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Synaptotagmin-like protein 1

Binds phosphatidylinositol 3,4,5-trisphosphate (By similarity). May play a role in vesicle trafficking. Acts as a RAB27A effector protein and may play a role in cytotoxic granule exocytosis in lymphocytes.

AlphaFold DB , UniProt , Accession Q99N80, Species MOUSE (Mus musculus, Mouse), Gene Sytl1, Length 567 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.9	Very low	39.7	Very low	234 Å²	234	161 Å²	161	100%	1.153	82%	0.818	S	S	*	*				0	134.2	0	-78.7	-67.5	-167.3	0	0	108.4
2	P	43.2	Very low	39.1	Very low	119 Å²	119	159.6 Å²	159.6	77%	0.773	81%	0.812	S	S	*	*			cis	-85.7	-108.8	-21.7	29.9	-22.7	0	0	0	112.6
3	Q	40.4	Very low	38.6	Very low	136 Å²	136	166.1 Å²	166.1	64%	0.636	82%	0.821	S	S	*	*			trans	-158.3	147.5	-139.1	-78.7	-175.9	46.5	0	0	117.3
4	R	42.3	Very low	38.3	Very low	229 Å²	229	160.6 Å²	160.6	86%	0.864	82%	0.816	S	S	*	*			trans	70.5	149	156.9	-58.4	162.6	-149.6	-156.4	4.8	118
5	G	39.9	Very low	37.7	Very low	75 Å²	75	160.9 Å²	160.9	77%	0.773	82%	0.819	S	S	*	*			cis	-179.6	160.7	-6.9	0	0	0	0	0	117
6	H	41.6	Very low	37.4	Very low	189 Å²	189	158.8 Å²	158.8	88%	0.875	82%	0.819	S	S	*	*			trans	-32.3	173.8	157.6	-89.2	-60.8	0	0	0	119.1
7	P	45.2	Very low	37.1	Very low	100 Å²	100	155.8 Å²	155.8	65%	0.649	82%	0.815	S	S	*	*			cis	-142.4	-171	-8.8	34.2	-12.1	0	0	0	116.4
8	S	40	Very low	36.9	Very low	112 Å²	112	156.9 Å²	156.9	78%	0.783	82%	0.821	S	S	*	*			trans	76.3	147.9	149.6	-60.7	0	0	0	0	118.1
9	Q	38	Very low	36.9	Very low	187 Å²	187	154 Å²	154	87%	0.874	81%	0.813	S	S	*	*			cis	-141.8	161.1	26.7	-168	170.4	14.6	0	0	113.8
10	E	33.8	Very low	36.8	Very low	160 Å²	160	154.7 Å²	154.7	75%	0.748	81%	0.813	S	S	*	*			trans	-90.1	161.9	-171.9	-52.2	144.2	115.2	0	0	114.3
11	R	35.4	Very low	36.7	Very low	230 Å²	230	152.1 Å²	152.1	87%	0.868	82%	0.815	S	S	*	*			trans	-156.2	123.8	138.3	-115.5	173.6	-163.4	-160.7	2.4	112.7
12	L	32	Very low	36.5	Very low	144 Å²	144	150.2 Å²	150.2	75%	0.754	80%	0.802	S	S	*	*			trans	-85.3	154.2	168.6	-62	118.2	0	0	0	110.7
13	W	32.7	Very low	35.9	Very low	244 Å²	244	147.2 Å²	147.2	92%	0.924	79%	0.793	S	S	*	*			trans	-139.8	133.7	144.2	-79.9	112	0	0	0	109.7
14	A	34.9	Very low	35.5	Very low	90 Å²	90	148 Å²	148	74%	0.744	81%	0.81	S	S	*	*			trans	-111.6	168.7	-179.4	0	0	0	0	0	111.1
15	L	29	Very low	35	Very low	165 Å²	165	140.4 Å²	140.4	86%	0.864	80%	0.804	S	S	*	*			trans	-63.2	142.8	177.9	-62.8	168.6	0	0	0	112.5
16	P	33.7	Very low	34.9	Very low	127 Å²	127	140.4 Å²	140.4	83%	0.825	79%	0.791	S	S	*	*			trans	-92.2	115.2	156.4	32.6	-25.6	0	0	0	110.6
17	S	31.5	Very low	35	Very low	108 Å²	108	139 Å²	139	76%	0.755	79%	0.785	S	S	*	*			trans	-88.3	142.2	160.2	-54.3	0	0	0	0	109.4
18	L	34.4	Very low	35.1	Very low	175 Å²	175	138.5 Å²	138.5	92%	0.916	78%	0.78	S	S	*	*			trans	-178.7	163.3	156.2	-94.7	161	0	0	0	108
19	P	36	Very low	35.9	Very low	102 Å²	102	141.9 Å²	141.9	66%	0.662	78%	0.783	S	S	*	*			trans	-134.7	178.1	-136.2	44.7	-29.7	0	0	0	117.1
20	M	34.7	Very low	37.5	Very low	167 Å²	167	135.3 Å²	135.3	82%	0.823	77%	0.766	S	S	*	*			trans	54.2	97.8	147.4	-72.2	-73.4	-76.2	0	0	119.5
21	A	34.5	Very low	39.6	Very low	102 Å²	102	130.2 Å²	130.2	84%	0.843	74%	0.744	S	S	*	*			trans	-153.2	125.5	142.4	0	0	0	0	0	110.2
22	H	33.1	Very low	41.8	Very low	193 Å²	193	123.2 Å²	123.2	89%	0.894	72%	0.723	S	S	*	*			trans	-84.5	134.8	169.4	-87.6	-86.8	0	0	0	110.3
23	G	30.5	Very low	44.2	Very low	57 Å²	57	121.5 Å²	121.5	59%	0.588	72%	0.715	S	S	*	*			trans	-138.6	133.3	166.5	0	0	0	0	0	110.1	G25	G23-G25 PolarHBondContact O-N 3.08Å; G23-G25 VanDerWaalsContact O-N 3.08Å
24	P	31.6	Very low	46.7	Very low	151 Å²	151	111 Å²	111	98%	0.981	68%	0.676	S	S	*	*			trans	-81.6	87.2	-176.9	31.6	-34	0	0	0	111.8
25	G	32.1	Very low	48.9	Very low	71 Å²	71	110.5 Å²	110.5	73%	0.732	67%	0.668	S	S	*	*			trans	179.5	142.3	170.7	0	0	0	0	0	111.1	G23	G23-G25 PolarHBondContact O-N 3.08Å; G23-G25 VanDerWaalsContact O-N 3.08Å
26	S	37.6	Very low	51.6	Low	74 Å²	74	109.5 Å²	109.5	52%	0.517	66%	0.657	S	S	.	*			cis	-138.1	111.9	8.9	48.9	0	0	0	0	112.8	V28	S26-V28 PolarHBondContact O-N 3.28Å
27	E	44.5	Very low	54	Low	160 Å²	160	104.4 Å²	104.4	75%	0.748	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	37.8	164.2	-64.1	-174.7	141.6	0	0	112.3	R108	E27-R108 VanDerWaalsContact CB-NH2 3.27Å; E27-R108 VanDerWaalsContact O-CZ 3.24Å; E27-R108 PolarHBondContact O-NH1 2.86Å; E27-R108 PolarHBondContact O-NH2 3.46Å; E27-R108 IonicContact OE2-NH2 3.16Å; E27-R108 PolarHBondContact OE2-NH2 2.93Å; E27-R108 VanDerWaalsContact OE2-NH2 3.16Å
28	V	47.7	Very low	56.8	Low	89 Å²	89	102.7 Å²	102.7	54%	0.539	61%	0.607	S	S	.	*	T	Hydrogen-bonded Turn	trans	-108.6	-36.9	-167.8	-175.4	0	0	0	0	111.6	S26 G30 L31	S26-V28 PolarHBondContact O-N 3.28Å; V28-G30 PolarHBondContact O-N 3.16Å; V28-G30 VanDerWaalsContact O-N 3.11Å; V28-L31 PolarHBondContact O-N 2.86Å
29	E	56.7	Low	59.3	Low	183 Å²	183	101.5 Å²	101.5	86%	0.855	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	-9.7	-171.7	-61.9	-178.5	117.9	0	0	115.1
30	G	71.7	Confident	62	Low	49 Å²	49	104.4 Å²	104.4	51%	0.505	60%	0.602	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102	-15.1	178.8	0	0	0	0	0	115.8	V28 L101	V28-G30 PolarHBondContact O-N 3.16Å; V28-G30 VanDerWaalsContact O-N 3.11Å; G30-L101 WeakPolarHBondContact O-CD1 3.41Å
31	L	77.7	Confident	64.7	Low	53 Å²	53	100.7 Å²	100.7	28%	0.277	58%	0.582	S	S	.	*	S	Bend	trans	-84.2	149.3	-172.9	-90.4	66.4	0	0	0	111.9	V28 A104 R108	V28-L31 PolarHBondContact O-N 2.86Å; L31-A104 HydrophobicContact CD2-CB 4.46Å; L31-R108 HydrophobicContact CD2-CG 3.97Å
32	L	80.6	Confident	67.3	Low	83 Å²	83	97.2 Å²	97.2	44%	0.435	55%	0.549	S	S	.	.	P	Polyproline II helix	trans	-76.7	135.3	174.7	-61.1	171	0	0	0	109.3	L34 L101 V102 S105	L32-L34 HydrophobicContact CB-CD2 4.2Å; L32-L34 HydrophobicContact CB-CG 4.19Å; L32-L34 PolarHBondContact O-N 2.81Å; L32-L101 HydrophobicContact CD1-CD2 4.47Å; L32-L101 HydrophobicContact CD2-CD2 4.44Å; L32-L101 HydrophobicContact CG-CD2 4.15Å; L32-V102 HydrophobicContact CD1-CG2 3.78Å; L32-S105 PolarHBondContact N-OG 2.87Å; L32-S105 WeakPolarHBondContact O-CB 3.4Å
33	D	83.6	Confident	70	Confident	109 Å²	109	94.1 Å²	94.1	58%	0.583	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-67.4	128.5	160.1	-175	13.6	0	0	0	108.8	S35 F36	D33-S35 VanDerWaalsContact CG-OG 3.28Å; D33-S35 WeakPolarHBondContact OD1-CB 3.46Å; D33-S35 PolarHBondContact OD1-N 2.92Å; D33-S35 PolarHBondContact OD1-OG 2.84Å; D33-S35 PolarHBondContact OD2-OG 3.42Å; D33-S35 VanDerWaalsContact OD2-OG 3.06Å; D33-F36 WeakPolarHBondContact O-CE1 3.21Å
34	L	84.3	Confident	73	Confident	23 Å²	23	94 Å²	94	12%	0.12	53%	0.528	C	S	.	.			trans	-133.5	19	179	-61.2	179.6	0	0	0	110.8	L32 F36 L37 V102 I106 K109	L32-L34 HydrophobicContact CB-CD2 4.2Å; L32-L34 HydrophobicContact CB-CG 4.19Å; L32-L34 PolarHBondContact O-N 2.81Å; L34-F36 VanDerWaalsContact C-N 3.26Å; L34-F36 HydrophobicContact CD2-CZ 4.48Å; L34-F36 PolarHBondContact O-N 2.95Å; L34-L37 HydrophobicContact CB-CD1 4.08Å; L34-L37 HydrophobicContact CB-CG 4.47Å; L34-L37 HydrophobicContact CD2-CD1 3.99Å; L34-L37 HydrophobicContact CG-CD1 4.44Å; L34-L37 PolarHBondContact O-N 3.1Å; L34-V102 HydrophobicContact CD1-CG1 4.45Å; L34-I106 HydrophobicContact CD1-CG1 3.61Å; L34-K109 PolarHBondContact O-NZ 2.88Å
35	S	81.1	Confident	75.8	Confident	80 Å²	80	89.6 Å²	89.6	56%	0.559	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-35.6	179	59	0	0	0	0	112.7	D33 L37	D33-S35 VanDerWaalsContact CG-OG 3.28Å; D33-S35 WeakPolarHBondContact OD1-CB 3.46Å; D33-S35 PolarHBondContact OD1-N 2.92Å; D33-S35 PolarHBondContact OD1-OG 2.84Å; D33-S35 PolarHBondContact OD2-OG 3.42Å; D33-S35 VanDerWaalsContact OD2-OG 3.06Å; S35-L37 VanDerWaalsContact C-N 3.32Å; S35-L37 PolarHBondContact O-N 2.75Å
36	F	86.6	Confident	78.6	Confident	144 Å²	144	88.2 Å²	88.2	63%	0.632	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-14.4	-179.3	56.6	-97.4	0	0	0	115.1	D33 L34	D33-F36 WeakPolarHBondContact O-CE1 3.21Å; L34-F36 VanDerWaalsContact C-N 3.26Å; L34-F36 HydrophobicContact CD2-CZ 4.48Å; L34-F36 PolarHBondContact O-N 2.95Å
37	L	84.4	Confident	81.2	Confident	20 Å²	20	87.5 Å²	87.5	11%	0.105	47%	0.465	C	S	.	.			trans	-71.8	133.8	179.5	-65.9	-178.9	0	0	0	111.6	L34 S35 E41 I45 K109	L34-L37 HydrophobicContact CB-CD1 4.08Å; L34-L37 HydrophobicContact CB-CG 4.47Å; L34-L37 HydrophobicContact CD2-CD1 3.99Å; L34-L37 HydrophobicContact CG-CD1 4.44Å; L34-L37 PolarHBondContact O-N 3.1Å; S35-L37 VanDerWaalsContact C-N 3.32Å; S35-L37 PolarHBondContact O-N 2.75Å; L37-E41 HydrophobicContact CB-CB 4.46Å; L37-E41 HydrophobicContact CD2-CB 4.09Å; L37-I45 HydrophobicContact CD1-CD1 3.63Å; L37-I45 HydrophobicContact CD2-CD1 4.28Å; L37-K109 PolarHBondContact O-NZ 3.01Å
38	T	89.4	Confident	83.6	Confident	71 Å²	71	83 Å²	83	44%	0.436	45%	0.449	S	S	.	.			trans	-63.9	168.5	164.1	61	0	0	0	0	111.7	E41 Q42	T38-E41 WeakPolarHBondContact CB-OE2 3.27Å; T38-E41 WeakPolarHBondContact CG2-OE2 3.4Å; T38-E41 PolarHBondContact N-OE2 3.32Å; T38-E41 WeakPolarHBondContact OG1-CB 3.38Å; T38-E41 VanDerWaalsContact OG1-CG 3.23Å; T38-E41 WeakPolarHBondContact OG1-CG 3.31Å; T38-E41 PolarHBondContact OG1-N 3.44Å; T38-E41 PolarHBondContact OG1-OE2 3.37Å; T38-Q42 VanDerWaalsContact O-CB 3.29Å; T38-Q42 WeakPolarHBondContact O-CB 3.45Å; T38-Q42 PolarHBondContact O-N 3.34Å; T38-Q42 VanDerWaalsContact O-N 3.11Å
39	E	88.1	Confident	85.6	Confident	151 Å²	151	79.6 Å²	79.6	71%	0.706	43%	0.427	S	S	*	.	H	α-helix	trans	-67.6	-38.4	174.7	-172.3	152.9	-140.8	0	0	111.6	Q42 E43	E39-Q42 PolarHBondContact O-N 3.06Å; E39-E43 PolarHBondContact O-N 3.44Å
40	E	90.8	Very high	87.3	Confident	162 Å²	162	76.5 Å²	76.5	76%	0.757	41%	0.411	S	S	*	.	H	α-helix	trans	-60.8	-47.9	175.9	-62.5	175.6	-169.7	0	0	112.1	Q42 E43 A44	E40-Q42 VanDerWaalsContact C-N 3.33Å; E40-Q42 PolarHBondContact O-N 3.43Å; E40-E43 PolarHBondContact O-N 2.89Å; E40-A44 WeakPolarHBondContact O-CB 3.28Å; E40-A44 PolarHBondContact O-N 3.41Å
41	E	91.4	Very high	88.3	Confident	89 Å²	89	80.9 Å²	80.9	42%	0.416	41%	0.412	S	S	.	.	H	α-helix	trans	-63.5	-39.1	174.9	-70.4	165.9	114.6	0	0	111.9	L37 T38 A44 I45	L37-E41 HydrophobicContact CB-CB 4.46Å; L37-E41 HydrophobicContact CD2-CB 4.09Å; T38-E41 WeakPolarHBondContact CB-OE2 3.27Å; T38-E41 WeakPolarHBondContact CG2-OE2 3.4Å; T38-E41 PolarHBondContact N-OE2 3.32Å; T38-E41 WeakPolarHBondContact OG1-CB 3.38Å; T38-E41 VanDerWaalsContact OG1-CG 3.23Å; T38-E41 WeakPolarHBondContact OG1-CG 3.31Å; T38-E41 PolarHBondContact OG1-N 3.44Å; T38-E41 PolarHBondContact OG1-OE2 3.37Å; E41-A44 PolarHBondContact O-N 3.18Å; E41-I45 WeakPolarHBondContact O-CB 3.36Å; E41-I45 WeakPolarHBondContact O-CD1 3.39Å; E41-I45 VanDerWaalsContact O-CG1 3.24Å; E41-I45 WeakPolarHBondContact O-CG1 3.37Å; E41-I45 PolarHBondContact O-N 2.85Å
42	Q	89.4	Confident	88.8	Confident	30 Å²	30	81.2 Å²	81.2	14%	0.14	41%	0.414	C	S	.	.	H	α-helix	trans	-67.2	-36.8	179	-172.2	-178.1	-67.5	0	0	112	T38 E39 E40 S46 I106 K109	T38-Q42 VanDerWaalsContact O-CB 3.29Å; T38-Q42 WeakPolarHBondContact O-CB 3.45Å; T38-Q42 PolarHBondContact O-N 3.34Å; T38-Q42 VanDerWaalsContact O-N 3.11Å; E39-Q42 PolarHBondContact O-N 3.06Å; E40-Q42 VanDerWaalsContact C-N 3.33Å; E40-Q42 PolarHBondContact O-N 3.43Å; Q42-S46 WeakPolarHBondContact O-CB 3.36Å; Q42-S46 PolarHBondContact O-N 3.11Å; Q42-I106 HydrophobicContact CG-CG2 4.04Å; Q42-K109 VanDerWaalsContact OE1-CD 3.26Å; Q42-K109 VanDerWaalsContact OE1-CE 3.24Å
43	E	90.7	Very high	89.3	Confident	128 Å²	128	79.3 Å²	79.3	60%	0.598	41%	0.411	S	S	*	.	H	α-helix	trans	-68.7	-46	172.4	-178.4	157.6	-124.1	0	0	111.5	E39 E40 I45 S46 D47	E39-E43 PolarHBondContact O-N 3.44Å; E40-E43 PolarHBondContact O-N 2.89Å; E43-I45 VanDerWaalsContact C-N 3.3Å; E43-I45 PolarHBondContact O-N 3.28Å; E43-S46 CarbonylContact O-C 3.59Å; E43-S46 WeakPolarHBondContact O-CA 3.46Å; E43-S46 VanDerWaalsContact O-CB 3.27Å; E43-S46 WeakPolarHBondContact O-CB 3.46Å; E43-S46 PolarHBondContact O-N 3.45Å; E43-D47 PolarHBondContact O-N 3.14Å
44	A	93.3	Very high	89.7	Confident	55 Å²	55	79.5 Å²	79.5	46%	0.455	41%	0.408	S	S	.	.	H	α-helix	trans	-57.1	-42.2	176	0	0	0	0	0	112.3	E40 E41 D47 V48	E40-A44 WeakPolarHBondContact O-CB 3.28Å; E40-A44 PolarHBondContact O-N 3.41Å; E41-A44 PolarHBondContact O-N 3.18Å; A44-D47 PolarHBondContact O-N 3.26Å; A44-V48 WeakPolarHBondContact O-CG2 3.43Å; A44-V48 PolarHBondContact O-N 3.23Å; A44-V48 VanDerWaalsContact O-N 3.13Å
45	I	90.8	Very high	90	Very high	57 Å²	57	83.6 Å²	83.6	29%	0.292	43%	0.429	S	S	.	.	H	α-helix	trans	-67.6	-39.8	173.8	-67.4	162.2	0	0	0	111.2	L37 E41 E43 D47 V48 L49 V102 I106	L37-I45 HydrophobicContact CD1-CD1 3.63Å; L37-I45 HydrophobicContact CD2-CD1 4.28Å; E41-I45 WeakPolarHBondContact O-CB 3.36Å; E41-I45 WeakPolarHBondContact O-CD1 3.39Å; E41-I45 VanDerWaalsContact O-CG1 3.24Å; E41-I45 WeakPolarHBondContact O-CG1 3.37Å; E41-I45 PolarHBondContact O-N 2.85Å; E43-I45 VanDerWaalsContact C-N 3.3Å; E43-I45 PolarHBondContact O-N 3.28Å; I45-D47 VanDerWaalsContact C-N 3.31Å; I45-D47 PolarHBondContact O-N 3.44Å; I45-V48 PolarHBondContact O-N 3.16Å; I45-L49 HydrophobicContact CG2-CD1 4.09Å; I45-L49 HydrophobicContact CG2-CG 4.45Å; I45-L49 WeakPolarHBondContact O-CG 3.45Å; I45-L49 PolarHBondContact O-N 2.99Å; I45-V102 HydrophobicContact CG2-CG1 3.81Å; I45-I106 HydrophobicContact CB-CD1 4.45Å; I45-I106 HydrophobicContact CG2-CD1 3.73Å
46	S	89.7	Confident	90.4	Very high	43 Å²	43	83.8 Å²	83.8	30%	0.301	42%	0.418	S	S	.	.	H	α-helix	trans	-58.3	-43.4	174.9	-167.4	0	0	0	0	111.6	Q42 E43 L49 K50	Q42-S46 WeakPolarHBondContact O-CB 3.36Å; Q42-S46 PolarHBondContact O-N 3.11Å; E43-S46 CarbonylContact O-C 3.59Å; E43-S46 WeakPolarHBondContact O-CA 3.46Å; E43-S46 VanDerWaalsContact O-CB 3.27Å; E43-S46 WeakPolarHBondContact O-CB 3.46Å; E43-S46 PolarHBondContact O-N 3.45Å; S46-L49 CarbonylContact O-C 3.59Å; S46-L49 WeakPolarHBondContact O-CA 3.34Å; S46-L49 WeakPolarHBondContact O-CB 3.46Å; S46-L49 PolarHBondContact O-N 3.25Å; S46-L49 VanDerWaalsContact O-N 3.13Å; S46-K50 WeakPolarHBondContact O-CG 3.25Å; S46-K50 PolarHBondContact O-N 3.1Å
47	D	92.8	Very high	90.6	Very high	59 Å²	59	83.5 Å²	83.5	32%	0.316	42%	0.418	S	S	.	.	H	α-helix	trans	-70.8	-32.8	179.5	-87.5	12.2	0	0	0	113.6	E43 A44 I45 K50 R51	E43-D47 PolarHBondContact O-N 3.14Å; A44-D47 PolarHBondContact O-N 3.26Å; I45-D47 VanDerWaalsContact C-N 3.31Å; I45-D47 PolarHBondContact O-N 3.44Å; D47-K50 PolarHBondContact O-N 2.8Å; D47-K50 WeakPolarHBondContact OD1-CD 3.46Å; D47-K50 VanDerWaalsContact OD1-CE 3.29Å; D47-K50 WeakPolarHBondContact OD1-CE 3.49Å; D47-K50 IonicContact OD1-NZ 2.63Å; D47-K50 PolarHBondContact OD1-NZ 3.3Å; D47-R51 WeakPolarHBondContact O-CB 3.34Å; D47-R51 WeakPolarHBondContact O-CG 3.26Å; D47-R51 PolarHBondContact O-N 3.1Å; D47-R51 PolarHBondContact O-NE 2.94Å; D47-R51 VanDerWaalsContact O-NE 3.1Å
48	V	94.5	Very high	91	Very high	65 Å²	65	87.4 Å²	87.4	39%	0.394	44%	0.439	S	S	.	.	H	α-helix	trans	-61.4	-47.1	166.3	172.9	0	0	0	0	109.7	A44 I45 K50 R51 D52	A44-V48 WeakPolarHBondContact O-CG2 3.43Å; A44-V48 PolarHBondContact O-N 3.23Å; A44-V48 VanDerWaalsContact O-N 3.13Å; I45-V48 PolarHBondContact O-N 3.16Å; V48-K50 VanDerWaalsContact C-N 3.26Å; V48-K50 PolarHBondContact O-N 2.77Å; V48-R51 PolarHBondContact O-N 3.07Å; V48-R51 VanDerWaalsContact O-N 3.15Å; V48-D52 WeakPolarHBondContact O-CB 3.18Å; V48-D52 PolarHBondContact O-N 3.03Å
49	L	91.3	Very high	91	Very high	17 Å²	17	87.7 Å²	87.7	9%	0.089	44%	0.435	C	S	.	.	H	α-helix	trans	-66.4	-20.1	179	-68.8	172.3	0	0	0	114.9	I45 S46 V102 R103 I106	I45-L49 HydrophobicContact CG2-CD1 4.09Å; I45-L49 HydrophobicContact CG2-CG 4.45Å; I45-L49 WeakPolarHBondContact O-CG 3.45Å; I45-L49 PolarHBondContact O-N 2.99Å; S46-L49 CarbonylContact O-C 3.59Å; S46-L49 WeakPolarHBondContact O-CA 3.34Å; S46-L49 WeakPolarHBondContact O-CB 3.46Å; S46-L49 PolarHBondContact O-N 3.25Å; S46-L49 VanDerWaalsContact O-N 3.13Å; L49-V102 HydrophobicContact CD1-CB 4.37Å; L49-V102 HydrophobicContact CD1-CG1 3.88Å; L49-R103 HydrophobicContact CD1-CB 4.25Å; L49-R103 PolarHBondContact O-NH2 3.47Å; L49-R103 VanDerWaalsContact O-NH2 3.07Å; L49-I106 HydrophobicContact CD1-CD1 4.13Å
50	K	90.7	Very high	91.1	Very high	118 Å²	118	87 Å²	87	51%	0.513	43%	0.432	S	S	.	.	H	α-helix	trans	-77.1	-50.3	167.8	-67.2	169.8	-159.7	166.6	0	110.7	S46 D47 V48 D52 A53 H54	S46-K50 WeakPolarHBondContact O-CG 3.25Å; S46-K50 PolarHBondContact O-N 3.1Å; D47-K50 PolarHBondContact O-N 2.8Å; D47-K50 WeakPolarHBondContact OD1-CD 3.46Å; D47-K50 VanDerWaalsContact OD1-CE 3.29Å; D47-K50 WeakPolarHBondContact OD1-CE 3.49Å; D47-K50 IonicContact OD1-NZ 2.63Å; D47-K50 PolarHBondContact OD1-NZ 3.3Å; V48-K50 VanDerWaalsContact C-N 3.26Å; V48-K50 PolarHBondContact O-N 2.77Å; K50-D52 PolarHBondContact O-N 2.62Å; K50-A53 WeakPolarHBondContact O-CB 3.35Å; K50-A53 PolarHBondContact O-N 2.91Å; K50-A53 VanDerWaalsContact O-N 3.14Å; K50-H54 PolarHBondContact O-N 3.28Å; K50-H54 VanDerWaalsContact O-N 3.11Å
51	R	92.5	Very high	91.2	Very high	141 Å²	141	80.7 Å²	80.7	53%	0.532	41%	0.41	S	S	.	.	H	α-helix	trans	-59.9	-44.9	179	-77.5	175.4	-92.1	135.2	-8.9	112	D47 V48 A53 H54 L55	D47-R51 WeakPolarHBondContact O-CB 3.34Å; D47-R51 WeakPolarHBondContact O-CG 3.26Å; D47-R51 PolarHBondContact O-N 3.1Å; D47-R51 PolarHBondContact O-NE 2.94Å; D47-R51 VanDerWaalsContact O-NE 3.1Å; V48-R51 PolarHBondContact O-N 3.07Å; V48-R51 VanDerWaalsContact O-N 3.15Å; R51-A53 VanDerWaalsContact C-N 3.31Å; R51-A53 PolarHBondContact O-N 2.99Å; R51-H54 PolarHBondContact O-N 3.49Å; R51-L55 WeakPolarHBondContact O-CB 3.47Å; R51-L55 WeakPolarHBondContact O-CG 3.49Å; R51-L55 PolarHBondContact O-N 3.22Å
52	D	89.7	Confident	91.3	Very high	60 Å²	60	81.1 Å²	81.1	32%	0.321	41%	0.408	S	S	.	.	H	α-helix	trans	-55.3	-42	172.5	-98.4	39	0	0	0	113	V48 K50 R56	V48-D52 WeakPolarHBondContact O-CB 3.18Å; V48-D52 PolarHBondContact O-N 3.03Å; K50-D52 PolarHBondContact O-N 2.62Å; D52-R56 WeakPolarHBondContact O-CG 3.27Å; D52-R56 PolarHBondContact O-N 3.4Å; D52-R56 IonicContact OD2-NH2 3.73Å; D52-R56 PolarHBondContact OD2-NH2 3.07Å
53	A	89.7	Confident	91.3	Very high	44 Å²	44	80.4 Å²	80.4	36%	0.364	41%	0.406	S	S	.	.	H	α-helix	trans	-68.8	-43.4	-178.8	0	0	0	0	0	111.4	K50 R51 R56 Q57	K50-A53 WeakPolarHBondContact O-CB 3.35Å; K50-A53 PolarHBondContact O-N 2.91Å; K50-A53 VanDerWaalsContact O-N 3.14Å; R51-A53 VanDerWaalsContact C-N 3.31Å; R51-A53 PolarHBondContact O-N 2.99Å; A53-R56 PolarHBondContact O-N 3.4Å; A53-Q57 PolarHBondContact O-N 3.36Å
54	H	92.9	Very high	91.3	Very high	113 Å²	113	77.6 Å²	77.6	52%	0.523	40%	0.4	S	S	.	.	H	α-helix	trans	-63.4	-43	175.1	-178	-109.3	0	0	0	112.1	K50 R51 R56 Q57 L58	K50-H54 PolarHBondContact O-N 3.28Å; K50-H54 VanDerWaalsContact O-N 3.11Å; R51-H54 PolarHBondContact O-N 3.49Å; H54-R56 PolarHBondContact O-N 3.29Å; H54-Q57 PolarHBondContact O-N 3.04Å; H54-L58 WeakPolarHBondContact O-CG 3.17Å; H54-L58 PolarHBondContact O-N 2.93Å
55	L	91.6	Very high	91.3	Very high	108 Å²	108	82.4 Å²	82.4	57%	0.565	41%	0.411	S	S	*	.	H	α-helix	trans	-61.1	-41.8	175.2	-73.1	169.7	0	0	0	112	R51 L58 E59	R51-L55 WeakPolarHBondContact O-CB 3.47Å; R51-L55 WeakPolarHBondContact O-CG 3.49Å; R51-L55 PolarHBondContact O-N 3.22Å; L55-L58 PolarHBondContact O-N 3.21Å; L55-E59 VanDerWaalsContact O-CB 3.27Å; L55-E59 WeakPolarHBondContact O-CB 3.33Å; L55-E59 PolarHBondContact O-N 3.1Å
56	R	89	Confident	91.3	Very high	84 Å²	84	81.1 Å²	81.1	32%	0.317	40%	0.404	S	S	.	.	H	α-helix	trans	-63.3	-39	173.9	-73.5	178.1	-149.9	177.7	9.5	112.9	D52 A53 H54 E59 E60 S99	D52-R56 WeakPolarHBondContact O-CG 3.27Å; D52-R56 PolarHBondContact O-N 3.4Å; D52-R56 IonicContact OD2-NH2 3.73Å; D52-R56 PolarHBondContact OD2-NH2 3.07Å; A53-R56 PolarHBondContact O-N 3.4Å; H54-R56 PolarHBondContact O-N 3.29Å; R56-E59 PolarHBondContact O-N 2.63Å; R56-E60 VanDerWaalsContact O-CB 3.28Å; R56-E60 WeakPolarHBondContact O-CB 3.31Å; R56-E60 PolarHBondContact O-N 3.17Å; R56-S99 PolarHBondContact NH1-OG 2.91Å; R56-S99 PolarHBondContact NH2-OG 3.13Å
57	Q	90.7	Very high	91.3	Very high	139 Å²	139	85.4 Å²	85.4	65%	0.65	41%	0.414	S	S	*	.	H	α-helix	trans	-66.8	-39.9	178.4	-170.3	179.7	6.6	0	0	112.1	A53 H54 G61	A53-Q57 PolarHBondContact O-N 3.36Å; H54-Q57 PolarHBondContact O-N 3.04Å; Q57-G61 PolarHBondContact O-N 3.18Å
58	L	92.4	Very high	91.2	Very high	101 Å²	101	86.9 Å²	86.9	53%	0.529	44%	0.435	S	S	.	.	H	α-helix	trans	-64	-42	172.1	-69	176.2	0	0	0	111.7	H54 L55 G61 R62	H54-L58 WeakPolarHBondContact O-CG 3.17Å; H54-L58 PolarHBondContact O-N 2.93Å; L55-L58 PolarHBondContact O-N 3.21Å; L58-G61 CarbonylContact O-C 3.52Å; L58-G61 PolarHBondContact O-N 3.39Å; L58-R62 PolarHBondContact O-N 3.32Å
59	E	89.5	Confident	91	Very high	78 Å²	78	88 Å²	88	36%	0.364	45%	0.446	S	S	.	.	H	α-helix	trans	-69.2	-41.9	-179.7	-179.9	60.6	-174.5	0	0	112.5	L55 R56 G61 R62 V63	L55-E59 VanDerWaalsContact O-CB 3.27Å; L55-E59 WeakPolarHBondContact O-CB 3.33Å; L55-E59 PolarHBondContact O-N 3.1Å; R56-E59 PolarHBondContact O-N 2.63Å; E59-G61 VanDerWaalsContact C-N 3.3Å; E59-G61 PolarHBondContact O-N 3.19Å; E59-R62 CarbonylContact O-C 3.45Å; E59-R62 WeakPolarHBondContact O-CA 3.47Å; E59-R62 WeakPolarHBondContact O-CB 3.47Å; E59-R62 PolarHBondContact O-N 3.11Å; E59-R62 IonicContact OE1-CZ 3.78Å; E59-R62 IonicContact OE1-NE 2.66Å; E59-R62 PolarHBondContact OE1-NE 2.9Å; E59-R62 IonicContact OE1-NH2 3.76Å; E59-R62 PolarHBondContact OE1-NH2 3.05Å; E59-R62 IonicContact OE2-CZ 3.64Å; E59-R62 IonicContact OE2-NE 3.62Å; E59-R62 PolarHBondContact OE2-NE 3.49Å; E59-R62 IonicContact OE2-NH2 3.67Å; E59-V63 WeakPolarHBondContact O-CB 3.36Å; E59-V63 WeakPolarHBondContact O-CG2 3.28Å; E59-V63 PolarHBondContact O-N 3.02Å
60	E	90.2	Very high	90.7	Very high	135 Å²	135	89.1 Å²	89.1	63%	0.631	45%	0.451	S	S	*	.	H	α-helix	trans	-60.6	-41	171.5	-175.7	169.3	-152.8	0	0	110.8	R56 R62 V63 S64	R56-E60 VanDerWaalsContact O-CB 3.28Å; R56-E60 WeakPolarHBondContact O-CB 3.31Å; R56-E60 PolarHBondContact O-N 3.17Å; E60-R62 VanDerWaalsContact C-N 3.33Å; E60-R62 PolarHBondContact O-N 3.24Å; E60-V63 PolarHBondContact O-N 3.48Å; E60-S64 WeakPolarHBondContact O-CB 3.39Å; E60-S64 PolarHBondContact O-N 3.37Å; E60-S64 PolarHBondContact O-OG 3.24Å
61	G	92.5	Very high	90.5	Very high	30 Å²	30	92.8 Å²	92.8	31%	0.309	47%	0.47	S	S	.	.	H	α-helix	trans	-63.6	-31.6	170.9	0	0	0	0	0	114.3	Q57 L58 E59 K65	Q57-G61 PolarHBondContact O-N 3.18Å; L58-G61 CarbonylContact O-C 3.52Å; L58-G61 PolarHBondContact O-N 3.39Å; E59-G61 VanDerWaalsContact C-N 3.3Å; E59-G61 PolarHBondContact O-N 3.19Å; G61-K65 WeakPolarHBondContact O-CD 3.36Å; G61-K65 VanDerWaalsContact O-CG 3.27Å; G61-K65 WeakPolarHBondContact O-CG 3.34Å; G61-K65 PolarHBondContact O-N 2.87Å
62	R	94.1	Very high	90.2	Very high	99 Å²	99	88.8 Å²	88.8	37%	0.374	46%	0.459	S	S	.	.	H	α-helix	trans	-72.9	-47.1	173.9	-170.6	-170.6	71.8	82.4	7.2	111.1	L58 E59 E60 K65 L66 L79	L58-R62 PolarHBondContact O-N 3.32Å; E59-R62 CarbonylContact O-C 3.45Å; E59-R62 WeakPolarHBondContact O-CA 3.47Å; E59-R62 WeakPolarHBondContact O-CB 3.47Å; E59-R62 PolarHBondContact O-N 3.11Å; E59-R62 IonicContact OE1-CZ 3.78Å; E59-R62 IonicContact OE1-NE 2.66Å; E59-R62 PolarHBondContact OE1-NE 2.9Å; E59-R62 IonicContact OE1-NH2 3.76Å; E59-R62 PolarHBondContact OE1-NH2 3.05Å; E59-R62 IonicContact OE2-CZ 3.64Å; E59-R62 IonicContact OE2-NE 3.62Å; E59-R62 PolarHBondContact OE2-NE 3.49Å; E59-R62 IonicContact OE2-NH2 3.67Å; E60-R62 VanDerWaalsContact C-N 3.33Å; E60-R62 PolarHBondContact O-N 3.24Å; R62-K65 PolarHBondContact O-N 2.69Å; R62-L66 VanDerWaalsContact NH1-CD1 3.26Å; R62-L66 PolarHBondContact O-N 2.92Å; R62-L79 VanDerWaalsContact CZ-O 3.3Å; R62-L79 PolarHBondContact NH1-O 3.34Å; R62-L79 PolarHBondContact NH2-O 3.02Å
63	V	89	Confident	90	Very high	15 Å²	15	90.7 Å²	90.7	9%	0.091	48%	0.475	C	S	.	.	H	α-helix	trans	-61.4	-43.8	177.2	167.4	0	0	0	0	111.1	E59 E60 K65 L66 R67 T80	E59-V63 WeakPolarHBondContact O-CB 3.36Å; E59-V63 WeakPolarHBondContact O-CG2 3.28Å; E59-V63 PolarHBondContact O-N 3.02Å; E60-V63 PolarHBondContact O-N 3.48Å; V63-K65 VanDerWaalsContact C-N 3.34Å; V63-K65 PolarHBondContact O-N 3.22Å; V63-L66 PolarHBondContact O-N 3.46Å; V63-R67 HydrophobicContact CG1-CG 4.41Å; V63-R67 WeakPolarHBondContact O-CB 3.28Å; V63-R67 WeakPolarHBondContact O-CG 3.33Å; V63-R67 PolarHBondContact O-N 3.03Å; V63-T80 HydrophobicContact CB-CG2 4.49Å; V63-T80 HydrophobicContact CG1-CG2 3.91Å; V63-T80 HydrophobicContact CG2-CG2 4.41Å
64	S	91.2	Very high	89.6	Confident	68 Å²	68	95.5 Å²	95.5	48%	0.476	48%	0.484	S	S	.	.	H	α-helix	trans	-63.9	-36.5	176.2	-71.4	0	0	0	0	112.8	E60 A68	E60-S64 WeakPolarHBondContact O-CB 3.39Å; E60-S64 PolarHBondContact O-N 3.37Å; E60-S64 PolarHBondContact O-OG 3.24Å; S64-A68 PolarHBondContact O-N 2.87Å
65	K	92.3	Very high	89.3	Confident	156 Å²	156	94.8 Å²	94.8	68%	0.678	48%	0.481	S	S	*	.	H	α-helix	trans	-65.9	-44.7	173.1	-73.7	167.6	-175.3	173.6	0	111.7	G61 R62 V63 A68 S69	G61-K65 WeakPolarHBondContact O-CD 3.36Å; G61-K65 VanDerWaalsContact O-CG 3.27Å; G61-K65 WeakPolarHBondContact O-CG 3.34Å; G61-K65 PolarHBondContact O-N 2.87Å; R62-K65 PolarHBondContact O-N 2.69Å; V63-K65 VanDerWaalsContact C-N 3.34Å; V63-K65 PolarHBondContact O-N 3.22Å; K65-A68 PolarHBondContact O-N 2.97Å; K65-A68 VanDerWaalsContact O-N 3.14Å; K65-S69 WeakPolarHBondContact O-CB 3.21Å; K65-S69 PolarHBondContact O-N 3.43Å; K65-S69 VanDerWaalsContact O-N 3.1Å; K65-S69 PolarHBondContact O-OG 3.14Å
66	L	90.6	Very high	89.2	Confident	30 Å²	30	91.3 Å²	91.3	16%	0.157	46%	0.462	C	S	.	.	H	α-helix	trans	-61.1	-45.5	176.1	-75.6	173.1	0	0	0	112.5	R62 V63 A68 S69 L70 L76 L79 T80	R62-L66 VanDerWaalsContact NH1-CD1 3.26Å; R62-L66 PolarHBondContact O-N 2.92Å; V63-L66 PolarHBondContact O-N 3.46Å; L66-A68 PolarHBondContact O-N 2.83Å; L66-A68 VanDerWaalsContact O-N 3.16Å; L66-S69 PolarHBondContact O-N 3.24Å; L66-S69 PolarHBondContact O-OG 2.89Å; L66-L70 HydrophobicContact CD2-CD1 4.1Å; L66-L70 WeakPolarHBondContact O-CB 3.24Å; L66-L70 PolarHBondContact O-N 3.3Å; L66-L70 VanDerWaalsContact O-N 3.1Å; L66-L76 HydrophobicContact CB-CD1 4.2Å; L66-L79 HydrophobicContact CD1-CB 3.85Å; L66-L79 WeakPolarHBondContact CD1-O 3.46Å; L66-L79 HydrophobicContact CD2-CB 4.5Å; L66-T80 HydrophobicContact CB-CG2 4.27Å; L66-T80 HydrophobicContact CD1-CG2 4.39Å
67	R	90.9	Very high	89.2	Confident	133 Å²	133	91.2 Å²	91.2	50%	0.502	46%	0.464	S	S	.	.	H	α-helix	trans	-63.3	-17	176.1	-72.1	177	176.4	168.9	0.7	113.6	V63 L76 T80 D82	V63-R67 HydrophobicContact CG1-CG 4.41Å; V63-R67 WeakPolarHBondContact O-CB 3.28Å; V63-R67 WeakPolarHBondContact O-CG 3.33Å; V63-R67 PolarHBondContact O-N 3.03Å; R67-L76 HydrophobicContact CB-CD1 4.44Å; R67-L76 HydrophobicContact CG-CD1 3.9Å; R67-L76 HydrophobicContact CG-CD2 4.29Å; R67-L76 HydrophobicContact CG-CG 4.46Å; R67-T80 HydrophobicContact CG-CG2 4.2Å; R67-D82 IonicContact CZ-OD2 2.75Å; R67-D82 IonicContact NE-OD2 2.7Å; R67-D82 IonicContact NH2-OD1 2.77Å; R67-D82 PolarHBondContact NH2-OD1 2.91Å; R67-D82 IonicContact NH2-OD2 2.8Å; R67-D82 PolarHBondContact NH2-OD2 3.38Å
68	A	90.9	Very high	88.9	Confident	91 Å²	91	88.4 Å²	88.4	75%	0.752	45%	0.453	S	S	*	.	H	α-helix	trans	-98	-11.3	173.7	0	0	0	0	0	114	S64 K65 L66	S64-A68 PolarHBondContact O-N 2.87Å; K65-A68 PolarHBondContact O-N 2.97Å; K65-A68 VanDerWaalsContact O-N 3.14Å; L66-A68 PolarHBondContact O-N 2.83Å; L66-A68 VanDerWaalsContact O-N 3.16Å
69	S	90.3	Very high	88.7	Confident	89 Å²	89	87 Å²	87	62%	0.622	45%	0.445	S	S	*	.	H	α-helix	trans	-118.9	-5.5	-172.3	74.5	0	0	0	0	115.2	K65 L66	K65-S69 WeakPolarHBondContact O-CB 3.21Å; K65-S69 PolarHBondContact O-N 3.43Å; K65-S69 VanDerWaalsContact O-N 3.1Å; K65-S69 PolarHBondContact O-OG 3.14Å; L66-S69 PolarHBondContact O-N 3.24Å; L66-S69 PolarHBondContact O-OG 2.89Å
70	L	83.6	Confident	88.7	Confident	39 Å²	39	83.4 Å²	83.4	20%	0.204	43%	0.429	C	S	.	.			trans	-136.8	110.1	-165.3	-141	158.1	0	0	0	111	L66 D72 Q75 L76 L79	L66-L70 HydrophobicContact CD2-CD1 4.1Å; L66-L70 WeakPolarHBondContact O-CB 3.24Å; L66-L70 PolarHBondContact O-N 3.3Å; L66-L70 VanDerWaalsContact O-N 3.1Å; L70-D72 HydrophobicContact CD2-CB 4.1Å; L70-Q75 HydrophobicContact CD2-CB 3.77Å; L70-L76 HydrophobicContact CB-CD1 4.34Å; L70-L79 HydrophobicContact CD1-CD1 3.41Å; L70-L79 VanDerWaalsContact CD1-CD1 3.41Å
71	E	86	Confident	88.5	Confident	195 Å²	195	78 Å²	78	91%	0.911	41%	0.41	S	S	*	.			trans	-82.1	-28.1	-173.3	-62.1	-176.9	162.3	0	0	113.8	P73	E71-P73 WeakPolarHBondContact O-CD 3.36Å
72	D	86.5	Confident	88.2	Confident	57 Å²	57	78.5 Å²	78.5	31%	0.305	41%	0.405	S	S	.	.			trans	-70.4	113.2	178.3	171.3	20.5	0	0	0	111	L70 W74 Q75 L76	L70-D72 HydrophobicContact CD2-CB 4.1Å; D72-W74 PolarHBondContact O-N 3Å; D72-W74 WeakPolarHBondContact OD1-CB 3.29Å; D72-W74 PolarHBondContact OD1-N 2.79Å; D72-Q75 HydrophobicContact CB-CB 4.26Å; D72-Q75 VanDerWaalsContact OD2-CB 3.24Å; D72-Q75 WeakPolarHBondContact OD2-CB 3.29Å; D72-Q75 WeakPolarHBondContact OD2-CG 3.4Å; D72-Q75 PolarHBondContact OD2-N 3.3Å; D72-Q75 VanDerWaalsContact OD2-N 3.08Å; D72-Q75 PolarHBondContact OD2-NE2 2.94Å; D72-L76 WeakPolarHBondContact O-CB 3.38Å; D72-L76 PolarHBondContact O-N 3.43Å
73	P	86.2	Confident	87.8	Confident	100 Å²	100	80.1 Å²	80.1	65%	0.649	41%	0.412	S	S	*	.	H	α-helix	trans	-63.8	-24.7	-179.5	-20.7	34.4	0	0	0	113.5	E71 K77	E71-P73 WeakPolarHBondContact O-CD 3.36Å; P73-K77 VanDerWaalsContact O-CB 3.26Å; P73-K77 WeakPolarHBondContact O-CB 3.41Å; P73-K77 PolarHBondContact O-N 3.05Å
74	W	81.7	Confident	87.5	Confident	145 Å²	145	85.3 Å²	85.3	55%	0.549	43%	0.433	S	S	.	.	H	α-helix	trans	-78.4	-52.8	-177.7	-171.1	78.3	0	0	0	111.5	D72 L76 K77 I78	D72-W74 PolarHBondContact O-N 3Å; D72-W74 WeakPolarHBondContact OD1-CB 3.29Å; D72-W74 PolarHBondContact OD1-N 2.79Å; W74-L76 VanDerWaalsContact C-N 3.28Å; W74-L76 PolarHBondContact O-N 2.92Å; W74-K77 PolarHBondContact O-N 3.37Å; W74-I78 HydrophobicContact CD2-CD1 3.9Å; W74-I78 HydrophobicContact CE3-CD1 3.85Å; W74-I78 HydrophobicContact CH2-CD1 3.51Å; W74-I78 HydrophobicContact CZ2-CD1 3.55Å; W74-I78 HydrophobicContact CZ3-CD1 3.66Å; W74-I78 PolarHBondContact O-N 3.14Å; W74-I78 VanDerWaalsContact O-N 3.16Å
75	Q	85.6	Confident	86.9	Confident	98 Å²	98	87.4 Å²	87.4	46%	0.458	44%	0.435	S	S	.	.	H	α-helix	trans	-58.3	-39.8	169.1	-83.7	173.3	74.3	0	0	112.2	L70 D72 K77 I78 L79	L70-Q75 HydrophobicContact CD2-CB 3.77Å; D72-Q75 HydrophobicContact CB-CB 4.26Å; D72-Q75 VanDerWaalsContact OD2-CB 3.24Å; D72-Q75 WeakPolarHBondContact OD2-CB 3.29Å; D72-Q75 WeakPolarHBondContact OD2-CG 3.4Å; D72-Q75 PolarHBondContact OD2-N 3.3Å; D72-Q75 VanDerWaalsContact OD2-N 3.08Å; D72-Q75 PolarHBondContact OD2-NE2 2.94Å; Q75-K77 PolarHBondContact O-N 3.29Å; Q75-I78 PolarHBondContact O-N 2.86Å; Q75-L79 HydrophobicContact CB-CD1 4.3Å; Q75-L79 WeakPolarHBondContact O-CB 3.35Å; Q75-L79 VanDerWaalsContact O-CG 3.28Å; Q75-L79 WeakPolarHBondContact O-CG 3.49Å; Q75-L79 PolarHBondContact O-N 3.39Å
76	L	89.3	Confident	86.3	Confident	35 Å²	35	84.2 Å²	84.2	18%	0.183	42%	0.423	C	S	.	.	H	α-helix	trans	-57	-52.5	176.5	-177.1	67.4	0	0	0	110.5	L66 R67 L70 D72 W74 I78 L79 T80	L66-L76 HydrophobicContact CB-CD1 4.2Å; R67-L76 HydrophobicContact CB-CD1 4.44Å; R67-L76 HydrophobicContact CG-CD1 3.9Å; R67-L76 HydrophobicContact CG-CD2 4.29Å; R67-L76 HydrophobicContact CG-CG 4.46Å; L70-L76 HydrophobicContact CB-CD1 4.34Å; D72-L76 WeakPolarHBondContact O-CB 3.38Å; D72-L76 PolarHBondContact O-N 3.43Å; W74-L76 VanDerWaalsContact C-N 3.28Å; W74-L76 PolarHBondContact O-N 2.92Å; L76-I78 PolarHBondContact O-N 3Å; L76-L79 PolarHBondContact O-N 2.67Å; L76-L79 VanDerWaalsContact O-N 3.17Å; L76-T80 HydrophobicContact CD1-CG2 3.71Å; L76-T80 HydrophobicContact CG-CG2 4.14Å; L76-T80 WeakPolarHBondContact O-CB 3.32Å; L76-T80 WeakPolarHBondContact O-CG2 3.38Å; L76-T80 PolarHBondContact O-N 2.81Å; L76-T80 PolarHBondContact O-OG1 3.1Å
77	K	88.8	Confident	85.8	Confident	82 Å²	82	84.3 Å²	84.3	36%	0.357	43%	0.428	S	S	.	.	H	α-helix	trans	-60	-31.1	-179.4	-174	175.4	-176.4	172.5	0	113.6	P73 W74 Q75 D82 W83 E86	P73-K77 VanDerWaalsContact O-CB 3.26Å; P73-K77 WeakPolarHBondContact O-CB 3.41Å; P73-K77 PolarHBondContact O-N 3.05Å; W74-K77 PolarHBondContact O-N 3.37Å; Q75-K77 PolarHBondContact O-N 3.29Å; K77-D82 HydrophobicContact CG-CB 4.16Å; K77-D82 PolarHBondContact O-N 3.12Å; K77-W83 HydrophobicContact CG-CB 4.11Å; K77-W83 PolarHBondContact O-N 3.36Å; K77-E86 VanDerWaalsContact CE-OE2 3.25Å; K77-E86 WeakPolarHBondContact CE-OE2 3.2Å; K77-E86 IonicContact NZ-OE2 3.47Å; K77-E86 PolarHBondContact NZ-OE2 2.86Å
78	I	86	Confident	85.1	Confident	80 Å²	80	81.4 Å²	81.4	41%	0.41	42%	0.417	S	S	.	.	H	α-helix	trans	-72.8	-54.4	172.9	-68.7	169.7	0	0	0	110.3	W74 Q75 L76 T80 G81	W74-I78 HydrophobicContact CD2-CD1 3.9Å; W74-I78 HydrophobicContact CE3-CD1 3.85Å; W74-I78 HydrophobicContact CH2-CD1 3.51Å; W74-I78 HydrophobicContact CZ2-CD1 3.55Å; W74-I78 HydrophobicContact CZ3-CD1 3.66Å; W74-I78 PolarHBondContact O-N 3.14Å; W74-I78 VanDerWaalsContact O-N 3.16Å; Q75-I78 PolarHBondContact O-N 2.86Å; L76-I78 PolarHBondContact O-N 3Å; I78-T80 VanDerWaalsContact C-N 3.34Å; I78-T80 PolarHBondContact O-N 2.82Å; I78-G81 PolarHBondContact O-N 2.88Å; I78-G81 VanDerWaalsContact O-N 3.1Å
79	L	86.9	Confident	84.5	Confident	71 Å²	71	80.6 Å²	80.6	37%	0.372	41%	0.406	S	S	.	.	H	α-helix	trans	-71.1	-25	-171.6	-68.5	167.4	0	0	0	113.5	R62 L66 L70 Q75 L76	R62-L79 VanDerWaalsContact CZ-O 3.3Å; R62-L79 PolarHBondContact NH1-O 3.34Å; R62-L79 PolarHBondContact NH2-O 3.02Å; L66-L79 HydrophobicContact CD1-CB 3.85Å; L66-L79 WeakPolarHBondContact CD1-O 3.46Å; L66-L79 HydrophobicContact CD2-CB 4.5Å; L70-L79 HydrophobicContact CD1-CD1 3.41Å; L70-L79 VanDerWaalsContact CD1-CD1 3.41Å; Q75-L79 HydrophobicContact CB-CD1 4.3Å; Q75-L79 WeakPolarHBondContact O-CB 3.35Å; Q75-L79 VanDerWaalsContact O-CG 3.28Å; Q75-L79 WeakPolarHBondContact O-CG 3.49Å; Q75-L79 PolarHBondContact O-N 3.39Å; L76-L79 PolarHBondContact O-N 2.67Å; L76-L79 VanDerWaalsContact O-N 3.17Å
80	T	90	Very high	84	Confident	4 Å²	4	83.2 Å²	83.2	3%	0.025	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-13.3	171.7	60.5	0	0	0	0	113.7	V63 L66 R67 L76 I78 D82	V63-T80 HydrophobicContact CB-CG2 4.49Å; V63-T80 HydrophobicContact CG1-CG2 3.91Å; V63-T80 HydrophobicContact CG2-CG2 4.41Å; L66-T80 HydrophobicContact CB-CG2 4.27Å; L66-T80 HydrophobicContact CD1-CG2 4.39Å; R67-T80 HydrophobicContact CG-CG2 4.2Å; L76-T80 HydrophobicContact CD1-CG2 3.71Å; L76-T80 HydrophobicContact CG-CG2 4.14Å; L76-T80 WeakPolarHBondContact O-CB 3.32Å; L76-T80 WeakPolarHBondContact O-CG2 3.38Å; L76-T80 PolarHBondContact O-N 2.81Å; L76-T80 PolarHBondContact O-OG1 3.1Å; I78-T80 VanDerWaalsContact C-N 3.34Å; I78-T80 PolarHBondContact O-N 2.82Å; T80-D82 WeakPolarHBondContact CB-OD2 3.5Å; T80-D82 PolarHBondContact O-N 3.42Å; T80-D82 WeakPolarHBondContact OG1-CB 3.36Å; T80-D82 PolarHBondContact OG1-N 3.39Å; T80-D82 PolarHBondContact OG1-OD2 3.32Å
81	G	86.3	Confident	83.7	Confident	22 Å²	22	90.9 Å²	90.9	23%	0.227	44%	0.435	C	S	.	.			trans	70.1	14.2	-171.1	0	0	0	0	0	114.4	I78 W83 F84 Q85	I78-G81 PolarHBondContact O-N 2.88Å; I78-G81 VanDerWaalsContact O-N 3.1Å; G81-W83 PolarHBondContact O-N 2.94Å; G81-F84 WeakPolarHBondContact O-CB 3.13Å; G81-F84 PolarHBondContact O-N 3.2Å; G81-Q85 PolarHBondContact O-N 3.43Å
82	D	86	Confident	82.9	Confident	40 Å²	40	87.2 Å²	87.2	21%	0.214	42%	0.417	C	S	.	.	H	α-helix	trans	-60.4	-29.3	-179.8	-76.3	-42.4	0	0	0	112.3	R67 K77 T80 F84 Q85 E86	R67-D82 IonicContact CZ-OD2 2.75Å; R67-D82 IonicContact NE-OD2 2.7Å; R67-D82 IonicContact NH2-OD1 2.77Å; R67-D82 PolarHBondContact NH2-OD1 2.91Å; R67-D82 IonicContact NH2-OD2 2.8Å; R67-D82 PolarHBondContact NH2-OD2 3.38Å; K77-D82 HydrophobicContact CG-CB 4.16Å; K77-D82 PolarHBondContact O-N 3.12Å; T80-D82 WeakPolarHBondContact CB-OD2 3.5Å; T80-D82 PolarHBondContact O-N 3.42Å; T80-D82 WeakPolarHBondContact OG1-CB 3.36Å; T80-D82 PolarHBondContact OG1-N 3.39Å; T80-D82 PolarHBondContact OG1-OD2 3.32Å; D82-F84 VanDerWaalsContact C-N 3.28Å; D82-F84 PolarHBondContact O-N 3.44Å; D82-Q85 PolarHBondContact O-N 2.99Å; D82-E86 PolarHBondContact O-N 3.17Å
83	W	85.5	Confident	81.8	Confident	132 Å²	132	93.6 Å²	93.6	50%	0.5	45%	0.445	S	S	.	.	H	α-helix	trans	-58.9	-36.5	171.4	76.1	-89.3	0	0	0	113.1	K77 G81 A87	K77-W83 HydrophobicContact CG-CB 4.11Å; K77-W83 PolarHBondContact O-N 3.36Å; G81-W83 PolarHBondContact O-N 2.94Å; W83-A87 VanDerWaalsContact O-CB 3.29Å; W83-A87 WeakPolarHBondContact O-CB 3.42Å; W83-A87 PolarHBondContact O-N 3.23Å
84	F	83	Confident	80.8	Confident	124 Å²	124	96.4 Å²	96.4	54%	0.544	45%	0.449	S	S	.	.	H	α-helix	trans	-74.2	-35.8	179.9	176.3	-94.5	0	0	0	111.1	G81 D82 R88	G81-F84 WeakPolarHBondContact O-CB 3.13Å; G81-F84 PolarHBondContact O-N 3.2Å; D82-F84 VanDerWaalsContact C-N 3.28Å; D82-F84 PolarHBondContact O-N 3.44Å; F84-R88 VanDerWaalsContact O-CB 3.28Å; F84-R88 WeakPolarHBondContact O-CB 3.27Å; F84-R88 PolarHBondContact O-N 3.16Å
85	Q	78.6	Confident	79.8	Confident	112 Å²	112	93.6 Å²	93.6	52%	0.523	46%	0.457	S	S	.	.	H	α-helix	trans	-64.6	-42.3	173.9	-59	-157.2	39.6	0	0	111.5	G81 D82 R88 S89	G81-Q85 PolarHBondContact O-N 3.43Å; D82-Q85 PolarHBondContact O-N 2.99Å; Q85-R88 PolarHBondContact O-N 3.22Å; Q85-S89 PolarHBondContact O-N 2.9Å
86	E	80.2	Confident	78.7	Confident	90 Å²	90	95.6 Å²	95.6	42%	0.421	47%	0.466	S	S	.	.	H	α-helix	trans	-67.3	-44.7	175.5	-170.9	176.3	-159.7	0	0	112.3	K77 D82 R88 S89 Q90	K77-E86 VanDerWaalsContact CE-OE2 3.25Å; K77-E86 WeakPolarHBondContact CE-OE2 3.2Å; K77-E86 IonicContact NZ-OE2 3.47Å; K77-E86 PolarHBondContact NZ-OE2 2.86Å; D82-E86 PolarHBondContact O-N 3.17Å; E86-R88 VanDerWaalsContact C-N 3.25Å; E86-R88 PolarHBondContact O-N 3.28Å; E86-S89 PolarHBondContact O-N 2.65Å; E86-S89 PolarHBondContact O-OG 3.34Å; E86-Q90 WeakPolarHBondContact O-CG 3.43Å; E86-Q90 PolarHBondContact O-N 2.71Å; E86-Q90 VanDerWaalsContact O-N 3.1Å
87	A	80.4	Confident	77.8	Confident	32 Å²	32	97.6 Å²	97.6	26%	0.264	47%	0.473	S	S	.	.	H	α-helix	trans	-61.5	-34.1	174.8	0	0	0	0	0	112.3	W83 R91	W83-A87 VanDerWaalsContact O-CB 3.29Å; W83-A87 WeakPolarHBondContact O-CB 3.42Å; W83-A87 PolarHBondContact O-N 3.23Å; A87-R91 WeakPolarHBondContact O-CG 3.29Å; A87-R91 PolarHBondContact O-N 3.33Å
88	R	75.6	Confident	77.3	Confident	71 Å²	71	96.1 Å²	96.1	27%	0.268	48%	0.481	S	S	.	.	H	α-helix	trans	-71.2	-43	173.8	-178.5	-175.9	141.7	-166.4	-13.4	112.1	F84 Q85 E86 Q90 R91 H92 F97	F84-R88 VanDerWaalsContact O-CB 3.28Å; F84-R88 WeakPolarHBondContact O-CB 3.27Å; F84-R88 PolarHBondContact O-N 3.16Å; Q85-R88 PolarHBondContact O-N 3.22Å; E86-R88 VanDerWaalsContact C-N 3.25Å; E86-R88 PolarHBondContact O-N 3.28Å; R88-Q90 VanDerWaalsContact C-N 3.3Å; R88-Q90 PolarHBondContact O-N 3.08Å; R88-R91 PolarHBondContact O-N 2.96Å; R88-R91 VanDerWaalsContact O-N 3.12Å; R88-H92 PolarHBondContact O-N 3.46Å; R88-F97 VanDerWaalsContact NH1-CD1 3.35Å; R88-F97 VanDerWaalsContact NH2-CD2 3.3Å
89	S	78.2	Confident	77.1	Confident	74 Å²	74	92.9 Å²	92.9	52%	0.517	47%	0.465	S	S	.	.	H	α-helix	trans	-65.8	-33.8	-178.3	70.4	0	0	0	0	112.3	Q85 E86 R91	Q85-S89 PolarHBondContact O-N 2.9Å; E86-S89 PolarHBondContact O-N 2.65Å; E86-S89 PolarHBondContact O-OG 3.34Å; S89-R91 VanDerWaalsContact C-N 3.34Å
90	Q	79.7	Confident	76.9	Confident	145 Å²	145	92.3 Å²	92.3	68%	0.678	46%	0.463	S	S	*	.	H	α-helix	trans	-68	-29.2	172.1	-67.3	-176.6	20.2	0	0	113.5	E86 R88	E86-Q90 WeakPolarHBondContact O-CG 3.43Å; E86-Q90 PolarHBondContact O-N 2.71Å; E86-Q90 VanDerWaalsContact O-N 3.1Å; R88-Q90 VanDerWaalsContact C-N 3.3Å; R88-Q90 PolarHBondContact O-N 3.08Å
91	R	77.9	Confident	76.6	Confident	200 Å²	200	94.9 Å²	94.9	76%	0.755	48%	0.476	S	S	*	.	H	α-helix	trans	-85.2	-26	177.7	-69.4	178.3	-170.5	-165.6	4.9	113.8	A87 R88 S89	A87-R91 WeakPolarHBondContact O-CG 3.29Å; A87-R91 PolarHBondContact O-N 3.33Å; R88-R91 PolarHBondContact O-N 2.96Å; R88-R91 VanDerWaalsContact O-N 3.12Å; S89-R91 VanDerWaalsContact C-N 3.34Å
92	H	69.7	Low	76.5	Confident	117 Å²	117	95.3 Å²	95.3	54%	0.542	47%	0.474	S	S	.	.			trans	-137.6	105.6	-170.9	-60.4	-71.9	0	0	0	112.3	R88 H94	R88-H92 PolarHBondContact O-N 3.46Å; H92-H94 PolarHBondContact O-N 3.4Å
93	H	62.9	Low	76.4	Confident	192 Å²	192	96.6 Å²	96.6	89%	0.889	48%	0.476	S	S	*	.			trans	-65.7	-4.4	176.3	-69.3	-62.8	0	0	0	115.3
94	H	64.1	Low	76.2	Confident	159 Å²	159	92 Å²	92	74%	0.736	47%	0.467	S	S	*	.			trans	-91.8	116.3	174.7	-77.1	-34.6	0	0	0	111.7	H92 H96	H92-H94 PolarHBondContact O-N 3.4Å; H94-H96 VanDerWaalsContact C-N 3.34Å; H94-H96 PolarHBondContact O-N 2.96Å
95	A	60.4	Low	76.4	Confident	86 Å²	86	86.5 Å²	86.5	71%	0.711	44%	0.443	S	S	*	.			trans	-69.4	-26.7	179.6	0	0	0	0	0	114	F97	A95-F97 PolarHBondContact O-N 3.43Å
96	H	63.6	Low	76.5	Confident	140 Å²	140	82.2 Å²	82.2	65%	0.648	42%	0.424	S	S	*	.	S	Bend	trans	-67.8	128.8	-177.3	-55.4	-63.5	0	0	0	111.7	H94	H94-H96 VanDerWaalsContact C-N 3.34Å; H94-H96 PolarHBondContact O-N 2.96Å
97	F	69.6	Low	76.5	Confident	77 Å²	77	86 Å²	86	34%	0.338	43%	0.434	S	S	.	.			trans	-70	144.2	168.5	-84	-119.5	0	0	0	109.8	R88 A95 S99 D100 L101	R88-F97 VanDerWaalsContact NH1-CD1 3.35Å; R88-F97 VanDerWaalsContact NH2-CD2 3.3Å; A95-F97 PolarHBondContact O-N 3.43Å; F97-S99 PolarHBondContact O-N 3.46Å; F97-S99 VanDerWaalsContact O-N 3.14Å; F97-D100 PolarHBondContact O-N 3.33Å; F97-L101 PolarHBondContact O-N 3.25Å
98	G	79.2	Confident	76	Confident	51 Å²	51	89.4 Å²	89.4	53%	0.526	44%	0.44	S	S	.	.	H	α-helix	trans	-55.9	-32.4	177.6	0	0	0	0	0	113.5	D100 L101 V102	G98-D100 PolarHBondContact O-N 2.95Å; G98-L101 PolarHBondContact O-N 3.43Å; G98-V102 VanDerWaalsContact O-CG2 3.31Å; G98-V102 WeakPolarHBondContact O-CG2 3.45Å; G98-V102 PolarHBondContact O-N 3.07Å
99	S	82.4	Confident	75.4	Confident	11 Å²	11	90.1 Å²	90.1	8%	0.077	45%	0.445	C	S	.	.	H	α-helix	trans	-55.6	-36.1	172.7	55.9	0	0	0	0	113.3	R56 F97 R103	R56-S99 PolarHBondContact NH1-OG 2.91Å; R56-S99 PolarHBondContact NH2-OG 3.13Å; F97-S99 PolarHBondContact O-N 3.46Å; F97-S99 VanDerWaalsContact O-N 3.14Å; S99-R103 WeakPolarHBondContact O-CB 3.24Å; S99-R103 PolarHBondContact O-N 2.84Å
100	D	81.3	Confident	74.5	Confident	59 Å²	59	94.6 Å²	94.6	32%	0.316	46%	0.455	S	S	.	.	H	α-helix	trans	-87	-31.9	-170.8	-49.4	-25.2	0	0	0	109.6	F97 G98 R103 A104	F97-D100 PolarHBondContact O-N 3.33Å; G98-D100 PolarHBondContact O-N 2.95Å; D100-R103 PolarHBondContact O-N 3.15Å; D100-R103 IonicContact OD1-CZ 3.07Å; D100-R103 IonicContact OD1-NH1 2.77Å; D100-R103 PolarHBondContact OD1-NH1 2.94Å; D100-A104 VanDerWaalsContact O-CB 3.31Å; D100-A104 WeakPolarHBondContact O-CB 3.45Å; D100-A104 PolarHBondContact O-N 3Å
101	L	84	Confident	72.8	Confident	58 Å²	58	91.5 Å²	91.5	30%	0.304	45%	0.45	S	S	.	.	H	α-helix	trans	-61.4	-46.6	166.6	-155	74.4	0	0	0	111.6	G30 L32 F97 G98 A104 S105	G30-L101 WeakPolarHBondContact O-CD1 3.41Å; L32-L101 HydrophobicContact CD1-CD2 4.47Å; L32-L101 HydrophobicContact CD2-CD2 4.44Å; L32-L101 HydrophobicContact CG-CD2 4.15Å; F97-L101 PolarHBondContact O-N 3.25Å; G98-L101 PolarHBondContact O-N 3.43Å; L101-A104 PolarHBondContact O-N 3.37Å; L101-S105 WeakPolarHBondContact O-CB 3.46Å; L101-S105 PolarHBondContact O-N 3.48Å; L101-S105 PolarHBondContact O-OG 3.36Å
102	V	84.9	Confident	71	Confident	32 Å²	32	87.9 Å²	87.9	19%	0.194	45%	0.452	C	S	.	.	H	α-helix	trans	-65.2	-44.7	174.8	179.4	0	0	0	0	110.5	L32 L34 I45 L49 G98 A104 S105 I106	L32-V102 HydrophobicContact CD1-CG2 3.78Å; L34-V102 HydrophobicContact CD1-CG1 4.45Å; I45-V102 HydrophobicContact CG2-CG1 3.81Å; L49-V102 HydrophobicContact CD1-CB 4.37Å; L49-V102 HydrophobicContact CD1-CG1 3.88Å; G98-V102 VanDerWaalsContact O-CG2 3.31Å; G98-V102 WeakPolarHBondContact O-CG2 3.45Å; G98-V102 PolarHBondContact O-N 3.07Å; V102-A104 VanDerWaalsContact C-N 3.26Å; V102-A104 PolarHBondContact O-N 3.14Å; V102-S105 PolarHBondContact O-N 3.06Å; V102-S105 VanDerWaalsContact O-N 3.14Å; V102-I106 HydrophobicContact CG1-CD1 3.74Å; V102-I106 HydrophobicContact CG1-CG1 4.19Å; V102-I106 WeakPolarHBondContact O-CG1 3.21Å; V102-I106 PolarHBondContact O-N 2.74Å
103	R	84.2	Confident	69.6	Low	67 Å²	67	91.8 Å²	91.8	25%	0.253	47%	0.468	S	S	.	.	H	α-helix	trans	-66.3	-23.6	178.2	-161.3	-173.1	-70.3	120.9	-7.2	113.1	L49 S99 D100 R107	L49-R103 HydrophobicContact CD1-CB 4.25Å; L49-R103 PolarHBondContact O-NH2 3.47Å; L49-R103 VanDerWaalsContact O-NH2 3.07Å; S99-R103 WeakPolarHBondContact O-CB 3.24Å; S99-R103 PolarHBondContact O-N 2.84Å; D100-R103 PolarHBondContact O-N 3.15Å; D100-R103 IonicContact OD1-CZ 3.07Å; D100-R103 IonicContact OD1-NH1 2.77Å; D100-R103 PolarHBondContact OD1-NH1 2.94Å; R103-R107 WeakPolarHBondContact O-CG 3.3Å; R103-R107 PolarHBondContact O-NE 3.43Å
104	A	81.2	Confident	68.3	Low	36 Å²	36	85.8 Å²	85.8	30%	0.298	46%	0.457	S	S	.	.	H	α-helix	trans	-78.4	-44.9	168.8	0	0	0	0	0	111.6	L31 D100 L101 V102 R107 R108	L31-A104 HydrophobicContact CD2-CB 4.46Å; D100-A104 VanDerWaalsContact O-CB 3.31Å; D100-A104 WeakPolarHBondContact O-CB 3.45Å; D100-A104 PolarHBondContact O-N 3Å; L101-A104 PolarHBondContact O-N 3.37Å; V102-A104 VanDerWaalsContact C-N 3.26Å; V102-A104 PolarHBondContact O-N 3.14Å; A104-R107 PolarHBondContact O-N 2.84Å; A104-R108 PolarHBondContact O-N 3.31Å
105	S	85.4	Confident	67	Low	7 Å²	7	86 Å²	86	5%	0.049	46%	0.464	C	S	.	.	H	α-helix	trans	-62.6	-46.2	-179.1	-54.5	0	0	0	0	112.1	L32 L101 V102 R107 R108 K109	L32-S105 PolarHBondContact N-OG 2.87Å; L32-S105 WeakPolarHBondContact O-CB 3.4Å; L101-S105 WeakPolarHBondContact O-CB 3.46Å; L101-S105 PolarHBondContact O-N 3.48Å; L101-S105 PolarHBondContact O-OG 3.36Å; V102-S105 PolarHBondContact O-N 3.06Å; V102-S105 VanDerWaalsContact O-N 3.14Å; S105-R107 VanDerWaalsContact C-N 3.31Å; S105-R107 PolarHBondContact O-N 2.77Å; S105-R108 PolarHBondContact O-N 3.4Å; S105-K109 PolarHBondContact O-N 3.24Å
106	I	82.1	Confident	65.7	Low	22 Å²	22	91.6 Å²	91.6	11%	0.113	48%	0.475	C	S	.	.	H	α-helix	trans	-60.5	-40.1	174.2	-67.2	175.4	0	0	0	111.2	L34 Q42 I45 L49 V102 R108 K109	L34-I106 HydrophobicContact CD1-CG1 3.61Å; Q42-I106 HydrophobicContact CG-CG2 4.04Å; I45-I106 HydrophobicContact CB-CD1 4.45Å; I45-I106 HydrophobicContact CG2-CD1 3.73Å; L49-I106 HydrophobicContact CD1-CD1 4.13Å; V102-I106 HydrophobicContact CG1-CD1 3.74Å; V102-I106 HydrophobicContact CG1-CG1 4.19Å; V102-I106 WeakPolarHBondContact O-CG1 3.21Å; V102-I106 PolarHBondContact O-N 2.74Å; I106-R108 VanDerWaalsContact C-N 3.31Å; I106-R108 PolarHBondContact O-N 3.37Å; I106-K109 PolarHBondContact O-N 3.31Å
107	R	79.1	Confident	64.5	Low	171 Å²	171	89.4 Å²	89.4	65%	0.645	48%	0.481	S	S	*	.	H	α-helix	trans	-65.9	-29.5	180	-83.3	-173.1	-80	-161.7	6.1	113.2	R103 A104 S105 K110	R103-R107 WeakPolarHBondContact O-CG 3.3Å; R103-R107 PolarHBondContact O-NE 3.43Å; A104-R107 PolarHBondContact O-N 2.84Å; S105-R107 VanDerWaalsContact C-N 3.31Å; S105-R107 PolarHBondContact O-N 2.77Å; R107-K110 PolarHBondContact O-N 3.42Å
108	R	70.7	Confident	62.9	Low	102 Å²	102	94.6 Å²	94.6	39%	0.385	51%	0.512	S	S	.	.	H	α-helix	trans	-69.1	-37.2	172.4	-81.8	-151.4	177.9	135.9	12.9	113.8	E27 L31 A104 S105 I106 K110 S111	E27-R108 VanDerWaalsContact CB-NH2 3.27Å; E27-R108 VanDerWaalsContact O-CZ 3.24Å; E27-R108 PolarHBondContact O-NH1 2.86Å; E27-R108 PolarHBondContact O-NH2 3.46Å; E27-R108 IonicContact OE2-NH2 3.16Å; E27-R108 PolarHBondContact OE2-NH2 2.93Å; E27-R108 VanDerWaalsContact OE2-NH2 3.16Å; L31-R108 HydrophobicContact CD2-CG 3.97Å; A104-R108 PolarHBondContact O-N 3.31Å; S105-R108 PolarHBondContact O-N 3.4Å; I106-R108 VanDerWaalsContact C-N 3.31Å; I106-R108 PolarHBondContact O-N 3.37Å; R108-K110 PolarHBondContact O-N 3.11Å; R108-K110 VanDerWaalsContact O-N 3.17Å; R108-S111 WeakPolarHBondContact O-CB 3.38Å; R108-S111 PolarHBondContact O-N 2.82Å
109	K	63.7	Low	60.8	Low	86 Å²	86	95.7 Å²	95.7	37%	0.374	52%	0.523	S	S	.	.	H	α-helix	trans	-61.4	-23.5	177.8	-175.5	170.9	167.1	-164.2	0	113	L34 L37 Q42 S105 I106 S111	L34-K109 PolarHBondContact O-NZ 2.88Å; L37-K109 PolarHBondContact O-NZ 3.01Å; Q42-K109 VanDerWaalsContact OE1-CD 3.26Å; Q42-K109 VanDerWaalsContact OE1-CE 3.24Å; S105-K109 PolarHBondContact O-N 3.24Å; I106-K109 PolarHBondContact O-N 3.31Å; K109-S111 VanDerWaalsContact C-N 3.35Å
110	K	59.3	Low	58.6	Low	168 Å²	168	101.1 Å²	101.1	73%	0.73	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	10.1	176.9	-153.5	151	-173.5	161	0	114.3	R107 R108 P112	R107-K110 PolarHBondContact O-N 3.42Å; R108-K110 PolarHBondContact O-N 3.11Å; R108-K110 VanDerWaalsContact O-N 3.17Å; K110-P112 WeakPolarHBondContact O-CD 3.34Å
111	S	43.6	Very low	56.4	Low	81 Å²	81	106 Å²	106	57%	0.566	59%	0.587	S	S	*	*			trans	-101.9	106.2	172.6	-175.6	0	0	0	0	110.8	R108 K109 K113	R108-S111 WeakPolarHBondContact O-CB 3.38Å; R108-S111 PolarHBondContact O-N 2.82Å; K109-S111 VanDerWaalsContact C-N 3.35Å; S111-K113 PolarHBondContact O-N 2.94Å; S111-K113 VanDerWaalsContact O-N 3.1Å
112	P	40	Very low	54.3	Low	123 Å²	123	107 Å²	107	80%	0.799	61%	0.612	S	S	*	*			trans	-70.2	105.6	170	29.2	-31.9	0	0	0	108.7	K110 G114	K110-P112 WeakPolarHBondContact O-CD 3.34Å; P112-G114 PolarHBondContact O-N 3.42Å
113	K	39.3	Very low	52	Low	200 Å²	200	115 Å²	115	87%	0.87	65%	0.647	S	S	*	*			trans	-74	90.8	177.7	-166	-178.7	-173.8	-174.8	0	109.2	S111	S111-K113 PolarHBondContact O-N 2.94Å; S111-K113 VanDerWaalsContact O-N 3.1Å
114	G	35.5	Very low	49.8	Very low	65 Å²	65	116 Å²	116	67%	0.67	67%	0.67	S	S	*	*			trans	-58.8	135	-175.8	0	0	0	0	0	113.3	P112	P112-G114 PolarHBondContact O-N 3.42Å
115	D	37.1	Very low	47.6	Very low	164 Å²	164	123 Å²	123	88%	0.877	70%	0.696	S	S	*	*			trans	-69	140.9	171.4	-80.5	-48.3	0	0	0	111.2	A117	D115-A117 PolarHBondContact O-N 3.13Å
116	Q	34.6	Very low	45.3	Very low	203 Å²	203	126.6 Å²	126.6	95%	0.949	73%	0.726	S	S	*	*			trans	-83	101.2	177.1	-65.8	177.5	17.2	0	0	109.9
117	A	36.9	Very low	43	Very low	94 Å²	94	130.6 Å²	130.6	78%	0.777	76%	0.763	S	S	*	*			trans	-118.9	119.6	171.3	0	0	0	0	0	110.4	D115	D115-A117 PolarHBondContact O-N 3.13Å
118	L	37.4	Very low	41	Very low	186 Å²	186	125.8 Å²	125.8	97%	0.974	77%	0.767	S	S	*	*			trans	-52.5	139	-177.3	-63.2	119.8	0	0	0	114.5
119	G	33.4	Very low	39.2	Very low	75 Å²	75	129.5 Å²	129.5	77%	0.773	79%	0.788	S	S	*	*			trans	148.1	137.9	143.2	0	0	0	0	0	118.4
120	S	36.2	Very low	38	Very low	124 Å²	124	133.3 Å²	133.3	87%	0.867	81%	0.813	S	S	*	*			trans	70.6	117.8	164.4	-153.1	0	0	0	0	118.9
121	D	36.9	Very low	36.7	Very low	163 Å²	163	130.2 Å²	130.2	87%	0.872	81%	0.808	S	S	*	*			trans	-69.8	160.8	159.8	-46.9	-88.5	0	0	0	111.6
122	G	39.7	Very low	36.5	Very low	79 Å²	79	133.7 Å²	133.7	81%	0.814	82%	0.819	S	S	*	*			trans	174.6	120.5	174.9	0	0	0	0	0	111.5
123	E	36	Very low	36.3	Very low	198 Å²	198	136.4 Å²	136.4	93%	0.925	82%	0.821	S	S	*	*			trans	-93.3	169.4	-171.9	-64.8	173.5	96.5	0	0	114.2
124	A	37.6	Very low	36.1	Very low	90 Å²	90	130.4 Å²	130.4	74%	0.744	82%	0.815	S	S	*	*			trans	90	108.1	149.2	0	0	0	0	0	121.4
125	E	36.3	Very low	35.9	Very low	182 Å²	182	136.5 Å²	136.5	85%	0.85	83%	0.827	S	S	*	*				88.6	141.4	118.7	-73.8	-57.6	143.5	0	0	125.2
126	A	35.2	Very low	35.8	Very low	82 Å²	82	134.4 Å²	134.4	68%	0.678	82%	0.822	S	S	*	*			trans	71	102.6	145.4	0	0	0	0	0	124.4
127	A	35	Very low	35.8	Very low	107 Å²	107	134 Å²	134	88%	0.884	82%	0.82	S	S	*	*				78.5	158.1	119.9	0	0	0	0	0	122.5
128	G	36.6	Very low	35.7	Very low	70 Å²	70	134.6 Å²	134.6	72%	0.722	82%	0.818	S	S	*	*			trans	92.5	86.9	-170.8	0	0	0	0	0	111.2
129	E	33.4	Very low	35.3	Very low	180 Å²	180	136.7 Å²	136.7	84%	0.841	81%	0.813	S	S	*	*			cis	66.2	96.9	37.7	-144.7	-177.7	167.7	0	0	113.3
130	D	37.8	Very low	35.3	Very low	166 Å²	166	139.6 Å²	139.6	89%	0.888	82%	0.816	S	S	*	*			trans	-146.7	129.3	153.2	-130	-22.8	0	0	0	107.2
131	T	33.1	Very low	34.9	Very low	102 Å²	102	138.7 Å²	138.7	63%	0.626	81%	0.81	S	S	*	*			trans	-133	143	-167.5	-68.9	0	0	0	0	109.9
132	I	39.3	Very low	35	Very low	154 Å²	154	138.5 Å²	138.5	79%	0.79	81%	0.807	S	S	*	*			trans	-166	117.5	142.5	-100.9	147.1	0	0	0	110.4
133	E	35.7	Very low	34.4	Very low	180 Å²	180	143.8 Å²	143.8	84%	0.841	81%	0.81	S	S	*	*			trans	31.4	146.4	131.6	-44.3	-175.3	154.8	0	0	119.4
134	G	33.6	Very low	34.4	Very low	74 Å²	74	140.8 Å²	140.8	76%	0.763	81%	0.805	S	S	*	*			cis	139.7	150.4	20	0	0	0	0	0	107.2
135	E	32.2	Very low	34.3	Very low	194 Å²	194	140.9 Å²	140.9	91%	0.907	81%	0.806	S	S	*	*			cis	-139.3	165.6	4.5	-67.3	-173.8	95.8	0	0	111.4
136	P	34.7	Very low	33.8	Very low	120 Å²	120	136.5 Å²	136.5	78%	0.779	80%	0.801	S	S	*	*			trans	-117.9	146.2	169.3	38.7	-27.2	0	0	0	114.5
137	E	35.7	Very low	33.8	Very low	195 Å²	195	138.7 Å²	138.7	91%	0.911	81%	0.808	S	S	*	*			trans	-157.9	156.1	161.6	-107.8	-168.6	-164	0	0	110.1
138	S	33.6	Very low	33.5	Very low	105 Å²	105	142.7 Å²	142.7	73%	0.734	81%	0.808	S	S	*	*			cis	-148.2	173.4	-4	57.6	0	0	0	0	110.3
139	R	29.3	Very low	33.3	Very low	231 Å²	231	151.6 Å²	151.6	87%	0.872	82%	0.82	S	S	*	*			trans	-105.4	145.3	-179.2	-68.6	176.5	175.6	148.2	-3.4	112.3
140	V	34.3	Very low	33	Very low	135 Å²	135	147.9 Å²	147.9	82%	0.818	81%	0.814	S	S	*	*			trans	-134.4	136.4	153	-178.1	0	0	0	0	108.9
141	S	26.6	Very low	32.8	Very low	106 Å²	106	146.3 Å²	146.3	74%	0.741	81%	0.811	S	S	*	*			trans	-120.4	140.3	176.4	-58.2	0	0	0	0	109.7
142	I	38.3	Very low	32.7	Very low	159 Å²	159	150.1 Å²	150.1	82%	0.815	82%	0.822	S	S	*	*			trans	-134	134.8	166.1	-62.5	-177.7	0	0	0	107.7	V144	I142-V144 HydrophobicContact CG2-CG2 4.35Å
143	E	28.5	Very low	32.4	Very low	189 Å²	189	149.2 Å²	149.2	88%	0.883	82%	0.823	S	S	*	*			trans	-132.9	122.8	-173.8	175.2	-178.2	-126.9	0	0	107.7
144	V	36.4	Very low	32.2	Very low	136 Å²	136	150 Å²	150	82%	0.824	83%	0.827	S	S	*	*			trans	-141.3	135.3	174.9	-176.3	0	0	0	0	109.9	I142	I142-V144 HydrophobicContact CG2-CG2 4.35Å
145	A	33.6	Very low	32.1	Very low	92 Å²	92	149.8 Å²	149.8	76%	0.76	83%	0.825	S	S	*	*			trans	-75.9	159.2	-166.7	0	0	0	0	0	115.8
146	A	27	Very low	32.5	Very low	90 Å²	90	146 Å²	146	74%	0.744	82%	0.817	S	S	*	*			trans	-82	168	154.8	0	0	0	0	0	110.9
147	P	35.2	Very low	32.3	Very low	128 Å²	128	146.9 Å²	146.9	83%	0.831	82%	0.815	S	S	*	*				-139.3	174.5	124.6	37.7	-25.7	0	0	0	114.7
148	E	28	Very low	32.2	Very low	190 Å²	190	146.2 Å²	146.2	89%	0.888	82%	0.817	S	S	*	*			trans	-87.4	163	-165.2	-48.8	164.4	111.4	0	0	114.8
149	R	31.9	Very low	32.2	Very low	257 Å²	257	146.4 Å²	146.4	97%	0.97	82%	0.818	S	S	*	*			trans	-153.6	142.9	135.5	-143.8	174.1	-167.2	-147.1	-1.3	113.8
150	S	28.4	Very low	32.4	Very low	102 Å²	102	140.7 Å²	140.7	71%	0.713	81%	0.814	S	S	*	*			trans	-126	147.3	-176.6	50.5	0	0	0	0	112.8
151	T	33.4	Very low	32.5	Very low	133 Å²	133	139.9 Å²	139.9	82%	0.816	81%	0.811	S	S	*	*			trans	172.8	118.5	153.8	40.7	0	0	0	0	105.5
152	E	30.6	Very low	32.8	Very low	183 Å²	183	145.8 Å²	145.8	86%	0.855	82%	0.819	S	S	*	*			cis	83.1	151.9	44.8	-148.7	179.4	-174.3	0	0	114.2
153	T	33.1	Very low	33	Very low	134 Å²	134	143.6 Å²	143.6	82%	0.822	81%	0.813	S	S	*	*			trans	79.1	109.1	-164.7	-29.8	0	0	0	0	112.9
154	Q	32.7	Very low	33.2	Very low	196 Å²	196	140.5 Å²	140.5	92%	0.916	81%	0.809	S	S	*	*			cis	87.3	118.8	24.7	-160.1	-173.6	72	0	0	115.5
155	G	31	Very low	33.1	Very low	71 Å²	71	139.4 Å²	139.4	73%	0.732	81%	0.807	S	S	*	*			trans	139.1	100.8	168.1	0	0	0	0	0	115.6
156	P	39.5	Very low	33.1	Very low	113 Å²	113	144.5 Å²	144.5	73%	0.734	81%	0.813	S	S	*	*			trans	-114.9	-172.4	-177.8	42.3	-33.5	0	0	0	115.1
157	D	31.7	Very low	33.3	Very low	139 Å²	139	144.7 Å²	144.7	74%	0.743	81%	0.814	S	S	*	*			trans	72.6	121.1	159.4	-67.2	-23.1	0	0	0	122
158	L	33.4	Very low	33.4	Very low	182 Å²	182	144.6 Å²	144.6	95%	0.953	82%	0.816	S	S	*	*			trans	-134.2	137.2	133	-81	-178.6	0	0	0	109.3
159	S	33	Very low	33.5	Very low	108 Å²	108	145.2 Å²	145.2	76%	0.755	82%	0.819	S	S	*	*			trans	-120.2	157.7	-167.6	6.8	0	0	0	0	112.7
160	S	32.8	Very low	33.6	Very low	112 Å²	112	136.6 Å²	136.6	78%	0.783	81%	0.81	S	S	*	*			trans	-173.3	124.8	141.1	-166.1	0	0	0	0	112.9
161	P	37.3	Very low	33.8	Very low	117 Å²	117	141.2 Å²	141.2	76%	0.76	82%	0.821	S	S	*	*			trans	-103.4	174.1	169.6	38.9	-32.6	0	0	0	112.8
162	Y	33.4	Very low	33.5	Very low	230 Å²	230	144 Å²	144	90%	0.902	82%	0.824	S	S	*	*			trans	-133.1	154.9	169.2	-131.6	-96.1	0	0	0	113.9
163	V	41.2	Very low	33.6	Very low	114 Å²	114	144.8 Å²	144.8	69%	0.691	83%	0.828	S	S	*	*			trans	-89.4	140.8	-157.8	176.2	0	0	0	0	114.2
164	P	33.3	Very low	33.3	Very low	123 Å²	123	146.6 Å²	146.6	80%	0.799	83%	0.827	S	S	*	*			trans	-95.8	148.5	157.7	36.2	-30.5	0	0	0	112.2
165	S	35.6	Very low	33.4	Very low	113 Å²	113	143.1 Å²	143.1	79%	0.79	82%	0.822	S	S	*	*			trans	-126.4	148.2	-176.8	-78.2	0	0	0	0	114.2
166	K	33	Very low	33.5	Very low	200 Å²	200	147.4 Å²	147.4	87%	0.87	82%	0.823	S	S	*	*			trans	-26.9	129.8	169.2	-64.6	-179.5	177.2	-173.1	0	114.8
167	A	30.3	Very low	33.1	Very low	94 Å²	94	149.9 Å²	149.9	78%	0.777	83%	0.83	S	S	*	*				84.1	131.2	57.4	0	0	0	0	0	114.5
168	S	36.9	Very low	33.3	Very low	125 Å²	125	151.2 Å²	151.2	87%	0.874	83%	0.831	S	S	*	*			trans	-158.3	149.6	161.2	-86.1	0	0	0	0	109.1
169	E	30.8	Very low	33.2	Very low	203 Å²	203	152.1 Å²	152.1	95%	0.949	83%	0.83	S	S	*	*			trans	-90.7	158.3	177.3	-65.9	150.6	123	0	0	111.4
170	G	34.1	Very low	33.2	Very low	76 Å²	76	152.5 Å²	152.5	78%	0.784	83%	0.832	S	S	*	*			trans	-161.3	116.4	-179.2	0	0	0	0	0	111.9
171	Q	32.4	Very low	33.1	Very low	200 Å²	200	156.6 Å²	156.6	94%	0.935	84%	0.839	S	S	*	*			trans	-57.3	161.6	-162.7	-68.3	162.4	-109.8	0	0	118.2
172	E	27.6	Very low	32.9	Very low	190 Å²	190	159.5 Å²	159.5	89%	0.888	85%	0.847	S	S	*	*			trans	-76.6	143.6	171.1	-53.3	157	128.8	0	0	111.9
173	E	32.4	Very low	32.8	Very low	200 Å²	200	157.7 Å²	157.7	94%	0.935	85%	0.847	S	S	*	*			trans	-147.2	150.7	146.9	-79.6	-153.7	144.1	0	0	110.3
174	E	27.2	Very low	32.7	Very low	172 Å²	172	157 Å²	157	80%	0.804	85%	0.852	S	S	*	*			trans	-117.6	127.1	-175.6	179.9	-171.1	-176.5	0	0	110.3
175	P	35	Very low	32.7	Very low	123 Å²	123	157.5 Å²	157.5	80%	0.799	86%	0.856	S	S	*	*	P	Polyproline II helix	trans	-91.7	123.6	174.3	32	-27.6	0	0	0	112
176	Q	32.5	Very low	32.4	Very low	161 Å²	161	155.4 Å²	155.4	75%	0.752	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-80.5	147.9	175.7	-64.7	-179.1	-30.5	0	0	112.3
177	D	30.6	Very low	32.6	Very low	165 Å²	165	156 Å²	156	88%	0.882	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-63.4	131.5	175.9	-68.4	-60.3	0	0	0	112.7
178	H	36.8	Very low	32.7	Very low	167 Å²	167	155.5 Å²	155.5	77%	0.773	86%	0.862	S	S	*	*			trans	-130.1	112.2	166.4	-92.7	-73.9	0	0	0	111	C180	H178-C180 PolarHBondContact O-N 3.1Å
179	E	31	Very low	32.5	Very low	201 Å²	201	153.1 Å²	153.1	94%	0.939	86%	0.857	S	S	*	*			trans	-69.7	124.2	167.2	-65.2	-176.5	106.3	0	0	109.8
180	C	33.4	Very low	32.7	Very low	116 Å²	116	149.2 Å²	149.2	78%	0.784	85%	0.847	S	S	*	*			trans	-120.1	122.5	169.5	-77.6	0	0	0	0	110.1	H178	H178-C180 PolarHBondContact O-N 3.1Å
181	E	30.7	Very low	32.6	Very low	198 Å²	198	154.1 Å²	154.1	93%	0.925	85%	0.849	S	S	*	*			trans	-74.6	136.8	171.8	-66	-179.9	115.4	0	0	110
182	L	33.7	Very low	32.8	Very low	178 Å²	178	151.5 Å²	151.5	93%	0.932	85%	0.847	S	S	*	*			trans	-94.9	107.7	176.5	-76.5	169.6	0	0	0	110.3
183	E	29.5	Very low	33.1	Very low	193 Å²	193	146.6 Å²	146.6	90%	0.902	84%	0.839	S	S	*	*			trans	-102.1	136.1	158	-70.1	-123.2	131.5	0	0	109.5
184	A	39.2	Very low	33.3	Very low	98 Å²	98	145.8 Å²	145.8	81%	0.81	84%	0.835	S	S	*	*			trans	-135.4	114.9	173.3	0	0	0	0	0	109.1
185	P	35.1	Very low	33.9	Very low	134 Å²	134	141.5 Å²	141.5	87%	0.87	83%	0.829	S	S	*	*			trans	-75.5	158.3	174.6	32.6	-34.6	0	0	0	111.1
186	G	29.3	Very low	34.1	Very low	70 Å²	70	143.2 Å²	143.2	72%	0.722	83%	0.831	S	S	*	*			trans	-113.8	-155.8	-175.1	0	0	0	0	0	115.4
187	E	35.4	Very low	34.7	Very low	213 Å²	213	140.5 Å²	140.5	100%	0.995	83%	0.828	S	S	*	*			trans	74.4	134.7	175.8	-52.8	-162.5	115.3	0	0	118.4
188	G	32.3	Very low	34.9	Very low	83 Å²	83	140.6 Å²	140.6	86%	0.856	82%	0.823	S	S	*	*			trans	151.4	84	164.8	0	0	0	0	0	118
189	G	34.1	Very low	35	Very low	74 Å²	74	139.8 Å²	139.8	76%	0.763	82%	0.823	S	S	*	*			trans	91	118.6	162.8	0	0	0	0	0	115.9
190	V	34.9	Very low	35.5	Very low	121 Å²	121	137 Å²	137	73%	0.733	82%	0.815	S	S	*	*			cis	111.5	99	12.3	179.7	0	0	0	0	114
191	Q	32.5	Very low	35.9	Very low	180 Å²	180	136.8 Å²	136.8	84%	0.841	81%	0.812	S	S	*	*			trans	67.4	159.5	152.1	-62.6	170.4	26.4	0	0	116.7
192	V	36.1	Very low	36.2	Very low	144 Å²	144	135.5 Å²	135.5	87%	0.873	81%	0.806	S	S	*	*			cis	-131.1	171.6	26.3	176.1	0	0	0	0	111.7
193	A	33.9	Very low	36.2	Very low	87 Å²	87	135.2 Å²	135.2	72%	0.719	80%	0.8	S	S	*	*			trans	-118.7	170.8	-167.6	0	0	0	0	0	115.1
194	E	37	Very low	36.5	Very low	184 Å²	184	136.3 Å²	136.3	86%	0.86	80%	0.802	S	S	*	*			trans	-169	129.2	136.8	-100.9	176	162.7	0	0	107.3
195	A	38.2	Very low	36.1	Very low	82 Å²	82	135.9 Å²	135.9	68%	0.678	80%	0.799	S	S	*	*				69.4	135.2	80.9	0	0	0	0	0	113.6
196	D	40.3	Very low	36.2	Very low	158 Å²	158	138.8 Å²	138.8	85%	0.845	80%	0.8	S	S	*	*			cis	-154.4	-179.9	-3.4	-118.3	-2.8	0	0	0	109.9
197	P	44.1	Very low	36.3	Very low	105 Å²	105	143 Å²	143	68%	0.682	80%	0.801	S	S	*	*			trans	-113.3	-159.5	-157.2	44.3	-38.5	0	0	0	117
198	E	35.5	Very low	36.2	Very low	166 Å²	166	140.3 Å²	140.3	78%	0.776	79%	0.789	S	S	*	*			trans	90.5	118.2	154.5	-132.5	171.9	145.7	0	0	119.8
199	L	39.9	Very low	36.2	Very low	150 Å²	150	141.5 Å²	141.5	79%	0.785	78%	0.784	S	S	*	*				172.2	115	113.6	-90.1	169.9	0	0	0	115.2
200	D	40	Very low	36	Very low	144 Å²	144	145.5 Å²	145.5	77%	0.77	78%	0.783	S	S	*	*			trans	36.8	152.3	149.1	-73.2	-51.7	0	0	0	127.7
201	P	41.4	Very low	35.9	Very low	111 Å²	111	145.4 Å²	145.4	72%	0.721	79%	0.785	S	S	*	*			trans	-112.4	165.9	171.6	42.5	-33	0	0	0	114.7
202	E	37.5	Very low	35.7	Very low	171 Å²	171	141.9 Å²	141.9	80%	0.799	78%	0.776	S	S	*	*			trans	-157.5	123.1	146.8	-118.4	-173.6	126.3	0	0	115.1
203	Q	33.2	Very low	35.8	Very low	172 Å²	172	140.8 Å²	140.8	80%	0.804	77%	0.772	S	S	*	*			trans	21.8	131.4	132.6	-55.2	-174.1	30.2	0	0	122.8
204	K	35.6	Very low	35.9	Very low	215 Å²	215	141.6 Å²	141.6	94%	0.935	78%	0.778	S	S	*	*				-155.7	155.7	117.9	-121.8	178	-177.8	-176.2	0	112.4
205	A	32.3	Very low	35.7	Very low	90 Å²	90	142.2 Å²	142.2	74%	0.744	78%	0.781	S	S	*	*			trans	-130.1	167.4	-176.9	0	0	0	0	0	111
206	E	36	Very low	35.5	Very low	195 Å²	195	144.2 Å²	144.2	91%	0.911	79%	0.79	S	S	*	*			trans	-156.4	159.6	150.1	-118	159.1	-156.7	0	0	111.2
207	Q	31.8	Very low	35.1	Very low	158 Å²	158	146.2 Å²	146.2	74%	0.738	79%	0.791	S	S	*	*			trans	-94.3	-168.5	-172.6	-64.2	146.9	-112.8	0	0	110.5
208	E	33	Very low	34.8	Very low	157 Å²	157	146.3 Å²	146.3	73%	0.734	80%	0.801	S	S	*	*			cis	-152.9	170.2	8.8	-150.9	91.8	85.1	0	0	105.1
209	S	32.9	Very low	34.4	Very low	107 Å²	107	144.5 Å²	144.5	75%	0.748	80%	0.801	S	S	*	*			cis	-162.7	-177.2	17.4	62.2	0	0	0	0	111.7
210	Q	28.9	Very low	34.2	Very low	158 Å²	158	143.5 Å²	143.5	74%	0.738	81%	0.806	S	S	*	*			trans	-128.2	165.9	162.9	-142.3	-167.6	30.1	0	0	107.8
211	P	34.7	Very low	33.8	Very low	120 Å²	120	146 Å²	146	78%	0.779	81%	0.811	S	S	*	*				-154.4	-179.3	80.9	40.4	-19.7	0	0	0	116.7
212	T	27.8	Very low	33.5	Very low	106 Å²	106	148.5 Å²	148.5	65%	0.65	82%	0.816	S	S	*	*			trans	-110.7	-161.4	170.8	60.2	0	0	0	0	109.6
213	P	38.8	Very low	33.4	Very low	121 Å²	121	146.5 Å²	146.5	79%	0.786	81%	0.81	S	S	*	*			cis	-122.9	179.2	-46.2	28.9	-10.8	0	0	0	112.2
214	A	34.2	Very low	33.3	Very low	104 Å²	104	145 Å²	145	86%	0.86	80%	0.803	S	S	*	*			trans	-145.8	150.5	163	0	0	0	0	0	112.8
215	Q	33	Very low	33.1	Very low	196 Å²	196	140.9 Å²	140.9	92%	0.916	79%	0.792	S	S	*	*			trans	-109.3	149.2	-178.1	-59.6	173.8	-5.2	0	0	111.8
216	S	35.7	Very low	33.1	Very low	124 Å²	124	139.6 Å²	139.6	87%	0.867	79%	0.787	S	S	*	*			trans	-152.6	145.5	149.5	59.6	0	0	0	0	111.7
217	K	30.6	Very low	33	Very low	201 Å²	201	138.5 Å²	138.5	87%	0.874	78%	0.782	S	S	*	*			trans	-102.3	144.1	176.1	-69.3	173.6	177.1	172.8	0	109.7
218	A	37.2	Very low	33.1	Very low	106 Å²	106	139.6 Å²	139.6	88%	0.876	79%	0.787	S	S	*	*			trans	-143	96.1	159	0	0	0	0	0	109.9
219	T	27.7	Very low	33.3	Very low	129 Å²	129	136.4 Å²	136.4	79%	0.791	79%	0.787	S	S	*	*			trans	-99.9	133.1	173.7	47.9	0	0	0	0	110.8
220	S	36.7	Very low	33.6	Very low	128 Å²	128	137.2 Å²	137.2	90%	0.895	79%	0.79	S	S	*	*			trans	-137.7	125.2	156.8	-75.6	0	0	0	0	110.1
221	K	30.5	Very low	33.9	Very low	198 Å²	198	133.7 Å²	133.7	86%	0.861	80%	0.796	S	S	*	*			trans	-94.3	154.3	165.4	-62.2	176.8	175.8	-177.6	0	108.9
222	I	35.4	Very low	33.9	Very low	163 Å²	163	136.6 Å²	136.6	84%	0.836	80%	0.804	S	S	*	*			trans	169.6	141.1	151.7	-96.6	151	0	0	0	107.6
223	L	35.3	Very low	34.2	Very low	128 Å²	128	135.1 Å²	135.1	67%	0.67	81%	0.811	S	S	*	*			cis	-165.1	153.7	-25.4	-153.6	71	0	0	0	108.7
224	E	31.5	Very low	34.2	Very low	140 Å²	140	135.3 Å²	135.3	65%	0.654	81%	0.812	S	S	*	*			trans	43.2	135.8	146.1	-85.1	176.7	74.8	0	0	125.5
225	N	31.5	Very low	34.2	Very low	130 Å²	130	135.1 Å²	135.1	70%	0.695	80%	0.804	S	S	*	*			trans	69.7	149.2	141.2	-50.1	-17.1	0	0	0	120
226	G	31.9	Very low	34.5	Very low	63 Å²	63	133.9 Å²	133.9	65%	0.649	80%	0.803	S	S	*	*			cis	174.1	170	-6.5	0	0	0	0	0	115.2
227	E	34.1	Very low	34.5	Very low	171 Å²	171	134.5 Å²	134.5	80%	0.799	80%	0.796	S	S	*	*			trans	71.2	143.4	151.7	-82.5	144.4	105.9	0	0	124.5
228	E	34.8	Very low	34.9	Very low	181 Å²	181	136 Å²	136	85%	0.846	80%	0.796	S	S	*	*			trans	54.9	116.5	158.6	-61.6	-167.4	139.9	0	0	121.3
229	A	35.9	Very low	34.9	Very low	90 Å²	90	138.1 Å²	138.1	74%	0.744	79%	0.79	S	S	*	*			cis	101.1	153	46.2	0	0	0	0	0	112.3
230	P	38.6	Very low	35.5	Very low	124 Å²	124	138.9 Å²	138.9	81%	0.805	79%	0.789	S	S	*	*			trans	-116.3	156.7	-132.6	39.1	-31.7	0	0	0	117.2
231	G	36.5	Very low	35.4	Very low	84 Å²	84	137.3 Å²	137.3	87%	0.866	78%	0.778	S	S	*	*			trans	-93.6	128.7	173.5	0	0	0	0	0	114.1
232	L	35.1	Very low	35.6	Very low	181 Å²	181	133.3 Å²	133.3	95%	0.948	77%	0.774	S	S	*	*			trans	-99.9	145.2	173.3	-73.4	153.4	0	0	0	110.8
233	G	33.7	Very low	35.7	Very low	76 Å²	76	131.3 Å²	131.3	78%	0.784	78%	0.775	S	S	*	*			trans	172.8	104.4	172.1	0	0	0	0	0	114.4
234	P	39.4	Very low	35.7	Very low	125 Å²	125	130 Å²	130	81%	0.812	78%	0.776	S	S	*	*			trans	-112.9	169.4	-174.3	40.6	-33.5	0	0	0	115.2
235	S	33.2	Very low	36.2	Very low	99 Å²	99	129.2 Å²	129.2	69%	0.692	79%	0.786	S	S	*	*			trans	66.5	128.3	155.6	-167.8	0	0	0	0	119.9
236	L	39.7	Very low	36.7	Very low	171 Å²	171	129.3 Å²	129.3	90%	0.895	79%	0.791	S	S	*	*			trans	-148.1	99.6	147.3	-114.1	174.6	0	0	0	110.3
237	D	34.4	Very low	37.1	Very low	137 Å²	137	131.5 Å²	131.5	73%	0.733	80%	0.797	S	S	*	*			trans	-71.6	126.1	170.7	-76.8	-69.7	0	0	0	111.8
238	R	39.8	Very low	37.5	Very low	231 Å²	231	128.8 Å²	128.8	87%	0.872	80%	0.797	S	S	*	*			trans	-154.2	92.2	158.2	-129.8	164.5	-150.8	-160.2	4.8	110.5
239	M	38.1	Very low	37.7	Very low	151 Å²	151	127.7 Å²	127.7	74%	0.744	80%	0.796	S	S	*	*				75.3	114.8	80.2	-73.9	-171.4	87.4	0	0	115.1
240	L	39.6	Very low	37.9	Very low	146 Å²	146	131.3 Å²	131.3	76%	0.764	80%	0.803	S	S	*	*			trans	91.1	140.6	139.9	-68.4	174	0	0	0	122.2
241	S	34.8	Very low	37.9	Very low	95 Å²	95	130.4 Å²	130.4	66%	0.664	80%	0.8	S	S	*	*			trans	62.6	111.6	152.6	-61.9	0	0	0	0	118.6
242	S	34.6	Very low	38	Very low	113 Å²	113	130.9 Å²	130.9	79%	0.79	79%	0.79	S	S	*	*				68.2	107.4	53.3	85.2	0	0	0	0	114.9
243	S	37.8	Very low	38.2	Very low	122 Å²	122	127.8 Å²	127.8	85%	0.853	78%	0.778	S	S	*	*				-164.7	161.4	112.9	-158.8	0	0	0	0	111.3
244	S	35.2	Very low	38.5	Very low	99 Å²	99	132.2 Å²	132.2	69%	0.692	78%	0.783	S	S	*	*			trans	-92.4	156.6	174.6	54.7	0	0	0	0	112.5
245	S	41.3	Very low	38.3	Very low	124 Å²	124	132.1 Å²	132.1	87%	0.867	79%	0.785	S	S	*	*			trans	-157.4	160.2	144.7	-85.4	0	0	0	0	110.2
246	V	43.1	Very low	38.5	Very low	132 Å²	132	130.6 Å²	130.6	80%	0.8	79%	0.786	S	S	*	*			trans	-130.8	-174	-163.2	-64.2	0	0	0	0	111.9
247	S	39.5	Very low	38.3	Very low	109 Å²	109	127.8 Å²	127.8	76%	0.762	78%	0.78	S	S	*	*			trans	83.4	150.5	-177.7	87.6	0	0	0	0	114.5
248	S	42	Very low	38.4	Very low	114 Å²	114	129.2 Å²	129.2	80%	0.797	79%	0.787	S	S	*	*			cis	-128	164.2	7.9	-75.2	0	0	0	0	113.7
249	L	39.6	Very low	38.3	Very low	159 Å²	159	126 Å²	126	83%	0.832	78%	0.784	S	S	*	*			trans	-85.3	154	-176.4	-63.8	155.5	0	0	0	112.6
250	N	40.8	Very low	38.1	Very low	165 Å²	165	123.9 Å²	123.9	88%	0.882	78%	0.784	S	S	*	*				176.8	165.9	119.7	-88.9	-20.9	0	0	0	113.9
251	S	37.8	Very low	37.8	Very low	106 Å²	106	125.6 Å²	125.6	74%	0.741	79%	0.793	S	S	*	*			trans	78.9	96	177.2	-159.8	0	0	0	0	118.7
252	S	38.5	Very low	37.5	Very low	94 Å²	94	126.6 Å²	126.6	66%	0.657	80%	0.8	S	S	*	*				-7.9	151.7	129.2	45.8	0	0	0	0	118.6
253	T	39.7	Very low	37.3	Very low	116 Å²	116	124.9 Å²	124.9	71%	0.712	80%	0.8	S	S	*	*			cis	-162.5	151.1	20	-9.5	0	0	0	0	113.2
254	L	39.9	Very low	36.8	Very low	168 Å²	168	127.7 Å²	127.7	88%	0.88	80%	0.8	S	S	*	*			trans	63.4	145.1	162.9	-54.6	178.6	0	0	0	116.7
255	S	34.1	Very low	36.4	Very low	123 Å²	123	132.4 Å²	132.4	86%	0.86	81%	0.811	S	S	*	*			cis	-158.3	162.5	-12.6	-176.9	0	0	0	0	108.8
256	G	37.7	Very low	35.8	Very low	68 Å²	68	131.1 Å²	131.1	70%	0.701	81%	0.808	S	S	*	*			trans	107.9	66.2	155.9	0	0	0	0	0	120.5
257	S	35.2	Very low	36	Very low	111 Å²	111	127.7 Å²	127.7	78%	0.776	80%	0.799	S	S	*	*			trans	63.9	119.5	149	-157.7	0	0	0	0	121.1
258	L	37.4	Very low	37	Very low	168 Å²	168	129.2 Å²	129.2	88%	0.88	80%	0.804	S	S	*	*			trans	-105.5	118.9	160.6	-75	167.9	0	0	0	109.5
259	M	38.6	Very low	38.6	Very low	163 Å²	163	125.5 Å²	125.5	80%	0.803	78%	0.776	S	S	*	*			trans	-145.4	149.6	173.9	-79.8	-74.8	102.3	0	0	112.1
260	S	32.5	Very low	40.9	Very low	107 Å²	107	124.5 Å²	124.5	75%	0.748	77%	0.767	S	S	*	*			trans	51.4	92.7	170.2	59.2	0	0	0	0	118.7	S262	S260-S262 PolarHBondContact O-N 3.47Å
261	L	33.9	Very low	43.3	Very low	181 Å²	181	117.9 Å²	117.9	95%	0.948	73%	0.733	S	S	*	*			trans	-77.1	102.5	146.7	-74.2	168.1	0	0	0	109.3
262	S	29.1	Very low	45.9	Very low	116 Å²	116	120.3 Å²	120.3	81%	0.811	73%	0.726	S	S	*	*			trans	171.8	119.1	154.9	29.4	0	0	0	0	110.6	S260	S260-S262 PolarHBondContact O-N 3.47Å
263	G	29	Very low	48.6	Very low	77 Å²	77	117 Å²	117	79%	0.794	71%	0.707	S	S	*	*			trans	168.3	104.2	178.1	0	0	0	0	0	112.7
264	E	28	Very low	51.3	Low	181 Å²	181	112.6 Å²	112.6	85%	0.846	68%	0.68	S	S	*	*			trans	-71.9	139.1	-179.2	-57.7	143.4	114.5	0	0	111.9	A266	E264-A266 PolarHBondContact O-N 3.03Å
265	E	27.8	Very low	54.1	Low	198 Å²	198	104.6 Å²	104.6	93%	0.925	64%	0.639	S	S	*	*			trans	31.3	33.9	157.6	-57.4	-160.4	135.3	0	0	119.9	G267	E265-G267 PolarHBondContact O-N 2.78Å
266	A	27.7	Very low	57.2	Low	97 Å²	97	99.6 Å²	99.6	80%	0.802	60%	0.602	S	S	*	*			trans	-79.9	55.2	-171	0	0	0	0	0	114.4	E264	E264-A266 PolarHBondContact O-N 3.03Å
267	G	46.3	Very low	60.1	Low	60 Å²	60	96.4 Å²	96.4	62%	0.619	57%	0.569	S	S	*	*	S	Bend	trans	-135.6	-66.3	-176.9	0	0	0	0	0	115.4	E265 V269	E265-G267 PolarHBondContact O-N 2.78Å; G267-V269 PolarHBondContact O-N 3.49Å
268	T	60.9	Low	63	Low	142 Å²	142	91.4 Å²	91.4	87%	0.871	53%	0.534	S	S	*	.			trans	-98.9	95	-159.7	-47.8	0	0	0	0	112.7	Q270	T268-Q270 PolarHBondContact O-N 2.84Å
269	V	77.1	Confident	65.9	Low	35 Å²	35	83.4 Å²	83.4	21%	0.212	49%	0.492	C	S	.	.			trans	-69.2	118.1	168.4	175.5	0	0	0	0	109	G267 V271 A299 A301 I367 L369	G267-V269 PolarHBondContact O-N 3.49Å; V269-V271 PolarHBondContact O-N 3.33Å; V269-V271 VanDerWaalsContact O-N 3.09Å; V269-A299 HydrophobicContact CG1-CB 3.52Å; V269-A301 HydrophobicContact CG2-CB 3.93Å; V269-I367 HydrophobicContact CB-CG2 4.3Å; V269-I367 HydrophobicContact CG2-CG2 3.7Å; V269-L369 HydrophobicContact CG1-CD2 4.34Å
270	Q	86.4	Confident	68.6	Low	138 Å²	138	80 Å²	80	65%	0.645	47%	0.474	S	S	*	.			trans	-60.1	115.2	174.4	-177.5	-177.8	75.2	0	0	109.6	T268 R272 A299	T268-Q270 PolarHBondContact O-N 2.84Å; Q270-R272 PolarHBondContact O-N 3.45Å; Q270-A299 VanDerWaalsContact O-CB 3.25Å; Q270-A299 WeakPolarHBondContact O-CB 3.37Å
271	V	91.2	Very high	71.6	Confident	26 Å²	26	76.8 Å²	76.8	16%	0.158	45%	0.446	C	S	.	.			trans	-61.2	134.6	179.7	167.4	0	0	0	0	110.9	V269 F368 L369 G370 L390 P392	V269-V271 PolarHBondContact O-N 3.33Å; V269-V271 VanDerWaalsContact O-N 3.09Å; V271-F368 HydrophobicContact CG2-CD1 4.16Å; V271-F368 HydrophobicContact CG2-CE1 3.85Å; V271-L369 WeakPolarHBondContact CG1-O 3.48Å; V271-G370 VanDerWaalsContact CG1-CA 3.48Å; V271-L390 HydrophobicContact CG1-CB 4.05Å; V271-L390 WeakPolarHBondContact CG1-O 3.35Å; V271-P392 HydrophobicContact CB-CG 4.29Å; V271-P392 HydrophobicContact CG2-CB 4.5Å
272	R	92.1	Very high	74.5	Confident	157 Å²	157	71.4 Å²	71.4	59%	0.592	42%	0.416	S	S	*	.			trans	-153.3	151.8	-179.9	-73.5	-171.9	165.7	-134.6	-7.8	110.6	Q270 G297 L298 A299	Q270-R272 PolarHBondContact O-N 3.45Å; R272-G297 CarbonylContact C-O 3.55Å; R272-L298 WeakPolarHBondContact O-CA 3.41Å; R272-A299 HydrophobicContact CB-CB 4.28Å; R272-A299 PolarHBondContact O-N 2.88Å
273	G	95.7	Very high	77.6	Confident	25 Å²	25	69.6 Å²	69.6	26%	0.258	40%	0.402	S	S	.	.			trans	107	-173.3	171.9	0	0	0	0	0	113.4	Q296 G297 L390	G273-Q296 CarbonylContact C-O 3.37Å; G273-Q296 WeakPolarHBondContact CA-O 3.22Å; G273-G297 WeakPolarHBondContact CA-O 3.24Å; G273-G297 PolarHBondContact N-O 2.83Å; G273-L390 WeakPolarHBondContact O-CB 3.49Å; G273-L390 PolarHBondContact O-N 2.74Å
274	S	97.9	Very high	80.7	Confident	23 Å²	23	69.8 Å²	69.8	16%	0.161	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	159.5	-179.6	54.6	0	0	0	0	110.6	C295 Q296 W387 L388	S274-C295 CarbonylContact O-C 3.6Å; S274-C295 WeakPolarHBondContact O-CA 3.19Å; S274-C295 VanDerWaalsContact O-CB 3.26Å; S274-C295 WeakPolarHBondContact O-CB 3.26Å; S274-Q296 PolarHBondContact N-O 2.79Å; S274-Q296 PolarHBondContact O-N 2.86Å; S274-W387 VanDerWaalsContact OG-CZ3 3.29Å; S274-W387 WeakPolarHBondContact OG-CZ3 3.36Å; S274-L388 CarbonylContact C-O 3.48Å; S274-L388 VanDerWaalsContact CA-O 3.24Å; S274-L388 WeakPolarHBondContact CA-O 3.43Å; S274-L388 WeakPolarHBondContact CB-O 3.41Å
275	V	98.3	Very high	83.9	Confident	1 Å²	1	64.3 Å²	64.3	1%	0.006	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	137.3	172.6	58.5	0	0	0	0	110	F277 V372 W387 L388 L390	V275-F277 HydrophobicContact CG1-CD1 4.25Å; V275-F277 HydrophobicContact CG1-CE1 4.46Å; V275-F277 HydrophobicContact CG2-CD1 4.43Å; V275-V372 HydrophobicContact CG1-CG1 4.27Å; V275-V372 HydrophobicContact CG1-CG2 3.75Å; V275-W387 WeakPolarHBondContact O-CA 3.23Å; V275-L388 PolarHBondContact N-O 3.35Å; V275-L388 PolarHBondContact O-N 2.74Å; V275-L390 HydrophobicContact CB-CD2 4.14Å; V275-L390 HydrophobicContact CG1-CD2 3.81Å
276	L	98.3	Very high	87.1	Confident	18 Å²	18	56.8 Å²	56.8	9%	0.094	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	123.6	173.1	-178.1	59.6	0	0	0	109.2	I293 Q294 A385 W387	L276-I293 HydrophobicContact CB-CB 4.42Å; L276-I293 HydrophobicContact CD2-CB 4.27Å; L276-I293 HydrophobicContact CD2-CD1 4.49Å; L276-I293 HydrophobicContact CD2-CG2 3.9Å; L276-I293 HydrophobicContact CG-CB 4.11Å; L276-I293 HydrophobicContact CG-CD1 4.13Å; L276-I293 HydrophobicContact CG-CG2 4.3Å; L276-I293 WeakPolarHBondContact O-CB 3.45Å; L276-I293 PolarHBondContact O-N 3.01Å; L276-Q294 HydrophobicContact CB-CG 3.9Å; L276-Q294 HydrophobicContact CD2-CG 3.96Å; L276-Q294 PolarHBondContact N-O 2.83Å; L276-Q294 PolarHBondContact O-N 2.79Å; L276-A385 HydrophobicContact CD1-CB 3.75Å; L276-A385 WeakPolarHBondContact CD1-O 3.45Å; L276-A385 HydrophobicContact CG-CB 4.22Å; L276-W387 HydrophobicContact CB-CD2 3.75Å; L276-W387 HydrophobicContact CB-CE3 3.69Å; L276-W387 HydrophobicContact CB-CG 4.48Å; L276-W387 HydrophobicContact CB-CH2 3.9Å; L276-W387 HydrophobicContact CB-CZ2 3.93Å; L276-W387 HydrophobicContact CB-CZ3 3.77Å; L276-W387 HydrophobicContact CD1-CD2 4.08Å; L276-W387 HydrophobicContact CD1-CG 3.99Å; L276-W387 HydrophobicContact CD2-CZ2 3.91Å; L276-W387 HydrophobicContact CG-CD2 4.35Å; L276-W387 HydrophobicContact CG-CZ2 4.43Å
277	F	98.2	Very high	90.3	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	161.2	176.8	66.7	-80.2	0	0	0	111.4	V275 L279 Q291 L353 L355 V372 V374 W379 A385 T386 L388	V275-F277 HydrophobicContact CG1-CD1 4.25Å; V275-F277 HydrophobicContact CG1-CE1 4.46Å; V275-F277 HydrophobicContact CG2-CD1 4.43Å; F277-L279 HydrophobicContact CD2-CD2 3.71Å; F277-L279 HydrophobicContact CD2-CG 4.11Å; F277-L279 HydrophobicContact CE2-CD1 4.31Å; F277-L279 HydrophobicContact CE2-CD2 3.86Å; F277-L279 HydrophobicContact CE2-CG 3.93Å; F277-Q291 WeakPolarHBondContact CA-O 3.1Å; F277-Q291 VanDerWaalsContact CB-O 3.27Å; F277-Q291 WeakPolarHBondContact CB-O 3.49Å; F277-L353 HydrophobicContact CE2-CD2 4.5Å; F277-L355 HydrophobicContact CB-CD1 4.41Å; F277-L355 HydrophobicContact CD1-CD1 3.9Å; F277-L355 HydrophobicContact CD2-CD1 3.92Å; F277-L355 HydrophobicContact CE1-CD1 4.16Å; F277-L355 HydrophobicContact CE2-CD1 4.18Å; F277-L355 HydrophobicContact CG-CD1 3.79Å; F277-L355 HydrophobicContact CZ-CD1 4.3Å; F277-V372 HydrophobicContact CE1-CG2 4.29Å; F277-V374 HydrophobicContact CZ-CG2 3.99Å; F277-W379 HydrophobicContact CD2-CH2 4.48Å; F277-W379 AromaticContact CE2-CH2 3.63Å; F277-W379 HydrophobicContact CE2-CH2 3.63Å; F277-W379 HydrophobicContact CE2-CZ2 4.36Å; F277-W379 AromaticContact CE2-CZ3 3.93Å; F277-W379 HydrophobicContact CE2-CZ3 3.93Å; F277-W379 AromaticContact CZ-CH2 3.93Å; F277-W379 HydrophobicContact CZ-CH2 3.93Å; F277-W379 AromaticContact CZ-CZ3 3.93Å; F277-W379 HydrophobicContact CZ-CZ3 3.93Å; F277-A385 CarbonylContact O-C 3.52Å; F277-A385 VanDerWaalsContact O-CA 3.31Å; F277-A385 WeakPolarHBondContact O-CA 3.3Å; F277-T386 PolarHBondContact N-O 3.04Å; F277-T386 PolarHBondContact O-N 2.84Å; F277-L388 HydrophobicContact CE1-CB 4.36Å; F277-L388 HydrophobicContact CE1-CD1 3.79Å; F277-L388 HydrophobicContact CE1-CG 3.99Å; F277-L388 HydrophobicContact CZ-CD1 3.72Å; F277-L388 HydrophobicContact CZ-CG 4.29Å
278	S	97.3	Very high	92.7	Very high	6 Å²	6	51 Å²	51	4%	0.042	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	156	164.5	64.1	0	0	0	0	110.6	H280 Q291	S278-H280 PolarHBondContact OG-NE2 2.67Å; S278-Q291 PolarHBondContact N-O 3.22Å; S278-Q291 VanDerWaalsContact N-O 3.17Å; S278-Q291 PolarHBondContact O-N 3.21Å
279	L	97.1	Very high	94.4	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	130.6	175.5	-53	-174.2	0	0	0	109.2	F277 L288 R289 V290 L353 L376 W379 W381	F277-L279 HydrophobicContact CD2-CD2 3.71Å; F277-L279 HydrophobicContact CD2-CG 4.11Å; F277-L279 HydrophobicContact CE2-CD1 4.31Å; F277-L279 HydrophobicContact CE2-CD2 3.86Å; F277-L279 HydrophobicContact CE2-CG 3.93Å; L279-L288 HydrophobicContact CB-CD1 4.46Å; L279-R289 WeakPolarHBondContact CA-O 3.44Å; L279-V290 HydrophobicContact CD2-CB 4.17Å; L279-V290 HydrophobicContact CD2-CG1 3.82Å; L279-V290 HydrophobicContact CD2-CG2 3.96Å; L279-L353 HydrophobicContact CD1-CD2 3.81Å; L279-L353 HydrophobicContact CD2-CD2 3.33Å; L279-L353 HydrophobicContact CG-CD2 4.22Å; L279-L376 HydrophobicContact CD1-CD2 3.64Å; L279-W379 HydrophobicContact CB-CZ2 4.25Å; L279-W379 HydrophobicContact CD1-CD2 3.71Å; L279-W379 HydrophobicContact CD1-CE3 4.22Å; L279-W379 HydrophobicContact CD1-CG 3.94Å; L279-W379 HydrophobicContact CD1-CZ2 4.15Å; L279-W379 HydrophobicContact CG-CD2 4.34Å; L279-W379 HydrophobicContact CG-CH2 4.43Å; L279-W379 HydrophobicContact CG-CZ2 3.87Å; L279-W381 HydrophobicContact CB-CZ3 4.35Å
280	H	95.1	Very high	95.4	Very high	90 Å²	90	45 Å²	45	42%	0.417	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	131.6	173.2	-55.2	-65.2	0	0	0	108.7	S278 R289	S278-H280 PolarHBondContact OG-NE2 2.67Å; H280-R289 PolarHBondContact N-O 2.84Å; H280-R289 WeakPolarHBondContact O-CA 3.28Å; H280-R289 WeakPolarHBondContact O-CB 3.5Å; H280-R289 PolarHBondContact O-N 2.96Å
281	Y	95.7	Very high	95.9	Very high	40 Å²	40	41.8 Å²	41.8	16%	0.157	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	135.4	173.1	-179.1	-103.4	0	0	0	109.7	P283 S286 E287 L288 V343 Q345 L348	Y281-P283 HydrophobicContact CD1-CG 3.9Å; Y281-P283 HydrophobicContact CE1-CB 4.01Å; Y281-P283 HydrophobicContact CE1-CG 3.81Å; Y281-S286 WeakPolarHBondContact OH-CA 3.33Å; Y281-E287 WeakPolarHBondContact CA-O 3.38Å; Y281-E287 WeakPolarHBondContact CD2-O 3.41Å; Y281-L288 HydrophobicContact CD2-CB 4.5Å; Y281-V343 HydrophobicContact CE2-CG1 4.5Å; Y281-V343 WeakPolarHBondContact CE2-O 3.47Å; Y281-V343 PolarHBondContact OH-O 3.06Å; Y281-Q345 HydrophobicContact CD1-CB 4.44Å; Y281-Q345 HydrophobicContact CD1-CG 4.03Å; Y281-Q345 HydrophobicContact CE1-CB 3.55Å; Y281-Q345 HydrophobicContact CE1-CG 3.6Å; Y281-Q345 PolarHBondContact OH-N 2.53Å; Y281-L348 HydrophobicContact CD1-CD1 4.37Å; Y281-L348 HydrophobicContact CD2-CD1 3.81Å; Y281-L348 HydrophobicContact CD2-CD2 4.41Å; Y281-L348 HydrophobicContact CE2-CD1 4.16Å; Y281-L348 HydrophobicContact CG-CD1 3.92Å
282	E	95.4	Very high	96.3	Very high	68 Å²	68	40.5 Å²	40.5	32%	0.318	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	101.4	176.1	-172.3	177.2	-90.6	0	0	110.1	G284 T285 S286 E287 R289	E282-G284 VanDerWaalsContact C-N 3.3Å; E282-G284 PolarHBondContact O-N 3.18Å; E282-T285 PolarHBondContact O-N 3.45Å; E282-T285 PolarHBondContact O-OG1 3.47Å; E282-T285 WeakPolarHBondContact OE2-CG2 3.34Å; E282-T285 PolarHBondContact OE2-OG1 3.23Å; E282-S286 PolarHBondContact O-N 3.21Å; E282-E287 PolarHBondContact N-O 3.45Å; E282-E287 PolarHBondContact O-N 2.64Å; E282-R289 VanDerWaalsContact CD-NH1 3.33Å; E282-R289 IonicContact OE1-CZ 3.09Å; E282-R289 VanDerWaalsContact OE1-CZ 3.26Å; E282-R289 IonicContact OE1-NH1 3.19Å; E282-R289 PolarHBondContact OE1-NH1 3.31Å; E282-R289 IonicContact OE1-NH2 3.46Å; E282-R289 PolarHBondContact OE1-NH2 3.27Å; E282-R289 IonicContact OE2-CZ 3.02Å; E282-R289 IonicContact OE2-NH1 3.66Å; E282-R289 IonicContact OE2-NH2 3.67Å; E282-R289 PolarHBondContact OE2-NH2 3.4Å
283	P	93.5	Very high	96.6	Very high	79 Å²	79	34.3 Å²	34.3	51%	0.513	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-37.6	-175	-26	33.6	0	0	0	114.1	Y281 T285 S286	Y281-P283 HydrophobicContact CD1-CG 3.9Å; Y281-P283 HydrophobicContact CE1-CB 4.01Å; Y281-P283 HydrophobicContact CE1-CG 3.81Å; P283-T285 PolarHBondContact O-N 3.15Å; P283-S286 PolarHBondContact O-N 3.5Å
284	G	94.3	Very high	96.7	Very high	80 Å²	80	35.8 Å²	35.8	83%	0.825	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-18.6	-177.1	0	0	0	0	0	115.2	E282	E282-G284 VanDerWaalsContact C-N 3.3Å; E282-G284 PolarHBondContact O-N 3.18Å
285	T	94.9	Very high	96.7	Very high	66 Å²	66	34.7 Å²	34.7	41%	0.405	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.2	-5	175.1	52.4	0	0	0	0	113.1	E282 P283 E287	E282-T285 PolarHBondContact O-N 3.45Å; E282-T285 PolarHBondContact O-OG1 3.47Å; E282-T285 WeakPolarHBondContact OE2-CG2 3.34Å; E282-T285 PolarHBondContact OE2-OG1 3.23Å; P283-T285 PolarHBondContact O-N 3.15Å; T285-E287 PolarHBondContact O-N 3.25Å; T285-E287 WeakPolarHBondContact OG1-CG 3.24Å
286	S	94.9	Very high	96.7	Very high	41 Å²	41	39.7 Å²	39.7	29%	0.287	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.6	46.4	-169.1	-62.2	0	0	0	0	112.3	Y281 E282 P283 S342 V343	Y281-S286 WeakPolarHBondContact OH-CA 3.33Å; E282-S286 PolarHBondContact O-N 3.21Å; P283-S286 PolarHBondContact O-N 3.5Å; S286-S342 WeakPolarHBondContact O-CA 3.18Å; S286-S342 PolarHBondContact O-OG 3.46Å; S286-V343 CarbonylContact C-O 3.44Å; S286-V343 PolarHBondContact O-N 2.86Å; S286-V343 VanDerWaalsContact O-O 3.07Å
287	E	96.2	Very high	96.6	Very high	34 Å²	34	40.8 Å²	40.8	16%	0.159	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	126.2	177.3	-74.4	-173.1	161.3	0	0	111.9	Y281 E282 T285 R289 R340 H341	Y281-E287 WeakPolarHBondContact CA-O 3.38Å; Y281-E287 WeakPolarHBondContact CD2-O 3.41Å; E282-E287 PolarHBondContact N-O 3.45Å; E282-E287 PolarHBondContact O-N 2.64Å; T285-E287 PolarHBondContact O-N 3.25Å; T285-E287 WeakPolarHBondContact OG1-CG 3.24Å; E287-R289 HydrophobicContact CB-CG 4.3Å; E287-R289 IonicContact OE2-CZ 3.25Å; E287-R289 IonicContact OE2-NE 2.65Å; E287-R289 PolarHBondContact OE2-NE 2.69Å; E287-R289 IonicContact OE2-NH2 3.64Å; E287-R289 PolarHBondContact OE2-NH2 3.48Å; E287-R340 VanDerWaalsContact CD-NH1 3.28Å; E287-R340 VanDerWaalsContact OE1-CD 3.28Å; E287-R340 WeakPolarHBondContact OE1-CD 3.48Å; E287-R340 IonicContact OE1-CZ 3.25Å; E287-R340 IonicContact OE1-NE 3.36Å; E287-R340 IonicContact OE1-NH1 3.42Å; E287-R340 PolarHBondContact OE1-NH1 2.94Å; E287-R340 WeakPolarHBondContact OE2-CD 3.23Å; E287-R340 IonicContact OE2-CZ 2.67Å; E287-R340 IonicContact OE2-NE 3.69Å; E287-R340 IonicContact OE2-NH1 2.78Å; E287-R340 PolarHBondContact OE2-NH1 3.37Å; E287-H341 CarbonylContact C-O 3.55Å; E287-H341 WeakPolarHBondContact CA-O 3.41Å
288	L	96.2	Very high	96.5	Very high	0 Å²	0	41 Å²	41	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	116.9	155.9	176.6	64.2	0	0	0	109	L279 Y281 V290 L314 H341 V343 L348 L376 W381	L279-L288 HydrophobicContact CB-CD1 4.46Å; Y281-L288 HydrophobicContact CD2-CB 4.5Å; L288-V290 HydrophobicContact CD2-CG2 4.49Å; L288-V290 HydrophobicContact CG-CG2 4.25Å; L288-L314 HydrophobicContact CD2-CD1 3.97Å; L288-H341 HydrophobicContact CB-CB 4.41Å; L288-H341 PolarHBondContact N-O 2.82Å; L288-H341 PolarHBondContact O-N 2.97Å; L288-V343 HydrophobicContact CB-CG1 3.74Å; L288-L348 HydrophobicContact CD2-CD2 4.49Å; L288-L376 HydrophobicContact CD2-CD1 3.59Å; L288-W381 HydrophobicContact CD1-CH2 3.87Å; L288-W381 HydrophobicContact CD1-CZ3 3.79Å
289	R	97	Very high	96.3	Very high	53 Å²	53	41.1 Å²	41.1	20%	0.2	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	118.3	177.7	-63.8	-174.3	173.2	151	9.9	110.3	L279 H280 E282 E287 T338 R340	L279-R289 WeakPolarHBondContact CA-O 3.44Å; H280-R289 PolarHBondContact N-O 2.84Å; H280-R289 WeakPolarHBondContact O-CA 3.28Å; H280-R289 WeakPolarHBondContact O-CB 3.5Å; H280-R289 PolarHBondContact O-N 2.96Å; E282-R289 VanDerWaalsContact CD-NH1 3.33Å; E282-R289 IonicContact OE1-CZ 3.09Å; E282-R289 VanDerWaalsContact OE1-CZ 3.26Å; E282-R289 IonicContact OE1-NH1 3.19Å; E282-R289 PolarHBondContact OE1-NH1 3.31Å; E282-R289 IonicContact OE1-NH2 3.46Å; E282-R289 PolarHBondContact OE1-NH2 3.27Å; E282-R289 IonicContact OE2-CZ 3.02Å; E282-R289 IonicContact OE2-NH1 3.66Å; E282-R289 IonicContact OE2-NH2 3.67Å; E282-R289 PolarHBondContact OE2-NH2 3.4Å; E287-R289 HydrophobicContact CB-CG 4.3Å; E287-R289 IonicContact OE2-CZ 3.25Å; E287-R289 IonicContact OE2-NE 2.65Å; E287-R289 PolarHBondContact OE2-NE 2.69Å; E287-R289 IonicContact OE2-NH2 3.64Å; E287-R289 PolarHBondContact OE2-NH2 3.48Å; R289-T338 HydrophobicContact CB-CG2 3.8Å; R289-T338 HydrophobicContact CG-CG2 4.32Å; R289-R340 HydrophobicContact CG-CG 4.42Å
290	V	97.6	Very high	96.1	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	99.3	-179.8	-173.6	0	0	0	0	108.1	L279 L288 V292 L339 L353 L355	L279-V290 HydrophobicContact CD2-CB 4.17Å; L279-V290 HydrophobicContact CD2-CG1 3.82Å; L279-V290 HydrophobicContact CD2-CG2 3.96Å; L288-V290 HydrophobicContact CD2-CG2 4.49Å; L288-V290 HydrophobicContact CG-CG2 4.25Å; V290-V292 HydrophobicContact CG1-CG2 4.46Å; V290-V292 PolarHBondContact O-N 2.92Å; V290-L339 HydrophobicContact CB-CB 4.42Å; V290-L339 PolarHBondContact N-O 3.47Å; V290-L339 PolarHBondContact O-N 3.19Å; V290-L353 HydrophobicContact CG1-CD1 4.5Å; V290-L353 HydrophobicContact CG1-CD2 4.08Å; V290-L353 HydrophobicContact CG2-CD1 3.96Å; V290-L353 HydrophobicContact CG2-CD2 4.1Å; V290-L355 HydrophobicContact CG1-CD1 4.06Å; V290-L355 HydrophobicContact CG1-CD2 4.06Å; V290-L355 HydrophobicContact CG1-CG 4.49Å
291	Q	98.1	Very high	95.7	Very high	69 Å²	69	39.5 Å²	39.5	32%	0.322	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	102.2	-179.7	-173.2	177.1	-14.5	0	0	109.7	F277 S278 I293	F277-Q291 WeakPolarHBondContact CA-O 3.1Å; F277-Q291 VanDerWaalsContact CB-O 3.27Å; F277-Q291 WeakPolarHBondContact CB-O 3.49Å; S278-Q291 PolarHBondContact N-O 3.22Å; S278-Q291 VanDerWaalsContact N-O 3.17Å; S278-Q291 PolarHBondContact O-N 3.21Å; Q291-I293 HydrophobicContact CG-CG1 4.01Å; Q291-I293 PolarHBondContact O-N 3.39Å
292	V	98.4	Very high	95	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	109	175.5	-176.2	0	0	0	0	108.3	V290 V310 T324 F335 N336 E337 L339 L355	V290-V292 HydrophobicContact CG1-CG2 4.46Å; V290-V292 PolarHBondContact O-N 2.92Å; V292-V310 HydrophobicContact CG1-CB 4.15Å; V292-V310 HydrophobicContact CG1-CG1 4.47Å; V292-V310 HydrophobicContact CG1-CG2 3.8Å; V292-T324 HydrophobicContact CB-CG2 4Å; V292-T324 HydrophobicContact CG1-CG2 4.05Å; V292-T324 HydrophobicContact CG2-CG2 4.2Å; V292-F335 HydrophobicContact CG1-CB 4.1Å; V292-F335 HydrophobicContact CG1-CD2 3.84Å; V292-F335 HydrophobicContact CG1-CG 4.13Å; V292-F335 WeakPolarHBondContact O-CB 3.27Å; V292-N336 WeakPolarHBondContact O-CA 3.24Å; V292-N336 PolarHBondContact O-N 2.97Å; V292-E337 PolarHBondContact N-O 3.06Å; V292-E337 PolarHBondContact O-N 2.88Å; V292-L339 HydrophobicContact CG2-CD1 4.04Å; V292-L339 HydrophobicContact CG2-CG 4.34Å; V292-L355 HydrophobicContact CG2-CD2 4.3Å
293	I	98.4	Very high	94.1	Very high	27 Å²	27	50 Å²	50	14%	0.138	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	-62.7	-171.7	-63.1	160.8	0	0	0	109.3	L276 Q291 F335 N336 A385	L276-I293 HydrophobicContact CB-CB 4.42Å; L276-I293 HydrophobicContact CD2-CB 4.27Å; L276-I293 HydrophobicContact CD2-CD1 4.49Å; L276-I293 HydrophobicContact CD2-CG2 3.9Å; L276-I293 HydrophobicContact CG-CB 4.11Å; L276-I293 HydrophobicContact CG-CD1 4.13Å; L276-I293 HydrophobicContact CG-CG2 4.3Å; L276-I293 WeakPolarHBondContact O-CB 3.45Å; L276-I293 PolarHBondContact O-N 3.01Å; Q291-I293 HydrophobicContact CG-CG1 4.01Å; Q291-I293 PolarHBondContact O-N 3.39Å; I293-F335 WeakPolarHBondContact O-CA 3.19Å; I293-F335 PolarHBondContact O-N 2.84Å; I293-N336 WeakPolarHBondContact CG2-OD1 3.37Å; I293-N336 PolarHBondContact O-N 2.9Å; I293-N336 PolarHBondContact O-OD1 2.9Å; I293-A385 HydrophobicContact CD1-CB 3.39Å
294	Q	98.3	Very high	93.2	Very high	56 Å²	56	57.5 Å²	57.5	26%	0.262	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	168.8	-179.9	60.4	-179.2	-22.2	0	0	112.6	L276 P333 I334 W387	L276-Q294 HydrophobicContact CB-CG 3.9Å; L276-Q294 HydrophobicContact CD2-CG 3.96Å; L276-Q294 PolarHBondContact N-O 2.83Å; L276-Q294 PolarHBondContact O-N 2.79Å; Q294-P333 CarbonylContact C-O 3.4Å; Q294-P333 WeakPolarHBondContact CA-O 3.46Å; Q294-P333 VanDerWaalsContact CB-O 3.28Å; Q294-P333 WeakPolarHBondContact CB-O 3.23Å; Q294-I334 HydrophobicContact CB-CG1 4.16Å; Q294-W387 HydrophobicContact CG-CH2 3.68Å; Q294-W387 HydrophobicContact CG-CZ2 4.09Å; Q294-W387 HydrophobicContact CG-CZ3 4.48Å
295	C	98.3	Very high	92.7	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	158	161.9	-52.8	0	0	0	0	110.4	S274 L298 N332 P333	S274-C295 CarbonylContact O-C 3.6Å; S274-C295 WeakPolarHBondContact O-CA 3.19Å; S274-C295 VanDerWaalsContact O-CB 3.26Å; S274-C295 WeakPolarHBondContact O-CB 3.26Å; C295-L298 HydrophobicContact CB-CD1 3.9Å; C295-L298 HydrophobicContact CB-CD2 3.76Å; C295-L298 HydrophobicContact CB-CG 3.85Å; C295-N332 CarbonylContact O-C 3.54Å; C295-N332 WeakPolarHBondContact O-CA 3.39Å; C295-P333 HydrophobicContact CB-CG 3.81Å; C295-P333 PolarHBondContact N-O 2.87Å
296	Q	97.3	Very high	92.6	Very high	106 Å²	106	55.6 Å²	55.6	50%	0.495	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	143.1	177.5	-172.2	178.2	16.4	0	0	110.6	G273 S274 L298 N332 W387	G273-Q296 CarbonylContact C-O 3.37Å; G273-Q296 WeakPolarHBondContact CA-O 3.22Å; S274-Q296 PolarHBondContact N-O 2.79Å; S274-Q296 PolarHBondContact O-N 2.86Å; Q296-L298 VanDerWaalsContact C-N 3.32Å; Q296-L298 PolarHBondContact O-N 2.78Å; Q296-N332 WeakPolarHBondContact CA-OD1 3.29Å; Q296-W387 HydrophobicContact CB-CH2 3.66Å; Q296-W387 HydrophobicContact CB-CZ3 3.79Å
297	G	95.7	Very high	92.7	Very high	41 Å²	41	55.3 Å²	55.3	42%	0.423	25%	0.251	S	S	.	.	S	Bend	trans	66.7	25	170.9	0	0	0	0	0	115.6	R272 G273 L331 N332	R272-G297 CarbonylContact C-O 3.55Å; G273-G297 WeakPolarHBondContact CA-O 3.24Å; G273-G297 PolarHBondContact N-O 2.83Å; G297-L331 PolarHBondContact N-O 2.93Å; G297-N332 PolarHBondContact N-OD1 2.87Å
298	L	96.8	Very high	92.7	Very high	5 Å²	5	53.7 Å²	53.7	3%	0.026	24%	0.244	C	C	.	.			trans	-58.3	146	-176.2	-65.9	-177.1	0	0	0	112.8	R272 C295 Q296 P308 L331 P333 V357 L369 L390	R272-L298 WeakPolarHBondContact O-CA 3.41Å; C295-L298 HydrophobicContact CB-CD1 3.9Å; C295-L298 HydrophobicContact CB-CD2 3.76Å; C295-L298 HydrophobicContact CB-CG 3.85Å; Q296-L298 VanDerWaalsContact C-N 3.32Å; Q296-L298 PolarHBondContact O-N 2.78Å; L298-P308 HydrophobicContact CD1-CB 3.64Å; L298-P308 HydrophobicContact CD1-CG 3.89Å; L298-L331 HydrophobicContact CB-CB 4.48Å; L298-L331 WeakPolarHBondContact CB-O 3.2Å; L298-L331 WeakPolarHBondContact CG-O 3.45Å; L298-L331 PolarHBondContact N-O 2.91Å; L298-P333 HydrophobicContact CD1-CG 3.68Å; L298-V357 HydrophobicContact CD1-CG1 4Å; L298-V357 HydrophobicContact CD2-CG1 4.13Å; L298-L369 HydrophobicContact CD1-CD1 4.45Å; L298-L390 HydrophobicContact CD2-CD1 3.35Å
299	A	93.3	Very high	92.8	Very high	7 Å²	7	54.7 Å²	54.7	6%	0.058	25%	0.248	C	C	.	.			trans	-59.5	141.3	172.5	0	0	0	0	0	112.3	V269 Q270 R272 A301 S306 L369	V269-A299 HydrophobicContact CG1-CB 3.52Å; Q270-A299 VanDerWaalsContact O-CB 3.25Å; Q270-A299 WeakPolarHBondContact O-CB 3.37Å; R272-A299 HydrophobicContact CB-CB 4.28Å; R272-A299 PolarHBondContact O-N 2.88Å; A299-A301 PolarHBondContact O-N 2.81Å; A299-S306 PolarHBondContact O-OG 3.46Å; A299-L369 HydrophobicContact CB-CD2 4.42Å
300	A	91.9	Very high	92.9	Very high	46 Å²	46	52.2 Å²	52.2	38%	0.38	24%	0.238	S	C	.	.			trans	-94.8	89.6	-177.7	0	0	0	0	0	111.3	R302 R305 S306 L331	A300-R302 VanDerWaalsContact C-N 3.29Å; A300-R302 PolarHBondContact O-N 2.98Å; A300-R305 CarbonylContact C-O 3.5Å; A300-S306 WeakPolarHBondContact CA-OG 3.38Å; A300-L331 HydrophobicContact CB-CD1 4.06Å; A300-L331 HydrophobicContact CB-CD2 4.08Å
301	A	86.5	Confident	92.9	Very high	11 Å²	11	53.9 Å²	53.9	9%	0.091	25%	0.245	C	C	.	.			trans	-67.8	-21.1	-169.2	0	0	0	0	0	115.1	V269 A299 R305 S306 H359 I367 L369	V269-A301 HydrophobicContact CG2-CB 3.93Å; A299-A301 PolarHBondContact O-N 2.81Å; A301-R305 PolarHBondContact N-O 2.81Å; A301-S306 PolarHBondContact N-OG 2.84Å; A301-H359 HydrophobicContact CB-CB 4.06Å; A301-I367 HydrophobicContact CB-CB 4.31Å; A301-I367 HydrophobicContact CB-CD1 4.18Å; A301-I367 HydrophobicContact CB-CG2 4.08Å; A301-L369 HydrophobicContact CB-CD2 3.84Å
302	R	81.3	Confident	92.9	Very high	104 Å²	104	50.6 Å²	50.6	39%	0.392	23%	0.23	S	C	.	.	B	Isolated β-bridge	trans	-139.5	130.8	173.8	-62.1	-64.2	-171.3	-149.3	9.9	109.9	A300 R304 R305 E361 I367	A300-R302 VanDerWaalsContact C-N 3.29Å; A300-R302 PolarHBondContact O-N 2.98Å; R302-R304 PolarHBondContact O-N 3.32Å; R302-R305 PolarHBondContact N-O 3.37Å; R302-R305 VanDerWaalsContact N-O 3.12Å; R302-R305 CarbonylContact O-C 3.58Å; R302-R305 WeakPolarHBondContact O-CG 3.27Å; R302-R305 PolarHBondContact O-N 3.39Å; R302-E361 IonicContact CZ-OE2 3.94Å; R302-E361 IonicContact NE-OE2 2.73Å; R302-E361 PolarHBondContact NE-OE2 2.91Å; R302-E361 IonicContact NH2-OE2 3.18Å; R302-E361 PolarHBondContact NH2-OE2 2.83Å; R302-I367 VanDerWaalsContact CZ-CD1 3.47Å
303	R	77	Confident	92.7	Very high	226 Å²	226	53.3 Å²	53.3	85%	0.853	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	26	65	169.1	-64.9	-171	-177	-178.7	2.5	115	R305	R303-R305 VanDerWaalsContact C-N 3.32Å; R303-R305 PolarHBondContact O-N 3.12Å
304	R	74.5	Confident	92.5	Very high	236 Å²	236	52 Å²	52	89%	0.891	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.2	24.9	179.4	-60.9	-176.3	179.5	-94	0.1	116.6	R302	R302-R304 PolarHBondContact O-N 3.32Å
305	R	84.5	Confident	92.1	Very high	106 Å²	106	52.1 Å²	52.1	40%	0.4	24%	0.236	S	C	.	.	B	Isolated β-bridge	trans	-141.6	157.3	175.9	57.9	174	-177.6	-87.9	6.4	112	A300 A301 R302 R303	A300-R305 CarbonylContact C-O 3.5Å; A301-R305 PolarHBondContact N-O 2.81Å; R302-R305 PolarHBondContact N-O 3.37Å; R302-R305 VanDerWaalsContact N-O 3.12Å; R302-R305 CarbonylContact O-C 3.58Å; R302-R305 WeakPolarHBondContact O-CG 3.27Å; R302-R305 PolarHBondContact O-N 3.39Å; R303-R305 VanDerWaalsContact C-N 3.32Å; R303-R305 PolarHBondContact O-N 3.12Å
306	S	93.2	Very high	91.5	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	27%	0.267	C	S	.	.			trans	-138.7	152.3	163	-68.1	0	0	0	0	108.2	A299 A300 A301 P308 R329 N330	A299-S306 PolarHBondContact O-OG 3.46Å; A300-S306 WeakPolarHBondContact CA-OG 3.38Å; A301-S306 PolarHBondContact N-OG 2.84Å; S306-P308 WeakPolarHBondContact O-CD 3.45Å; S306-R329 CarbonylContact O-C 3.55Å; S306-R329 VanDerWaalsContact O-CA 3.22Å; S306-R329 WeakPolarHBondContact O-CA 3.23Å; S306-R329 PolarHBondContact O-N 2.79Å; S306-N330 PolarHBondContact O-N 3.24Å
307	D	95.7	Very high	90.7	Very high	35 Å²	35	54.5 Å²	54.5	19%	0.187	26%	0.258	C	S	.	.			trans	-108.4	74.5	168.4	-60.7	-28.2	0	0	0	108.4	V326 K327 K328 R329 H359 R360	D307-V326 HydrophobicContact CB-CG1 4.06Å; D307-K327 CarbonylContact C-O 3.59Å; D307-K327 WeakPolarHBondContact CA-O 3.3Å; D307-K328 WeakPolarHBondContact OD1-CA 3.32Å; D307-R329 PolarHBondContact OD1-N 3.1Å; D307-H359 PolarHBondContact N-ND1 3.03Å; D307-H359 WeakPolarHBondContact O-CA 3.31Å; D307-H359 IonicContact OD2-CE1 3.26Å; D307-R360 PolarHBondContact O-N 3.08Å
308	P	97.5	Very high	89.3	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	148	-171.6	28.8	-39.6	0	0	0	115	L298 S306 V326 K327 N330 P333 F335 V357 W358 L369	L298-P308 HydrophobicContact CD1-CB 3.64Å; L298-P308 HydrophobicContact CD1-CG 3.89Å; S306-P308 WeakPolarHBondContact O-CD 3.45Å; P308-V326 WeakPolarHBondContact O-CA 3.22Å; P308-K327 WeakPolarHBondContact CD-O 3.1Å; P308-K327 PolarHBondContact O-N 2.93Å; P308-N330 WeakPolarHBondContact CD-O 3.35Å; P308-N330 VanDerWaalsContact CG-O 3.25Å; P308-N330 WeakPolarHBondContact CG-O 3.43Å; P308-P333 HydrophobicContact CB-CG 4.16Å; P308-P333 HydrophobicContact CG-CB 3.77Å; P308-P333 HydrophobicContact CG-CG 3.61Å; P308-F335 HydrophobicContact CB-CZ 4.39Å; P308-V357 HydrophobicContact CB-CG1 4.26Å; P308-W358 CarbonylContact C-O 3.36Å; P308-W358 VanDerWaalsContact CA-O 3.27Å; P308-W358 WeakPolarHBondContact CA-O 3.22Å; P308-L369 HydrophobicContact CB-CD1 4.25Å
309	Y	98.3	Very high	88.3	Confident	21 Å²	21	68.9 Å²	68.9	8%	0.082	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	157.2	159.5	69.5	-77	0	0	0	109.6	K311 K323 S325 V326 W358 R360 N366	Y309-K311 HydrophobicContact CD2-CG 4.33Å; Y309-K311 HydrophobicContact CE2-CD 4.44Å; Y309-K311 HydrophobicContact CE2-CG 3.75Å; Y309-K311 WeakPolarHBondContact OH-CE 3.22Å; Y309-K323 HydrophobicContact CD2-CB 4.39Å; Y309-S325 WeakPolarHBondContact CB-O 3.45Å; Y309-V326 HydrophobicContact CD1-CG2 4.13Å; Y309-V326 HydrophobicContact CG-CG2 4.14Å; Y309-W358 HydrophobicContact CD1-CB 4Å; Y309-W358 WeakPolarHBondContact CD1-O 3.33Å; Y309-W358 HydrophobicContact CE1-CB 3.47Å; Y309-W358 VanDerWaalsContact CE1-CB 3.47Å; Y309-W358 HydrophobicContact CE1-CG 4.47Å; Y309-W358 HydrophobicContact CE2-CB 4.27Å; Y309-W358 PolarHBondContact N-O 2.78Å; Y309-W358 PolarHBondContact O-N 2.87Å; Y309-R360 HydrophobicContact CD1-CB 3.98Å; Y309-R360 HydrophobicContact CE1-CB 3.93Å; Y309-N366 PolarHBondContact OH-ND2 2.91Å
310	V	98.4	Very high	88	Confident	0 Å²	0	69 Å²	69	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	136.9	176.7	-170.7	0	0	0	0	109.2	V292 K323 T324 F335 L355 S356 V357	V292-V310 HydrophobicContact CG1-CB 4.15Å; V292-V310 HydrophobicContact CG1-CG1 4.47Å; V292-V310 HydrophobicContact CG1-CG2 3.8Å; V310-K323 CarbonylContact O-C 3.52Å; V310-K323 VanDerWaalsContact O-CA 3.22Å; V310-K323 WeakPolarHBondContact O-CA 3.32Å; V310-T324 HydrophobicContact CB-CG2 4.02Å; V310-T324 PolarHBondContact N-OG1 3.13Å; V310-T324 PolarHBondContact O-N 2.95Å; V310-F335 HydrophobicContact CG2-CD2 4.18Å; V310-F335 HydrophobicContact CG2-CE2 3.67Å; V310-F335 HydrophobicContact CG2-CZ 3.94Å; V310-L355 HydrophobicContact CG1-CD2 3.88Å; V310-S356 CarbonylContact C-O 3.54Å; V310-S356 WeakPolarHBondContact CA-O 3.45Å; V310-V357 HydrophobicContact CG2-CG2 4.21Å
311	K	97.5	Very high	88.1	Confident	35 Å²	35	72.6 Å²	72.6	15%	0.152	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	143.6	164.1	-58.8	178.5	-164.2	163	0	108.8	Y309 Y313 R322 L355 S356 W358	Y309-K311 HydrophobicContact CD2-CG 4.33Å; Y309-K311 HydrophobicContact CE2-CD 4.44Å; Y309-K311 HydrophobicContact CE2-CG 3.75Å; Y309-K311 WeakPolarHBondContact OH-CE 3.22Å; K311-Y313 HydrophobicContact CB-CD2 4.45Å; K311-Y313 HydrophobicContact CB-CE2 3.96Å; K311-Y313 HydrophobicContact CD-CE2 4.04Å; K311-R322 CarbonylContact C-O 3.48Å; K311-R322 WeakPolarHBondContact CA-O 3.29Å; K311-L355 WeakPolarHBondContact O-CA 3.28Å; K311-S356 PolarHBondContact N-O 3.37Å; K311-S356 PolarHBondContact O-N 2.79Å; K311-W358 HydrophobicContact CD-CG 4.45Å
312	S	97.5	Very high	88.6	Confident	0 Å²	0	77 Å²	77	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	137.2	170	-177.3	0	0	0	0	109.6	R322 H341 L353 S354	S312-R322 PolarHBondContact N-O 2.85Å; S312-R322 PolarHBondContact O-N 2.93Å; S312-H341 PolarHBondContact OG-NE2 2.71Å; S312-L353 VanDerWaalsContact OG-CD1 3.24Å; S312-L353 WeakPolarHBondContact OG-CD1 3.26Å; S312-S354 WeakPolarHBondContact CA-O 3.44Å
313	Y	95.5	Very high	89.4	Confident	58 Å²	58	79.2 Å²	79.2	23%	0.227	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	143.5	169.7	-65.1	-101.7	0	0	0	108.4	K311 K321 S354	K311-Y313 HydrophobicContact CB-CD2 4.45Å; K311-Y313 HydrophobicContact CB-CE2 3.96Å; K311-Y313 HydrophobicContact CD-CE2 4.04Å; Y313-K321 HydrophobicContact CD1-CB 4.17Å; Y313-K321 HydrophobicContact CE1-CB 3.7Å; Y313-K321 HydrophobicContact CE1-CD 4.37Å; Y313-K321 HydrophobicContact CE1-CG 3.92Å; Y313-S354 PolarHBondContact N-O 2.77Å; Y313-S354 PolarHBondContact O-N 3.38Å
314	L	93.4	Very high	90.4	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	111.1	163.8	-169.8	65.1	0	0	0	107.2	L288 D317 S320 H341 V343 R351 L376	L288-L314 HydrophobicContact CD2-CD1 3.97Å; L314-D317 WeakPolarHBondContact O-CB 3.42Å; L314-D317 PolarHBondContact O-N 3.37Å; L314-S320 PolarHBondContact N-OG 3.2Å; L314-S320 WeakPolarHBondContact O-CB 3.33Å; L314-S320 PolarHBondContact O-OG 3.26Å; L314-H341 HydrophobicContact CD2-CB 4.24Å; L314-V343 HydrophobicContact CD2-CB 3.76Å; L314-V343 HydrophobicContact CD2-CG1 3.91Å; L314-V343 HydrophobicContact CD2-CG2 3.96Å; L314-R351 HydrophobicContact CD1-CB 3.61Å; L314-R351 HydrophobicContact CD1-CG 4.2Å; L314-R351 HydrophobicContact CD2-CG 4.31Å; L314-R351 HydrophobicContact CG-CB 4.03Å; L314-R351 HydrophobicContact CG-CG 4.2Å; L314-L376 HydrophobicContact CD1-CD1 3.73Å
315	L	89.5	Confident	91.5	Very high	58 Å²	58	60.2 Å²	60.2	30%	0.304	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	146.1	179.4	-55.4	-179.1	0	0	0	109.6	R351 V352	L315-R351 WeakPolarHBondContact O-CA 3.37Å; L315-V352 HydrophobicContact CB-CB 4.27Å; L315-V352 WeakPolarHBondContact CB-O 3.44Å; L315-V352 HydrophobicContact CD1-CB 4.45Å; L315-V352 PolarHBondContact N-O 2.7Å; L315-V352 PolarHBondContact O-N 2.61Å
316	P	85.1	Confident	92.2	Very high	98 Å²	98	57.6 Å²	57.6	64%	0.636	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	cis	-87.8	11	6.3	36.1	-36.8	0	0	0	115.4	K318	P316-K318 PolarHBondContact O-N 3.12Å
317	D	80.5	Confident	92.4	Very high	57 Å²	57	60.1 Å²	60.1	31%	0.305	29%	0.289	S	S	.	.			trans	-64.9	119.4	-169.7	-58.3	-20.2	0	0	0	113	L314 Q319 S320 R351	L314-D317 WeakPolarHBondContact O-CB 3.42Å; L314-D317 PolarHBondContact O-N 3.37Å; D317-Q319 PolarHBondContact O-N 3.06Å; D317-Q319 VanDerWaalsContact O-N 3.1Å; D317-S320 PolarHBondContact O-N 2.77Å; D317-S320 PolarHBondContact O-OG 3.36Å; D317-R351 IonicContact OD1-CZ 3.22Å; D317-R351 IonicContact OD1-NH1 2.7Å; D317-R351 PolarHBondContact OD1-NH1 2.77Å; D317-R351 IonicContact OD1-NH2 3.84Å; D317-R351 IonicContact OD2-CZ 3.53Å; D317-R351 IonicContact OD2-NH1 3.64Å; D317-R351 PolarHBondContact OD2-NH1 2.84Å; D317-R351 IonicContact OD2-NH2 2.84Å
318	K	67.5	Low	92.3	Very high	194 Å²	194	66.4 Å²	66.4	84%	0.843	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-18.3	-177.7	-61.1	-179.8	-178.1	177.6	0	114.1	P316	P316-K318 PolarHBondContact O-N 3.12Å
319	Q	76.4	Confident	92.1	Very high	154 Å²	154	75.9 Å²	75.9	72%	0.72	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.6	12.9	-174.4	-61.3	-64.3	1.2	0	0	114.9	D317 K321	D317-Q319 PolarHBondContact O-N 3.06Å; D317-Q319 VanDerWaalsContact O-N 3.1Å; Q319-K321 PolarHBondContact O-N 2.91Å
320	S	85.2	Confident	91.9	Very high	10 Å²	10	77.7 Å²	77.7	7%	0.07	36%	0.361	C	S	.	.			trans	-71.8	10.9	176.1	57.7	0	0	0	0	114.8	L314 D317 R322 H341	L314-S320 PolarHBondContact N-OG 3.2Å; L314-S320 WeakPolarHBondContact O-CB 3.33Å; L314-S320 PolarHBondContact O-OG 3.26Å; D317-S320 PolarHBondContact O-N 2.77Å; D317-S320 PolarHBondContact O-OG 3.36Å; S320-R322 PolarHBondContact O-N 2.97Å; S320-H341 PolarHBondContact O-CE1 2.84Å; S320-H341 PolarHBondContact O-ND1 2.76Å; S320-H341 VanDerWaalsContact O-ND1 3.15Å
321	K	94.8	Very high	91.8	Very high	121 Å²	121	80 Å²	80	53%	0.526	37%	0.374	S	S	.	.			trans	-59.4	118.5	-174.8	-175.5	177.5	69.3	-153.7	0	111.8	Y313 Q319	Y313-K321 HydrophobicContact CD1-CB 4.17Å; Y313-K321 HydrophobicContact CE1-CB 3.7Å; Y313-K321 HydrophobicContact CE1-CD 4.37Å; Y313-K321 HydrophobicContact CE1-CG 3.92Å; Q319-K321 PolarHBondContact O-N 2.91Å
322	R	97.3	Very high	91.8	Very high	104 Å²	104	82.2 Å²	82.2	39%	0.392	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	160.1	168.2	-57.4	-63	178	-102.8	4.3	110.1	K311 S312 S320 L339 R340	K311-R322 CarbonylContact C-O 3.48Å; K311-R322 WeakPolarHBondContact CA-O 3.29Å; S312-R322 PolarHBondContact N-O 2.85Å; S312-R322 PolarHBondContact O-N 2.93Å; S320-R322 PolarHBondContact O-N 2.97Å; R322-L339 HydrophobicContact CB-CB 3.97Å; R322-L339 HydrophobicContact CB-CD1 4.19Å; R322-L339 HydrophobicContact CB-CD2 4.4Å; R322-L339 HydrophobicContact CB-CG 4.41Å; R322-R340 PolarHBondContact NE-O 3.01Å
323	K	97.7	Very high	91.8	Very high	151 Å²	151	82.2 Å²	82.2	66%	0.657	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-152	149.7	-179.7	71.5	-169.1	-179.1	-164.9	0	112.6	Y309 V310 L339	Y309-K323 HydrophobicContact CD2-CB 4.39Å; V310-K323 CarbonylContact O-C 3.52Å; V310-K323 VanDerWaalsContact O-CA 3.22Å; V310-K323 WeakPolarHBondContact O-CA 3.32Å; K323-L339 WeakPolarHBondContact O-CD2 3.28Å
324	T	98.6	Very high	91.9	Very high	7 Å²	7	84 Å²	84	4%	0.043	40%	0.4	C	S	.	.			trans	-78.8	170.6	168.6	67.3	0	0	0	0	111.9	V292 V310 F335 E337 L339	V292-T324 HydrophobicContact CB-CG2 4Å; V292-T324 HydrophobicContact CG1-CG2 4.05Å; V292-T324 HydrophobicContact CG2-CG2 4.2Å; V310-T324 HydrophobicContact CB-CG2 4.02Å; V310-T324 PolarHBondContact N-OG1 3.13Å; V310-T324 PolarHBondContact O-N 2.95Å; T324-F335 HydrophobicContact CG2-CB 4.4Å; T324-F335 HydrophobicContact CG2-CD1 4.01Å; T324-F335 HydrophobicContact CG2-CG 4.21Å; T324-F335 WeakPolarHBondContact OG1-CD1 3.29Å; T324-F335 VanDerWaalsContact OG1-CE1 3.29Å; T324-F335 WeakPolarHBondContact OG1-CE1 3.25Å; T324-E337 VanDerWaalsContact CA-OE2 3.25Å; T324-E337 WeakPolarHBondContact CA-OE2 3.49Å; T324-E337 WeakPolarHBondContact CB-OE2 3.44Å; T324-E337 HydrophobicContact CG2-CB 4.27Å; T324-L339 HydrophobicContact CG2-CD1 4.28Å; T324-L339 HydrophobicContact CG2-CD2 4.42Å
325	S	98	Very high	92.1	Very high	55 Å²	55	84.4 Å²	84.4	39%	0.385	40%	0.402	S	S	.	.			trans	-60.2	164	158.9	80.6	0	0	0	0	111.7	Y309 K327 F335 E337	Y309-S325 WeakPolarHBondContact CB-O 3.45Å; S325-K327 WeakPolarHBondContact OG-CE 3.44Å; S325-K327 PolarHBondContact OG-NZ 2.77Å; S325-F335 WeakPolarHBondContact O-CE1 3.3Å; S325-E337 WeakPolarHBondContact CB-OE1 3.36Å; S325-E337 PolarHBondContact N-OE2 2.86Å; S325-E337 PolarHBondContact OG-OE1 2.78Å
326	V	97.8	Very high	92.5	Very high	51 Å²	51	86.5 Å²	86.5	31%	0.309	41%	0.413	S	S	.	.			trans	-102.2	115.4	-177	-179.1	0	0	0	0	109.3	D307 P308 Y309 R360	D307-V326 HydrophobicContact CB-CG1 4.06Å; P308-V326 WeakPolarHBondContact O-CA 3.22Å; Y309-V326 HydrophobicContact CD1-CG2 4.13Å; Y309-V326 HydrophobicContact CG-CG2 4.14Å; V326-R360 HydrophobicContact CG1-CB 3.84Å; V326-R360 HydrophobicContact CG2-CB 4.21Å
327	K	97.4	Very high	93.2	Very high	53 Å²	53	83.9 Å²	83.9	23%	0.23	39%	0.392	C	S	.	.			trans	-88.7	115.8	176.4	-48.2	-66.5	165.2	159.9	0	108	D307 P308 S325 P333 I334 F335 E337	D307-K327 CarbonylContact C-O 3.59Å; D307-K327 WeakPolarHBondContact CA-O 3.3Å; P308-K327 WeakPolarHBondContact CD-O 3.1Å; P308-K327 PolarHBondContact O-N 2.93Å; S325-K327 WeakPolarHBondContact OG-CE 3.44Å; S325-K327 PolarHBondContact OG-NZ 2.77Å; K327-P333 HydrophobicContact CB-CB 3.91Å; K327-P333 HydrophobicContact CG-CB 3.86Å; K327-I334 WeakPolarHBondContact CD-O 3.33Å; K327-I334 WeakPolarHBondContact CE-O 3.33Å; K327-I334 PolarHBondContact NZ-O 2.97Å; K327-I334 VanDerWaalsContact NZ-O 3.13Å; K327-F335 HydrophobicContact CD-CD1 4.33Å; K327-F335 HydrophobicContact CD-CE1 4.49Å; K327-F335 HydrophobicContact CG-CD1 3.87Å; K327-F335 HydrophobicContact CG-CE1 3.6Å; K327-F335 HydrophobicContact CG-CZ 4.24Å; K327-F335 PolarHBondContact NZ-O 3.02Å; K327-F335 VanDerWaalsContact NZ-O 3.16Å; K327-E337 VanDerWaalsContact CE-OE1 3.25Å; K327-E337 WeakPolarHBondContact CE-OE1 3.37Å; K327-E337 IonicContact NZ-OE1 2.68Å; K327-E337 PolarHBondContact NZ-OE1 2.98Å
328	K	94.9	Very high	94	Very high	168 Å²	168	84.5 Å²	84.5	73%	0.73	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	140.6	-174.8	-65.1	175.7	-177.5	172.3	0	111.9	D307 N330	D307-K328 WeakPolarHBondContact OD1-CA 3.32Å; K328-N330 VanDerWaalsContact C-N 3.31Å; K328-N330 PolarHBondContact O-N 3.2Å
329	R	93.2	Very high	95.4	Very high	199 Å²	199	76 Å²	76	75%	0.751	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	39.4	171.8	-56.4	-176.8	-179.3	176.9	1	114.5	S306 D307	S306-R329 CarbonylContact O-C 3.55Å; S306-R329 VanDerWaalsContact O-CA 3.22Å; S306-R329 WeakPolarHBondContact O-CA 3.23Å; S306-R329 PolarHBondContact O-N 2.79Å; D307-R329 PolarHBondContact OD1-N 3.1Å
330	N	94.7	Very high	96.4	Very high	58 Å²	58	74.4 Å²	74.4	31%	0.31	35%	0.349	S	S	.	.			trans	-128.7	133.8	-177	-165.7	-4.2	0	0	0	111.4	S306 P308 K328 N332 P333	S306-N330 PolarHBondContact O-N 3.24Å; P308-N330 WeakPolarHBondContact CD-O 3.35Å; P308-N330 VanDerWaalsContact CG-O 3.25Å; P308-N330 WeakPolarHBondContact CG-O 3.43Å; K328-N330 VanDerWaalsContact C-N 3.31Å; K328-N330 PolarHBondContact O-N 3.2Å; N330-N332 PolarHBondContact ND2-O 3.06Å; N330-N332 VanDerWaalsContact OD1-C 3.28Å; N330-N332 WeakPolarHBondContact OD1-CA 3.31Å; N330-N332 PolarHBondContact OD1-N 2.75Å; N330-N332 PolarHBondContact OD1-O 3.14Å; N330-P333 WeakPolarHBondContact ND2-CA 3.18Å
331	L	95.7	Very high	96.9	Very high	49 Å²	49	74.1 Å²	74.1	26%	0.257	35%	0.347	S	S	.	.	S	Bend	trans	-100.4	-8.1	174.1	-54.4	-177.7	0	0	0	112.6	G297 L298 A300 P333	G297-L331 PolarHBondContact N-O 2.93Å; L298-L331 HydrophobicContact CB-CB 4.48Å; L298-L331 WeakPolarHBondContact CB-O 3.2Å; L298-L331 WeakPolarHBondContact CG-O 3.45Å; L298-L331 PolarHBondContact N-O 2.91Å; A300-L331 HydrophobicContact CB-CD1 4.06Å; A300-L331 HydrophobicContact CB-CD2 4.08Å; L331-P333 VanDerWaalsContact C-CD 3.42Å
332	N	97	Very high	96.9	Very high	81 Å²	81	72.8 Å²	72.8	43%	0.433	35%	0.353	S	S	.	.	S	Bend	trans	-126.8	65	172.1	-49.7	-73.7	0	0	0	109.2	C295 Q296 G297 N330	C295-N332 CarbonylContact O-C 3.54Å; C295-N332 WeakPolarHBondContact O-CA 3.39Å; Q296-N332 WeakPolarHBondContact CA-OD1 3.29Å; G297-N332 PolarHBondContact N-OD1 2.87Å; N330-N332 PolarHBondContact ND2-O 3.06Å; N330-N332 VanDerWaalsContact OD1-C 3.28Å; N330-N332 WeakPolarHBondContact OD1-CA 3.31Å; N330-N332 PolarHBondContact OD1-N 2.75Å; N330-N332 PolarHBondContact OD1-O 3.14Å
333	P	97.3	Very high	96.7	Very high	0 Å²	0	68.1 Å²	68.1	0%	0	34%	0.336	C	S	.	.			trans	-69.4	129.4	-176.6	30.6	-38	0	0	0	112	Q294 C295 L298 P308 K327 N330 L331 F335	Q294-P333 CarbonylContact C-O 3.4Å; Q294-P333 WeakPolarHBondContact CA-O 3.46Å; Q294-P333 VanDerWaalsContact CB-O 3.28Å; Q294-P333 WeakPolarHBondContact CB-O 3.23Å; C295-P333 HydrophobicContact CB-CG 3.81Å; C295-P333 PolarHBondContact N-O 2.87Å; L298-P333 HydrophobicContact CD1-CG 3.68Å; P308-P333 HydrophobicContact CB-CG 4.16Å; P308-P333 HydrophobicContact CG-CB 3.77Å; P308-P333 HydrophobicContact CG-CG 3.61Å; K327-P333 HydrophobicContact CB-CB 3.91Å; K327-P333 HydrophobicContact CG-CB 3.86Å; N330-P333 WeakPolarHBondContact ND2-CA 3.18Å; L331-P333 VanDerWaalsContact C-CD 3.42Å; P333-F335 HydrophobicContact CB-CD2 4.33Å; P333-F335 HydrophobicContact CB-CE1 4.37Å; P333-F335 HydrophobicContact CB-CE2 3.65Å; P333-F335 HydrophobicContact CB-CZ 3.67Å; P333-F335 HydrophobicContact CG-CD2 4.4Å; P333-F335 HydrophobicContact CG-CE2 3.47Å; P333-F335 VanDerWaalsContact CG-CE2 3.47Å; P333-F335 HydrophobicContact CG-CZ 3.74Å
334	I	98.3	Very high	96.4	Very high	96 Å²	96	67.1 Å²	67.1	49%	0.492	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	118.9	164	-57.8	175.3	0	0	0	107.7	Q294 K327	Q294-I334 HydrophobicContact CB-CG1 4.16Å; K327-I334 WeakPolarHBondContact CD-O 3.33Å; K327-I334 WeakPolarHBondContact CE-O 3.33Å; K327-I334 PolarHBondContact NZ-O 2.97Å; K327-I334 VanDerWaalsContact NZ-O 3.13Å
335	F	98.2	Very high	96.1	Very high	9 Å²	9	72.4 Å²	72.4	4%	0.039	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	-64.3	176.8	-65.1	-76.9	0	0	0	110.4	V292 I293 P308 V310 T324 S325 K327 P333 E337	V292-F335 HydrophobicContact CG1-CB 4.1Å; V292-F335 HydrophobicContact CG1-CD2 3.84Å; V292-F335 HydrophobicContact CG1-CG 4.13Å; V292-F335 WeakPolarHBondContact O-CB 3.27Å; I293-F335 WeakPolarHBondContact O-CA 3.19Å; I293-F335 PolarHBondContact O-N 2.84Å; P308-F335 HydrophobicContact CB-CZ 4.39Å; V310-F335 HydrophobicContact CG2-CD2 4.18Å; V310-F335 HydrophobicContact CG2-CE2 3.67Å; V310-F335 HydrophobicContact CG2-CZ 3.94Å; T324-F335 HydrophobicContact CG2-CB 4.4Å; T324-F335 HydrophobicContact CG2-CD1 4.01Å; T324-F335 HydrophobicContact CG2-CG 4.21Å; T324-F335 WeakPolarHBondContact OG1-CD1 3.29Å; T324-F335 VanDerWaalsContact OG1-CE1 3.29Å; T324-F335 WeakPolarHBondContact OG1-CE1 3.25Å; S325-F335 WeakPolarHBondContact O-CE1 3.3Å; K327-F335 HydrophobicContact CD-CD1 4.33Å; K327-F335 HydrophobicContact CD-CE1 4.49Å; K327-F335 HydrophobicContact CG-CD1 3.87Å; K327-F335 HydrophobicContact CG-CE1 3.6Å; K327-F335 HydrophobicContact CG-CZ 4.24Å; K327-F335 PolarHBondContact NZ-O 3.02Å; K327-F335 VanDerWaalsContact NZ-O 3.16Å; P333-F335 HydrophobicContact CB-CD2 4.33Å; P333-F335 HydrophobicContact CB-CE1 4.37Å; P333-F335 HydrophobicContact CB-CE2 3.65Å; P333-F335 HydrophobicContact CB-CZ 3.67Å; P333-F335 HydrophobicContact CG-CD2 4.4Å; P333-F335 HydrophobicContact CG-CE2 3.47Å; P333-F335 VanDerWaalsContact CG-CE2 3.47Å; P333-F335 HydrophobicContact CG-CZ 3.74Å; F335-E337 HydrophobicContact CB-CB 4.46Å; F335-E337 HydrophobicContact CB-CG 4.48Å
336	N	97.7	Very high	95.9	Very high	102 Å²	102	73.9 Å²	73.9	55%	0.545	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	53.4	50.8	-168.8	-65.9	-10.7	0	0	0	112.1	V292 I293	V292-N336 WeakPolarHBondContact O-CA 3.24Å; V292-N336 PolarHBondContact O-N 2.97Å; I293-N336 WeakPolarHBondContact CG2-OD1 3.37Å; I293-N336 PolarHBondContact O-N 2.9Å; I293-N336 PolarHBondContact O-OD1 2.9Å
337	E	98.4	Very high	95.5	Very high	43 Å²	43	74.8 Å²	74.8	20%	0.201	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	127.3	-173.5	-70.4	169.8	-127.2	0	0	111	V292 T324 S325 K327 F335	V292-E337 PolarHBondContact N-O 3.06Å; V292-E337 PolarHBondContact O-N 2.88Å; T324-E337 VanDerWaalsContact CA-OE2 3.25Å; T324-E337 WeakPolarHBondContact CA-OE2 3.49Å; T324-E337 WeakPolarHBondContact CB-OE2 3.44Å; T324-E337 HydrophobicContact CG2-CB 4.27Å; S325-E337 WeakPolarHBondContact CB-OE1 3.36Å; S325-E337 PolarHBondContact N-OE2 2.86Å; S325-E337 PolarHBondContact OG-OE1 2.78Å; K327-E337 VanDerWaalsContact CE-OE1 3.25Å; K327-E337 WeakPolarHBondContact CE-OE1 3.37Å; K327-E337 IonicContact NZ-OE1 2.68Å; K327-E337 PolarHBondContact NZ-OE1 2.98Å; F335-E337 HydrophobicContact CB-CB 4.46Å; F335-E337 HydrophobicContact CB-CG 4.48Å
338	T	98	Very high	95.1	Very high	70 Å²	70	72.7 Å²	72.7	43%	0.429	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	113.3	-179.3	-54.5	0	0	0	0	111	R289	R289-T338 HydrophobicContact CB-CG2 3.8Å; R289-T338 HydrophobicContact CG-CG2 4.32Å
339	L	97.7	Very high	94.9	Very high	15 Å²	15	68.4 Å²	68.4	8%	0.079	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	138.2	174.2	-52.7	-177.5	0	0	0	109.2	V290 V292 R322 K323 T324	V290-L339 HydrophobicContact CB-CB 4.42Å; V290-L339 PolarHBondContact N-O 3.47Å; V290-L339 PolarHBondContact O-N 3.19Å; V292-L339 HydrophobicContact CG2-CD1 4.04Å; V292-L339 HydrophobicContact CG2-CG 4.34Å; R322-L339 HydrophobicContact CB-CB 3.97Å; R322-L339 HydrophobicContact CB-CD1 4.19Å; R322-L339 HydrophobicContact CB-CD2 4.4Å; R322-L339 HydrophobicContact CB-CG 4.41Å; K323-L339 WeakPolarHBondContact O-CD2 3.28Å; T324-L339 HydrophobicContact CG2-CD1 4.28Å; T324-L339 HydrophobicContact CG2-CD2 4.42Å
340	R	97.2	Very high	94.4	Very high	120 Å²	120	62 Å²	62	45%	0.453	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	129	-173.7	-55.1	-174.2	176.1	-157	4.1	112	E287 R289 R322	E287-R340 VanDerWaalsContact CD-NH1 3.28Å; E287-R340 VanDerWaalsContact OE1-CD 3.28Å; E287-R340 WeakPolarHBondContact OE1-CD 3.48Å; E287-R340 IonicContact OE1-CZ 3.25Å; E287-R340 IonicContact OE1-NE 3.36Å; E287-R340 IonicContact OE1-NH1 3.42Å; E287-R340 PolarHBondContact OE1-NH1 2.94Å; E287-R340 WeakPolarHBondContact OE2-CD 3.23Å; E287-R340 IonicContact OE2-CZ 2.67Å; E287-R340 IonicContact OE2-NE 3.69Å; E287-R340 IonicContact OE2-NH1 2.78Å; E287-R340 PolarHBondContact OE2-NH1 3.37Å; R289-R340 HydrophobicContact CG-CG 4.42Å; R322-R340 PolarHBondContact NE-O 3.01Å
341	H	95.5	Very high	94.1	Very high	4 Å²	4	60.8 Å²	60.8	2%	0.019	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	136	171.2	-55.7	-70.4	0	0	0	109	E287 L288 S312 L314 S320	E287-H341 CarbonylContact C-O 3.55Å; E287-H341 WeakPolarHBondContact CA-O 3.41Å; L288-H341 HydrophobicContact CB-CB 4.41Å; L288-H341 PolarHBondContact N-O 2.82Å; L288-H341 PolarHBondContact O-N 2.97Å; S312-H341 PolarHBondContact OG-NE2 2.71Å; L314-H341 HydrophobicContact CD2-CB 4.24Å; S320-H341 PolarHBondContact O-CE1 2.84Å; S320-H341 PolarHBondContact O-ND1 2.76Å; S320-H341 VanDerWaalsContact O-ND1 3.15Å
342	S	94.2	Very high	93.9	Very high	93 Å²	93	60.6 Å²	60.6	65%	0.65	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.3	125.8	170.3	-174.6	0	0	0	0	108.9	S286	S286-S342 WeakPolarHBondContact O-CA 3.18Å; S286-S342 PolarHBondContact O-OG 3.46Å
343	V	92.6	Very high	93.8	Very high	7 Å²	7	56.7 Å²	56.7	4%	0.042	32%	0.324	C	S	.	.			trans	-161.5	141.3	-176	56.2	0	0	0	0	108.4	Y281 S286 L288 L314 D347 L348 R351	Y281-V343 HydrophobicContact CE2-CG1 4.5Å; Y281-V343 WeakPolarHBondContact CE2-O 3.47Å; Y281-V343 PolarHBondContact OH-O 3.06Å; S286-V343 CarbonylContact C-O 3.44Å; S286-V343 PolarHBondContact O-N 2.86Å; S286-V343 VanDerWaalsContact O-O 3.07Å; L288-V343 HydrophobicContact CB-CG1 3.74Å; L314-V343 HydrophobicContact CD2-CB 3.76Å; L314-V343 HydrophobicContact CD2-CG1 3.91Å; L314-V343 HydrophobicContact CD2-CG2 3.96Å; V343-D347 HydrophobicContact CG2-CB 3.65Å; V343-L348 HydrophobicContact CG1-CD2 3.69Å; V343-L348 HydrophobicContact CG2-CD2 4.18Å; V343-R351 HydrophobicContact CG2-CG 4.4Å
344	Q	92.7	Very high	93.7	Very high	129 Å²	129	56.9 Å²	56.9	60%	0.603	33%	0.325	S	S	*	.			trans	-77.4	151.6	177	-62.1	-168.3	20	0	0	111.3	A346 D347	Q344-A346 PolarHBondContact O-N 2.8Å; Q344-D347 WeakPolarHBondContact O-CB 3.01Å; Q344-D347 PolarHBondContact O-N 2.88Å
345	Q	92.3	Very high	93.6	Very high	118 Å²	118	52.3 Å²	52.3	55%	0.551	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-34.1	-177.7	-161.6	170.5	-9.3	0	0	112.8	Y281 D347 L348	Y281-Q345 HydrophobicContact CD1-CB 4.44Å; Y281-Q345 HydrophobicContact CD1-CG 4.03Å; Y281-Q345 HydrophobicContact CE1-CB 3.55Å; Y281-Q345 HydrophobicContact CE1-CG 3.6Å; Y281-Q345 PolarHBondContact OH-N 2.53Å; Q345-D347 VanDerWaalsContact C-N 3.29Å; Q345-D347 PolarHBondContact O-N 3.12Å; Q345-L348 HydrophobicContact CG-CD1 4.13Å; Q345-L348 PolarHBondContact O-N 3.34Å
346	A	92.7	Very high	93.5	Very high	87 Å²	87	51.9 Å²	51.9	72%	0.719	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-26.7	176.9	0	0	0	0	0	113.4	Q344	Q344-A346 PolarHBondContact O-N 2.8Å
347	D	89.8	Confident	93.5	Very high	69 Å²	69	47.1 Å²	47.1	37%	0.369	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-27.9	178.8	-82.3	17.3	0	0	0	112.5	V343 Q344 Q345 P349 G350 R351	V343-D347 HydrophobicContact CG2-CB 3.65Å; Q344-D347 WeakPolarHBondContact O-CB 3.01Å; Q344-D347 PolarHBondContact O-N 2.88Å; Q345-D347 VanDerWaalsContact C-N 3.29Å; Q345-D347 PolarHBondContact O-N 3.12Å; D347-P349 VanDerWaalsContact C-CD 3.46Å; D347-G350 PolarHBondContact O-N 3.11Å; D347-R351 WeakPolarHBondContact O-CG 3.36Å; D347-R351 IonicContact OD2-CZ 2.77Å; D347-R351 IonicContact OD2-NE 3.83Å; D347-R351 IonicContact OD2-NH2 3.58Å; D347-R351 PolarHBondContact OD2-NH2 3.04Å
348	L	89.8	Confident	93.4	Very high	10 Å²	10	46.8 Å²	46.8	5%	0.052	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-50	-46.4	-168.5	-68.3	172	0	0	0	113.8	Y281 L288 V343 Q345 G350 R351 L376 W381	Y281-L348 HydrophobicContact CD1-CD1 4.37Å; Y281-L348 HydrophobicContact CD2-CD1 3.81Å; Y281-L348 HydrophobicContact CD2-CD2 4.41Å; Y281-L348 HydrophobicContact CE2-CD1 4.16Å; Y281-L348 HydrophobicContact CG-CD1 3.92Å; L288-L348 HydrophobicContact CD2-CD2 4.49Å; V343-L348 HydrophobicContact CG1-CD2 3.69Å; V343-L348 HydrophobicContact CG2-CD2 4.18Å; Q345-L348 HydrophobicContact CG-CD1 4.13Å; Q345-L348 PolarHBondContact O-N 3.34Å; L348-G350 PolarHBondContact O-N 2.7Å; L348-G350 VanDerWaalsContact O-N 3.13Å; L348-R351 PolarHBondContact O-N 3.01Å; L348-L376 HydrophobicContact CD2-CD1 4.15Å; L348-L376 WeakPolarHBondContact O-CB 3.05Å; L348-W381 HydrophobicContact CD1-CH2 4.01Å; L348-W381 HydrophobicContact CD1-CZ2 4.12Å; L348-W381 HydrophobicContact CD2-CH2 4.34Å
349	P	89.1	Confident	93.3	Very high	78 Å²	78	43.7 Å²	43.7	51%	0.506	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-62.2	-22.3	-179.7	-22.3	35.2	0	0	0	114	D347 R351 D377	D347-P349 VanDerWaalsContact C-CD 3.46Å; P349-R351 VanDerWaalsContact C-N 3.34Å; P349-D377 HydrophobicContact CB-CB 3.99Å
350	G	83.6	Confident	93.1	Very high	64 Å²	64	49.2 Å²	49.2	66%	0.66	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-86.7	3.9	176.2	0	0	0	0	0	114.6	D347 L348	D347-G350 PolarHBondContact O-N 3.11Å; L348-G350 PolarHBondContact O-N 2.7Å; L348-G350 VanDerWaalsContact O-N 3.13Å
351	R	87.6	Confident	92.7	Very high	32 Å²	32	44.8 Å²	44.8	12%	0.121	26%	0.256	C	S	.	.			trans	-114.3	149	-173.8	-46.2	-43.6	-162.9	86.4	0.8	112.9	L314 L315 D317 V343 D347 L348 P349 L376	L314-R351 HydrophobicContact CD1-CB 3.61Å; L314-R351 HydrophobicContact CD1-CG 4.2Å; L314-R351 HydrophobicContact CD2-CG 4.31Å; L314-R351 HydrophobicContact CG-CB 4.03Å; L314-R351 HydrophobicContact CG-CG 4.2Å; L315-R351 WeakPolarHBondContact O-CA 3.37Å; D317-R351 IonicContact OD1-CZ 3.22Å; D317-R351 IonicContact OD1-NH1 2.7Å; D317-R351 PolarHBondContact OD1-NH1 2.77Å; D317-R351 IonicContact OD1-NH2 3.84Å; D317-R351 IonicContact OD2-CZ 3.53Å; D317-R351 IonicContact OD2-NH1 3.64Å; D317-R351 PolarHBondContact OD2-NH1 2.84Å; D317-R351 IonicContact OD2-NH2 2.84Å; V343-R351 HydrophobicContact CG2-CG 4.4Å; D347-R351 WeakPolarHBondContact O-CG 3.36Å; D347-R351 IonicContact OD2-CZ 2.77Å; D347-R351 IonicContact OD2-NE 3.83Å; D347-R351 IonicContact OD2-NH2 3.58Å; D347-R351 PolarHBondContact OD2-NH2 3.04Å; L348-R351 PolarHBondContact O-N 3.01Å; P349-R351 VanDerWaalsContact C-N 3.34Å; R351-L376 HydrophobicContact CB-CD1 4.26Å; R351-L376 PolarHBondContact O-N 2.83Å
352	V	91.7	Very high	92.2	Very high	45 Å²	45	49 Å²	49	27%	0.273	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	125.4	170.3	-179.3	0	0	0	0	109	L315 E373 V374 P375	L315-V352 HydrophobicContact CB-CB 4.27Å; L315-V352 WeakPolarHBondContact CB-O 3.44Å; L315-V352 HydrophobicContact CD1-CB 4.45Å; L315-V352 PolarHBondContact N-O 2.7Å; L315-V352 PolarHBondContact O-N 2.61Å; V352-E373 HydrophobicContact CG1-CB 3.92Å; V352-V374 WeakPolarHBondContact CA-O 3.3Å; V352-P375 HydrophobicContact CG2-CB 4.47Å; V352-P375 HydrophobicContact CG2-CG 4.5Å
353	L	95.2	Very high	91.6	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	119	171.2	170.3	66.9	0	0	0	109.5	F277 L279 V290 S312 L355 E373 V374 L376	F277-L353 HydrophobicContact CE2-CD2 4.5Å; L279-L353 HydrophobicContact CD1-CD2 3.81Å; L279-L353 HydrophobicContact CD2-CD2 3.33Å; L279-L353 HydrophobicContact CG-CD2 4.22Å; V290-L353 HydrophobicContact CG1-CD1 4.5Å; V290-L353 HydrophobicContact CG1-CD2 4.08Å; V290-L353 HydrophobicContact CG2-CD1 3.96Å; V290-L353 HydrophobicContact CG2-CD2 4.1Å; S312-L353 VanDerWaalsContact OG-CD1 3.24Å; S312-L353 WeakPolarHBondContact OG-CD1 3.26Å; L353-L355 HydrophobicContact CD1-CG 4.33Å; L353-L355 HydrophobicContact CD2-CD1 4.13Å; L353-L355 HydrophobicContact CD2-CG 4.39Å; L353-L355 HydrophobicContact CG-CD1 4.47Å; L353-L355 HydrophobicContact CG-CG 4.22Å; L353-E373 CarbonylContact O-C 3.35Å; L353-E373 WeakPolarHBondContact O-CA 3.46Å; L353-V374 HydrophobicContact CB-CB 4.34Å; L353-V374 PolarHBondContact N-O 3.24Å; L353-V374 PolarHBondContact O-N 3.02Å; L353-L376 HydrophobicContact CB-CD2 3.97Å; L353-L376 HydrophobicContact CB-CG 4.4Å
354	S	94.9	Very high	90.8	Very high	3 Å²	3	54.9 Å²	54.9	2%	0.021	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	116.9	175.7	-173	0	0	0	0	110.2	S312 Y313 E373	S312-S354 WeakPolarHBondContact CA-O 3.44Å; Y313-S354 PolarHBondContact N-O 2.77Å; Y313-S354 PolarHBondContact O-N 3.38Å; S354-E373 WeakPolarHBondContact CB-OE1 3.47Å; S354-E373 PolarHBondContact OG-OE1 3.32Å
355	L	97.2	Very high	90.2	Very high	1 Å²	1	60 Å²	60	1%	0.005	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	106.5	179.5	-81.1	172.2	0	0	0	110.3	F277 V290 V292 V310 K311 L353 E371 V372	F277-L355 HydrophobicContact CB-CD1 4.41Å; F277-L355 HydrophobicContact CD1-CD1 3.9Å; F277-L355 HydrophobicContact CD2-CD1 3.92Å; F277-L355 HydrophobicContact CE1-CD1 4.16Å; F277-L355 HydrophobicContact CE2-CD1 4.18Å; F277-L355 HydrophobicContact CG-CD1 3.79Å; F277-L355 HydrophobicContact CZ-CD1 4.3Å; V290-L355 HydrophobicContact CG1-CD1 4.06Å; V290-L355 HydrophobicContact CG1-CD2 4.06Å; V290-L355 HydrophobicContact CG1-CG 4.49Å; V292-L355 HydrophobicContact CG2-CD2 4.3Å; V310-L355 HydrophobicContact CG1-CD2 3.88Å; K311-L355 WeakPolarHBondContact O-CA 3.28Å; L353-L355 HydrophobicContact CD1-CG 4.33Å; L353-L355 HydrophobicContact CD2-CD1 4.13Å; L353-L355 HydrophobicContact CD2-CG 4.39Å; L353-L355 HydrophobicContact CG-CD1 4.47Å; L353-L355 HydrophobicContact CG-CG 4.22Å; L355-E371 CarbonylContact O-C 3.46Å; L355-E371 WeakPolarHBondContact O-CA 3.38Å; L355-E371 VanDerWaalsContact O-CB 3.29Å; L355-E371 WeakPolarHBondContact O-CB 3.42Å; L355-V372 HydrophobicContact CB-CG2 3.88Å; L355-V372 PolarHBondContact N-O 3.42Å; L355-V372 PolarHBondContact O-N 2.96Å
356	S	96.2	Very high	90	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	133.9	-176.2	54	0	0	0	0	112.7	V310 K311 W358 E371	V310-S356 CarbonylContact C-O 3.54Å; V310-S356 WeakPolarHBondContact CA-O 3.45Å; K311-S356 PolarHBondContact N-O 3.37Å; K311-S356 PolarHBondContact O-N 2.79Å; S356-W358 PolarHBondContact OG-NE1 2.83Å; S356-E371 WeakPolarHBondContact CB-OE2 3.39Å
357	V	97.8	Very high	89.9	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.006	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	135.4	-178.7	-166.5	0	0	0	0	109.7	L298 P308 V310 L369 G370 L390	L298-V357 HydrophobicContact CD1-CG1 4Å; L298-V357 HydrophobicContact CD2-CG1 4.13Å; P308-V357 HydrophobicContact CB-CG1 4.26Å; V310-V357 HydrophobicContact CG2-CG2 4.21Å; V357-L369 HydrophobicContact CB-CB 4.25Å; V357-L369 HydrophobicContact CG1-CB 4.27Å; V357-L369 HydrophobicContact CG1-CD1 4.2Å; V357-L369 WeakPolarHBondContact O-CB 3.36Å; V357-L369 PolarHBondContact O-N 2.82Å; V357-G370 PolarHBondContact N-O 3.05Å; V357-L390 HydrophobicContact CB-CD1 4.33Å; V357-L390 HydrophobicContact CG2-CD1 3.87Å; V357-L390 HydrophobicContact CG2-CD2 3.69Å; V357-L390 HydrophobicContact CG2-CG 4.47Å
358	W	96.3	Very high	90	Very high	36 Å²	36	52.7 Å²	52.7	14%	0.136	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	134.7	-172.6	-62.6	78.7	0	0	0	111	P308 Y309 K311 S356 R360 N366 I367 F368	P308-W358 CarbonylContact C-O 3.36Å; P308-W358 VanDerWaalsContact CA-O 3.27Å; P308-W358 WeakPolarHBondContact CA-O 3.22Å; Y309-W358 HydrophobicContact CD1-CB 4Å; Y309-W358 WeakPolarHBondContact CD1-O 3.33Å; Y309-W358 HydrophobicContact CE1-CB 3.47Å; Y309-W358 VanDerWaalsContact CE1-CB 3.47Å; Y309-W358 HydrophobicContact CE1-CG 4.47Å; Y309-W358 HydrophobicContact CE2-CB 4.27Å; Y309-W358 PolarHBondContact N-O 2.78Å; Y309-W358 PolarHBondContact O-N 2.87Å; K311-W358 HydrophobicContact CD-CG 4.45Å; S356-W358 PolarHBondContact OG-NE1 2.83Å; W358-R360 PolarHBondContact O-N 3.47Å; W358-N366 HydrophobicContact CE3-CB 4.1Å; W358-I367 CarbonylContact C-O 3.52Å; W358-I367 WeakPolarHBondContact CA-O 3.48Å; W358-F368 HydrophobicContact CD2-CD2 4.38Å; W358-F368 AromaticContact CE2-CD2 3.97Å; W358-F368 HydrophobicContact CE3-CB 4.19Å; W358-F368 HydrophobicContact CH2-CB 4.35Å; W358-F368 HydrophobicContact CH2-CD2 4.26Å; W358-F368 AromaticContact CZ2-CD2 3.93Å; W358-F368 HydrophobicContact CZ2-CD2 3.93Å; W358-F368 HydrophobicContact CZ3-CB 4.05Å
359	H	95.1	Very high	90.2	Very high	5 Å²	5	52.2 Å²	52.2	2%	0.023	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	121.6	161.1	172.8	21.3	0	0	0	108.5	A301 D307 E361 N366 I367 L369	A301-H359 HydrophobicContact CB-CB 4.06Å; D307-H359 PolarHBondContact N-ND1 3.03Å; D307-H359 WeakPolarHBondContact O-CA 3.31Å; D307-H359 IonicContact OD2-CE1 3.26Å; H359-E361 PolarHBondContact O-N 3.24Å; H359-E361 VanDerWaalsContact O-N 3.13Å; H359-N366 WeakPolarHBondContact O-CA 3.5Å; H359-N366 WeakPolarHBondContact O-CB 3.5Å; H359-I367 HydrophobicContact CB-CB 4.3Å; H359-I367 PolarHBondContact N-O 2.82Å; H359-I367 PolarHBondContact O-N 2.85Å; H359-L369 HydrophobicContact CB-CD1 4.12Å; H359-L369 HydrophobicContact CB-CD2 4.22Å; H359-L369 HydrophobicContact CB-CG 4.27Å
360	R	94.5	Very high	90.5	Very high	131 Å²	131	48.5 Å²	48.5	49%	0.494	26%	0.264	S	S	.	.			trans	-69	105.4	165.9	-177	176.7	177.8	-73.8	3.4	109.7	D307 Y309 V326 W358 N366	D307-R360 PolarHBondContact O-N 3.08Å; Y309-R360 HydrophobicContact CD1-CB 3.98Å; Y309-R360 HydrophobicContact CE1-CB 3.93Å; V326-R360 HydrophobicContact CG1-CB 3.84Å; V326-R360 HydrophobicContact CG2-CB 4.21Å; W358-R360 PolarHBondContact O-N 3.47Å; R360-N366 VanDerWaalsContact CA-OD1 3.29Å; R360-N366 WeakPolarHBondContact CA-OD1 2.98Å
361	E	88.4	Confident	91.1	Very high	28 Å²	28	46.5 Å²	46.5	13%	0.131	24%	0.238	C	C	.	.			trans	-76.7	155.2	171.7	-178.2	56.6	-82.9	0	0	109.8	R302 H359 L363 N366	R302-E361 IonicContact CZ-OE2 3.94Å; R302-E361 IonicContact NE-OE2 2.73Å; R302-E361 PolarHBondContact NE-OE2 2.91Å; R302-E361 IonicContact NH2-OE2 3.18Å; R302-E361 PolarHBondContact NH2-OE2 2.83Å; H359-E361 PolarHBondContact O-N 3.24Å; H359-E361 VanDerWaalsContact O-N 3.13Å; E361-L363 WeakPolarHBondContact CG-O 3.32Å; E361-N366 PolarHBondContact N-OD1 3.2Å; E361-N366 VanDerWaalsContact N-OD1 3.14Å
362	S	85	Confident	91.5	Very high	93 Å²	93	45.5 Å²	45.5	65%	0.65	24%	0.235	S	C	*	.	S	Bend	trans	-88.1	-30.8	179.5	56.8	0	0	0	0	113.5
363	L	81.2	Confident	91.6	Very high	151 Å²	151	48.1 Å²	48.1	79%	0.791	24%	0.244	S	C	*	.	S	Bend	trans	-139.6	116.4	179.6	-65.6	173.5	0	0	0	109.5	E361	E361-L363 WeakPolarHBondContact CG-O 3.32Å
364	G	75.3	Confident	91.5	Very high	72 Å²	72	48.5 Å²	48.5	74%	0.742	25%	0.247	S	C	*	.	S	Bend	trans	96.5	-155.7	-179	0	0	0	0	0	114.1
365	R	80.1	Confident	91.4	Very high	235 Å²	235	50.8 Å²	50.8	89%	0.887	26%	0.261	S	S	*	.	S	Bend	trans	-78.6	138.6	-174	-65	179.9	179.3	173.4	-0.2	111.4
366	N	88.6	Confident	91.2	Very high	60 Å²	60	50.8 Å²	50.8	32%	0.321	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-61.2	136.8	172	-62.1	-58.3	0	0	0	110.4	Y309 W358 H359 R360 E361	Y309-N366 PolarHBondContact OH-ND2 2.91Å; W358-N366 HydrophobicContact CE3-CB 4.1Å; H359-N366 WeakPolarHBondContact O-CA 3.5Å; H359-N366 WeakPolarHBondContact O-CB 3.5Å; R360-N366 VanDerWaalsContact CA-OD1 3.29Å; R360-N366 WeakPolarHBondContact CA-OD1 2.98Å; E361-N366 PolarHBondContact N-OD1 3.2Å; E361-N366 VanDerWaalsContact N-OD1 3.14Å
367	I	90.6	Very high	90.8	Very high	27 Å²	27	55.5 Å²	55.5	14%	0.138	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	127.2	-173.6	-55.6	174.6	0	0	0	109.1	V269 A301 R302 W358 H359	V269-I367 HydrophobicContact CB-CG2 4.3Å; V269-I367 HydrophobicContact CG2-CG2 3.7Å; A301-I367 HydrophobicContact CB-CB 4.31Å; A301-I367 HydrophobicContact CB-CD1 4.18Å; A301-I367 HydrophobicContact CB-CG2 4.08Å; R302-I367 VanDerWaalsContact CZ-CD1 3.47Å; W358-I367 CarbonylContact C-O 3.52Å; W358-I367 WeakPolarHBondContact CA-O 3.48Å; H359-I367 HydrophobicContact CB-CB 4.3Å; H359-I367 PolarHBondContact N-O 2.82Å; H359-I367 PolarHBondContact O-N 2.85Å
368	F	92	Very high	90.5	Very high	35 Å²	35	60.3 Å²	60.3	15%	0.154	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	137.7	176.3	177.9	-102.3	0	0	0	111	V271 W358 E371 R393	V271-F368 HydrophobicContact CG2-CD1 4.16Å; V271-F368 HydrophobicContact CG2-CE1 3.85Å; W358-F368 HydrophobicContact CD2-CD2 4.38Å; W358-F368 AromaticContact CE2-CD2 3.97Å; W358-F368 HydrophobicContact CE3-CB 4.19Å; W358-F368 HydrophobicContact CH2-CB 4.35Å; W358-F368 HydrophobicContact CH2-CD2 4.26Å; W358-F368 AromaticContact CZ2-CD2 3.93Å; W358-F368 HydrophobicContact CZ2-CD2 3.93Å; W358-F368 HydrophobicContact CZ3-CB 4.05Å; F368-E371 HydrophobicContact CE2-CB 3.94Å; F368-E371 HydrophobicContact CE2-CG 4.31Å; F368-E371 HydrophobicContact CZ-CB 3.88Å; F368-E371 HydrophobicContact CZ-CG 3.93Å; F368-R393 HydrophobicContact CD1-CB 4.31Å; F368-R393 HydrophobicContact CD2-CG 4.36Å; F368-R393 HydrophobicContact CE1-CB 3.8Å; F368-R393 HydrophobicContact CE1-CG 3.92Å; F368-R393 HydrophobicContact CE2-CB 4.47Å; F368-R393 VanDerWaalsContact CE2-CD 3.45Å; F368-R393 HydrophobicContact CE2-CG 3.72Å; F368-R393 VanDerWaalsContact CE2-NE 3.32Å; F368-R393 HydrophobicContact CZ-CB 3.88Å; F368-R393 HydrophobicContact CZ-CG 3.46Å; F368-R393 VanDerWaalsContact CZ-CG 3.46Å
369	L	94.6	Very high	90.2	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	-8.8	-178.3	-60.8	-179.2	0	0	0	113.8	V269 V271 L298 A299 A301 P308 V357 H359	V269-L369 HydrophobicContact CG1-CD2 4.34Å; V271-L369 WeakPolarHBondContact CG1-O 3.48Å; L298-L369 HydrophobicContact CD1-CD1 4.45Å; A299-L369 HydrophobicContact CB-CD2 4.42Å; A301-L369 HydrophobicContact CB-CD2 3.84Å; P308-L369 HydrophobicContact CB-CD1 4.25Å; V357-L369 HydrophobicContact CB-CB 4.25Å; V357-L369 HydrophobicContact CG1-CB 4.27Å; V357-L369 HydrophobicContact CG1-CD1 4.2Å; V357-L369 WeakPolarHBondContact O-CB 3.36Å; V357-L369 PolarHBondContact O-N 2.82Å; H359-L369 HydrophobicContact CB-CD1 4.12Å; H359-L369 HydrophobicContact CB-CD2 4.22Å; H359-L369 HydrophobicContact CB-CG 4.27Å
370	G	95	Very high	90.1	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	132.2	163.3	-177.5	0	0	0	0	0	113.1	V271 V357 Q391	V271-G370 VanDerWaalsContact CG1-CA 3.48Å; V357-G370 PolarHBondContact N-O 3.05Å; G370-Q391 CarbonylContact C-O 3.55Å; G370-Q391 VanDerWaalsContact CA-O 3.3Å; G370-Q391 WeakPolarHBondContact CA-O 3.21Å
371	E	95.7	Very high	89.9	Confident	21 Å²	21	62.1 Å²	62.1	10%	0.098	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	170.9	178.7	74.2	-169.1	168.3	0	0	114.3	L355 S356 F368 Q391 R393	L355-E371 CarbonylContact O-C 3.46Å; L355-E371 WeakPolarHBondContact O-CA 3.38Å; L355-E371 VanDerWaalsContact O-CB 3.29Å; L355-E371 WeakPolarHBondContact O-CB 3.42Å; S356-E371 WeakPolarHBondContact CB-OE2 3.39Å; F368-E371 HydrophobicContact CE2-CB 3.94Å; F368-E371 HydrophobicContact CE2-CG 4.31Å; F368-E371 HydrophobicContact CZ-CB 3.88Å; F368-E371 HydrophobicContact CZ-CG 3.93Å; E371-Q391 PolarHBondContact N-O 2.7Å; E371-Q391 PolarHBondContact O-N 3.19Å; E371-R393 VanDerWaalsContact CD-CG 3.48Å; E371-R393 HydrophobicContact CG-CG 4.46Å; E371-R393 WeakPolarHBondContact OE1-CG 3.23Å; E371-R393 IonicContact OE1-NE 3.01Å; E371-R393 PolarHBondContact OE1-NE 2.74Å; E371-R393 IonicContact OE2-CZ 2.77Å; E371-R393 IonicContact OE2-NE 3.49Å; E371-R393 PolarHBondContact OE2-NE 3.42Å; E371-R393 IonicContact OE2-NH2 3.42Å; E371-R393 PolarHBondContact OE2-NH2 3.31Å
372	V	95.7	Very high	89.9	Confident	11 Å²	11	68.2 Å²	68.2	7%	0.067	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	141.8	168.5	-62.8	0	0	0	0	109	V275 F277 L355 L388 P389 L390	V275-V372 HydrophobicContact CG1-CG1 4.27Å; V275-V372 HydrophobicContact CG1-CG2 3.75Å; F277-V372 HydrophobicContact CE1-CG2 4.29Å; L355-V372 HydrophobicContact CB-CG2 3.88Å; L355-V372 PolarHBondContact N-O 3.42Å; L355-V372 PolarHBondContact O-N 2.96Å; V372-L388 HydrophobicContact CB-CB 4.2Å; V372-L388 HydrophobicContact CB-CD1 4.18Å; V372-L388 HydrophobicContact CG1-CB 3.67Å; V372-L388 HydrophobicContact CG2-CB 4.35Å; V372-L388 HydrophobicContact CG2-CD1 4.23Å; V372-P389 WeakPolarHBondContact CG1-O 3.29Å; V372-L390 HydrophobicContact CG1-CD2 4.28Å
373	E	94.2	Very high	89.9	Confident	100 Å²	100	65.3 Å²	65.3	47%	0.467	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	138.2	173.8	-56.7	-145.4	133.7	0	0	109.6	V352 L353 S354	V352-E373 HydrophobicContact CG1-CB 3.92Å; L353-E373 CarbonylContact O-C 3.35Å; L353-E373 WeakPolarHBondContact O-CA 3.46Å; S354-E373 WeakPolarHBondContact CB-OE1 3.47Å; S354-E373 PolarHBondContact OG-OE1 3.32Å
374	V	93.8	Very high	90.4	Very high	8 Å²	8	66.4 Å²	66.4	5%	0.048	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	104.1	-169.5	-177.7	0	0	0	0	109.5	F277 V352 L353 L376 W379 L388	F277-V374 HydrophobicContact CZ-CG2 3.99Å; V352-V374 WeakPolarHBondContact CA-O 3.3Å; L353-V374 HydrophobicContact CB-CB 4.34Å; L353-V374 PolarHBondContact N-O 3.24Å; L353-V374 PolarHBondContact O-N 3.02Å; V374-L376 HydrophobicContact CG1-CD2 4.26Å; V374-L376 PolarHBondContact O-N 2.92Å; V374-W379 HydrophobicContact CG1-CB 4.48Å; V374-W379 HydrophobicContact CG1-CD2 4.27Å; V374-W379 HydrophobicContact CG1-CE3 3.47Å; V374-W379 VanDerWaalsContact CG1-CE3 3.47Å; V374-W379 HydrophobicContact CG1-CZ3 4.06Å; V374-L388 HydrophobicContact CG2-CD1 3.74Å
375	P	92.4	Very high	91.3	Very high	51 Å²	51	65 Å²	65	33%	0.331	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	122	169.1	-21.1	34.7	0	0	0	110.3	V352 D377 T378 W379	V352-P375 HydrophobicContact CG2-CB 4.47Å; V352-P375 HydrophobicContact CG2-CG 4.5Å; P375-D377 VanDerWaalsContact C-N 3.32Å; P375-D377 VanDerWaalsContact C-OD1 3.25Å; P375-D377 WeakPolarHBondContact CB-OD1 3.48Å; P375-D377 PolarHBondContact O-N 3.49Å; P375-T378 HydrophobicContact CB-CG2 4.42Å; P375-T378 PolarHBondContact O-N 3.21Å; P375-T378 PolarHBondContact O-OG1 2.99Å; P375-W379 PolarHBondContact O-N 2.87Å
376	L	92.2	Very high	92	Very high	2 Å²	2	55.7 Å²	55.7	1%	0.01	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-8.8	-169.7	-62.6	-174.7	0	0	0	113.9	L279 L288 L314 L348 R351 L353 V374 W379 W381	L279-L376 HydrophobicContact CD1-CD2 3.64Å; L288-L376 HydrophobicContact CD2-CD1 3.59Å; L314-L376 HydrophobicContact CD1-CD1 3.73Å; L348-L376 HydrophobicContact CD2-CD1 4.15Å; L348-L376 WeakPolarHBondContact O-CB 3.05Å; R351-L376 HydrophobicContact CB-CD1 4.26Å; R351-L376 PolarHBondContact O-N 2.83Å; L353-L376 HydrophobicContact CB-CD2 3.97Å; L353-L376 HydrophobicContact CB-CG 4.4Å; V374-L376 HydrophobicContact CG1-CD2 4.26Å; V374-L376 PolarHBondContact O-N 2.92Å; L376-W379 HydrophobicContact CD2-CB 4.48Å; L376-W381 HydrophobicContact CB-CZ2 4.21Å
377	D	89	Confident	92.4	Very high	99 Å²	99	57.7 Å²	57.7	53%	0.529	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-38	162.1	61.4	-32.2	0	0	0	112.3	P349 P375	P349-D377 HydrophobicContact CB-CB 3.99Å; P375-D377 VanDerWaalsContact C-N 3.32Å; P375-D377 VanDerWaalsContact C-OD1 3.25Å; P375-D377 WeakPolarHBondContact CB-OD1 3.48Å; P375-D377 PolarHBondContact O-N 3.49Å
378	T	90.2	Very high	92.7	Very high	101 Å²	101	58.6 Å²	58.6	62%	0.62	30%	0.303	S	S	*	.	S	Bend	trans	-87.5	-6.7	-179.8	67.1	0	0	0	0	114.4	P375	P375-T378 HydrophobicContact CB-CG2 4.42Å; P375-T378 PolarHBondContact O-N 3.21Å; P375-T378 PolarHBondContact O-OG1 2.99Å
379	W	91.4	Very high	93	Very high	28 Å²	28	60.7 Å²	60.7	11%	0.106	32%	0.32	C	S	.	.			trans	-76.1	131.9	-175.6	-177	-97	0	0	0	112.6	F277 L279 V374 P375 L376 W381	F277-W379 HydrophobicContact CD2-CH2 4.48Å; F277-W379 AromaticContact CE2-CH2 3.63Å; F277-W379 HydrophobicContact CE2-CH2 3.63Å; F277-W379 HydrophobicContact CE2-CZ2 4.36Å; F277-W379 AromaticContact CE2-CZ3 3.93Å; F277-W379 HydrophobicContact CE2-CZ3 3.93Å; F277-W379 AromaticContact CZ-CH2 3.93Å; F277-W379 HydrophobicContact CZ-CH2 3.93Å; F277-W379 AromaticContact CZ-CZ3 3.93Å; F277-W379 HydrophobicContact CZ-CZ3 3.93Å; L279-W379 HydrophobicContact CB-CZ2 4.25Å; L279-W379 HydrophobicContact CD1-CD2 3.71Å; L279-W379 HydrophobicContact CD1-CE3 4.22Å; L279-W379 HydrophobicContact CD1-CG 3.94Å; L279-W379 HydrophobicContact CD1-CZ2 4.15Å; L279-W379 HydrophobicContact CG-CD2 4.34Å; L279-W379 HydrophobicContact CG-CH2 4.43Å; L279-W379 HydrophobicContact CG-CZ2 3.87Å; V374-W379 HydrophobicContact CG1-CB 4.48Å; V374-W379 HydrophobicContact CG1-CD2 4.27Å; V374-W379 HydrophobicContact CG1-CE3 3.47Å; V374-W379 VanDerWaalsContact CG1-CE3 3.47Å; V374-W379 HydrophobicContact CG1-CZ3 4.06Å; P375-W379 PolarHBondContact O-N 2.87Å; L376-W379 HydrophobicContact CD2-CB 4.48Å; W379-W381 AromaticContact CD1-CD2 3.84Å; W379-W381 PolarHBondContact O-N 3.35Å; W379-W381 PolarHBondContact O-NE1 2.92Å
380	N	91.7	Very high	93.1	Very high	95 Å²	95	61.1 Å²	61.1	51%	0.508	32%	0.322	S	S	.	.			trans	-79.5	103.2	170.9	179.8	16	0	0	0	110.7	D382 S383	N380-D382 PolarHBondContact O-N 2.96Å; N380-D382 PolarHBondContact OD1-N 2.96Å; N380-S383 WeakPolarHBondContact O-CB 3.4Å; N380-S383 PolarHBondContact O-N 3.49Å
381	W	90.4	Very high	93	Very high	87 Å²	87	66 Å²	66	33%	0.33	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-20.8	-178.3	-62.8	92.8	0	0	0	114.5	L279 L288 L348 L376 W379 S383	L279-W381 HydrophobicContact CB-CZ3 4.35Å; L288-W381 HydrophobicContact CD1-CH2 3.87Å; L288-W381 HydrophobicContact CD1-CZ3 3.79Å; L348-W381 HydrophobicContact CD1-CH2 4.01Å; L348-W381 HydrophobicContact CD1-CZ2 4.12Å; L348-W381 HydrophobicContact CD2-CH2 4.34Å; L376-W381 HydrophobicContact CB-CZ2 4.21Å; W379-W381 AromaticContact CD1-CD2 3.84Å; W379-W381 PolarHBondContact O-N 3.35Å; W379-W381 PolarHBondContact O-NE1 2.92Å; W381-S383 VanDerWaalsContact C-N 3.3Å
382	D	88.9	Confident	92.6	Very high	157 Å²	157	68.6 Å²	68.6	84%	0.84	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	3.3	173.5	-62.6	-48.1	0	0	0	113	N380	N380-D382 PolarHBondContact O-N 2.96Å; N380-D382 PolarHBondContact OD1-N 2.96Å
383	S	85.4	Confident	91.6	Very high	32 Å²	32	73.1 Å²	73.1	22%	0.224	38%	0.38	C	S	.	.			trans	-72.6	138	-178.8	-172.3	0	0	0	0	112.8	N380 W381 T386	N380-S383 WeakPolarHBondContact O-CB 3.4Å; N380-S383 PolarHBondContact O-N 3.49Å; W381-S383 VanDerWaalsContact C-N 3.3Å; S383-T386 PolarHBondContact OG-OG1 3.46Å
384	E	90.3	Very high	89.9	Confident	174 Å²	174	73.1 Å²	73.1	81%	0.813	39%	0.387	S	S	*	.			trans	-62.6	174.6	158.4	-67.1	-168.1	178.5	0	0	111.6	T386	E384-T386 PolarHBondContact O-N 2.93Å; E384-T386 PolarHBondContact O-OG1 2.89Å
385	A	95.5	Very high	88	Confident	41 Å²	41	77.4 Å²	77.4	34%	0.339	41%	0.414	S	S	.	.			trans	-57.5	123.8	179.3	0	0	0	0	0	112.4	L276 F277 I293	L276-A385 HydrophobicContact CD1-CB 3.75Å; L276-A385 WeakPolarHBondContact CD1-O 3.45Å; L276-A385 HydrophobicContact CG-CB 4.22Å; F277-A385 CarbonylContact O-C 3.52Å; F277-A385 VanDerWaalsContact O-CA 3.31Å; F277-A385 WeakPolarHBondContact O-CA 3.3Å; I293-A385 HydrophobicContact CD1-CB 3.39Å
386	T	94.8	Very high	85.8	Confident	41 Å²	41	78.9 Å²	78.9	25%	0.252	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	137.2	-171.3	-69.5	0	0	0	0	111.5	F277 S383 E384 L388	F277-T386 PolarHBondContact N-O 3.04Å; F277-T386 PolarHBondContact O-N 2.84Å; S383-T386 PolarHBondContact OG-OG1 3.46Å; E384-T386 PolarHBondContact O-N 2.93Å; E384-T386 PolarHBondContact O-OG1 2.89Å; T386-L388 HydrophobicContact CG2-CD2 3.99Å; T386-L388 HydrophobicContact CG2-CG 4.26Å
387	W	97	Very high	83.7	Confident	101 Å²	101	80.5 Å²	80.5	38%	0.383	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	121.1	169.7	-76.5	105.5	0	0	0	110.6	S274 V275 L276 Q294 Q296	S274-W387 VanDerWaalsContact OG-CZ3 3.29Å; S274-W387 WeakPolarHBondContact OG-CZ3 3.36Å; V275-W387 WeakPolarHBondContact O-CA 3.23Å; L276-W387 HydrophobicContact CB-CD2 3.75Å; L276-W387 HydrophobicContact CB-CE3 3.69Å; L276-W387 HydrophobicContact CB-CG 4.48Å; L276-W387 HydrophobicContact CB-CH2 3.9Å; L276-W387 HydrophobicContact CB-CZ2 3.93Å; L276-W387 HydrophobicContact CB-CZ3 3.77Å; L276-W387 HydrophobicContact CD1-CD2 4.08Å; L276-W387 HydrophobicContact CD1-CG 3.99Å; L276-W387 HydrophobicContact CD2-CZ2 3.91Å; L276-W387 HydrophobicContact CG-CD2 4.35Å; L276-W387 HydrophobicContact CG-CZ2 4.43Å; Q294-W387 HydrophobicContact CG-CH2 3.68Å; Q294-W387 HydrophobicContact CG-CZ2 4.09Å; Q294-W387 HydrophobicContact CG-CZ3 4.48Å; Q296-W387 HydrophobicContact CB-CH2 3.66Å; Q296-W387 HydrophobicContact CB-CZ3 3.79Å
388	L	96.5	Very high	81.9	Confident	46 Å²	46	78.3 Å²	78.3	24%	0.241	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	138.1	168.8	-64.1	-175.8	0	0	0	111.2	S274 V275 F277 V372 V374 T386	S274-L388 CarbonylContact C-O 3.48Å; S274-L388 VanDerWaalsContact CA-O 3.24Å; S274-L388 WeakPolarHBondContact CA-O 3.43Å; S274-L388 WeakPolarHBondContact CB-O 3.41Å; V275-L388 PolarHBondContact N-O 3.35Å; V275-L388 PolarHBondContact O-N 2.74Å; F277-L388 HydrophobicContact CE1-CB 4.36Å; F277-L388 HydrophobicContact CE1-CD1 3.79Å; F277-L388 HydrophobicContact CE1-CG 3.99Å; F277-L388 HydrophobicContact CZ-CD1 3.72Å; F277-L388 HydrophobicContact CZ-CG 4.29Å; V372-L388 HydrophobicContact CB-CB 4.2Å; V372-L388 HydrophobicContact CB-CD1 4.18Å; V372-L388 HydrophobicContact CG1-CB 3.67Å; V372-L388 HydrophobicContact CG2-CB 4.35Å; V372-L388 HydrophobicContact CG2-CD1 4.23Å; V374-L388 HydrophobicContact CG2-CD1 3.74Å; T386-L388 HydrophobicContact CG2-CD2 3.99Å; T386-L388 HydrophobicContact CG2-CG 4.26Å
389	P	97.3	Very high	80.1	Confident	80 Å²	80	78.5 Å²	78.5	52%	0.519	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	130.6	178.1	30.6	-33.2	0	0	0	110.8	V372 Q391	V372-P389 WeakPolarHBondContact CG1-O 3.29Å; P389-Q391 PolarHBondContact O-N 3.34Å; P389-Q391 PolarHBondContact O-NE2 3.28Å
390	L	97.2	Very high	78.6	Confident	9 Å²	9	82.5 Å²	82.5	5%	0.047	44%	0.444	C	S	.	.	P	Polyproline II helix	trans	-68.9	129	-179.1	-63.4	176.1	0	0	0	111.1	V271 G273 V275 L298 V357 V372	V271-L390 HydrophobicContact CG1-CB 4.05Å; V271-L390 WeakPolarHBondContact CG1-O 3.35Å; G273-L390 WeakPolarHBondContact O-CB 3.49Å; G273-L390 PolarHBondContact O-N 2.74Å; V275-L390 HydrophobicContact CB-CD2 4.14Å; V275-L390 HydrophobicContact CG1-CD2 3.81Å; L298-L390 HydrophobicContact CD2-CD1 3.35Å; V357-L390 HydrophobicContact CB-CD1 4.33Å; V357-L390 HydrophobicContact CG2-CD1 3.87Å; V357-L390 HydrophobicContact CG2-CD2 3.69Å; V357-L390 HydrophobicContact CG2-CG 4.47Å; V372-L390 HydrophobicContact CG1-CD2 4.28Å
391	Q	93.2	Very high	77.5	Confident	101 Å²	101	79.9 Å²	79.9	47%	0.472	43%	0.43	S	S	.	.	B	Isolated β-bridge	trans	-100.8	153	177.7	-56.8	-49	-49.2	0	0	111.9	G370 E371 P389	G370-Q391 CarbonylContact C-O 3.55Å; G370-Q391 VanDerWaalsContact CA-O 3.3Å; G370-Q391 WeakPolarHBondContact CA-O 3.21Å; E371-Q391 PolarHBondContact N-O 2.7Å; E371-Q391 PolarHBondContact O-N 3.19Å; P389-Q391 PolarHBondContact O-N 3.34Å; P389-Q391 PolarHBondContact O-NE2 3.28Å
392	P	88.4	Confident	77	Confident	77 Å²	77	80.5 Å²	80.5	50%	0.5	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-55.7	141.1	163.5	-20.5	32.4	0	0	0	111	V271 V394	V271-P392 HydrophobicContact CB-CG 4.29Å; V271-P392 HydrophobicContact CG2-CB 4.5Å; P392-V394 VanDerWaalsContact C-N 3.3Å; P392-V394 PolarHBondContact O-N 2.67Å
393	R	73.5	Confident	76.9	Confident	106 Å²	106	74.6 Å²	74.6	40%	0.4	42%	0.416	S	S	.	.			trans	-61.2	101.9	152.2	-92.8	171.9	-173	-119.9	-19.1	106.3	F368 E371 P395	F368-R393 HydrophobicContact CD1-CB 4.31Å; F368-R393 HydrophobicContact CD2-CG 4.36Å; F368-R393 HydrophobicContact CE1-CB 3.8Å; F368-R393 HydrophobicContact CE1-CG 3.92Å; F368-R393 HydrophobicContact CE2-CB 4.47Å; F368-R393 VanDerWaalsContact CE2-CD 3.45Å; F368-R393 HydrophobicContact CE2-CG 3.72Å; F368-R393 VanDerWaalsContact CE2-NE 3.32Å; F368-R393 HydrophobicContact CZ-CB 3.88Å; F368-R393 HydrophobicContact CZ-CG 3.46Å; F368-R393 VanDerWaalsContact CZ-CG 3.46Å; E371-R393 VanDerWaalsContact CD-CG 3.48Å; E371-R393 HydrophobicContact CG-CG 4.46Å; E371-R393 WeakPolarHBondContact OE1-CG 3.23Å; E371-R393 IonicContact OE1-NE 3.01Å; E371-R393 PolarHBondContact OE1-NE 2.74Å; E371-R393 IonicContact OE2-CZ 2.77Å; E371-R393 IonicContact OE2-NE 3.49Å; E371-R393 PolarHBondContact OE2-NE 3.42Å; E371-R393 IonicContact OE2-NH2 3.42Å; E371-R393 PolarHBondContact OE2-NH2 3.31Å; R393-P395 VanDerWaalsContact O-CD 3.24Å; R393-P395 WeakPolarHBondContact O-CD 3.38Å
394	V	59.2	Low	76.9	Confident	100 Å²	100	73.4 Å²	73.4	61%	0.606	41%	0.406	S	S	*	.			trans	-72.1	106.6	145.7	-179	0	0	0	0	103.6	P392	P392-V394 VanDerWaalsContact C-N 3.3Å; P392-V394 PolarHBondContact O-N 2.67Å
395	P	52.5	Low	76.8	Confident	97 Å²	97	65.6 Å²	65.6	63%	0.63	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-59.2	128.9	158.3	-1	18	0	0	0	104.1	R393 S397	R393-P395 VanDerWaalsContact O-CD 3.24Å; R393-P395 WeakPolarHBondContact O-CD 3.38Å; P395-S397 PolarHBondContact O-N 2.77Å
396	P	46.4	Very low	76.8	Confident	83 Å²	83	66.4 Å²	66.4	54%	0.539	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-51.6	118.2	173.7	23.4	-32.9	0	0	0	105.6	E400 L401	P396-E400 HydrophobicContact CB-CB 4.34Å; P396-L401 HydrophobicContact CB-CD1 4.3Å; P396-L401 HydrophobicContact CG-CD1 4.4Å
397	S	48.2	Very low	76.9	Confident	35 Å²	35	64.4 Å²	64.4	25%	0.245	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-56.4	152.9	-177.1	67.4	0	0	0	0	107.5	P395 D399 E400 L401	P395-S397 PolarHBondContact O-N 2.77Å; S397-D399 PolarHBondContact O-N 2.79Å; S397-E400 WeakPolarHBondContact CB-OE1 3.28Å; S397-E400 PolarHBondContact N-OE1 3.42Å; S397-E400 PolarHBondContact N-OE2 2.7Å; S397-E400 PolarHBondContact O-N 3.25Å; S397-E400 WeakPolarHBondContact OG-CG 3.38Å; S397-E400 PolarHBondContact OG-N 3.25Å; S397-E400 PolarHBondContact OG-OE1 3.45Å; S397-L401 WeakPolarHBondContact O-CD1 3.43Å
398	P	51	Low	76.9	Confident	53 Å²	53	60.6 Å²	60.6	34%	0.344	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.1	-29.1	177.9	-30.5	37.6	0	0	0	112.1	R404 L442	P398-R404 PolarHBondContact O-NE 2.78Å; P398-R404 PolarHBondContact O-NH2 3.32Å; P398-L442 HydrophobicContact CB-CD2 3.94Å
399	D	52.5	Low	77	Confident	106 Å²	106	58.4 Å²	58.4	57%	0.567	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-17	177.6	-54	-62.1	0	0	0	115.2	S397 R404	S397-D399 PolarHBondContact O-N 2.79Å; D399-R404 IonicContact OD1-CZ 3.39Å; D399-R404 IonicContact OD1-NH2 2.71Å; D399-R404 PolarHBondContact OD1-NH2 3.28Å
400	E	60.4	Low	77	Confident	111 Å²	111	54.6 Å²	54.6	52%	0.519	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-15.6	175.2	-78.9	154.1	-120.2	0	0	114.6	P396 S397	P396-E400 HydrophobicContact CB-CB 4.34Å; S397-E400 WeakPolarHBondContact CB-OE1 3.28Å; S397-E400 PolarHBondContact N-OE1 3.42Å; S397-E400 PolarHBondContact N-OE2 2.7Å; S397-E400 PolarHBondContact O-N 3.25Å; S397-E400 WeakPolarHBondContact OG-CG 3.38Å; S397-E400 PolarHBondContact OG-N 3.25Å; S397-E400 PolarHBondContact OG-OE1 3.45Å
401	L	69.8	Low	77	Confident	41 Å²	41	54.2 Å²	54.2	22%	0.215	31%	0.309	C	S	.	.	S	Bend	trans	-60.9	127.3	174.8	-85.1	81.3	0	0	0	109.4	P396 S397 S403 V440 T561	P396-L401 HydrophobicContact CB-CD1 4.3Å; P396-L401 HydrophobicContact CG-CD1 4.4Å; S397-L401 WeakPolarHBondContact O-CD1 3.43Å; L401-S403 PolarHBondContact O-N 3.32Å; L401-S403 VanDerWaalsContact O-N 3.16Å; L401-V440 HydrophobicContact CD2-CB 4.22Å; L401-V440 HydrophobicContact CD2-CG1 3.9Å; L401-V440 HydrophobicContact CD2-CG2 3.99Å; L401-T561 WeakPolarHBondContact O-CB 3.11Å; L401-T561 WeakPolarHBondContact O-CG2 3.41Å; L401-T561 PolarHBondContact O-OG1 2.98Å
402	P	79.2	Confident	77.2	Confident	99 Å²	99	50.7 Å²	50.7	64%	0.643	29%	0.292	S	S	*	.	S	Bend	trans	-65.7	-22.8	-176.6	25.8	-34.9	0	0	0	113.1	R560 T561	P402-R560 WeakPolarHBondContact O-CA 3.48Å; P402-T561 PolarHBondContact O-N 3.38Å
403	S	85.6	Confident	77.7	Confident	33 Å²	33	47.3 Å²	47.3	23%	0.231	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	144.8	171.3	177.8	0	0	0	0	110.3	L401 G405 L559	L401-S403 PolarHBondContact O-N 3.32Å; L401-S403 VanDerWaalsContact O-N 3.16Å; S403-G405 PolarHBondContact OG-N 2.86Å; S403-G405 PolarHBondContact OG-O 2.92Å; S403-L559 WeakPolarHBondContact CA-O 3.5Å; S403-L559 PolarHBondContact OG-N 2.78Å; S403-L559 VanDerWaalsContact OG-N 3.16Å; S403-L559 PolarHBondContact OG-O 3.13Å
404	R	86.4	Confident	78.8	Confident	8 Å²	8	42.3 Å²	42.3	3%	0.03	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	16.3	173.9	-62.2	-159.9	-171.6	126.8	-10.9	114.1	P398 D399 L439 V440 L442 Q511 L512 L559 T561	P398-R404 PolarHBondContact O-NE 2.78Å; P398-R404 PolarHBondContact O-NH2 3.32Å; D399-R404 IonicContact OD1-CZ 3.39Å; D399-R404 IonicContact OD1-NH2 2.71Å; D399-R404 PolarHBondContact OD1-NH2 3.28Å; R404-L439 CarbonylContact O-C 3.53Å; R404-L439 VanDerWaalsContact O-CA 3.3Å; R404-L439 WeakPolarHBondContact O-CA 3.35Å; R404-V440 HydrophobicContact CB-CB 4.27Å; R404-V440 PolarHBondContact O-N 2.99Å; R404-L442 VanDerWaalsContact NH2-CD2 3.29Å; R404-Q511 PolarHBondContact NH1-O 2.94Å; R404-L512 WeakPolarHBondContact CD-O 3.28Å; R404-L512 WeakPolarHBondContact CG-O 3.28Å; R404-L512 PolarHBondContact NH1-O 2.87Å; R404-L559 PolarHBondContact N-O 3.4Å; R404-T561 HydrophobicContact CG-CG2 3.83Å
405	G	89.2	Confident	80.5	Confident	10 Å²	10	39 Å²	39	10%	0.103	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	153.8	-163.9	174.7	0	0	0	0	0	112.7	S403 L559	S403-G405 PolarHBondContact OG-N 2.86Å; S403-G405 PolarHBondContact OG-O 2.92Å; G405-L559 PolarHBondContact O-N 3.29Å
406	L	94	Very high	82.4	Confident	57 Å²	57	37.3 Å²	37.3	30%	0.298	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	140.9	173.8	-63.2	165.5	0	0	0	110.1	A436 Q437 L556 L557	L406-A436 CarbonylContact O-C 3.56Å; L406-A436 VanDerWaalsContact O-CA 3.23Å; L406-A436 WeakPolarHBondContact O-CA 3.49Å; L406-Q437 HydrophobicContact CB-CG 3.81Å; L406-Q437 HydrophobicContact CD1-CG 4.46Å; L406-Q437 PolarHBondContact N-O 2.99Å; L406-Q437 PolarHBondContact O-N 3.42Å; L406-L556 HydrophobicContact CB-CD1 3.82Å; L406-L556 HydrophobicContact CB-CG 4.27Å; L406-L556 HydrophobicContact CD1-CD2 4.28Å; L406-L556 HydrophobicContact CD1-CG 4.39Å; L406-L557 CarbonylContact C-O 3.57Å; L406-L557 VanDerWaalsContact CA-O 3.31Å; L406-L557 WeakPolarHBondContact CA-O 3.11Å
407	L	97.3	Very high	84.6	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	125.6	174.8	-176.2	66.1	0	0	0	109.5	L409 V433 A436 I451 L499 T515 L556 L557 L559	L407-L409 HydrophobicContact CD2-CD2 4.12Å; L407-L409 HydrophobicContact CG-CD2 3.99Å; L407-V433 HydrophobicContact CD1-CG1 4.16Å; L407-A436 HydrophobicContact CD1-CB 4.16Å; L407-I451 HydrophobicContact CD1-CD1 3.65Å; L407-I451 HydrophobicContact CD1-CG1 4.08Å; L407-I451 HydrophobicContact CD2-CD1 3.96Å; L407-I451 HydrophobicContact CG-CD1 4.48Å; L407-L499 HydrophobicContact CD2-CB 4.17Å; L407-L499 HydrophobicContact CD2-CD2 4.3Å; L407-T515 HydrophobicContact CD2-CG2 3.99Å; L407-L556 WeakPolarHBondContact O-CA 3.08Å; L407-L557 PolarHBondContact N-O 2.8Å; L407-L557 PolarHBondContact O-N 2.85Å; L407-L559 HydrophobicContact CB-CD1 4.37Å; L407-L559 HydrophobicContact CB-CD2 3.97Å; L407-L559 HydrophobicContact CB-CG 3.99Å; L407-L559 HydrophobicContact CD2-CD2 4.31Å
408	S	97.3	Very high	86.6	Confident	20 Å²	20	36.2 Å²	36.2	14%	0.14	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	125.1	177	-179	0	0	0	0	109.8	K434 E435	S408-K434 WeakPolarHBondContact O-CB 3.43Å; S408-K434 PolarHBondContact O-N 2.81Å; S408-E435 PolarHBondContact N-O 3.09Å; S408-E435 PolarHBondContact O-N 2.98Å
409	L	97.9	Very high	88.2	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	169.4	-178.5	65.8	145.8	0	0	0	113	L407 L411 W432 L499 L517 G555 L557	L407-L409 HydrophobicContact CD2-CD2 4.12Å; L407-L409 HydrophobicContact CG-CD2 3.99Å; L409-L411 HydrophobicContact CD1-CD2 3.64Å; L409-L411 HydrophobicContact CD1-CG 4.16Å; L409-W432 CarbonylContact C-O 3.58Å; L409-W432 WeakPolarHBondContact CA-O 3.4Å; L409-W432 WeakPolarHBondContact CB-O 3.36Å; L409-L499 HydrophobicContact CD1-CD2 4.25Å; L409-L517 HydrophobicContact CD1-CD1 4.27Å; L409-G555 PolarHBondContact N-O 3.27Å; L409-G555 PolarHBondContact O-N 3.29Å; L409-L557 HydrophobicContact CD2-CD1 4.37Å
410	S	98.2	Very high	89.5	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.007	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	148.4	163.5	-45.1	0	0	0	0	110.9	W432 K434 W552 V553 D554	S410-W432 PolarHBondContact N-O 3.31Å; S410-W432 PolarHBondContact O-N 2.6Å; S410-K434 WeakPolarHBondContact OG-CE 3.19Å; S410-K434 PolarHBondContact OG-NZ 3.36Å; S410-W552 VanDerWaalsContact CB-CE3 3.45Å; S410-V553 CarbonylContact C-O 3.56Å; S410-V553 VanDerWaalsContact CA-O 3.3Å; S410-V553 WeakPolarHBondContact CA-O 2.97Å; S410-D554 WeakPolarHBondContact CB-OD1 3.31Å; S410-D554 PolarHBondContact OG-OD1 3Å
411	L	98	Very high	90.5	Very high	0 Å²	0	35 Å²	35	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	141	172.1	-55	176.8	0	0	0	110.2	L409 H430 F431 L517 L541 W542 L545 W552 V553	L409-L411 HydrophobicContact CD1-CD2 3.64Å; L409-L411 HydrophobicContact CD1-CG 4.16Å; L411-H430 WeakPolarHBondContact CA-O 3.43Å; L411-F431 HydrophobicContact CD2-CD1 3.34Å; L411-F431 HydrophobicContact CD2-CE1 3.74Å; L411-F431 HydrophobicContact CD2-CG 4.25Å; L411-L517 HydrophobicContact CD1-CD1 3.81Å; L411-L517 HydrophobicContact CD1-CD2 4.47Å; L411-L517 HydrophobicContact CD2-CD1 3.91Å; L411-L517 HydrophobicContact CG-CD1 4.44Å; L411-L541 HydrophobicContact CD1-CD2 3.79Å; L411-L541 HydrophobicContact CD1-CG 3.83Å; L411-L541 HydrophobicContact CG-CD2 4.36Å; L411-W542 HydrophobicContact CD1-CE3 4.32Å; L411-L545 HydrophobicContact CB-CD1 3.81Å; L411-L545 HydrophobicContact CB-CD2 4.13Å; L411-L545 HydrophobicContact CB-CG 4.43Å; L411-L545 HydrophobicContact CD1-CD2 4.02Å; L411-W552 CarbonylContact O-C 3.6Å; L411-W552 WeakPolarHBondContact O-CA 3.49Å; L411-V553 PolarHBondContact N-O 2.62Å; L411-V553 PolarHBondContact O-N 3.02Å
412	K	97.4	Very high	91	Very high	27 Å²	27	35.2 Å²	35.2	12%	0.117	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	136.4	166.3	175.1	-168	-173.7	-140.5	0	108.6	V414 E419 H430 C550 E551 W552	K412-V414 HydrophobicContact CD-CG2 3.82Å; K412-V414 VanDerWaalsContact CE-CG2 3.48Å; K412-V414 HydrophobicContact CG-CG2 3.99Å; K412-V414 VanDerWaalsContact NZ-CG2 3.26Å; K412-E419 IonicContact NZ-OE1 3.95Å; K412-E419 PolarHBondContact NZ-OE1 2.6Å; K412-H430 HydrophobicContact CB-CB 4.14Å; K412-H430 PolarHBondContact N-O 3.37Å; K412-H430 WeakPolarHBondContact O-CB 3.42Å; K412-H430 PolarHBondContact O-N 2.75Å; K412-C550 WeakPolarHBondContact CE-O 3.36Å; K412-E551 WeakPolarHBondContact CA-O 3.39Å; K412-E551 WeakPolarHBondContact CB-O 3.14Å; K412-E551 WeakPolarHBondContact CG-O 3.06Å; K412-W552 HydrophobicContact CB-CD2 3.69Å; K412-W552 HydrophobicContact CB-CE3 3.58Å; K412-W552 HydrophobicContact CB-CG 4.27Å; K412-W552 HydrophobicContact CB-CH2 4.23Å; K412-W552 HydrophobicContact CB-CZ2 4.3Å; K412-W552 HydrophobicContact CB-CZ3 3.86Å; K412-W552 HydrophobicContact CD-CD2 4.48Å; K412-W552 HydrophobicContact CD-CZ2 4.36Å
413	Y	97.4	Very high	91.2	Very high	7 Å²	7	34.8 Å²	34.8	3%	0.027	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	130.6	168.6	172.9	-122.5	0	0	0	109.4	P415 E428 F487 P489 L492 P549 C550	Y413-P415 HydrophobicContact CD1-CG 4.23Å; Y413-P415 HydrophobicContact CE1-CB 4.32Å; Y413-P415 HydrophobicContact CE1-CG 3.78Å; Y413-E428 CarbonylContact C-O 3.56Å; Y413-E428 WeakPolarHBondContact CA-O 3.31Å; Y413-E428 VanDerWaalsContact CD2-O 3.27Å; Y413-E428 WeakPolarHBondContact CD2-O 3.49Å; Y413-F487 WeakPolarHBondContact CE2-O 3.43Å; Y413-F487 PolarHBondContact OH-O 2.6Å; Y413-P489 HydrophobicContact CE1-CG 4.18Å; Y413-P489 WeakPolarHBondContact OH-CD 3.34Å; Y413-L492 HydrophobicContact CD1-CD1 3.83Å; Y413-L492 HydrophobicContact CD2-CD1 3.38Å; Y413-L492 HydrophobicContact CE1-CD1 4.01Å; Y413-L492 HydrophobicContact CE2-CD1 3.59Å; Y413-L492 HydrophobicContact CG-CD1 3.5Å; Y413-P549 HydrophobicContact CD1-CB 4.46Å; Y413-C550 PolarHBondContact O-N 3.19Å
414	V	96.3	Very high	91.2	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	105.2	-179.8	-165.9	0	0	0	0	107.9	K412 S418 E419 P424 G427 E428	K412-V414 HydrophobicContact CD-CG2 3.82Å; K412-V414 VanDerWaalsContact CE-CG2 3.48Å; K412-V414 HydrophobicContact CG-CG2 3.99Å; K412-V414 VanDerWaalsContact NZ-CG2 3.26Å; V414-S418 VanDerWaalsContact CG1-OG 3.29Å; V414-S418 WeakPolarHBondContact CG1-OG 3.2Å; V414-E419 HydrophobicContact CG1-CG 3.85Å; V414-P424 HydrophobicContact CB-CG 4.11Å; V414-P424 VanDerWaalsContact CG1-CD 3.45Å; V414-P424 HydrophobicContact CG1-CG 3.75Å; V414-G427 CarbonylContact O-C 3.53Å; V414-G427 WeakPolarHBondContact O-CA 3.3Å; V414-E428 HydrophobicContact CB-CB 4.33Å; V414-E428 PolarHBondContact N-O 3.48Å; V414-E428 PolarHBondContact O-N 2.96Å
415	P	95.3	Very high	91.2	Very high	31 Å²	31	39.2 Å²	39.2	20%	0.201	27%	0.274	C	S	.	.			trans	-59.6	152.1	176.5	-22.3	31.9	0	0	0	112.5	Y413 G417 S418 P549	Y413-P415 HydrophobicContact CD1-CG 4.23Å; Y413-P415 HydrophobicContact CE1-CB 4.32Å; Y413-P415 HydrophobicContact CE1-CG 3.78Å; P415-G417 PolarHBondContact O-N 2.87Å; P415-S418 WeakPolarHBondContact O-CB 3.28Å; P415-S418 PolarHBondContact O-N 3.44Å; P415-S418 VanDerWaalsContact O-N 3.12Å; P415-S418 PolarHBondContact O-OG 2.79Å; P415-P549 HydrophobicContact CG-CB 3.95Å
416	A	93.7	Very high	91.3	Very high	62 Å²	62	40.6 Å²	40.6	51%	0.512	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	126.2	175.7	0	0	0	0	0	111	S418 P424	A416-S418 VanDerWaalsContact C-N 3.31Å; A416-S418 PolarHBondContact O-N 2.98Å; A416-P424 CarbonylContact C-O 3.51Å; A416-P424 WeakPolarHBondContact CA-O 3.32Å
417	G	91.2	Very high	91.2	Very high	39 Å²	39	38 Å²	38	40%	0.402	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.1	13.5	179.8	0	0	0	0	0	116.5	P415 E419 Q423 P424	P415-G417 PolarHBondContact O-N 2.87Å; G417-E419 VanDerWaalsContact C-N 3.33Å; G417-Q423 CarbonylContact C-O 3.59Å; G417-Q423 WeakPolarHBondContact CA-O 3.32Å; G417-P424 PolarHBondContact N-O 3.39Å
418	S	90.3	Very high	91.2	Very high	55 Å²	55	40.8 Å²	40.8	39%	0.385	28%	0.283	S	S	.	.			trans	-75.8	-17.8	178.7	65.5	0	0	0	0	114.6	V414 P415 A416 Q423 C550	V414-S418 VanDerWaalsContact CG1-OG 3.29Å; V414-S418 WeakPolarHBondContact CG1-OG 3.2Å; P415-S418 WeakPolarHBondContact O-CB 3.28Å; P415-S418 PolarHBondContact O-N 3.44Å; P415-S418 VanDerWaalsContact O-N 3.12Å; P415-S418 PolarHBondContact O-OG 2.79Å; A416-S418 VanDerWaalsContact C-N 3.31Å; A416-S418 PolarHBondContact O-N 2.98Å; S418-Q423 PolarHBondContact N-O 3.22Å; S418-C550 PolarHBondContact OG-SG 2.96Å; S418-C550 VanDerWaalsContact OG-SG 3.37Å
419	E	85.7	Confident	91.2	Very high	86 Å²	86	39.8 Å²	39.8	40%	0.402	28%	0.276	S	S	.	.	B	Isolated β-bridge	trans	-104.3	161.3	178.3	-58.7	-168.1	177.2	0	0	111.4	K412 V414 G417 G421 G422 Q423	K412-E419 IonicContact NZ-OE1 3.95Å; K412-E419 PolarHBondContact NZ-OE1 2.6Å; V414-E419 HydrophobicContact CG1-CG 3.85Å; G417-E419 VanDerWaalsContact C-N 3.33Å; E419-G421 PolarHBondContact O-N 3.3Å; E419-G422 PolarHBondContact O-N 3.16Å; E419-Q423 CarbonylContact C-O 3.56Å; E419-Q423 WeakPolarHBondContact CA-O 3.41Å; E419-Q423 WeakPolarHBondContact CB-O 3.35Å; E419-Q423 PolarHBondContact N-O 3.09Å; E419-Q423 PolarHBondContact O-N 3.26Å
420	G	79.2	Confident	91.1	Very high	78 Å²	78	41.1 Å²	41.1	80%	0.804	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	132	-168.6	0	0	0	0	0	113.8
421	G	81.6	Confident	91.1	Very high	82 Å²	82	41 Å²	41	85%	0.845	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.4	12.7	-179.4	0	0	0	0	0	115.1	E419	E419-G421 PolarHBondContact O-N 3.3Å
422	G	79.7	Confident	91.2	Very high	45 Å²	45	45.6 Å²	45.6	46%	0.464	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.7	29.4	179	0	0	0	0	0	113	E419	E419-G422 PolarHBondContact O-N 3.16Å
423	Q	82.8	Confident	91.2	Very high	90 Å²	90	44.3 Å²	44.3	42%	0.421	29%	0.293	S	S	.	.	B	Isolated β-bridge	trans	-103.9	158.2	173.3	-67.1	-65.4	-24.1	0	0	110	G417 S418 E419	G417-Q423 CarbonylContact C-O 3.59Å; G417-Q423 WeakPolarHBondContact CA-O 3.32Å; S418-Q423 PolarHBondContact N-O 3.22Å; E419-Q423 CarbonylContact C-O 3.56Å; E419-Q423 WeakPolarHBondContact CA-O 3.41Å; E419-Q423 WeakPolarHBondContact CB-O 3.35Å; E419-Q423 PolarHBondContact N-O 3.09Å; E419-Q423 PolarHBondContact O-N 3.26Å
424	P	86.5	Confident	91.2	Very high	4 Å²	4	45.5 Å²	45.5	3%	0.026	30%	0.299	C	S	.	.	S	Bend	cis	-65.8	156.9	-17.4	30.5	-35.9	0	0	0	111.5	V414 A416 G417 S426 E428	V414-P424 HydrophobicContact CB-CG 4.11Å; V414-P424 VanDerWaalsContact CG1-CD 3.45Å; V414-P424 HydrophobicContact CG1-CG 3.75Å; A416-P424 CarbonylContact C-O 3.51Å; A416-P424 WeakPolarHBondContact CA-O 3.32Å; G417-P424 PolarHBondContact N-O 3.39Å; P424-S426 VanDerWaalsContact CB-O 3.3Å; P424-S426 WeakPolarHBondContact CB-O 3.32Å; P424-S426 WeakPolarHBondContact CG-O 3.47Å; P424-S426 PolarHBondContact O-N 3.37Å; P424-E428 VanDerWaalsContact CB-CD 3.49Å; P424-E428 HydrophobicContact CB-CG 3.7Å; P424-E428 WeakPolarHBondContact CB-OE1 3.28Å; P424-E428 HydrophobicContact CG-CB 4.43Å; P424-E428 HydrophobicContact CG-CG 3.88Å
425	Q	85.5	Confident	91.2	Very high	129 Å²	129	48.9 Å²	48.9	60%	0.603	31%	0.314	S	S	*	.	S	Bend	trans	-70.5	-19.4	-176.1	-65.6	-173	-24.7	0	0	114
426	S	91.2	Very high	91.1	Very high	39 Å²	39	47.4 Å²	47.4	27%	0.273	31%	0.305	S	S	.	.	S	Bend	trans	-136.1	167.5	168	70.1	0	0	0	0	108.3	P424 E428 G486	P424-S426 VanDerWaalsContact CB-O 3.3Å; P424-S426 WeakPolarHBondContact CB-O 3.32Å; P424-S426 WeakPolarHBondContact CG-O 3.47Å; P424-S426 PolarHBondContact O-N 3.37Å; S426-E428 PolarHBondContact O-N 3.41Å; S426-G486 PolarHBondContact OG-N 2.8Å
427	G	93.5	Very high	90.9	Very high	4 Å²	4	47.3 Å²	47.3	4%	0.041	29%	0.294	C	S	.	.			trans	-71.5	132.7	179.3	0	0	0	0	0	111.9	V414 D485 G486 F487	V414-G427 CarbonylContact O-C 3.53Å; V414-G427 WeakPolarHBondContact O-CA 3.3Å; G427-D485 CarbonylContact O-C 3.49Å; G427-G486 PolarHBondContact O-N 2.95Å; G427-F487 VanDerWaalsContact CA-O 3.27Å; G427-F487 WeakPolarHBondContact CA-O 3.44Å; G427-F487 PolarHBondContact O-N 2.93Å
428	E	96.2	Very high	90.6	Very high	57 Å²	57	49.6 Å²	49.6	27%	0.266	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	131.6	-176.4	-66.2	-179.7	173.1	0	0	112	Y413 V414 P424 S426 H430 V483 Y484	Y413-E428 CarbonylContact C-O 3.56Å; Y413-E428 WeakPolarHBondContact CA-O 3.31Å; Y413-E428 VanDerWaalsContact CD2-O 3.27Å; Y413-E428 WeakPolarHBondContact CD2-O 3.49Å; V414-E428 HydrophobicContact CB-CB 4.33Å; V414-E428 PolarHBondContact N-O 3.48Å; V414-E428 PolarHBondContact O-N 2.96Å; P424-E428 VanDerWaalsContact CB-CD 3.49Å; P424-E428 HydrophobicContact CB-CG 3.7Å; P424-E428 WeakPolarHBondContact CB-OE1 3.28Å; P424-E428 HydrophobicContact CG-CB 4.43Å; P424-E428 HydrophobicContact CG-CG 3.88Å; S426-E428 PolarHBondContact O-N 3.41Å; E428-H430 IonicContact OE2-CD2 3.87Å; E428-H430 IonicContact OE2-CE1 2.83Å; E428-H430 PolarHBondContact OE2-CE1 3.19Å; E428-H430 IonicContact OE2-NE2 3.9Å; E428-H430 PolarHBondContact OE2-NE2 2.83Å; E428-V483 HydrophobicContact CB-CG1 4.08Å; E428-V483 HydrophobicContact CG-CG1 4.31Å; E428-Y484 CarbonylContact C-O 3.37Å; E428-Y484 WeakPolarHBondContact CA-O 3.43Å
429	L	96.8	Very high	90.4	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	113.6	173.1	179.7	63.4	0	0	0	110.2	F431 V455 V483 Y484 L492 W542 L545	L429-F431 HydrophobicContact CB-CE2 4.47Å; L429-F431 HydrophobicContact CD1-CZ 4.45Å; L429-F431 HydrophobicContact CD2-CE1 4.42Å; L429-F431 HydrophobicContact CD2-CE2 3.66Å; L429-F431 HydrophobicContact CD2-CZ 3.39Å; L429-F431 HydrophobicContact CG-CD2 4.41Å; L429-F431 HydrophobicContact CG-CE2 3.59Å; L429-F431 HydrophobicContact CG-CZ 3.69Å; L429-V455 HydrophobicContact CD2-CG2 4.38Å; L429-V483 WeakPolarHBondContact O-CA 3.33Å; L429-Y484 PolarHBondContact N-O 3.04Å; L429-Y484 PolarHBondContact O-N 3.49Å; L429-L492 HydrophobicContact CD2-CD2 3.9Å; L429-W542 HydrophobicContact CD1-CZ3 4.43Å; L429-W542 HydrophobicContact CD2-CH2 3.65Å; L429-W542 HydrophobicContact CD2-CZ3 4.13Å; L429-L545 HydrophobicContact CD1-CD2 3.74Å
430	H	97.7	Very high	90.2	Very high	27 Å²	27	46.1 Å²	46.1	13%	0.125	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	132.3	-175.6	-67.9	-120.5	0	0	0	111.1	L411 K412 E428 W552	L411-H430 WeakPolarHBondContact CA-O 3.43Å; K412-H430 HydrophobicContact CB-CB 4.14Å; K412-H430 PolarHBondContact N-O 3.37Å; K412-H430 WeakPolarHBondContact O-CB 3.42Å; K412-H430 PolarHBondContact O-N 2.75Å; E428-H430 IonicContact OE2-CD2 3.87Å; E428-H430 IonicContact OE2-CE1 2.83Å; E428-H430 PolarHBondContact OE2-CE1 3.19Å; E428-H430 IonicContact OE2-NE2 3.9Å; E428-H430 PolarHBondContact OE2-NE2 2.83Å; H430-W552 HydrophobicContact CB-CH2 3.71Å; H430-W552 HydrophobicContact CB-CZ3 4.02Å
431	F	98	Very high	90.1	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	103.3	175.3	-58.2	-93.9	0	0	0	109.7	L411 L429 V433 V455 T481 M482 Y484 A497 L499 L517	L411-F431 HydrophobicContact CD2-CD1 3.34Å; L411-F431 HydrophobicContact CD2-CE1 3.74Å; L411-F431 HydrophobicContact CD2-CG 4.25Å; L429-F431 HydrophobicContact CB-CE2 4.47Å; L429-F431 HydrophobicContact CD1-CZ 4.45Å; L429-F431 HydrophobicContact CD2-CE1 4.42Å; L429-F431 HydrophobicContact CD2-CE2 3.66Å; L429-F431 HydrophobicContact CD2-CZ 3.39Å; L429-F431 HydrophobicContact CG-CD2 4.41Å; L429-F431 HydrophobicContact CG-CE2 3.59Å; L429-F431 HydrophobicContact CG-CZ 3.69Å; F431-V433 PolarHBondContact O-N 3.12Å; F431-V455 HydrophobicContact CE2-CG2 4.02Å; F431-V455 HydrophobicContact CZ-CG2 4.02Å; F431-T481 CarbonylContact O-C 3.59Å; F431-T481 VanDerWaalsContact O-CA 3.29Å; F431-T481 WeakPolarHBondContact O-CA 3.48Å; F431-M482 HydrophobicContact CB-CB 4.42Å; F431-M482 HydrophobicContact CB-CE 4.43Å; F431-M482 PolarHBondContact N-O 2.66Å; F431-M482 PolarHBondContact O-N 2.81Å; F431-Y484 AromaticContact CD2-CD2 3.81Å; F431-Y484 HydrophobicContact CD2-CD2 3.81Å; F431-Y484 AromaticContact CD2-CE2 3.97Å; F431-Y484 HydrophobicContact CD2-CE2 3.97Å; F431-Y484 AromaticContact CE2-CD2 3.5Å; F431-Y484 HydrophobicContact CE2-CD2 3.5Å; F431-Y484 AromaticContact CE2-CE2 3.81Å; F431-Y484 HydrophobicContact CE2-CE2 3.81Å; F431-Y484 HydrophobicContact CE2-CG 4.44Å; F431-A497 HydrophobicContact CE1-CB 3.44Å; F431-A497 VanDerWaalsContact CE1-CB 3.44Å; F431-A497 HydrophobicContact CZ-CB 3.36Å; F431-L499 HydrophobicContact CD1-CD1 4.05Å; F431-L499 HydrophobicContact CD1-CD2 4.4Å; F431-L499 HydrophobicContact CE1-CD1 4.02Å; F431-L517 HydrophobicContact CE1-CD1 4.25Å
432	W	98.3	Very high	89.7	Confident	95 Å²	95	41.3 Å²	41.3	36%	0.36	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	99.5	170.5	177.4	21.8	0	0	0	109.4	L409 S410 K434 W552	L409-W432 CarbonylContact C-O 3.58Å; L409-W432 WeakPolarHBondContact CA-O 3.4Å; L409-W432 WeakPolarHBondContact CB-O 3.36Å; S410-W432 PolarHBondContact N-O 3.31Å; S410-W432 PolarHBondContact O-N 2.6Å; W432-K434 HydrophobicContact CD2-CG 4.23Å; W432-K434 HydrophobicContact CG-CG 4.5Å; W432-K434 HydrophobicContact CZ2-CG 4.36Å; W432-K434 PolarHBondContact O-N 2.89Å; W432-W552 HydrophobicContact CB-CH2 3.96Å; W432-W552 HydrophobicContact CB-CZ3 3.79Å
433	V	97.9	Very high	89.2	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	113.3	176.2	-179.4	0	0	0	0	108.6	L407 F431 I451 T467 F478 N479 H480 M482 L499	L407-V433 HydrophobicContact CD1-CG1 4.16Å; F431-V433 PolarHBondContact O-N 3.12Å; V433-I451 HydrophobicContact CG1-CB 4.36Å; V433-I451 HydrophobicContact CG1-CG1 4.08Å; V433-I451 HydrophobicContact CG1-CG2 4.4Å; V433-I451 HydrophobicContact CG2-CG2 4.27Å; V433-T467 HydrophobicContact CG1-CG2 4.46Å; V433-F478 HydrophobicContact CG1-CB 4.07Å; V433-F478 HydrophobicContact CG1-CD2 3.86Å; V433-F478 HydrophobicContact CG1-CG 4.22Å; V433-N479 CarbonylContact O-C 3.58Å; V433-N479 VanDerWaalsContact O-CA 3.3Å; V433-N479 WeakPolarHBondContact O-CA 3.32Å; V433-N479 PolarHBondContact O-N 2.99Å; V433-N479 VanDerWaalsContact O-N 3.13Å; V433-H480 PolarHBondContact N-O 2.79Å; V433-H480 PolarHBondContact O-N 2.96Å; V433-M482 HydrophobicContact CG2-CE 3.52Å; V433-L499 HydrophobicContact CG2-CD2 3.89Å
434	K	97.4	Very high	88.4	Confident	33 Å²	33	47.9 Å²	47.9	14%	0.143	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	-67.8	-175.2	-61.8	170.9	-179.3	167.7	0	110.4	S408 S410 W432 F478 N479 D554	S408-K434 WeakPolarHBondContact O-CB 3.43Å; S408-K434 PolarHBondContact O-N 2.81Å; S410-K434 WeakPolarHBondContact OG-CE 3.19Å; S410-K434 PolarHBondContact OG-NZ 3.36Å; W432-K434 HydrophobicContact CD2-CG 4.23Å; W432-K434 HydrophobicContact CG-CG 4.5Å; W432-K434 HydrophobicContact CZ2-CG 4.36Å; W432-K434 PolarHBondContact O-N 2.89Å; K434-F478 PolarHBondContact O-N 3.45Å; K434-N479 PolarHBondContact O-N 3.32Å; K434-D554 IonicContact NZ-OD1 3.58Å; K434-D554 PolarHBondContact NZ-OD1 2.77Å; K434-D554 IonicContact NZ-OD2 2.67Å; K434-D554 PolarHBondContact NZ-OD2 2.64Å; K434-D554 VanDerWaalsContact NZ-OD2 3.11Å
435	E	96	Very high	87.6	Confident	70 Å²	70	50.2 Å²	50.2	33%	0.327	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159	165.1	-173.9	64.1	-170.6	156.6	0	0	111.4	S408 P476 V477	S408-E435 PolarHBondContact N-O 3.09Å; S408-E435 PolarHBondContact O-N 2.98Å; E435-P476 CarbonylContact C-O 3.47Å; E435-P476 VanDerWaalsContact CA-O 3.23Å; E435-P476 WeakPolarHBondContact CA-O 3.27Å; E435-P476 WeakPolarHBondContact CB-O 3.17Å; E435-V477 HydrophobicContact CB-CB 4.42Å; E435-V477 HydrophobicContact CB-CG2 4.14Å
436	A	93.8	Very high	87	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	149.6	160.2	0	0	0	0	0	110.1	L406 L407 L439 S475 P476 F478 L559	L406-A436 CarbonylContact O-C 3.56Å; L406-A436 VanDerWaalsContact O-CA 3.23Å; L406-A436 WeakPolarHBondContact O-CA 3.49Å; L407-A436 HydrophobicContact CD1-CB 4.16Å; A436-L439 HydrophobicContact CB-CD1 4.48Å; A436-L439 HydrophobicContact CB-CD2 3.97Å; A436-L439 HydrophobicContact CB-CG 4.41Å; A436-S475 CarbonylContact O-C 3.51Å; A436-S475 WeakPolarHBondContact O-CA 3.29Å; A436-P476 HydrophobicContact CB-CG 4.06Å; A436-P476 PolarHBondContact N-O 3.24Å; A436-P476 VanDerWaalsContact O-CD 3.28Å; A436-P476 WeakPolarHBondContact O-CD 3.39Å; A436-F478 HydrophobicContact CB-CE2 4.2Å; A436-L559 HydrophobicContact CB-CD1 4.08Å
437	Q	88.9	Confident	86.6	Confident	61 Å²	61	45.8 Å²	45.8	29%	0.285	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	155.8	-174.3	65.9	-178.3	35.7	0	0	111.8	L406 L439	L406-Q437 HydrophobicContact CB-CG 3.81Å; L406-Q437 HydrophobicContact CD1-CG 4.46Å; L406-Q437 PolarHBondContact N-O 2.99Å; L406-Q437 PolarHBondContact O-N 3.42Å; Q437-L439 VanDerWaalsContact C-N 3.3Å; Q437-L439 PolarHBondContact O-N 2.97Å
438	S	85.1	Confident	86.6	Confident	87 Å²	87	47.2 Å²	47.2	61%	0.608	26%	0.263	S	S	*	.	S	Bend	trans	55.4	40.9	-180	-57.1	0	0	0	0	113.4	V440	S438-V440 PolarHBondContact O-N 3.36Å
439	L	85.8	Confident	86.5	Confident	11 Å²	11	44.5 Å²	44.5	6%	0.058	25%	0.25	C	S	.	.			trans	-68	129.8	-176.6	-65.8	-174.5	0	0	0	112.6	R404 A436 Q437 P441 L447 T449 L474 P476 L501 L559	R404-L439 CarbonylContact O-C 3.53Å; R404-L439 VanDerWaalsContact O-CA 3.3Å; R404-L439 WeakPolarHBondContact O-CA 3.35Å; A436-L439 HydrophobicContact CB-CD1 4.48Å; A436-L439 HydrophobicContact CB-CD2 3.97Å; A436-L439 HydrophobicContact CB-CG 4.41Å; Q437-L439 VanDerWaalsContact C-N 3.3Å; Q437-L439 PolarHBondContact O-N 2.97Å; L439-P441 WeakPolarHBondContact O-CD 3.41Å; L439-L447 HydrophobicContact CB-CD1 4.11Å; L439-L447 HydrophobicContact CD1-CD1 4.08Å; L439-T449 HydrophobicContact CD1-CG2 4.18Å; L439-L474 HydrophobicContact CB-CB 4.47Å; L439-L474 VanDerWaalsContact CB-O 3.29Å; L439-L474 WeakPolarHBondContact CB-O 3.44Å; L439-L474 VanDerWaalsContact CG-O 3.3Å; L439-L474 WeakPolarHBondContact CG-O 3.13Å; L439-L474 PolarHBondContact N-O 3.32Å; L439-P476 VanDerWaalsContact CD1-CD 3.44Å; L439-P476 HydrophobicContact CD1-CG 3.69Å; L439-L501 HydrophobicContact CD1-CD2 3.8Å; L439-L501 HydrophobicContact CD2-CD2 3.52Å; L439-L501 HydrophobicContact CG-CD2 4.34Å; L439-L559 HydrophobicContact CD2-CD1 3.63Å
440	V	81.8	Confident	86.6	Confident	57 Å²	57	45.2 Å²	45.2	35%	0.345	25%	0.253	S	S	.	.			trans	-94.1	112.6	171.4	-174	0	0	0	0	109	L401 R404 S438	L401-V440 HydrophobicContact CD2-CB 4.22Å; L401-V440 HydrophobicContact CD2-CG1 3.9Å; L401-V440 HydrophobicContact CD2-CG2 3.99Å; R404-V440 HydrophobicContact CB-CB 4.27Å; R404-V440 PolarHBondContact O-N 2.99Å; S438-V440 PolarHBondContact O-N 3.36Å
441	P	78	Confident	86.6	Confident	36 Å²	36	43.9 Å²	43.9	23%	0.234	25%	0.247	C	C	.	.			trans	-78.2	143.6	-175.9	32.7	-36.5	0	0	0	112.3	L439 R443 L447 L474	L439-P441 WeakPolarHBondContact O-CD 3.41Å; P441-R443 WeakPolarHBondContact CB-O 3.17Å; P441-R443 PolarHBondContact O-N 3.16Å; P441-L447 HydrophobicContact CB-CD1 3.97Å; P441-L447 HydrophobicContact CB-CD2 3.7Å; P441-L447 HydrophobicContact CB-CG 3.84Å; P441-L474 HydrophobicContact CB-CD2 4.29Å; P441-L474 HydrophobicContact CG-CD2 4.3Å
442	L	72.1	Confident	86.5	Confident	22 Å²	22	45.2 Å²	45.2	12%	0.115	25%	0.253	C	S	.	.	S	Bend	trans	-60.2	-24.2	174.8	-94.2	172	0	0	0	114.1	P398 R404 R510 L512	P398-L442 HydrophobicContact CB-CD2 3.94Å; R404-L442 VanDerWaalsContact NH2-CD2 3.29Å; L442-R510 HydrophobicContact CD1-CB 3.85Å; L442-L512 HydrophobicContact CB-CD2 4.24Å; L442-L512 HydrophobicContact CD1-CD2 3.89Å; L442-L512 HydrophobicContact CG-CD2 3.86Å
443	R	70	Confident	86.5	Confident	135 Å²	135	40.7 Å²	40.7	51%	0.509	24%	0.236	S	C	.	.	S	Bend	trans	-145.6	148.8	-175.1	-67.3	170.6	-70.8	168.7	0.9	108.7	P441 G445 D503	P441-R443 WeakPolarHBondContact CB-O 3.17Å; P441-R443 PolarHBondContact O-N 3.16Å; R443-G445 PolarHBondContact O-N 2.58Å; R443-D503 IonicContact CZ-OD2 2.98Å; R443-D503 IonicContact NH2-OD2 2.74Å; R443-D503 PolarHBondContact NH2-OD2 2.89Å
444	P	66.5	Low	86.4	Confident	139 Å²	139	40.7 Å²	40.7	90%	0.903	24%	0.236	S	C	*	.	S	Bend	trans	-57.6	123.8	173.3	-23.6	34.2	0	0	0	111.6
445	G	68.3	Low	86.4	Confident	52 Å²	52	39.3 Å²	39.3	54%	0.536	23%	0.23	S	C	.	.	S	Bend	trans	146.5	178.8	-177.8	0	0	0	0	0	112.6	R443	R443-G445 PolarHBondContact O-N 2.58Å
446	S	73.1	Confident	86.3	Confident	71 Å²	71	36.1 Å²	36.1	50%	0.497	22%	0.215	S	C	.	.			trans	-85.4	139.9	172.2	63.7	0	0	0	0	111
447	L	84.2	Confident	86.3	Confident	5 Å²	5	39.5 Å²	39.5	3%	0.026	24%	0.237	C	C	.	.			trans	-89.2	141.9	-179.6	-60.7	168.6	0	0	0	112.4	L439 P441 T449 R472 S473 L474 D503 L512	L439-L447 HydrophobicContact CB-CD1 4.11Å; L439-L447 HydrophobicContact CD1-CD1 4.08Å; P441-L447 HydrophobicContact CB-CD1 3.97Å; P441-L447 HydrophobicContact CB-CD2 3.7Å; P441-L447 HydrophobicContact CB-CG 3.84Å; L447-T449 HydrophobicContact CB-CG2 3.56Å; L447-T449 HydrophobicContact CD1-CG2 4.24Å; L447-R472 CarbonylContact O-C 3.5Å; L447-R472 VanDerWaalsContact O-CA 3.25Å; L447-R472 WeakPolarHBondContact O-CA 3.2Å; L447-R472 PolarHBondContact O-N 3.48Å; L447-S473 PolarHBondContact O-N 3.43Å; L447-L474 HydrophobicContact CD1-CD2 3.73Å; L447-L474 HydrophobicContact CG-CD2 3.86Å; L447-D503 HydrophobicContact CD2-CB 4.28Å; L447-L512 HydrophobicContact CD1-CD1 3.8Å; L447-L512 HydrophobicContact CD2-CD1 4.35Å; L447-L512 HydrophobicContact CD2-CD2 4.43Å
448	D	92.4	Very high	86.4	Confident	34 Å²	34	40.1 Å²	40.1	18%	0.182	24%	0.243	C	C	.	.			trans	-103.7	100.2	167.2	-86.2	17.9	0	0	0	107.9	V469 V470 R471 R472 H504	D448-V469 HydrophobicContact CB-CG1 4.11Å; D448-V470 CarbonylContact C-O 3.53Å; D448-R471 HydrophobicContact CB-CG 4.41Å; D448-R471 VanDerWaalsContact OD1-CA 3.22Å; D448-R471 WeakPolarHBondContact OD1-CA 3.44Å; D448-R471 VanDerWaalsContact OD1-CB 3.32Å; D448-R471 WeakPolarHBondContact OD1-CB 3.29Å; D448-R471 VanDerWaalsContact OD2-CD 3.22Å; D448-R471 WeakPolarHBondContact OD2-CD 3.2Å; D448-R471 VanDerWaalsContact OD2-CG 3.26Å; D448-R471 WeakPolarHBondContact OD2-CG 3.22Å; D448-R471 IonicContact OD2-NE 2.74Å; D448-R471 PolarHBondContact OD2-NE 2.88Å; D448-R472 PolarHBondContact OD1-N 3.5Å; D448-H504 HydrophobicContact CB-CB 4.31Å; D448-H504 VanDerWaalsContact O-CB 3.24Å; D448-H504 WeakPolarHBondContact O-CB 3.01Å; D448-H504 PolarHBondContact O-N 2.9Å
449	T	95.1	Very high	86.5	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	150.2	-163.1	61.3	0	0	0	0	115.2	L439 L447 V469 V470 P476 W502 L512	L439-T449 HydrophobicContact CD1-CG2 4.18Å; L447-T449 HydrophobicContact CB-CG2 3.56Å; L447-T449 HydrophobicContact CD1-CG2 4.24Å; T449-V469 CarbonylContact O-C 3.31Å; T449-V469 VanDerWaalsContact O-CA 3.26Å; T449-V469 WeakPolarHBondContact O-CA 3.49Å; T449-V470 PolarHBondContact N-O 3.1Å; T449-V470 PolarHBondContact O-N 3.21Å; T449-P476 VanDerWaalsContact OG1-CB 3.24Å; T449-P476 WeakPolarHBondContact OG1-CB 3.49Å; T449-P476 VanDerWaalsContact OG1-CG 3.3Å; T449-P476 WeakPolarHBondContact OG1-CG 3.42Å; T449-W502 VanDerWaalsContact CA-O 3.23Å; T449-W502 WeakPolarHBondContact CA-O 3.47Å; T449-L512 HydrophobicContact CG2-CD1 4.09Å
450	Y	97.5	Very high	86.8	Confident	14 Å²	14	41.8 Å²	41.8	6%	0.055	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	153.9	163.4	65.5	-85.1	0	0	0	111.5	Q452 R466 V469 W502 H504 S509	Y450-Q452 HydrophobicContact CD2-CB 4.47Å; Y450-Q452 HydrophobicContact CE2-CB 4.21Å; Y450-R466 HydrophobicContact CD2-CB 4.33Å; Y450-V469 HydrophobicContact CD1-CG2 4.02Å; Y450-V469 HydrophobicContact CG-CG2 4.44Å; Y450-W502 HydrophobicContact CD1-CB 4.02Å; Y450-W502 HydrophobicContact CD2-CB 4.24Å; Y450-W502 HydrophobicContact CE1-CB 3.56Å; Y450-W502 HydrophobicContact CE1-CG 4.37Å; Y450-W502 HydrophobicContact CE2-CB 3.79Å; Y450-W502 AromaticContact CE2-CD1 3.89Å; Y450-W502 AromaticContact CE2-CG 3.83Å; Y450-W502 HydrophobicContact CE2-CG 3.83Å; Y450-W502 HydrophobicContact CG-CB 4.35Å; Y450-W502 VanDerWaalsContact CZ-CB 3.41Å; Y450-W502 AromaticContact CZ-CG 3.73Å; Y450-W502 PolarHBondContact N-O 3.41Å; Y450-W502 PolarHBondContact O-N 2.7Å; Y450-H504 HydrophobicContact CD1-CB 4.15Å; Y450-H504 HydrophobicContact CE1-CB 4.1Å; Y450-S509 VanDerWaalsContact OH-CB 3.28Å; Y450-S509 WeakPolarHBondContact OH-CB 3.15Å; Y450-S509 PolarHBondContact OH-OG 2.93Å
451	I	98	Very high	87.2	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	135.6	169.1	-70.6	-78.6	0	0	0	108.9	L407 V433 R466 T467 F478 M482 L499 S500 L501	L407-I451 HydrophobicContact CD1-CD1 3.65Å; L407-I451 HydrophobicContact CD1-CG1 4.08Å; L407-I451 HydrophobicContact CD2-CD1 3.96Å; L407-I451 HydrophobicContact CG-CD1 4.48Å; V433-I451 HydrophobicContact CG1-CB 4.36Å; V433-I451 HydrophobicContact CG1-CG1 4.08Å; V433-I451 HydrophobicContact CG1-CG2 4.4Å; V433-I451 HydrophobicContact CG2-CG2 4.27Å; I451-R466 CarbonylContact O-C 3.56Å; I451-R466 WeakPolarHBondContact O-CA 3.33Å; I451-R466 WeakPolarHBondContact O-CB 3.3Å; I451-T467 HydrophobicContact CB-CG2 3.78Å; I451-T467 HydrophobicContact CG2-CG2 4.39Å; I451-T467 PolarHBondContact N-OG1 3.47Å; I451-T467 PolarHBondContact O-N 3.44Å; I451-F478 HydrophobicContact CG1-CD2 4.14Å; I451-F478 HydrophobicContact CG1-CE2 3.77Å; I451-F478 HydrophobicContact CG1-CZ 4.03Å; I451-M482 HydrophobicContact CG2-CE 4.41Å; I451-L499 HydrophobicContact CG2-CB 4.47Å; I451-L499 HydrophobicContact CG2-CD2 4.42Å; I451-S500 CarbonylContact C-O 3.55Å; I451-S500 WeakPolarHBondContact CA-O 3.49Å; I451-L501 HydrophobicContact CD1-CB 3.78Å; I451-L501 HydrophobicContact CD1-CD1 3.64Å; I451-L501 HydrophobicContact CD1-CG 4.32Å; I451-L501 HydrophobicContact CG1-CD1 3.87Å
452	Q	97.3	Very high	87.7	Confident	28 Å²	28	53 Å²	53	13%	0.131	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	128.4	169.7	178.3	-173.6	-97.9	0	0	109	Y450 Q465 R466 S500	Y450-Q452 HydrophobicContact CD2-CB 4.47Å; Y450-Q452 HydrophobicContact CE2-CB 4.21Å; Q452-Q465 WeakPolarHBondContact CA-O 3.42Å; Q452-R466 HydrophobicContact CB-CB 4.43Å; Q452-S500 PolarHBondContact N-O 2.74Å; Q452-S500 PolarHBondContact O-N 3.33Å; Q452-S500 PolarHBondContact O-OG 2.98Å
453	C	97.6	Very high	88.6	Confident	0 Å²	0	53 Å²	53	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	154.2	177.2	-175.1	0	0	0	0	110.9	R464 Q465 M482 Y484 E498 L499	C453-R464 WeakPolarHBondContact O-CA 3.45Å; C453-Q465 PolarHBondContact N-O 3.06Å; C453-M482 HydrophobicContact CB-CE 3.71Å; C453-M482 HydrophobicContact CB-SD 3.74Å; C453-Y484 VanDerWaalsContact C-OH 3.28Å; C453-Y484 HydrophobicContact CB-CE2 4.37Å; C453-Y484 WeakPolarHBondContact CB-OH 3.4Å; C453-Y484 PolarHBondContact O-OH 2.89Å; C453-Y484 PolarHBondContact SG-OH 2.87Å; C453-Y484 VanDerWaalsContact SG-OH 3.4Å; C453-E498 CarbonylContact C-O 3.59Å; C453-E498 VanDerWaalsContact CA-O 3.31Å; C453-E498 WeakPolarHBondContact CA-O 3.39Å; C453-L499 HydrophobicContact CB-CG 4.39Å
454	S	95.8	Very high	89.8	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	141.4	169.3	-45.7	0	0	0	0	108.2	R464 A497 E498 R566	S454-R464 WeakPolarHBondContact OG-CD 3.06Å; S454-R464 WeakPolarHBondContact OG-CG 3.4Å; S454-A497 CarbonylContact O-C 3.54Å; S454-A497 WeakPolarHBondContact O-CA 3.06Å; S454-E498 PolarHBondContact N-O 3.06Å; S454-E498 PolarHBondContact O-N 3.28Å; S454-R566 PolarHBondContact OG-NH2 3.26Å
455	V	96.2	Very high	91.3	Very high	3 Å²	3	47 Å²	47	2%	0.018	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	94.7	173.3	-175	0	0	0	0	108.8	L429 F431 D458 Y484 F487 A495 A497	L429-V455 HydrophobicContact CD2-CG2 4.38Å; F431-V455 HydrophobicContact CE2-CG2 4.02Å; F431-V455 HydrophobicContact CZ-CG2 4.02Å; V455-D458 PolarHBondContact O-N 2.82Å; V455-D458 VanDerWaalsContact O-N 3.12Å; V455-Y484 HydrophobicContact CB-CD1 4.21Å; V455-Y484 HydrophobicContact CB-CE1 4.35Å; V455-Y484 HydrophobicContact CG2-CD1 3.69Å; V455-Y484 HydrophobicContact CG2-CD2 3.88Å; V455-Y484 HydrophobicContact CG2-CE1 3.82Å; V455-Y484 HydrophobicContact CG2-CE2 3.99Å; V455-Y484 HydrophobicContact CG2-CG 3.71Å; V455-F487 HydrophobicContact CB-CZ 3.98Å; V455-F487 HydrophobicContact CG1-CE1 3.61Å; V455-F487 HydrophobicContact CG1-CE2 4.21Å; V455-F487 HydrophobicContact CG1-CZ 3.42Å; V455-F487 VanDerWaalsContact CG1-CZ 3.42Å; V455-A495 HydrophobicContact CG1-CB 4.12Å; V455-A497 HydrophobicContact CG2-CB 4.32Å
456	L	95	Very high	92.6	Very high	3 Å²	3	52.2 Å²	52.2	2%	0.016	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	141.8	-177.3	-54.7	179.9	0	0	0	110.3	D459 A495 C496 E498 W531	L456-D459 HydrophobicContact CD2-CB 4.11Å; L456-A495 VanDerWaalsContact O-CA 3.22Å; L456-A495 WeakPolarHBondContact O-CA 3.29Å; L456-A495 WeakPolarHBondContact O-CB 3.33Å; L456-C496 HydrophobicContact CB-CB 4.26Å; L456-C496 WeakPolarHBondContact CB-O 3.39Å; L456-C496 PolarHBondContact N-O 2.9Å; L456-C496 PolarHBondContact O-N 3.5Å; L456-E498 HydrophobicContact CD1-CB 4.45Å; L456-W531 HydrophobicContact CB-CD2 4.26Å; L456-W531 HydrophobicContact CB-CE3 3.81Å; L456-W531 HydrophobicContact CB-CH2 3.65Å; L456-W531 HydrophobicContact CB-CZ2 4.12Å; L456-W531 HydrophobicContact CB-CZ3 3.49Å; L456-W531 VanDerWaalsContact CB-CZ3 3.49Å; L456-W531 HydrophobicContact CD1-CB 4.1Å; L456-W531 HydrophobicContact CD1-CD2 3.66Å; L456-W531 HydrophobicContact CD1-CE3 3.6Å; L456-W531 HydrophobicContact CD1-CG 3.91Å; L456-W531 HydrophobicContact CD1-CZ3 4.21Å; L456-W531 HydrophobicContact CG-CE3 4.35Å; L456-W531 HydrophobicContact CG-CZ3 4.5Å
457	P	92.7	Very high	93.8	Very high	72 Å²	72	49.2 Å²	49.2	47%	0.468	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	cis	-79.7	-5	15.5	31.3	-37.4	0	0	0	117	D459 Y525 W531	P457-D459 PolarHBondContact O-N 2.74Å; P457-Y525 HydrophobicContact CG-CD2 3.9Å; P457-Y525 HydrophobicContact CG-CE2 3.97Å; P457-W531 HydrophobicContact CB-CH2 4.13Å; P457-W531 HydrophobicContact CB-CZ2 4.06Å
458	D	91.8	Very high	94.4	Very high	74 Å²	74	59.3 Å²	59.3	40%	0.396	28%	0.284	S	S	.	.	B	Isolated β-bridge	trans	-77	104.9	176.2	-170.8	-23.5	0	0	0	111.4	V455 S460 S463	V455-D458 PolarHBondContact O-N 2.82Å; V455-D458 VanDerWaalsContact O-N 3.12Å; D458-S460 WeakPolarHBondContact OD1-CA 3.34Å; D458-S460 WeakPolarHBondContact OD1-CB 3.24Å; D458-S460 PolarHBondContact OD1-N 3.44Å; D458-S460 PolarHBondContact OD1-OG 3.38Å; D458-S463 VanDerWaalsContact CG-CB 3.41Å; D458-S463 VanDerWaalsContact CG-OG 3.24Å; D458-S463 VanDerWaalsContact OD1-CB 3.24Å; D458-S463 WeakPolarHBondContact OD1-CB 3.22Å; D458-S463 PolarHBondContact OD1-OG 2.77Å; D458-S463 WeakPolarHBondContact OD2-CB 2.93Å
459	D	88	Confident	94.6	Very high	88 Å²	88	60.1 Å²	60.1	47%	0.471	29%	0.29	S	S	.	.			trans	-103.2	7.9	170.6	75.9	-17.7	0	0	0	114.6	L456 P457 R464	L456-D459 HydrophobicContact CD2-CB 4.11Å; P457-D459 PolarHBondContact O-N 2.74Å; D459-R464 WeakPolarHBondContact O-CD 3.48Å; D459-R464 PolarHBondContact O-NE 3.13Å
460	S	90.7	Very high	94.6	Very high	44 Å²	44	61.7 Å²	61.7	31%	0.308	30%	0.3	S	S	.	.			trans	-58.4	156.1	-169.9	75.6	0	0	0	0	112.5	D458 A462 S463 R464	D458-S460 WeakPolarHBondContact OD1-CA 3.34Å; D458-S460 WeakPolarHBondContact OD1-CB 3.24Å; D458-S460 PolarHBondContact OD1-N 3.44Å; D458-S460 PolarHBondContact OD1-OG 3.38Å; S460-A462 PolarHBondContact O-N 2.88Å; S460-A462 PolarHBondContact OG-N 3.31Å; S460-S463 PolarHBondContact N-OG 2.75Å; S460-S463 PolarHBondContact O-N 3.09Å; S460-S463 PolarHBondContact O-OG 2.7Å; S460-S463 PolarHBondContact OG-N 2.95Å; S460-S463 PolarHBondContact OG-OG 3.47Å; S460-R464 WeakPolarHBondContact O-CG 3.25Å; S460-R464 PolarHBondContact O-N 3.41Å
461	R	90.3	Very high	94.3	Very high	232 Å²	232	69.5 Å²	69.5	88%	0.875	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-10.6	176.6	-61.6	-164.3	178.7	-167.4	2	113.7
462	A	89.5	Confident	93.8	Very high	98 Å²	98	79 Å²	79	81%	0.81	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-37	-178.6	0	0	0	0	0	113.3	S460	S460-A462 PolarHBondContact O-N 2.88Å; S460-A462 PolarHBondContact OG-N 3.31Å
463	S	90.9	Very high	93.2	Very high	21 Å²	21	79.2 Å²	79.2	15%	0.147	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-36	179.1	60.8	0	0	0	0	113	D458 S460 Q465 Y484	D458-S463 VanDerWaalsContact CG-CB 3.41Å; D458-S463 VanDerWaalsContact CG-OG 3.24Å; D458-S463 VanDerWaalsContact OD1-CB 3.24Å; D458-S463 WeakPolarHBondContact OD1-CB 3.22Å; D458-S463 PolarHBondContact OD1-OG 2.77Å; D458-S463 WeakPolarHBondContact OD2-CB 2.93Å; S460-S463 PolarHBondContact N-OG 2.75Å; S460-S463 PolarHBondContact O-N 3.09Å; S460-S463 PolarHBondContact O-OG 2.7Å; S460-S463 PolarHBondContact OG-N 2.95Å; S460-S463 PolarHBondContact OG-OG 3.47Å; S463-Q465 PolarHBondContact O-N 3.14Å; S463-Y484 WeakPolarHBondContact O-CE1 3.44Å
464	R	94.8	Very high	92.7	Very high	89 Å²	89	82.7 Å²	82.7	34%	0.336	39%	0.388	S	S	.	.			trans	-64.6	114.4	-172.3	-66.1	-175.4	-53.1	169.3	14	113.4	C453 S454 D459 S460	C453-R464 WeakPolarHBondContact O-CA 3.45Å; S454-R464 WeakPolarHBondContact OG-CD 3.06Å; S454-R464 WeakPolarHBondContact OG-CG 3.4Å; D459-R464 WeakPolarHBondContact O-CD 3.48Å; D459-R464 PolarHBondContact O-NE 3.13Å; S460-R464 WeakPolarHBondContact O-CG 3.25Å; S460-R464 PolarHBondContact O-N 3.41Å
465	Q	97.5	Very high	92.3	Very high	60 Å²	60	85.9 Å²	85.9	28%	0.28	41%	0.41	S	S	.	.			trans	-93.6	156.9	174.2	-60.3	-179.3	46.5	0	0	111.4	Q452 C453 S463 M482 V483 Y484	Q452-Q465 WeakPolarHBondContact CA-O 3.42Å; C453-Q465 PolarHBondContact N-O 3.06Å; S463-Q465 PolarHBondContact O-N 3.14Å; Q465-M482 HydrophobicContact CB-CB 4.14Å; Q465-M482 HydrophobicContact CB-CG 3.78Å; Q465-M482 HydrophobicContact CB-SD 3.61Å; Q465-M482 VanDerWaalsContact OE1-CB 3.3Å; Q465-V483 PolarHBondContact NE2-O 2.87Å; Q465-Y484 HydrophobicContact CB-CE2 4.48Å; Q465-Y484 HydrophobicContact CG-CE1 4.5Å; Q465-Y484 HydrophobicContact CG-CE2 4.32Å; Q465-Y484 PolarHBondContact N-OH 2.93Å
466	R	97	Very high	92.2	Very high	161 Å²	161	85.8 Å²	85.8	61%	0.608	41%	0.409	S	S	*	.	B	Isolated β-bridge	trans	-149.4	149.6	178.5	65.3	177.1	179.6	171.5	-0.2	112.7	Y450 I451 Q452	Y450-R466 HydrophobicContact CD2-CB 4.33Å; I451-R466 CarbonylContact O-C 3.56Å; I451-R466 WeakPolarHBondContact O-CA 3.33Å; I451-R466 WeakPolarHBondContact O-CB 3.3Å; Q452-R466 HydrophobicContact CB-CB 4.43Å
467	T	97.8	Very high	92.2	Very high	8 Å²	8	89.1 Å²	89.1	5%	0.049	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-70	170.6	172.6	69.6	0	0	0	0	111.6	V433 I451 F478 H480	V433-T467 HydrophobicContact CG1-CG2 4.46Å; I451-T467 HydrophobicContact CB-CG2 3.78Å; I451-T467 HydrophobicContact CG2-CG2 4.39Å; I451-T467 PolarHBondContact N-OG1 3.47Å; I451-T467 PolarHBondContact O-N 3.44Å; T467-F478 HydrophobicContact CG2-CB 4.12Å; T467-F478 HydrophobicContact CG2-CD1 4.15Å; T467-F478 HydrophobicContact CG2-CG 4.2Å; T467-F478 WeakPolarHBondContact OG1-CD1 3.48Å; T467-H480 HydrophobicContact CG2-CB 4Å
468	R	96.8	Very high	92.4	Very high	216 Å²	216	86.7 Å²	86.7	82%	0.815	41%	0.412	S	S	*	.	P	Polyproline II helix	trans	-65.8	157.9	160.9	-64.3	-178.1	179.2	-178.6	0	110.2
469	V	96.8	Very high	92.6	Very high	51 Å²	51	88.1 Å²	88.1	31%	0.309	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-79.1	117.9	173.8	-175.2	0	0	0	0	109.6	D448 T449 Y450 R471 H504	D448-V469 HydrophobicContact CB-CG1 4.11Å; T449-V469 CarbonylContact O-C 3.31Å; T449-V469 VanDerWaalsContact O-CA 3.26Å; T449-V469 WeakPolarHBondContact O-CA 3.49Å; Y450-V469 HydrophobicContact CD1-CG2 4.02Å; Y450-V469 HydrophobicContact CG-CG2 4.44Å; V469-R471 HydrophobicContact CG1-CG 4.31Å; V469-H504 HydrophobicContact CG1-CB 4.08Å
470	V	94.1	Very high	93.1	Very high	34 Å²	34	87 Å²	87	21%	0.206	41%	0.411	C	S	.	.	B	Isolated β-bridge	trans	-91.5	111.3	173.3	-178.9	0	0	0	0	107.9	D448 T449 P476 V477 F478	D448-V470 CarbonylContact C-O 3.53Å; T449-V470 PolarHBondContact N-O 3.1Å; T449-V470 PolarHBondContact O-N 3.21Å; V470-P476 HydrophobicContact CB-CB 3.79Å; V470-P476 HydrophobicContact CG1-CB 3.63Å; V470-P476 HydrophobicContact CG2-CB 4.36Å; V470-V477 WeakPolarHBondContact CG2-O 3.39Å; V470-F478 HydrophobicContact CB-CD1 4.47Å; V470-F478 HydrophobicContact CB-CE1 4.13Å; V470-F478 HydrophobicContact CG2-CD1 3.5Å; V470-F478 VanDerWaalsContact CG2-CD1 3.5Å; V470-F478 HydrophobicContact CG2-CE1 3.64Å; V470-F478 HydrophobicContact CG2-CG 4.41Å
471	R	92.9	Very high	93.4	Very high	177 Å²	177	88 Å²	88	67%	0.668	42%	0.416	S	S	*	.			trans	-85	148	-171.7	-64.6	-162.1	170.7	151	0.6	113.3	D448 V469 S473	D448-R471 HydrophobicContact CB-CG 4.41Å; D448-R471 VanDerWaalsContact OD1-CA 3.22Å; D448-R471 WeakPolarHBondContact OD1-CA 3.44Å; D448-R471 VanDerWaalsContact OD1-CB 3.32Å; D448-R471 WeakPolarHBondContact OD1-CB 3.29Å; D448-R471 VanDerWaalsContact OD2-CD 3.22Å; D448-R471 WeakPolarHBondContact OD2-CD 3.2Å; D448-R471 VanDerWaalsContact OD2-CG 3.26Å; D448-R471 WeakPolarHBondContact OD2-CG 3.22Å; D448-R471 IonicContact OD2-NE 2.74Å; D448-R471 PolarHBondContact OD2-NE 2.88Å; V469-R471 HydrophobicContact CG1-CG 4.31Å; R471-S473 PolarHBondContact O-N 3.03Å
472	R	87	Confident	93.7	Very high	199 Å²	199	76.9 Å²	76.9	75%	0.751	37%	0.374	S	S	*	.	S	Bend	trans	50.4	41.8	171.1	-54.9	-177.8	180	175.1	-2.4	115.8	L447 D448	L447-R472 CarbonylContact O-C 3.5Å; L447-R472 VanDerWaalsContact O-CA 3.25Å; L447-R472 WeakPolarHBondContact O-CA 3.2Å; L447-R472 PolarHBondContact O-N 3.48Å; D448-R472 PolarHBondContact OD1-N 3.5Å
473	S	85.1	Confident	94.1	Very high	33 Å²	33	74.6 Å²	74.6	23%	0.231	35%	0.35	C	S	.	.			trans	-131.4	141.1	179.9	-170.4	0	0	0	0	114	L447 R471 S475	L447-S473 PolarHBondContact O-N 3.43Å; R471-S473 PolarHBondContact O-N 3.03Å; S473-S475 PolarHBondContact OG-N 3.01Å; S473-S475 PolarHBondContact OG-O 2.8Å
474	L	86.1	Confident	94.3	Very high	74 Å²	74	74.2 Å²	74.2	39%	0.387	35%	0.345	S	S	.	.	S	Bend	trans	-95.3	-4.2	166.6	-58.3	-178.4	0	0	0	112.8	L439 P441 L447	L439-L474 HydrophobicContact CB-CB 4.47Å; L439-L474 VanDerWaalsContact CB-O 3.29Å; L439-L474 WeakPolarHBondContact CB-O 3.44Å; L439-L474 VanDerWaalsContact CG-O 3.3Å; L439-L474 WeakPolarHBondContact CG-O 3.13Å; L439-L474 PolarHBondContact N-O 3.32Å; P441-L474 HydrophobicContact CB-CD2 4.29Å; P441-L474 HydrophobicContact CG-CD2 4.3Å; L447-L474 HydrophobicContact CD1-CD2 3.73Å; L447-L474 HydrophobicContact CG-CD2 3.86Å
475	S	88	Confident	94.2	Very high	67 Å²	67	75.3 Å²	75.3	47%	0.469	36%	0.357	S	S	.	.	S	Bend	trans	-131.7	71.9	168.5	-60.7	0	0	0	0	109.3	A436 S473 V477	A436-S475 CarbonylContact O-C 3.51Å; A436-S475 WeakPolarHBondContact O-CA 3.29Å; S473-S475 PolarHBondContact OG-N 3.01Å; S473-S475 PolarHBondContact OG-O 2.8Å; S475-V477 PolarHBondContact O-N 3.12Å
476	P	92.8	Very high	94	Very high	0 Å²	0	75 Å²	75	0%	0	37%	0.371	C	S	.	.			trans	-75.7	121.9	-176.1	29.9	-36.8	0	0	0	112.2	E435 A436 L439 T449 V470 F478	E435-P476 CarbonylContact C-O 3.47Å; E435-P476 VanDerWaalsContact CA-O 3.23Å; E435-P476 WeakPolarHBondContact CA-O 3.27Å; E435-P476 WeakPolarHBondContact CB-O 3.17Å; A436-P476 HydrophobicContact CB-CG 4.06Å; A436-P476 PolarHBondContact N-O 3.24Å; A436-P476 VanDerWaalsContact O-CD 3.28Å; A436-P476 WeakPolarHBondContact O-CD 3.39Å; L439-P476 VanDerWaalsContact CD1-CD 3.44Å; L439-P476 HydrophobicContact CD1-CG 3.69Å; T449-P476 VanDerWaalsContact OG1-CB 3.24Å; T449-P476 WeakPolarHBondContact OG1-CB 3.49Å; T449-P476 VanDerWaalsContact OG1-CG 3.3Å; T449-P476 WeakPolarHBondContact OG1-CG 3.42Å; V470-P476 HydrophobicContact CB-CB 3.79Å; V470-P476 HydrophobicContact CG1-CB 3.63Å; V470-P476 HydrophobicContact CG2-CB 4.36Å; P476-F478 HydrophobicContact CB-CE1 4.16Å; P476-F478 HydrophobicContact CB-CE2 4.1Å; P476-F478 HydrophobicContact CB-CZ 3.71Å; P476-F478 HydrophobicContact CG-CE2 3.85Å; P476-F478 HydrophobicContact CG-CZ 3.65Å
477	V	96.4	Very high	93.7	Very high	73 Å²	73	69 Å²	69	44%	0.442	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	119.3	170.5	-177.5	0	0	0	0	109.3	E435 V470 S475 N479	E435-V477 HydrophobicContact CB-CB 4.42Å; E435-V477 HydrophobicContact CB-CG2 4.14Å; V470-V477 WeakPolarHBondContact CG2-O 3.39Å; S475-V477 PolarHBondContact O-N 3.12Å; V477-N479 HydrophobicContact CG1-CB 4.48Å; V477-N479 VanDerWaalsContact CG1-ND2 3.32Å; V477-N479 WeakPolarHBondContact CG1-ND2 3.11Å
478	F	96.8	Very high	93.4	Very high	22 Å²	22	69.6 Å²	69.6	10%	0.096	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	-41.7	-177.9	-61.6	-69.9	0	0	0	112.9	V433 K434 A436 I451 T467 V470 P476 H480 L501	V433-F478 HydrophobicContact CG1-CB 4.07Å; V433-F478 HydrophobicContact CG1-CD2 3.86Å; V433-F478 HydrophobicContact CG1-CG 4.22Å; K434-F478 PolarHBondContact O-N 3.45Å; A436-F478 HydrophobicContact CB-CE2 4.2Å; I451-F478 HydrophobicContact CG1-CD2 4.14Å; I451-F478 HydrophobicContact CG1-CE2 3.77Å; I451-F478 HydrophobicContact CG1-CZ 4.03Å; T467-F478 HydrophobicContact CG2-CB 4.12Å; T467-F478 HydrophobicContact CG2-CD1 4.15Å; T467-F478 HydrophobicContact CG2-CG 4.2Å; T467-F478 WeakPolarHBondContact OG1-CD1 3.48Å; V470-F478 HydrophobicContact CB-CD1 4.47Å; V470-F478 HydrophobicContact CB-CE1 4.13Å; V470-F478 HydrophobicContact CG2-CD1 3.5Å; V470-F478 VanDerWaalsContact CG2-CD1 3.5Å; V470-F478 HydrophobicContact CG2-CE1 3.64Å; V470-F478 HydrophobicContact CG2-CG 4.41Å; P476-F478 HydrophobicContact CB-CE1 4.16Å; P476-F478 HydrophobicContact CB-CE2 4.1Å; P476-F478 HydrophobicContact CB-CZ 3.71Å; P476-F478 HydrophobicContact CG-CE2 3.85Å; P476-F478 HydrophobicContact CG-CZ 3.65Å; F478-H480 VanDerWaalsContact C-N 3.31Å; F478-H480 PolarHBondContact O-N 2.85Å; F478-L501 HydrophobicContact CE2-CD1 4.19Å; F478-L501 HydrophobicContact CZ-CD1 3.75Å
479	N	96	Very high	93.2	Very high	103 Å²	103	63 Å²	63	55%	0.551	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	36.9	57.5	-175.1	-78.4	-29.3	0	0	0	113.6	V433 K434 V477	V433-N479 CarbonylContact O-C 3.58Å; V433-N479 VanDerWaalsContact O-CA 3.3Å; V433-N479 WeakPolarHBondContact O-CA 3.32Å; V433-N479 PolarHBondContact O-N 2.99Å; V433-N479 VanDerWaalsContact O-N 3.13Å; K434-N479 PolarHBondContact O-N 3.32Å; V477-N479 HydrophobicContact CG1-CB 4.48Å; V477-N479 VanDerWaalsContact CG1-ND2 3.32Å; V477-N479 WeakPolarHBondContact CG1-ND2 3.11Å
480	H	97.2	Very high	93	Very high	64 Å²	64	63.8 Å²	63.8	30%	0.296	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	126.8	-171.6	-174.8	65.2	0	0	0	111.5	V433 T467 F478	V433-H480 PolarHBondContact N-O 2.79Å; V433-H480 PolarHBondContact O-N 2.96Å; T467-H480 HydrophobicContact CG2-CB 4Å; F478-H480 VanDerWaalsContact C-N 3.31Å; F478-H480 PolarHBondContact O-N 2.85Å
481	T	97.5	Very high	93	Very high	65 Å²	65	64.6 Å²	64.6	40%	0.399	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	127.1	176.3	-49.1	0	0	0	0	110.5	F431 V483 W552	F431-T481 CarbonylContact O-C 3.59Å; F431-T481 VanDerWaalsContact O-CA 3.29Å; F431-T481 WeakPolarHBondContact O-CA 3.48Å; T481-V483 HydrophobicContact CG2-CG2 4.15Å; T481-W552 HydrophobicContact CG2-CH2 4.34Å
482	M	97.5	Very high	93.1	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	140.5	170.1	-66.5	171.4	-67.8	0	0	108.3	F431 V433 I451 C453 Q465 Y484	F431-M482 HydrophobicContact CB-CB 4.42Å; F431-M482 HydrophobicContact CB-CE 4.43Å; F431-M482 PolarHBondContact N-O 2.66Å; F431-M482 PolarHBondContact O-N 2.81Å; V433-M482 HydrophobicContact CG2-CE 3.52Å; I451-M482 HydrophobicContact CG2-CE 4.41Å; C453-M482 HydrophobicContact CB-CE 3.71Å; C453-M482 HydrophobicContact CB-SD 3.74Å; Q465-M482 HydrophobicContact CB-CB 4.14Å; Q465-M482 HydrophobicContact CB-CG 3.78Å; Q465-M482 HydrophobicContact CB-SD 3.61Å; Q465-M482 VanDerWaalsContact OE1-CB 3.3Å; M482-Y484 HydrophobicContact CB-CE2 4.43Å
483	V	96.3	Very high	93.4	Very high	50 Å²	50	53 Å²	53	30%	0.303	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	129	-176.7	-174.5	0	0	0	0	109.2	E428 L429 Q465 T481	E428-V483 HydrophobicContact CB-CG1 4.08Å; E428-V483 HydrophobicContact CG-CG1 4.31Å; L429-V483 WeakPolarHBondContact O-CA 3.33Å; Q465-V483 PolarHBondContact NE2-O 2.87Å; T481-V483 HydrophobicContact CG2-CG2 4.15Å
484	Y	95.9	Very high	93.9	Very high	13 Å²	13	54.6 Å²	54.6	5%	0.051	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	125.9	176.7	-69.4	-104.2	0	0	0	109.2	E428 L429 F431 C453 V455 S463 Q465 M482	E428-Y484 CarbonylContact C-O 3.37Å; E428-Y484 WeakPolarHBondContact CA-O 3.43Å; L429-Y484 PolarHBondContact N-O 3.04Å; L429-Y484 PolarHBondContact O-N 3.49Å; F431-Y484 AromaticContact CD2-CD2 3.81Å; F431-Y484 HydrophobicContact CD2-CD2 3.81Å; F431-Y484 AromaticContact CD2-CE2 3.97Å; F431-Y484 HydrophobicContact CD2-CE2 3.97Å; F431-Y484 AromaticContact CE2-CD2 3.5Å; F431-Y484 HydrophobicContact CE2-CD2 3.5Å; F431-Y484 AromaticContact CE2-CE2 3.81Å; F431-Y484 HydrophobicContact CE2-CE2 3.81Å; F431-Y484 HydrophobicContact CE2-CG 4.44Å; C453-Y484 VanDerWaalsContact C-OH 3.28Å; C453-Y484 HydrophobicContact CB-CE2 4.37Å; C453-Y484 WeakPolarHBondContact CB-OH 3.4Å; C453-Y484 PolarHBondContact O-OH 2.89Å; C453-Y484 PolarHBondContact SG-OH 2.87Å; C453-Y484 VanDerWaalsContact SG-OH 3.4Å; V455-Y484 HydrophobicContact CB-CD1 4.21Å; V455-Y484 HydrophobicContact CB-CE1 4.35Å; V455-Y484 HydrophobicContact CG2-CD1 3.69Å; V455-Y484 HydrophobicContact CG2-CD2 3.88Å; V455-Y484 HydrophobicContact CG2-CE1 3.82Å; V455-Y484 HydrophobicContact CG2-CE2 3.99Å; V455-Y484 HydrophobicContact CG2-CG 3.71Å; S463-Y484 WeakPolarHBondContact O-CE1 3.44Å; Q465-Y484 HydrophobicContact CB-CE2 4.48Å; Q465-Y484 HydrophobicContact CG-CE1 4.5Å; Q465-Y484 HydrophobicContact CG-CE2 4.32Å; Q465-Y484 PolarHBondContact N-OH 2.93Å; M482-Y484 HydrophobicContact CB-CE2 4.43Å
485	D	93.7	Very high	94.4	Very high	111 Å²	111	51 Å²	51	59%	0.594	30%	0.298	S	S	*	.			trans	-96.8	171.7	-179.8	54.6	-20.8	0	0	0	112.1	G427 F487	G427-D485 CarbonylContact O-C 3.49Å; D485-F487 WeakPolarHBondContact O-CD2 3.43Å; D485-F487 WeakPolarHBondContact O-CE2 3.49Å
486	G	92	Very high	94.8	Very high	54 Å²	54	47.9 Å²	47.9	56%	0.557	28%	0.276	S	S	*	.	S	Bend	trans	86.8	0.1	175.6	0	0	0	0	0	116.8	S426 G427	S426-G486 PolarHBondContact OG-N 2.8Å; G427-G486 PolarHBondContact O-N 2.95Å
487	F	91.5	Very high	95.1	Very high	35 Å²	35	47.9 Å²	47.9	15%	0.154	28%	0.276	C	S	.	.			trans	-93.6	120.8	-171.9	-72.3	-88.5	0	0	0	113.9	Y413 G427 V455 D485 D491 L492 A495	Y413-F487 WeakPolarHBondContact CE2-O 3.43Å; Y413-F487 PolarHBondContact OH-O 2.6Å; G427-F487 VanDerWaalsContact CA-O 3.27Å; G427-F487 WeakPolarHBondContact CA-O 3.44Å; G427-F487 PolarHBondContact O-N 2.93Å; V455-F487 HydrophobicContact CB-CZ 3.98Å; V455-F487 HydrophobicContact CG1-CE1 3.61Å; V455-F487 HydrophobicContact CG1-CE2 4.21Å; V455-F487 HydrophobicContact CG1-CZ 3.42Å; V455-F487 VanDerWaalsContact CG1-CZ 3.42Å; D485-F487 WeakPolarHBondContact O-CD2 3.43Å; D485-F487 WeakPolarHBondContact O-CE2 3.49Å; F487-D491 HydrophobicContact CD1-CB 4.05Å; F487-L492 HydrophobicContact CB-CD2 3.89Å; F487-L492 HydrophobicContact CB-CG 4.23Å; F487-L492 HydrophobicContact CD1-CD2 3.87Å; F487-L492 HydrophobicContact CG-CD2 4.03Å; F487-A495 HydrophobicContact CE1-CB 4.18Å
488	G	92.1	Very high	95.1	Very high	20 Å²	20	44.8 Å²	44.8	21%	0.206	26%	0.257	C	S	.	.			trans	-82.2	165.2	169	0	0	0	0	0	113.6	A490 D491 L492	G488-A490 PolarHBondContact O-N 2.86Å; G488-A490 VanDerWaalsContact O-N 3.14Å; G488-D491 VanDerWaalsContact CA-OD2 3.29Å; G488-D491 WeakPolarHBondContact CA-OD2 3.22Å; G488-D491 PolarHBondContact N-OD2 2.81Å; G488-D491 WeakPolarHBondContact O-CB 3.37Å; G488-D491 PolarHBondContact O-N 2.85Å; G488-D491 VanDerWaalsContact O-N 3.1Å; G488-L492 PolarHBondContact O-N 2.87Å
489	P	90.8	Very high	95.2	Very high	77 Å²	77	43.7 Å²	43.7	50%	0.5	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-14.3	175.6	-19.8	32.2	0	0	0	114.2	Y413	Y413-P489 HydrophobicContact CE1-CG 4.18Å; Y413-P489 WeakPolarHBondContact OH-CD 3.34Å
490	A	92.7	Very high	95.2	Very high	69 Å²	69	38.8 Å²	38.8	57%	0.57	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-41.7	171.4	0	0	0	0	0	111.4	G488 L492 R493	G488-A490 PolarHBondContact O-N 2.86Å; G488-A490 VanDerWaalsContact O-N 3.14Å; A490-L492 PolarHBondContact O-N 2.78Å; A490-R493 WeakPolarHBondContact O-CB 3.15Å; A490-R493 PolarHBondContact O-N 3.07Å; A490-R493 VanDerWaalsContact O-N 3.08Å
491	D	93.9	Very high	95.2	Very high	51 Å²	51	35.8 Å²	35.8	27%	0.273	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-61.1	-43	178.9	-60.7	-72.8	0	0	0	112.1	F487 G488 R493 Q494 A495 Y525	F487-D491 HydrophobicContact CD1-CB 4.05Å; G488-D491 VanDerWaalsContact CA-OD2 3.29Å; G488-D491 WeakPolarHBondContact CA-OD2 3.22Å; G488-D491 PolarHBondContact N-OD2 2.81Å; G488-D491 WeakPolarHBondContact O-CB 3.37Å; G488-D491 PolarHBondContact O-N 2.85Å; G488-D491 VanDerWaalsContact O-N 3.1Å; D491-R493 PolarHBondContact O-N 2.89Å; D491-Q494 CarbonylContact O-C 3.47Å; D491-Q494 WeakPolarHBondContact O-CA 3.25Å; D491-Q494 PolarHBondContact O-N 3.33Å; D491-A495 WeakPolarHBondContact O-CB 3.43Å; D491-A495 PolarHBondContact O-N 3.01Å; D491-Y525 WeakPolarHBondContact CA-OH 3.29Å; D491-Y525 VanDerWaalsContact CB-OH 3.23Å; D491-Y525 WeakPolarHBondContact CB-OH 3.33Å; D491-Y525 PolarHBondContact OD1-OH 3.41Å
492	L	95	Very high	95.1	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-65	-9.8	176.6	-62.9	-175.8	0	0	0	114.4	Y413 L429 F487 G488 A490 W542 L546	Y413-L492 HydrophobicContact CD1-CD1 3.83Å; Y413-L492 HydrophobicContact CD2-CD1 3.38Å; Y413-L492 HydrophobicContact CE1-CD1 4.01Å; Y413-L492 HydrophobicContact CE2-CD1 3.59Å; Y413-L492 HydrophobicContact CG-CD1 3.5Å; L429-L492 HydrophobicContact CD2-CD2 3.9Å; F487-L492 HydrophobicContact CB-CD2 3.89Å; F487-L492 HydrophobicContact CB-CG 4.23Å; F487-L492 HydrophobicContact CD1-CD2 3.87Å; F487-L492 HydrophobicContact CG-CD2 4.03Å; G488-L492 PolarHBondContact O-N 2.87Å; A490-L492 PolarHBondContact O-N 2.78Å; L492-W542 HydrophobicContact CB-CZ2 4.4Å; L492-W542 HydrophobicContact CD2-CH2 4.31Å; L492-W542 HydrophobicContact CD2-CZ2 4.1Å; L492-W542 PolarHBondContact O-NE1 2.84Å; L492-L546 HydrophobicContact CB-CD2 3.65Å; L492-L546 HydrophobicContact CD1-CD2 4.22Å
493	R	95.2	Very high	94.8	Very high	131 Å²	131	35.7 Å²	35.7	49%	0.494	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-88.4	-14.3	169.9	-58.3	-180	179.6	-84.4	-4.4	112.8	A490 D491 L519 L546	A490-R493 WeakPolarHBondContact O-CB 3.15Å; A490-R493 PolarHBondContact O-N 3.07Å; A490-R493 VanDerWaalsContact O-N 3.08Å; D491-R493 PolarHBondContact O-N 2.89Å; R493-L519 HydrophobicContact CB-CD1 3.87Å; R493-L519 HydrophobicContact CG-CD1 4.04Å; R493-L546 HydrophobicContact CG-CD1 4.3Å
494	Q	95.7	Very high	94.7	Very high	67 Å²	67	37 Å²	37	31%	0.313	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.8	-15.5	-179	-62.3	-66.5	-16.7	0	0	112.7	D491 S524 Y525 M532	D491-Q494 CarbonylContact O-C 3.47Å; D491-Q494 WeakPolarHBondContact O-CA 3.25Å; D491-Q494 PolarHBondContact O-N 3.33Å; Q494-S524 VanDerWaalsContact O-CB 3.31Å; Q494-S524 WeakPolarHBondContact O-CB 3Å; Q494-S524 PolarHBondContact O-OG 2.83Å; Q494-Y525 HydrophobicContact CB-CD1 4.19Å; Q494-Y525 HydrophobicContact CB-CD2 3.79Å; Q494-Y525 HydrophobicContact CB-CE1 4.08Å; Q494-Y525 HydrophobicContact CB-CE2 3.65Å; Q494-Y525 HydrophobicContact CB-CG 4.06Å; Q494-Y525 HydrophobicContact CG-CD1 4.48Å; Q494-M532 VanDerWaalsContact C-CE 3.46Å; Q494-M532 WeakPolarHBondContact O-CE 3.15Å
495	A	95.9	Very high	94.1	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.213	C	C	.	.			trans	-87.7	159.7	178.1	0	0	0	0	0	112.9	V455 L456 F487 D491 M532	V455-A495 HydrophobicContact CG1-CB 4.12Å; L456-A495 VanDerWaalsContact O-CA 3.22Å; L456-A495 WeakPolarHBondContact O-CA 3.29Å; L456-A495 WeakPolarHBondContact O-CB 3.33Å; F487-A495 HydrophobicContact CE1-CB 4.18Å; D491-A495 WeakPolarHBondContact O-CB 3.43Å; D491-A495 PolarHBondContact O-N 3.01Å; A495-M532 WeakPolarHBondContact O-CE 3.35Å
496	C	97.1	Very high	93.5	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	122.7	171.3	178.2	0	0	0	0	110.5	L456 L517 W531 M532	L456-C496 HydrophobicContact CB-CB 4.26Å; L456-C496 WeakPolarHBondContact CB-O 3.39Å; L456-C496 PolarHBondContact N-O 2.9Å; L456-C496 PolarHBondContact O-N 3.5Å; C496-L517 CarbonylContact C-O 3.53Å; C496-L517 WeakPolarHBondContact CA-O 3.34Å; C496-W531 HydrophobicContact CB-CE3 3.74Å; C496-W531 HydrophobicContact CB-CZ3 3.61Å; C496-M532 HydrophobicContact CB-CE 4.29Å; C496-M532 HydrophobicContact CB-SD 4.13Å
497	A	97.5	Very high	93	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	112.4	175.1	0	0	0	0	0	111	F431 S454 V455 L499 R516 L517 W542	F431-A497 HydrophobicContact CE1-CB 3.44Å; F431-A497 VanDerWaalsContact CE1-CB 3.44Å; F431-A497 HydrophobicContact CZ-CB 3.36Å; S454-A497 CarbonylContact O-C 3.54Å; S454-A497 WeakPolarHBondContact O-CA 3.06Å; V455-A497 HydrophobicContact CG2-CB 4.32Å; A497-L499 HydrophobicContact CB-CD1 4.39Å; A497-R516 WeakPolarHBondContact O-CA 3.37Å; A497-L517 HydrophobicContact CB-CB 4.26Å; A497-L517 PolarHBondContact N-O 3.2Å; A497-L517 PolarHBondContact O-N 3.01Å; A497-W542 HydrophobicContact CB-CH2 3.97Å; A497-W542 HydrophobicContact CB-CZ3 3.87Å
498	E	97.5	Very high	92.7	Very high	8 Å²	8	44.6 Å²	44.6	4%	0.037	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	119.6	175.7	-169.6	-174.3	108.5	0	0	109.9	C453 S454 L456 T515 R516 L563 R566	C453-E498 CarbonylContact C-O 3.59Å; C453-E498 VanDerWaalsContact CA-O 3.31Å; C453-E498 WeakPolarHBondContact CA-O 3.39Å; S454-E498 PolarHBondContact N-O 3.06Å; S454-E498 PolarHBondContact O-N 3.28Å; L456-E498 HydrophobicContact CD1-CB 4.45Å; E498-T515 WeakPolarHBondContact CA-O 3.16Å; E498-R516 HydrophobicContact CB-CG 3.99Å; E498-R516 HydrophobicContact CG-CG 3.74Å; E498-R516 IonicContact OE2-CZ 3.72Å; E498-R516 VanDerWaalsContact OE2-CZ 3.22Å; E498-R516 IonicContact OE2-NE 3.47Å; E498-R516 PolarHBondContact OE2-NE 3.15Å; E498-R516 IonicContact OE2-NH2 2.89Å; E498-R516 PolarHBondContact OE2-NH2 2.74Å; E498-L563 HydrophobicContact CG-CD2 3.87Å; E498-R566 IonicContact OE1-CZ 2.65Å; E498-R566 IonicContact OE1-NE 2.74Å; E498-R566 IonicContact OE1-NH2 3.43Å; E498-R566 PolarHBondContact OE1-NH2 3.27Å; E498-R566 IonicContact OE2-CZ 3.62Å; E498-R566 IonicContact OE2-NE 3.36Å; E498-R566 PolarHBondContact OE2-NE 3.44Å; E498-R566 IonicContact OE2-NH2 3.39Å; E498-R566 PolarHBondContact OE2-NH2 3.22Å
499	L	97.7	Very high	92.7	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	119.4	172	-69.4	85.2	0	0	0	108.7	L407 L409 F431 V433 I451 C453 A497 G514 T515 L517	L407-L499 HydrophobicContact CD2-CB 4.17Å; L407-L499 HydrophobicContact CD2-CD2 4.3Å; L409-L499 HydrophobicContact CD1-CD2 4.25Å; F431-L499 HydrophobicContact CD1-CD1 4.05Å; F431-L499 HydrophobicContact CD1-CD2 4.4Å; F431-L499 HydrophobicContact CE1-CD1 4.02Å; V433-L499 HydrophobicContact CG2-CD2 3.89Å; I451-L499 HydrophobicContact CG2-CB 4.47Å; I451-L499 HydrophobicContact CG2-CD2 4.42Å; C453-L499 HydrophobicContact CB-CG 4.39Å; A497-L499 HydrophobicContact CB-CD1 4.39Å; L499-G514 CarbonylContact O-C 3.47Å; L499-G514 WeakPolarHBondContact O-CA 3.41Å; L499-T515 HydrophobicContact CB-CG2 4Å; L499-T515 PolarHBondContact N-O 3.21Å; L499-T515 PolarHBondContact O-N 3.43Å; L499-L517 HydrophobicContact CD1-CD1 3.75Å
500	S	96.2	Very high	92.6	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	132.2	-173.9	53.8	0	0	0	0	110.9	I451 Q452 W502 G513	I451-S500 CarbonylContact C-O 3.55Å; I451-S500 WeakPolarHBondContact CA-O 3.49Å; Q452-S500 PolarHBondContact N-O 2.74Å; Q452-S500 PolarHBondContact O-N 3.33Å; Q452-S500 PolarHBondContact O-OG 2.98Å; S500-W502 PolarHBondContact OG-NE1 3.47Å; S500-G513 WeakPolarHBondContact CA-O 3.24Å
501	L	96.9	Very high	92.6	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	134.1	175.4	-175	74.3	0	0	0	109.8	L439 I451 F478 Q511 L512 G513 L559	L439-L501 HydrophobicContact CD1-CD2 3.8Å; L439-L501 HydrophobicContact CD2-CD2 3.52Å; L439-L501 HydrophobicContact CG-CD2 4.34Å; I451-L501 HydrophobicContact CD1-CB 3.78Å; I451-L501 HydrophobicContact CD1-CD1 3.64Å; I451-L501 HydrophobicContact CD1-CG 4.32Å; I451-L501 HydrophobicContact CG1-CD1 3.87Å; F478-L501 HydrophobicContact CE2-CD1 4.19Å; F478-L501 HydrophobicContact CZ-CD1 3.75Å; L501-Q511 CarbonylContact O-C 3.58Å; L501-Q511 WeakPolarHBondContact O-CA 3.25Å; L501-L512 HydrophobicContact CB-CB 4.46Å; L501-L512 HydrophobicContact CD2-CB 4.16Å; L501-L512 HydrophobicContact CD2-CD1 3.77Å; L501-L512 HydrophobicContact CG-CB 4.36Å; L501-L512 HydrophobicContact CG-CD1 4.1Å; L501-L512 PolarHBondContact O-N 2.86Å; L501-G513 PolarHBondContact N-O 3.04Å; L501-L559 HydrophobicContact CB-CD1 4.34Å; L501-L559 HydrophobicContact CB-CD2 3.9Å; L501-L559 HydrophobicContact CD2-CD1 3.68Å
502	W	95.6	Very high	92.4	Very high	51 Å²	51	46.6 Å²	46.6	19%	0.193	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	133.6	-176.7	-66.4	77.4	0	0	0	112.1	T449 Y450 S500 R510 Q511	T449-W502 VanDerWaalsContact CA-O 3.23Å; T449-W502 WeakPolarHBondContact CA-O 3.47Å; Y450-W502 HydrophobicContact CD1-CB 4.02Å; Y450-W502 HydrophobicContact CD2-CB 4.24Å; Y450-W502 HydrophobicContact CE1-CB 3.56Å; Y450-W502 HydrophobicContact CE1-CG 4.37Å; Y450-W502 HydrophobicContact CE2-CB 3.79Å; Y450-W502 AromaticContact CE2-CD1 3.89Å; Y450-W502 AromaticContact CE2-CG 3.83Å; Y450-W502 HydrophobicContact CE2-CG 3.83Å; Y450-W502 HydrophobicContact CG-CB 4.35Å; Y450-W502 VanDerWaalsContact CZ-CB 3.41Å; Y450-W502 AromaticContact CZ-CG 3.73Å; Y450-W502 PolarHBondContact N-O 3.41Å; Y450-W502 PolarHBondContact O-N 2.7Å; S500-W502 PolarHBondContact OG-NE1 3.47Å; W502-R510 CarbonylContact C-O 3.6Å; W502-R510 VanDerWaalsContact CA-O 3.32Å; W502-R510 WeakPolarHBondContact CA-O 3.34Å; W502-R510 VanDerWaalsContact CE3-C 3.49Å; W502-Q511 HydrophobicContact CD2-CB 4.12Å; W502-Q511 HydrophobicContact CE3-CB 4.12Å; W502-Q511 HydrophobicContact CH2-CB 4.03Å; W502-Q511 HydrophobicContact CZ2-CB 4.01Å; W502-Q511 HydrophobicContact CZ2-CG 4.34Å; W502-Q511 HydrophobicContact CZ3-CB 4.09Å
503	D	92.7	Very high	92.3	Very high	12 Å²	12	46.8 Å²	46.8	6%	0.064	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	114.1	163.4	174.9	37.4	0	0	0	109	R443 L447 G505 S509 R510 L512	R443-D503 IonicContact CZ-OD2 2.98Å; R443-D503 IonicContact NH2-OD2 2.74Å; R443-D503 PolarHBondContact NH2-OD2 2.89Å; L447-D503 HydrophobicContact CD2-CB 4.28Å; D503-G505 VanDerWaalsContact C-N 3.35Å; D503-G505 PolarHBondContact O-N 3.46Å; D503-S509 CarbonylContact O-C 3.57Å; D503-S509 WeakPolarHBondContact O-CA 3.37Å; D503-R510 PolarHBondContact N-O 2.96Å; D503-R510 PolarHBondContact O-N 2.7Å; D503-L512 HydrophobicContact CB-CD1 4.09Å; D503-L512 HydrophobicContact CB-CD2 4.07Å; D503-L512 HydrophobicContact CB-CG 3.99Å
504	H	92.8	Very high	92.3	Very high	77 Å²	77	40.5 Å²	40.5	36%	0.356	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	76.5	-179.7	-177.4	-72.3	0	0	0	110.6	D448 Y450 V469	D448-H504 HydrophobicContact CB-CB 4.31Å; D448-H504 VanDerWaalsContact O-CB 3.24Å; D448-H504 WeakPolarHBondContact O-CB 3.01Å; D448-H504 PolarHBondContact O-N 2.9Å; Y450-H504 HydrophobicContact CD1-CB 4.15Å; Y450-H504 HydrophobicContact CE1-CB 4.1Å; V469-H504 HydrophobicContact CG1-CB 4.08Å
505	G	84	Confident	92.4	Very high	15 Å²	15	37.3 Å²	37.3	16%	0.155	21%	0.211	C	C	.	.			trans	-67.5	152.2	173.7	0	0	0	0	0	113.3	D503 L507 A508	D503-G505 VanDerWaalsContact C-N 3.35Å; D503-G505 PolarHBondContact O-N 3.46Å; G505-L507 PolarHBondContact O-N 2.78Å; G505-L507 VanDerWaalsContact O-N 3.15Å; G505-A508 WeakPolarHBondContact CA-O 3.44Å; G505-A508 PolarHBondContact N-O 3.18Å; G505-A508 PolarHBondContact O-N 3Å
506	A	80.6	Confident	92.4	Very high	112 Å²	112	37.6 Å²	37.6	93%	0.926	21%	0.212	S	C	*	.	S	Bend	trans	-63.7	-18.6	-177.1	0	0	0	0	0	115.5
507	L	82.3	Confident	92.5	Very high	181 Å²	181	37.6 Å²	37.6	95%	0.948	21%	0.212	S	C	*	.	S	Bend	trans	-109.9	-32.5	177.2	-64.7	174.9	0	0	0	112.9	G505	G505-L507 PolarHBondContact O-N 2.78Å; G505-L507 VanDerWaalsContact O-N 3.15Å
508	A	85.7	Confident	92.5	Very high	65 Å²	65	37.6 Å²	37.6	54%	0.537	21%	0.212	S	C	.	.			trans	-161.9	144.6	-179.9	0	0	0	0	0	109.8	G505	G505-A508 WeakPolarHBondContact CA-O 3.44Å; G505-A508 PolarHBondContact N-O 3.18Å; G505-A508 PolarHBondContact O-N 3Å
509	S	90.9	Very high	92.4	Very high	41 Å²	41	39 Å²	39	29%	0.287	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	145.8	165.8	-55.2	0	0	0	0	110.8	Y450 D503	Y450-S509 VanDerWaalsContact OH-CB 3.28Å; Y450-S509 WeakPolarHBondContact OH-CB 3.15Å; Y450-S509 PolarHBondContact OH-OG 2.93Å; D503-S509 CarbonylContact O-C 3.57Å; D503-S509 WeakPolarHBondContact O-CA 3.37Å
510	R	89.8	Confident	92.2	Very high	142 Å²	142	39.6 Å²	39.6	54%	0.536	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	133.7	172.1	-68.3	-173.7	170.8	-141.4	-3.9	110.6	L442 W502 D503 L512	L442-R510 HydrophobicContact CD1-CB 3.85Å; W502-R510 CarbonylContact C-O 3.6Å; W502-R510 VanDerWaalsContact CA-O 3.32Å; W502-R510 WeakPolarHBondContact CA-O 3.34Å; W502-R510 VanDerWaalsContact CE3-C 3.49Å; D503-R510 PolarHBondContact N-O 2.96Å; D503-R510 PolarHBondContact O-N 2.7Å; R510-L512 PolarHBondContact O-N 3.39Å
511	Q	91.6	Very high	92	Very high	72 Å²	72	43 Å²	43	34%	0.336	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	125.8	174.3	-170.3	168.3	-11.9	0	0	109.8	R404 L501 W502 G513	R404-Q511 PolarHBondContact NH1-O 2.94Å; L501-Q511 CarbonylContact O-C 3.58Å; L501-Q511 WeakPolarHBondContact O-CA 3.25Å; W502-Q511 HydrophobicContact CD2-CB 4.12Å; W502-Q511 HydrophobicContact CE3-CB 4.12Å; W502-Q511 HydrophobicContact CH2-CB 4.03Å; W502-Q511 HydrophobicContact CZ2-CB 4.01Å; W502-Q511 HydrophobicContact CZ2-CG 4.34Å; W502-Q511 HydrophobicContact CZ3-CB 4.09Å; Q511-G513 WeakPolarHBondContact CG-O 3.22Å; Q511-G513 PolarHBondContact NE2-O 2.88Å
512	L	89.7	Confident	91.8	Very high	4 Å²	4	44.7 Å²	44.7	2%	0.021	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	-35.2	174.7	-69.5	173	0	0	0	111.1	R404 L442 L447 T449 L501 D503 R510	R404-L512 WeakPolarHBondContact CD-O 3.28Å; R404-L512 WeakPolarHBondContact CG-O 3.28Å; R404-L512 PolarHBondContact NH1-O 2.87Å; L442-L512 HydrophobicContact CB-CD2 4.24Å; L442-L512 HydrophobicContact CD1-CD2 3.89Å; L442-L512 HydrophobicContact CG-CD2 3.86Å; L447-L512 HydrophobicContact CD1-CD1 3.8Å; L447-L512 HydrophobicContact CD2-CD1 4.35Å; L447-L512 HydrophobicContact CD2-CD2 4.43Å; T449-L512 HydrophobicContact CG2-CD1 4.09Å; L501-L512 HydrophobicContact CB-CB 4.46Å; L501-L512 HydrophobicContact CD2-CB 4.16Å; L501-L512 HydrophobicContact CD2-CD1 3.77Å; L501-L512 HydrophobicContact CG-CB 4.36Å; L501-L512 HydrophobicContact CG-CD1 4.1Å; L501-L512 PolarHBondContact O-N 2.86Å; D503-L512 HydrophobicContact CB-CD1 4.09Å; D503-L512 HydrophobicContact CB-CD2 4.07Å; D503-L512 HydrophobicContact CB-CG 3.99Å; R510-L512 PolarHBondContact O-N 3.39Å
513	G	92.6	Very high	91.7	Very high	3 Å²	3	44.2 Å²	44.2	3%	0.031	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.1	-166.7	177.2	0	0	0	0	0	110.5	S500 L501 Q511 R560	S500-G513 WeakPolarHBondContact CA-O 3.24Å; L501-G513 PolarHBondContact N-O 3.04Å; Q511-G513 WeakPolarHBondContact CG-O 3.22Å; Q511-G513 PolarHBondContact NE2-O 2.88Å; G513-R560 CarbonylContact C-O 3.53Å; G513-R560 WeakPolarHBondContact CA-O 3.13Å
514	G	95.7	Very high	91.7	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.1	-174.1	173.5	0	0	0	0	0	113.4	L499 L559 R560	L499-G514 CarbonylContact O-C 3.47Å; L499-G514 WeakPolarHBondContact O-CA 3.41Å; G514-L559 CarbonylContact O-C 3.47Å; G514-R560 PolarHBondContact N-O 2.99Å; G514-R560 WeakPolarHBondContact O-CB 3.31Å; G514-R560 PolarHBondContact O-N 3.27Å
515	T	97.2	Very high	91.7	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	149.9	174.2	178.3	0	0	0	0	109	L407 E498 L499 E538 L557	L407-T515 HydrophobicContact CD2-CG2 3.99Å; E498-T515 WeakPolarHBondContact CA-O 3.16Å; L499-T515 HydrophobicContact CB-CG2 4Å; L499-T515 PolarHBondContact N-O 3.21Å; L499-T515 PolarHBondContact O-N 3.43Å; T515-E538 WeakPolarHBondContact CA-OE1 3.32Å; T515-E538 VanDerWaalsContact CB-OE1 3.32Å; T515-E538 WeakPolarHBondContact CB-OE1 3.13Å; T515-E538 WeakPolarHBondContact OG1-CG 3.29Å; T515-E538 PolarHBondContact OG1-OE1 2.83Å; T515-L557 HydrophobicContact CG2-CD1 4.4Å
516	R	97.3	Very high	92	Very high	5 Å²	5	48.3 Å²	48.3	2%	0.019	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	115.9	-178.2	-84.1	178.8	176.1	158.8	2.8	111	A497 E498 D533 S534 E538 L563 V564	A497-R516 WeakPolarHBondContact O-CA 3.37Å; E498-R516 HydrophobicContact CB-CG 3.99Å; E498-R516 HydrophobicContact CG-CG 3.74Å; E498-R516 IonicContact OE2-CZ 3.72Å; E498-R516 VanDerWaalsContact OE2-CZ 3.22Å; E498-R516 IonicContact OE2-NE 3.47Å; E498-R516 PolarHBondContact OE2-NE 3.15Å; E498-R516 IonicContact OE2-NH2 2.89Å; E498-R516 PolarHBondContact OE2-NH2 2.74Å; R516-D533 WeakPolarHBondContact CD-OD1 3.42Å; R516-D533 IonicContact CZ-OD1 3.45Å; R516-D533 IonicContact NE-OD1 2.91Å; R516-D533 IonicContact NH1-OD1 3.88Å; R516-D533 PolarHBondContact NH1-OD1 2.87Å; R516-D533 IonicContact NH1-OD2 2.74Å; R516-S534 VanDerWaalsContact O-CB 3.32Å; R516-S534 WeakPolarHBondContact O-CB 3.38Å; R516-S534 PolarHBondContact O-OG 3.48Å; R516-E538 PolarHBondContact N-OE1 2.98Å; R516-E538 WeakPolarHBondContact O-CB 3.39Å; R516-L563 HydrophobicContact CG-CD2 4.07Å; R516-L563 HydrophobicContact CG-CG 4.43Å; R516-V564 VanDerWaalsContact CZ-O 3.26Å; R516-V564 PolarHBondContact NH1-O 3.25Å; R516-V564 PolarHBondContact NH2-O 2.65Å
517	L	97.9	Very high	92.6	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	112.7	-176.1	-58.9	165.2	0	0	0	109.8	L409 L411 F431 C496 A497 L499 E538 L541 W542 L557	L409-L517 HydrophobicContact CD1-CD1 4.27Å; L411-L517 HydrophobicContact CD1-CD1 3.81Å; L411-L517 HydrophobicContact CD1-CD2 4.47Å; L411-L517 HydrophobicContact CD2-CD1 3.91Å; L411-L517 HydrophobicContact CG-CD1 4.44Å; F431-L517 HydrophobicContact CE1-CD1 4.25Å; C496-L517 CarbonylContact C-O 3.53Å; C496-L517 WeakPolarHBondContact CA-O 3.34Å; A497-L517 HydrophobicContact CB-CB 4.26Å; A497-L517 PolarHBondContact N-O 3.2Å; A497-L517 PolarHBondContact O-N 3.01Å; L499-L517 HydrophobicContact CD1-CD1 3.75Å; L517-E538 HydrophobicContact CD2-CB 4.49Å; L517-L541 HydrophobicContact CD2-CB 4.46Å; L517-L541 HydrophobicContact CD2-CD2 3.88Å; L517-W542 HydrophobicContact CB-CD2 4.18Å; L517-W542 HydrophobicContact CB-CE3 3.48Å; L517-W542 VanDerWaalsContact CB-CE3 3.48Å; L517-W542 HydrophobicContact CB-CZ3 3.88Å; L517-L557 HydrophobicContact CD2-CD1 3.54Å
518	S	97.1	Very high	93.1	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	28%	0.283	C	S	.	.	S	Bend	trans	-164.1	177.1	177.6	72.8	0	0	0	0	110.3	G520 M532 S534 W542	S518-G520 PolarHBondContact O-N 3.13Å; S518-G520 VanDerWaalsContact OG-CA 3.31Å; S518-G520 WeakPolarHBondContact OG-CA 3.34Å; S518-G520 PolarHBondContact OG-N 2.7Å; S518-M532 VanDerWaalsContact CB-SD 3.51Å; S518-M532 PolarHBondContact OG-SD 2.91Å; S518-M532 VanDerWaalsContact OG-SD 3.32Å; S518-S534 PolarHBondContact N-OG 2.94Å; S518-S534 PolarHBondContact OG-OG 2.88Å; S518-W542 VanDerWaalsContact C-CD1 3.41Å
519	L	96.6	Very high	93.4	Very high	38 Å²	38	46.8 Å²	46.8	20%	0.199	26%	0.263	C	S	.	.			trans	-70.7	-8.1	165.5	-63.3	-179.6	0	0	0	113.1	R493 T521 K539 Q543 L546	R493-L519 HydrophobicContact CB-CD1 3.87Å; R493-L519 HydrophobicContact CG-CD1 4.04Å; L519-T521 HydrophobicContact CB-CG2 3.96Å; L519-T521 PolarHBondContact O-N 2.93Å; L519-K539 WeakPolarHBondContact O-CE 3.36Å; L519-Q543 HydrophobicContact CD2-CG 3.63Å; L519-L546 HydrophobicContact CD1-CD1 4.32Å; L519-L546 HydrophobicContact CD2-CD1 3.97Å; L519-L546 HydrophobicContact CG-CD1 4.28Å
520	G	92.4	Very high	93.5	Very high	13 Å²	13	47.6 Å²	47.6	13%	0.134	27%	0.267	C	S	.	.			trans	47.2	54.4	177	0	0	0	0	0	113.9	S518 G522 M532 K539	S518-G520 PolarHBondContact O-N 3.13Å; S518-G520 VanDerWaalsContact OG-CA 3.31Å; S518-G520 WeakPolarHBondContact OG-CA 3.34Å; S518-G520 PolarHBondContact OG-N 2.7Å; G520-G522 VanDerWaalsContact C-N 3.35Å; G520-M532 CarbonylContact C-O 3.57Å; G520-M532 VanDerWaalsContact C-O 3.31Å; G520-M532 WeakPolarHBondContact CA-O 3.16Å; G520-K539 VanDerWaalsContact O-CE 3.22Å; G520-K539 WeakPolarHBondContact O-CE 3.43Å; G520-K539 PolarHBondContact O-NZ 3.16Å
521	T	93.2	Very high	93.6	Very high	71 Å²	71	42.1 Å²	42.1	44%	0.436	25%	0.247	S	C	.	.			trans	-82.8	-2.3	-176.4	44.6	0	0	0	0	114.1	L519 S523	L519-T521 HydrophobicContact CB-CG2 3.96Å; L519-T521 PolarHBondContact O-N 2.93Å; T521-S523 PolarHBondContact O-N 3.42Å; T521-S523 VanDerWaalsContact O-N 3.12Å; T521-S523 PolarHBondContact O-OG 3.45Å; T521-S523 PolarHBondContact OG1-N 2.95Å; T521-S523 PolarHBondContact OG1-O 3.02Å
522	G	91.9	Very high	93.7	Very high	37 Å²	37	39 Å²	39	38%	0.381	23%	0.232	S	C	.	.	S	Bend	trans	61.5	9.7	-166.5	0	0	0	0	0	114.6	G520 Q528 V529	G520-G522 VanDerWaalsContact C-N 3.35Å; G522-Q528 WeakPolarHBondContact O-CA 3.18Å; G522-V529 PolarHBondContact O-N 2.86Å
523	S	92.9	Very high	93.9	Very high	41 Å²	41	40.5 Å²	40.5	29%	0.287	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	143.8	-172.8	49.6	0	0	0	0	113.1	T521 L527	T521-S523 PolarHBondContact O-N 3.42Å; T521-S523 VanDerWaalsContact O-N 3.12Å; T521-S523 PolarHBondContact O-OG 3.45Å; T521-S523 PolarHBondContact OG1-N 2.95Å; T521-S523 PolarHBondContact OG1-O 3.02Å; S523-L527 CarbonylContact C-O 3.49Å; S523-L527 WeakPolarHBondContact CA-O 3.24Å; S523-L527 VanDerWaalsContact CB-O 3.28Å; S523-L527 WeakPolarHBondContact CB-O 3.49Å
524	S	93.7	Very high	94	Very high	4 Å²	4	40.6 Å²	40.6	3%	0.028	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	129.2	-176.2	178.2	0	0	0	0	109.8	Q494 G526 L527 W531	Q494-S524 VanDerWaalsContact O-CB 3.31Å; Q494-S524 WeakPolarHBondContact O-CB 3Å; Q494-S524 PolarHBondContact O-OG 2.83Å; S524-G526 PolarHBondContact O-N 3.23Å; S524-L527 PolarHBondContact N-O 3.49Å; S524-L527 PolarHBondContact O-N 2.98Å; S524-W531 VanDerWaalsContact CB-CH2 3.45Å; S524-W531 VanDerWaalsContact OG-CH2 3.28Å; S524-W531 WeakPolarHBondContact OG-CH2 3.26Å
525	Y	93.2	Very high	93.9	Very high	110 Å²	110	42 Å²	42	43%	0.431	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.7	34	-179.2	-68	-83.9	0	0	0	114.2	P457 D491 Q494	P457-Y525 HydrophobicContact CG-CD2 3.9Å; P457-Y525 HydrophobicContact CG-CE2 3.97Å; D491-Y525 WeakPolarHBondContact CA-OH 3.29Å; D491-Y525 VanDerWaalsContact CB-OH 3.23Å; D491-Y525 WeakPolarHBondContact CB-OH 3.33Å; D491-Y525 PolarHBondContact OD1-OH 3.41Å; Q494-Y525 HydrophobicContact CB-CD1 4.19Å; Q494-Y525 HydrophobicContact CB-CD2 3.79Å; Q494-Y525 HydrophobicContact CB-CE1 4.08Å; Q494-Y525 HydrophobicContact CB-CE2 3.65Å; Q494-Y525 HydrophobicContact CB-CG 4.06Å; Q494-Y525 HydrophobicContact CG-CD1 4.48Å
526	G	90.2	Very high	93.8	Very high	75 Å²	75	46.5 Å²	46.5	77%	0.773	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.2	-6.8	179.8	0	0	0	0	0	115.6	S524	S524-G526 PolarHBondContact O-N 3.23Å
527	L	92.2	Very high	93.7	Very high	121 Å²	121	51 Å²	51	63%	0.634	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.5	145.2	174.1	-59	177.7	0	0	0	110.6	S523 S524 V529	S523-L527 CarbonylContact C-O 3.49Å; S523-L527 WeakPolarHBondContact CA-O 3.24Å; S523-L527 VanDerWaalsContact CB-O 3.28Å; S523-L527 WeakPolarHBondContact CB-O 3.49Å; S524-L527 PolarHBondContact N-O 3.49Å; S524-L527 PolarHBondContact O-N 2.98Å; L527-V529 HydrophobicContact CB-CG1 4.33Å
528	Q	93.1	Very high	93.7	Very high	185 Å²	185	51 Å²	51	86%	0.864	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.2	131.6	164.8	-72	-174.6	-9.1	0	0	109	G522	G522-Q528 WeakPolarHBondContact O-CA 3.18Å
529	V	93.3	Very high	93.7	Very high	20 Å²	20	53.9 Å²	53.9	12%	0.121	31%	0.312	C	S	.	.			trans	-136.8	134.7	-176.8	-62.4	0	0	0	0	111.5	G522 L527 W531 M532	G522-V529 PolarHBondContact O-N 2.86Å; L527-V529 HydrophobicContact CB-CG1 4.33Å; V529-W531 VanDerWaalsContact C-N 3.27Å; V529-W531 HydrophobicContact CB-CD2 4.06Å; V529-W531 HydrophobicContact CB-CG 4.4Å; V529-W531 HydrophobicContact CB-CZ2 4.01Å; V529-W531 HydrophobicContact CG1-CZ2 3.9Å; V529-W531 HydrophobicContact CG2-CD2 3.86Å; V529-W531 HydrophobicContact CG2-CE3 3.99Å; V529-W531 HydrophobicContact CG2-CH2 4.07Å; V529-W531 HydrophobicContact CG2-CZ2 3.91Å; V529-W531 HydrophobicContact CG2-CZ3 4.08Å; V529-W531 PolarHBondContact O-N 3.31Å; V529-M532 HydrophobicContact CG2-CB 3.96Å; V529-M532 HydrophobicContact CG2-CG 3.48Å; V529-M532 VanDerWaalsContact CG2-CG 3.48Å
530	P	91.6	Very high	93.7	Very high	59 Å²	59	58.2 Å²	58.2	38%	0.383	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-19.8	-176.2	29.3	-35.7	0	0	0	113.4	M532 V564 A567	P530-M532 VanDerWaalsContact C-N 3.35Å; P530-V564 HydrophobicContact CB-CG1 3.76Å; P530-V564 WeakPolarHBondContact O-CB 3.16Å; P530-A567 HydrophobicContact CG-CB 4.17Å
531	W	92.2	Very high	94	Very high	26 Å²	26	58.2 Å²	58.2	10%	0.098	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	6.6	-176.4	50.9	-105.7	0	0	0	115	L456 P457 C496 S524 V529 D533	L456-W531 HydrophobicContact CB-CD2 4.26Å; L456-W531 HydrophobicContact CB-CE3 3.81Å; L456-W531 HydrophobicContact CB-CH2 3.65Å; L456-W531 HydrophobicContact CB-CZ2 4.12Å; L456-W531 HydrophobicContact CB-CZ3 3.49Å; L456-W531 VanDerWaalsContact CB-CZ3 3.49Å; L456-W531 HydrophobicContact CD1-CB 4.1Å; L456-W531 HydrophobicContact CD1-CD2 3.66Å; L456-W531 HydrophobicContact CD1-CE3 3.6Å; L456-W531 HydrophobicContact CD1-CG 3.91Å; L456-W531 HydrophobicContact CD1-CZ3 4.21Å; L456-W531 HydrophobicContact CG-CE3 4.35Å; L456-W531 HydrophobicContact CG-CZ3 4.5Å; P457-W531 HydrophobicContact CB-CH2 4.13Å; P457-W531 HydrophobicContact CB-CZ2 4.06Å; C496-W531 HydrophobicContact CB-CE3 3.74Å; C496-W531 HydrophobicContact CB-CZ3 3.61Å; S524-W531 VanDerWaalsContact CB-CH2 3.45Å; S524-W531 VanDerWaalsContact OG-CH2 3.28Å; S524-W531 WeakPolarHBondContact OG-CH2 3.26Å; V529-W531 VanDerWaalsContact C-N 3.27Å; V529-W531 HydrophobicContact CB-CD2 4.06Å; V529-W531 HydrophobicContact CB-CG 4.4Å; V529-W531 HydrophobicContact CB-CZ2 4.01Å; V529-W531 HydrophobicContact CG1-CZ2 3.9Å; V529-W531 HydrophobicContact CG2-CD2 3.86Å; V529-W531 HydrophobicContact CG2-CE3 3.99Å; V529-W531 HydrophobicContact CG2-CH2 4.07Å; V529-W531 HydrophobicContact CG2-CZ2 3.91Å; V529-W531 HydrophobicContact CG2-CZ3 4.08Å; V529-W531 PolarHBondContact O-N 3.31Å; W531-D533 PolarHBondContact O-N 2.99Å
532	M	94.1	Very high	94.2	Very high	7 Å²	7	54.8 Å²	54.8	3%	0.034	31%	0.307	C	S	.	.			trans	-87.5	45.7	166.6	-82.9	-74.8	-166.9	0	0	110.7	Q494 A495 C496 S518 G520 V529 P530	Q494-M532 VanDerWaalsContact C-CE 3.46Å; Q494-M532 WeakPolarHBondContact O-CE 3.15Å; A495-M532 WeakPolarHBondContact O-CE 3.35Å; C496-M532 HydrophobicContact CB-CE 4.29Å; C496-M532 HydrophobicContact CB-SD 4.13Å; S518-M532 VanDerWaalsContact CB-SD 3.51Å; S518-M532 PolarHBondContact OG-SD 2.91Å; S518-M532 VanDerWaalsContact OG-SD 3.32Å; G520-M532 CarbonylContact C-O 3.57Å; G520-M532 VanDerWaalsContact C-O 3.31Å; G520-M532 WeakPolarHBondContact CA-O 3.16Å; V529-M532 HydrophobicContact CG2-CB 3.96Å; V529-M532 HydrophobicContact CG2-CG 3.48Å; V529-M532 VanDerWaalsContact CG2-CG 3.48Å; P530-M532 VanDerWaalsContact C-N 3.35Å
533	D	93.3	Very high	94.4	Very high	36 Å²	36	57 Å²	57	19%	0.193	31%	0.308	C	S	.	.			trans	-98.3	23.7	-171.3	68.4	-57	0	0	0	114.3	R516 W531 T535 R560 V564	R516-D533 WeakPolarHBondContact CD-OD1 3.42Å; R516-D533 IonicContact CZ-OD1 3.45Å; R516-D533 IonicContact NE-OD1 2.91Å; R516-D533 IonicContact NH1-OD1 3.88Å; R516-D533 PolarHBondContact NH1-OD1 2.87Å; R516-D533 IonicContact NH1-OD2 2.74Å; W531-D533 PolarHBondContact O-N 2.99Å; D533-T535 PolarHBondContact O-N 3.4Å; D533-R560 PolarHBondContact O-NH2 3.17Å; D533-R560 IonicContact OD2-CZ 3.11Å; D533-R560 IonicContact OD2-NH1 3.85Å; D533-R560 PolarHBondContact OD2-NH1 3.38Å; D533-R560 VanDerWaalsContact OD2-NH1 3.09Å; D533-R560 IonicContact OD2-NH2 3.37Å; D533-R560 PolarHBondContact OD2-NH2 3.27Å; D533-V564 HydrophobicContact CB-CG2 3.88Å
534	S	95.7	Very high	94.6	Very high	4 Å²	4	56.5 Å²	56.5	3%	0.028	30%	0.303	C	S	.	.			trans	-56.5	133.2	-177.2	-61	0	0	0	0	113.3	R516 S518 E538 K539	R516-S534 VanDerWaalsContact O-CB 3.32Å; R516-S534 WeakPolarHBondContact O-CB 3.38Å; R516-S534 PolarHBondContact O-OG 3.48Å; S518-S534 PolarHBondContact N-OG 2.94Å; S518-S534 PolarHBondContact OG-OG 2.88Å; S534-E538 VanDerWaalsContact CA-OE2 3.28Å; S534-E538 WeakPolarHBondContact CA-OE2 3.27Å; S534-K539 WeakPolarHBondContact O-CD 3.4Å; S534-K539 WeakPolarHBondContact O-CE 3.19Å; S534-K539 PolarHBondContact O-NZ 2.87Å
535	T	93.3	Very high	94.8	Very high	31 Å²	31	56.3 Å²	56.3	19%	0.19	30%	0.301	C	S	.	.			trans	-68.6	168.9	173.8	73.8	0	0	0	0	111.7	D533 E537 E538 K539	D533-T535 PolarHBondContact O-N 3.4Å; T535-E537 WeakPolarHBondContact CB-OE2 3.48Å; T535-E537 PolarHBondContact O-N 3.29Å; T535-E537 PolarHBondContact OG1-OE2 3.26Å; T535-E538 PolarHBondContact N-OE2 2.85Å; T535-E538 PolarHBondContact O-N 2.83Å; T535-E538 WeakPolarHBondContact OG1-CG 3.28Å; T535-E538 PolarHBondContact OG1-N 2.97Å; T535-K539 WeakPolarHBondContact O-CB 3.25Å; T535-K539 VanDerWaalsContact O-CG 3.29Å; T535-K539 WeakPolarHBondContact O-CG 3.5Å; T535-K539 PolarHBondContact O-N 2.61Å
536	P	95.5	Very high	94.9	Very high	94 Å²	94	52.4 Å²	52.4	61%	0.61	29%	0.288	S	S	*	.	H	α-helix	trans	-56.1	-37.4	177.9	-26.3	36.8	0	0	0	113.6	Q540	P536-Q540 WeakPolarHBondContact O-CB 3.48Å; P536-Q540 PolarHBondContact O-N 3.32Å
537	E	94.3	Very high	95.2	Very high	100 Å²	100	55.8 Å²	55.8	47%	0.467	28%	0.283	S	S	.	.	H	α-helix	trans	-73.5	-43.3	-178.8	-48.2	71.4	-151.8	0	0	110.9	T535 K539 Q540 L541 L557	T535-E537 WeakPolarHBondContact CB-OE2 3.48Å; T535-E537 PolarHBondContact O-N 3.29Å; T535-E537 PolarHBondContact OG1-OE2 3.26Å; E537-K539 VanDerWaalsContact C-N 3.31Å; E537-K539 PolarHBondContact O-N 3.36Å; E537-Q540 PolarHBondContact O-N 2.92Å; E537-L541 PolarHBondContact O-N 2.86Å; E537-L541 VanDerWaalsContact O-N 3.09Å; E537-L557 HydrophobicContact CB-CD2 4.06Å
538	E	97.5	Very high	95.3	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-61.9	-39.5	174	-67.3	175.8	151.2	0	0	111.5	T515 R516 L517 S534 T535 W542 L557 R560	T515-E538 WeakPolarHBondContact CA-OE1 3.32Å; T515-E538 VanDerWaalsContact CB-OE1 3.32Å; T515-E538 WeakPolarHBondContact CB-OE1 3.13Å; T515-E538 WeakPolarHBondContact OG1-CG 3.29Å; T515-E538 PolarHBondContact OG1-OE1 2.83Å; R516-E538 PolarHBondContact N-OE1 2.98Å; R516-E538 WeakPolarHBondContact O-CB 3.39Å; L517-E538 HydrophobicContact CD2-CB 4.49Å; S534-E538 VanDerWaalsContact CA-OE2 3.28Å; S534-E538 WeakPolarHBondContact CA-OE2 3.27Å; T535-E538 PolarHBondContact N-OE2 2.85Å; T535-E538 PolarHBondContact O-N 2.83Å; T535-E538 WeakPolarHBondContact OG1-CG 3.28Å; T535-E538 PolarHBondContact OG1-N 2.97Å; E538-W542 PolarHBondContact O-N 2.82Å; E538-L557 HydrophobicContact CG-CD1 4.34Å; E538-L557 HydrophobicContact CG-CD2 4.27Å; E538-R560 IonicContact OE1-CZ 3.58Å; E538-R560 IonicContact OE1-NE 3.66Å; E538-R560 PolarHBondContact OE1-NE 2.99Å; E538-R560 IonicContact OE1-NH2 2.76Å; E538-R560 PolarHBondContact OE1-NH2 3.06Å; E538-R560 IonicContact OE2-CZ 2.7Å; E538-R560 IonicContact OE2-NE 2.81Å; E538-R560 PolarHBondContact OE2-NE 2.89Å; E538-R560 IonicContact OE2-NH2 2.7Å; E538-R560 PolarHBondContact OE2-NH2 3.3Å
539	K	97.2	Very high	95.4	Very high	60 Å²	60	50.5 Å²	50.5	26%	0.261	26%	0.255	S	S	.	.	H	α-helix	trans	-65.4	-47.7	174.2	-79.1	167.2	169.1	156.7	0	112.2	L519 G520 S534 T535 E537 L541 W542 Q543	L519-K539 WeakPolarHBondContact O-CE 3.36Å; G520-K539 VanDerWaalsContact O-CE 3.22Å; G520-K539 WeakPolarHBondContact O-CE 3.43Å; G520-K539 PolarHBondContact O-NZ 3.16Å; S534-K539 WeakPolarHBondContact O-CD 3.4Å; S534-K539 WeakPolarHBondContact O-CE 3.19Å; S534-K539 PolarHBondContact O-NZ 2.87Å; T535-K539 WeakPolarHBondContact O-CB 3.25Å; T535-K539 VanDerWaalsContact O-CG 3.29Å; T535-K539 WeakPolarHBondContact O-CG 3.5Å; T535-K539 PolarHBondContact O-N 2.61Å; E537-K539 VanDerWaalsContact C-N 3.31Å; E537-K539 PolarHBondContact O-N 3.36Å; K539-L541 VanDerWaalsContact C-N 3.3Å; K539-L541 PolarHBondContact O-N 2.97Å; K539-W542 PolarHBondContact O-N 2.8Å; K539-Q543 WeakPolarHBondContact O-CB 3.45Å; K539-Q543 VanDerWaalsContact O-CG 3.28Å; K539-Q543 WeakPolarHBondContact O-CG 3.34Å; K539-Q543 PolarHBondContact O-N 2.9Å
540	Q	97.3	Very high	95.4	Very high	128 Å²	128	52 Å²	52	60%	0.598	27%	0.266	S	S	*	.	H	α-helix	trans	-60.4	-40.8	-179.4	-176.8	179.9	-4.1	0	0	111.4	P536 E537 Q543 T544	P536-Q540 WeakPolarHBondContact O-CB 3.48Å; P536-Q540 PolarHBondContact O-N 3.32Å; E537-Q540 PolarHBondContact O-N 2.92Å; Q540-Q543 PolarHBondContact O-N 2.91Å; Q540-T544 WeakPolarHBondContact O-CB 3.47Å; Q540-T544 PolarHBondContact O-N 2.81Å; Q540-T544 PolarHBondContact O-OG1 2.93Å
541	L	97.5	Very high	95.7	Very high	13 Å²	13	54.2 Å²	54.2	7%	0.068	27%	0.271	C	S	.	.	H	α-helix	trans	-64.3	-44.1	176.9	-170.4	67.5	0	0	0	111.7	L411 L517 E537 K539 T544 L545 V553 D554 L557	L411-L541 HydrophobicContact CD1-CD2 3.79Å; L411-L541 HydrophobicContact CD1-CG 3.83Å; L411-L541 HydrophobicContact CG-CD2 4.36Å; L517-L541 HydrophobicContact CD2-CB 4.46Å; L517-L541 HydrophobicContact CD2-CD2 3.88Å; E537-L541 PolarHBondContact O-N 2.86Å; E537-L541 VanDerWaalsContact O-N 3.09Å; K539-L541 VanDerWaalsContact C-N 3.3Å; K539-L541 PolarHBondContact O-N 2.97Å; L541-T544 PolarHBondContact O-N 2.73Å; L541-L545 PolarHBondContact O-N 3.36Å; L541-V553 HydrophobicContact CD1-CB 4.36Å; L541-V553 HydrophobicContact CD1-CG1 3.6Å; L541-D554 VanDerWaalsContact CD1-O 3.28Å; L541-D554 WeakPolarHBondContact CD1-O 3.46Å; L541-L557 HydrophobicContact CD2-CD1 3.79Å; L541-L557 HydrophobicContact CD2-CG 4.46Å
542	W	97.7	Very high	95.9	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-70.7	-32.6	178.6	-165.3	-99.7	0	0	0	113.5	L411 L429 L492 A497 L517 S518 E538 K539 L545 L546	L411-W542 HydrophobicContact CD1-CE3 4.32Å; L429-W542 HydrophobicContact CD1-CZ3 4.43Å; L429-W542 HydrophobicContact CD2-CH2 3.65Å; L429-W542 HydrophobicContact CD2-CZ3 4.13Å; L492-W542 HydrophobicContact CB-CZ2 4.4Å; L492-W542 HydrophobicContact CD2-CH2 4.31Å; L492-W542 HydrophobicContact CD2-CZ2 4.1Å; L492-W542 PolarHBondContact O-NE1 2.84Å; A497-W542 HydrophobicContact CB-CH2 3.97Å; A497-W542 HydrophobicContact CB-CZ3 3.87Å; L517-W542 HydrophobicContact CB-CD2 4.18Å; L517-W542 HydrophobicContact CB-CE3 3.48Å; L517-W542 VanDerWaalsContact CB-CE3 3.48Å; L517-W542 HydrophobicContact CB-CZ3 3.88Å; S518-W542 VanDerWaalsContact C-CD1 3.41Å; E538-W542 PolarHBondContact O-N 2.82Å; K539-W542 PolarHBondContact O-N 2.8Å; W542-L545 HydrophobicContact CD2-CD2 4.21Å; W542-L545 HydrophobicContact CE3-CD2 3.64Å; W542-L545 HydrophobicContact CZ3-CD2 3.86Å; W542-L546 WeakPolarHBondContact O-CG 3.28Å; W542-L546 PolarHBondContact O-N 3.04Å
543	Q	97.3	Very high	96.1	Very high	84 Å²	84	58.9 Å²	58.9	39%	0.393	29%	0.29	S	S	.	.	H	α-helix	trans	-65.1	-47.9	170.9	-74.6	169.3	-11.6	0	0	110.9	L519 K539 Q540 L545 L546 E547	L519-Q543 HydrophobicContact CD2-CG 3.63Å; K539-Q543 WeakPolarHBondContact O-CB 3.45Å; K539-Q543 VanDerWaalsContact O-CG 3.28Å; K539-Q543 WeakPolarHBondContact O-CG 3.34Å; K539-Q543 PolarHBondContact O-N 2.9Å; Q540-Q543 PolarHBondContact O-N 2.91Å; Q543-L545 VanDerWaalsContact C-N 3.28Å; Q543-L545 PolarHBondContact O-N 3.4Å; Q543-L546 WeakPolarHBondContact O-CB 3.43Å; Q543-L546 PolarHBondContact O-N 3.25Å; Q543-E547 WeakPolarHBondContact O-CG 3.49Å; Q543-E547 PolarHBondContact O-N 2.98Å
544	T	97	Very high	96.2	Very high	29 Å²	29	62.1 Å²	62.1	18%	0.178	31%	0.308	C	S	.	.	H	α-helix	trans	-60.6	-38.2	179	-52.4	0	0	0	0	111.6	Q540 L541 L546 E547 R548 V553	Q540-T544 WeakPolarHBondContact O-CB 3.47Å; Q540-T544 PolarHBondContact O-N 2.81Å; Q540-T544 PolarHBondContact O-OG1 2.93Å; L541-T544 PolarHBondContact O-N 2.73Å; T544-L546 PolarHBondContact O-N 3.04Å; T544-E547 PolarHBondContact O-N 3.3Å; T544-R548 HydrophobicContact CG2-CG 4.47Å; T544-R548 WeakPolarHBondContact O-CB 3.41Å; T544-R548 PolarHBondContact O-N 2.77Å; T544-V553 HydrophobicContact CG2-CG1 3.56Å; T544-V553 HydrophobicContact CG2-CG2 4.07Å
545	L	96.7	Very high	96.2	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-59.7	-40.4	172.7	173.8	68.7	0	0	0	113.2	L411 L429 L541 W542 Q543	L411-L545 HydrophobicContact CB-CD1 3.81Å; L411-L545 HydrophobicContact CB-CD2 4.13Å; L411-L545 HydrophobicContact CB-CG 4.43Å; L411-L545 HydrophobicContact CD1-CD2 4.02Å; L429-L545 HydrophobicContact CD1-CD2 3.74Å; L541-L545 PolarHBondContact O-N 3.36Å; W542-L545 HydrophobicContact CD2-CD2 4.21Å; W542-L545 HydrophobicContact CE3-CD2 3.64Å; W542-L545 HydrophobicContact CZ3-CD2 3.86Å; Q543-L545 VanDerWaalsContact C-N 3.28Å; Q543-L545 PolarHBondContact O-N 3.4Å
546	L	95.3	Very high	96.3	Very high	29 Å²	29	65.4 Å²	65.4	15%	0.152	33%	0.326	C	S	.	.	H	α-helix	trans	-75.1	-28.3	178	-71.7	170.6	0	0	0	112.9	L492 R493 L519 W542 Q543 T544	L492-L546 HydrophobicContact CB-CD2 3.65Å; L492-L546 HydrophobicContact CD1-CD2 4.22Å; R493-L546 HydrophobicContact CG-CD1 4.3Å; L519-L546 HydrophobicContact CD1-CD1 4.32Å; L519-L546 HydrophobicContact CD2-CD1 3.97Å; L519-L546 HydrophobicContact CG-CD1 4.28Å; W542-L546 WeakPolarHBondContact O-CG 3.28Å; W542-L546 PolarHBondContact O-N 3.04Å; Q543-L546 WeakPolarHBondContact O-CB 3.43Å; Q543-L546 PolarHBondContact O-N 3.25Å; T544-L546 PolarHBondContact O-N 3.04Å
547	E	96.4	Very high	96.4	Very high	145 Å²	145	61.1 Å²	61.1	68%	0.678	30%	0.299	S	S	*	.	H	α-helix	trans	-81.1	-25.2	177.2	-71.5	171	-169.2	0	0	112.8	Q543 T544 P549	Q543-E547 WeakPolarHBondContact O-CG 3.49Å; Q543-E547 PolarHBondContact O-N 2.98Å; T544-E547 PolarHBondContact O-N 3.3Å; E547-P549 VanDerWaalsContact C-CD 3.42Å; E547-P549 WeakPolarHBondContact O-CD 3.46Å
548	R	95.9	Very high	96.3	Very high	134 Å²	134	58 Å²	58	51%	0.506	29%	0.287	S	S	.	.	S	Bend	trans	-123.8	65.4	-176.5	-53.6	-169.6	-170.3	-170	2.5	112.4	T544 E551	T544-R548 HydrophobicContact CG2-CG 4.47Å; T544-R548 WeakPolarHBondContact O-CB 3.41Å; T544-R548 PolarHBondContact O-N 2.77Å; R548-E551 HydrophobicContact CB-CB 4.14Å; R548-E551 HydrophobicContact CB-CG 4.41Å; R548-E551 VanDerWaalsContact CD-OE2 3.28Å; R548-E551 WeakPolarHBondContact CD-OE2 3.4Å; R548-E551 IonicContact NH1-OE2 3.76Å; R548-E551 PolarHBondContact O-N 2.89Å
549	P	94	Very high	96.1	Very high	61 Å²	61	58.1 Å²	58.1	40%	0.396	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	150.4	171.9	28.1	-35.3	0	0	0	110.8	Y413 P415 E547 E551	Y413-P549 HydrophobicContact CD1-CB 4.46Å; P415-P549 HydrophobicContact CG-CB 3.95Å; E547-P549 VanDerWaalsContact C-CD 3.42Å; E547-P549 WeakPolarHBondContact O-CD 3.46Å; P549-E551 PolarHBondContact O-N 3.28Å; P549-E551 VanDerWaalsContact O-N 3.12Å
550	C	94.2	Very high	95.9	Very high	53 Å²	53	55.8 Å²	55.8	36%	0.358	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.8	-8.3	-174.1	-58.1	0	0	0	0	116.7	K412 Y413 S418	K412-C550 WeakPolarHBondContact CE-O 3.36Å; Y413-C550 PolarHBondContact O-N 3.19Å; S418-C550 PolarHBondContact OG-SG 2.96Å; S418-C550 VanDerWaalsContact OG-SG 3.37Å
551	E	96.4	Very high	95.5	Very high	105 Å²	105	51.7 Å²	51.7	49%	0.491	26%	0.261	S	S	.	.	S	Bend	trans	-90.9	156.3	172.4	-63	-168.3	173.6	0	0	112.5	K412 R548 P549	K412-E551 WeakPolarHBondContact CA-O 3.39Å; K412-E551 WeakPolarHBondContact CB-O 3.14Å; K412-E551 WeakPolarHBondContact CG-O 3.06Å; R548-E551 HydrophobicContact CB-CB 4.14Å; R548-E551 HydrophobicContact CB-CG 4.41Å; R548-E551 VanDerWaalsContact CD-OE2 3.28Å; R548-E551 WeakPolarHBondContact CD-OE2 3.4Å; R548-E551 IonicContact NH1-OE2 3.76Å; R548-E551 PolarHBondContact O-N 2.89Å; P549-E551 PolarHBondContact O-N 3.28Å; P549-E551 VanDerWaalsContact O-N 3.12Å
552	W	97.5	Very high	94.9	Very high	113 Å²	113	55.8 Å²	55.8	43%	0.428	28%	0.283	S	S	.	.			trans	-89.1	126.1	166.9	-74.5	104.4	0	0	0	110	S410 L411 K412 H430 W432 T481	S410-W552 VanDerWaalsContact CB-CE3 3.45Å; L411-W552 CarbonylContact O-C 3.6Å; L411-W552 WeakPolarHBondContact O-CA 3.49Å; K412-W552 HydrophobicContact CB-CD2 3.69Å; K412-W552 HydrophobicContact CB-CE3 3.58Å; K412-W552 HydrophobicContact CB-CG 4.27Å; K412-W552 HydrophobicContact CB-CH2 4.23Å; K412-W552 HydrophobicContact CB-CZ2 4.3Å; K412-W552 HydrophobicContact CB-CZ3 3.86Å; K412-W552 HydrophobicContact CD-CD2 4.48Å; K412-W552 HydrophobicContact CD-CZ2 4.36Å; H430-W552 HydrophobicContact CB-CH2 3.71Å; H430-W552 HydrophobicContact CB-CZ3 4.02Å; W432-W552 HydrophobicContact CB-CH2 3.96Å; W432-W552 HydrophobicContact CB-CZ3 3.79Å; T481-W552 HydrophobicContact CG2-CH2 4.34Å
553	V	97.3	Very high	94.5	Very high	17 Å²	17	56.9 Å²	56.9	10%	0.103	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	118.7	175.8	-167.7	0	0	0	0	109.2	S410 L411 L541 T544	S410-V553 CarbonylContact C-O 3.56Å; S410-V553 VanDerWaalsContact CA-O 3.3Å; S410-V553 WeakPolarHBondContact CA-O 2.97Å; L411-V553 PolarHBondContact N-O 2.62Å; L411-V553 PolarHBondContact O-N 3.02Å; L541-V553 HydrophobicContact CD1-CB 4.36Å; L541-V553 HydrophobicContact CD1-CG1 3.6Å; T544-V553 HydrophobicContact CG2-CG1 3.56Å; T544-V553 HydrophobicContact CG2-CG2 4.07Å
554	D	97.3	Very high	94	Very high	105 Å²	105	55.7 Å²	55.7	56%	0.561	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.2	141.4	-179.8	-83.1	-11.1	0	0	0	112.5	S410 K434 L541	S410-D554 WeakPolarHBondContact CB-OD1 3.31Å; S410-D554 PolarHBondContact OG-OD1 3Å; K434-D554 IonicContact NZ-OD1 3.58Å; K434-D554 PolarHBondContact NZ-OD1 2.77Å; K434-D554 IonicContact NZ-OD2 2.67Å; K434-D554 PolarHBondContact NZ-OD2 2.64Å; K434-D554 VanDerWaalsContact NZ-OD2 3.11Å; L541-D554 VanDerWaalsContact CD1-O 3.28Å; L541-D554 WeakPolarHBondContact CD1-O 3.46Å
555	G	94.8	Very high	93.3	Very high	13 Å²	13	59.1 Å²	59.1	13%	0.134	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	143.4	177.9	0	0	0	0	0	113.5	L409	L409-G555 PolarHBondContact N-O 3.27Å; L409-G555 PolarHBondContact O-N 3.29Å
556	L	95.9	Very high	92.5	Very high	90 Å²	90	62.4 Å²	62.4	47%	0.471	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	105.9	172.9	-178.2	66.8	0	0	0	108.1	L406 L407	L406-L556 HydrophobicContact CB-CD1 3.82Å; L406-L556 HydrophobicContact CB-CG 4.27Å; L406-L556 HydrophobicContact CD1-CD2 4.28Å; L406-L556 HydrophobicContact CD1-CG 4.39Å; L407-L556 WeakPolarHBondContact O-CA 3.08Å
557	L	96.1	Very high	90.9	Very high	5 Å²	5	68.3 Å²	68.3	3%	0.026	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	148.2	-165	-65.1	175.2	0	0	0	112.8	L406 L407 L409 T515 L517 E537 E538 L541	L406-L557 CarbonylContact C-O 3.57Å; L406-L557 VanDerWaalsContact CA-O 3.31Å; L406-L557 WeakPolarHBondContact CA-O 3.11Å; L407-L557 PolarHBondContact N-O 2.8Å; L407-L557 PolarHBondContact O-N 2.85Å; L409-L557 HydrophobicContact CD2-CD1 4.37Å; T515-L557 HydrophobicContact CG2-CD1 4.4Å; L517-L557 HydrophobicContact CD2-CD1 3.54Å; E537-L557 HydrophobicContact CB-CD2 4.06Å; E538-L557 HydrophobicContact CG-CD1 4.34Å; E538-L557 HydrophobicContact CG-CD2 4.27Å; L541-L557 HydrophobicContact CD2-CD1 3.79Å; L541-L557 HydrophobicContact CD2-CG 4.46Å
558	P	92.8	Very high	90.6	Very high	34 Å²	34	64.5 Å²	64.5	22%	0.221	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	133.9	175.5	27.1	-33.7	0	0	0	111.6	R560	P558-R560 HydrophobicContact CB-CG 4.1Å; P558-R560 HydrophobicContact CG-CG 3.97Å; P558-R560 PolarHBondContact O-N 3.03Å
559	L	94.6	Very high	90.4	Very high	2 Å²	2	60.8 Å²	60.8	1%	0.01	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	74.4	166.8	-75.4	166.9	0	0	0	109.4	S403 R404 G405 L407 A436 L439 L501 G514	S403-L559 WeakPolarHBondContact CA-O 3.5Å; S403-L559 PolarHBondContact OG-N 2.78Å; S403-L559 VanDerWaalsContact OG-N 3.16Å; S403-L559 PolarHBondContact OG-O 3.13Å; R404-L559 PolarHBondContact N-O 3.4Å; G405-L559 PolarHBondContact O-N 3.29Å; L407-L559 HydrophobicContact CB-CD1 4.37Å; L407-L559 HydrophobicContact CB-CD2 3.97Å; L407-L559 HydrophobicContact CB-CG 3.99Å; L407-L559 HydrophobicContact CD2-CD2 4.31Å; A436-L559 HydrophobicContact CB-CD1 4.08Å; L439-L559 HydrophobicContact CD2-CD1 3.63Å; L501-L559 HydrophobicContact CB-CD1 4.34Å; L501-L559 HydrophobicContact CB-CD2 3.9Å; L501-L559 HydrophobicContact CD2-CD1 3.68Å; G514-L559 CarbonylContact O-C 3.47Å
560	R	92.5	Very high	90.2	Very high	11 Å²	11	60.8 Å²	60.8	4%	0.042	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58	143.5	-176.9	-60.2	-167.1	-70.2	123.9	-21.2	112.1	P402 G513 G514 D533 E538 P558 N562 L563	P402-R560 WeakPolarHBondContact O-CA 3.48Å; G513-R560 CarbonylContact C-O 3.53Å; G513-R560 WeakPolarHBondContact CA-O 3.13Å; G514-R560 PolarHBondContact N-O 2.99Å; G514-R560 WeakPolarHBondContact O-CB 3.31Å; G514-R560 PolarHBondContact O-N 3.27Å; D533-R560 PolarHBondContact O-NH2 3.17Å; D533-R560 IonicContact OD2-CZ 3.11Å; D533-R560 IonicContact OD2-NH1 3.85Å; D533-R560 PolarHBondContact OD2-NH1 3.38Å; D533-R560 VanDerWaalsContact OD2-NH1 3.09Å; D533-R560 IonicContact OD2-NH2 3.37Å; D533-R560 PolarHBondContact OD2-NH2 3.27Å; E538-R560 IonicContact OE1-CZ 3.58Å; E538-R560 IonicContact OE1-NE 3.66Å; E538-R560 PolarHBondContact OE1-NE 2.99Å; E538-R560 IonicContact OE1-NH2 2.76Å; E538-R560 PolarHBondContact OE1-NH2 3.06Å; E538-R560 IonicContact OE2-CZ 2.7Å; E538-R560 IonicContact OE2-NE 2.81Å; E538-R560 PolarHBondContact OE2-NE 2.89Å; E538-R560 IonicContact OE2-NH2 2.7Å; E538-R560 PolarHBondContact OE2-NH2 3.3Å; P558-R560 HydrophobicContact CB-CG 4.1Å; P558-R560 HydrophobicContact CG-CG 3.97Å; P558-R560 PolarHBondContact O-N 3.03Å; R560-N562 PolarHBondContact NH1-OD1 2.97Å; R560-L563 HydrophobicContact CB-CD1 3.63Å; R560-L563 WeakPolarHBondContact O-CD1 3.38Å
561	T	88.1	Confident	89.9	Confident	42 Å²	42	61.2 Å²	61.2	26%	0.258	35%	0.349	S	S	.	.	S	Bend	trans	-89.8	-25.4	169.4	51.2	0	0	0	0	112.3	L401 P402 R404 L563	L401-T561 WeakPolarHBondContact O-CB 3.11Å; L401-T561 WeakPolarHBondContact O-CG2 3.41Å; L401-T561 PolarHBondContact O-OG1 2.98Å; P402-T561 PolarHBondContact O-N 3.38Å; R404-T561 HydrophobicContact CG-CG2 3.83Å; T561-L563 VanDerWaalsContact C-N 3.32Å; T561-L563 PolarHBondContact O-N 3.04Å
562	N	85.1	Confident	89.5	Confident	100 Å²	100	58.5 Å²	58.5	54%	0.535	34%	0.34	S	S	.	.			trans	-88.8	27.9	-169.4	74.5	-14.1	0	0	0	115.1	R560 V564	R560-N562 PolarHBondContact NH1-OD1 2.97Å; N562-V564 PolarHBondContact O-N 2.68Å
563	L	89	Confident	89	Confident	23 Å²	23	54.9 Å²	54.9	12%	0.12	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-61.4	120.8	175.1	-85.2	69.4	0	0	0	108.7	E498 R516 R560 T561	E498-L563 HydrophobicContact CG-CD2 3.87Å; R516-L563 HydrophobicContact CG-CD2 4.07Å; R516-L563 HydrophobicContact CG-CG 4.43Å; R560-L563 HydrophobicContact CB-CD1 3.63Å; R560-L563 WeakPolarHBondContact O-CD1 3.38Å; T561-L563 VanDerWaalsContact C-N 3.32Å; T561-L563 PolarHBondContact O-N 3.04Å
564	V	86.4	Confident	88.4	Confident	59 Å²	59	57.6 Å²	57.6	36%	0.358	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-61.4	131.8	-179.1	-169.7	0	0	0	0	109.2	R516 P530 D533 N562 R566	R516-V564 VanDerWaalsContact CZ-O 3.26Å; R516-V564 PolarHBondContact NH1-O 3.25Å; R516-V564 PolarHBondContact NH2-O 2.65Å; P530-V564 HydrophobicContact CB-CG1 3.76Å; P530-V564 WeakPolarHBondContact O-CB 3.16Å; D533-V564 HydrophobicContact CB-CG2 3.88Å; N562-V564 PolarHBondContact O-N 2.68Å; V564-R566 PolarHBondContact O-N 2.66Å
565	P	82.7	Confident	87.7	Confident	101 Å²	101	53.9 Å²	53.9	66%	0.656	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-52.9	142.3	-178.9	-29.9	36.4	0	0	0	113.1	A567	P565-A567 PolarHBondContact O-N 3.2Å
566	R	81.3	Confident	87.1	Confident	68 Å²	68	57.3 Å²	57.3	26%	0.257	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-71.5	116.9	164.8	-49.3	-177.8	-162.5	175.7	1.2	105.8	S454 E498 V564	S454-R566 PolarHBondContact OG-NH2 3.26Å; E498-R566 IonicContact OE1-CZ 2.65Å; E498-R566 IonicContact OE1-NE 2.74Å; E498-R566 IonicContact OE1-NH2 3.43Å; E498-R566 PolarHBondContact OE1-NH2 3.27Å; E498-R566 IonicContact OE2-CZ 3.62Å; E498-R566 IonicContact OE2-NE 3.36Å; E498-R566 PolarHBondContact OE2-NE 3.44Å; E498-R566 IonicContact OE2-NH2 3.39Å; E498-R566 PolarHBondContact OE2-NH2 3.22Å; V564-R566 PolarHBondContact O-N 2.66Å
567	A	60.9	Low	86.3	Confident	153 Å²	153	54.4 Å²	54.4	100%	1.264	34%	0.341	S	S	*	.			trans	-85.7	0	-174.3	0	0	0	0	0	112.1	P530 P565	P530-A567 HydrophobicContact CG-CB 4.17Å; P565-A567 PolarHBondContact O-N 3.2Å

Retrieved 567 of 567 residues in 1069.9 ms (Link to these results)

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