; P224-W514 HydrophobicContact CG-CZ3 4.32Å
225	P	55.9	Low	53.3	Low	134 Å²	134	98.6 Å²	98.6	87%	0.87	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.7	132.3	-177.3	21	-30.2	0	0	0	111.5
226	G	61.1	Low	55	Low	70 Å²	70	97.4 Å²	97.4	72%	0.722	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	91.1	5.8	176.3	0	0	0	0	0	116.2	P224 W514	P224-G226 PolarHBondContact O-N 3.18Å; G226-W514 PolarHBondContact O-NE1 3.01Å
227	G	58.8	Low	56.6	Low	24 Å²	24	95 Å²	95	25%	0.247	55%	0.552	C	S	.	*			trans	-79.8	176	173.1	0	0	0	0	0	114.7	P224	P224-G227 PolarHBondContact O-N 2.89Å
228	P	65.9	Low	58.6	Low	47 Å²	47	89.5 Å²	89.5	31%	0.305	53%	0.532	S	S	.	.			trans	-53.3	165.1	176.1	-24.6	33.6	0	0	0	113.3	P506 W507	P228-P506 HydrophobicContact CG-CB 4.28Å; P228-W507 HydrophobicContact CB-CZ2 4.32Å; P228-W507 WeakPolarHBondContact O-CH2 3.31Å; P228-W507 WeakPolarHBondContact O-CZ2 3.37Å
229	A	59.1	Low	60.3	Low	101 Å²	101	89.5 Å²	89.5	84%	0.835	52%	0.523	S	S	*	.	S	Bend	trans	-79.5	-17	180	0	0	0	0	0	114
230	Q	59.6	Low	61.7	Low	138 Å²	138	83.5 Å²	83.5	65%	0.645	49%	0.492	S	S	*	.	S	Bend	trans	-145.9	145.6	-175.8	-66	-177.6	-3.5	0	0	110.6	I232 W507	Q230-I232 HydrophobicContact CB-CG1 4.15Å; Q230-I232 PolarHBondContact O-N 3.43Å; Q230-W507 PolarHBondContact O-NE1 3.02Å
231	I	60.5	Low	62.9	Low	46 Å²	46	78.2 Å²	78.2	24%	0.236	47%	0.466	C	S	.	.			trans	-84.7	94.3	166.2	-57.1	159.1	0	0	0	106.7	L221 L223 P269 W507	L221-I231 HydrophobicContact CD1-CD1 3.61Å; L223-I231 HydrophobicContact CD2-CD1 3.97Å; L223-I231 HydrophobicContact CD2-CG1 4.3Å; I231-P269 HydrophobicContact CD1-CB 3.69Å; I231-P269 HydrophobicContact CD1-CG 3.78Å; I231-W507 VanDerWaalsContact CG1-CD1 3.41Å; I231-W507 HydrophobicContact CG1-CD2 4.34Å; I231-W507 HydrophobicContact CG1-CG 4Å; I231-W507 VanDerWaalsContact CG1-NE1 3.3Å
232	I	61.6	Low	63.5	Low	107 Å²	107	80.8 Å²	80.8	55%	0.549	48%	0.48	S	S	.	.			trans	-97.8	106	167.8	-57.3	174.9	0	0	0	106.1	Q230 M234	Q230-I232 HydrophobicContact CB-CG1 4.15Å; Q230-I232 PolarHBondContact O-N 3.43Å; I232-M234 PolarHBondContact O-N 3.2Å
233	S	61.8	Low	64	Low	35 Å²	35	75 Å²	75	25%	0.245	46%	0.458	C	S	.	.			trans	-62.3	126.5	173.6	-167.1	0	0	0	0	109.4	R235 E273 S312	S233-R235 VanDerWaalsContact C-N 3.3Å; S233-E273 VanDerWaalsContact CB-OE1 3.22Å; S233-E273 WeakPolarHBondContact CB-OE1 3.46Å; S233-E273 PolarHBondContact OG-OE1 2.87Å; S233-S312 WeakPolarHBondContact CB-OG 3.39Å
234	M	66.3	Low	64.6	Low	153 Å²	153	75.8 Å²	75.8	75%	0.754	46%	0.463	S	S	*	.			trans	-93.3	6.8	177.5	-63.3	-110	71.3	0	0	111.6	I232 P506	I232-M234 PolarHBondContact O-N 3.2Å; M234-P506 HydrophobicContact CG-CG 4.44Å
235	R	74.5	Confident	65.6	Low	32 Å²	32	76.9 Å²	76.9	12%	0.121	46%	0.462	C	S	.	.			trans	-71.2	135.9	-176.9	-75.3	177.6	163.2	-122.6	5.2	111	S233 V274 T278 E281 G502	S233-R235 VanDerWaalsContact C-N 3.3Å; R235-V274 VanDerWaalsContact NH2-CA 3.27Å; R235-V274 PolarHBondContact NH2-O 3.45Å; R235-T278 VanDerWaalsContact NH1-N 3.11Å; R235-T278 PolarHBondContact NH2-OG1 3.44Å; R235-E281 WeakPolarHBondContact CD-OE1 3.18Å; R235-E281 IonicContact CZ-OE1 3.38Å; R235-E281 IonicContact CZ-OE2 2.91Å; R235-E281 IonicContact NH1-OE1 3.55Å; R235-E281 PolarHBondContact NH1-OE1 3.13Å; R235-E281 IonicContact NH1-OE2 3.86Å; R235-E281 PolarHBondContact NH1-OE2 3.23Å; R235-G502 PolarHBondContact NE-O 2.74Å; R235-G502 VanDerWaalsContact NE-O 3.14Å; R235-G502 VanDerWaalsContact NH2-C 3.34Å; R235-G502 PolarHBondContact NH2-O 2.79Å
236	P	63.8	Low	66.5	Low	72 Å²	72	77 Å²	77	47%	0.468	46%	0.455	S	S	.	.			trans	-62.8	147.8	173.1	24	-29	0	0	0	110.2	V238	P236-V238 HydrophobicContact CB-CG2 4.16Å; P236-V238 HydrophobicContact CG-CG2 3.9Å; P236-V238 PolarHBondContact O-N 3.39Å; P236-V238 VanDerWaalsContact O-N 3.09Å
237	N	66.1	Low	67.3	Low	118 Å²	118	76.9 Å²	76.9	63%	0.631	45%	0.453	S	S	*	.			trans	-75.4	99.9	170	-162.6	-33.2	0	0	0	107.6
238	V	71.9	Confident	68.5	Low	51 Å²	51	81.7 Å²	81.7	31%	0.309	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-100.3	130.3	-178.4	-177.3	0	0	0	0	108.7	P236	P236-V238 HydrophobicContact CB-CG2 4.16Å; P236-V238 HydrophobicContact CG-CG2 3.9Å; P236-V238 PolarHBondContact O-N 3.39Å; P236-V238 VanDerWaalsContact O-N 3.09Å
239	D	72.2	Confident	69.5	Low	113 Å²	113	81.1 Å²	81.1	60%	0.604	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-73.3	118.3	165.1	-72.1	-35.7	0	0	0	108
240	P	68.4	Low	71	Confident	8 Å²	8	77 Å²	77	5%	0.052	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-60.8	145.2	179.7	26.7	-31.2	0	0	0	109.2	L242 E283 W316 W318	P240-L242 PolarHBondContact O-N 2.89Å; P240-L242 VanDerWaalsContact O-N 3.14Å; P240-E283 HydrophobicContact CB-CG 3.44Å; P240-E283 VanDerWaalsContact CB-CG 3.44Å; P240-E283 VanDerWaalsContact CB-OE1 3.27Å; P240-E283 WeakPolarHBondContact CB-OE1 3.3Å; P240-W316 HydrophobicContact CB-CH2 3.96Å; P240-W316 HydrophobicContact CB-CZ2 3.87Å; P240-W316 HydrophobicContact CG-CH2 3.83Å; P240-W316 HydrophobicContact CG-CZ2 3.61Å; P240-W318 HydrophobicContact CG-CB 3.96Å; P240-W318 VanDerWaalsContact CG-CD1 3.41Å; P240-W318 HydrophobicContact CG-CD2 3.87Å; P240-W318 HydrophobicContact CG-CG 3.47Å; P240-W318 VanDerWaalsContact CG-CG 3.47Å
241	P	68.1	Low	72.5	Confident	50 Å²	50	71 Å²	71	33%	0.325	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-59.8	124	176	-27.4	40.9	0	0	0	109.2	G243 R252 E281 E283	P241-G243 PolarHBondContact O-N 2.92Å; P241-R252 VanDerWaalsContact CB-NH2 3.3Å; P241-R252 VanDerWaalsContact CG-NH1 3.34Å; P241-E281 WeakPolarHBondContact CD-O 3.41Å; P241-E283 WeakPolarHBondContact O-CG 3.31Å
242	L	66.5	Low	74.2	Confident	125 Å²	125	69.7 Å²	69.7	65%	0.654	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-48.9	135.8	173.3	-63.1	171.1	0	0	0	107.8	P240 L244	P240-L242 PolarHBondContact O-N 2.89Å; P240-L242 VanDerWaalsContact O-N 3.14Å; L242-L244 CarbonylContact O-C 3.58Å; L242-L244 PolarHBondContact O-N 2.85Å
243	G	65.9	Low	75.9	Confident	43 Å²	43	64.7 Å²	64.7	44%	0.443	37%	0.369	S	S	.	.	S	Bend	trans	-62.5	21	179.3	0	0	0	0	0	114.7	P241 P249 A250	P241-G243 PolarHBondContact O-N 2.92Å; G243-P249 WeakPolarHBondContact O-CA 3.48Å; G243-A250 PolarHBondContact O-N 3.14Å
244	L	72.3	Confident	77.7	Confident	83 Å²	83	63 Å²	63	44%	0.435	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	120.6	176.7	-70.2	153.3	0	0	0	107.9	L242 K248	L242-L244 CarbonylContact O-C 3.58Å; L242-L244 PolarHBondContact O-N 2.85Å; L244-K248 CarbonylContact C-O 3.56Å; L244-K248 VanDerWaalsContact CA-O 3.26Å; L244-K248 WeakPolarHBondContact CA-O 3.19Å
245	R	76.9	Confident	79.2	Confident	65 Å²	65	55.8 Å²	55.8	25%	0.245	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	131.5	163.9	179.1	174.1	-60	-97.2	1.3	109.3	G247 K248 A250 H495 E527 Y529	R245-G247 PolarHBondContact O-N 3.48Å; R245-G247 VanDerWaalsContact O-N 3.08Å; R245-K248 PolarHBondContact N-O 3.15Å; R245-K248 WeakPolarHBondContact O-CB 3.34Å; R245-K248 PolarHBondContact O-N 3.48Å; R245-K248 VanDerWaalsContact O-O 3.11Å; R245-A250 HydrophobicContact CB-CB 4.44Å; R245-H495 PolarHBondContact NH2-CD2 2.8Å; R245-H495 VanDerWaalsContact NH2-CG 3.33Å; R245-E527 WeakPolarHBondContact CB-OE1 3.19Å; R245-E527 VanDerWaalsContact CD-OE1 3.24Å; R245-E527 WeakPolarHBondContact CD-OE1 3.45Å; R245-E527 IonicContact CZ-OE1 3.6Å; R245-E527 IonicContact CZ-OE2 2.75Å; R245-E527 IonicContact NE-OE1 3.89Å; R245-E527 PolarHBondContact NE-OE1 3.1Å; R245-E527 IonicContact NE-OE2 3.97Å; R245-E527 PolarHBondContact NE-OE2 3.46Å; R245-E527 IonicContact NH2-OE1 3.47Å; R245-E527 IonicContact NH2-OE2 2.96Å; R245-E527 PolarHBondContact NH2-OE2 3.48Å; R245-Y529 HydrophobicContact CB-CE1 3.98Å; R245-Y529 HydrophobicContact CG-CE1 4.29Å
246	D	76.2	Confident	80.4	Confident	137 Å²	137	54.3 Å²	54.3	73%	0.733	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	33.3	-177.6	-55.2	-29.5	0	0	0	112.7	K248 Y529	D246-K248 PolarHBondContact O-N 2.84Å; D246-Y529 PolarHBondContact OD2-OH 3.01Å
247	G	77.3	Confident	81.9	Confident	66 Å²	66	50.9 Å²	50.9	68%	0.68	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.3	5	-176.3	0	0	0	0	0	115.4	R245	R245-G247 PolarHBondContact O-N 3.48Å; R245-G247 VanDerWaalsContact O-N 3.08Å
248	K	82.7	Confident	83.3	Confident	126 Å²	126	45.4 Å²	45.4	55%	0.548	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	138.6	177.9	-64.5	179.6	-177.6	175.7	0	110.9	L244 R245 D246 A250 Y529	L244-K248 CarbonylContact C-O 3.56Å; L244-K248 VanDerWaalsContact CA-O 3.26Å; L244-K248 WeakPolarHBondContact CA-O 3.19Å; R245-K248 PolarHBondContact N-O 3.15Å; R245-K248 WeakPolarHBondContact O-CB 3.34Å; R245-K248 PolarHBondContact O-N 3.48Å; R245-K248 VanDerWaalsContact O-O 3.11Å; D246-K248 PolarHBondContact O-N 2.84Å; K248-A250 PolarHBondContact O-N 3.18Å; K248-Y529 HydrophobicContact CB-CD1 3.73Å; K248-Y529 HydrophobicContact CB-CE1 3.91Å; K248-Y529 HydrophobicContact CD-CD1 4.28Å; K248-Y529 HydrophobicContact CD-CE1 4.34Å
249	P	86.9	Confident	84.2	Confident	35 Å²	35	46.9 Å²	46.9	23%	0.227	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	138.2	178.2	23.9	-27.2	0	0	0	110.3	G243 I530 L532	G243-P249 WeakPolarHBondContact O-CA 3.48Å; P249-I530 HydrophobicContact CB-CD1 4.28Å; P249-I530 HydrophobicContact CB-CG1 3.88Å; P249-I530 HydrophobicContact CG-CG1 4.31Å; P249-I530 WeakPolarHBondContact CG-O 3.39Å; P249-I530 WeakPolarHBondContact O-CG1 3.24Å; P249-I530 PolarHBondContact O-N 3.32Å; P249-L532 HydrophobicContact CB-CD1 3.72Å; P249-L532 HydrophobicContact CB-CG 4.23Å; P249-L532 HydrophobicContact CG-CB 4.2Å; P249-L532 HydrophobicContact CG-CD1 4.17Å; P249-L532 HydrophobicContact CG-CG 4.25Å
250	A	90.6	Very high	85.2	Confident	15 Å²	15	41.7 Å²	41.7	12%	0.124	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	147.3	-177.2	0	0	0	0	0	110.8	G243 R245 K248 E527 F528 Y529	G243-A250 PolarHBondContact O-N 3.14Å; R245-A250 HydrophobicContact CB-CB 4.44Å; K248-A250 PolarHBondContact O-N 3.18Å; A250-E527 HydrophobicContact CB-CG 3.85Å; A250-F528 CarbonylContact C-O 3.6Å; A250-F528 VanDerWaalsContact CA-O 3.23Å; A250-F528 WeakPolarHBondContact CA-O 3.2Å; A250-Y529 HydrophobicContact CB-CD1 4.32Å
251	V	93	Very high	86.5	Confident	11 Å²	11	41.3 Å²	41.3	7%	0.067	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	139.8	176.4	70.4	0	0	0	0	109.5	K285 I352 V383 E527 F528 I530	V251-K285 HydrophobicContact CG2-CB 3.82Å; V251-K285 HydrophobicContact CG2-CG 4.18Å; V251-I352 HydrophobicContact CG2-CD1 3.93Å; V251-V383 HydrophobicContact CB-CG1 4.38Å; V251-V383 HydrophobicContact CG1-CG1 4.14Å; V251-V383 HydrophobicContact CG2-CG1 4.29Å; V251-E527 WeakPolarHBondContact O-CA 3.35Å; V251-F528 HydrophobicContact CG1-CB 4.18Å; V251-F528 PolarHBondContact N-O 3.31Å; V251-F528 PolarHBondContact O-N 3.44Å; V251-I530 HydrophobicContact CB-CD1 4.42Å; V251-I530 HydrophobicContact CB-CG2 3.91Å; V251-I530 HydrophobicContact CG1-CG2 3.54Å
252	R	96.1	Very high	87.8	Confident	18 Å²	18	39.8 Å²	39.8	7%	0.068	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	122.7	174.5	-68.6	177.1	177.9	-178.3	2	110.9	P241 N282 E283 K285 I286 V525 A526 E527	P241-R252 VanDerWaalsContact CB-NH2 3.3Å; P241-R252 VanDerWaalsContact CG-NH1 3.34Å; R252-N282 WeakPolarHBondContact CD-O 3.25Å; R252-N282 PolarHBondContact NH1-O 3.06Å; R252-E283 WeakPolarHBondContact CB-O 3.38Å; R252-K285 PolarHBondContact O-N 3.17Å; R252-I286 PolarHBondContact O-N 3.25Å; R252-V525 HydrophobicContact CB-CG1 3.92Å; R252-V525 HydrophobicContact CG-CG1 4.26Å; R252-A526 WeakPolarHBondContact CA-O 3.24Å; R252-E527 HydrophobicContact CG-CB 3.98Å; R252-E527 HydrophobicContact CG-CG 3.7Å; R252-E527 IonicContact CZ-OE2 3.19Å; R252-E527 IonicContact NE-OE2 2.64Å; R252-E527 PolarHBondContact NE-OE2 3.49Å; R252-E527 IonicContact NH2-OE2 3.99Å; R252-E527 PolarHBondContact NH2-OE2 3.45Å
253	L	97.4	Very high	89.3	Confident	2 Å²	2	34.9 Å²	34.9	1%	0.01	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	135.5	172.4	174.9	78	0	0	0	107.7	I286 V390 V434 L436 V525 A526 F528	L253-I286 CarbonylContact C-O 3.5Å; L253-I286 WeakPolarHBondContact CA-O 3.37Å; L253-I286 HydrophobicContact CD1-CB 3.58Å; L253-I286 HydrophobicContact CD1-CD1 4.41Å; L253-I286 HydrophobicContact CD1-CG2 3.45Å; L253-I286 VanDerWaalsContact CD1-CG2 3.45Å; L253-V390 HydrophobicContact CD1-CG1 4.47Å; L253-V390 HydrophobicContact CD1-CG2 4.35Å; L253-V434 HydrophobicContact CD2-CB 4.18Å; L253-V434 HydrophobicContact CD2-CG1 3.72Å; L253-V434 HydrophobicContact CD2-CG2 4.01Å; L253-L436 HydrophobicContact CD1-CD2 4.15Å; L253-L436 HydrophobicContact CD2-CD2 3.64Å; L253-L436 HydrophobicContact CG-CD2 3.84Å; L253-V525 WeakPolarHBondContact O-CA 3.46Å; L253-A526 PolarHBondContact N-O 2.89Å; L253-A526 PolarHBondContact O-N 2.83Å; L253-F528 HydrophobicContact CB-CE2 4.19Å; L253-F528 HydrophobicContact CD2-CE2 4.24Å
254	A	98.5	Very high	90.7	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	159.8	178.5	0	0	0	0	0	112.2	I284 I286 L287 A288 V524 V525	A254-I284 HydrophobicContact CB-CD1 3.77Å; A254-I284 HydrophobicContact CB-CG1 4.07Å; A254-I284 HydrophobicContact CB-CG2 3.63Å; A254-I286 PolarHBondContact N-O 3.18Å; A254-L287 HydrophobicContact CB-CD1 3.74Å; A254-L287 WeakPolarHBondContact O-CA 3.35Å; A254-A288 PolarHBondContact O-N 2.86Å; A254-V524 CarbonylContact C-O 3.56Å; A254-V524 WeakPolarHBondContact CA-O 3.47Å; A254-V524 WeakPolarHBondContact CB-O 3.25Å; A254-V525 HydrophobicContact CB-CB 4.42Å; A254-V525 HydrophobicContact CB-CG1 4.49Å; A254-V525 HydrophobicContact CB-CG2 3.88Å
255	T	98.6	Very high	91.8	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.006	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	143.1	166.9	-166	0	0	0	0	110.7	A288 Q290 L436 G437 I482 P523 V524	T255-A288 CarbonylContact C-O 3.56Å; T255-A288 VanDerWaalsContact CA-O 3.3Å; T255-A288 WeakPolarHBondContact CA-O 3.38Å; T255-Q290 PolarHBondContact OG1-NE2 3.06Å; T255-Q290 PolarHBondContact OG1-OE1 3.47Å; T255-L436 HydrophobicContact CG2-CB 4.22Å; T255-G437 VanDerWaalsContact OG1-CA 3.29Å; T255-G437 WeakPolarHBondContact OG1-CA 3.36Å; T255-G437 PolarHBondContact OG1-N 3.03Å; T255-I482 HydrophobicContact CG2-CG1 4.13Å; T255-P523 WeakPolarHBondContact O-CA 3.43Å; T255-V524 HydrophobicContact CG2-CB 4Å; T255-V524 PolarHBondContact N-O 3.33Å; T255-V524 PolarHBondContact O-N 3.34Å
256	W	98.3	Very high	92.7	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.008	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	117.5	178.7	-163	4.7	0	0	0	112	L258 V274 V275 T278 L287 A288 V289 Q290 L503 H521 P523	W256-L258 HydrophobicContact CD2-CD2 3.67Å; W256-L258 HydrophobicContact CE3-CD2 4.02Å; W256-L258 HydrophobicContact CG-CD2 3.99Å; W256-L258 HydrophobicContact CZ2-CD2 4.36Å; W256-V274 HydrophobicContact CH2-CG1 4.05Å; W256-V275 HydrophobicContact CH2-CG2 4.18Å; W256-V275 HydrophobicContact CZ3-CB 4.31Å; W256-V275 HydrophobicContact CZ3-CG1 4.34Å; W256-V275 HydrophobicContact CZ3-CG2 4.04Å; W256-T278 HydrophobicContact CH2-CG2 4.35Å; W256-T278 HydrophobicContact CZ3-CG2 3.97Å; W256-L287 HydrophobicContact CB-CD1 3.95Å; W256-A288 PolarHBondContact N-O 3.15Å; W256-V289 WeakPolarHBondContact O-CA 3.36Å; W256-Q290 PolarHBondContact O-N 2.78Å; W256-L503 HydrophobicContact CH2-CD2 3.91Å; W256-L503 HydrophobicContact CZ2-CD2 3.91Å; W256-H521 PolarHBondContact NE1-O 2.76Å; W256-P523 HydrophobicContact CB-CB 4.35Å; W256-P523 HydrophobicContact CD2-CB 4.05Å; W256-P523 HydrophobicContact CD2-CG 3.57Å; W256-P523 HydrophobicContact CE3-CB 4.2Å; W256-P523 HydrophobicContact CE3-CG 3.69Å; W256-P523 HydrophobicContact CG-CB 4.14Å; W256-P523 HydrophobicContact CG-CG 4.09Å; W256-P523 HydrophobicContact CH2-CG 3.99Å; W256-P523 HydrophobicContact CZ2-CG 3.9Å; W256-P523 HydrophobicContact CZ3-CG 3.88Å
257	S	95.9	Very high	93.6	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	124.4	165.4	177.8	0	0	0	0	109.6	S519	S257-S519 WeakPolarHBondContact O-CB 3.31Å; S257-S519 PolarHBondContact O-OG 2.76Å
258	L	95.7	Very high	94.5	Very high	3 Å²	3	30.4 Å²	30.4	2%	0.016	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	13	-179.3	-67.8	-176.8	0	0	0	113.5	W256 C261 K265 V275 V289 Q290 F301	W256-L258 HydrophobicContact CD2-CD2 3.67Å; W256-L258 HydrophobicContact CE3-CD2 4.02Å; W256-L258 HydrophobicContact CG-CD2 3.99Å; W256-L258 HydrophobicContact CZ2-CD2 4.36Å; L258-C261 HydrophobicContact CB-CB 3.7Å; L258-K265 PolarHBondContact O-NZ 3.27Å; L258-V275 HydrophobicContact CD2-CG2 4.05Å; L258-V289 HydrophobicContact CB-CG1 4.36Å; L258-V289 HydrophobicContact CD1-CG1 3.62Å; L258-V289 HydrophobicContact CG-CG1 3.81Å; L258-Q290 PolarHBondContact N-O 3.5Å; L258-F301 HydrophobicContact CD1-CD2 4.43Å; L258-F301 HydrophobicContact CD1-CE2 3.7Å; L258-F301 HydrophobicContact CD1-CZ 4.2Å
259	Q	91.7	Very high	95	Very high	82 Å²	82	24.7 Å²	24.7	38%	0.383	13%	0.129	S	C	.	.	E	Extended strand (participates in β ladder)	trans	50.8	78.7	169.2	-165.7	-162.5	23.4	0	0	113.3	K265 D291 D520	Q259-K265 PolarHBondContact O-NZ 2.66Å; Q259-D291 VanDerWaalsContact CA-OD2 3.27Å; Q259-D291 WeakPolarHBondContact CA-OD2 3.24Å; Q259-D520 WeakPolarHBondContact CG-OD1 3.22Å; Q259-D520 PolarHBondContact NE2-OD1 3.15Å; Q259-D520 PolarHBondContact NE2-OD2 3.09Å; Q259-D520 PolarHBondContact OE1-OD1 3.15Å
260	G	92.1	Very high	95.4	Very high	4 Å²	4	23 Å²	23	4%	0.041	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	58.5	50.2	178.7	0	0	0	0	0	113	S262 D291 V293	G260-S262 PolarHBondContact O-N 2.79Å; G260-D291 CarbonylContact C-O 3.57Å; G260-D291 WeakPolarHBondContact CA-O 3.45Å; G260-D291 PolarHBondContact N-O 3.01Å; G260-D291 VanDerWaalsContact N-O 3.15Å; G260-D291 PolarHBondContact N-OD2 3.25Å; G260-V293 VanDerWaalsContact C-CG2 3.46Å
261	C	95.5	Very high	95.7	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	105.7	-175.2	-163.9	0	0	0	0	111.8	L258 K265 D291 L292 V293	L258-C261 HydrophobicContact CB-CB 3.7Å; C261-K265 HydrophobicContact CB-CD 4.48Å; C261-D291 PolarHBondContact N-O 2.78Å; C261-L292 HydrophobicContact CB-CD2 3.85Å; C261-V293 PolarHBondContact O-N 3.13Å
262	S	96.3	Very high	95.9	Very high	17 Å²	17	23.7 Å²	23.7	12%	0.119	12%	0.117	C	C	.	.			trans	-92.9	170.6	170.6	62.3	0	0	0	0	111.4	G260 E264 K265 A266	G260-S262 PolarHBondContact O-N 2.79Å; S262-E264 PolarHBondContact O-N 3.22Å; S262-K265 PolarHBondContact O-N 3.26Å; S262-K265 PolarHBondContact OG-N 3.1Å; S262-A266 WeakPolarHBondContact O-CB 3.3Å; S262-A266 PolarHBondContact O-N 2.94Å
263	C	96.4	Very high	95.9	Very high	23 Å²	23	23 Å²	23	16%	0.155	11%	0.114	C	C	.	.	H	α-helix	trans	-58.5	-35.9	171	-69.8	0	0	0	0	112	A266 N267 E294	C263-A266 PolarHBondContact O-N 3.18Å; C263-N267 WeakPolarHBondContact O-CB 3.29Å; C263-N267 PolarHBondContact O-N 3.14Å; C263-N267 PolarHBondContact O-ND2 3.19Å; C263-N267 VanDerWaalsContact O-ND2 3.13Å; C263-E294 WeakPolarHBondContact CB-OE2 3.49Å; C263-E294 PolarHBondContact N-OE2 3.1Å; C263-E294 PolarHBondContact SG-OE2 3.07Å
264	E	95.4	Very high	95.9	Very high	163 Å²	163	22.9 Å²	22.9	76%	0.762	11%	0.114	S	C	*	.	H	α-helix	trans	-60.9	-48.3	174.9	-173.9	-175.8	-178.4	0	0	111.1	S262 A266 N267 N268	S262-E264 PolarHBondContact O-N 3.22Å; E264-A266 PolarHBondContact O-N 3.1Å; E264-N267 PolarHBondContact O-N 2.65Å; E264-N268 PolarHBondContact O-N 2.85Å; E264-N268 VanDerWaalsContact O-N 3.16Å
265	K	95.6	Very high	95.8	Very high	46 Å²	46	22.9 Å²	22.9	20%	0.2	11%	0.114	C	C	.	.	H	α-helix	trans	-61.8	-44.3	176.9	-171	178.1	-175.7	-178.9	0	111.4	L258 Q259 C261 S262 N267 N268 V271 A518	L258-K265 PolarHBondContact O-NZ 3.27Å; Q259-K265 PolarHBondContact O-NZ 2.66Å; C261-K265 HydrophobicContact CB-CD 4.48Å; S262-K265 PolarHBondContact O-N 3.26Å; S262-K265 PolarHBondContact OG-N 3.1Å; K265-N267 VanDerWaalsContact C-N 3.29Å; K265-N267 PolarHBondContact O-N 2.98Å; K265-N268 WeakPolarHBondContact O-CB 3.48Å; K265-N268 PolarHBondContact O-N 2.85Å; K265-V271 HydrophobicContact CG-CG1 4.3Å; K265-V271 HydrophobicContact CG-CG2 4.25Å; K265-V271 WeakPolarHBondContact O-CB 3.33Å; K265-A518 WeakPolarHBondContact CE-O 3.31Å; K265-A518 PolarHBondContact NZ-O 3.25Å
266	A	97.1	Very high	95.8	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-72.4	-20.2	179	0	0	0	0	0	113.8	S262 C263 E264 R272 A297 K300 F301	S262-A266 WeakPolarHBondContact O-CB 3.3Å; S262-A266 PolarHBondContact O-N 2.94Å; C263-A266 PolarHBondContact O-N 3.18Å; E264-A266 PolarHBondContact O-N 3.1Å; A266-R272 PolarHBondContact O-NE 3.22Å; A266-R272 VanDerWaalsContact O-NE 3.11Å; A266-A297 HydrophobicContact CB-CB 4.05Å; A266-A297 WeakPolarHBondContact CB-O 3.49Å; A266-K300 HydrophobicContact CB-CB 3.93Å; A266-K300 HydrophobicContact CB-CG 4.03Å; A266-F301 HydrophobicContact CB-CE1 4.14Å; A266-F301 HydrophobicContact CB-CE2 3.9Å; A266-F301 HydrophobicContact CB-CZ 3.59Å
267	N	95.5	Very high	95.7	Very high	71 Å²	71	23.2 Å²	23.2	38%	0.38	12%	0.116	S	C	.	.	H	α-helix	trans	-81.8	-19.8	172.9	-78.2	-28.4	0	0	0	113.4	C263 E264 K265 P269 R272 K300	C263-N267 WeakPolarHBondContact O-CB 3.29Å; C263-N267 PolarHBondContact O-N 3.14Å; C263-N267 PolarHBondContact O-ND2 3.19Å; C263-N267 VanDerWaalsContact O-ND2 3.13Å; E264-N267 PolarHBondContact O-N 2.65Å; K265-N267 VanDerWaalsContact C-N 3.29Å; K265-N267 PolarHBondContact O-N 2.98Å; N267-P269 WeakPolarHBondContact O-CD 3.33Å; N267-R272 PolarHBondContact OD1-NH2 2.97Å; N267-R272 VanDerWaalsContact OD1-NH2 3.07Å; N267-K300 WeakPolarHBondContact OD1-CD 3.09Å; N267-K300 WeakPolarHBondContact OD1-CE 3.28Å
268	N	95.3	Very high	95.7	Very high	19 Å²	19	23.2 Å²	23.2	10%	0.102	12%	0.116	C	C	.	.	S	Bend	trans	-59.1	122.4	171.6	-179.6	-70.6	0	0	0	109.6	E264 K265 G270 V271 R272 W507	E264-N268 PolarHBondContact O-N 2.85Å; E264-N268 VanDerWaalsContact O-N 3.16Å; K265-N268 WeakPolarHBondContact O-CB 3.48Å; K265-N268 PolarHBondContact O-N 2.85Å; N268-G270 VanDerWaalsContact C-N 3.27Å; N268-G270 PolarHBondContact O-N 3.12Å; N268-G270 WeakPolarHBondContact OD1-CA 3.35Å; N268-G270 PolarHBondContact OD1-N 3.4Å; N268-V271 HydrophobicContact CB-CB 4.17Å; N268-V271 HydrophobicContact CB-CG2 3.92Å; N268-V271 PolarHBondContact O-N 2.89Å; N268-V271 PolarHBondContact OD1-N 2.88Å; N268-R272 WeakPolarHBondContact O-CB 3.4Å; N268-R272 PolarHBondContact O-N 2.86Å; N268-W507 PolarHBondContact ND2-O 3.37Å; N268-W507 PolarHBondContact OD1-O 2.91Å
269	P	94.2	Very high	95.8	Very high	7 Å²	7	23.1 Å²	23.1	5%	0.045	12%	0.115	C	C	.	.	H	α-helix	trans	-66.3	-30.2	-174.3	24.3	-33	0	0	0	112.7	L221 L223 I231 N267 E273 L310	L221-P269 HydrophobicContact CD1-CB 4.48Å; L223-P269 HydrophobicContact CD2-CG 3.74Å; I231-P269 HydrophobicContact CD1-CB 3.69Å; I231-P269 HydrophobicContact CD1-CG 3.78Å; N267-P269 WeakPolarHBondContact O-CD 3.33Å; P269-E273 VanDerWaalsContact O-CB 3.25Å; P269-E273 WeakPolarHBondContact O-CB 3.39Å; P269-E273 PolarHBondContact O-N 2.84Å; P269-L310 HydrophobicContact CB-CD2 3.82Å
270	G	94.6	Very high	95.9	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-66.6	-45.4	174.4	0	0	0	0	0	112.2	N268 V274 N505	N268-G270 VanDerWaalsContact C-N 3.27Å; N268-G270 PolarHBondContact O-N 3.12Å; N268-G270 WeakPolarHBondContact OD1-CA 3.35Å; N268-G270 PolarHBondContact OD1-N 3.4Å; G270-V274 WeakPolarHBondContact O-CB 3.43Å; G270-V274 VanDerWaalsContact O-CG2 3.25Å; G270-V274 WeakPolarHBondContact O-CG2 3.28Å; G270-V274 PolarHBondContact O-N 3.22Å; G270-N505 VanDerWaalsContact CA-CG 3.49Å; G270-N505 WeakPolarHBondContact CA-OD1 3.49Å
271	V	96.9	Very high	96	Very high	5 Å²	5	20.1 Å²	20.1	3%	0.03	10%	0.1	C	C	.	.	H	α-helix	trans	-62.7	-46.2	175.1	177.3	0	0	0	0	110.4	K265 N268 V274 V275 F301 I508 A518	K265-V271 HydrophobicContact CG-CG1 4.3Å; K265-V271 HydrophobicContact CG-CG2 4.25Å; K265-V271 WeakPolarHBondContact O-CB 3.33Å; N268-V271 HydrophobicContact CB-CB 4.17Å; N268-V271 HydrophobicContact CB-CG2 3.92Å; N268-V271 PolarHBondContact O-N 2.89Å; N268-V271 PolarHBondContact OD1-N 2.88Å; V271-V274 PolarHBondContact O-N 2.78Å; V271-V275 HydrophobicContact CG1-CG2 4.4Å; V271-V275 WeakPolarHBondContact O-CG2 3.36Å; V271-V275 PolarHBondContact O-N 3.3Å; V271-F301 HydrophobicContact CG1-CE1 4.19Å; V271-F301 HydrophobicContact CG1-CZ 4.21Å; V271-I508 HydrophobicContact CG2-CD1 4.09Å; V271-I508 HydrophobicContact CG2-CG1 3.89Å; V271-I508 HydrophobicContact CG2-CG2 4.41Å; V271-A518 HydrophobicContact CG1-CB 4.3Å
272	R	96.6	Very high	95.9	Very high	34 Å²	34	21.1 Å²	21.1	13%	0.128	11%	0.106	C	C	.	.	H	α-helix	trans	-63.8	-42.8	-179	-159.8	-171.8	-56.1	169.6	-9.3	112.3	A266 N267 N268 C276 F301 E304 L310	A266-R272 PolarHBondContact O-NE 3.22Å; A266-R272 VanDerWaalsContact O-NE 3.11Å; N267-R272 PolarHBondContact OD1-NH2 2.97Å; N267-R272 VanDerWaalsContact OD1-NH2 3.07Å; N268-R272 WeakPolarHBondContact O-CB 3.4Å; N268-R272 PolarHBondContact O-N 2.86Å; R272-C276 WeakPolarHBondContact O-CB 3.27Å; R272-C276 PolarHBondContact O-N 3.39Å; R272-C276 PolarHBondContact O-SG 3.07Å; R272-F301 HydrophobicContact CB-CD1 4.41Å; R272-F301 HydrophobicContact CB-CE1 4.35Å; R272-F301 HydrophobicContact CG-CD1 3.86Å; R272-F301 HydrophobicContact CG-CE1 4.26Å; R272-E304 HydrophobicContact CG-CB 3.96Å; R272-E304 HydrophobicContact CG-CG 3.96Å; R272-E304 IonicContact NH1-OE2 3.89Å; R272-L310 HydrophobicContact CB-CD1 4.02Å; R272-L310 HydrophobicContact CG-CD1 4.2Å
273	E	95.8	Very high	95.8	Very high	3 Å²	3	21.7 Å²	21.7	1%	0.014	11%	0.106	C	C	.	.	H	α-helix	trans	-57.6	-50.8	171.6	-177.1	178.4	104.1	0	0	110.5	S233 P269 V275 C276 M277 L310 S312 N505	S233-E273 VanDerWaalsContact CB-OE1 3.22Å; S233-E273 WeakPolarHBondContact CB-OE1 3.46Å; S233-E273 PolarHBondContact OG-OE1 2.87Å; P269-E273 VanDerWaalsContact O-CB 3.25Å; P269-E273 WeakPolarHBondContact O-CB 3.39Å; P269-E273 PolarHBondContact O-N 2.84Å; E273-V275 PolarHBondContact O-N 2.95Å; E273-C276 PolarHBondContact O-N 2.93Å; E273-M277 HydrophobicContact CG-CG 3.89Å; E273-M277 WeakPolarHBondContact O-CB 3.36Å; E273-M277 VanDerWaalsContact O-CG 3.31Å; E273-M277 WeakPolarHBondContact O-CG 3.21Å; E273-M277 PolarHBondContact O-N 2.96Å; E273-L310 HydrophobicContact CB-CD1 3.95Å; E273-S312 VanDerWaalsContact CD-OG 3.27Å; E273-S312 WeakPolarHBondContact OE2-CB 3.39Å; E273-S312 PolarHBondContact OE2-OG 2.74Å; E273-N505 PolarHBondContact OE1-ND2 3.02Å
274	V	96.9	Very high	95.8	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-59	-47.9	-177.1	165.3	0	0	0	0	111.3	R235 W256 G270 V271 T278 N505 I508 A518	R235-V274 VanDerWaalsContact NH2-CA 3.27Å; R235-V274 PolarHBondContact NH2-O 3.45Å; W256-V274 HydrophobicContact CH2-CG1 4.05Å; G270-V274 WeakPolarHBondContact O-CB 3.43Å; G270-V274 VanDerWaalsContact O-CG2 3.25Å; G270-V274 WeakPolarHBondContact O-CG2 3.28Å; G270-V274 PolarHBondContact O-N 3.22Å; V271-V274 PolarHBondContact O-N 2.78Å; V274-T278 WeakPolarHBondContact O-CB 3.47Å; V274-T278 PolarHBondContact O-N 2.73Å; V274-T278 PolarHBondContact O-OG1 3Å; V274-N505 HydrophobicContact CG2-CB 3.71Å; V274-I508 HydrophobicContact CG2-CD1 3.92Å; V274-A518 HydrophobicContact CB-CB 3.97Å; V274-A518 HydrophobicContact CG1-CB 3.45Å; V274-A518 VanDerWaalsContact CG1-CB 3.45Å
275	V	97.9	Very high	95.9	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-64.4	-52.2	-179.8	175	0	0	0	0	110.7	W256 L258 V271 E273 T278 L279 F301	W256-V275 HydrophobicContact CH2-CG2 4.18Å; W256-V275 HydrophobicContact CZ3-CB 4.31Å; W256-V275 HydrophobicContact CZ3-CG1 4.34Å; W256-V275 HydrophobicContact CZ3-CG2 4.04Å; L258-V275 HydrophobicContact CD2-CG2 4.05Å; V271-V275 HydrophobicContact CG1-CG2 4.4Å; V271-V275 WeakPolarHBondContact O-CG2 3.36Å; V271-V275 PolarHBondContact O-N 3.3Å; E273-V275 PolarHBondContact O-N 2.95Å; V275-T278 PolarHBondContact O-N 3.16Å; V275-L279 HydrophobicContact CG1-CD1 4.48Å; V275-L279 VanDerWaalsContact O-CD1 3.24Å; V275-L279 WeakPolarHBondContact O-CD1 3.39Å; V275-L279 PolarHBondContact O-N 2.62Å; V275-F301 HydrophobicContact CB-CD1 3.75Å; V275-F301 HydrophobicContact CB-CE1 3.82Å; V275-F301 HydrophobicContact CB-CG 4.35Å; V275-F301 HydrophobicContact CB-CZ 4.45Å; V275-F301 HydrophobicContact CG1-CB 4.29Å; V275-F301 HydrophobicContact CG1-CD1 3.79Å; V275-F301 HydrophobicContact CG1-CD2 4.29Å; V275-F301 HydrophobicContact CG1-CE1 4.18Å; V275-F301 HydrophobicContact CG1-CG 3.87Å; V275-F301 HydrophobicContact CG2-CD1 4.24Å; V275-F301 HydrophobicContact CG2-CE1 3.79Å; V275-F301 HydrophobicContact CG2-CZ 4.04Å
276	C	97.6	Very high	96	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-66.7	-44.4	-174.2	-60	0	0	0	0	112.2	R272 E273 T278 L279 L280 E304 L305 V313	R272-C276 WeakPolarHBondContact O-CB 3.27Å; R272-C276 PolarHBondContact O-N 3.39Å; R272-C276 PolarHBondContact O-SG 3.07Å; E273-C276 PolarHBondContact O-N 2.93Å; C276-T278 PolarHBondContact O-N 3.29Å; C276-L279 WeakPolarHBondContact O-CB 3.42Å; C276-L279 PolarHBondContact O-N 3.19Å; C276-L280 WeakPolarHBondContact O-CG 3.05Å; C276-L280 PolarHBondContact O-N 2.8Å; C276-L280 VanDerWaalsContact O-N 3.12Å; C276-E304 HydrophobicContact CB-CG 4.28Å; C276-L305 HydrophobicContact CB-CD2 3.78Å; C276-L305 HydrophobicContact CB-CG 4.05Å; C276-V313 HydrophobicContact CB-CG2 4.16Å
277	M	96.1	Very high	96.1	Very high	11 Å²	11	12.3 Å²	12.3	5%	0.054	6%	0.06	C	C	.	.	H	α-helix	trans	-68.2	-35.3	179.3	-68.5	-58.5	-57.7	0	0	111.8	E273 L279 L280 E281 V313 W316	E273-M277 HydrophobicContact CG-CG 3.89Å; E273-M277 WeakPolarHBondContact O-CB 3.36Å; E273-M277 VanDerWaalsContact O-CG 3.31Å; E273-M277 WeakPolarHBondContact O-CG 3.21Å; E273-M277 PolarHBondContact O-N 2.96Å; M277-L279 VanDerWaalsContact C-N 3.26Å; M277-L279 PolarHBondContact O-N 3.23Å; M277-L280 PolarHBondContact O-N 2.64Å; M277-L280 HydrophobicContact SD-CD1 4.24Å; M277-E281 HydrophobicContact CE-CG 4.3Å; M277-E281 VanDerWaalsContact O-CB 3.26Å; M277-E281 WeakPolarHBondContact O-CB 3.23Å; M277-E281 WeakPolarHBondContact O-CG 3.29Å; M277-E281 PolarHBondContact O-N 2.96Å; M277-V313 HydrophobicContact CG-CG2 4.35Å; M277-V313 HydrophobicContact SD-CG2 3.91Å; M277-W316 HydrophobicContact CE-CE3 3.83Å; M277-W316 HydrophobicContact CE-CZ3 4.29Å
278	T	96.8	Very high	96.2	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-59.6	-39.9	173.6	-71.9	0	0	0	0	111.6	R235 W256 V274 V275 C276 N282 V499 P523	R235-T278 VanDerWaalsContact NH1-N 3.11Å; R235-T278 PolarHBondContact NH2-OG1 3.44Å; W256-T278 HydrophobicContact CH2-CG2 4.35Å; W256-T278 HydrophobicContact CZ3-CG2 3.97Å; V274-T278 WeakPolarHBondContact O-CB 3.47Å; V274-T278 PolarHBondContact O-N 2.73Å; V274-T278 PolarHBondContact O-OG1 3Å; V275-T278 PolarHBondContact O-N 3.16Å; C276-T278 PolarHBondContact O-N 3.29Å; T278-N282 WeakPolarHBondContact O-CB 3.22Å; T278-N282 PolarHBondContact O-N 2.81Å; T278-N282 PolarHBondContact O-ND2 3.47Å; T278-V499 HydrophobicContact CG2-CG1 4.18Å; T278-P523 HydrophobicContact CG2-CG 3.81Å
279	L	96.9	Very high	96.4	Very high	0 Å²	0	8 Å²	8	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-64.6	-46.7	177.8	-92.9	58.2	0	0	0	111.4	V275 C276 M277 E283 I284 L287 L305 W323 L345	V275-L279 HydrophobicContact CG1-CD1 4.48Å; V275-L279 VanDerWaalsContact O-CD1 3.24Å; V275-L279 WeakPolarHBondContact O-CD1 3.39Å; V275-L279 PolarHBondContact O-N 2.62Å; C276-L279 WeakPolarHBondContact O-CB 3.42Å; C276-L279 PolarHBondContact O-N 3.19Å; M277-L279 VanDerWaalsContact C-N 3.26Å; M277-L279 PolarHBondContact O-N 3.23Å; L279-E283 PolarHBondContact O-N 3.47Å; L279-I284 HydrophobicContact CD1-CD1 4.41Å; L279-I284 HydrophobicContact CG-CB 4.32Å; L279-I284 HydrophobicContact CG-CG2 4.41Å; L279-I284 PolarHBondContact O-N 3.14Å; L279-L287 HydrophobicContact CD1-CD2 3.79Å; L279-L287 HydrophobicContact CD2-CD2 4.09Å; L279-L287 HydrophobicContact CG-CD2 4.4Å; L279-L305 HydrophobicContact CB-CD2 4.49Å; L279-L305 HydrophobicContact CD2-CD1 3.78Å; L279-W323 HydrophobicContact CB-CH2 4.09Å; L279-W323 HydrophobicContact CB-CZ2 4.31Å; L279-W323 HydrophobicContact CD2-CE3 4.37Å; L279-W323 HydrophobicContact CD2-CH2 3.51Å; L279-W323 HydrophobicContact CD2-CZ2 4.26Å; L279-W323 HydrophobicContact CD2-CZ3 3.6Å; L279-W323 HydrophobicContact CG-CH2 3.96Å; L279-W323 HydrophobicContact CG-CZ3 4.46Å; L279-L345 HydrophobicContact CD2-CD1 4.46Å
280	L	95.1	Very high	96.5	Very high	7 Å²	7	7.7 Å²	7.7	4%	0.037	4%	0.036	C	C	.	.	H	α-helix	trans	-68	-49.8	-179.1	-65.1	176	0	0	0	112.3	C276 M277 N282 E283 L305 V313 W316 R320	C276-L280 WeakPolarHBondContact O-CG 3.05Å; C276-L280 PolarHBondContact O-N 2.8Å; C276-L280 VanDerWaalsContact O-N 3.12Å; M277-L280 PolarHBondContact O-N 2.64Å; M277-L280 HydrophobicContact SD-CD1 4.24Å; L280-N282 VanDerWaalsContact C-N 3.28Å; L280-N282 PolarHBondContact O-N 2.75Å; L280-E283 PolarHBondContact O-N 3.38Å; L280-L305 HydrophobicContact CD1-CD2 4.29Å; L280-L305 HydrophobicContact CD2-CD2 4.11Å; L280-L305 HydrophobicContact CG-CD2 3.97Å; L280-V313 HydrophobicContact CD1-CG1 4.31Å; L280-W316 HydrophobicContact CB-CD2 4.19Å; L280-W316 HydrophobicContact CB-CH2 4.49Å; L280-W316 HydrophobicContact CB-CZ2 3.93Å; L280-W316 HydrophobicContact CD1-CB 4.45Å; L280-W316 HydrophobicContact CD1-CD2 4.37Å; L280-W316 HydrophobicContact CD1-CG 4.01Å; L280-W316 WeakPolarHBondContact O-CZ2 3.29Å; L280-R320 HydrophobicContact CD1-CG 4.28Å; L280-R320 HydrophobicContact CD2-CB 4.19Å; L280-R320 HydrophobicContact CD2-CG 4.25Å
281	E	94	Very high	96.4	Very high	16 Å²	16	8.4 Å²	8.4	8%	0.075	4%	0.039	C	C	.	.	H	α-helix	trans	-62.9	-33.2	-178.3	-71.1	164.2	-167.7	0	0	112.9	R235 P241 M277 W316	R235-E281 WeakPolarHBondContact CD-OE1 3.18Å; R235-E281 IonicContact CZ-OE1 3.38Å; R235-E281 IonicContact CZ-OE2 2.91Å; R235-E281 IonicContact NH1-OE1 3.55Å; R235-E281 PolarHBondContact NH1-OE1 3.13Å; R235-E281 IonicContact NH1-OE2 3.86Å; R235-E281 PolarHBondContact NH1-OE2 3.23Å; P241-E281 WeakPolarHBondContact CD-O 3.41Å; M277-E281 HydrophobicContact CE-CG 4.3Å; M277-E281 VanDerWaalsContact O-CB 3.26Å; M277-E281 WeakPolarHBondContact O-CB 3.23Å; M277-E281 WeakPolarHBondContact O-CG 3.29Å; M277-E281 PolarHBondContact O-N 2.96Å; E281-W316 HydrophobicContact CG-CH2 4.29Å; E281-W316 HydrophobicContact CG-CZ3 4.09Å
282	N	93.8	Very high	96.3	Very high	22 Å²	22	8.2 Å²	8.2	12%	0.118	4%	0.038	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	7	-178.8	-65	-87.6	0	0	0	113	R252 T278 L280 I284	R252-N282 WeakPolarHBondContact CD-O 3.25Å; R252-N282 PolarHBondContact NH1-O 3.06Å; T278-N282 WeakPolarHBondContact O-CB 3.22Å; T278-N282 PolarHBondContact O-N 2.81Å; T278-N282 PolarHBondContact O-ND2 3.47Å; L280-N282 VanDerWaalsContact C-N 3.28Å; L280-N282 PolarHBondContact O-N 2.75Å; N282-I284 HydrophobicContact CB-CD1 4.03Å; N282-I284 HydrophobicContact CB-CG1 3.95Å; N282-I284 PolarHBondContact O-N 2.92Å; N282-I284 VanDerWaalsContact O-N 3.13Å
283	E	93.7	Very high	96.2	Very high	29 Å²	29	8.3 Å²	8.3	14%	0.136	4%	0.042	C	C	.	.	T	Hydrogen-bonded Turn	trans	50	37.7	-179.9	-73.9	-82.7	170.4	0	0	113	P240 P241 R252 L279 L280 K285	P240-E283 HydrophobicContact CB-CG 3.44Å; P240-E283 VanDerWaalsContact CB-CG 3.44Å; P240-E283 VanDerWaalsContact CB-OE1 3.27Å; P240-E283 WeakPolarHBondContact CB-OE1 3.3Å; P241-E283 WeakPolarHBondContact O-CG 3.31Å; R252-E283 WeakPolarHBondContact CB-O 3.38Å; L279-E283 PolarHBondContact O-N 3.47Å; L280-E283 PolarHBondContact O-N 3.38Å; E283-K285 PolarHBondContact O-N 3.32Å; E283-K285 WeakPolarHBondContact OE2-CE 3.33Å; E283-K285 IonicContact OE2-NZ 3.23Å; E283-K285 PolarHBondContact OE2-NZ 3.42Å
284	I	96.6	Very high	96.1	Very high	1 Å²	1	12 Å²	12	1%	0.005	6%	0.059	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	127.3	175.8	-63.5	169.3	0	0	0	106.9	A254 L279 N282 I286 L287 W323 V525	A254-I284 HydrophobicContact CB-CD1 3.77Å; A254-I284 HydrophobicContact CB-CG1 4.07Å; A254-I284 HydrophobicContact CB-CG2 3.63Å; L279-I284 HydrophobicContact CD1-CD1 4.41Å; L279-I284 HydrophobicContact CG-CB 4.32Å; L279-I284 HydrophobicContact CG-CG2 4.41Å; L279-I284 PolarHBondContact O-N 3.14Å; N282-I284 HydrophobicContact CB-CD1 4.03Å; N282-I284 HydrophobicContact CB-CG1 3.95Å; N282-I284 PolarHBondContact O-N 2.92Å; N282-I284 VanDerWaalsContact O-N 3.13Å; I284-I286 WeakPolarHBondContact CG2-O 3.45Å; I284-L287 HydrophobicContact CG2-CB 4.22Å; I284-W323 WeakPolarHBondContact O-CH2 3.25Å; I284-W323 WeakPolarHBondContact O-CZ2 3.43Å; I284-V525 HydrophobicContact CD1-CG2 3.79Å; I284-V525 HydrophobicContact CG1-CG1 4.24Å; I284-V525 HydrophobicContact CG1-CG2 4.13Å
285	K	96.6	Very high	96	Very high	32 Å²	32	17.2 Å²	17.2	14%	0.139	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	-21.6	-179.9	-57.9	-55.9	-177.1	-174.1	0	113.2	V251 R252 E283 W346 D347 S350 I352	V251-K285 HydrophobicContact CG2-CB 3.82Å; V251-K285 HydrophobicContact CG2-CG 4.18Å; R252-K285 PolarHBondContact O-N 3.17Å; E283-K285 PolarHBondContact O-N 3.32Å; E283-K285 WeakPolarHBondContact OE2-CE 3.33Å; E283-K285 IonicContact OE2-NZ 3.23Å; E283-K285 PolarHBondContact OE2-NZ 3.42Å; K285-W346 CarbonylContact O-C 3.55Å; K285-W346 WeakPolarHBondContact O-CA 3.43Å; K285-D347 HydrophobicContact CD-CB 4.21Å; K285-D347 IonicContact NZ-OD2 3.93Å; K285-D347 PolarHBondContact O-N 2.76Å; K285-S350 WeakPolarHBondContact CD-OG 3.23Å; K285-I352 HydrophobicContact CB-CD1 3.59Å
286	I	98.4	Very high	96	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.005	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	126.4	172.7	-52	177.2	0	0	0	107.4	R252 L253 A254 I284 L345 W346 I352 F381 V383	R252-I286 PolarHBondContact O-N 3.25Å; L253-I286 CarbonylContact C-O 3.5Å; L253-I286 WeakPolarHBondContact CA-O 3.37Å; L253-I286 HydrophobicContact CD1-CB 3.58Å; L253-I286 HydrophobicContact CD1-CD1 4.41Å; L253-I286 HydrophobicContact CD1-CG2 3.45Å; L253-I286 VanDerWaalsContact CD1-CG2 3.45Å; A254-I286 PolarHBondContact N-O 3.18Å; I284-I286 WeakPolarHBondContact CG2-O 3.45Å; I286-L345 CarbonylContact C-O 3.55Å; I286-L345 WeakPolarHBondContact CA-O 3.46Å; I286-W346 HydrophobicContact CG1-CB 4.26Å; I286-I352 HydrophobicContact CD1-CD1 4.1Å; I286-I352 HydrophobicContact CD1-CG2 3.84Å; I286-I352 HydrophobicContact CG1-CD1 3.78Å; I286-I352 HydrophobicContact CG1-CG2 4.04Å; I286-F381 HydrophobicContact CD1-CB 4.49Å; I286-F381 HydrophobicContact CD1-CD1 4.36Å; I286-F381 HydrophobicContact CD1-CG 4.28Å; I286-F381 HydrophobicContact CG2-CE1 4.44Å; I286-F381 HydrophobicContact CG2-CE2 4.2Å; I286-F381 HydrophobicContact CG2-CZ 4.07Å; I286-V383 HydrophobicContact CD1-CG2 3.96Å
287	L	98.7	Very high	95.9	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	122.5	175	177	73.3	0	0	0	109.3	A254 W256 L279 I284 V289 F344 L345	A254-L287 HydrophobicContact CB-CD1 3.74Å; A254-L287 WeakPolarHBondContact O-CA 3.35Å; W256-L287 HydrophobicContact CB-CD1 3.95Å; L279-L287 HydrophobicContact CD1-CD2 3.79Å; L279-L287 HydrophobicContact CD2-CD2 4.09Å; L279-L287 HydrophobicContact CG-CD2 4.4Å; I284-L287 HydrophobicContact CG2-CB 4.22Å; L287-V289 HydrophobicContact CD2-CG2 3.47Å; L287-V289 VanDerWaalsContact CD2-CG2 3.47Å; L287-V289 HydrophobicContact CG-CG2 3.72Å; L287-F344 CarbonylContact O-C 3.58Å; L287-F344 VanDerWaalsContact O-CA 3.3Å; L287-F344 WeakPolarHBondContact O-CA 3.38Å; L287-L345 HydrophobicContact CB-CB 4.27Å; L287-L345 HydrophobicContact CD2-CD1 4.15Å; L287-L345 PolarHBondContact N-O 3.1Å; L287-L345 PolarHBondContact O-N 2.89Å
288	A	98.6	Very high	96	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	128.7	164.2	0	0	0	0	0	110	A254 T255 W256 F344 L436	A254-A288 PolarHBondContact O-N 2.86Å; T255-A288 CarbonylContact C-O 3.56Å; T255-A288 VanDerWaalsContact CA-O 3.3Å; T255-A288 WeakPolarHBondContact CA-O 3.38Å; W256-A288 PolarHBondContact N-O 3.15Å; A288-F344 HydrophobicContact CB-CD1 3.76Å; A288-F344 HydrophobicContact CB-CE1 3.57Å; A288-L436 HydrophobicContact CB-CD1 3.22Å; A288-L436 HydrophobicContact CB-CD2 4.25Å; A288-L436 HydrophobicContact CB-CG 4.38Å
289	V	98.2	Very high	96.1	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.006	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	132.6	-176.7	-179.9	0	0	0	0	109.8	W256 L258 L287 L292 L298 S342 G343	W256-V289 WeakPolarHBondContact O-CA 3.36Å; L258-V289 HydrophobicContact CB-CG1 4.36Å; L258-V289 HydrophobicContact CD1-CG1 3.62Å; L258-V289 HydrophobicContact CG-CG1 3.81Å; L287-V289 HydrophobicContact CD2-CG2 3.47Å; L287-V289 VanDerWaalsContact CD2-CG2 3.47Å; L287-V289 HydrophobicContact CG-CG2 3.72Å; V289-L292 HydrophobicContact CG1-CD1 4.33Å; V289-L292 HydrophobicContact CG1-CD2 3.71Å; V289-L292 HydrophobicContact CG1-CG 4Å; V289-L298 HydrophobicContact CB-CD1 4.1Å; V289-L298 HydrophobicContact CG1-CD1 4.25Å; V289-L298 HydrophobicContact CG2-CD1 3.79Å; V289-S342 CarbonylContact O-C 3.52Å; V289-S342 VanDerWaalsContact O-CA 3.27Å; V289-S342 WeakPolarHBondContact O-CA 3.33Å; V289-G343 PolarHBondContact N-O 3.45Å; V289-G343 PolarHBondContact O-N 3.25Å
290	Q	95.9	Very high	96.1	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	164.1	174.5	-60.1	82.5	41.1	0	0	111.5	T255 W256 L258 S392 H394	T255-Q290 PolarHBondContact OG1-NE2 3.06Å; T255-Q290 PolarHBondContact OG1-OE1 3.47Å; W256-Q290 PolarHBondContact O-N 2.78Å; L258-Q290 PolarHBondContact N-O 3.5Å; Q290-S392 PolarHBondContact NE2-OG 3.19Å; Q290-H394 HydrophobicContact CB-CB 4.15Å; Q290-H394 HydrophobicContact CG-CB 4.14Å
291	D	93.7	Very high	96.3	Very high	15 Å²	15	27.4 Å²	27.4	8%	0.08	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	61.3	46.1	175.7	-156.8	13.1	0	0	0	114.4	Q259 G260 C261 S335 Y341 H394	Q259-D291 VanDerWaalsContact CA-OD2 3.27Å; Q259-D291 WeakPolarHBondContact CA-OD2 3.24Å; G260-D291 CarbonylContact C-O 3.57Å; G260-D291 WeakPolarHBondContact CA-O 3.45Å; G260-D291 PolarHBondContact N-O 3.01Å; G260-D291 VanDerWaalsContact N-O 3.15Å; G260-D291 PolarHBondContact N-OD2 3.25Å; C261-D291 PolarHBondContact N-O 2.78Å; D291-S335 WeakPolarHBondContact OD1-CB 3.42Å; D291-S335 PolarHBondContact OD1-OG 3.41Å; D291-Y341 PolarHBondContact N-O 2.87Å; D291-H394 IonicContact OD1-CE1 3.44Å
292	L	95.1	Very high	96.5	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	129	168.5	-60.6	174	0	0	0	109.6	C261 V289 L298 V327 S340 Y341	C261-L292 HydrophobicContact CB-CD2 3.85Å; V289-L292 HydrophobicContact CG1-CD1 4.33Å; V289-L292 HydrophobicContact CG1-CD2 3.71Å; V289-L292 HydrophobicContact CG1-CG 4Å; L292-L298 HydrophobicContact CD1-CB 4.1Å; L292-L298 HydrophobicContact CD1-CD2 4.38Å; L292-V327 HydrophobicContact CD1-CG1 4.01Å; L292-V327 HydrophobicContact CD1-CG2 4.02Å; L292-S340 CarbonylContact O-C 3.57Å; L292-S340 VanDerWaalsContact O-CA 3.28Å; L292-S340 WeakPolarHBondContact O-CA 3.27Å; L292-Y341 WeakPolarHBondContact CB-O 3.16Å; L292-Y341 PolarHBondContact N-O 3.35Å; L292-Y341 PolarHBondContact O-N 2.84Å
293	V	94.2	Very high	96.7	Very high	36 Å²	36	29.1 Å²	29.1	22%	0.218	14%	0.14	C	C	.	.	S	Bend	trans	-84.2	-36.8	175.1	179.1	0	0	0	0	110.5	G260 C261	G260-V293 VanDerWaalsContact C-CG2 3.46Å; C261-V293 PolarHBondContact O-N 3.13Å
294	E	94.4	Very high	96.9	Very high	80 Å²	80	27.8 Å²	27.8	37%	0.374	13%	0.134	S	C	.	.	S	Bend	trans	-126.1	139.3	-179.8	-68.4	170.6	168.4	0	0	109	C263 E296 A297	C263-E294 WeakPolarHBondContact CB-OE2 3.49Å; C263-E294 PolarHBondContact N-OE2 3.1Å; C263-E294 PolarHBondContact SG-OE2 3.07Å; E294-E296 VanDerWaalsContact C-N 3.29Å; E294-E296 PolarHBondContact O-N 2.97Å; E294-A297 VanDerWaalsContact O-CB 3.28Å; E294-A297 WeakPolarHBondContact O-CB 3.33Å; E294-A297 PolarHBondContact O-N 2.8Å
295	R	94.8	Very high	96.9	Very high	111 Å²	111	27.7 Å²	27.7	42%	0.419	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-35.2	-174.5	-59.7	176.9	-60.3	155.4	10.3	111.1	A297 L298 V327 Y341	R295-A297 PolarHBondContact O-N 2.85Å; R295-L298 PolarHBondContact O-N 3.44Å; R295-V327 HydrophobicContact CB-CB 4.11Å; R295-V327 HydrophobicContact CB-CG1 3.89Å; R295-V327 HydrophobicContact CB-CG2 4.49Å; R295-V327 HydrophobicContact CG-CB 4.38Å; R295-V327 HydrophobicContact CG-CG1 3.76Å; R295-V327 WeakPolarHBondContact O-CG2 3.36Å; R295-Y341 HydrophobicContact CG-CD1 4.04Å; R295-Y341 HydrophobicContact CG-CD2 4.31Å; R295-Y341 HydrophobicContact CG-CE1 4.25Å; R295-Y341 HydrophobicContact CG-CG 4.09Å
296	E	96.3	Very high	97	Very high	89 Å²	89	28.9 Å²	28.9	42%	0.416	14%	0.141	S	C	.	.	H	α-helix	trans	-69.4	-12.4	-178.2	-57.8	73.7	-161.5	0	0	112.2	E294 D299	E294-E296 VanDerWaalsContact C-N 3.29Å; E294-E296 PolarHBondContact O-N 2.97Å; E296-D299 PolarHBondContact O-N 3.45Å
297	A	97.1	Very high	96.8	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-64.3	-39.5	176.4	0	0	0	0	0	111.8	A266 E294 R295 D299 K300	A266-A297 HydrophobicContact CB-CB 4.05Å; A266-A297 WeakPolarHBondContact CB-O 3.49Å; E294-A297 VanDerWaalsContact O-CB 3.28Å; E294-A297 WeakPolarHBondContact O-CB 3.33Å; E294-A297 PolarHBondContact O-N 2.8Å; R295-A297 PolarHBondContact O-N 2.85Å; A297-D299 VanDerWaalsContact C-N 3.29Å; A297-D299 PolarHBondContact O-N 2.92Å; A297-K300 WeakPolarHBondContact O-CB 3.26Å; A297-K300 PolarHBondContact O-N 3.21Å
298	L	97.8	Very high	96.6	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-65.9	-35	-179.1	-166.9	65.9	0	0	0	111.8	V289 L292 R295 K300 F301 C302 V327 L345	V289-L298 HydrophobicContact CB-CD1 4.1Å; V289-L298 HydrophobicContact CG1-CD1 4.25Å; V289-L298 HydrophobicContact CG2-CD1 3.79Å; L292-L298 HydrophobicContact CD1-CB 4.1Å; L292-L298 HydrophobicContact CD1-CD2 4.38Å; R295-L298 PolarHBondContact O-N 3.44Å; L298-K300 PolarHBondContact O-N 2.81Å; L298-F301 HydrophobicContact CD1-CD2 4.33Å; L298-F301 PolarHBondContact O-N 2.84Å; L298-C302 PolarHBondContact O-N 3.41Å; L298-V327 HydrophobicContact CB-CG2 3.76Å; L298-V327 HydrophobicContact CD2-CG2 3.58Å; L298-V327 HydrophobicContact CG-CG2 4.32Å; L298-L345 HydrophobicContact CD1-CD1 3.53Å; L298-L345 HydrophobicContact CD1-CD2 4.44Å; L298-L345 HydrophobicContact CD1-CG 3.73Å; L298-L345 HydrophobicContact CD2-CG 4.21Å; L298-L345 HydrophobicContact CG-CD1 4.17Å; L298-L345 HydrophobicContact CG-CD2 4.19Å; L298-L345 HydrophobicContact CG-CG 3.91Å
299	D	97.8	Very high	96.3	Very high	70 Å²	70	38.1 Å²	38.1	37%	0.374	19%	0.189	S	C	.	.	H	α-helix	trans	-63.3	-27.5	178.7	-68.4	-19.7	0	0	0	112.2	E296 A297 F301 C302 V303 S325	E296-D299 PolarHBondContact O-N 3.45Å; A297-D299 VanDerWaalsContact C-N 3.29Å; A297-D299 PolarHBondContact O-N 2.92Å; D299-F301 VanDerWaalsContact C-N 3.33Å; D299-F301 PolarHBondContact O-N 2.96Å; D299-C302 PolarHBondContact O-N 3.29Å; D299-V303 WeakPolarHBondContact O-CB 3.36Å; D299-V303 VanDerWaalsContact O-CG2 3.24Å; D299-V303 WeakPolarHBondContact O-CG2 3.47Å; D299-V303 PolarHBondContact O-N 3.03Å; D299-S325 PolarHBondContact OD1-OG 3.01Å
300	K	98	Very high	96	Very high	73 Å²	73	38.2 Å²	38.2	32%	0.317	19%	0.19	S	C	.	.	H	α-helix	trans	-62.7	-40.4	176	-57	-56.7	-175.1	-179.8	0	112.1	A266 N267 A297 L298 E304	A266-K300 HydrophobicContact CB-CB 3.93Å; A266-K300 HydrophobicContact CB-CG 4.03Å; N267-K300 WeakPolarHBondContact OD1-CD 3.09Å; N267-K300 WeakPolarHBondContact OD1-CE 3.28Å; A297-K300 WeakPolarHBondContact O-CB 3.26Å; A297-K300 PolarHBondContact O-N 3.21Å; L298-K300 PolarHBondContact O-N 2.81Å; K300-E304 WeakPolarHBondContact O-CB 2.9Å; K300-E304 PolarHBondContact O-N 3.15Å
301	F	98.4	Very high	95.8	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-71.8	-41.2	176	-53	-60.7	0	0	0	111	L258 A266 V271 R272 V275 L298 D299 V303 E304 L305 L345	L258-F301 HydrophobicContact CD1-CD2 4.43Å; L258-F301 HydrophobicContact CD1-CE2 3.7Å; L258-F301 HydrophobicContact CD1-CZ 4.2Å; A266-F301 HydrophobicContact CB-CE1 4.14Å; A266-F301 HydrophobicContact CB-CE2 3.9Å; A266-F301 HydrophobicContact CB-CZ 3.59Å; V271-F301 HydrophobicContact CG1-CE1 4.19Å; V271-F301 HydrophobicContact CG1-CZ 4.21Å; R272-F301 HydrophobicContact CB-CD1 4.41Å; R272-F301 HydrophobicContact CB-CE1 4.35Å; R272-F301 HydrophobicContact CG-CD1 3.86Å; R272-F301 HydrophobicContact CG-CE1 4.26Å; V275-F301 HydrophobicContact CB-CD1 3.75Å; V275-F301 HydrophobicContact CB-CE1 3.82Å; V275-F301 HydrophobicContact CB-CG 4.35Å; V275-F301 HydrophobicContact CB-CZ 4.45Å; V275-F301 HydrophobicContact CG1-CB 4.29Å; V275-F301 HydrophobicContact CG1-CD1 3.79Å; V275-F301 HydrophobicContact CG1-CD2 4.29Å; V275-F301 HydrophobicContact CG1-CE1 4.18Å; V275-F301 HydrophobicContact CG1-CG 3.87Å; V275-F301 HydrophobicContact CG2-CD1 4.24Å; V275-F301 HydrophobicContact CG2-CE1 3.79Å; V275-F301 HydrophobicContact CG2-CZ 4.04Å; L298-F301 HydrophobicContact CD1-CD2 4.33Å; L298-F301 PolarHBondContact O-N 2.84Å; D299-F301 VanDerWaalsContact C-N 3.33Å; D299-F301 PolarHBondContact O-N 2.96Å; F301-V303 PolarHBondContact O-N 2.87Å; F301-E304 PolarHBondContact O-N 3.23Å; F301-L305 WeakPolarHBondContact O-CG 3.47Å; F301-L305 PolarHBondContact O-N 3.2Å; F301-L345 HydrophobicContact CB-CD1 4.22Å
302	C	98.3	Very high	95.6	Very high	10 Å²	10	41.5 Å²	41.5	7%	0.068	22%	0.218	C	C	.	.	H	α-helix	trans	-58.5	-47.3	176.2	-169.7	0	0	0	0	112.2	L298 D299 E304 L305 N306 W323 L345	L298-C302 PolarHBondContact O-N 3.41Å; D299-C302 PolarHBondContact O-N 3.29Å; C302-E304 VanDerWaalsContact C-N 3.34Å; C302-E304 PolarHBondContact O-N 3.32Å; C302-L305 PolarHBondContact O-N 2.99Å; C302-N306 PolarHBondContact O-N 3.04Å; C302-N306 PolarHBondContact O-ND2 3.42Å; C302-W323 PolarHBondContact SG-O 2.91Å; C302-W323 VanDerWaalsContact SG-O 3.36Å; C302-L345 HydrophobicContact CB-CD2 3.69Å
303	V	98.1	Very high	95.4	Very high	64 Å²	64	41.5 Å²	41.5	39%	0.388	22%	0.218	S	C	.	.	H	α-helix	trans	-61.7	-43.4	177.4	167.1	0	0	0	0	110.9	D299 F301 N306 Q307	D299-V303 WeakPolarHBondContact O-CB 3.36Å; D299-V303 VanDerWaalsContact O-CG2 3.24Å; D299-V303 WeakPolarHBondContact O-CG2 3.47Å; D299-V303 PolarHBondContact O-N 3.03Å; F301-V303 PolarHBondContact O-N 2.87Å; V303-N306 PolarHBondContact O-N 3.17Å; V303-Q307 HydrophobicContact CG1-CG 4.24Å; V303-Q307 WeakPolarHBondContact O-CB 3.44Å; V303-Q307 WeakPolarHBondContact O-CG 3.19Å; V303-Q307 PolarHBondContact O-N 3.37Å
304	E	97.7	Very high	95.3	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-65.3	-43.1	178.9	178.7	58.4	-147.5	0	0	113.2	R272 C276 K300 F301 C302 N306 G308 T309 L310 V313	R272-E304 HydrophobicContact CG-CB 3.96Å; R272-E304 HydrophobicContact CG-CG 3.96Å; R272-E304 IonicContact NH1-OE2 3.89Å; C276-E304 HydrophobicContact CB-CG 4.28Å; K300-E304 WeakPolarHBondContact O-CB 2.9Å; K300-E304 PolarHBondContact O-N 3.15Å; F301-E304 PolarHBondContact O-N 3.23Å; C302-E304 VanDerWaalsContact C-N 3.34Å; C302-E304 PolarHBondContact O-N 3.32Å; E304-N306 PolarHBondContact O-N 2.92Å; E304-G308 VanDerWaalsContact O-CA 3.24Å; E304-G308 WeakPolarHBondContact O-CA 3.28Å; E304-G308 PolarHBondContact O-N 2.88Å; E304-T309 PolarHBondContact OE1-N 2.99Å; E304-T309 WeakPolarHBondContact OE2-CB 3.33Å; E304-T309 PolarHBondContact OE2-N 2.95Å; E304-T309 VanDerWaalsContact OE2-N 3.16Å; E304-T309 PolarHBondContact OE2-OG1 2.66Å; E304-L310 HydrophobicContact CG-CD1 3.93Å; E304-L310 HydrophobicContact CG-CG 4.38Å; E304-L310 VanDerWaalsContact OE1-CB 3.3Å; E304-L310 WeakPolarHBondContact OE1-CB 3.42Å; E304-L310 WeakPolarHBondContact OE1-CG 3.42Å; E304-L310 PolarHBondContact OE1-N 3.29Å; E304-V313 HydrophobicContact CG-CG2 4.19Å; E304-V313 WeakPolarHBondContact OE1-CB 2.71Å; E304-V313 WeakPolarHBondContact OE1-CG2 2.96Å
305	L	97.7	Very high	95.1	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-59.4	-37	176.7	-73.9	160.9	0	0	0	112	C276 L279 L280 F301 C302 R320 W323	C276-L305 HydrophobicContact CB-CD2 3.78Å; C276-L305 HydrophobicContact CB-CG 4.05Å; L279-L305 HydrophobicContact CB-CD2 4.49Å; L279-L305 HydrophobicContact CD2-CD1 3.78Å; L280-L305 HydrophobicContact CD1-CD2 4.29Å; L280-L305 HydrophobicContact CD2-CD2 4.11Å; L280-L305 HydrophobicContact CG-CD2 3.97Å; F301-L305 WeakPolarHBondContact O-CG 3.47Å; F301-L305 PolarHBondContact O-N 3.2Å; C302-L305 PolarHBondContact O-N 2.99Å; L305-R320 WeakPolarHBondContact O-CD 3.41Å; L305-R320 PolarHBondContact O-NE 3.37Å; L305-R320 VanDerWaalsContact O-NE 3.14Å; L305-W323 HydrophobicContact CB-CB 4.11Å; L305-W323 HydrophobicContact CB-CD2 4.31Å; L305-W323 HydrophobicContact CB-CG 3.72Å; L305-W323 HydrophobicContact CD1-CB 4.4Å; L305-W323 HydrophobicContact CD1-CD2 3.63Å; L305-W323 HydrophobicContact CD1-CE3 3.87Å; L305-W323 HydrophobicContact CD1-CG 3.87Å; L305-W323 HydrophobicContact CD1-CZ2 4.43Å; L305-W323 HydrophobicContact CD1-CZ3 4.37Å; L305-W323 HydrophobicContact CG-CD2 4.41Å; L305-W323 HydrophobicContact CG-CG 4.33Å
306	N	97.6	Very high	94.9	Very high	56 Å²	56	42.4 Å²	42.4	30%	0.299	23%	0.231	S	C	.	.	H	α-helix	trans	-78.6	-52.4	179.5	-72.9	-50.1	0	0	0	112.5	C302 V303 E304 R320 W323	C302-N306 PolarHBondContact O-N 3.04Å; C302-N306 PolarHBondContact O-ND2 3.42Å; V303-N306 PolarHBondContact O-N 3.17Å; E304-N306 PolarHBondContact O-N 2.92Å; N306-R320 PolarHBondContact O-NH2 3.41Å; N306-R320 VanDerWaalsContact O-NH2 3.15Å; N306-W323 PolarHBondContact ND2-O 2.8Å; N306-W323 PolarHBondContact OD1-N 3.19Å
307	Q	95.6	Very high	94.6	Very high	131 Å²	131	45.6 Å²	45.6	61%	0.612	24%	0.243	S	C	*	.	H	α-helix	trans	-83.8	-32.4	-171.8	-63	-179	4.6	0	0	112.8	V303 T309	V303-Q307 HydrophobicContact CG1-CG 4.24Å; V303-Q307 WeakPolarHBondContact O-CB 3.44Å; V303-Q307 WeakPolarHBondContact O-CG 3.19Å; V303-Q307 PolarHBondContact O-N 3.37Å; Q307-T309 HydrophobicContact CB-CG2 4.26Å
308	G	93	Very high	94.2	Very high	3 Å²	3	50.2 Å²	50.2	3%	0.031	26%	0.261	C	S	.	.			trans	58.8	73.9	-175.1	0	0	0	0	0	111.6	E304 Q314	E304-G308 VanDerWaalsContact O-CA 3.24Å; E304-G308 WeakPolarHBondContact O-CA 3.28Å; E304-G308 PolarHBondContact O-N 2.88Å; G308-Q314 WeakPolarHBondContact O-CG 3.41Å; G308-Q314 PolarHBondContact O-NE2 3.01Å
309	T	93.1	Very high	93.8	Very high	61 Å²	61	55.1 Å²	55.1	37%	0.374	29%	0.293	S	S	.	.			trans	-88.6	-26.2	177.8	72.7	0	0	0	0	112	E304 Q307 Q314	E304-T309 PolarHBondContact OE1-N 2.99Å; E304-T309 WeakPolarHBondContact OE2-CB 3.33Å; E304-T309 PolarHBondContact OE2-N 2.95Å; E304-T309 VanDerWaalsContact OE2-N 3.16Å; E304-T309 PolarHBondContact OE2-OG1 2.66Å; Q307-T309 HydrophobicContact CB-CG2 4.26Å; T309-Q314 PolarHBondContact O-NE2 2.92Å
310	L	92.1	Very high	93.6	Very high	4 Å²	4	55.3 Å²	55.3	2%	0.021	29%	0.288	C	S	.	.	S	Bend	trans	-81.7	139.5	177.7	-61.6	168.6	0	0	0	110.9	L221 P269 R272 E273 E304 S312 V313 Q314	L221-L310 HydrophobicContact CD1-CD2 4.38Å; P269-L310 HydrophobicContact CB-CD2 3.82Å; R272-L310 HydrophobicContact CB-CD1 4.02Å; R272-L310 HydrophobicContact CG-CD1 4.2Å; E273-L310 HydrophobicContact CB-CD1 3.95Å; E304-L310 HydrophobicContact CG-CD1 3.93Å; E304-L310 HydrophobicContact CG-CG 4.38Å; E304-L310 VanDerWaalsContact OE1-CB 3.3Å; E304-L310 WeakPolarHBondContact OE1-CB 3.42Å; E304-L310 WeakPolarHBondContact OE1-CG 3.42Å; E304-L310 PolarHBondContact OE1-N 3.29Å; L310-S312 PolarHBondContact O-N 3.42Å; L310-V313 HydrophobicContact CB-CB 4.47Å; L310-V313 HydrophobicContact CB-CG2 4.15Å; L310-V313 PolarHBondContact O-N 2.83Å; L310-Q314 WeakPolarHBondContact O-CG 3.36Å; L310-Q314 PolarHBondContact O-N 3.33Å
311	A	90.3	Very high	93.4	Very high	67 Å²	67	52.8 Å²	52.8	55%	0.554	28%	0.283	S	S	*	.	H	α-helix	trans	-54.4	-39.7	-178.6	0	0	0	0	0	113	V313 Q314 T315	A311-V313 PolarHBondContact O-N 3.05Å; A311-Q314 PolarHBondContact O-N 3.35Å; A311-T315 WeakPolarHBondContact O-CB 3.41Å; A311-T315 VanDerWaalsContact O-CG2 3.25Å; A311-T315 WeakPolarHBondContact O-CG2 3.46Å; A311-T315 PolarHBondContact O-N 2.72Å; A311-T315 PolarHBondContact O-OG1 2.76Å
312	S	90.9	Very high	93.3	Very high	16 Å²	16	56.4 Å²	56.4	11%	0.112	31%	0.305	C	S	.	.	H	α-helix	trans	-64.3	-39.2	178.4	-52.6	0	0	0	0	112.4	S233 E273 L310 T315 W316	S233-S312 WeakPolarHBondContact CB-OG 3.39Å; E273-S312 VanDerWaalsContact CD-OG 3.27Å; E273-S312 WeakPolarHBondContact OE2-CB 3.39Å; E273-S312 PolarHBondContact OE2-OG 2.74Å; L310-S312 PolarHBondContact O-N 3.42Å; S312-T315 PolarHBondContact O-OG1 2.87Å; S312-W316 PolarHBondContact O-N 2.89Å
313	V	91.5	Very high	93.3	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-75.2	-34.5	177.8	-177	0	0	0	0	111.1	C276 M277 L280 E304 L310 A311 W316	C276-V313 HydrophobicContact CB-CG2 4.16Å; M277-V313 HydrophobicContact CG-CG2 4.35Å; M277-V313 HydrophobicContact SD-CG2 3.91Å; L280-V313 HydrophobicContact CD1-CG1 4.31Å; E304-V313 HydrophobicContact CG-CG2 4.19Å; E304-V313 WeakPolarHBondContact OE1-CB 2.71Å; E304-V313 WeakPolarHBondContact OE1-CG2 2.96Å; L310-V313 HydrophobicContact CB-CB 4.47Å; L310-V313 HydrophobicContact CB-CG2 4.15Å; L310-V313 PolarHBondContact O-N 2.83Å; A311-V313 PolarHBondContact O-N 3.05Å; V313-W316 VanDerWaalsContact O-CB 3.29Å; V313-W316 WeakPolarHBondContact O-CB 3.35Å; V313-W316 PolarHBondContact O-N 2.91Å
314	Q	91.3	Very high	93.3	Very high	118 Å²	118	57.7 Å²	57.7	55%	0.551	30%	0.304	S	S	*	.	H	α-helix	trans	-66.9	-39.3	174.3	-72.1	179.2	-3.2	0	0	112.8	G308 T309 L310 A311 W316	G308-Q314 WeakPolarHBondContact O-CG 3.41Å; G308-Q314 PolarHBondContact O-NE2 3.01Å; T309-Q314 PolarHBondContact O-NE2 2.92Å; L310-Q314 WeakPolarHBondContact O-CG 3.36Å; L310-Q314 PolarHBondContact O-N 3.33Å; A311-Q314 PolarHBondContact O-N 3.35Å; Q314-W316 PolarHBondContact O-N 2.98Å
315	T	90	Very high	93.4	Very high	105 Å²	105	59.2 Å²	59.2	64%	0.644	32%	0.315	S	S	*	.	S	Bend	trans	-82.1	-3	-178.9	55.1	0	0	0	0	113.1	A311 S312 K317	A311-T315 WeakPolarHBondContact O-CB 3.41Å; A311-T315 VanDerWaalsContact O-CG2 3.25Å; A311-T315 WeakPolarHBondContact O-CG2 3.46Å; A311-T315 PolarHBondContact O-N 2.72Å; A311-T315 PolarHBondContact O-OG1 2.76Å; S312-T315 PolarHBondContact O-OG1 2.87Å; T315-K317 PolarHBondContact O-N 2.78Å
316	W	90.8	Very high	93.4	Very high	23 Å²	23	61.7 Å²	61.7	9%	0.087	33%	0.327	C	S	.	.			trans	-60.6	121.7	171.7	-174.1	-112.9	0	0	0	110.7	P240 M277 L280 E281 S312 V313 Q314 W318	P240-W316 HydrophobicContact CB-CH2 3.96Å; P240-W316 HydrophobicContact CB-CZ2 3.87Å; P240-W316 HydrophobicContact CG-CH2 3.83Å; P240-W316 HydrophobicContact CG-CZ2 3.61Å; M277-W316 HydrophobicContact CE-CE3 3.83Å; M277-W316 HydrophobicContact CE-CZ3 4.29Å; L280-W316 HydrophobicContact CB-CD2 4.19Å; L280-W316 HydrophobicContact CB-CH2 4.49Å; L280-W316 HydrophobicContact CB-CZ2 3.93Å; L280-W316 HydrophobicContact CD1-CB 4.45Å; L280-W316 HydrophobicContact CD1-CD2 4.37Å; L280-W316 HydrophobicContact CD1-CG 4.01Å; L280-W316 WeakPolarHBondContact O-CZ2 3.29Å; E281-W316 HydrophobicContact CG-CH2 4.29Å; E281-W316 HydrophobicContact CG-CZ3 4.09Å; S312-W316 PolarHBondContact O-N 2.89Å; V313-W316 VanDerWaalsContact O-CB 3.29Å; V313-W316 WeakPolarHBondContact O-CB 3.35Å; V313-W316 PolarHBondContact O-N 2.91Å; Q314-W316 PolarHBondContact O-N 2.98Å; W316-W318 HydrophobicContact CZ2-CB 3.98Å; W316-W318 AromaticContact CZ2-CD1 3.8Å; W316-W318 HydrophobicContact CZ2-CG 4.22Å; W316-W318 PolarHBondContact NE1-O 2.74Å
317	K	89.8	Confident	93.4	Very high	156 Å²	156	60.1 Å²	60.1	68%	0.678	32%	0.32	S	S	*	.			trans	-83.8	-18.7	-170.9	-63.1	176.3	-176.9	167.7	0	113.7	T315	T315-K317 PolarHBondContact O-N 2.78Å
318	W	89.6	Confident	93.5	Very high	98 Å²	98	53.9 Å²	53.9	37%	0.371	29%	0.291	S	S	.	.	S	Bend	trans	-100.1	165	-171.4	-56.7	97.3	0	0	0	111.3	P240 W316 R320	P240-W318 HydrophobicContact CG-CB 3.96Å; P240-W318 VanDerWaalsContact CG-CD1 3.41Å; P240-W318 HydrophobicContact CG-CD2 3.87Å; P240-W318 HydrophobicContact CG-CG 3.47Å; P240-W318 VanDerWaalsContact CG-CG 3.47Å; W316-W318 HydrophobicContact CZ2-CB 3.98Å; W316-W318 AromaticContact CZ2-CD1 3.8Å; W316-W318 HydrophobicContact CZ2-CG 4.22Å; W316-W318 PolarHBondContact NE1-O 2.74Å; W318-R320 PolarHBondContact O-N 3.16Å
319	P	89.6	Confident	93.4	Very high	103 Å²	103	61.9 Å²	61.9	67%	0.669	33%	0.327	S	S	*	.			trans	-56.6	123.9	176.9	-24.1	34.7	0	0	0	110.9	G321	P319-G321 VanDerWaalsContact C-N 3.35Å
320	R	92.2	Very high	93.4	Very high	73 Å²	73	63.2 Å²	63.2	28%	0.275	33%	0.328	S	S	.	.			trans	-74.6	-28.6	175.1	-67.6	-164.8	-58.1	-99.2	1.9	112.6	L280 L305 N306 W318 W323	L280-R320 HydrophobicContact CD1-CG 4.28Å; L280-R320 HydrophobicContact CD2-CB 4.19Å; L280-R320 HydrophobicContact CD2-CG 4.25Å; L305-R320 WeakPolarHBondContact O-CD 3.41Å; L305-R320 PolarHBondContact O-NE 3.37Å; L305-R320 VanDerWaalsContact O-NE 3.14Å; N306-R320 PolarHBondContact O-NH2 3.41Å; N306-R320 VanDerWaalsContact O-NH2 3.15Å; W318-R320 PolarHBondContact O-N 3.16Å; R320-W323 PolarHBondContact O-NE1 3.45Å
321	G	93.2	Very high	93.3	Very high	21 Å²	21	64.9 Å²	64.9	22%	0.216	34%	0.339	C	S	.	.			trans	89.2	-171.5	-173.4	0	0	0	0	0	113.2	P319 D347 S349	P319-G321 VanDerWaalsContact C-N 3.35Å; G321-D347 WeakPolarHBondContact CA-OD1 3.25Å; G321-S349 VanDerWaalsContact CA-OG 3.24Å; G321-S349 WeakPolarHBondContact CA-OG 3.46Å
322	V	97.3	Very high	93.1	Very high	76 Å²	76	61.7 Å²	61.7	46%	0.461	31%	0.313	S	S	.	.			trans	-123.7	98.6	176.6	179.6	0	0	0	0	108	D347 S348 S349	V322-D347 PolarHBondContact N-OD1 3.15Å; V322-S348 PolarHBondContact O-N 2.87Å; V322-S348 PolarHBondContact O-OG 3.3Å; V322-S349 PolarHBondContact N-OG 3.06Å
323	W	98.4	Very high	92.6	Very high	9 Å²	9	61.4 Å²	61.4	3%	0.034	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	140.7	-170.6	-71.3	80.6	0	0	0	112.2	L279 I284 C302 L305 N306 R320 L345 W346 D347	L279-W323 HydrophobicContact CB-CH2 4.09Å; L279-W323 HydrophobicContact CB-CZ2 4.31Å; L279-W323 HydrophobicContact CD2-CE3 4.37Å; L279-W323 HydrophobicContact CD2-CH2 3.51Å; L279-W323 HydrophobicContact CD2-CZ2 4.26Å; L279-W323 HydrophobicContact CD2-CZ3 3.6Å; L279-W323 HydrophobicContact CG-CH2 3.96Å; L279-W323 HydrophobicContact CG-CZ3 4.46Å; I284-W323 WeakPolarHBondContact O-CH2 3.25Å; I284-W323 WeakPolarHBondContact O-CZ2 3.43Å; C302-W323 PolarHBondContact SG-O 2.91Å; C302-W323 VanDerWaalsContact SG-O 3.36Å; L305-W323 HydrophobicContact CB-CB 4.11Å; L305-W323 HydrophobicContact CB-CD2 4.31Å; L305-W323 HydrophobicContact CB-CG 3.72Å; L305-W323 HydrophobicContact CD1-CB 4.4Å; L305-W323 HydrophobicContact CD1-CD2 3.63Å; L305-W323 HydrophobicContact CD1-CE3 3.87Å; L305-W323 HydrophobicContact CD1-CG 3.87Å; L305-W323 HydrophobicContact CD1-CZ2 4.43Å; L305-W323 HydrophobicContact CD1-CZ3 4.37Å; L305-W323 HydrophobicContact CG-CD2 4.41Å; L305-W323 HydrophobicContact CG-CG 4.33Å; N306-W323 PolarHBondContact ND2-O 2.8Å; N306-W323 PolarHBondContact OD1-N 3.19Å; R320-W323 PolarHBondContact O-NE1 3.45Å; W323-L345 HydrophobicContact CE3-CB 4.13Å; W323-L345 HydrophobicContact CZ3-CB 4.11Å; W323-W346 CarbonylContact C-O 3.54Å; W323-W346 VanDerWaalsContact CA-O 3.31Å; W323-W346 WeakPolarHBondContact CA-O 3.14Å; W323-D347 HydrophobicContact CD2-CB 4.31Å; W323-D347 HydrophobicContact CZ2-CB 4.29Å
324	K	98.6	Very high	91.7	Very high	92 Å²	92	66.4 Å²	66.4	40%	0.4	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	151.1	172.7	-65.1	178.8	-177.1	171.3	0	109.1	L345 W346 S348	K324-L345 WeakPolarHBondContact O-CA 3.13Å; K324-W346 HydrophobicContact CB-CD2 3.92Å; K324-W346 HydrophobicContact CB-CE3 4.12Å; K324-W346 HydrophobicContact CB-CH2 3.6Å; K324-W346 HydrophobicContact CB-CZ2 3.38Å; K324-W346 HydrophobicContact CB-CZ3 3.96Å; K324-W346 HydrophobicContact CD-CZ2 3.65Å; K324-W346 HydrophobicContact CG-CZ2 4.16Å; K324-W346 PolarHBondContact N-O 2.83Å; K324-W346 VanDerWaalsContact O-CE3 3.26Å; K324-W346 PolarHBondContact O-N 2.88Å; K324-S348 WeakPolarHBondContact CE-OG 3.35Å
325	S	98.3	Very high	90.5	Very high	31 Å²	31	61.4 Å²	61.4	22%	0.217	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	149.2	177.3	40	0	0	0	0	110.3	D299 F344	D299-S325 PolarHBondContact OD1-OG 3.01Å; S325-F344 CarbonylContact C-O 3.5Å; S325-F344 VanDerWaalsContact CA-O 3.31Å; S325-F344 WeakPolarHBondContact CA-O 3.31Å
326	I	98.4	Very high	89.1	Confident	52 Å²	52	62 Å²	62	27%	0.267	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	142.9	163.9	-165.5	168.2	0	0	0	108.7	G343 F344 W346 L354 A357	I326-G343 CarbonylContact O-C 3.46Å; I326-G343 WeakPolarHBondContact O-CA 3.48Å; I326-F344 HydrophobicContact CG2-CB 4.02Å; I326-F344 HydrophobicContact CG2-CD2 4.17Å; I326-F344 PolarHBondContact N-O 3.47Å; I326-F344 PolarHBondContact O-N 2.85Å; I326-W346 HydrophobicContact CB-CH2 4.36Å; I326-W346 HydrophobicContact CB-CZ3 4.06Å; I326-W346 HydrophobicContact CG2-CH2 4.45Å; I326-W346 HydrophobicContact CG2-CZ3 3.86Å; I326-L354 HydrophobicContact CB-CD2 4.2Å; I326-L354 HydrophobicContact CD1-CD2 3.67Å; I326-L354 HydrophobicContact CG2-CD2 3.76Å; I326-A357 HydrophobicContact CD1-CB 4.1Å
327	V	98.1	Very high	87.8	Confident	23 Å²	23	68.1 Å²	68.1	14%	0.139	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	147.1	176.3	-176.1	0	0	0	0	108.6	L292 R295 L298 E329 Y341 S342	L292-V327 HydrophobicContact CD1-CG1 4.01Å; L292-V327 HydrophobicContact CD1-CG2 4.02Å; R295-V327 HydrophobicContact CB-CB 4.11Å; R295-V327 HydrophobicContact CB-CG1 3.89Å; R295-V327 HydrophobicContact CB-CG2 4.49Å; R295-V327 HydrophobicContact CG-CB 4.38Å; R295-V327 HydrophobicContact CG-CG1 3.76Å; R295-V327 WeakPolarHBondContact O-CG2 3.36Å; L298-V327 HydrophobicContact CB-CG2 3.76Å; L298-V327 HydrophobicContact CD2-CG2 3.58Å; L298-V327 HydrophobicContact CG-CG2 4.32Å; V327-E329 PolarHBondContact O-N 2.76Å; V327-Y341 HydrophobicContact CG1-CG 4.46Å; V327-S342 WeakPolarHBondContact CG1-O 3.31Å
328	S	96.6	Very high	87.2	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	33%	0.333	C	S	.	.			trans	-56.1	134.6	177.6	66.7	0	0	0	0	111.8	K330 T332 Y341 S342	S328-K330 VanDerWaalsContact CB-O 3.26Å; S328-K330 WeakPolarHBondContact CB-O 3.34Å; S328-K330 PolarHBondContact OG-O 2.92Å; S328-T332 WeakPolarHBondContact OG-CG2 3.34Å; S328-Y341 WeakPolarHBondContact O-CD1 3.03Å; S328-S342 WeakPolarHBondContact CB-O 3.23Å; S328-S342 PolarHBondContact N-O 3.26Å; S328-S342 PolarHBondContact OG-N 3.01Å; S328-S342 PolarHBondContact OG-O 3.12Å
329	E	92.5	Very high	87	Confident	172 Å²	172	60.8 Å²	60.8	80%	0.804	34%	0.335	S	S	*	.	S	Bend	trans	-69.8	-37.1	177.6	-63.7	-174.7	165	0	0	111.8	V327	V327-E329 PolarHBondContact O-N 2.76Å
330	K	91.5	Very high	87.1	Confident	89 Å²	89	55.9 Å²	55.9	39%	0.387	30%	0.303	S	S	.	.	S	Bend	trans	-97.4	152.4	173.4	-62.3	173.2	-179.7	170	0	109.4	S328 V359 D361	S328-K330 VanDerWaalsContact CB-O 3.26Å; S328-K330 WeakPolarHBondContact CB-O 3.34Å; S328-K330 PolarHBondContact OG-O 2.92Å; K330-V359 HydrophobicContact CB-CB 4.35Å; K330-V359 HydrophobicContact CB-CG1 4.36Å; K330-V359 HydrophobicContact CB-CG2 4.2Å; K330-D361 VanDerWaalsContact NZ-CG 3.26Å; K330-D361 IonicContact NZ-OD1 2.69Å; K330-D361 PolarHBondContact NZ-OD1 3.2Å; K330-D361 IonicContact NZ-OD2 3.22Å; K330-D361 PolarHBondContact NZ-OD2 2.85Å
331	P	89.7	Confident	87.2	Confident	39 Å²	39	54.6 Å²	54.6	25%	0.253	30%	0.298	S	S	.	.			trans	-52.6	150.7	165.9	-26.5	36.2	0	0	0	111.6	V339 S340 Y341 Q375	P331-V339 HydrophobicContact CB-CB 3.99Å; P331-V339 HydrophobicContact CB-CG1 4.29Å; P331-V339 HydrophobicContact CG-CB 4Å; P331-V339 HydrophobicContact CG-CG1 4.16Å; P331-V339 HydrophobicContact CG-CG2 4.31Å; P331-S340 CarbonylContact C-O 3.13Å; P331-S340 WeakPolarHBondContact CA-O 3.19Å; P331-Y341 HydrophobicContact CB-CE1 4.46Å; P331-Y341 HydrophobicContact CG-CE1 3.97Å; P331-Q375 PolarHBondContact O-OE1 2.83Å
332	T	87.6	Confident	87.4	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.288	C	S	.	.			trans	-117	-12.4	178.3	54.6	0	0	0	0	112.8	S328 S340 Y341 S342 V359 Q375 Y377	S328-T332 WeakPolarHBondContact OG-CG2 3.34Å; T332-S340 PolarHBondContact N-O 2.96Å; T332-S340 PolarHBondContact OG1-O 3.09Å; T332-Y341 VanDerWaalsContact OG1-C 3.28Å; T332-S342 PolarHBondContact OG1-N 3.22Å; T332-S342 PolarHBondContact OG1-OG 3.23Å; T332-V359 HydrophobicContact CG2-CG1 4.44Å; T332-V359 HydrophobicContact CG2-CG2 4.09Å; T332-Q375 PolarHBondContact O-N 3.19Å; T332-Q375 VanDerWaalsContact O-O 3.07Å; T332-Y377 HydrophobicContact CG2-CG 4.44Å
333	G	80.3	Confident	87.4	Confident	9 Å²	9	50 Å²	50	9%	0.093	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169	-169.9	175.6	0	0	0	0	0	112.3	S340	G333-S340 WeakPolarHBondContact CA-OG 3.48Å; G333-S340 PolarHBondContact N-O 3.1Å; G333-S340 PolarHBondContact O-N 2.75Å; G333-S340 PolarHBondContact O-OG 3.08Å
334	H	71.8	Confident	87.4	Confident	106 Å²	106	49.6 Å²	49.6	49%	0.491	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	132.8	174.8	-65.8	-77.8	0	0	0	110.2	G338 S340	H334-G338 CarbonylContact C-O 3.5Å; H334-G338 WeakPolarHBondContact CA-O 3.24Å; H334-S340 PolarHBondContact N-OG 2.83Å
335	S	67	Low	87.4	Confident	12 Å²	12	45.2 Å²	45.2	8%	0.084	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	166.3	171.2	-166.6	0	0	0	0	109.8	D291 K337 G338	D291-S335 WeakPolarHBondContact OD1-CB 3.42Å; D291-S335 PolarHBondContact OD1-OG 3.41Å; S335-K337 PolarHBondContact O-N 3.18Å; S335-K337 VanDerWaalsContact O-N 3.08Å; S335-G338 PolarHBondContact N-O 3.38Å; S335-G338 PolarHBondContact O-N 2.83Å; S335-G338 VanDerWaalsContact O-N 3.1Å; S335-G338 VanDerWaalsContact O-O 3.1Å
336	S	60.9	Low	87.4	Confident	118 Å²	118	44.5 Å²	44.5	83%	0.825	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-20.6	170.8	57.3	0	0	0	0	113.1
337	K	61.6	Low	87.4	Confident	151 Å²	151	42.1 Å²	42.1	66%	0.657	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.9	3.6	179.5	-62.4	-178.4	-179	177	0	114.6	S335	S335-K337 PolarHBondContact O-N 3.18Å; S335-K337 VanDerWaalsContact O-N 3.08Å
338	G	77.2	Confident	87.3	Confident	35 Å²	35	42.1 Å²	42.1	36%	0.361	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	133.5	-140.7	179.5	0	0	0	0	0	113.6	H334 S335	H334-G338 CarbonylContact C-O 3.5Å; H334-G338 WeakPolarHBondContact CA-O 3.24Å; S335-G338 PolarHBondContact N-O 3.38Å; S335-G338 PolarHBondContact O-N 2.83Å; S335-G338 VanDerWaalsContact O-N 3.1Å; S335-G338 VanDerWaalsContact O-O 3.1Å
339	V	86.9	Confident	87.2	Confident	66 Å²	66	45.5 Å²	45.5	40%	0.4	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	149.5	173.3	-67.9	0	0	0	0	110.7	P331 Y341	P331-V339 HydrophobicContact CB-CB 3.99Å; P331-V339 HydrophobicContact CB-CG1 4.29Å; P331-V339 HydrophobicContact CG-CB 4Å; P331-V339 HydrophobicContact CG-CG1 4.16Å; P331-V339 HydrophobicContact CG-CG2 4.31Å; V339-Y341 HydrophobicContact CG2-CE2 4.19Å
340	S	90.7	Very high	87.1	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	148.9	176	63.2	0	0	0	0	110.9	L292 P331 T332 G333 H334 H394	L292-S340 CarbonylContact O-C 3.57Å; L292-S340 VanDerWaalsContact O-CA 3.28Å; L292-S340 WeakPolarHBondContact O-CA 3.27Å; P331-S340 CarbonylContact C-O 3.13Å; P331-S340 WeakPolarHBondContact CA-O 3.19Å; T332-S340 PolarHBondContact N-O 2.96Å; T332-S340 PolarHBondContact OG1-O 3.09Å; G333-S340 WeakPolarHBondContact CA-OG 3.48Å; G333-S340 PolarHBondContact N-O 3.1Å; G333-S340 PolarHBondContact O-N 2.75Å; G333-S340 PolarHBondContact O-OG 3.08Å; H334-S340 PolarHBondContact N-OG 2.83Å; S340-H394 PolarHBondContact OG-ND1 2.91Å
341	Y	94.9	Very high	87.1	Confident	45 Å²	45	36.9 Å²	36.9	18%	0.176	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	159.2	177.6	-58.2	-94.6	0	0	0	109.9	D291 L292 R295 V327 S328 P331 T332 V339	D291-Y341 PolarHBondContact N-O 2.87Å; L292-Y341 WeakPolarHBondContact CB-O 3.16Å; L292-Y341 PolarHBondContact N-O 3.35Å; L292-Y341 PolarHBondContact O-N 2.84Å; R295-Y341 HydrophobicContact CG-CD1 4.04Å; R295-Y341 HydrophobicContact CG-CD2 4.31Å; R295-Y341 HydrophobicContact CG-CE1 4.25Å; R295-Y341 HydrophobicContact CG-CG 4.09Å; V327-Y341 HydrophobicContact CG1-CG 4.46Å; S328-Y341 WeakPolarHBondContact O-CD1 3.03Å; P331-Y341 HydrophobicContact CB-CE1 4.46Å; P331-Y341 HydrophobicContact CG-CE1 3.97Å; T332-Y341 VanDerWaalsContact OG1-C 3.28Å; V339-Y341 HydrophobicContact CG2-CE2 4.19Å
342	S	96.7	Very high	87.3	Confident	1 Å²	1	35 Å²	35	1%	0.007	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	153	170.8	-59	0	0	0	0	109.1	V289 V327 S328 T332 Y377	V289-S342 CarbonylContact O-C 3.52Å; V289-S342 VanDerWaalsContact O-CA 3.27Å; V289-S342 WeakPolarHBondContact O-CA 3.33Å; V327-S342 WeakPolarHBondContact CG1-O 3.31Å; S328-S342 WeakPolarHBondContact CB-O 3.23Å; S328-S342 PolarHBondContact N-O 3.26Å; S328-S342 PolarHBondContact OG-N 3.01Å; S328-S342 PolarHBondContact OG-O 3.12Å; T332-S342 PolarHBondContact OG1-N 3.22Å; T332-S342 PolarHBondContact OG1-OG 3.23Å; S342-Y377 WeakPolarHBondContact O-CE1 3.49Å
343	G	98.1	Very high	87.8	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	170.1	-179.6	0	0	0	0	0	112.9	V289 I326	V289-G343 PolarHBondContact N-O 3.45Å; V289-G343 PolarHBondContact O-N 3.25Å; I326-G343 CarbonylContact O-C 3.46Å; I326-G343 WeakPolarHBondContact O-CA 3.48Å
344	F	98.7	Very high	88.6	Confident	0 Å²	0	40 Å²	40	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	138.7	172.9	-60.7	-81.4	0	0	0	110.2	L287 A288 S325 I326 Y377 A379 F381 V390	L287-F344 CarbonylContact O-C 3.58Å; L287-F344 VanDerWaalsContact O-CA 3.3Å; L287-F344 WeakPolarHBondContact O-CA 3.38Å; A288-F344 HydrophobicContact CB-CD1 3.76Å; A288-F344 HydrophobicContact CB-CE1 3.57Å; S325-F344 CarbonylContact C-O 3.5Å; S325-F344 VanDerWaalsContact CA-O 3.31Å; S325-F344 WeakPolarHBondContact CA-O 3.31Å; I326-F344 HydrophobicContact CG2-CB 4.02Å; I326-F344 HydrophobicContact CG2-CD2 4.17Å; I326-F344 PolarHBondContact N-O 3.47Å; I326-F344 PolarHBondContact O-N 2.85Å; F344-Y377 AromaticContact CD2-CD1 3.9Å; F344-Y377 HydrophobicContact CD2-CD1 3.9Å; F344-Y377 AromaticContact CD2-CE1 3.48Å; F344-Y377 HydrophobicContact CD2-CE1 3.48Å; F344-Y377 VanDerWaalsContact CD2-CE1 3.48Å; F344-Y377 AromaticContact CE2-CD1 3.36Å; F344-Y377 HydrophobicContact CE2-CD1 3.36Å; F344-Y377 AromaticContact CE2-CE1 3.4Å; F344-Y377 HydrophobicContact CE2-CE1 3.4Å; F344-Y377 HydrophobicContact CE2-CG 4.1Å; F344-Y377 HydrophobicContact CZ-CD1 4.19Å; F344-A379 HydrophobicContact CD2-CB 3.79Å; F344-A379 HydrophobicContact CE1-CB 4.5Å; F344-A379 HydrophobicContact CE2-CB 3.4Å; F344-A379 VanDerWaalsContact CE2-CB 3.4Å; F344-A379 HydrophobicContact CG-CB 4.49Å; F344-A379 HydrophobicContact CZ-CB 3.8Å; F344-F381 HydrophobicContact CB-CZ 3.94Å; F344-F381 HydrophobicContact CD1-CE2 4.17Å; F344-F381 HydrophobicContact CD1-CZ 4.3Å; F344-F381 HydrophobicContact CG-CE2 4.25Å; F344-F381 HydrophobicContact CG-CZ 4.07Å; F344-V390 HydrophobicContact CE1-CB 4.32Å; F344-V390 HydrophobicContact CE1-CG1 3.72Å; F344-V390 HydrophobicContact CZ-CG1 4.28Å
345	L	98.5	Very high	89.8	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	136.2	165.7	-79	165.5	0	0	0	108.3	L279 I286 L287 L298 F301 C302 W323 K324	L279-L345 HydrophobicContact CD2-CD1 4.46Å; I286-L345 CarbonylContact C-O 3.55Å; I286-L345 WeakPolarHBondContact CA-O 3.46Å; L287-L345 HydrophobicContact CB-CB 4.27Å; L287-L345 HydrophobicContact CD2-CD1 4.15Å; L287-L345 PolarHBondContact N-O 3.1Å; L287-L345 PolarHBondContact O-N 2.89Å; L298-L345 HydrophobicContact CD1-CD1 3.53Å; L298-L345 HydrophobicContact CD1-CD2 4.44Å; L298-L345 HydrophobicContact CD1-CG 3.73Å; L298-L345 HydrophobicContact CD2-CG 4.21Å; L298-L345 HydrophobicContact CG-CD1 4.17Å; L298-L345 HydrophobicContact CG-CD2 4.19Å; L298-L345 HydrophobicContact CG-CG 3.91Å; F301-L345 HydrophobicContact CB-CD1 4.22Å; C302-L345 HydrophobicContact CB-CD2 3.69Å; W323-L345 HydrophobicContact CE3-CB 4.13Å; W323-L345 HydrophobicContact CZ3-CB 4.11Å; K324-L345 WeakPolarHBondContact O-CA 3.13Å
346	W	98.5	Very high	91.2	Very high	16 Å²	16	43.7 Å²	43.7	6%	0.061	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	150.7	175.5	73	101.8	0	0	0	113.2	K285 I286 W323 K324 I326 S348 I352 L354 F381	K285-W346 CarbonylContact O-C 3.55Å; K285-W346 WeakPolarHBondContact O-CA 3.43Å; I286-W346 HydrophobicContact CG1-CB 4.26Å; W323-W346 CarbonylContact C-O 3.54Å; W323-W346 VanDerWaalsContact CA-O 3.31Å; W323-W346 WeakPolarHBondContact CA-O 3.14Å; K324-W346 HydrophobicContact CB-CD2 3.92Å; K324-W346 HydrophobicContact CB-CE3 4.12Å; K324-W346 HydrophobicContact CB-CH2 3.6Å; K324-W346 HydrophobicContact CB-CZ2 3.38Å; K324-W346 HydrophobicContact CB-CZ3 3.96Å; K324-W346 HydrophobicContact CD-CZ2 3.65Å; K324-W346 HydrophobicContact CG-CZ2 4.16Å; K324-W346 PolarHBondContact N-O 2.83Å; K324-W346 VanDerWaalsContact O-CE3 3.26Å; K324-W346 PolarHBondContact O-N 2.88Å; I326-W346 HydrophobicContact CB-CH2 4.36Å; I326-W346 HydrophobicContact CB-CZ3 4.06Å; I326-W346 HydrophobicContact CG2-CH2 4.45Å; I326-W346 HydrophobicContact CG2-CZ3 3.86Å; W346-S348 PolarHBondContact O-N 3.1Å; W346-I352 HydrophobicContact CB-CG2 4.28Å; W346-I352 VanDerWaalsContact CD1-O 3.31Å; W346-I352 HydrophobicContact CG-CG2 4.29Å; W346-I352 PolarHBondContact NE1-O 3.5Å; W346-L354 HydrophobicContact CH2-CB 4.01Å; W346-L354 HydrophobicContact CH2-CD2 3.72Å; W346-L354 HydrophobicContact CZ2-CB 3.64Å; W346-L354 HydrophobicContact CZ2-CD2 4.24Å; W346-L354 HydrophobicContact CZ3-CD2 4.14Å; W346-F381 HydrophobicContact CB-CE1 4.11Å; W346-F381 AromaticContact CD2-CE1 3.92Å; W346-F381 HydrophobicContact CD2-CE1 3.92Å; W346-F381 HydrophobicContact CE3-CE1 4.19Å; W346-F381 AromaticContact CG-CE1 3.89Å; W346-F381 HydrophobicContact CG-CE1 3.89Å
347	D	97.4	Very high	92.9	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.011	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	100.4	174.2	174.7	19.5	0	0	0	110.8	K285 G321 V322 W323 S349 S350	K285-D347 HydrophobicContact CD-CB 4.21Å; K285-D347 IonicContact NZ-OD2 3.93Å; K285-D347 PolarHBondContact O-N 2.76Å; G321-D347 WeakPolarHBondContact CA-OD1 3.25Å; V322-D347 PolarHBondContact N-OD1 3.15Å; W323-D347 HydrophobicContact CD2-CB 4.31Å; W323-D347 HydrophobicContact CZ2-CB 4.29Å; D347-S349 PolarHBondContact O-N 3.12Å; D347-S349 WeakPolarHBondContact OD1-CB 3.26Å; D347-S349 PolarHBondContact OD1-N 2.83Å; D347-S349 PolarHBondContact OD1-OG 2.89Å; D347-S349 PolarHBondContact OD2-OG 3.35Å; D347-S350 PolarHBondContact O-N 3.26Å; D347-S350 PolarHBondContact OD2-OG 3.38Å
348	S	96.4	Very high	94.5	Very high	23 Å²	23	35.5 Å²	35.5	16%	0.161	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-68.6	-19.2	178.6	62.2	0	0	0	0	114.3	V322 K324 W346 S350 G351 I352	V322-S348 PolarHBondContact O-N 2.87Å; V322-S348 PolarHBondContact O-OG 3.3Å; K324-S348 WeakPolarHBondContact CE-OG 3.35Å; W346-S348 PolarHBondContact O-N 3.1Å; S348-S350 PolarHBondContact O-N 2.94Å; S348-G351 PolarHBondContact O-N 3.02Å; S348-I352 WeakPolarHBondContact CA-O 3.44Å
349	S	93.6	Very high	95.2	Very high	71 Å²	71	34.4 Å²	34.4	50%	0.497	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-73.1	-16.4	175.9	75.4	0	0	0	0	113	G321 V322 D347 G351	G321-S349 VanDerWaalsContact CA-OG 3.24Å; G321-S349 WeakPolarHBondContact CA-OG 3.46Å; V322-S349 PolarHBondContact N-OG 3.06Å; D347-S349 PolarHBondContact O-N 3.12Å; D347-S349 WeakPolarHBondContact OD1-CB 3.26Å; D347-S349 PolarHBondContact OD1-N 2.83Å; D347-S349 PolarHBondContact OD1-OG 2.89Å; D347-S349 PolarHBondContact OD2-OG 3.35Å; S349-G351 PolarHBondContact O-N 2.9Å
350	S	90.8	Very high	95.2	Very high	43 Å²	43	32.7 Å²	32.7	30%	0.301	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-84.8	16.2	175.8	-69.7	0	0	0	0	113.5	K285 D347 S348	K285-S350 WeakPolarHBondContact CD-OG 3.23Å; D347-S350 PolarHBondContact O-N 3.26Å; D347-S350 PolarHBondContact OD2-OG 3.38Å; S348-S350 PolarHBondContact O-N 2.94Å
351	G	90.9	Very high	94.4	Very high	37 Å²	37	37.8 Å²	37.8	38%	0.381	22%	0.218	S	C	.	.	S	Bend	trans	70.9	33.5	-178.8	0	0	0	0	0	113.2	S348 S349 G384	S348-G351 PolarHBondContact O-N 3.02Å; S349-G351 PolarHBondContact O-N 2.9Å; G351-G384 PolarHBondContact O-N 3.37Å
352	I	95.8	Very high	93	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.005	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	116.3	-179.2	-57.3	174.4	0	0	0	108.8	V251 K285 I286 W346 S348 F381 L382 V383	V251-I352 HydrophobicContact CG2-CD1 3.93Å; K285-I352 HydrophobicContact CB-CD1 3.59Å; I286-I352 HydrophobicContact CD1-CD1 4.1Å; I286-I352 HydrophobicContact CD1-CG2 3.84Å; I286-I352 HydrophobicContact CG1-CD1 3.78Å; I286-I352 HydrophobicContact CG1-CG2 4.04Å; W346-I352 HydrophobicContact CB-CG2 4.28Å; W346-I352 VanDerWaalsContact CD1-O 3.31Å; W346-I352 HydrophobicContact CG-CG2 4.29Å; W346-I352 PolarHBondContact NE1-O 3.5Å; S348-I352 WeakPolarHBondContact CA-O 3.44Å; I352-F381 HydrophobicContact CG2-CD1 3.82Å; I352-F381 HydrophobicContact CG2-CE1 4.49Å; I352-L382 WeakPolarHBondContact CA-O 3.24Å; I352-V383 HydrophobicContact CG1-CG1 4.24Å; I352-V383 HydrophobicContact CG1-CG2 4.38Å; I352-V383 HydrophobicContact CG2-CG2 4.25Å
353	D	96.4	Very high	90.9	Very high	75 Å²	75	42.5 Å²	42.5	40%	0.401	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	133.8	177.7	-72.4	-45.6	0	0	0	110.8	F381 L382	D353-F381 CarbonylContact O-C 3.6Å; D353-F381 WeakPolarHBondContact O-CA 3.03Å; D353-L382 PolarHBondContact N-O 3.2Å; D353-L382 PolarHBondContact O-N 3.17Å
354	L	97.6	Very high	88.6	Confident	37 Å²	37	48.8 Å²	48.8	19%	0.194	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	124.7	169.7	-177.6	71.6	0	0	0	109.1	I326 W346 D356 A357 A379 F381	I326-L354 HydrophobicContact CB-CD2 4.2Å; I326-L354 HydrophobicContact CD1-CD2 3.67Å; I326-L354 HydrophobicContact CG2-CD2 3.76Å; W346-L354 HydrophobicContact CH2-CB 4.01Å; W346-L354 HydrophobicContact CH2-CD2 3.72Å; W346-L354 HydrophobicContact CZ2-CB 3.64Å; W346-L354 HydrophobicContact CZ2-CD2 4.24Å; W346-L354 HydrophobicContact CZ3-CD2 4.14Å; L354-D356 WeakPolarHBondContact CD1-O 3.46Å; L354-A357 HydrophobicContact CD1-CB 4.4Å; L354-A357 HydrophobicContact CD2-CB 4.38Å; L354-A379 HydrophobicContact CD1-CB 3.83Å; L354-F381 HydrophobicContact CB-CD1 4.29Å; L354-F381 HydrophobicContact CB-CE1 4.07Å; L354-F381 HydrophobicContact CD1-CD1 4.04Å; L354-F381 HydrophobicContact CD1-CD2 4.33Å; L354-F381 HydrophobicContact CD1-CE1 3.69Å; L354-F381 HydrophobicContact CD1-CE2 4.01Å; L354-F381 HydrophobicContact CD1-CG 4.35Å; L354-F381 HydrophobicContact CD1-CZ 3.68Å; L354-F381 HydrophobicContact CG-CE1 4.46Å
355	K	96.8	Very high	86	Confident	123 Å²	123	55.1 Å²	55.1	54%	0.535	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	-53.2	174.8	-66.7	-63.2	-176.3	-174.1	0	111.3	H380	K355-H380 HydrophobicContact CB-CB 4.18Å; K355-H380 PolarHBondContact N-O 3.19Å
356	D	96.4	Very high	83.1	Confident	73 Å²	73	62.5 Å²	62.5	39%	0.39	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	163	174.7	65.4	69.3	0	0	0	110.2	L354 A379 H380	L354-D356 WeakPolarHBondContact CD1-O 3.46Å; D356-A379 WeakPolarHBondContact O-CA 3.37Å; D356-H380 VanDerWaalsContact CG-ND1 3.31Å; D356-H380 PolarHBondContact O-N 3.26Å; D356-H380 IonicContact OD1-CE1 3Å; D356-H380 IonicContact OD1-CG 3.97Å; D356-H380 IonicContact OD1-ND1 3.96Å; D356-H380 PolarHBondContact OD1-ND1 2.84Å; D356-H380 IonicContact OD2-CG 3.78Å; D356-H380 IonicContact OD2-ND1 3.81Å; D356-H380 PolarHBondContact OD2-ND1 2.83Å
357	A	97	Very high	80.3	Confident	28 Å²	28	65 Å²	65	23%	0.231	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	136.1	167.4	0	0	0	0	0	109.8	I326 L354 Y377 L378 A379	I326-A357 HydrophobicContact CD1-CB 4.1Å; L354-A357 HydrophobicContact CD1-CB 4.4Å; L354-A357 HydrophobicContact CD2-CB 4.38Å; A357-Y377 HydrophobicContact CB-CE2 3.81Å; A357-Y377 WeakPolarHBondContact CB-OH 3.4Å; A357-L378 CarbonylContact C-O 3.51Å; A357-L378 WeakPolarHBondContact CA-O 3.28Å; A357-A379 HydrophobicContact CB-CB 3.95Å
358	V	94.7	Very high	77.8	Confident	70 Å²	70	73.7 Å²	73.7	42%	0.424	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	140.2	-172.5	66	0	0	0	0	111.2	L360 Y377 L378	V358-L360 HydrophobicContact CG1-CD2 4.28Å; V358-Y377 WeakPolarHBondContact O-CD2 3.42Å; V358-L378 HydrophobicContact CG1-CB 4.34Å; V358-L378 HydrophobicContact CG1-CD2 4.36Å; V358-L378 PolarHBondContact N-O 3.31Å; V358-L378 PolarHBondContact O-N 2.74Å
359	V	92.7	Very high	75.1	Confident	12 Å²	12	74.9 Å²	74.9	7%	0.073	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	122.6	168.2	-178.2	0	0	0	0	108	K330 T332 D361 Q375 L376 Y377	K330-V359 HydrophobicContact CB-CB 4.35Å; K330-V359 HydrophobicContact CB-CG1 4.36Å; K330-V359 HydrophobicContact CB-CG2 4.2Å; T332-V359 HydrophobicContact CG2-CG1 4.44Å; T332-V359 HydrophobicContact CG2-CG2 4.09Å; V359-D361 PolarHBondContact O-N 3.38Å; V359-Q375 HydrophobicContact CG1-CB 4.02Å; V359-Q375 HydrophobicContact CG1-CG 3.81Å; V359-L376 WeakPolarHBondContact CA-O 3.24Å; V359-Y377 HydrophobicContact CG2-CD2 3.78Å; V359-Y377 HydrophobicContact CG2-CE2 4.28Å
360	L	87.4	Confident	72.7	Confident	30 Å²	30	79.2 Å²	79.2	16%	0.157	48%	0.476	C	S	.	.	P	Polyproline II helix	trans	-73.6	121.7	-179.7	-62.3	174.4	0	0	0	109.9	V358 L376 L378 T426	V358-L360 HydrophobicContact CG1-CD2 4.28Å; L360-L376 HydrophobicContact CB-CB 4.27Å; L360-L376 HydrophobicContact CD1-CB 3.85Å; L360-L376 HydrophobicContact CD1-CD1 4.09Å; L360-L376 HydrophobicContact CG-CB 4.38Å; L360-L376 PolarHBondContact N-O 3.36Å; L360-L378 HydrophobicContact CD1-CB 4.21Å; L360-L378 HydrophobicContact CD1-CD1 4.11Å; L360-L378 HydrophobicContact CD2-CB 4.43Å; L360-L378 HydrophobicContact CD2-CD1 4.39Å; L360-L378 HydrophobicContact CG-CB 4.2Å; L360-T426 HydrophobicContact CD1-CG2 3.39Å; L360-T426 HydrophobicContact CD2-CG2 3.91Å; L360-T426 HydrophobicContact CG-CG2 4.3Å
361	D	74	Confident	70.5	Confident	106 Å²	106	84 Å²	84	57%	0.567	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-79.9	133.7	175.7	-70.8	-41.7	0	0	0	109.9	K330 V359	K330-D361 VanDerWaalsContact NZ-CG 3.26Å; K330-D361 IonicContact NZ-OD1 2.69Å; K330-D361 PolarHBondContact NZ-OD1 3.2Å; K330-D361 IonicContact NZ-OD2 3.22Å; K330-D361 PolarHBondContact NZ-OD2 2.85Å; V359-D361 PolarHBondContact O-N 3.38Å
362	H	65.8	Low	69.1	Low	52 Å²	52	84.7 Å²	84.7	24%	0.241	50%	0.495	C	S	.	.	P	Polyproline II helix	trans	-86.5	135.4	169.2	-71	-64.1	0	0	0	109.3	V364 P374 S420	H362-V364 PolarHBondContact O-N 2.97Å; H362-V364 VanDerWaalsContact O-N 3.1Å; H362-P374 PolarHBondContact NE2-O 3.37Å; H362-S420 WeakPolarHBondContact CE1-CB 3.19Å
363	P	52.4	Low	67.8	Low	93 Å²	93	88.1 Å²	88.1	60%	0.604	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-61.5	118.5	172.7	24.4	-30.7	0	0	0	108.9	V365	P363-V365 PolarHBondContact O-N 2.76Å
364	V	48.7	Very low	66.7	Low	132 Å²	132	84.7 Å²	84.7	80%	0.8	49%	0.493	S	S	*	.			trans	-59.9	107.4	178.1	179.8	0	0	0	0	108.3	H362 N366	H362-V364 PolarHBondContact O-N 2.97Å; H362-V364 VanDerWaalsContact O-N 3.1Å; V364-N366 PolarHBondContact O-N 2.84Å
365	V	43.8	Very low	66.2	Low	134 Å²	134	85.5 Å²	85.5	81%	0.812	50%	0.496	S	S	*	.			trans	-74.6	114.4	169.5	-176.9	0	0	0	0	106.9	P363 G367	P363-V365 PolarHBondContact O-N 2.76Å; V365-G367 PolarHBondContact O-N 2.78Å
366	N	37.9	Very low	65.9	Low	154 Å²	154	79.9 Å²	79.9	82%	0.824	47%	0.471	S	S	*	.	S	Bend	trans	-43.3	129.9	-179.3	-81.7	-28.1	0	0	0	113.5	V364	V364-N366 PolarHBondContact O-N 2.84Å
367	G	40.8	Very low	65.8	Low	68 Å²	68	76.6 Å²	76.6	70%	0.701	45%	0.454	S	S	*	.	S	Bend	trans	93	106	156.1	0	0	0	0	0	116.1	V365 G369	V365-G367 PolarHBondContact O-N 2.78Å; G367-G369 PolarHBondContact O-N 2.86Å
368	N	43.3	Very low	65.7	Low	186 Å²	186	75.6 Å²	75.6	100%	0.995	44%	0.444	S	S	*	.	S	Bend	trans	48	22.1	155.2	-89.6	15.9	0	0	0	119.6
369	G	39.8	Very low	65.8	Low	47 Å²	47	72.3 Å²	72.3	49%	0.485	42%	0.424	S	S	.	.			trans	-108.7	97.9	177.5	0	0	0	0	0	112	G367 H371	G367-G369 PolarHBondContact O-N 2.86Å; G369-H371 PolarHBondContact O-N 3.02Å
370	N	43	Very low	66	Low	163 Å²	163	73.1 Å²	73.1	87%	0.872	43%	0.427	S	S	*	.			trans	-71.2	69	172.6	-150.5	18.1	0	0	0	110
371	H	46.5	Very low	66.5	Low	144 Å²	144	71.7 Å²	71.7	67%	0.667	42%	0.42	S	S	*	.			trans	-94.5	97.7	171.6	-66.5	-71.8	0	0	0	108.2	G369 H373	G369-H371 PolarHBondContact O-N 3.02Å; H371-H373 VanDerWaalsContact C-N 3.34Å; H371-H373 PolarHBondContact O-N 2.61Å
372	A	61.1	Low	67.5	Low	51 Å²	51	69 Å²	69	42%	0.421	41%	0.405	S	S	.	.			trans	-76.2	81.3	-177.3	0	0	0	0	0	110.7	Q417	A372-Q417 HydrophobicContact CB-CG 4.39Å; A372-Q417 WeakPolarHBondContact O-CG 3.5Å
373	H	67.7	Low	68.8	Low	72 Å²	72	66.8 Å²	66.8	33%	0.333	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-74.5	137	166	-65.7	-64.2	0	0	0	109.5	H371 H418	H371-H373 VanDerWaalsContact C-N 3.34Å; H371-H373 PolarHBondContact O-N 2.61Å; H373-H418 PolarHBondContact ND1-O 3.02Å
374	P	74.6	Confident	70.4	Confident	4 Å²	4	63.9 Å²	63.9	3%	0.026	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-63.1	139.3	174.1	29.5	-36.4	0	0	0	109.7	H362 H394 M395 H418 L419	H362-P374 PolarHBondContact NE2-O 3.37Å; P374-H394 WeakPolarHBondContact CB-O 3.39Å; P374-M395 HydrophobicContact CB-CG 4.05Å; P374-M395 HydrophobicContact CG-CG 3.83Å; P374-M395 HydrophobicContact CG-SD 4.41Å; P374-H418 WeakPolarHBondContact CD-O 3.47Å; P374-L419 HydrophobicContact CG-CD2 3.98Å
375	Q	85.9	Confident	72.1	Confident	54 Å²	54	61.8 Å²	61.8	25%	0.252	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-79.8	127.5	170.4	-112	171.9	-34.4	0	0	108.5	P331 T332 V359	P331-Q375 PolarHBondContact O-OE1 2.83Å; T332-Q375 PolarHBondContact O-N 3.19Å; T332-Q375 VanDerWaalsContact O-O 3.07Å; V359-Q375 HydrophobicContact CG1-CB 4.02Å; V359-Q375 HydrophobicContact CG1-CG 3.81Å
376	L	90.5	Very high	74.2	Confident	4 Å²	4	56.8 Å²	56.8	2%	0.021	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-91.8	134.8	-176.1	-56.7	174.6	0	0	0	109	V359 L360 V391 V393 L419 I423	V359-L376 WeakPolarHBondContact CA-O 3.24Å; L360-L376 HydrophobicContact CB-CB 4.27Å; L360-L376 HydrophobicContact CD1-CB 3.85Å; L360-L376 HydrophobicContact CD1-CD1 4.09Å; L360-L376 HydrophobicContact CG-CB 4.38Å; L360-L376 PolarHBondContact N-O 3.36Å; L376-V391 HydrophobicContact CB-CG1 4.08Å; L376-V391 HydrophobicContact CD1-CG1 4.49Å; L376-V391 HydrophobicContact CD2-CG1 4.39Å; L376-V393 HydrophobicContact CD2-CG1 4.41Å; L376-V393 HydrophobicContact CD2-CG2 3.84Å; L376-L419 HydrophobicContact CD2-CD2 4.29Å; L376-I423 HydrophobicContact CD1-CB 4.25Å; L376-I423 HydrophobicContact CD1-CD1 3.44Å; L376-I423 VanDerWaalsContact CD1-CD1 3.44Å; L376-I423 HydrophobicContact CD1-CG1 3.5Å; L376-I423 VanDerWaalsContact CD1-CG1 3.5Å; L376-I423 HydrophobicContact CD2-CD1 4.26Å
377	Y	94.6	Very high	76.8	Confident	5 Å²	5	54.9 Å²	54.9	2%	0.02	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	109.3	175.2	-172.6	-141.7	0	0	0	110	T332 S342 F344 A357 V358 V359 S392	T332-Y377 HydrophobicContact CG2-CG 4.44Å; S342-Y377 WeakPolarHBondContact O-CE1 3.49Å; F344-Y377 AromaticContact CD2-CD1 3.9Å; F344-Y377 HydrophobicContact CD2-CD1 3.9Å; F344-Y377 AromaticContact CD2-CE1 3.48Å; F344-Y377 HydrophobicContact CD2-CE1 3.48Å; F344-Y377 VanDerWaalsContact CD2-CE1 3.48Å; F344-Y377 AromaticContact CE2-CD1 3.36Å; F344-Y377 HydrophobicContact CE2-CD1 3.36Å; F344-Y377 AromaticContact CE2-CE1 3.4Å; F344-Y377 HydrophobicContact CE2-CE1 3.4Å; F344-Y377 HydrophobicContact CE2-CG 4.1Å; F344-Y377 HydrophobicContact CZ-CD1 4.19Å; A357-Y377 HydrophobicContact CB-CE2 3.81Å; A357-Y377 WeakPolarHBondContact CB-OH 3.4Å; V358-Y377 WeakPolarHBondContact O-CD2 3.42Å; V359-Y377 HydrophobicContact CG2-CD2 3.78Å; V359-Y377 HydrophobicContact CG2-CE2 4.28Å; Y377-S392 PolarHBondContact N-O 3.42Å; Y377-S392 VanDerWaalsContact N-O 3.09Å; Y377-S392 PolarHBondContact O-N 2.97Å
378	L	94.7	Very high	79.4	Confident	7 Å²	7	52.1 Å²	52.1	4%	0.037	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	139.9	-175.4	-173.9	151.5	0	0	0	109.7	A357 V358 L360 H380 T389 V390 V391 T426	A357-L378 CarbonylContact C-O 3.51Å; A357-L378 WeakPolarHBondContact CA-O 3.28Å; V358-L378 HydrophobicContact CG1-CB 4.34Å; V358-L378 HydrophobicContact CG1-CD2 4.36Å; V358-L378 PolarHBondContact N-O 3.31Å; V358-L378 PolarHBondContact O-N 2.74Å; L360-L378 HydrophobicContact CD1-CB 4.21Å; L360-L378 HydrophobicContact CD1-CD1 4.11Å; L360-L378 HydrophobicContact CD2-CB 4.43Å; L360-L378 HydrophobicContact CD2-CD1 4.39Å; L360-L378 HydrophobicContact CG-CB 4.2Å; L378-H380 WeakPolarHBondContact CD2-CE1 3.47Å; L378-T389 HydrophobicContact CD1-CG2 4.09Å; L378-T389 HydrophobicContact CD2-CG2 4.22Å; L378-T389 HydrophobicContact CG-CG2 4.12Å; L378-V390 CarbonylContact C-O 3.56Å; L378-V390 WeakPolarHBondContact CA-O 3.34Å; L378-V391 HydrophobicContact CD1-CG2 4.04Å; L378-V391 HydrophobicContact CG-CG2 4.16Å; L378-T426 HydrophobicContact CD1-CG2 4.15Å
379	A	96.9	Very high	81.9	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	137.5	173.2	0	0	0	0	0	111.4	F344 L354 D356 A357 F381 V390	F344-A379 HydrophobicContact CD2-CB 3.79Å; F344-A379 HydrophobicContact CE1-CB 4.5Å; F344-A379 HydrophobicContact CE2-CB 3.4Å; F344-A379 VanDerWaalsContact CE2-CB 3.4Å; F344-A379 HydrophobicContact CG-CB 4.49Å; F344-A379 HydrophobicContact CZ-CB 3.8Å; L354-A379 HydrophobicContact CD1-CB 3.83Å; D356-A379 WeakPolarHBondContact O-CA 3.37Å; A357-A379 HydrophobicContact CB-CB 3.95Å; A379-F381 HydrophobicContact CB-CD2 4.12Å; A379-F381 HydrophobicContact CB-CE2 3.57Å; A379-F381 HydrophobicContact CB-CZ 4.29Å; A379-V390 PolarHBondContact N-O 3.13Å; A379-V390 PolarHBondContact O-N 3.48Å
380	H	96.8	Very high	84.6	Confident	29 Å²	29	41.1 Å²	41.1	13%	0.134	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	114	174.1	-61.4	105.8	0	0	0	109.8	K355 D356 L378 T389	K355-H380 HydrophobicContact CB-CB 4.18Å; K355-H380 PolarHBondContact N-O 3.19Å; D356-H380 VanDerWaalsContact CG-ND1 3.31Å; D356-H380 PolarHBondContact O-N 3.26Å; D356-H380 IonicContact OD1-CE1 3Å; D356-H380 IonicContact OD1-CG 3.97Å; D356-H380 IonicContact OD1-ND1 3.96Å; D356-H380 PolarHBondContact OD1-ND1 2.84Å; D356-H380 IonicContact OD2-CG 3.78Å; D356-H380 IonicContact OD2-ND1 3.81Å; D356-H380 PolarHBondContact OD2-ND1 2.83Å; L378-H380 WeakPolarHBondContact CD2-CE1 3.47Å; H380-T389 PolarHBondContact CD2-OG1 3.31Å
381	F	97.1	Very high	87.1	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	131.6	177.7	-72.3	-85.2	0	0	0	110.8	I286 F344 W346 I352 D353 L354 A379 V383 E387 L388 V390	I286-F381 HydrophobicContact CD1-CB 4.49Å; I286-F381 HydrophobicContact CD1-CD1 4.36Å; I286-F381 HydrophobicContact CD1-CG 4.28Å; I286-F381 HydrophobicContact CG2-CE1 4.44Å; I286-F381 HydrophobicContact CG2-CE2 4.2Å; I286-F381 HydrophobicContact CG2-CZ 4.07Å; F344-F381 HydrophobicContact CB-CZ 3.94Å; F344-F381 HydrophobicContact CD1-CE2 4.17Å; F344-F381 HydrophobicContact CD1-CZ 4.3Å; F344-F381 HydrophobicContact CG-CE2 4.25Å; F344-F381 HydrophobicContact CG-CZ 4.07Å; W346-F381 HydrophobicContact CB-CE1 4.11Å; W346-F381 AromaticContact CD2-CE1 3.92Å; W346-F381 HydrophobicContact CD2-CE1 3.92Å; W346-F381 HydrophobicContact CE3-CE1 4.19Å; W346-F381 AromaticContact CG-CE1 3.89Å; W346-F381 HydrophobicContact CG-CE1 3.89Å; I352-F381 HydrophobicContact CG2-CD1 3.82Å; I352-F381 HydrophobicContact CG2-CE1 4.49Å; D353-F381 CarbonylContact O-C 3.6Å; D353-F381 WeakPolarHBondContact O-CA 3.03Å; L354-F381 HydrophobicContact CB-CD1 4.29Å; L354-F381 HydrophobicContact CB-CE1 4.07Å; L354-F381 HydrophobicContact CD1-CD1 4.04Å; L354-F381 HydrophobicContact CD1-CD2 4.33Å; L354-F381 HydrophobicContact CD1-CE1 3.69Å; L354-F381 HydrophobicContact CD1-CE2 4.01Å; L354-F381 HydrophobicContact CD1-CG 4.35Å; L354-F381 HydrophobicContact CD1-CZ 3.68Å; L354-F381 HydrophobicContact CG-CE1 4.46Å; A379-F381 HydrophobicContact CB-CD2 4.12Å; A379-F381 HydrophobicContact CB-CE2 3.57Å; A379-F381 HydrophobicContact CB-CZ 4.29Å; F381-V383 HydrophobicContact CB-CG2 4.1Å; F381-E387 CarbonylContact O-C 3.55Å; F381-E387 WeakPolarHBondContact O-CA 3.46Å; F381-L388 HydrophobicContact CB-CB 4.48Å; F381-L388 PolarHBondContact N-O 3.3Å; F381-L388 PolarHBondContact O-N 2.92Å; F381-V390 HydrophobicContact CD2-CB 4.34Å; F381-V390 HydrophobicContact CD2-CG2 3.86Å; F381-V390 HydrophobicContact CE2-CB 4.41Å; F381-V390 HydrophobicContact CE2-CG2 4.3Å
382	L	95.3	Very high	89.5	Confident	49 Å²	49	26.5 Å²	26.5	26%	0.257	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	113.5	163.4	-177.2	66.3	0	0	0	108.5	I352 D353	I352-L382 WeakPolarHBondContact CA-O 3.24Å; D353-L382 PolarHBondContact N-O 3.2Å; D353-L382 PolarHBondContact O-N 3.17Å
383	V	92.8	Very high	91	Very high	6 Å²	6	24.1 Å²	24.1	4%	0.036	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	99.2	179.5	-175.3	0	0	0	0	108.8	V251 I286 I352 F381 S385 V386 L388 I530	V251-V383 HydrophobicContact CB-CG1 4.38Å; V251-V383 HydrophobicContact CG1-CG1 4.14Å; V251-V383 HydrophobicContact CG2-CG1 4.29Å; I286-V383 HydrophobicContact CD1-CG2 3.96Å; I352-V383 HydrophobicContact CG1-CG1 4.24Å; I352-V383 HydrophobicContact CG1-CG2 4.38Å; I352-V383 HydrophobicContact CG2-CG2 4.25Å; F381-V383 HydrophobicContact CB-CG2 4.1Å; V383-S385 PolarHBondContact O-N 3.5Å; V383-S385 VanDerWaalsContact O-N 3.14Å; V383-V386 PolarHBondContact N-O 3.17Å; V383-V386 PolarHBondContact O-N 3.26Å; V383-L388 HydrophobicContact CG2-CB 4.42Å; V383-I530 HydrophobicContact CG1-CG2 3.82Å
384	G	86.4	Confident	92.1	Very high	33 Å²	33	21.2 Å²	21.2	34%	0.34	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.4	-114.7	-169.7	0	0	0	0	0	111.1	G351	G351-G384 PolarHBondContact O-N 3.37Å
385	S	84.7	Confident	92.7	Very high	88 Å²	88	21.2 Å²	21.2	62%	0.615	12%	0.122	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.5	3.8	176.2	72.4	0	0	0	0	114.2	V383	V383-S385 PolarHBondContact O-N 3.5Å; V383-S385 VanDerWaalsContact O-N 3.14Å
386	V	88.3	Confident	92.1	Very high	28 Å²	28	22.4 Å²	22.4	17%	0.17	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	127.4	-175.2	-179	0	0	0	0	109	V383 E432	V383-V386 PolarHBondContact N-O 3.17Å; V383-V386 PolarHBondContact O-N 3.26Å; V386-E432 HydrophobicContact CG1-CB 4.28Å; V386-E432 HydrophobicContact CG1-CG 4.01Å
387	E	92.7	Very high	90.8	Very high	114 Å²	114	24.1 Å²	24.1	53%	0.533	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	111	168.4	-174.4	167.1	-156.2	0	0	108.4	F381 E432	F381-E387 CarbonylContact O-C 3.55Å; F381-E387 WeakPolarHBondContact O-CA 3.46Å; E387-E432 WeakPolarHBondContact O-CB 3.34Å
388	L	94.9	Very high	88.5	Confident	11 Å²	11	27.6 Å²	27.6	6%	0.058	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	120.4	-176.1	-175	74.7	0	0	0	109.5	F381 V383 V390 V434 L488	F381-L388 HydrophobicContact CB-CB 4.48Å; F381-L388 PolarHBondContact N-O 3.3Å; F381-L388 PolarHBondContact O-N 2.92Å; V383-L388 HydrophobicContact CG2-CB 4.42Å; L388-V390 HydrophobicContact CD2-CG2 3.77Å; L388-V390 HydrophobicContact CG-CG2 3.9Å; L388-V434 HydrophobicContact CD1-CG2 3.86Å; L388-V434 HydrophobicContact CG-CG2 4.48Å; L388-L488 HydrophobicContact CD1-CD1 3.61Å; L388-L488 HydrophobicContact CD1-CD2 4.01Å
389	T	95.9	Very high	85.7	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.006	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	116.8	175.6	-52.9	0	0	0	0	108.9	L378 H380 E430 E432 L433 V434	L378-T389 HydrophobicContact CD1-CG2 4.09Å; L378-T389 HydrophobicContact CD2-CG2 4.22Å; L378-T389 HydrophobicContact CG-CG2 4.12Å; H380-T389 PolarHBondContact CD2-OG1 3.31Å; T389-E430 WeakPolarHBondContact CB-OE2 3.29Å; T389-E430 HydrophobicContact CG2-CG 4.12Å; T389-E430 PolarHBondContact OG1-OE2 3.28Å; T389-E432 PolarHBondContact N-O 3.45Å; T389-L433 HydrophobicContact CG2-CD1 4.07Å; T389-L433 CarbonylContact O-C 3.59Å; T389-L433 WeakPolarHBondContact O-CA 3.48Å; T389-V434 PolarHBondContact O-N 3.2Å
390	V	97.1	Very high	82.6	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	120.4	-177.3	-173.5	0	0	0	0	109.7	L253 F344 L378 A379 F381 L388 V434 L436	L253-V390 HydrophobicContact CD1-CG1 4.47Å; L253-V390 HydrophobicContact CD1-CG2 4.35Å; F344-V390 HydrophobicContact CE1-CB 4.32Å; F344-V390 HydrophobicContact CE1-CG1 3.72Å; F344-V390 HydrophobicContact CZ-CG1 4.28Å; L378-V390 CarbonylContact C-O 3.56Å; L378-V390 WeakPolarHBondContact CA-O 3.34Å; A379-V390 PolarHBondContact N-O 3.13Å; A379-V390 PolarHBondContact O-N 3.48Å; F381-V390 HydrophobicContact CD2-CB 4.34Å; F381-V390 HydrophobicContact CD2-CG2 3.86Å; F381-V390 HydrophobicContact CE2-CB 4.41Å; F381-V390 HydrophobicContact CE2-CG2 4.3Å; L388-V390 HydrophobicContact CD2-CG2 3.77Å; L388-V390 HydrophobicContact CG-CG2 3.9Å; V390-V434 WeakPolarHBondContact CA-O 3.38Å; V390-L436 HydrophobicContact CG1-CD1 4.08Å; V390-L436 HydrophobicContact CG1-CD2 3.87Å; V390-L436 HydrophobicContact CG1-CG 3.99Å
391	V	95.7	Very high	79.4	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.006	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	115	177.8	-177.4	0	0	0	0	109.2	L376 L378 V393 L427 L433 V434 V435 L436	L376-V391 HydrophobicContact CB-CG1 4.08Å; L376-V391 HydrophobicContact CD1-CG1 4.49Å; L376-V391 HydrophobicContact CD2-CG1 4.39Å; L378-V391 HydrophobicContact CD1-CG2 4.04Å; L378-V391 HydrophobicContact CG-CG2 4.16Å; V391-V393 HydrophobicContact CG1-CG2 4.45Å; V391-L427 HydrophobicContact CG2-CD2 4.23Å; V391-L433 HydrophobicContact CG2-CD1 3.82Å; V391-V434 PolarHBondContact N-O 3.21Å; V391-V435 HydrophobicContact CB-CG1 4.34Å; V391-V435 HydrophobicContact CB-CG2 4.23Å; V391-V435 HydrophobicContact CG1-CG1 4.38Å; V391-V435 CarbonylContact O-C 3.56Å; V391-V435 WeakPolarHBondContact O-CA 3.32Å; V391-L436 PolarHBondContact O-N 3.32Å
392	S	95.8	Very high	76.3	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	129	174.3	179.9	0	0	0	0	111	Q290 Y377 L436	Q290-S392 PolarHBondContact NE2-OG 3.19Å; Y377-S392 PolarHBondContact N-O 3.42Å; Y377-S392 VanDerWaalsContact N-O 3.09Å; Y377-S392 PolarHBondContact O-N 2.97Å; S392-L436 CarbonylContact C-O 3.56Å; S392-L436 WeakPolarHBondContact CA-O 3.07Å
393	V	92.8	Very high	73.4	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	133	-178.6	-175.3	0	0	0	0	109.7	L376 V391 M395 L419 V435 L436 G437 H438 F439	L376-V393 HydrophobicContact CD2-CG1 4.41Å; L376-V393 HydrophobicContact CD2-CG2 3.84Å; V391-V393 HydrophobicContact CG1-CG2 4.45Å; V393-M395 HydrophobicContact CG1-CG 3.79Å; V393-M395 HydrophobicContact CG1-SD 4.1Å; V393-L419 HydrophobicContact CG1-CD2 4.08Å; V393-V435 HydrophobicContact CG2-CG1 3.53Å; V393-L436 PolarHBondContact N-O 3.45Å; V393-G437 CarbonylContact O-C 3.48Å; V393-G437 WeakPolarHBondContact O-CA 3.48Å; V393-H438 PolarHBondContact O-N 3.24Å; V393-F439 HydrophobicContact CB-CE1 4.24Å; V393-F439 HydrophobicContact CB-CZ 4.36Å; V393-F439 HydrophobicContact CG1-CD1 4.3Å; V393-F439 HydrophobicContact CG1-CE1 4.2Å; V393-F439 HydrophobicContact CG2-CE1 4.2Å; V393-F439 HydrophobicContact CG2-CZ 4.3Å
394	H	91.2	Very high	70.3	Confident	12 Å²	12	55.3 Å²	55.3	6%	0.056	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	106.3	170.2	-175.4	-123.5	0	0	0	109	Q290 D291 S340 P374 H438	Q290-H394 HydrophobicContact CB-CB 4.15Å; Q290-H394 HydrophobicContact CG-CB 4.14Å; D291-H394 IonicContact OD1-CE1 3.44Å; S340-H394 PolarHBondContact OG-ND1 2.91Å; P374-H394 WeakPolarHBondContact CB-O 3.39Å; H394-H438 WeakPolarHBondContact CA-O 3.37Å; H394-H438 AromaticContact CD2-CD2 3.85Å
395	M	87.8	Confident	67.7	Low	3 Å²	3	59.7 Å²	59.7	2%	0.015	39%	0.389	C	S	.	.			trans	-108.4	140.5	178.7	-66.9	179.8	73.3	0	0	110.2	P374 V393 Q417 L419 H438 F439 F448	P374-M395 HydrophobicContact CB-CG 4.05Å; P374-M395 HydrophobicContact CG-CG 3.83Å; P374-M395 HydrophobicContact CG-SD 4.41Å; V393-M395 HydrophobicContact CG1-CG 3.79Å; V393-M395 HydrophobicContact CG1-SD 4.1Å; M395-Q417 HydrophobicContact CE-CB 4.02Å; M395-Q417 WeakPolarHBondContact CE-O 3.27Å; M395-L419 HydrophobicContact SD-CD2 3.98Å; M395-L419 HydrophobicContact SD-CG 4.11Å; M395-H438 PolarHBondContact N-O 2.86Å; M395-H438 PolarHBondContact O-CD2 3.25Å; M395-H438 PolarHBondContact O-NE2 2.82Å; M395-F439 HydrophobicContact SD-CD1 4.44Å; M395-F448 HydrophobicContact SD-CE1 3.98Å
396	Q	73.4	Confident	65	Low	80 Å²	80	60.8 Å²	60.8	37%	0.374	40%	0.397	S	S	.	.			trans	-79.9	130.2	177.5	-165.8	160.7	20	0	0	110.8
397	S	61.3	Low	62.5	Low	39 Å²	39	69.5 Å²	69.5	27%	0.273	43%	0.432	S	S	.	.			trans	-69.1	133.1	173.3	-172.3	0	0	0	0	110.7	A399	S397-A399 PolarHBondContact O-N 3.08Å; S397-A399 VanDerWaalsContact O-N 3.1Å
398	T	47.7	Very low	59.4	Low	79 Å²	79	70.4 Å²	70.4	49%	0.485	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	-69.3	-0.7	179.3	48.4	0	0	0	0	114	S400	T398-S400 PolarHBondContact O-N 2.91Å
399	A	36.4	Very low	56.7	Low	89 Å²	89	79.3 Å²	79.3	74%	0.736	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-85.4	6	-170.4	0	0	0	0	0	116.1	S397	S397-A399 PolarHBondContact O-N 3.08Å; S397-A399 VanDerWaalsContact O-N 3.1Å
400	S	31.6	Very low	53.6	Low	98 Å²	98	88 Å²	88	69%	0.685	53%	0.527	S	S	*	.	G	3₁₀ helix	trans	-124	35.6	-174.8	78.6	0	0	0	0	116	T398	T398-S400 PolarHBondContact O-N 2.91Å
401	A	29.7	Very low	50.8	Low	100 Å²	100	94.3 Å²	94.3	83%	0.826	57%	0.571	S	S	*	*			trans	-94.5	87.6	160.2	0	0	0	0	0	109
402	G	30.1	Very low	47.5	Very low	70 Å²	70	97.5 Å²	97.5	72%	0.722	60%	0.604	S	S	*	*			trans	-59.6	145.3	174.9	0	0	0	0	0	112.4	S404	G402-S404 PolarHBondContact O-N 3.09Å
403	E	34.4	Very low	44.6	Very low	205 Å²	205	106.1 Å²	106.1	96%	0.958	64%	0.644	S	S	*	*			trans	-42.8	111.3	177	-62.3	172.8	137.2	0	0	113.4
404	S	28.7	Very low	42	Very low	111 Å²	111	113 Å²	113	78%	0.776	68%	0.681	S	S	*	*			trans	-126.6	110.6	149.9	67.7	0	0	0	0	108.3	G402 S406	G402-S404 PolarHBondContact O-N 3.09Å; S404-S406 PolarHBondContact O-N 3.19Å
405	S	30.8	Very low	39.9	Very low	124 Å²	124	121.3 Å²	121.3	87%	0.867	72%	0.717	S	S	*	*			trans	-61.6	119.5	176.6	56.3	0	0	0	0	111.7
406	S	29	Very low	38.4	Very low	112 Å²	112	122 Å²	122	78%	0.783	72%	0.724	S	S	*	*			trans	-155.9	128.4	136.1	60.4	0	0	0	0	109.9	S404 T408	S404-S406 PolarHBondContact O-N 3.19Å; S406-T408 PolarHBondContact O-N 3.42Å
407	K	35.4	Very low	38.2	Very low	211 Å²	211	119.4 Å²	119.4	92%	0.917	71%	0.712	S	S	*	*			trans	-65.7	125.7	178.8	-69.7	173.2	174.4	176.6	0	109.7
408	T	27.6	Very low	38.8	Very low	132 Å²	132	121.7 Å²	121.7	81%	0.81	72%	0.719	S	S	*	*			trans	-150.7	122.3	139.2	-31.1	0	0	0	0	108.4	S406 Q410	S406-T408 PolarHBondContact O-N 3.42Å; T408-Q410 PolarHBondContact O-N 3.07Å; T408-Q410 VanDerWaalsContact O-N 3.08Å
409	H	38.9	Very low	40.2	Very low	198 Å²	198	118.2 Å²	118.2	92%	0.917	70%	0.697	S	S	*	*			trans	-62.9	107.1	173.6	-83.7	-78.4	0	0	0	109.8
410	Q	30.3	Very low	42	Very low	185 Å²	185	114.5 Å²	114.5	86%	0.864	67%	0.665	S	S	*	*			trans	-143.3	129.7	149.3	-94.2	176	19.2	0	0	107	T408 G412	T408-Q410 PolarHBondContact O-N 3.07Å; T408-Q410 VanDerWaalsContact O-N 3.08Å; Q410-G412 PolarHBondContact O-N 2.8Å
411	S	37.6	Very low	44	Very low	132 Å²	132	113.9 Å²	113.9	92%	0.923	66%	0.659	S	S	*	*			trans	-56	96.3	171	49.1	0	0	0	0	109.7
412	G	27.4	Very low	45.8	Very low	68 Å²	68	111.1 Å²	111.1	70%	0.701	63%	0.634	S	S	*	*			trans	-103.4	111.7	171.4	0	0	0	0	0	108.5	Q410	Q410-G412 PolarHBondContact O-N 2.8Å
413	E	35.3	Very low	48.1	Very low	181 Å²	181	107.9 Å²	107.9	85%	0.846	60%	0.6	S	S	*	*			trans	-52.5	137.9	165.9	-68.4	172.6	148.7	0	0	109.6	K415	E413-K415 PolarHBondContact O-N 3.5Å
414	D	36.5	Very low	50.2	Low	143 Å²	143	100.6 Å²	100.6	77%	0.765	57%	0.566	S	S	*	*			trans	-56.3	104.2	175.8	-147.1	1.3	0	0	0	108.7	G416	D414-G416 VanDerWaalsContact C-N 3.28Å; D414-G416 PolarHBondContact O-N 3.42Å
415	K	47.2	Very low	52.5	Low	188 Å²	188	102.5 Å²	102.5	82%	0.817	56%	0.562	S	S	*	*			trans	-81.6	73.2	-173.7	-70.8	-173.1	-180	-178.9	0	110.6	E413	E413-K415 PolarHBondContact O-N 3.5Å
416	G	57.5	Low	54.5	Low	16 Å²	16	99 Å²	99	17%	0.165	54%	0.536	C	S	.	.			trans	-63.9	151.1	168.1	0	0	0	0	0	112.1	D414	D414-G416 VanDerWaalsContact C-N 3.28Å; D414-G416 PolarHBondContact O-N 3.42Å
417	Q	67.8	Low	56.9	Low	27 Å²	27	94.1 Å²	94.1	13%	0.126	50%	0.501	C	S	.	.			trans	-69.3	133.8	164.5	-68.9	-168.3	-19.6	0	0	108	A372 M395	A372-Q417 HydrophobicContact CB-CG 4.39Å; A372-Q417 WeakPolarHBondContact O-CG 3.5Å; M395-Q417 HydrophobicContact CE-CB 4.02Å; M395-Q417 WeakPolarHBondContact CE-O 3.27Å
418	H	74.1	Confident	58.7	Low	87 Å²	87	92.2 Å²	92.2	40%	0.403	49%	0.488	S	S	.	.			trans	-120	144.5	176.8	-63.9	-48	0	0	0	110	H373 P374 S420 E447	H373-H418 PolarHBondContact ND1-O 3.02Å; P374-H418 WeakPolarHBondContact CD-O 3.47Å; H418-S420 PolarHBondContact O-N 3.04Å; H418-E447 IonicContact CE1-OE1 3.27Å; H418-E447 PolarHBondContact CE1-OE1 2.86Å; H418-E447 WeakPolarHBondContact ND1-CG 3.39Å; H418-E447 IonicContact ND1-OE1 2.84Å
419	L	78.1	Confident	60.9	Low	6 Å²	6	89.1 Å²	89.1	3%	0.031	48%	0.483	C	S	.	.			trans	-61.1	125.6	169.1	-67.5	174.5	0	0	0	108.7	P374 L376 V393 M395 I423 F448 L451	P374-L419 HydrophobicContact CG-CD2 3.98Å; L376-L419 HydrophobicContact CD2-CD2 4.29Å; V393-L419 HydrophobicContact CG1-CD2 4.08Å; M395-L419 HydrophobicContact SD-CD2 3.98Å; M395-L419 HydrophobicContact SD-CG 4.11Å; L419-I423 HydrophobicContact CD1-CD1 4.47Å; L419-I423 HydrophobicContact CD2-CD1 4.2Å; L419-F448 HydrophobicContact CD1-CD1 4.05Å; L419-L451 HydrophobicContact CD1-CD1 3.82Å; L419-L451 HydrophobicContact CD1-CD2 3.98Å; L419-L451 HydrophobicContact CD1-CG 3.78Å
420	S	74	Confident	62.9	Low	10 Å²	10	83.1 Å²	83.1	7%	0.07	46%	0.455	C	S	.	.			trans	-58.4	136.4	178.5	172.7	0	0	0	0	110	H362 H418 S422 I423	H362-S420 WeakPolarHBondContact CE1-CB 3.19Å; H418-S420 PolarHBondContact O-N 3.04Å; S420-S422 PolarHBondContact O-N 2.79Å; S420-S422 VanDerWaalsContact O-N 3.1Å; S420-S422 WeakPolarHBondContact OG-CB 3.25Å; S420-S422 PolarHBondContact OG-N 3.13Å; S420-S422 PolarHBondContact OG-OG 3.11Å; S420-I423 VanDerWaalsContact O-CB 3.23Å; S420-I423 WeakPolarHBondContact O-CB 3.35Å; S420-I423 WeakPolarHBondContact O-CG2 3.45Å; S420-I423 PolarHBondContact O-N 3.17Å
421	P	72.6	Confident	65.4	Low	86 Å²	86	81.8 Å²	81.8	56%	0.558	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-26.9	172.2	-25.3	34.1	0	0	0	113.4	I423 Q424	P421-I423 PolarHBondContact O-N 3.32Å; P421-I423 VanDerWaalsContact O-N 3.13Å; P421-Q424 WeakPolarHBondContact O-CB 3.38Å; P421-Q424 WeakPolarHBondContact O-CG 3.37Å; P421-Q424 PolarHBondContact O-N 2.99Å
422	S	69.3	Low	68	Low	42 Å²	42	77.6 Å²	77.6	29%	0.294	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-21.8	174.2	-56.6	0	0	0	0	113.1	S420 Q424 E425 T426	S420-S422 PolarHBondContact O-N 2.79Å; S420-S422 VanDerWaalsContact O-N 3.1Å; S420-S422 WeakPolarHBondContact OG-CB 3.25Å; S420-S422 PolarHBondContact OG-N 3.13Å; S420-S422 PolarHBondContact OG-OG 3.11Å; S422-Q424 PolarHBondContact O-N 2.94Å; S422-E425 WeakPolarHBondContact O-CB 3.46Å; S422-E425 PolarHBondContact O-N 3.25Å; S422-T426 PolarHBondContact O-N 2.82Å; S422-T426 PolarHBondContact O-OG1 3.38Å
423	I	78.4	Confident	71.2	Confident	2 Å²	2	74.6 Å²	74.6	1%	0.01	38%	0.38	C	S	.	.	H	α-helix	trans	-56.4	-32.9	173.2	-158.1	174.6	0	0	0	111	L376 L419 S420 P421 E425 T426 L427 V450 L451	L376-I423 HydrophobicContact CD1-CB 4.25Å; L376-I423 HydrophobicContact CD1-CD1 3.44Å; L376-I423 VanDerWaalsContact CD1-CD1 3.44Å; L376-I423 HydrophobicContact CD1-CG1 3.5Å; L376-I423 VanDerWaalsContact CD1-CG1 3.5Å; L376-I423 HydrophobicContact CD2-CD1 4.26Å; L419-I423 HydrophobicContact CD1-CD1 4.47Å; L419-I423 HydrophobicContact CD2-CD1 4.2Å; S420-I423 VanDerWaalsContact O-CB 3.23Å; S420-I423 WeakPolarHBondContact O-CB 3.35Å; S420-I423 WeakPolarHBondContact O-CG2 3.45Å; S420-I423 PolarHBondContact O-N 3.17Å; P421-I423 PolarHBondContact O-N 3.32Å; P421-I423 VanDerWaalsContact O-N 3.13Å; I423-E425 PolarHBondContact O-N 2.77Å; I423-T426 PolarHBondContact O-N 2.86Å; I423-L427 HydrophobicContact CD1-CD1 4.17Å; I423-L427 HydrophobicContact CG1-CD1 3.78Å; I423-L427 HydrophobicContact CG1-CD2 4.37Å; I423-L427 HydrophobicContact CG1-CG 3.92Å; I423-L427 HydrophobicContact CG2-CD1 4.45Å; I423-L427 WeakPolarHBondContact O-CB 3.31Å; I423-L427 WeakPolarHBondContact O-CG 3.48Å; I423-L427 PolarHBondContact O-N 3.34Å; I423-V450 HydrophobicContact CG2-CG1 3.45Å; I423-V450 VanDerWaalsContact CG2-CG1 3.45Å; I423-L451 HydrophobicContact CD1-CD2 4.27Å
424	Q	76.8	Confident	74.1	Confident	51 Å²	51	66 Å²	66	24%	0.238	34%	0.34	C	S	.	.	H	α-helix	trans	-63.2	-32.4	177.8	-62.8	-170.2	-42.1	0	0	112.2	P421 S422 R428 V450 E454	P421-Q424 WeakPolarHBondContact O-CB 3.38Å; P421-Q424 WeakPolarHBondContact O-CG 3.37Å; P421-Q424 PolarHBondContact O-N 2.99Å; S422-Q424 PolarHBondContact O-N 2.94Å; Q424-R428 WeakPolarHBondContact O-CB 3.16Å; Q424-R428 PolarHBondContact O-N 2.95Å; Q424-V450 HydrophobicContact CG-CG1 3.42Å; Q424-V450 VanDerWaalsContact CG-CG1 3.42Å; Q424-E454 HydrophobicContact CB-CG 4.38Å; Q424-E454 HydrophobicContact CG-CG 4.1Å
425	E	77.1	Confident	77	Confident	151 Å²	151	59.2 Å²	59.2	71%	0.706	30%	0.304	S	S	*	.	H	α-helix	trans	-73.4	-40.6	176.4	-169.5	167	-157.7	0	0	110.7	S422 I423 R428	S422-E425 WeakPolarHBondContact O-CB 3.46Å; S422-E425 PolarHBondContact O-N 3.25Å; I423-E425 PolarHBondContact O-N 2.77Å; E425-R428 WeakPolarHBondContact O-CB 3.37Å; E425-R428 PolarHBondContact O-N 2.89Å
426	T	74.1	Confident	79.3	Confident	51 Å²	51	50.2 Å²	50.2	31%	0.313	27%	0.265	S	S	.	.	H	α-helix	trans	-69	-36.2	177.2	-44.4	0	0	0	0	113.3	L360 L378 S422 I423 R428	L360-T426 HydrophobicContact CD1-CG2 3.39Å; L360-T426 HydrophobicContact CD2-CG2 3.91Å; L360-T426 HydrophobicContact CG-CG2 4.3Å; L378-T426 HydrophobicContact CD1-CG2 4.15Å; S422-T426 PolarHBondContact O-N 2.82Å; S422-T426 PolarHBondContact O-OG1 3.38Å; I423-T426 PolarHBondContact O-N 2.86Å; T426-R428 VanDerWaalsContact C-N 3.27Å
427	L	78.9	Confident	81.2	Confident	10 Å²	10	49.5 Å²	49.5	5%	0.052	26%	0.257	C	S	.	.	H	α-helix	trans	-78	-15.9	177.1	-58.1	173	0	0	0	111.9	V391 I423 G429 L433 V435 L451 L456	V391-L427 HydrophobicContact CG2-CD2 4.23Å; I423-L427 HydrophobicContact CD1-CD1 4.17Å; I423-L427 HydrophobicContact CG1-CD1 3.78Å; I423-L427 HydrophobicContact CG1-CD2 4.37Å; I423-L427 HydrophobicContact CG1-CG 3.92Å; I423-L427 HydrophobicContact CG2-CD1 4.45Å; I423-L427 WeakPolarHBondContact O-CB 3.31Å; I423-L427 WeakPolarHBondContact O-CG 3.48Å; I423-L427 PolarHBondContact O-N 3.34Å; L427-G429 PolarHBondContact O-N 3.41Å; L427-L433 HydrophobicContact CB-CD2 3.77Å; L427-L433 HydrophobicContact CD1-CD2 4.47Å; L427-L433 HydrophobicContact CD2-CD1 3.77Å; L427-L433 HydrophobicContact CD2-CD2 3.42Å; L427-L433 VanDerWaalsContact CD2-CD2 3.42Å; L427-L433 HydrophobicContact CD2-CG 4.15Å; L427-L433 HydrophobicContact CG-CD2 4Å; L427-V435 HydrophobicContact CD2-CG2 3.93Å; L427-L451 HydrophobicContact CD1-CD2 4.02Å; L427-L456 HydrophobicContact CD1-CD1 4.02Å
428	R	73.8	Confident	82.4	Confident	170 Å²	170	48.8 Å²	48.8	64%	0.642	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	109.4	-177.3	177.7	-175.5	-61.1	-101.4	-5.3	110.4	Q424 E425 T426	Q424-R428 WeakPolarHBondContact O-CB 3.16Å; Q424-R428 PolarHBondContact O-N 2.95Å; E425-R428 WeakPolarHBondContact O-CB 3.37Å; E425-R428 PolarHBondContact O-N 2.89Å; T426-R428 VanDerWaalsContact C-N 3.27Å
429	G	74	Confident	83.2	Confident	68 Å²	68	44.8 Å²	44.8	70%	0.701	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	119.8	-23.7	177.1	0	0	0	0	0	112.7	L427 K431	L427-G429 PolarHBondContact O-N 3.41Å; G429-K431 PolarHBondContact O-N 3.3Å
430	E	81	Confident	83.7	Confident	71 Å²	71	44.8 Å²	44.8	33%	0.332	24%	0.236	S	C	.	.			trans	-70.3	120.5	176	-63.5	-55.5	135.6	0	0	110.8	T389 L433	T389-E430 WeakPolarHBondContact CB-OE2 3.29Å; T389-E430 HydrophobicContact CG2-CG 4.12Å; T389-E430 PolarHBondContact OG1-OE2 3.28Å; E430-L433 HydrophobicContact CB-CB 4Å; E430-L433 HydrophobicContact CB-CD1 4.45Å; E430-L433 HydrophobicContact CB-CD2 4.37Å
431	K	82.2	Confident	84.3	Confident	157 Å²	157	45.8 Å²	45.8	68%	0.683	24%	0.243	S	C	*	.	S	Bend	trans	-81.9	-55.6	-176.4	-72	-178.3	-178.6	171.9	0	111.9	G429 S485 S487	G429-K431 PolarHBondContact O-N 3.3Å; K431-S485 PolarHBondContact O-OG 3.29Å; K431-S485 VanDerWaalsContact O-OG 3.05Å; K431-S487 WeakPolarHBondContact O-CB 3.47Å; K431-S487 PolarHBondContact O-OG 3.09Å; K431-S487 VanDerWaalsContact O-OG 3.04Å
432	E	91.9	Very high	85.1	Confident	45 Å²	45	43.7 Å²	43.7	21%	0.21	23%	0.231	C	C	.	.	S	Bend	trans	-104.8	68.2	-174.1	-57.3	-54.9	151.7	0	0	109.1	V386 E387 T389 S487 L488	V386-E432 HydrophobicContact CG1-CB 4.28Å; V386-E432 HydrophobicContact CG1-CG 4.01Å; E387-E432 WeakPolarHBondContact O-CB 3.34Å; T389-E432 PolarHBondContact N-O 3.45Å; E432-S487 WeakPolarHBondContact OE1-CB 3.3Å; E432-L488 HydrophobicContact CB-CD1 4.01Å; E432-L488 WeakPolarHBondContact OE2-CA 3.4Å; E432-L488 WeakPolarHBondContact OE2-CB 3.46Å; E432-L488 VanDerWaalsContact OE2-CD1 3.23Å; E432-L488 WeakPolarHBondContact OE2-CD1 3.48Å; E432-L488 PolarHBondContact OE2-N 3.23Å
433	L	94.5	Very high	86	Confident	5 Å²	5	42 Å²	42	3%	0.026	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	136.7	-173.1	170.9	68	0	0	0	112	T389 V391 L427 E430 V435 L456 S485	T389-L433 HydrophobicContact CG2-CD1 4.07Å; T389-L433 CarbonylContact O-C 3.59Å; T389-L433 WeakPolarHBondContact O-CA 3.48Å; V391-L433 HydrophobicContact CG2-CD1 3.82Å; L427-L433 HydrophobicContact CB-CD2 3.77Å; L427-L433 HydrophobicContact CD1-CD2 4.47Å; L427-L433 HydrophobicContact CD2-CD1 3.77Å; L427-L433 HydrophobicContact CD2-CD2 3.42Å; L427-L433 VanDerWaalsContact CD2-CD2 3.42Å; L427-L433 HydrophobicContact CD2-CG 4.15Å; L427-L433 HydrophobicContact CG-CD2 4Å; E430-L433 HydrophobicContact CB-CB 4Å; E430-L433 HydrophobicContact CB-CD1 4.45Å; E430-L433 HydrophobicContact CB-CD2 4.37Å; L433-V435 HydrophobicContact CD1-CG2 4.26Å; L433-V435 HydrophobicContact CD2-CG2 4.49Å; L433-V435 HydrophobicContact CG-CG2 4.29Å; L433-L456 HydrophobicContact CD2-CD2 4.06Å; L433-L456 HydrophobicContact CG-CD2 4.44Å; L433-S485 PolarHBondContact N-OG 2.83Å; L433-S485 VanDerWaalsContact N-OG 3.11Å; L433-S485 PolarHBondContact O-N 2.83Å; L433-S485 PolarHBondContact O-OG 3.13Å
434	V	96.6	Very high	86.4	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	130.1	168.7	-174.9	0	0	0	0	109.8	L253 L388 T389 V390 V391 L436 I482 W483 I484 L488	L253-V434 HydrophobicContact CD2-CB 4.18Å; L253-V434 HydrophobicContact CD2-CG1 3.72Å; L253-V434 HydrophobicContact CD2-CG2 4.01Å; L388-V434 HydrophobicContact CD1-CG2 3.86Å; L388-V434 HydrophobicContact CG-CG2 4.48Å; T389-V434 PolarHBondContact O-N 3.2Å; V390-V434 WeakPolarHBondContact CA-O 3.38Å; V391-V434 PolarHBondContact N-O 3.21Å; V434-L436 HydrophobicContact CG1-CB 4.27Å; V434-L436 HydrophobicContact CG1-CD2 3.94Å; V434-L436 HydrophobicContact CG1-CG 4.08Å; V434-I482 HydrophobicContact CG1-CG2 3.57Å; V434-W483 CarbonylContact C-O 3.56Å; V434-W483 WeakPolarHBondContact CA-O 3.41Å; V434-I484 HydrophobicContact CG2-CG2 4.42Å; V434-L488 HydrophobicContact CG2-CD2 3.22Å
435	V	96.1	Very high	87	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	117.2	170.1	-172.9	0	0	0	0	108.1	V391 V393 L427 L433 F439 L451 L456 W483	V391-V435 HydrophobicContact CB-CG1 4.34Å; V391-V435 HydrophobicContact CB-CG2 4.23Å; V391-V435 HydrophobicContact CG1-CG1 4.38Å; V391-V435 CarbonylContact O-C 3.56Å; V391-V435 WeakPolarHBondContact O-CA 3.32Å; V393-V435 HydrophobicContact CG2-CG1 3.53Å; L427-V435 HydrophobicContact CD2-CG2 3.93Å; L433-V435 HydrophobicContact CD1-CG2 4.26Å; L433-V435 HydrophobicContact CD2-CG2 4.49Å; L433-V435 HydrophobicContact CG-CG2 4.29Å; V435-F439 HydrophobicContact CG1-CE1 4.41Å; V435-F439 HydrophobicContact CG1-CZ 4.14Å; V435-L451 HydrophobicContact CG1-CD2 4.5Å; V435-L456 HydrophobicContact CG2-CD1 3.81Å; V435-W483 HydrophobicContact CB-CB 4.21Å; V435-W483 PolarHBondContact N-O 3.4Å; V435-W483 WeakPolarHBondContact O-CB 3.27Å; V435-W483 PolarHBondContact O-N 3.29Å
436	L	97.4	Very high	87.5	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	163.5	-172.4	51.2	63.3	0	0	0	111.9	L253 T255 A288 V390 V391 S392 V393 V434 N481 I482	L253-L436 HydrophobicContact CD1-CD2 4.15Å; L253-L436 HydrophobicContact CD2-CD2 3.64Å; L253-L436 HydrophobicContact CG-CD2 3.84Å; T255-L436 HydrophobicContact CG2-CB 4.22Å; A288-L436 HydrophobicContact CB-CD1 3.22Å; A288-L436 HydrophobicContact CB-CD2 4.25Å; A288-L436 HydrophobicContact CB-CG 4.38Å; V390-L436 HydrophobicContact CG1-CD1 4.08Å; V390-L436 HydrophobicContact CG1-CD2 3.87Å; V390-L436 HydrophobicContact CG1-CG 3.99Å; V391-L436 PolarHBondContact O-N 3.32Å; S392-L436 CarbonylContact C-O 3.56Å; S392-L436 WeakPolarHBondContact CA-O 3.07Å; V393-L436 PolarHBondContact N-O 3.45Å; V434-L436 HydrophobicContact CG1-CB 4.27Å; V434-L436 HydrophobicContact CG1-CD2 3.94Å; V434-L436 HydrophobicContact CG1-CG 4.08Å; L436-N481 WeakPolarHBondContact CA-O 3.29Å; L436-I482 HydrophobicContact CB-CB 4.37Å; L436-I482 HydrophobicContact CB-CG1 3.91Å; L436-I482 HydrophobicContact CB-CG2 4.4Å
437	G	95.5	Very high	88	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	133.3	-159.5	175.9	0	0	0	0	0	113.7	T255 V393 F439 D480 N481	T255-G437 VanDerWaalsContact OG1-CA 3.29Å; T255-G437 WeakPolarHBondContact OG1-CA 3.36Å; T255-G437 PolarHBondContact OG1-N 3.03Å; V393-G437 CarbonylContact O-C 3.48Å; V393-G437 WeakPolarHBondContact O-CA 3.48Å; G437-F439 VanDerWaalsContact O-CD2 3.24Å; G437-F439 WeakPolarHBondContact O-CD2 3.31Å; G437-F439 WeakPolarHBondContact O-CE2 3.25Å; G437-D480 WeakPolarHBondContact O-CA 3.48Å; G437-N481 PolarHBondContact N-O 3Å; G437-N481 PolarHBondContact O-N 3Å; G437-N481 VanDerWaalsContact O-N 3.14Å
438	H	92.9	Very high	88.5	Confident	12 Å²	12	42 Å²	42	6%	0.056	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	113.7	177.7	177.3	59.2	0	0	0	109.4	V393 H394 M395 D480 H521	V393-H438 PolarHBondContact O-N 3.24Å; H394-H438 WeakPolarHBondContact CA-O 3.37Å; H394-H438 AromaticContact CD2-CD2 3.85Å; M395-H438 PolarHBondContact N-O 2.86Å; M395-H438 PolarHBondContact O-CD2 3.25Å; M395-H438 PolarHBondContact O-NE2 2.82Å; H438-D480 IonicContact CG-OD1 3.58Å; H438-D480 IonicContact ND1-OD1 2.83Å; H438-D480 PolarHBondContact ND1-OD1 3.09Å; H438-H521 AromaticContact CE1-CE1 3.41Å; H438-H521 PolarHBondContact CE1-CE1 3.44Å; H438-H521 VanDerWaalsContact CE1-CE1 3.41Å; H438-H521 AromaticContact ND1-CE1 3.3Å; H438-H521 PolarHBondContact ND1-CE1 3.31Å; H438-H521 VanDerWaalsContact ND1-CE1 3.3Å; H438-H521 AromaticContact ND1-ND1 3.87Å
439	F	91.7	Very high	89.2	Confident	4 Å²	4	37.1 Å²	37.1	2%	0.018	21%	0.214	C	C	.	.			trans	-97.1	-8	-175.7	-71.8	-88.1	0	0	0	113.1	V393 M395 V435 G437 S441 F448 L451 L479 N481 W483	V393-F439 HydrophobicContact CB-CE1 4.24Å; V393-F439 HydrophobicContact CB-CZ 4.36Å; V393-F439 HydrophobicContact CG1-CD1 4.3Å; V393-F439 HydrophobicContact CG1-CE1 4.2Å; V393-F439 HydrophobicContact CG2-CE1 4.2Å; V393-F439 HydrophobicContact CG2-CZ 4.3Å; M395-F439 HydrophobicContact SD-CD1 4.44Å; V435-F439 HydrophobicContact CG1-CE1 4.41Å; V435-F439 HydrophobicContact CG1-CZ 4.14Å; G437-F439 VanDerWaalsContact O-CD2 3.24Å; G437-F439 WeakPolarHBondContact O-CD2 3.31Å; G437-F439 WeakPolarHBondContact O-CE2 3.25Å; F439-S441 PolarHBondContact O-N 3.23Å; F439-F448 HydrophobicContact CB-CE1 3.95Å; F439-F448 HydrophobicContact CB-CE2 4.25Å; F439-F448 HydrophobicContact CB-CZ 3.58Å; F439-F448 HydrophobicContact CD1-CD1 4.01Å; F439-F448 AromaticContact CD1-CE1 3.61Å; F439-F448 HydrophobicContact CD1-CE1 3.61Å; F439-F448 HydrophobicContact CD1-CZ 4.12Å; F439-F448 HydrophobicContact CG-CE1 4.21Å; F439-F448 HydrophobicContact CG-CZ 4.27Å; F439-F448 WeakPolarHBondContact O-CZ 3.47Å; F439-L451 HydrophobicContact CE1-CD1 3.94Å; F439-L479 PolarHBondContact N-O 3.3Å; F439-N481 HydrophobicContact CD2-CB 3.94Å; F439-N481 HydrophobicContact CE2-CB 3.93Å; F439-W483 AromaticContact CE1-CD1 3.98Å; F439-W483 AromaticContact CE1-NE1 3.78Å; F439-W483 AromaticContact CE2-CD1 3.72Å; F439-W483 AromaticContact CE2-NE1 3.72Å; F439-W483 AromaticContact CZ-CD1 3.34Å; F439-W483 AromaticContact CZ-NE1 3.49Å
440	G	88.4	Confident	89.9	Confident	5 Å²	5	35 Å²	35	5%	0.052	19%	0.188	C	C	.	.	S	Bend	trans	72.1	-15.5	178	0	0	0	0	0	115.8	L479	G440-L479 WeakPolarHBondContact O-CD2 3.25Å
441	S	87.6	Confident	90.3	Very high	31 Å²	31	31.7 Å²	31.7	22%	0.217	17%	0.172	C	C	.	.	S	Bend	trans	-141.7	163.1	-175.8	-64.1	0	0	0	0	111.7	F439 E447	F439-S441 PolarHBondContact O-N 3.23Å; S441-E447 VanDerWaalsContact CB-OE2 3.31Å; S441-E447 WeakPolarHBondContact CB-OE2 3.44Å; S441-E447 PolarHBondContact OG-OE2 3.43Å
442	S	88.1	Confident	90.8	Very high	43 Å²	43	27.9 Å²	27.9	30%	0.301	15%	0.154	S	C	.	.			trans	-62.1	145.4	175.3	170	0	0	0	0	112.6	Q444 S445 F448 S462	S442-Q444 PolarHBondContact O-N 3.14Å; S442-Q444 PolarHBondContact OG-OE1 2.87Å; S442-S445 WeakPolarHBondContact O-CB 3.29Å; S442-S445 PolarHBondContact O-N 3.39Å; S442-F448 WeakPolarHBondContact O-CD2 3.37Å; S442-F448 VanDerWaalsContact O-CE2 3.24Å; S442-F448 WeakPolarHBondContact O-CE2 3.38Å; S442-S462 WeakPolarHBondContact OG-CB 3.46Å
443	P	88.1	Confident	90.7	Very high	6 Å²	6	32.8 Å²	32.8	4%	0.039	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-16.8	180	23	-34.9	0	0	0	115.5	R452 P458 W483	P443-R452 PolarHBondContact O-NH1 3.02Å; P443-P458 HydrophobicContact CB-CB 4.07Å; P443-P458 HydrophobicContact CB-CG 4.33Å; P443-W483 HydrophobicContact CB-CH2 4.34Å; P443-W483 HydrophobicContact CB-CZ2 3.89Å
444	Q	87.5	Confident	90.4	Very high	112 Å²	112	35.3 Å²	35.3	52%	0.523	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-3	172.6	-58.9	84.9	28.2	0	0	114.4	S442 S446 S462	S442-Q444 PolarHBondContact O-N 3.14Å; S442-Q444 PolarHBondContact OG-OE1 2.87Å; Q444-S446 PolarHBondContact O-N 3.46Å; Q444-S462 VanDerWaalsContact CD-CB 3.47Å; Q444-S462 VanDerWaalsContact NE2-CB 3.28Å; Q444-S462 PolarHBondContact NE2-OG 2.91Å; Q444-S462 PolarHBondContact OE1-OG 2.98Å
445	S	88.6	Confident	90.1	Very high	30 Å²	30	41.3 Å²	41.3	21%	0.21	21%	0.212	C	C	.	.	S	Bend	trans	-53.5	138.9	173.1	-178.8	0	0	0	0	110.5	S442 E447 F448 R452	S442-S445 WeakPolarHBondContact O-CB 3.29Å; S442-S445 PolarHBondContact O-N 3.39Å; S445-E447 PolarHBondContact O-N 2.98Å; S445-E447 WeakPolarHBondContact OG-CB 3.01Å; S445-E447 VanDerWaalsContact OG-CG 3.23Å; S445-E447 WeakPolarHBondContact OG-CG 3.45Å; S445-E447 PolarHBondContact OG-N 3.44Å; S445-E447 PolarHBondContact OG-OE2 2.88Å; S445-E447 VanDerWaalsContact OG-OE2 3.09Å; S445-F448 PolarHBondContact O-N 3.33Å; S445-F448 VanDerWaalsContact O-N 3.13Å; S445-R452 PolarHBondContact O-NH1 3.44Å; S445-R452 PolarHBondContact O-NH2 3.26Å
446	S	87.9	Confident	89.9	Confident	87 Å²	87	41.7 Å²	41.7	61%	0.608	21%	0.214	S	C	*	.	G	3₁₀ helix	trans	-60.5	-21.4	175.9	50.1	0	0	0	0	112.2	Q444 F448 D449	Q444-S446 PolarHBondContact O-N 3.46Å; S446-F448 PolarHBondContact O-N 2.91Å; S446-F448 VanDerWaalsContact O-N 3.1Å; S446-D449 VanDerWaalsContact O-CB 3.26Å; S446-D449 WeakPolarHBondContact O-CB 3.37Å; S446-D449 PolarHBondContact O-N 3.05Å
447	E	85.5	Confident	89.7	Confident	34 Å²	34	43.8 Å²	43.8	16%	0.159	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-55.6	-27.9	174.1	-58.7	176.3	144.1	0	0	112.7	H418 S441 S445	H418-E447 IonicContact CE1-OE1 3.27Å; H418-E447 PolarHBondContact CE1-OE1 2.86Å; H418-E447 WeakPolarHBondContact ND1-CG 3.39Å; H418-E447 IonicContact ND1-OE1 2.84Å; S441-E447 VanDerWaalsContact CB-OE2 3.31Å; S441-E447 WeakPolarHBondContact CB-OE2 3.44Å; S441-E447 PolarHBondContact OG-OE2 3.43Å; S445-E447 PolarHBondContact O-N 2.98Å; S445-E447 WeakPolarHBondContact OG-CB 3.01Å; S445-E447 VanDerWaalsContact OG-CG 3.23Å; S445-E447 WeakPolarHBondContact OG-CG 3.45Å; S445-E447 PolarHBondContact OG-N 3.44Å; S445-E447 PolarHBondContact OG-OE2 2.88Å; S445-E447 VanDerWaalsContact OG-OE2 3.09Å
448	F	89.2	Confident	89.8	Confident	1 Å²	1	46.2 Å²	46.2	0%	0.004	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-99.3	11.7	-179.9	-47.7	-51.1	0	0	0	113.4	M395 L419 F439 S442 S445 S446 V450 L451 R452 W483	M395-F448 HydrophobicContact SD-CE1 3.98Å; L419-F448 HydrophobicContact CD1-CD1 4.05Å; F439-F448 HydrophobicContact CB-CE1 3.95Å; F439-F448 HydrophobicContact CB-CE2 4.25Å; F439-F448 HydrophobicContact CB-CZ 3.58Å; F439-F448 HydrophobicContact CD1-CD1 4.01Å; F439-F448 AromaticContact CD1-CE1 3.61Å; F439-F448 HydrophobicContact CD1-CE1 3.61Å; F439-F448 HydrophobicContact CD1-CZ 4.12Å; F439-F448 HydrophobicContact CG-CE1 4.21Å; F439-F448 HydrophobicContact CG-CZ 4.27Å; F439-F448 WeakPolarHBondContact O-CZ 3.47Å; S442-F448 WeakPolarHBondContact O-CD2 3.37Å; S442-F448 VanDerWaalsContact O-CE2 3.24Å; S442-F448 WeakPolarHBondContact O-CE2 3.38Å; S445-F448 PolarHBondContact O-N 3.33Å; S445-F448 VanDerWaalsContact O-N 3.13Å; S446-F448 PolarHBondContact O-N 2.91Å; S446-F448 VanDerWaalsContact O-N 3.1Å; F448-V450 PolarHBondContact O-N 3.33Å; F448-L451 HydrophobicContact CB-CD1 4.46Å; F448-L451 HydrophobicContact CD1-CD1 4.47Å; F448-L451 PolarHBondContact O-N 3.24Å; F448-L451 VanDerWaalsContact O-N 3.15Å; F448-R452 PolarHBondContact O-N 3.29Å; F448-R452 VanDerWaalsContact O-N 3.14Å; F448-W483 HydrophobicContact CB-CH2 3.86Å; F448-W483 HydrophobicContact CB-CZ2 3.84Å; F448-W483 HydrophobicContact CD2-CZ2 4.3Å; F448-W483 HydrophobicContact CG-CZ2 4.12Å
449	D	88.6	Confident	89.9	Confident	68 Å²	68	46.9 Å²	46.9	36%	0.364	25%	0.248	S	C	.	.	H	α-helix	trans	-59.7	-29.9	172.3	-81.7	-30.7	0	0	0	112	S446 L451 R452 K453	S446-D449 VanDerWaalsContact O-CB 3.26Å; S446-D449 WeakPolarHBondContact O-CB 3.37Å; S446-D449 PolarHBondContact O-N 3.05Å; D449-L451 VanDerWaalsContact C-N 3.33Å; D449-L451 PolarHBondContact O-N 3.19Å; D449-R452 VanDerWaalsContact CG-NH2 3.3Å; D449-R452 PolarHBondContact O-N 3.18Å; D449-R452 IonicContact OD1-CZ 3.57Å; D449-R452 IonicContact OD1-NE 3.63Å; D449-R452 PolarHBondContact OD1-NE 2.73Å; D449-R452 IonicContact OD1-NH2 3.53Å; D449-R452 PolarHBondContact OD1-NH2 2.89Å; D449-R452 IonicContact OD2-NH2 2.61Å; D449-K453 WeakPolarHBondContact O-CB 3.45Å; D449-K453 WeakPolarHBondContact O-CG 3.25Å; D449-K453 PolarHBondContact O-N 3.39Å
450	V	88.3	Confident	90	Very high	25 Å²	25	46.7 Å²	46.7	15%	0.152	25%	0.247	C	C	.	.	H	α-helix	trans	-60.5	-44	176.2	-175.7	0	0	0	0	111	I423 Q424 F448 E454	I423-V450 HydrophobicContact CG2-CG1 3.45Å; I423-V450 VanDerWaalsContact CG2-CG1 3.45Å; Q424-V450 HydrophobicContact CG-CG1 3.42Å; Q424-V450 VanDerWaalsContact CG-CG1 3.42Å; F448-V450 PolarHBondContact O-N 3.33Å; V450-E454 PolarHBondContact O-N 3.18Å
451	L	90.8	Very high	90.1	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-68.7	-41.7	176.8	-58.3	180	0	0	0	111.4	L419 I423 L427 V435 F439 F448 D449 K453 E454 K455 L456 W483	L419-L451 HydrophobicContact CD1-CD1 3.82Å; L419-L451 HydrophobicContact CD1-CD2 3.98Å; L419-L451 HydrophobicContact CD1-CG 3.78Å; I423-L451 HydrophobicContact CD1-CD2 4.27Å; L427-L451 HydrophobicContact CD1-CD2 4.02Å; V435-L451 HydrophobicContact CG1-CD2 4.5Å; F439-L451 HydrophobicContact CE1-CD1 3.94Å; F448-L451 HydrophobicContact CB-CD1 4.46Å; F448-L451 HydrophobicContact CD1-CD1 4.47Å; F448-L451 PolarHBondContact O-N 3.24Å; F448-L451 VanDerWaalsContact O-N 3.15Å; D449-L451 VanDerWaalsContact C-N 3.33Å; D449-L451 PolarHBondContact O-N 3.19Å; L451-K453 PolarHBondContact O-N 3.37Å; L451-E454 CarbonylContact O-C 3.5Å; L451-E454 PolarHBondContact O-N 3.3Å; L451-K455 PolarHBondContact O-N 3.19Å; L451-L456 HydrophobicContact CB-CB 4.3Å; L451-L456 HydrophobicContact CB-CD1 4.01Å; L451-L456 HydrophobicContact CD2-CD1 3.71Å; L451-L456 HydrophobicContact CG-CD1 4.39Å; L451-L456 WeakPolarHBondContact O-CB 3.44Å; L451-L456 PolarHBondContact O-N 3.41Å; L451-L456 VanDerWaalsContact O-N 3.08Å; L451-W483 HydrophobicContact CB-CD2 4.45Å; L451-W483 HydrophobicContact CB-CE3 4.07Å; L451-W483 HydrophobicContact CB-CZ3 4.24Å; L451-W483 HydrophobicContact CD1-CD2 3.85Å; L451-W483 HydrophobicContact CD1-CE3 4.29Å; L451-W483 HydrophobicContact CD1-CG 4.05Å; L451-W483 HydrophobicContact CD1-CZ2 4.37Å
452	R	91.1	Very high	90	Very high	78 Å²	78	52.5 Å²	52.5	29%	0.294	28%	0.277	S	S	.	.	H	α-helix	trans	-64.3	-37.9	177.5	-71.3	-173.9	-74.2	-88.9	7.5	112.7	P443 S445 F448 D449 E454 K455 W483	P443-R452 PolarHBondContact O-NH1 3.02Å; S445-R452 PolarHBondContact O-NH1 3.44Å; S445-R452 PolarHBondContact O-NH2 3.26Å; F448-R452 PolarHBondContact O-N 3.29Å; F448-R452 VanDerWaalsContact O-N 3.14Å; D449-R452 VanDerWaalsContact CG-NH2 3.3Å; D449-R452 PolarHBondContact O-N 3.18Å; D449-R452 IonicContact OD1-CZ 3.57Å; D449-R452 IonicContact OD1-NE 3.63Å; D449-R452 PolarHBondContact OD1-NE 2.73Å; D449-R452 IonicContact OD1-NH2 3.53Å; D449-R452 PolarHBondContact OD1-NH2 2.89Å; D449-R452 IonicContact OD2-NH2 2.61Å; R452-E454 VanDerWaalsContact C-N 3.28Å; R452-E454 PolarHBondContact O-N 3.2Å; R452-K455 WeakPolarHBondContact O-CA 3.43Å; R452-K455 PolarHBondContact O-N 3.46Å; R452-W483 HydrophobicContact CG-CH2 4.34Å; R452-W483 HydrophobicContact CG-CZ3 3.92Å
453	K	89.4	Confident	90	Very high	147 Å²	147	55 Å²	55	64%	0.639	29%	0.294	S	S	*	.	H	α-helix	trans	-61.4	-37.5	174.8	-77.4	170.3	-177	175.4	0	111.6	D449 L451 K455	D449-K453 WeakPolarHBondContact O-CB 3.45Å; D449-K453 WeakPolarHBondContact O-CG 3.25Å; D449-K453 PolarHBondContact O-N 3.39Å; L451-K453 PolarHBondContact O-N 3.37Å; K453-K455 PolarHBondContact O-N 3.42Å
454	E	88.4	Confident	90.2	Very high	59 Å²	59	58 Å²	58	28%	0.276	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	11.8	171	-63.8	-51.9	135	0	0	113.6	Q424 V450 L451 R452 L456	Q424-E454 HydrophobicContact CB-CG 4.38Å; Q424-E454 HydrophobicContact CG-CG 4.1Å; V450-E454 PolarHBondContact O-N 3.18Å; L451-E454 CarbonylContact O-C 3.5Å; L451-E454 PolarHBondContact O-N 3.3Å; R452-E454 VanDerWaalsContact C-N 3.28Å; R452-E454 PolarHBondContact O-N 3.2Å; E454-L456 PolarHBondContact O-N 3.13Å
455	K	90.1	Very high	90.5	Very high	126 Å²	126	56.5 Å²	56.5	55%	0.548	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.2	24.2	176.3	-57	165.4	176.3	170	0	113.5	L451 R452 K453	L451-K455 PolarHBondContact O-N 3.19Å; R452-K455 WeakPolarHBondContact O-CA 3.43Å; R452-K455 PolarHBondContact O-N 3.46Å; K453-K455 PolarHBondContact O-N 3.42Å
456	L	93.1	Very high	90.8	Very high	8 Å²	8	55.1 Å²	55.1	4%	0.042	29%	0.29	C	S	.	.			trans	-73.4	139.4	169.4	-63.4	172.9	0	0	0	109.9	L427 L433 V435 L451 E454 W483 I484	L427-L456 HydrophobicContact CD1-CD1 4.02Å; L433-L456 HydrophobicContact CD2-CD2 4.06Å; L433-L456 HydrophobicContact CG-CD2 4.44Å; V435-L456 HydrophobicContact CG2-CD1 3.81Å; L451-L456 HydrophobicContact CB-CB 4.3Å; L451-L456 HydrophobicContact CB-CD1 4.01Å; L451-L456 HydrophobicContact CD2-CD1 3.71Å; L451-L456 HydrophobicContact CG-CD1 4.39Å; L451-L456 WeakPolarHBondContact O-CB 3.44Å; L451-L456 PolarHBondContact O-N 3.41Å; L451-L456 VanDerWaalsContact O-N 3.08Å; E454-L456 PolarHBondContact O-N 3.13Å; L456-W483 HydrophobicContact CB-CB 4.25Å; L456-W483 HydrophobicContact CB-CE3 4.18Å; L456-I484 WeakPolarHBondContact CA-O 3.45Å
457	C	93.9	Very high	91.2	Very high	44 Å²	44	52.1 Å²	52.1	30%	0.297	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	127.8	179.1	-61.7	0	0	0	0	109.9	W483 I484	C457-W483 CarbonylContact O-C 3.43Å; C457-W483 VanDerWaalsContact O-CA 3.31Å; C457-W483 WeakPolarHBondContact O-CA 3.24Å; C457-I484 PolarHBondContact N-O 3.09Å; C457-I484 PolarHBondContact O-N 3.29Å
458	P	96.1	Very high	91.6	Very high	50 Å²	50	51 Å²	51	33%	0.325	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	142.1	172.5	29.9	-29.2	0	0	0	109.8	P443 W483	P443-P458 HydrophobicContact CB-CB 4.07Å; P443-P458 HydrophobicContact CB-CG 4.33Å; P458-W483 HydrophobicContact CB-CD2 3.85Å; P458-W483 HydrophobicContact CB-CE3 3.89Å; P458-W483 HydrophobicContact CB-CH2 3.91Å; P458-W483 HydrophobicContact CB-CZ2 3.88Å; P458-W483 HydrophobicContact CB-CZ3 3.93Å; P458-W483 VanDerWaalsContact CD-CZ3 3.42Å; P458-W483 HydrophobicContact CG-CE3 4.13Å; P458-W483 HydrophobicContact CG-CH2 3.85Å; P458-W483 HydrophobicContact CG-CZ2 4.32Å; P458-W483 HydrophobicContact CG-CZ3 3.76Å
459	L	95.9	Very high	91.8	Very high	26 Å²	26	53.1 Å²	53.1	14%	0.136	28%	0.277	C	S	.	.	S	Bend	trans	-93.5	-28.8	178.6	-66.4	-174.2	0	0	0	113	N481 I482 I484 Y492 C496 A526 F528	L459-N481 PolarHBondContact N-OD1 3.03Å; L459-I482 HydrophobicContact CB-CB 4.47Å; L459-I482 WeakPolarHBondContact CB-O 3.47Å; L459-I482 HydrophobicContact CD1-CB 4.17Å; L459-I482 HydrophobicContact CD1-CG2 3.88Å; L459-I482 WeakPolarHBondContact CG-O 3.39Å; L459-I482 PolarHBondContact N-O 3.06Å; L459-I484 HydrophobicContact CD1-CD1 4.48Å; L459-I484 HydrophobicContact CD1-CG2 3.81Å; L459-I484 HydrophobicContact CD2-CD1 3.74Å; L459-I484 HydrophobicContact CD2-CG1 3.92Å; L459-I484 HydrophobicContact CG-CD1 4.43Å; L459-I484 HydrophobicContact CG-CG1 4.28Å; L459-I484 HydrophobicContact CG-CG2 4.18Å; L459-Y492 HydrophobicContact CD1-CD2 4.25Å; L459-Y492 HydrophobicContact CD1-CE2 3.8Å; L459-Y492 HydrophobicContact CD2-CD1 4.25Å; L459-Y492 HydrophobicContact CD2-CE1 3.76Å; L459-Y492 HydrophobicContact CD2-CE2 4.17Å; L459-C496 HydrophobicContact CB-CB 4.09Å; L459-A526 HydrophobicContact CD1-CB 3.53Å; L459-F528 HydrophobicContact CD1-CZ 4.48Å
460	I	94.6	Very high	91.8	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.005	27%	0.274	C	S	.	.	S	Bend	trans	-93	128.3	174.3	-62.3	-61.4	0	0	0	109.6	Q464 T466 N481 C496 V498 V524	I460-Q464 HydrophobicContact CG2-CB 4.07Å; I460-Q464 HydrophobicContact CG2-CG 4.42Å; I460-T466 HydrophobicContact CG2-CG2 4.01Å; I460-N481 PolarHBondContact N-OD1 3.08Å; I460-N481 VanDerWaalsContact N-OD1 3.07Å; I460-N481 PolarHBondContact O-ND2 3.33Å; I460-C496 WeakPolarHBondContact CD1-SG 3.14Å; I460-V498 HydrophobicContact CD1-CG2 3.77Å; I460-V524 HydrophobicContact CD1-CG1 3.81Å; I460-V524 HydrophobicContact CG1-CG1 3.47Å; I460-V524 VanDerWaalsContact CG1-CG1 3.47Å; I460-V524 HydrophobicContact CG1-CG2 4.47Å
461	L	89.2	Confident	91.8	Very high	114 Å²	114	60.7 Å²	60.7	60%	0.597	30%	0.303	S	S	*	.			trans	-78.1	149.8	174.4	-59.7	177.2	0	0	0	109.9	S463 Q464	L461-S463 PolarHBondContact O-N 3.17Å; L461-Q464 WeakPolarHBondContact O-CB 3.48Å; L461-Q464 PolarHBondContact O-N 3.29Å
462	S	86.1	Confident	91.8	Very high	44 Å²	44	62.8 Å²	62.8	31%	0.308	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-18.3	-179.7	51.5	0	0	0	0	115.2	S442 Q444 Q464	S442-S462 WeakPolarHBondContact OG-CB 3.46Å; Q444-S462 VanDerWaalsContact CD-CB 3.47Å; Q444-S462 VanDerWaalsContact NE2-CB 3.28Å; Q444-S462 PolarHBondContact NE2-OG 2.91Å; Q444-S462 PolarHBondContact OE1-OG 2.98Å; S462-Q464 PolarHBondContact O-N 3.26Å
463	S	87.4	Confident	91.7	Very high	94 Å²	94	62.4 Å²	62.4	66%	0.657	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-13.1	170.7	53.4	0	0	0	0	112.8	L461	L461-S463 PolarHBondContact O-N 3.17Å
464	Q	91.6	Very high	91.7	Very high	71 Å²	71	62.1 Å²	62.1	33%	0.332	33%	0.326	S	S	.	.	S	Bend	trans	-101.3	112.6	-179.7	-171.2	173.4	21.2	0	0	109.6	I460 L461 S462 C478 V498	I460-Q464 HydrophobicContact CG2-CB 4.07Å; I460-Q464 HydrophobicContact CG2-CG 4.42Å; L461-Q464 WeakPolarHBondContact O-CB 3.48Å; L461-Q464 PolarHBondContact O-N 3.29Å; S462-Q464 PolarHBondContact O-N 3.26Å; Q464-C478 WeakPolarHBondContact O-CB 3.48Å; Q464-C478 PolarHBondContact O-SG 3.17Å; Q464-V498 HydrophobicContact CG-CG2 3.89Å
465	F	94.9	Very high	91.8	Very high	80 Å²	80	59.6 Å²	59.6	35%	0.351	32%	0.316	S	S	.	.			trans	-68.6	150	176.7	-53.6	-45.5	0	0	0	110.5	Q474 G475 T476 L477 R500	F465-Q474 WeakPolarHBondContact CD2-O 3.36Å; F465-G475 VanDerWaalsContact CD2-C 3.45Å; F465-G475 WeakPolarHBondContact CD2-O 3.35Å; F465-T476 WeakPolarHBondContact CD1-O 3.29Å; F465-T476 VanDerWaalsContact CE1-O 3.24Å; F465-T476 WeakPolarHBondContact CE1-O 3.37Å; F465-L477 CarbonylContact C-O 3.42Å; F465-L477 VanDerWaalsContact CA-O 3.28Å; F465-L477 WeakPolarHBondContact CA-O 3.39Å; F465-R500 PolarHBondContact O-NH2 3.14Å
466	T	95.8	Very high	91.9	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	31%	0.314	C	S	.	.			trans	-122.5	-1.2	176.8	65.6	0	0	0	0	112.6	I460 L477 L479 D480 V498 C522 V524	I460-T466 HydrophobicContact CG2-CG2 4.01Å; T466-L477 PolarHBondContact N-O 2.93Å; T466-L479 PolarHBondContact OG1-N 3.4Å; T466-D480 WeakPolarHBondContact CB-OD2 3.13Å; T466-D480 HydrophobicContact CG2-CB 4.19Å; T466-D480 WeakPolarHBondContact CG2-O 3.47Å; T466-D480 PolarHBondContact OG1-N 3.33Å; T466-D480 PolarHBondContact OG1-OD2 3.19Å; T466-V498 HydrophobicContact CG2-CG2 4.1Å; T466-C522 VanDerWaalsContact O-CB 3.25Å; T466-C522 WeakPolarHBondContact O-CB 3.24Å; T466-C522 PolarHBondContact O-N 3.45Å; T466-V524 HydrophobicContact CG2-CG2 4.02Å
467	N	95.1	Very high	91.8	Very high	25 Å²	25	61.1 Å²	61.1	13%	0.134	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-95.7	164.9	170.5	73.1	-33.5	0	0	0	112.6	G475 T476 L477 R500 D520	N467-G475 VanDerWaalsContact O-CA 3.24Å; N467-G475 WeakPolarHBondContact O-CA 3.42Å; N467-G475 VanDerWaalsContact OD1-CA 3.23Å; N467-G475 WeakPolarHBondContact OD1-CA 3.28Å; N467-T476 PolarHBondContact ND2-OG1 2.86Å; N467-T476 VanDerWaalsContact ND2-OG1 3.15Å; N467-T476 PolarHBondContact OD1-N 3.16Å; N467-L477 PolarHBondContact N-O 3.3Å; N467-L477 PolarHBondContact OD1-N 3.02Å; N467-L477 PolarHBondContact OD1-O 2.91Å; N467-L477 VanDerWaalsContact OD1-O 3.1Å; N467-R500 PolarHBondContact O-NH1 2.76Å; N467-R500 PolarHBondContact O-NH2 2.99Å; N467-D520 CarbonylContact C-O 3.56Å; N467-D520 WeakPolarHBondContact CA-O 3.39Å; N467-D520 VanDerWaalsContact CB-O 3.31Å; N467-D520 WeakPolarHBondContact CB-O 3.28Å
468	I	94.6	Very high	91.7	Very high	11 Å²	11	59.5 Å²	59.5	6%	0.056	32%	0.322	C	S	.	.			trans	-149.9	150.3	177.1	-170.5	165.8	0	0	0	110.9	L503 V517 D520	I468-L503 HydrophobicContact CD1-CB 4.47Å; I468-L503 HydrophobicContact CD1-CD1 4.18Å; I468-L503 HydrophobicContact CG2-CD1 4.18Å; I468-V517 HydrophobicContact CG1-CG1 4.36Å; I468-V517 HydrophobicContact CG2-CG1 4.26Å; I468-D520 PolarHBondContact N-O 3.42Å; I468-D520 WeakPolarHBondContact O-CA 3.48Å
469	S	93.4	Very high	91.6	Very high	45 Å²	45	58.1 Å²	58.1	32%	0.315	31%	0.312	S	S	.	.			trans	-148	164.6	163.3	62.9	0	0	0	0	109.9	R471 C472 P473	S469-R471 PolarHBondContact O-N 3.47Å; S469-C472 PolarHBondContact N-O 3.15Å; S469-C472 CarbonylContact O-C 3.52Å; S469-C472 PolarHBondContact O-N 3.47Å; S469-C472 WeakPolarHBondContact OG-CB 3.46Å; S469-C472 PolarHBondContact OG-N 2.93Å; S469-P473 WeakPolarHBondContact O-CA 3.49Å
470	T	88.1	Confident	91.6	Very high	48 Å²	48	57 Å²	57	29%	0.294	31%	0.306	S	S	.	.	S	Bend	trans	-60.2	-30.2	174.6	53.9	0	0	0	0	112.6	T504 D510 V517	T470-T504 HydrophobicContact CG2-CG2 4.48Å; T470-D510 VanDerWaalsContact CB-OD2 3.27Å; T470-D510 WeakPolarHBondContact CB-OD2 3.39Å; T470-D510 VanDerWaalsContact CG2-OD2 3.28Å; T470-D510 WeakPolarHBondContact CG2-OD2 3.28Å; T470-D510 PolarHBondContact OG1-OD2 2.86Å; T470-V517 HydrophobicContact CG2-CG1 4.41Å
471	R	88.8	Confident	91.7	Very high	203 Å²	203	57.1 Å²	57.1	77%	0.766	31%	0.306	S	S	*	.	S	Bend	trans	-85.8	-25.9	178.4	-59.5	-178.6	-172.5	-106.5	-5.3	113.5	S469	S469-R471 PolarHBondContact O-N 3.47Å
472	C	89.7	Confident	92.1	Very high	45 Å²	45	51.7 Å²	51.7	30%	0.304	28%	0.278	S	S	.	.			trans	-135.4	78.4	178	-167.3	0	0	0	0	110.7	S469 Q474 G475	S469-C472 PolarHBondContact N-O 3.15Å; S469-C472 CarbonylContact O-C 3.52Å; S469-C472 PolarHBondContact O-N 3.47Å; S469-C472 WeakPolarHBondContact OG-CB 3.46Å; S469-C472 PolarHBondContact OG-N 2.93Å; C472-Q474 PolarHBondContact O-N 3.38Å; C472-G475 PolarHBondContact O-N 3.02Å; C472-G475 VanDerWaalsContact O-N 3.12Å
473	P	89.3	Confident	92.6	Very high	70 Å²	70	49.6 Å²	49.6	46%	0.455	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-24.7	-175.9	-24.9	35.7	0	0	0	114.2	S469 G475 R500	S469-P473 WeakPolarHBondContact O-CA 3.49Å; P473-G475 VanDerWaalsContact C-N 3.3Å; P473-R500 PolarHBondContact O-NH1 2.95Å
474	Q	89.4	Confident	93	Very high	141 Å²	141	45.2 Å²	45.2	66%	0.659	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-14.5	178.5	-62.1	-56.9	-33.1	0	0	113.1	F465 C472 R500	F465-Q474 WeakPolarHBondContact CD2-O 3.36Å; C472-Q474 PolarHBondContact O-N 3.38Å; Q474-R500 VanDerWaalsContact C-NH1 3.33Å; Q474-R500 VanDerWaalsContact O-CZ 3.24Å; Q474-R500 PolarHBondContact O-NH1 2.99Å; Q474-R500 PolarHBondContact O-NH2 3.45Å
475	G	91.3	Very high	93.2	Very high	5 Å²	5	42.4 Å²	42.4	5%	0.052	22%	0.22	C	C	.	.			trans	73.4	176.4	-174.2	0	0	0	0	0	113.5	F465 N467 C472 P473	F465-G475 VanDerWaalsContact CD2-C 3.45Å; F465-G475 WeakPolarHBondContact CD2-O 3.35Å; N467-G475 VanDerWaalsContact O-CA 3.24Å; N467-G475 WeakPolarHBondContact O-CA 3.42Å; N467-G475 VanDerWaalsContact OD1-CA 3.23Å; N467-G475 WeakPolarHBondContact OD1-CA 3.28Å; C472-G475 PolarHBondContact O-N 3.02Å; C472-G475 VanDerWaalsContact O-N 3.12Å; P473-G475 VanDerWaalsContact C-N 3.3Å
476	T	90.9	Very high	93	Very high	82 Å²	82	46.3 Å²	46.3	50%	0.503	23%	0.233	S	C	.	.	S	Bend	trans	-145.3	-15.4	-176	50.7	0	0	0	0	113.3	F465 N467	F465-T476 WeakPolarHBondContact CD1-O 3.29Å; F465-T476 VanDerWaalsContact CE1-O 3.24Å; F465-T476 WeakPolarHBondContact CE1-O 3.37Å; N467-T476 PolarHBondContact ND2-OG1 2.86Å; N467-T476 VanDerWaalsContact ND2-OG1 3.15Å; N467-T476 PolarHBondContact OD1-N 3.16Å
477	L	91.2	Very high	92.7	Very high	84 Å²	84	48.2 Å²	48.2	44%	0.44	25%	0.246	S	C	.	.			trans	-129.3	141.3	-171.3	-59	173.8	0	0	0	110.1	F465 T466 N467 L479	F465-L477 CarbonylContact C-O 3.42Å; F465-L477 VanDerWaalsContact CA-O 3.28Å; F465-L477 WeakPolarHBondContact CA-O 3.39Å; T466-L477 PolarHBondContact N-O 2.93Å; N467-L477 PolarHBondContact N-O 3.3Å; N467-L477 PolarHBondContact OD1-N 3.02Å; N467-L477 PolarHBondContact OD1-O 2.91Å; N467-L477 VanDerWaalsContact OD1-O 3.1Å; L477-L479 HydrophobicContact CB-CD1 3.97Å; L477-L479 HydrophobicContact CB-CD2 4.02Å; L477-L479 HydrophobicContact CB-CG 3.75Å; L477-L479 HydrophobicContact CD1-CD1 3.99Å
478	C	92.8	Very high	92.5	Very high	11 Å²	11	47 Å²	47	7%	0.074	24%	0.24	C	C	.	.			trans	-108.5	95.1	171.9	-176	0	0	0	0	107.4	Q464	Q464-C478 WeakPolarHBondContact O-CB 3.48Å; Q464-C478 PolarHBondContact O-SG 3.17Å
479	L	92.9	Very high	92.3	Very high	21 Å²	21	52.3 Å²	52.3	11%	0.11	26%	0.263	C	S	.	.			trans	-116	-17.2	-172.2	-53.1	176.4	0	0	0	112.8	F439 G440 T466 L477	F439-L479 PolarHBondContact N-O 3.3Å; G440-L479 WeakPolarHBondContact O-CD2 3.25Å; T466-L479 PolarHBondContact OG1-N 3.4Å; L477-L479 HydrophobicContact CB-CD1 3.97Å; L477-L479 HydrophobicContact CB-CD2 4.02Å; L477-L479 HydrophobicContact CB-CG 3.75Å; L477-L479 HydrophobicContact CD1-CD1 3.99Å
480	D	95.9	Very high	92.1	Very high	2 Å²	2	58.8 Å²	58.8	1%	0.011	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	141.3	-174.5	-50	-81.4	0	0	0	109.2	G437 H438 T466 H521 V524	G437-D480 WeakPolarHBondContact O-CA 3.48Å; H438-D480 IonicContact CG-OD1 3.58Å; H438-D480 IonicContact ND1-OD1 2.83Å; H438-D480 PolarHBondContact ND1-OD1 3.09Å; T466-D480 WeakPolarHBondContact CB-OD2 3.13Å; T466-D480 HydrophobicContact CG2-CB 4.19Å; T466-D480 WeakPolarHBondContact CG2-O 3.47Å; T466-D480 PolarHBondContact OG1-N 3.33Å; T466-D480 PolarHBondContact OG1-OD2 3.19Å; D480-H521 IonicContact OD1-CE1 3.26Å; D480-H521 IonicContact OD1-ND1 3.12Å; D480-H521 PolarHBondContact OD1-ND1 2.9Å; D480-H521 IonicContact OD2-CE1 3.05Å; D480-H521 IonicContact OD2-CG 2.89Å; D480-H521 IonicContact OD2-ND1 2.92Å; D480-H521 PolarHBondContact OD2-ND1 3.5Å; D480-V524 HydrophobicContact CB-CG2 3.86Å
481	N	96.9	Very high	92.2	Very high	3 Å²	3	58.5 Å²	58.5	2%	0.016	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	167.5	179.7	-141.5	-55.4	0	0	0	112.2	L436 G437 F439 L459 I460	L436-N481 WeakPolarHBondContact CA-O 3.29Å; G437-N481 PolarHBondContact N-O 3Å; G437-N481 PolarHBondContact O-N 3Å; G437-N481 VanDerWaalsContact O-N 3.14Å; F439-N481 HydrophobicContact CD2-CB 3.94Å; F439-N481 HydrophobicContact CE2-CB 3.93Å; L459-N481 PolarHBondContact N-OD1 3.03Å; I460-N481 PolarHBondContact N-OD1 3.08Å; I460-N481 VanDerWaalsContact N-OD1 3.07Å; I460-N481 PolarHBondContact O-ND2 3.33Å
482	I	97.9	Very high	92.4	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	118.7	168.8	-60.4	178.7	0	0	0	106.3	T255 V434 L436 L459 I484 V524 A526	T255-I482 HydrophobicContact CG2-CG1 4.13Å; V434-I482 HydrophobicContact CG1-CG2 3.57Å; L436-I482 HydrophobicContact CB-CB 4.37Å; L436-I482 HydrophobicContact CB-CG1 3.91Å; L436-I482 HydrophobicContact CB-CG2 4.4Å; L459-I482 HydrophobicContact CB-CB 4.47Å; L459-I482 WeakPolarHBondContact CB-O 3.47Å; L459-I482 HydrophobicContact CD1-CB 4.17Å; L459-I482 HydrophobicContact CD1-CG2 3.88Å; L459-I482 WeakPolarHBondContact CG-O 3.39Å; L459-I482 PolarHBondContact N-O 3.06Å; I482-I484 HydrophobicContact CG2-CG2 4.07Å; I482-V524 HydrophobicContact CD1-CB 4.49Å; I482-V524 HydrophobicContact CD1-CG1 3.88Å; I482-V524 HydrophobicContact CG1-CG1 3.94Å; I482-A526 HydrophobicContact CD1-CB 3.68Å; I482-A526 HydrophobicContact CG2-CB 4.3Å
483	W	96.5	Very high	92.5	Very high	1 Å²	1	49.9 Å²	49.9	0%	0.004	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	129.7	176.4	-62.6	76	0	0	0	109.3	V434 V435 F439 P443 F448 L451 R452 L456 C457 P458	V434-W483 CarbonylContact C-O 3.56Å; V434-W483 WeakPolarHBondContact CA-O 3.41Å; V435-W483 HydrophobicContact CB-CB 4.21Å; V435-W483 PolarHBondContact N-O 3.4Å; V435-W483 WeakPolarHBondContact O-CB 3.27Å; V435-W483 PolarHBondContact O-N 3.29Å; F439-W483 AromaticContact CE1-CD1 3.98Å; F439-W483 AromaticContact CE1-NE1 3.78Å; F439-W483 AromaticContact CE2-CD1 3.72Å; F439-W483 AromaticContact CE2-NE1 3.72Å; F439-W483 AromaticContact CZ-CD1 3.34Å; F439-W483 AromaticContact CZ-NE1 3.49Å; P443-W483 HydrophobicContact CB-CH2 4.34Å; P443-W483 HydrophobicContact CB-CZ2 3.89Å; F448-W483 HydrophobicContact CB-CH2 3.86Å; F448-W483 HydrophobicContact CB-CZ2 3.84Å; F448-W483 HydrophobicContact CD2-CZ2 4.3Å; F448-W483 HydrophobicContact CG-CZ2 4.12Å; L451-W483 HydrophobicContact CB-CD2 4.45Å; L451-W483 HydrophobicContact CB-CE3 4.07Å; L451-W483 HydrophobicContact CB-CZ3 4.24Å; L451-W483 HydrophobicContact CD1-CD2 3.85Å; L451-W483 HydrophobicContact CD1-CE3 4.29Å; L451-W483 HydrophobicContact CD1-CG 4.05Å; L451-W483 HydrophobicContact CD1-CZ2 4.37Å; R452-W483 HydrophobicContact CG-CH2 4.34Å; R452-W483 HydrophobicContact CG-CZ3 3.92Å; L456-W483 HydrophobicContact CB-CB 4.25Å; L456-W483 HydrophobicContact CB-CE3 4.18Å; C457-W483 CarbonylContact O-C 3.43Å; C457-W483 VanDerWaalsContact O-CA 3.31Å; C457-W483 WeakPolarHBondContact O-CA 3.24Å; P458-W483 HydrophobicContact CB-CD2 3.85Å; P458-W483 HydrophobicContact CB-CE3 3.89Å; P458-W483 HydrophobicContact CB-CH2 3.91Å; P458-W483 HydrophobicContact CB-CZ2 3.88Å; P458-W483 HydrophobicContact CB-CZ3 3.93Å; P458-W483 VanDerWaalsContact CD-CZ3 3.42Å; P458-W483 HydrophobicContact CG-CE3 4.13Å; P458-W483 HydrophobicContact CG-CH2 3.85Å; P458-W483 HydrophobicContact CG-CZ2 4.32Å; P458-W483 HydrophobicContact CG-CZ3 3.76Å
484	I	96.2	Very high	92.6	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.01	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	145.5	-176.9	63.7	165.3	0	0	0	112.2	V434 L456 C457 L459 I482 L488 K489 Y492 F528	V434-I484 HydrophobicContact CG2-CG2 4.42Å; L456-I484 WeakPolarHBondContact CA-O 3.45Å; C457-I484 PolarHBondContact N-O 3.09Å; C457-I484 PolarHBondContact O-N 3.29Å; L459-I484 HydrophobicContact CD1-CD1 4.48Å; L459-I484 HydrophobicContact CD1-CG2 3.81Å; L459-I484 HydrophobicContact CD2-CD1 3.74Å; L459-I484 HydrophobicContact CD2-CG1 3.92Å; L459-I484 HydrophobicContact CG-CD1 4.43Å; L459-I484 HydrophobicContact CG-CG1 4.28Å; L459-I484 HydrophobicContact CG-CG2 4.18Å; I482-I484 HydrophobicContact CG2-CG2 4.07Å; I484-L488 HydrophobicContact CB-CD2 4.09Å; I484-L488 HydrophobicContact CG2-CD2 3.93Å; I484-K489 HydrophobicContact CD1-CB 4.14Å; I484-K489 HydrophobicContact CD1-CG 4.47Å; I484-Y492 HydrophobicContact CD1-CD1 4.22Å; I484-Y492 HydrophobicContact CD1-CG 4Å; I484-F528 HydrophobicContact CG2-CE1 4.02Å; I484-F528 HydrophobicContact CG2-CZ 3.84Å
485	S	94.7	Very high	92.7	Very high	11 Å²	11	45.3 Å²	45.3	8%	0.077	23%	0.233	C	C	.	.			trans	-68.6	160.2	172	61.4	0	0	0	0	113.2	K431 L433 S487 L488 K489	K431-S485 PolarHBondContact O-OG 3.29Å; K431-S485 VanDerWaalsContact O-OG 3.05Å; L433-S485 PolarHBondContact N-OG 2.83Å; L433-S485 VanDerWaalsContact N-OG 3.11Å; L433-S485 PolarHBondContact O-N 2.83Å; L433-S485 PolarHBondContact O-OG 3.13Å; S485-S487 VanDerWaalsContact C-N 3.26Å; S485-S487 PolarHBondContact O-N 3.29Å; S485-L488 PolarHBondContact O-N 3.17Å; S485-L488 WeakPolarHBondContact OG-CB 3.4Å; S485-K489 PolarHBondContact O-N 3.31Å
486	R	91	Very high	92.9	Very high	162 Å²	162	46.3 Å²	46.3	61%	0.611	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-34.9	178.8	-177.5	-177.2	-68.7	-155.5	-6	112.5	K489	R486-K489 WeakPolarHBondContact O-CB 3.43Å
487	S	89.3	Confident	93.1	Very high	40 Å²	40	44.9 Å²	44.9	28%	0.28	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-47.2	178.5	-40.3	0	0	0	0	109.9	K431 E432 S485 K489 K490	K431-S487 WeakPolarHBondContact O-CB 3.47Å; K431-S487 PolarHBondContact O-OG 3.09Å; K431-S487 VanDerWaalsContact O-OG 3.04Å; E432-S487 WeakPolarHBondContact OE1-CB 3.3Å; S485-S487 VanDerWaalsContact C-N 3.26Å; S485-S487 PolarHBondContact O-N 3.29Å; S487-K489 VanDerWaalsContact C-N 3.26Å; S487-K489 PolarHBondContact O-N 3.06Å; S487-K490 WeakPolarHBondContact O-CB 3.14Å; S487-K490 WeakPolarHBondContact O-CG 3.48Å; S487-K490 PolarHBondContact O-N 3.25Å
488	L	91.3	Very high	93.3	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-66.6	-28.2	-178.9	-159.2	75.6	0	0	0	112.8	L388 E432 V434 I484 S485 K490 I491 Y492 F528	L388-L488 HydrophobicContact CD1-CD1 3.61Å; L388-L488 HydrophobicContact CD1-CD2 4.01Å; E432-L488 HydrophobicContact CB-CD1 4.01Å; E432-L488 WeakPolarHBondContact OE2-CA 3.4Å; E432-L488 WeakPolarHBondContact OE2-CB 3.46Å; E432-L488 VanDerWaalsContact OE2-CD1 3.23Å; E432-L488 WeakPolarHBondContact OE2-CD1 3.48Å; E432-L488 PolarHBondContact OE2-N 3.23Å; V434-L488 HydrophobicContact CG2-CD2 3.22Å; I484-L488 HydrophobicContact CB-CD2 4.09Å; I484-L488 HydrophobicContact CG2-CD2 3.93Å; S485-L488 PolarHBondContact O-N 3.17Å; S485-L488 WeakPolarHBondContact OG-CB 3.4Å; L488-K490 PolarHBondContact O-N 3.11Å; L488-I491 HydrophobicContact CD1-CD1 3.59Å; L488-I491 HydrophobicContact CD1-CG1 3.84Å; L488-I491 HydrophobicContact CG-CD1 4.49Å; L488-I491 HydrophobicContact CG-CG1 4.23Å; L488-I491 VanDerWaalsContact O-CG1 3.32Å; L488-I491 WeakPolarHBondContact O-CG1 3.26Å; L488-I491 PolarHBondContact O-N 3.19Å; L488-Y492 PolarHBondContact O-N 3.48Å; L488-F528 HydrophobicContact CD1-CD1 4.39Å; L488-F528 HydrophobicContact CD2-CD1 4.02Å; L488-F528 HydrophobicContact CD2-CE1 3.45Å; L488-F528 VanDerWaalsContact CD2-CE1 3.45Å; L488-F528 HydrophobicContact CD2-CZ 3.89Å; L488-F528 HydrophobicContact CG-CD1 3.87Å; L488-F528 HydrophobicContact CG-CE1 3.72Å
489	K	90.9	Very high	93.5	Very high	123 Å²	123	41.3 Å²	41.3	54%	0.535	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-56.2	-23.2	173.2	-169	171.2	-177.1	172.5	0	113.5	I484 S485 R486 S487	I484-K489 HydrophobicContact CD1-CB 4.14Å; I484-K489 HydrophobicContact CD1-CG 4.47Å; S485-K489 PolarHBondContact O-N 3.31Å; R486-K489 WeakPolarHBondContact O-CB 3.43Å; S487-K489 VanDerWaalsContact C-N 3.26Å; S487-K489 PolarHBondContact O-N 3.06Å
490	K	89.7	Confident	93.5	Very high	180 Å²	180	43.1 Å²	43.1	78%	0.783	21%	0.214	S	C	*	.	G	3₁₀ helix	trans	-73.1	-29.3	176.2	-62	177.2	-178	174.9	0	113.1	S487 L488	S487-K490 WeakPolarHBondContact O-CB 3.14Å; S487-K490 WeakPolarHBondContact O-CG 3.48Å; S487-K490 PolarHBondContact O-N 3.25Å; L488-K490 PolarHBondContact O-N 3.11Å
491	I	90.5	Very high	93.3	Very high	43 Å²	43	50.1 Å²	50.1	22%	0.221	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-10.2	179.7	68	170.9	0	0	0	112.4	L488 S493 F528 Y529	L488-I491 HydrophobicContact CD1-CD1 3.59Å; L488-I491 HydrophobicContact CD1-CG1 3.84Å; L488-I491 HydrophobicContact CG-CD1 4.49Å; L488-I491 HydrophobicContact CG-CG1 4.23Å; L488-I491 VanDerWaalsContact O-CG1 3.32Å; L488-I491 WeakPolarHBondContact O-CG1 3.26Å; L488-I491 PolarHBondContact O-N 3.19Å; I491-S493 PolarHBondContact O-N 3.24Å; I491-F528 HydrophobicContact CG1-CD1 4.43Å; I491-F528 CarbonylContact O-C 3.53Å; I491-F528 WeakPolarHBondContact O-CA 3.38Å; I491-Y529 WeakPolarHBondContact O-CD2 3.13Å; I491-Y529 PolarHBondContact O-N 2.77Å
492	Y	93.1	Very high	93.1	Very high	44 Å²	44	50.9 Å²	50.9	17%	0.173	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	127.8	169.6	176.3	-122.8	0	0	0	110.8	L459 I484 L488 G494 H495 C496 A526 E527 F528	L459-Y492 HydrophobicContact CD1-CD2 4.25Å; L459-Y492 HydrophobicContact CD1-CE2 3.8Å; L459-Y492 HydrophobicContact CD2-CD1 4.25Å; L459-Y492 HydrophobicContact CD2-CE1 3.76Å; L459-Y492 HydrophobicContact CD2-CE2 4.17Å; I484-Y492 HydrophobicContact CD1-CD1 4.22Å; I484-Y492 HydrophobicContact CD1-CG 4Å; L488-Y492 PolarHBondContact O-N 3.48Å; Y492-G494 VanDerWaalsContact CZ-C 3.42Å; Y492-G494 PolarHBondContact O-N 2.97Å; Y492-G494 PolarHBondContact OH-O 3.16Å; Y492-H495 WeakPolarHBondContact CE2-O 3.32Å; Y492-H495 VanDerWaalsContact OH-C 3.26Å; Y492-H495 PolarHBondContact OH-N 3.13Å; Y492-C496 WeakPolarHBondContact OH-CB 3.29Å; Y492-C496 PolarHBondContact OH-N 2.8Å; Y492-A526 HydrophobicContact CE2-CB 4.47Å; Y492-E527 WeakPolarHBondContact CD2-O 3.3Å; Y492-F528 HydrophobicContact CD2-CD1 4.16Å; Y492-F528 AromaticContact CD2-CE1 3.84Å; Y492-F528 HydrophobicContact CD2-CE1 3.84Å; Y492-F528 HydrophobicContact CD2-CZ 4.32Å; Y492-F528 HydrophobicContact CG-CE1 4.33Å
493	S	90.8	Very high	93	Very high	22 Å²	22	51 Å²	51	15%	0.154	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	-13.2	-175.5	64.2	0	0	0	0	114.3	I491 H495 E527	I491-S493 PolarHBondContact O-N 3.24Å; S493-H495 VanDerWaalsContact C-N 3.28Å; S493-H495 WeakPolarHBondContact OG-CB 3.39Å; S493-H495 PolarHBondContact OG-N 3.33Å; S493-H495 VanDerWaalsContact OG-N 3.08Å; S493-E527 WeakPolarHBondContact CB-O 3.47Å; S493-E527 PolarHBondContact N-O 2.95Å; S493-E527 WeakPolarHBondContact OG-CB 3.22Å; S493-E527 PolarHBondContact OG-O 3.42Å
494	G	91.3	Very high	92.8	Very high	55 Å²	55	54.5 Å²	54.5	57%	0.567	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	88.8	-7.4	-166.5	0	0	0	0	0	113.3	Y492	Y492-G494 VanDerWaalsContact CZ-C 3.42Å; Y492-G494 PolarHBondContact O-N 2.97Å; Y492-G494 PolarHBondContact OH-O 3.16Å
495	H	91.6	Very high	92.6	Very high	61 Å²	61	54.5 Å²	54.5	28%	0.282	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	115.5	-177.6	-165.5	70.8	0	0	0	112.3	R245 Y492 S493 E527	R245-H495 PolarHBondContact NH2-CD2 2.8Å; R245-H495 VanDerWaalsContact NH2-CG 3.33Å; Y492-H495 WeakPolarHBondContact CE2-O 3.32Å; Y492-H495 VanDerWaalsContact OH-C 3.26Å; Y492-H495 PolarHBondContact OH-N 3.13Å; S493-H495 VanDerWaalsContact C-N 3.28Å; S493-H495 WeakPolarHBondContact OG-CB 3.39Å; S493-H495 PolarHBondContact OG-N 3.33Å; S493-H495 VanDerWaalsContact OG-N 3.08Å; H495-E527 HydrophobicContact CB-CB 4.34Å; H495-E527 PolarHBondContact O-N 2.6Å
496	C	94.6	Very high	92.4	Very high	25 Å²	25	56.2 Å²	56.2	17%	0.169	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	138.7	169.6	-175.8	0	0	0	0	108.2	L459 I460 Y492 V525	L459-C496 HydrophobicContact CB-CB 4.09Å; I460-C496 WeakPolarHBondContact CD1-SG 3.14Å; Y492-C496 WeakPolarHBondContact OH-CB 3.29Å; Y492-C496 PolarHBondContact OH-N 2.8Å; C496-V525 CarbonylContact C-O 3.6Å; C496-V525 VanDerWaalsContact CA-O 3.24Å; C496-V525 WeakPolarHBondContact CA-O 3.47Å; C496-V525 PolarHBondContact SG-O 3.38Å; C496-V525 VanDerWaalsContact SG-O 3.42Å
497	M	95.1	Very high	92.3	Very high	52 Å²	52	48.7 Å²	48.7	26%	0.256	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	151.7	-176.1	63.5	-175.4	-67.8	0	0	112.1	V499 V525	M497-V499 HydrophobicContact CE-CG2 4.27Å; M497-V525 HydrophobicContact CG-CB 3.95Å; M497-V525 PolarHBondContact N-O 3.07Å; M497-V525 PolarHBondContact O-N 3.38Å
498	V	97.2	Very high	92.5	Very high	14 Å²	14	47.1 Å²	47.1	9%	0.085	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	114.2	168.3	-178.9	0	0	0	0	106.9	I460 Q464 T466 R500 C522 V524	I460-V498 HydrophobicContact CD1-CG2 3.77Å; Q464-V498 HydrophobicContact CG-CG2 3.89Å; T466-V498 HydrophobicContact CG2-CG2 4.1Å; V498-R500 HydrophobicContact CG1-CG 4.19Å; V498-R500 PolarHBondContact O-N 2.85Å; V498-C522 HydrophobicContact CG1-CB 3.3Å; V498-V524 HydrophobicContact CG2-CG2 4.39Å
499	V	96.1	Very high	92.3	Very high	6 Å²	6	50.8 Å²	50.8	4%	0.036	27%	0.271	C	S	.	.			trans	-72.6	123.2	178.2	-179.4	0	0	0	0	108.1	T278 M497 L503 C522 P523 V525	T278-V499 HydrophobicContact CG2-CG1 4.18Å; M497-V499 HydrophobicContact CE-CG2 4.27Å; V499-L503 HydrophobicContact CG1-CD2 4.39Å; V499-L503 WeakPolarHBondContact O-CD1 3.4Å; V499-C522 VanDerWaalsContact O-CB 3.3Å; V499-C522 WeakPolarHBondContact O-CB 3.47Å; V499-P523 HydrophobicContact CB-CB 4.2Å; V499-P523 HydrophobicContact CB-CG 3.94Å; V499-P523 HydrophobicContact CG1-CG 4.44Å; V499-P523 HydrophobicContact CG2-CB 4.34Å; V499-P523 PolarHBondContact N-O 2.92Å; V499-V525 HydrophobicContact CG2-CG2 3.71Å
500	R	93.6	Very high	92.1	Very high	60 Å²	60	46.4 Å²	46.4	23%	0.226	25%	0.254	C	S	.	.			trans	-121.1	-16	-179.5	-67.8	-174.7	165.6	-75.1	-9.4	113.7	F465 N467 P473 Q474 V498	F465-R500 PolarHBondContact O-NH2 3.14Å; N467-R500 PolarHBondContact O-NH1 2.76Å; N467-R500 PolarHBondContact O-NH2 2.99Å; P473-R500 PolarHBondContact O-NH1 2.95Å; Q474-R500 VanDerWaalsContact C-NH1 3.33Å; Q474-R500 VanDerWaalsContact O-CZ 3.24Å; Q474-R500 PolarHBondContact O-NH1 2.99Å; Q474-R500 PolarHBondContact O-NH2 3.45Å; V498-R500 HydrophobicContact CG1-CG 4.19Å; V498-R500 PolarHBondContact O-N 2.85Å
501	E	91.9	Very high	92	Very high	149 Å²	149	44.1 Å²	44.1	70%	0.696	25%	0.25	S	S	*	.	S	Bend	trans	-89.4	151.7	-178.7	-62	-172.4	-179.8	0	0	111.2	L503	E501-L503 PolarHBondContact O-N 3.13Å; E501-L503 VanDerWaalsContact O-N 3.12Å
502	G	91.8	Very high	91.5	Very high	18 Å²	18	54.6 Å²	54.6	19%	0.186	29%	0.287	C	S	.	.	S	Bend	trans	71.1	0.3	177.6	0	0	0	0	0	115.5	R235 T504	R235-G502 PolarHBondContact NE-O 2.74Å; R235-G502 VanDerWaalsContact NE-O 3.14Å; R235-G502 VanDerWaalsContact NH2-C 3.34Å; R235-G502 PolarHBondContact NH2-O 2.79Å; G502-T504 PolarHBondContact O-N 3.03Å
503	L	95.1	Very high	91.1	Very high	4 Å²	4	55.3 Å²	55.3	2%	0.021	30%	0.299	C	S	.	.			trans	-75.1	-4.9	-173.2	-58.2	-170.5	0	0	0	115.2	W256 I468 V499 E501 V517 A518 C522 P523	W256-L503 HydrophobicContact CH2-CD2 3.91Å; W256-L503 HydrophobicContact CZ2-CD2 3.91Å; I468-L503 HydrophobicContact CD1-CB 4.47Å; I468-L503 HydrophobicContact CD1-CD1 4.18Å; I468-L503 HydrophobicContact CG2-CD1 4.18Å; V499-L503 HydrophobicContact CG1-CD2 4.39Å; V499-L503 WeakPolarHBondContact O-CD1 3.4Å; E501-L503 PolarHBondContact O-N 3.13Å; E501-L503 VanDerWaalsContact O-N 3.12Å; L503-V517 WeakPolarHBondContact O-CA 3.38Å; L503-A518 PolarHBondContact O-N 3.47Å; L503-C522 HydrophobicContact CD1-CB 4.3Å; L503-P523 HydrophobicContact CD2-CG 4.14Å
504	T	93.3	Very high	90.9	Very high	73 Å²	73	58.6 Å²	58.6	45%	0.448	31%	0.308	S	S	.	.	B	Isolated β-bridge	trans	-109.7	153.2	177.2	57	0	0	0	0	112	T470 G502 G516 V517	T470-T504 HydrophobicContact CG2-CG2 4.48Å; G502-T504 PolarHBondContact O-N 3.03Å; T504-G516 WeakPolarHBondContact CA-O 3.43Å; T504-G516 WeakPolarHBondContact CB-O 3.33Å; T504-V517 HydrophobicContact CG2-CB 4.48Å; T504-V517 HydrophobicContact CG2-CG1 3.53Å
505	N	92.7	Very high	90.7	Very high	3 Å²	3	57.1 Å²	57.1	2%	0.016	29%	0.292	C	S	.	.			trans	-149	140.1	172.1	-177.9	-64.7	0	0	0	111	G270 E273 V274 W507 I508 G515 G516	G270-N505 VanDerWaalsContact CA-CG 3.49Å; G270-N505 WeakPolarHBondContact CA-OD1 3.49Å; E273-N505 PolarHBondContact OE1-ND2 3.02Å; V274-N505 HydrophobicContact CG2-CB 3.71Å; N505-W507 PolarHBondContact O-N 3.21Å; N505-W507 WeakPolarHBondContact OD1-CB 3.5Å; N505-W507 PolarHBondContact OD1-N 2.93Å; N505-I508 HydrophobicContact CB-CD1 3.73Å; N505-I508 HydrophobicContact CB-CG1 3.93Å; N505-I508 WeakPolarHBondContact O-CB 3.46Å; N505-I508 PolarHBondContact O-N 2.84Å; N505-G515 CarbonylContact O-C 3.43Å; N505-G515 VanDerWaalsContact O-CA 3.26Å; N505-G515 WeakPolarHBondContact O-CA 3.4Å; N505-G516 PolarHBondContact N-O 3.41Å; N505-G516 VanDerWaalsContact N-O 3.15Å
506	P	90.1	Very high	90.8	Very high	46 Å²	46	54.2 Å²	54.2	30%	0.299	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-20.3	178.5	-28	35.8	0	0	0	115.7	P228 M234 W514	P228-P506 HydrophobicContact CG-CB 4.28Å; M234-P506 HydrophobicContact CG-CG 4.44Å; P506-W514 WeakPolarHBondContact O-CB 3.28Å
507	W	88.8	Confident	90.8	Very high	5 Å²	5	54.2 Å²	54.2	2%	0.019	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	2.7	178.6	-81.5	92.1	0	0	0	114.9	L223 P224 P228 Q230 I231 N268 N505 W514	L223-W507 HydrophobicContact CB-CH2 3.56Å; L223-W507 HydrophobicContact CB-CZ2 4.38Å; L223-W507 HydrophobicContact CB-CZ3 3.72Å; L223-W507 HydrophobicContact CD1-CH2 3.58Å; L223-W507 HydrophobicContact CD1-CZ2 3.61Å; L223-W507 HydrophobicContact CD1-CZ3 4.47Å; L223-W507 HydrophobicContact CD2-CD2 4.13Å; L223-W507 HydrophobicContact CD2-CE3 4.03Å; L223-W507 HydrophobicContact CD2-CH2 3.66Å; L223-W507 HydrophobicContact CD2-CZ2 3.7Å; L223-W507 HydrophobicContact CD2-CZ3 3.82Å; L223-W507 HydrophobicContact CG-CH2 3.76Å; L223-W507 HydrophobicContact CG-CZ2 4.07Å; L223-W507 HydrophobicContact CG-CZ3 4.18Å; P224-W507 HydrophobicContact CG-CE3 3.98Å; P224-W507 HydrophobicContact CG-CZ3 3.97Å; P228-W507 HydrophobicContact CB-CZ2 4.32Å; P228-W507 WeakPolarHBondContact O-CH2 3.31Å; P228-W507 WeakPolarHBondContact O-CZ2 3.37Å; Q230-W507 PolarHBondContact O-NE1 3.02Å; I231-W507 VanDerWaalsContact CG1-CD1 3.41Å; I231-W507 HydrophobicContact CG1-CD2 4.34Å; I231-W507 HydrophobicContact CG1-CG 4Å; I231-W507 VanDerWaalsContact CG1-NE1 3.3Å; N268-W507 PolarHBondContact ND2-O 3.37Å; N268-W507 PolarHBondContact OD1-O 2.91Å; N505-W507 PolarHBondContact O-N 3.21Å; N505-W507 WeakPolarHBondContact OD1-CB 3.5Å; N505-W507 PolarHBondContact OD1-N 2.93Å; W507-W514 WeakPolarHBondContact O-CZ3 3.34Å
508	I	92.3	Very high	90.8	Very high	7 Å²	7	51.9 Å²	51.9	4%	0.036	27%	0.267	C	S	.	.	S	Bend	trans	-92.4	126.6	174.4	-58.9	175.1	0	0	0	107.9	V271 V274 N505 G515 G516 V517 A518	V271-I508 HydrophobicContact CG2-CD1 4.09Å; V271-I508 HydrophobicContact CG2-CG1 3.89Å; V271-I508 HydrophobicContact CG2-CG2 4.41Å; V274-I508 HydrophobicContact CG2-CD1 3.92Å; N505-I508 HydrophobicContact CB-CD1 3.73Å; N505-I508 HydrophobicContact CB-CG1 3.93Å; N505-I508 WeakPolarHBondContact O-CB 3.46Å; N505-I508 PolarHBondContact O-N 2.84Å; I508-G515 PolarHBondContact O-N 3.18Å; I508-G516 PolarHBondContact O-N 3.21Å; I508-V517 WeakPolarHBondContact CG2-O 3.23Å; I508-A518 HydrophobicContact CD1-CB 4.06Å
509	P	87.9	Confident	90.8	Very high	76 Å²	76	51.2 Å²	51.2	49%	0.494	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	140.1	173.1	-22.2	32.7	0	0	0	112	W514	P509-W514 HydrophobicContact CB-CZ3 4.42Å; P509-W514 HydrophobicContact CG-CE3 4.29Å; P509-W514 HydrophobicContact CG-CH2 4.26Å; P509-W514 HydrophobicContact CG-CZ3 3.71Å
510	D	87	Confident	90.7	Very high	31 Å²	31	53.6 Å²	53.6	17%	0.166	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	86.6	170.8	-173.9	17.8	0	0	0	109.2	T470 W512 S513	T470-D510 VanDerWaalsContact CB-OD2 3.27Å; T470-D510 WeakPolarHBondContact CB-OD2 3.39Å; T470-D510 VanDerWaalsContact CG2-OD2 3.28Å; T470-D510 WeakPolarHBondContact CG2-OD2 3.28Å; T470-D510 PolarHBondContact OG1-OD2 2.86Å; D510-W512 PolarHBondContact O-N 3.38Å; D510-S513 CarbonylContact C-O 3.49Å; D510-S513 PolarHBondContact N-O 3.44Å; D510-S513 CarbonylContact O-C 3.58Å; D510-S513 WeakPolarHBondContact O-CA 3.4Å; D510-S513 PolarHBondContact O-N 3.4Å; D510-S513 PolarHBondContact O-OG 3.03Å
511	N	86.4	Confident	90.8	Very high	132 Å²	132	51.5 Å²	51.5	71%	0.706	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	-105.8	-173.6	-61.1	-12.2	0	0	0	112.7
512	W	80.1	Confident	91.1	Very high	263 Å²	263	44.4 Å²	44.4	100%	0.996	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.9	10.6	179.1	-67.5	88.2	0	0	0	112.8	D510	D510-W512 PolarHBondContact O-N 3.38Å
513	S	85.3	Confident	91.4	Very high	59 Å²	59	43.6 Å²	43.6	41%	0.413	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	178.7	-177.4	54.7	0	0	0	0	111.6	D510	D510-S513 CarbonylContact C-O 3.49Å; D510-S513 PolarHBondContact N-O 3.44Å; D510-S513 CarbonylContact O-C 3.58Å; D510-S513 WeakPolarHBondContact O-CA 3.4Å; D510-S513 PolarHBondContact O-N 3.4Å; D510-S513 PolarHBondContact O-OG 3.03Å
514	W	86.6	Confident	91.6	Very high	92 Å²	92	43.4 Å²	43.4	35%	0.348	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	159.1	176.8	-70.6	106.8	0	0	0	110	P224 G226 P506 W507 P509	P224-W514 HydrophobicContact CB-CH2 4.27Å; P224-W514 HydrophobicContact CG-CH2 3.93Å; P224-W514 HydrophobicContact CG-CZ3 4.32Å; G226-W514 PolarHBondContact O-NE1 3.01Å; P506-W514 WeakPolarHBondContact O-CB 3.28Å; W507-W514 WeakPolarHBondContact O-CZ3 3.34Å; P509-W514 HydrophobicContact CB-CZ3 4.42Å; P509-W514 HydrophobicContact CG-CE3 4.29Å; P509-W514 HydrophobicContact CG-CH2 4.26Å; P509-W514 HydrophobicContact CG-CZ3 3.71Å
515	G	88.1	Confident	91.8	Very high	23 Å²	23	40 Å²	40	24%	0.237	21%	0.205	C	C	.	.			trans	102.2	24.4	-177.2	0	0	0	0	0	114.6	N505 I508	N505-G515 CarbonylContact O-C 3.43Å; N505-G515 VanDerWaalsContact O-CA 3.26Å; N505-G515 WeakPolarHBondContact O-CA 3.4Å; I508-G515 PolarHBondContact O-N 3.18Å
516	G	92.5	Very high	92	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.204	C	C	.	.			trans	-70.4	176.3	-177.6	0	0	0	0	0	114.7	T504 N505 I508	T504-G516 WeakPolarHBondContact CA-O 3.43Å; T504-G516 WeakPolarHBondContact CB-O 3.33Å; N505-G516 PolarHBondContact N-O 3.41Å; N505-G516 VanDerWaalsContact N-O 3.15Å; I508-G516 PolarHBondContact O-N 3.21Å
517	V	95	Very high	92.2	Very high	26 Å²	26	38 Å²	38	16%	0.158	19%	0.192	C	C	.	.	B	Isolated β-bridge	trans	-88.3	145.3	172.2	-67.9	0	0	0	0	110.5	I468 T470 L503 T504 I508 S519	I468-V517 HydrophobicContact CG1-CG1 4.36Å; I468-V517 HydrophobicContact CG2-CG1 4.26Å; T470-V517 HydrophobicContact CG2-CG1 4.41Å; L503-V517 WeakPolarHBondContact O-CA 3.38Å; T504-V517 HydrophobicContact CG2-CB 4.48Å; T504-V517 HydrophobicContact CG2-CG1 3.53Å; I508-V517 WeakPolarHBondContact CG2-O 3.23Å; V517-S519 WeakPolarHBondContact CB-O 3.19Å; V517-S519 VanDerWaalsContact CG2-O 3.29Å; V517-S519 WeakPolarHBondContact CG2-O 3.47Å; V517-S519 PolarHBondContact O-N 3.31Å
518	A	95.4	Very high	92.5	Very high	2 Å²	2	38 Å²	38	2%	0.017	19%	0.192	C	C	.	.	S	Bend	trans	-64.3	-30.3	175.5	0	0	0	0	0	112.9	K265 V271 V274 L503 I508	K265-A518 WeakPolarHBondContact CE-O 3.31Å; K265-A518 PolarHBondContact NZ-O 3.25Å; V271-A518 HydrophobicContact CG1-CB 4.3Å; V274-A518 HydrophobicContact CB-CB 3.97Å; V274-A518 HydrophobicContact CG1-CB 3.45Å; V274-A518 VanDerWaalsContact CG1-CB 3.45Å; L503-A518 PolarHBondContact O-N 3.47Å; I508-A518 HydrophobicContact CD1-CB 4.06Å
519	S	96.3	Very high	92.4	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.007	20%	0.198	C	C	.	.			trans	-151.9	151.7	174.7	-177.6	0	0	0	0	109	S257 V517 H521	S257-S519 WeakPolarHBondContact O-CB 3.31Å; S257-S519 PolarHBondContact O-OG 2.76Å; V517-S519 WeakPolarHBondContact CB-O 3.19Å; V517-S519 VanDerWaalsContact CG2-O 3.29Å; V517-S519 WeakPolarHBondContact CG2-O 3.47Å; V517-S519 PolarHBondContact O-N 3.31Å; S519-H521 PolarHBondContact O-N 3.14Å; S519-H521 PolarHBondContact OG-N 3.18Å; S519-H521 VanDerWaalsContact OG-N 3.16Å
520	D	94.8	Very high	92.3	Very high	56 Å²	56	37.1 Å²	37.1	30%	0.299	18%	0.179	S	C	.	.	S	Bend	trans	-74.1	-5.5	168.4	58.7	-11.8	0	0	0	112.9	Q259 N467 I468	Q259-D520 WeakPolarHBondContact CG-OD1 3.22Å; Q259-D520 PolarHBondContact NE2-OD1 3.15Å; Q259-D520 PolarHBondContact NE2-OD2 3.09Å; Q259-D520 PolarHBondContact OE1-OD1 3.15Å; N467-D520 CarbonylContact C-O 3.56Å; N467-D520 WeakPolarHBondContact CA-O 3.39Å; N467-D520 VanDerWaalsContact CB-O 3.31Å; N467-D520 WeakPolarHBondContact CB-O 3.28Å; I468-D520 PolarHBondContact N-O 3.42Å; I468-D520 WeakPolarHBondContact O-CA 3.48Å
521	H	96.6	Very high	91.5	Very high	15 Å²	15	41.6 Å²	41.6	7%	0.069	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-98.6	143.6	169.3	-63.3	-90.9	0	0	0	111.5	W256 H438 D480 S519	W256-H521 PolarHBondContact NE1-O 2.76Å; H438-H521 AromaticContact CE1-CE1 3.41Å; H438-H521 PolarHBondContact CE1-CE1 3.44Å; H438-H521 VanDerWaalsContact CE1-CE1 3.41Å; H438-H521 AromaticContact ND1-CE1 3.3Å; H438-H521 PolarHBondContact ND1-CE1 3.31Å; H438-H521 VanDerWaalsContact ND1-CE1 3.3Å; H438-H521 AromaticContact ND1-ND1 3.87Å; D480-H521 IonicContact OD1-CE1 3.26Å; D480-H521 IonicContact OD1-ND1 3.12Å; D480-H521 PolarHBondContact OD1-ND1 2.9Å; D480-H521 IonicContact OD2-CE1 3.05Å; D480-H521 IonicContact OD2-CG 2.89Å; D480-H521 IonicContact OD2-ND1 2.92Å; D480-H521 PolarHBondContact OD2-ND1 3.5Å; S519-H521 PolarHBondContact O-N 3.14Å; S519-H521 PolarHBondContact OG-N 3.18Å; S519-H521 VanDerWaalsContact OG-N 3.16Å
522	C	97.7	Very high	89.9	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.007	18%	0.183	C	C	.	.	P	Polyproline II helix	trans	-88.9	143.4	169	-64.8	0	0	0	0	110	T466 V498 V499 L503 V524	T466-C522 VanDerWaalsContact O-CB 3.25Å; T466-C522 WeakPolarHBondContact O-CB 3.24Å; T466-C522 PolarHBondContact O-N 3.45Å; V498-C522 HydrophobicContact CG1-CB 3.3Å; V499-C522 VanDerWaalsContact O-CB 3.3Å; V499-C522 WeakPolarHBondContact O-CB 3.47Å; L503-C522 HydrophobicContact CD1-CB 4.3Å; C522-V524 PolarHBondContact O-N 2.85Å
523	P	98	Very high	88.3	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-60.7	131.9	166.4	-6.3	14.5	0	0	0	110.7	T255 W256 T278 V499 L503	T255-P523 WeakPolarHBondContact O-CA 3.43Å; W256-P523 HydrophobicContact CB-CB 4.35Å; W256-P523 HydrophobicContact CD2-CB 4.05Å; W256-P523 HydrophobicContact CD2-CG 3.57Å; W256-P523 HydrophobicContact CE3-CB 4.2Å; W256-P523 HydrophobicContact CE3-CG 3.69Å; W256-P523 HydrophobicContact CG-CB 4.14Å; W256-P523 HydrophobicContact CG-CG 4.09Å; W256-P523 HydrophobicContact CH2-CG 3.99Å; W256-P523 HydrophobicContact CZ2-CG 3.9Å; W256-P523 HydrophobicContact CZ3-CG 3.88Å; T278-P523 HydrophobicContact CG2-CG 3.81Å; V499-P523 HydrophobicContact CB-CB 4.2Å; V499-P523 HydrophobicContact CB-CG 3.94Å; V499-P523 HydrophobicContact CG1-CG 4.44Å; V499-P523 HydrophobicContact CG2-CB 4.34Å; V499-P523 PolarHBondContact N-O 2.92Å; L503-P523 HydrophobicContact CD2-CG 4.14Å
524	V	98.3	Very high	86.2	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	126.2	170.6	179.9	0	0	0	0	108.1	A254 T255 I460 T466 D480 I482 V498 C522	A254-V524 CarbonylContact C-O 3.56Å; A254-V524 WeakPolarHBondContact CA-O 3.47Å; A254-V524 WeakPolarHBondContact CB-O 3.25Å; T255-V524 HydrophobicContact CG2-CB 4Å; T255-V524 PolarHBondContact N-O 3.33Å; T255-V524 PolarHBondContact O-N 3.34Å; I460-V524 HydrophobicContact CD1-CG1 3.81Å; I460-V524 HydrophobicContact CG1-CG1 3.47Å; I460-V524 VanDerWaalsContact CG1-CG1 3.47Å; I460-V524 HydrophobicContact CG1-CG2 4.47Å; T466-V524 HydrophobicContact CG2-CG2 4.02Å; D480-V524 HydrophobicContact CB-CG2 3.86Å; I482-V524 HydrophobicContact CD1-CB 4.49Å; I482-V524 HydrophobicContact CD1-CG1 3.88Å; I482-V524 HydrophobicContact CG1-CG1 3.94Å; V498-V524 HydrophobicContact CG2-CG2 4.39Å; C522-V524 PolarHBondContact O-N 2.85Å
525	V	98.1	Very high	84.1	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.012	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	130.4	-173.4	-172.6	0	0	0	0	109.7	R252 L253 A254 I284 C496 M497 V499	R252-V525 HydrophobicContact CB-CG1 3.92Å; R252-V525 HydrophobicContact CG-CG1 4.26Å; L253-V525 WeakPolarHBondContact O-CA 3.46Å; A254-V525 HydrophobicContact CB-CB 4.42Å; A254-V525 HydrophobicContact CB-CG1 4.49Å; A254-V525 HydrophobicContact CB-CG2 3.88Å; I284-V525 HydrophobicContact CD1-CG2 3.79Å; I284-V525 HydrophobicContact CG1-CG1 4.24Å; I284-V525 HydrophobicContact CG1-CG2 4.13Å; C496-V525 CarbonylContact C-O 3.6Å; C496-V525 VanDerWaalsContact CA-O 3.24Å; C496-V525 WeakPolarHBondContact CA-O 3.47Å; C496-V525 PolarHBondContact SG-O 3.38Å; C496-V525 VanDerWaalsContact SG-O 3.42Å; M497-V525 HydrophobicContact CG-CB 3.95Å; M497-V525 PolarHBondContact N-O 3.07Å; M497-V525 PolarHBondContact O-N 3.38Å; V499-V525 HydrophobicContact CG2-CG2 3.71Å
526	A	97.1	Very high	81.9	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.008	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	143.2	172.3	0	0	0	0	0	110.5	R252 L253 L459 I482 Y492 F528	R252-A526 WeakPolarHBondContact CA-O 3.24Å; L253-A526 PolarHBondContact N-O 2.89Å; L253-A526 PolarHBondContact O-N 2.83Å; L459-A526 HydrophobicContact CD1-CB 3.53Å; I482-A526 HydrophobicContact CD1-CB 3.68Å; I482-A526 HydrophobicContact CG2-CB 4.3Å; Y492-A526 HydrophobicContact CE2-CB 4.47Å; A526-F528 HydrophobicContact CB-CE2 3.74Å; A526-F528 HydrophobicContact CB-CZ 3.93Å
527	E	95.1	Very high	79.5	Confident	7 Å²	7	46.3 Å²	46.3	3%	0.033	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	133.2	-175.2	-167.4	-167.7	100.9	0	0	112.1	R245 A250 V251 R252 Y492 S493 H495	R245-E527 WeakPolarHBondContact CB-OE1 3.19Å; R245-E527 VanDerWaalsContact CD-OE1 3.24Å; R245-E527 WeakPolarHBondContact CD-OE1 3.45Å; R245-E527 IonicContact CZ-OE1 3.6Å; R245-E527 IonicContact CZ-OE2 2.75Å; R245-E527 IonicContact NE-OE1 3.89Å; R245-E527 PolarHBondContact NE-OE1 3.1Å; R245-E527 IonicContact NE-OE2 3.97Å; R245-E527 PolarHBondContact NE-OE2 3.46Å; R245-E527 IonicContact NH2-OE1 3.47Å; R245-E527 IonicContact NH2-OE2 2.96Å; R245-E527 PolarHBondContact NH2-OE2 3.48Å; A250-E527 HydrophobicContact CB-CG 3.85Å; V251-E527 WeakPolarHBondContact O-CA 3.35Å; R252-E527 HydrophobicContact CG-CB 3.98Å; R252-E527 HydrophobicContact CG-CG 3.7Å; R252-E527 IonicContact CZ-OE2 3.19Å; R252-E527 IonicContact NE-OE2 2.64Å; R252-E527 PolarHBondContact NE-OE2 3.49Å; R252-E527 IonicContact NH2-OE2 3.99Å; R252-E527 PolarHBondContact NH2-OE2 3.45Å; Y492-E527 WeakPolarHBondContact CD2-O 3.3Å; S493-E527 WeakPolarHBondContact CB-O 3.47Å; S493-E527 PolarHBondContact N-O 2.95Å; S493-E527 WeakPolarHBondContact OG-CB 3.22Å; S493-E527 PolarHBondContact OG-O 3.42Å; H495-E527 HydrophobicContact CB-CB 4.34Å; H495-E527 PolarHBondContact O-N 2.6Å
528	F	93.4	Very high	76.6	Confident	5 Å²	5	49.3 Å²	49.3	2%	0.022	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	137	-176.2	-56.1	-88.8	0	0	0	110.7	A250 V251 L253 L459 I484 L488 I491 Y492 A526	A250-F528 CarbonylContact C-O 3.6Å; A250-F528 VanDerWaalsContact CA-O 3.23Å; A250-F528 WeakPolarHBondContact CA-O 3.2Å; V251-F528 HydrophobicContact CG1-CB 4.18Å; V251-F528 PolarHBondContact N-O 3.31Å; V251-F528 PolarHBondContact O-N 3.44Å; L253-F528 HydrophobicContact CB-CE2 4.19Å; L253-F528 HydrophobicContact CD2-CE2 4.24Å; L459-F528 HydrophobicContact CD1-CZ 4.48Å; I484-F528 HydrophobicContact CG2-CE1 4.02Å; I484-F528 HydrophobicContact CG2-CZ 3.84Å; L488-F528 HydrophobicContact CD1-CD1 4.39Å; L488-F528 HydrophobicContact CD2-CD1 4.02Å; L488-F528 HydrophobicContact CD2-CE1 3.45Å; L488-F528 VanDerWaalsContact CD2-CE1 3.45Å; L488-F528 HydrophobicContact CD2-CZ 3.89Å; L488-F528 HydrophobicContact CG-CD1 3.87Å; L488-F528 HydrophobicContact CG-CE1 3.72Å; I491-F528 HydrophobicContact CG1-CD1 4.43Å; I491-F528 CarbonylContact O-C 3.53Å; I491-F528 WeakPolarHBondContact O-CA 3.38Å; Y492-F528 HydrophobicContact CD2-CD1 4.16Å; Y492-F528 AromaticContact CD2-CE1 3.84Å; Y492-F528 HydrophobicContact CD2-CE1 3.84Å; Y492-F528 HydrophobicContact CD2-CZ 4.32Å; Y492-F528 HydrophobicContact CG-CE1 4.33Å; A526-F528 HydrophobicContact CB-CE2 3.74Å; A526-F528 HydrophobicContact CB-CZ 3.93Å
529	Y	91.4	Very high	73.6	Confident	44 Å²	44	60.5 Å²	60.5	17%	0.173	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	137.7	171	-66.5	-61.6	0	0	0	110.7	R245 D246 K248 A250 I491	R245-Y529 HydrophobicContact CB-CE1 3.98Å; R245-Y529 HydrophobicContact CG-CE1 4.29Å; D246-Y529 PolarHBondContact OD2-OH 3.01Å; K248-Y529 HydrophobicContact CB-CD1 3.73Å; K248-Y529 HydrophobicContact CB-CE1 3.91Å; K248-Y529 HydrophobicContact CD-CD1 4.28Å; K248-Y529 HydrophobicContact CD-CE1 4.34Å; A250-Y529 HydrophobicContact CB-CD1 4.32Å; I491-Y529 WeakPolarHBondContact O-CD2 3.13Å; I491-Y529 PolarHBondContact O-N 2.77Å
530	I	84.4	Confident	70.7	Confident	19 Å²	19	65.5 Å²	65.5	10%	0.097	35%	0.345	C	S	.	.			trans	-116.5	142.2	176.1	53.7	174.4	0	0	0	109.3	P249 V251 V383 L532	P249-I530 HydrophobicContact CB-CD1 4.28Å; P249-I530 HydrophobicContact CB-CG1 3.88Å; P249-I530 HydrophobicContact CG-CG1 4.31Å; P249-I530 WeakPolarHBondContact CG-O 3.39Å; P249-I530 WeakPolarHBondContact O-CG1 3.24Å; P249-I530 PolarHBondContact O-N 3.32Å; V251-I530 HydrophobicContact CB-CD1 4.42Å; V251-I530 HydrophobicContact CB-CG2 3.91Å; V251-I530 HydrophobicContact CG1-CG2 3.54Å; V383-I530 HydrophobicContact CG1-CG2 3.82Å; I530-L532 HydrophobicContact CD1-CD1 3.71Å; I530-L532 HydrophobicContact CD1-CD2 3.82Å; I530-L532 HydrophobicContact CD1-CG 3.56Å; I530-L532 HydrophobicContact CG1-CD1 4.37Å; I530-L532 HydrophobicContact CG1-CG 3.95Å; I530-L532 PolarHBondContact O-N 3.21Å
531	N	70.8	Confident	68.3	Low	126 Å²	126	67.8 Å²	67.8	67%	0.674	37%	0.372	S	S	*	.			trans	-90.5	82.6	169.3	-72.8	-35.7	0	0	0	107.8	S533	N531-S533 PolarHBondContact O-N 3.38Å
532	L	53.6	Low	65.1	Low	53 Å²	53	75.6 Å²	75.6	28%	0.277	41%	0.41	S	S	.	.			trans	-70.5	124.8	168.6	-68.1	175.6	0	0	0	108.2	P249 I530 S534	P249-L532 HydrophobicContact CB-CD1 3.72Å; P249-L532 HydrophobicContact CB-CG 4.23Å; P249-L532 HydrophobicContact CG-CB 4.2Å; P249-L532 HydrophobicContact CG-CD1 4.17Å; P249-L532 HydrophobicContact CG-CG 4.25Å; I530-L532 HydrophobicContact CD1-CD1 3.71Å; I530-L532 HydrophobicContact CD1-CD2 3.82Å; I530-L532 HydrophobicContact CD1-CG 3.56Å; I530-L532 HydrophobicContact CG1-CD1 4.37Å; I530-L532 HydrophobicContact CG1-CG 3.95Å; I530-L532 PolarHBondContact O-N 3.21Å; L532-S534 PolarHBondContact O-N 2.98Å
533	S	46.7	Very low	62.1	Low	77 Å²	77	79.8 Å²	79.8	54%	0.538	45%	0.445	S	S	.	.			trans	-58.9	138.4	169	81.9	0	0	0	0	108.4	N531 K535 D536	N531-S533 PolarHBondContact O-N 3.38Å; S533-K535 PolarHBondContact O-N 3.25Å; S533-D536 PolarHBondContact O-N 3.43Å
534	S	40.3	Very low	58.8	Low	113 Å²	113	84.8 Å²	84.8	79%	0.79	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-1.5	-173	52.8	0	0	0	0	115.9	L532	L532-S534 PolarHBondContact O-N 2.98Å
535	K	41.8	Very low	55.7	Low	171 Å²	171	91 Å²	91	74%	0.743	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-29.3	179.6	-94.5	-176.9	172	-179.9	0	114.2	S533 S538	S533-K535 PolarHBondContact O-N 3.25Å; K535-S538 PolarHBondContact O-OG 3.22Å
536	D	43.2	Very low	52.5	Low	118 Å²	118	98.5 Å²	98.5	63%	0.631	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	-11.1	-171.9	-65.6	-38.1	0	0	0	114.5	S533 S538	S533-D536 PolarHBondContact O-N 3.43Å; D536-S538 VanDerWaalsContact C-N 3.3Å; D536-S538 PolarHBondContact O-N 3.26Å
537	M	41.8	Very low	49.4	Very low	136 Å²	136	109.7 Å²	109.7	67%	0.67	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	7.5	177.7	-64.1	-66.3	-80.4	0	0	113.6
538	S	34.3	Very low	46.3	Very low	88 Å²	88	116.5 Å²	116.5	62%	0.615	64%	0.643	S	S	*	*			trans	-100.9	16.8	-171.9	67.6	0	0	0	0	115.7	K535 D536 P540	K535-S538 PolarHBondContact O-OG 3.22Å; D536-S538 VanDerWaalsContact C-N 3.3Å; D536-S538 PolarHBondContact O-N 3.26Å; S538-P540 WeakPolarHBondContact O-CD 3.21Å
539	R	31.7	Very low	43.3	Very low	237 Å²	237	124.9 Å²	124.9	89%	0.894	68%	0.684	S	S	*	*			trans	-99.9	94.9	166.7	-74.2	-172.5	178.3	-177.8	1.4	110.4
540	P	36.6	Very low	40.5	Very low	107 Å²	107	130.9 Å²	130.9	70%	0.695	72%	0.716	S	S	*	*			trans	-71.4	136.2	173.1	27.8	-30.8	0	0	0	110.3	S538 M542	S538-P540 WeakPolarHBondContact O-CD 3.21Å; P540-M542 PolarHBondContact O-N 3.49Å; P540-M542 VanDerWaalsContact O-N 3.14Å
541	A	42.8	Very low	38.3	Very low	104 Å²	104	135 Å²	135	86%	0.86	74%	0.744	S	S	*	*			trans	-55.1	111.9	160.4	0	0	0	0	0	108.9
542	M	30.6	Very low	36.4	Very low	178 Å²	178	139 Å²	139	88%	0.877	76%	0.755	S	S	*	*			trans	-89.6	108.4	167	-89.6	-154.3	175.5	0	0	109.4	P540 A544	P540-M542 PolarHBondContact O-N 3.49Å; P540-M542 VanDerWaalsContact O-N 3.14Å; M542-A544 PolarHBondContact O-N 3.48Å
543	A	34.8	Very low	35.5	Very low	89 Å²	89	145.2 Å²	145.2	74%	0.736	78%	0.782	S	S	*	*			trans	-58.3	112.7	150.2	0	0	0	0	0	108.2	V545	A543-V545 PolarHBondContact O-N 3.42Å
544	A	28.5	Very low	34.8	Very low	106 Å²	106	150.5 Å²	150.5	88%	0.876	80%	0.799	S	S	*	*			trans	-78.3	97.3	166.4	0	0	0	0	0	107.8	M542	M542-A544 PolarHBondContact O-N 3.48Å
545	V	31.8	Very low	34.5	Very low	131 Å²	131	160.2 Å²	160.2	79%	0.794	82%	0.818	S	S	*	*			trans	-97.5	117.2	159	-179.8	0	0	0	0	106.3	A543	A543-V545 PolarHBondContact O-N 3.42Å
546	D	32.4	Very low	34.1	Very low	158 Å²	158	159.7 Å²	159.7	85%	0.845	82%	0.822	S	S	*	*			trans	-48.7	134.5	173.4	-107.1	-34.2	0	0	0	112.1
547	R	32	Very low	33.6	Very low	237 Å²	237	161.9 Å²	161.9	89%	0.894	83%	0.832	S	S	*	*			trans	-152	98.2	155.9	-129.8	179.5	-176.3	-179.1	1.6	111.4
548	D	29.2	Very low	33.2	Very low	150 Å²	150	163.3 Å²	163.3	80%	0.802	84%	0.841	S	S	*	*			trans	18.9	108.1	149.8	-66.2	-35.8	0	0	0	118.6
549	M	31.3	Very low	33.1	Very low	181 Å²	181	167.8 Å²	167.8	89%	0.892	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-91.8	118.5	151.2	-80.2	-159.2	77.3	0	0	109.7
550	M	31	Very low	33.2	Very low	169 Å²	169	163.4 Å²	163.4	83%	0.833	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-90.3	134.3	158.2	-85	-76.5	151.6	0	0	109.5
551	P	38.7	Very low	33	Very low	105 Å²	105	167.2 Å²	167.2	68%	0.682	86%	0.862	S	S	*	*	P	Polyproline II helix	trans	-84.9	141.3	-176.1	32.9	-31.4	0	0	0	111.7
552	K	31.6	Very low	32.3	Very low	211 Å²	211	171.7 Å²	171.7	92%	0.917	86%	0.862	S	S	*	*	P	Polyproline II helix	trans	-64.6	130.2	164.6	-71.8	177.8	175.8	177.8	0	109.2
553	H	34.7	Very low	32.4	Very low	183 Å²	183	171.2 Å²	171.2	85%	0.847	86%	0.861	S	S	*	*	P	Polyproline II helix	trans	-101.6	128.7	160.2	-102.7	20.5	0	0	0	109.4
554	E	32.6	Very low	32.2	Very low	188 Å²	188	178.1 Å²	178.1	88%	0.879	87%	0.872	S	S	*	*	P	Polyproline II helix	trans	-66.6	120.7	157.9	-78.3	176	126.3	0	0	109.6
555	R	32.8	Very low	32.5	Very low	318 Å²	318	184.6 Å²	184.6	100%	1.2	87%	0.871	S	S	*	*				176.1	0	118.3	-97.4	-177.1	-173.9	175.2	3.7	110.5

Retrieved 555 of 555 residues in 975.4 ms (Link to these results)

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