A0A3Q0KRY6_SCHMA Loading...

m7GpppX diphosphatase

Decapping scavenger enzyme that catalyzes the cleavage of a residual cap structure following the degradation of mRNAs by the 3'->5' exosome-mediated mRNA decay pathway.

AlphaFold DB , UniProt , Accession A0A3Q0KRY6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 390 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28	Very low	31.7	Very low	251 Å²	251	144.2 Å²	144.2	100%	1.236	80%	0.799	S	S	*	*				0	91	0	-73.2	-179.6	176.4	0	0	107.6
2	S	29.8	Very low	31.9	Very low	113 Å²	113	139.9 Å²	139.9	79%	0.79	78%	0.782	S	S	*	*			trans	-144.2	103.1	166.8	51.3	0	0	0	0	104.1	N4	S2-N4 PolarHBondContact O-N 2.8Å
3	E	28.1	Very low	32.5	Very low	193 Å²	193	134.8 Å²	134.8	90%	0.902	76%	0.759	S	S	*	*			trans	-57.5	125.6	179.7	-69.5	171.2	145.8	0	0	108.9	S5	E3-S5 PolarHBondContact O-N 2.92Å
4	N	33	Very low	33	Very low	140 Å²	140	133.3 Å²	133.3	75%	0.749	75%	0.754	S	S	*	*			trans	-54.9	109.5	165.5	-87.7	-20	0	0	0	107.6	S2 F6	S2-N4 PolarHBondContact O-N 2.8Å; N4-F6 HydrophobicContact CB-CD2 4.05Å; N4-F6 HydrophobicContact CB-CE2 4.14Å; N4-F6 PolarHBondContact O-N 3.4Å
5	S	29.7	Very low	33.2	Very low	116 Å²	116	131.1 Å²	131.1	81%	0.811	75%	0.747	S	S	*	*			trans	-73.7	78.1	169.1	74.6	0	0	0	0	108.7	E3 R7	E3-S5 PolarHBondContact O-N 2.92Å; S5-R7 PolarHBondContact O-N 2.86Å
6	F	37.2	Very low	33.5	Very low	113 Å²	113	130.1 Å²	130.1	50%	0.496	75%	0.747	S	S	.	*			trans	-63.7	126.5	149.6	-77.8	-82.4	0	0	0	106	N4 V8 D10	N4-F6 HydrophobicContact CB-CD2 4.05Å; N4-F6 HydrophobicContact CB-CE2 4.14Å; N4-F6 PolarHBondContact O-N 3.4Å; F6-V8 PolarHBondContact O-N 3Å; F6-D10 HydrophobicContact CB-CB 4.38Å; F6-D10 HydrophobicContact CD1-CB 3.8Å
7	R	30.9	Very low	34	Very low	202 Å²	202	133.1 Å²	133.1	76%	0.762	75%	0.75	S	S	*	*			trans	-60	140.1	171.4	-74.5	-179.1	171.8	-173.8	-1.8	106.6	S5 G9 D10	S5-R7 PolarHBondContact O-N 2.86Å; R7-G9 VanDerWaalsContact C-N 3.35Å; R7-G9 PolarHBondContact O-N 3.39Å; R7-D10 PolarHBondContact N-OD2 3.2Å; R7-D10 PolarHBondContact O-N 3.46Å
8	V	29.7	Very low	34.1	Very low	162 Å²	162	135.8 Å²	135.8	98%	0.982	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.4	102.3	170.7	178.2	0	0	0	0	107.2	F6	F6-V8 PolarHBondContact O-N 3Å
9	G	33.5	Very low	34.6	Very low	75 Å²	75	137.4 Å²	137.4	77%	0.773	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	133	-20.6	-173	0	0	0	0	0	115.6	R7 T11	R7-G9 VanDerWaalsContact C-N 3.35Å; R7-G9 PolarHBondContact O-N 3.39Å; G9-T11 PolarHBondContact O-N 3.2Å
10	D	34.7	Very low	34.6	Very low	91 Å²	91	135.3 Å²	135.3	49%	0.487	75%	0.747	S	S	.	*			trans	-78.3	112.2	178.7	-68.8	-28.9	0	0	0	110.2	F6 R7	F6-D10 HydrophobicContact CB-CB 4.38Å; F6-D10 HydrophobicContact CD1-CB 3.8Å; R7-D10 PolarHBondContact N-OD2 3.2Å; R7-D10 PolarHBondContact O-N 3.46Å
11	T	33.9	Very low	34.9	Very low	130 Å²	130	136 Å²	136	80%	0.798	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-62.1	127.5	166.5	25.6	0	0	0	0	109.2	G9	G9-T11 PolarHBondContact O-N 3.2Å
12	P	34.4	Very low	35.4	Very low	93 Å²	93	131.3 Å²	131.3	60%	0.604	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-59.8	145.5	175.2	23.6	-31.2	0	0	0	110	V14	P12-V14 PolarHBondContact O-N 3.45Å
13	P	39.8	Very low	35.6	Very low	74 Å²	74	130.9 Å²	130.9	48%	0.481	71%	0.707	S	S	.	*	P	Polyproline II helix	trans	-57.5	135.6	-178.5	22.4	-31.8	0	0	0	110	P15	P13-P15 WeakPolarHBondContact O-CD 3.29Å
14	V	39.8	Very low	36.4	Very low	113 Å²	113	126.3 Å²	126.3	69%	0.685	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-66	120.1	178.3	178.6	0	0	0	0	107.8	P12	P12-V14 PolarHBondContact O-N 3.45Å
15	P	36.1	Very low	36.6	Very low	100 Å²	100	124.1 Å²	124.1	65%	0.649	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-60.2	135.1	178.6	22.1	-30.3	0	0	0	109	P13 K17	P13-P15 WeakPolarHBondContact O-CD 3.29Å; P15-K17 PolarHBondContact O-N 2.88Å
16	P	37.5	Very low	36.9	Very low	116 Å²	116	123 Å²	123	75%	0.753	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-59.3	117.7	-177.6	21.9	-31.1	0	0	0	109.6
17	K	42.4	Very low	37.1	Very low	181 Å²	181	122.1 Å²	122.1	79%	0.787	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-67.7	151.1	168.9	-71.2	-177.6	178.2	177.9	0	109.2	P15 R19	P15-K17 PolarHBondContact O-N 2.88Å; K17-R19 PolarHBondContact O-N 2.57Å; K17-R19 VanDerWaalsContact O-N 3.16Å
18	K	34.7	Very low	37.4	Very low	182 Å²	182	119.2 Å²	119.2	79%	0.791	68%	0.679	S	S	*	*			trans	-43	121.1	178.6	-174.3	176	-178.6	175.6	0	110.3	A20	K18-A20 PolarHBondContact O-N 2.75Å
19	R	43.6	Very low	37.7	Very low	166 Å²	166	117.3 Å²	117.3	63%	0.626	67%	0.668	S	S	*	*			trans	-74.1	111.7	176.7	-66.5	-179.9	179.2	-178.9	-0.9	108.1	K17	K17-R19 PolarHBondContact O-N 2.57Å; K17-R19 VanDerWaalsContact O-N 3.16Å
20	A	36.1	Very low	37.9	Very low	94 Å²	94	118.4 Å²	118.4	78%	0.777	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-75	134.5	173.6	0	0	0	0	0	109.5	K18	K18-A20 PolarHBondContact O-N 2.75Å
21	R	40.2	Very low	37.9	Very low	152 Å²	152	121.3 Å²	121.3	57%	0.574	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-83.8	131.4	163.8	-83.3	-173	-178.7	174.4	0	108.7	W234 D235	R21-W234 PolarHBondContact NH2-O 3.31Å; R21-D235 PolarHBondContact NH1-O 3.16Å; R21-D235 PolarHBondContact NH2-O 3.15Å
22	L	38.2	Very low	37.8	Very low	151 Å²	151	117.6 Å²	117.6	79%	0.791	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-88.5	135.7	158.6	-86.7	126.3	0	0	0	108.2	V24	L22-V24 PolarHBondContact O-N 3.35Å
23	D	34.8	Very low	38.2	Very low	105 Å²	105	116 Å²	116	56%	0.561	65%	0.653	S	S	*	*			trans	-74.9	109.4	175.9	-161.6	-22.7	0	0	0	109.1	S25 T26	D23-S25 PolarHBondContact O-N 3.34Å; D23-S25 VanDerWaalsContact O-N 3.16Å; D23-S25 PolarHBondContact OD1-N 3.26Å; D23-S25 PolarHBondContact OD1-OG 3.31Å; D23-T26 PolarHBondContact O-N 3.09Å; D23-T26 VanDerWaalsContact O-N 3.15Å; D23-T26 PolarHBondContact O-OG1 3.47Å
24	V	44.2	Very low	38.6	Very low	97 Å²	97	117.9 Å²	117.9	59%	0.588	66%	0.664	S	S	*	*	G	3₁₀ helix	trans	-64.7	-20.5	-173.2	-175.2	0	0	0	0	111.7	L22 T26 V27	L22-V24 PolarHBondContact O-N 3.35Å; V24-T26 PolarHBondContact O-N 3.46Å; V24-T26 VanDerWaalsContact O-N 3.11Å; V24-V27 HydrophobicContact CG1-CG2 4.45Å; V24-V27 WeakPolarHBondContact O-CG2 3.36Å; V24-V27 PolarHBondContact O-N 3.17Å
25	S	38.1	Very low	39.4	Very low	93 Å²	93	118.2 Å²	118.2	65%	0.65	66%	0.662	S	S	*	*	G	3₁₀ helix	trans	-64.7	-11.1	175.5	64.3	0	0	0	0	114.4	D23	D23-S25 PolarHBondContact O-N 3.34Å; D23-S25 VanDerWaalsContact O-N 3.16Å; D23-S25 PolarHBondContact OD1-N 3.26Å; D23-S25 PolarHBondContact OD1-OG 3.31Å
26	T	35.8	Very low	40.5	Very low	92 Å²	92	116.2 Å²	116.2	56%	0.564	65%	0.654	S	S	*	*	G	3₁₀ helix	trans	-104.7	5.6	178.4	57	0	0	0	0	114.1	D23 V24 D28	D23-T26 PolarHBondContact O-N 3.09Å; D23-T26 VanDerWaalsContact O-N 3.15Å; D23-T26 PolarHBondContact O-OG1 3.47Å; V24-T26 PolarHBondContact O-N 3.46Å; V24-T26 VanDerWaalsContact O-N 3.11Å; T26-D28 PolarHBondContact O-N 3.09Å
27	V	39.9	Very low	41.8	Very low	96 Å²	96	113.4 Å²	113.4	58%	0.582	63%	0.634	S	S	*	*			trans	-82.3	53.6	-179.2	-165.6	0	0	0	0	110.6	V24	V24-V27 HydrophobicContact CG1-CG2 4.45Å; V24-V27 WeakPolarHBondContact O-CG2 3.36Å; V24-V27 PolarHBondContact O-N 3.17Å
28	D	37.2	Very low	43.5	Very low	141 Å²	141	107.1 Å²	107.1	75%	0.754	61%	0.613	S	S	*	*	S	Bend	trans	-94.4	105.8	159.6	-79.7	-31.7	0	0	0	107.4	T26 V30	T26-D28 PolarHBondContact O-N 3.09Å; D28-V30 PolarHBondContact O-N 3.47Å
29	T	37.5	Very low	46	Very low	122 Å²	122	101 Å²	101	75%	0.748	59%	0.587	S	S	*	*			trans	55	54	165.9	-17.1	0	0	0	0	115.8	N31	T29-N31 PolarHBondContact O-N 3.3Å
30	V	36.2	Very low	48.1	Very low	98 Å²	98	98.5 Å²	98.5	59%	0.594	58%	0.577	S	S	*	*			trans	-75.9	80.3	165.4	-173.2	0	0	0	0	109.6	D28 G32	D28-V30 PolarHBondContact O-N 3.47Å; V30-G32 PolarHBondContact O-N 3.46Å
31	N	35.8	Very low	50.6	Low	151 Å²	151	99 Å²	99	81%	0.807	57%	0.573	S	S	*	*			trans	-65.1	90	151.8	-86.6	-26.5	0	0	0	108	T29	T29-N31 PolarHBondContact O-N 3.3Å
32	G	32.2	Very low	53	Low	53 Å²	53	99.6 Å²	99.6	55%	0.546	58%	0.582	S	S	.	*			trans	102.8	76.7	162.7	0	0	0	0	0	115.9	V30	V30-G32 PolarHBondContact O-N 3.46Å
33	S	42.7	Very low	55.5	Low	58 Å²	58	95.4 Å²	95.4	41%	0.406	56%	0.56	S	S	.	*			trans	-88.7	132	135.5	90.2	0	0	0	0	106.9	D35 A36 T37	S33-D35 PolarHBondContact O-N 3.4Å; S33-A36 PolarHBondContact O-N 3.48Å; S33-A36 VanDerWaalsContact O-N 3.14Å; S33-A36 VanDerWaalsContact OG-CB 3.32Å; S33-A36 WeakPolarHBondContact OG-CB 3.47Å; S33-A36 PolarHBondContact OG-N 2.92Å; S33-T37 PolarHBondContact O-N 3.37Å
34	T	47.7	Very low	58.3	Low	115 Å²	115	92.3 Å²	92.3	71%	0.706	54%	0.543	S	S	*	.	H	α-helix	trans	-57.2	-33	-177.7	43.3	0	0	0	0	111.9	T37	T34-T37 PolarHBondContact O-N 2.83Å; T34-T37 PolarHBondContact O-OG1 3.04Å
35	D	55.6	Low	60.7	Low	120 Å²	120	92.4 Å²	92.4	64%	0.642	54%	0.537	S	S	*	.	H	α-helix	trans	-75.1	-29.9	179.8	-70.7	-6.3	0	0	0	113.1	S33 T37 S38 F39	S33-D35 PolarHBondContact O-N 3.4Å; D35-T37 PolarHBondContact O-N 3.28Å; D35-S38 PolarHBondContact O-OG 3.02Å; D35-F39 VanDerWaalsContact O-CD2 3.27Å; D35-F39 WeakPolarHBondContact O-CD2 3.34Å
36	A	59.8	Low	63.5	Low	58 Å²	58	93 Å²	93	48%	0.479	53%	0.532	S	S	.	.	H	α-helix	trans	-70.3	-24.4	175.3	0	0	0	0	0	111.9	S33 S38 F39	S33-A36 PolarHBondContact O-N 3.48Å; S33-A36 VanDerWaalsContact O-N 3.14Å; S33-A36 VanDerWaalsContact OG-CB 3.32Å; S33-A36 WeakPolarHBondContact OG-CB 3.47Å; S33-A36 PolarHBondContact OG-N 2.92Å; A36-S38 VanDerWaalsContact C-N 3.33Å; A36-S38 PolarHBondContact O-N 3.21Å; A36-F39 PolarHBondContact O-N 3.4Å
37	T	64.8	Low	66.2	Low	56 Å²	56	92.3 Å²	92.3	34%	0.344	52%	0.524	S	S	.	.	H	α-helix	trans	-68.8	-29.7	-179.2	68.3	0	0	0	0	113.2	S33 T34 D35 F39 N43	S33-T37 PolarHBondContact O-N 3.37Å; T34-T37 PolarHBondContact O-N 2.83Å; T34-T37 PolarHBondContact O-OG1 3.04Å; D35-T37 PolarHBondContact O-N 3.28Å; T37-F39 VanDerWaalsContact C-N 3.34Å; T37-F39 PolarHBondContact O-N 2.93Å; T37-N43 PolarHBondContact O-ND2 3.45Å
38	S	78	Confident	68.8	Low	50 Å²	50	90.1 Å²	90.1	35%	0.35	51%	0.513	S	S	.	.	H	α-helix	trans	-71.8	-26.9	179.9	53.2	0	0	0	0	113.4	D35 A36 F65	D35-S38 PolarHBondContact O-OG 3.02Å; A36-S38 VanDerWaalsContact C-N 3.33Å; A36-S38 PolarHBondContact O-N 3.21Å; S38-F65 WeakPolarHBondContact O-CD1 3.48Å
39	F	88.6	Confident	71.5	Confident	54 Å²	54	87.3 Å²	87.3	24%	0.237	50%	0.501	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	18.4	-174.4	-55.9	-60.8	0	0	0	114.3	D35 A36 T37 F65 M155 V157 Y159	D35-F39 VanDerWaalsContact O-CD2 3.27Å; D35-F39 WeakPolarHBondContact O-CD2 3.34Å; A36-F39 PolarHBondContact O-N 3.4Å; T37-F39 VanDerWaalsContact C-N 3.34Å; T37-F39 PolarHBondContact O-N 2.93Å; F39-F65 HydrophobicContact CB-CE1 4.12Å; F39-F65 HydrophobicContact CB-CZ 4.23Å; F39-F65 HydrophobicContact CD1-CD1 4.19Å; F39-F65 AromaticContact CD1-CD2 3.74Å; F39-F65 HydrophobicContact CD1-CD2 3.74Å; F39-F65 HydrophobicContact CD1-CE1 4.03Å; F39-F65 AromaticContact CD1-CE2 3.56Å; F39-F65 HydrophobicContact CD1-CE2 3.56Å; F39-F65 HydrophobicContact CD1-CG 4.04Å; F39-F65 AromaticContact CD1-CZ 3.71Å; F39-F65 HydrophobicContact CD1-CZ 3.71Å; F39-F65 HydrophobicContact CE1-CD2 4.05Å; F39-F65 HydrophobicContact CE1-CE2 4.1Å; F39-F65 HydrophobicContact CG-CZ 4.45Å; F39-M155 HydrophobicContact CB-CE 4.27Å; F39-M155 WeakPolarHBondContact O-CE 3.33Å; F39-V157 HydrophobicContact CB-CG2 4.32Å; F39-V157 HydrophobicContact CD1-CG1 3.86Å; F39-V157 HydrophobicContact CD1-CG2 4.47Å; F39-V157 HydrophobicContact CE1-CG1 3.91Å; F39-V157 HydrophobicContact CG-CG1 4.41Å; F39-V157 HydrophobicContact CG-CG2 4.31Å; F39-Y159 AromaticContact CE1-CD1 3.8Å; F39-Y159 HydrophobicContact CE1-CD1 3.8Å; F39-Y159 HydrophobicContact CE1-CE1 4.45Å; F39-Y159 AromaticContact CE1-CG 3.85Å; F39-Y159 HydrophobicContact CE1-CG 3.85Å; F39-Y159 AromaticContact CZ-CD1 3.7Å; F39-Y159 HydrophobicContact CZ-CD1 3.7Å; F39-Y159 HydrophobicContact CZ-CE1 4.34Å; F39-Y159 HydrophobicContact CZ-CG 4.18Å
40	R	87.8	Confident	74.1	Confident	113 Å²	113	82.6 Å²	82.6	43%	0.426	47%	0.471	S	S	.	.			trans	-65	146.7	176.6	-70.6	-179.1	175.5	-175.7	-0.6	111.5	E42 N43 M44	R40-E42 PolarHBondContact O-N 3.29Å; R40-E42 VanDerWaalsContact O-N 3.17Å; R40-N43 PolarHBondContact O-N 2.81Å; R40-M44 PolarHBondContact O-N 3.13Å
41	P	87.3	Confident	76.6	Confident	105 Å²	105	80.8 Å²	80.8	68%	0.682	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-54.2	-33.6	175.5	-27.9	35.5	0	0	0	114.2	N43 M44	P41-N43 PolarHBondContact O-N 3.26Å; P41-M44 WeakPolarHBondContact O-CB 3.45Å; P41-M44 PolarHBondContact O-N 3.39Å
42	E	90	Very high	79.2	Confident	164 Å²	164	78.4 Å²	78.4	77%	0.766	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-58.8	-30.2	176.5	-66.6	170.2	-170.1	0	0	113.2	R40	R40-E42 PolarHBondContact O-N 3.29Å; R40-E42 VanDerWaalsContact O-N 3.17Å
43	N	91.8	Very high	81.7	Confident	63 Å²	63	76.8 Å²	76.8	34%	0.337	42%	0.422	S	S	.	.	G	3₁₀ helix	trans	-94.8	-3.2	178	-65.4	-29	0	0	0	112.2	T37 R40 P41 F65 G66	T37-N43 PolarHBondContact O-ND2 3.45Å; R40-N43 PolarHBondContact O-N 2.81Å; P41-N43 PolarHBondContact O-N 3.26Å; N43-F65 HydrophobicContact CB-CD1 4.48Å; N43-F65 CarbonylContact O-C 3.51Å; N43-F65 WeakPolarHBondContact O-CA 3.45Å; N43-G66 PolarHBondContact O-N 3.08Å
44	M	93.6	Very high	83.7	Confident	40 Å²	40	80.9 Å²	80.9	20%	0.197	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	111.6	-170.8	-170.4	-172.1	-60.9	0	0	111.5	R40 P41 L61 T63 F65 V74 M155	R40-M44 PolarHBondContact O-N 3.13Å; P41-M44 WeakPolarHBondContact O-CB 3.45Å; P41-M44 PolarHBondContact O-N 3.39Å; M44-L61 HydrophobicContact SD-CD1 4.45Å; M44-T63 HydrophobicContact CG-CG2 3.77Å; M44-T63 HydrophobicContact SD-CG2 3.89Å; M44-F65 HydrophobicContact CB-CD1 4.14Å; M44-F65 HydrophobicContact CB-CE1 3.77Å; M44-F65 HydrophobicContact CE-CE1 3.79Å; M44-F65 HydrophobicContact CE-CZ 3.91Å; M44-F65 HydrophobicContact CG-CD1 4.45Å; M44-F65 HydrophobicContact CG-CE1 3.82Å; M44-F65 HydrophobicContact CG-CZ 4.17Å; M44-V74 HydrophobicContact CE-CB 4.44Å; M44-V74 HydrophobicContact CE-CG1 3.96Å; M44-V74 HydrophobicContact CE-CG2 3.94Å; M44-V74 HydrophobicContact SD-CB 4.49Å; M44-V74 HydrophobicContact SD-CG1 4.38Å; M44-V74 HydrophobicContact SD-CG2 4.2Å; M44-M155 HydrophobicContact CE-CE 3.39Å; M44-M155 HydrophobicContact CE-SD 4.18Å
45	H	94.6	Very high	85.3	Confident	99 Å²	99	83.8 Å²	83.8	46%	0.458	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	116.3	175.2	-59.7	155.9	0	0	0	110.1	T63 R64 G66	H45-T63 CarbonylContact O-C 3.58Å; H45-T63 WeakPolarHBondContact O-CA 3.28Å; H45-T63 WeakPolarHBondContact O-CB 3.39Å; H45-R64 PolarHBondContact N-O 3.48Å; H45-R64 PolarHBondContact O-N 3.13Å; H45-G66 PolarHBondContact CE1-O 2.85Å; H45-G66 VanDerWaalsContact CE1-O 3.27Å; H45-G66 PolarHBondContact ND1-O 3.26Å
46	L	95.8	Very high	86.5	Confident	106 Å²	106	80.4 Å²	80.4	56%	0.555	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.2	129.4	177.7	-179.3	68.3	0	0	0	111.1	S48 L61 T63	L46-S48 WeakPolarHBondContact CD1-O 3.28Å; L46-L61 HydrophobicContact CD1-CB 4.02Å; L46-L61 HydrophobicContact CD1-CD1 4.49Å; L46-L61 HydrophobicContact CD1-CD2 3.94Å; L46-L61 HydrophobicContact CD1-CG 4.38Å; L46-T63 HydrophobicContact CD1-CG2 4.42Å
47	I	94.3	Very high	88	Confident	77 Å²	77	84 Å²	84	40%	0.395	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	-50.7	169.6	-64.6	171	0	0	0	110.1	H62 R64 E71	I47-H62 HydrophobicContact CB-CB 4.32Å; I47-H62 WeakPolarHBondContact CB-O 3.16Å; I47-H62 WeakPolarHBondContact CD1-NE2 3.25Å; I47-H62 PolarHBondContact N-O 2.85Å; I47-R64 HydrophobicContact CD1-CG 3.76Å; I47-E71 HydrophobicContact CD1-CG 4.32Å
48	S	94.4	Very high	89.2	Confident	49 Å²	49	82.2 Å²	82.2	34%	0.343	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	160.4	177.1	64.5	0	0	0	0	112.3	L46 H62	L46-S48 WeakPolarHBondContact CD1-O 3.28Å; S48-H62 PolarHBondContact N-O 3.17Å; S48-H62 PolarHBondContact O-N 3.26Å
49	V	93.1	Very high	90	Very high	82 Å²	82	82.5 Å²	82.5	50%	0.497	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	118.3	167.8	-180	0	0	0	0	108.1	L59 L61	V49-L59 HydrophobicContact CG1-CD1 3.82Å; V49-L61 HydrophobicContact CG2-CD2 4.07Å
50	L	91.8	Very high	90.3	Very high	23 Å²	23	80.1 Å²	80.1	12%	0.12	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	-41.6	-179.8	-69.6	177.6	0	0	0	111.5	V60 H62 I73 F166 Y169	L50-V60 HydrophobicContact CB-CB 4.22Å; L50-V60 HydrophobicContact CB-CG1 3.98Å; L50-V60 WeakPolarHBondContact CB-O 3.4Å; L50-V60 HydrophobicContact CD1-CG1 4.06Å; L50-V60 PolarHBondContact N-O 3.39Å; L50-H62 HydrophobicContact CD1-CB 3.93Å; L50-H62 HydrophobicContact CD2-CB 3.97Å; L50-H62 HydrophobicContact CG-CB 3.77Å; L50-I73 HydrophobicContact CD1-CD1 4.23Å; L50-I73 HydrophobicContact CD1-CG1 4.06Å; L50-I73 HydrophobicContact CD1-CG2 4.04Å; L50-F166 HydrophobicContact CD1-CD1 4.06Å; L50-F166 HydrophobicContact CD1-CE1 4.43Å; L50-F166 HydrophobicContact CD2-CD1 4.46Å; L50-Y169 HydrophobicContact CB-CG 4.08Å; L50-Y169 HydrophobicContact CD1-CD2 3.83Å; L50-Y169 HydrophobicContact CD1-CE2 4.41Å; L50-Y169 HydrophobicContact CD1-CG 4.24Å
51	Q	89.4	Confident	90.6	Very high	61 Å²	61	75.6 Å²	75.6	29%	0.285	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	143.9	179.1	-174.3	176.9	-13.7	0	0	110.9	V60 Y169	Q51-V60 HydrophobicContact CB-CB 4.09Å; Q51-V60 HydrophobicContact CB-CG2 4.13Å; Q51-V60 PolarHBondContact N-O 3.38Å; Q51-V60 PolarHBondContact O-N 3.14Å; Q51-Y169 HydrophobicContact CB-CD1 4.31Å
52	N	90	Very high	91.1	Very high	101 Å²	101	71.7 Å²	71.7	54%	0.54	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	96.5	168.1	-177.9	9.3	0	0	0	109	L54 L59	N52-L54 PolarHBondContact O-N 2.82Å; N52-L59 HydrophobicContact CB-CD1 4.21Å
53	D	85.6	Confident	91.4	Very high	18 Å²	18	63.9 Å²	63.9	10%	0.096	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	97.2	178.6	-172.7	-19.2	0	0	0	109.9	R55 N56 K57 C58 Y332	D53-R55 PolarHBondContact O-N 2.9Å; D53-R55 WeakPolarHBondContact OD1-CB 3.26Å; D53-R55 PolarHBondContact OD1-N 3.38Å; D53-N56 HydrophobicContact CB-CB 4.46Å; D53-N56 PolarHBondContact OD1-N 3.28Å; D53-N56 WeakPolarHBondContact OD2-CB 3.48Å; D53-N56 PolarHBondContact OD2-ND2 3.04Å; D53-K57 WeakPolarHBondContact O-CA 3.48Å; D53-K57 PolarHBondContact O-N 3.45Å; D53-C58 HydrophobicContact CB-CB 4.33Å; D53-C58 PolarHBondContact N-O 2.9Å; D53-C58 PolarHBondContact O-N 2.89Å; D53-C58 VanDerWaalsContact O-N 3.07Å; D53-Y332 PolarHBondContact OD2-OH 3.16Å
54	L	84.7	Confident	91.5	Very high	145 Å²	145	65.4 Å²	65.4	76%	0.759	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-26.7	180	-59.5	177.9	0	0	0	112.9	N52	N52-L54 PolarHBondContact O-N 2.82Å
55	R	79.5	Confident	91.5	Very high	176 Å²	176	64.1 Å²	64.1	66%	0.664	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-47.8	-177.2	-175.3	174.1	-177.4	-165.6	-10.3	110.5	D53 K57 D330	D53-R55 PolarHBondContact O-N 2.9Å; D53-R55 WeakPolarHBondContact OD1-CB 3.26Å; D53-R55 PolarHBondContact OD1-N 3.38Å; R55-K57 VanDerWaalsContact C-N 3.31Å; R55-D330 IonicContact CZ-OD2 3.09Å; R55-D330 IonicContact NE-OD2 2.84Å; R55-D330 IonicContact NH1-OD2 2.65Å; R55-D330 PolarHBondContact NH1-OD2 2.78Å; R55-D330 IonicContact NH2-OD2 3.96Å; R55-D330 PolarHBondContact NH2-OD2 3.15Å
56	N	82.5	Confident	91.3	Very high	48 Å²	48	60.6 Å²	60.6	26%	0.257	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	1	179.5	-66	-43.6	0	0	0	113.5	D53 C58 D330	D53-N56 HydrophobicContact CB-CB 4.46Å; D53-N56 PolarHBondContact OD1-N 3.28Å; D53-N56 WeakPolarHBondContact OD2-CB 3.48Å; D53-N56 PolarHBondContact OD2-ND2 3.04Å; N56-C58 VanDerWaalsContact C-N 3.28Å; N56-C58 HydrophobicContact CB-CB 4.47Å; N56-C58 PolarHBondContact O-N 3.08Å; N56-D330 PolarHBondContact ND2-O 2.88Å; N56-D330 VanDerWaalsContact ND2-O 3.16Å; N56-D330 PolarHBondContact OD1-O 3.2Å
57	K	90.2	Very high	91	Very high	135 Å²	135	63.6 Å²	63.6	59%	0.587	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	47.9	-179.2	-55.1	173.5	-175.6	171.1	0	111.4	D53 R55 K78	D53-K57 WeakPolarHBondContact O-CA 3.48Å; D53-K57 PolarHBondContact O-N 3.45Å; R55-K57 VanDerWaalsContact C-N 3.31Å; K57-K78 HydrophobicContact CB-CB 3.96Å; K57-K78 HydrophobicContact CB-CG 3.93Å; K57-K78 HydrophobicContact CD-CB 4.34Å; K57-K78 HydrophobicContact CD-CG 4.47Å; K57-K78 PolarHBondContact O-N 3.23Å
58	C	91.1	Very high	90.7	Very high	18 Å²	18	61.9 Å²	61.9	12%	0.122	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	130.1	-173.6	-178	0	0	0	0	110.7	D53 N56 T75 L76 Q77	D53-C58 HydrophobicContact CB-CB 4.33Å; D53-C58 PolarHBondContact N-O 2.9Å; D53-C58 PolarHBondContact O-N 2.89Å; D53-C58 VanDerWaalsContact O-N 3.07Å; N56-C58 VanDerWaalsContact C-N 3.28Å; N56-C58 HydrophobicContact CB-CB 4.47Å; N56-C58 PolarHBondContact O-N 3.08Å; C58-T75 WeakPolarHBondContact SG-CG2 3.21Å; C58-L76 CarbonylContact C-O 3.51Å; C58-L76 WeakPolarHBondContact CA-O 3.48Å; C58-Q77 HydrophobicContact CB-CG 4.39Å
59	L	94	Very high	90.6	Very high	55 Å²	55	64.3 Å²	64.3	29%	0.288	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	128.5	179.8	179.3	66.1	0	0	0	109.1	V49 N52 L61 T75 L76	V49-L59 HydrophobicContact CG1-CD1 3.82Å; N52-L59 HydrophobicContact CB-CD1 4.21Å; L59-L61 HydrophobicContact CD1-CD2 3.97Å; L59-L61 HydrophobicContact CD2-CD1 4.46Å; L59-L61 HydrophobicContact CD2-CD2 3.9Å; L59-L61 HydrophobicContact CD2-CG 4.37Å; L59-L61 HydrophobicContact CG-CD2 3.7Å; L59-L61 HydrophobicContact CG-CG 4.16Å; L59-T75 CarbonylContact O-C 3.55Å; L59-T75 WeakPolarHBondContact O-CA 3.25Å; L59-L76 HydrophobicContact CB-CB 4.42Å; L59-L76 HydrophobicContact CD2-CD1 4.48Å; L59-L76 PolarHBondContact N-O 3.09Å; L59-L76 PolarHBondContact O-N 2.89Å
60	V	94.3	Very high	90.6	Very high	4 Å²	4	65.4 Å²	65.4	2%	0.024	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	126	179.1	-172.1	0	0	0	0	109.1	L50 Q51 I73 V74 T75 Y169	L50-V60 HydrophobicContact CB-CB 4.22Å; L50-V60 HydrophobicContact CB-CG1 3.98Å; L50-V60 WeakPolarHBondContact CB-O 3.4Å; L50-V60 HydrophobicContact CD1-CG1 4.06Å; L50-V60 PolarHBondContact N-O 3.39Å; Q51-V60 HydrophobicContact CB-CB 4.09Å; Q51-V60 HydrophobicContact CB-CG2 4.13Å; Q51-V60 PolarHBondContact N-O 3.38Å; Q51-V60 PolarHBondContact O-N 3.14Å; V60-I73 HydrophobicContact CG1-CG2 3.55Å; V60-V74 CarbonylContact C-O 3.59Å; V60-V74 WeakPolarHBondContact CA-O 3.24Å; V60-T75 HydrophobicContact CG2-CG2 4.27Å; V60-Y169 HydrophobicContact CB-CD1 4.27Å; V60-Y169 HydrophobicContact CB-CE1 3.99Å; V60-Y169 HydrophobicContact CG1-CD1 3.89Å; V60-Y169 HydrophobicContact CG1-CD2 4.17Å; V60-Y169 HydrophobicContact CG1-CE1 3.49Å; V60-Y169 VanDerWaalsContact CG1-CE1 3.49Å; V60-Y169 HydrophobicContact CG1-CE2 3.78Å; V60-Y169 HydrophobicContact CG1-CG 4.18Å; V60-Y169 HydrophobicContact CG2-CD1 4.25Å; V60-Y169 HydrophobicContact CG2-CE1 3.67Å
61	L	95.7	Very high	90.8	Very high	19 Å²	19	67.3 Å²	67.3	10%	0.099	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	138.5	-173.1	-53.6	179	0	0	0	110.6	M44 L46 V49 L59 T63 I73 V74 L76	M44-L61 HydrophobicContact SD-CD1 4.45Å; L46-L61 HydrophobicContact CD1-CB 4.02Å; L46-L61 HydrophobicContact CD1-CD1 4.49Å; L46-L61 HydrophobicContact CD1-CD2 3.94Å; L46-L61 HydrophobicContact CD1-CG 4.38Å; V49-L61 HydrophobicContact CG2-CD2 4.07Å; L59-L61 HydrophobicContact CD1-CD2 3.97Å; L59-L61 HydrophobicContact CD2-CD1 4.46Å; L59-L61 HydrophobicContact CD2-CD2 3.9Å; L59-L61 HydrophobicContact CD2-CG 4.37Å; L59-L61 HydrophobicContact CG-CD2 3.7Å; L59-L61 HydrophobicContact CG-CG 4.16Å; L61-T63 HydrophobicContact CB-CG2 3.67Å; L61-I73 WeakPolarHBondContact O-CA 3.37Å; L61-V74 HydrophobicContact CB-CB 4.36Å; L61-V74 PolarHBondContact N-O 3.04Å; L61-V74 PolarHBondContact O-N 2.95Å; L61-L76 HydrophobicContact CD1-CD1 4.2Å
62	H	96.2	Very high	91.1	Very high	22 Å²	22	64.4 Å²	64.4	10%	0.102	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	121.7	162.4	-179.6	-172.2	0	0	0	108	I47 S48 L50 E71 F166	I47-H62 HydrophobicContact CB-CB 4.32Å; I47-H62 WeakPolarHBondContact CB-O 3.16Å; I47-H62 WeakPolarHBondContact CD1-NE2 3.25Å; I47-H62 PolarHBondContact N-O 2.85Å; S48-H62 PolarHBondContact N-O 3.17Å; S48-H62 PolarHBondContact O-N 3.26Å; L50-H62 HydrophobicContact CD1-CB 3.93Å; L50-H62 HydrophobicContact CD2-CB 3.97Å; L50-H62 HydrophobicContact CG-CB 3.77Å; H62-E71 IonicContact CE1-OE2 3.15Å; H62-E71 VanDerWaalsContact NE2-CD 3.27Å; H62-E71 IonicContact NE2-OE1 3.91Å; H62-E71 IonicContact NE2-OE2 3.16Å; H62-E71 PolarHBondContact NE2-OE2 3.24Å; H62-F166 HydrophobicContact CB-CE1 4.32Å; H62-F166 AromaticContact CD2-CE1 3.36Å; H62-F166 WeakPolarHBondContact CD2-CE1 3.29Å; H62-F166 AromaticContact CD2-CZ 3.8Å; H62-F166 AromaticContact CE1-CE1 3.97Å; H62-F166 AromaticContact CG-CE1 3.69Å; H62-F166 AromaticContact NE2-CE1 3.59Å; H62-F166 AromaticContact NE2-CZ 3.67Å
63	T	96	Very high	91.3	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	167.2	-170.5	61.7	0	0	0	0	112.3	M44 H45 L46 L61 A72 V74	M44-T63 HydrophobicContact CG-CG2 3.77Å; M44-T63 HydrophobicContact SD-CG2 3.89Å; H45-T63 CarbonylContact O-C 3.58Å; H45-T63 WeakPolarHBondContact O-CA 3.28Å; H45-T63 WeakPolarHBondContact O-CB 3.39Å; L46-T63 HydrophobicContact CD1-CG2 4.42Å; L61-T63 HydrophobicContact CB-CG2 3.67Å; T63-A72 PolarHBondContact N-O 3.38Å; T63-A72 PolarHBondContact O-N 2.97Å; T63-A72 PolarHBondContact OG1-O 2.98Å; T63-V74 HydrophobicContact CG2-CB 4.41Å; T63-V74 HydrophobicContact CG2-CG2 4.16Å; T63-V74 WeakPolarHBondContact OG1-CG2 3.3Å
64	R	94.9	Very high	91.8	Very high	95 Å²	95	58.8 Å²	58.8	36%	0.358	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	161.1	159.7	-75.8	177	-172.6	168	4.9	108.9	H45 I47 P69 E71	H45-R64 PolarHBondContact N-O 3.48Å; H45-R64 PolarHBondContact O-N 3.13Å; I47-R64 HydrophobicContact CD1-CG 3.76Å; R64-P69 PolarHBondContact NE-O 2.58Å; R64-E71 HydrophobicContact CG-CG 4.3Å; R64-E71 IonicContact CZ-OE1 2.94Å; R64-E71 IonicContact NE-OE1 3.3Å; R64-E71 IonicContact NH2-OE1 2.82Å; R64-E71 PolarHBondContact NH2-OE1 3.11Å
65	F	93.6	Very high	92.2	Very high	14 Å²	14	52.8 Å²	52.8	6%	0.061	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	121.3	178.5	-70.5	-81.6	0	0	0	111.6	S38 F39 N43 M44 D67 D68 A72 V74 M155 V157	S38-F65 WeakPolarHBondContact O-CD1 3.48Å; F39-F65 HydrophobicContact CB-CE1 4.12Å; F39-F65 HydrophobicContact CB-CZ 4.23Å; F39-F65 HydrophobicContact CD1-CD1 4.19Å; F39-F65 AromaticContact CD1-CD2 3.74Å; F39-F65 HydrophobicContact CD1-CD2 3.74Å; F39-F65 HydrophobicContact CD1-CE1 4.03Å; F39-F65 AromaticContact CD1-CE2 3.56Å; F39-F65 HydrophobicContact CD1-CE2 3.56Å; F39-F65 HydrophobicContact CD1-CG 4.04Å; F39-F65 AromaticContact CD1-CZ 3.71Å; F39-F65 HydrophobicContact CD1-CZ 3.71Å; F39-F65 HydrophobicContact CE1-CD2 4.05Å; F39-F65 HydrophobicContact CE1-CE2 4.1Å; F39-F65 HydrophobicContact CG-CZ 4.45Å; N43-F65 HydrophobicContact CB-CD1 4.48Å; N43-F65 CarbonylContact O-C 3.51Å; N43-F65 WeakPolarHBondContact O-CA 3.45Å; M44-F65 HydrophobicContact CB-CD1 4.14Å; M44-F65 HydrophobicContact CB-CE1 3.77Å; M44-F65 HydrophobicContact CE-CE1 3.79Å; M44-F65 HydrophobicContact CE-CZ 3.91Å; M44-F65 HydrophobicContact CG-CD1 4.45Å; M44-F65 HydrophobicContact CG-CE1 3.82Å; M44-F65 HydrophobicContact CG-CZ 4.17Å; F65-D67 PolarHBondContact O-N 3.27Å; F65-D68 WeakPolarHBondContact O-CB 3.33Å; F65-D68 PolarHBondContact O-N 3.38Å; F65-D68 VanDerWaalsContact O-N 3.15Å; F65-A72 HydrophobicContact CD2-CB 3.89Å; F65-A72 HydrophobicContact CE2-CB 3.59Å; F65-V74 HydrophobicContact CE2-CG2 4.07Å; F65-V74 HydrophobicContact CZ-CG2 3.67Å; F65-M155 HydrophobicContact CZ-CE 4.27Å; F65-V157 HydrophobicContact CE2-CG1 3.97Å; F65-V157 HydrophobicContact CZ-CG1 4.34Å
66	G	90.3	Very high	92.9	Very high	25 Å²	25	46.6 Å²	46.6	26%	0.258	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	-133.5	-177.8	0	0	0	0	0	112.1	N43 H45	N43-G66 PolarHBondContact O-N 3.08Å; H45-G66 PolarHBondContact CE1-O 2.85Å; H45-G66 VanDerWaalsContact CE1-O 3.27Å; H45-G66 PolarHBondContact ND1-O 3.26Å
67	D	88.9	Confident	93.4	Very high	168 Å²	168	48.2 Å²	48.2	90%	0.898	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.6	4.5	177.2	-63.2	-37.6	0	0	0	113.5	F65 P69	F65-D67 PolarHBondContact O-N 3.27Å; D67-P69 WeakPolarHBondContact O-CD 3.43Å
68	D	89.5	Confident	93.4	Very high	42 Å²	42	46.9 Å²	46.9	23%	0.225	24%	0.24	C	C	.	.			trans	-70.9	122.6	179.1	-165.5	-30.5	0	0	0	110.4	F65 K70 Y159	F65-D68 WeakPolarHBondContact O-CB 3.33Å; F65-D68 PolarHBondContact O-N 3.38Å; F65-D68 VanDerWaalsContact O-N 3.15Å; D68-K70 PolarHBondContact O-N 2.68Å; D68-K70 VanDerWaalsContact OD1-CB 3.24Å; D68-K70 WeakPolarHBondContact OD1-CB 3.07Å; D68-K70 WeakPolarHBondContact OD1-CG 3.41Å; D68-K70 PolarHBondContact OD1-N 2.84Å; D68-K70 IonicContact OD2-NZ 3.72Å; D68-Y159 PolarHBondContact OD2-OH 2.88Å
69	P	91.1	Very high	93.1	Very high	100 Å²	100	47.5 Å²	47.5	65%	0.649	25%	0.245	S	C	*	.			trans	-67.7	-15.5	177.7	28.7	-37.2	0	0	0	113.6	R64 D67	R64-P69 PolarHBondContact NE-O 2.58Å; D67-P69 WeakPolarHBondContact O-CD 3.43Å
70	K	93.9	Very high	92.6	Very high	105 Å²	105	48.3 Å²	48.3	46%	0.457	26%	0.255	S	S	.	.			trans	-70.3	134.8	-178.9	-65.2	172.3	-152.2	152.3	0	111.3	D68 Y159 P160	D68-K70 PolarHBondContact O-N 2.68Å; D68-K70 VanDerWaalsContact OD1-CB 3.24Å; D68-K70 WeakPolarHBondContact OD1-CB 3.07Å; D68-K70 WeakPolarHBondContact OD1-CG 3.41Å; D68-K70 PolarHBondContact OD1-N 2.84Å; D68-K70 IonicContact OD2-NZ 3.72Å; K70-Y159 HydrophobicContact CB-CE2 3.78Å; K70-Y159 HydrophobicContact CD-CE2 4.33Å; K70-P160 HydrophobicContact CB-CB 4.04Å; K70-P160 HydrophobicContact CD-CB 3.86Å; K70-P160 HydrophobicContact CD-CG 4.36Å; K70-P160 HydrophobicContact CG-CB 4.27Å
71	E	94.9	Very high	92.2	Very high	63 Å²	63	54.1 Å²	54.1	29%	0.294	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	155.2	-179.2	-61.5	-179.6	170	0	0	111.5	I47 H62 R64 A161 F166	I47-E71 HydrophobicContact CD1-CG 4.32Å; H62-E71 IonicContact CE1-OE2 3.15Å; H62-E71 VanDerWaalsContact NE2-CD 3.27Å; H62-E71 IonicContact NE2-OE1 3.91Å; H62-E71 IonicContact NE2-OE2 3.16Å; H62-E71 PolarHBondContact NE2-OE2 3.24Å; R64-E71 HydrophobicContact CG-CG 4.3Å; R64-E71 IonicContact CZ-OE1 2.94Å; R64-E71 IonicContact NE-OE1 3.3Å; R64-E71 IonicContact NH2-OE1 2.82Å; R64-E71 PolarHBondContact NH2-OE1 3.11Å; E71-A161 PolarHBondContact O-N 3.29Å; E71-F166 HydrophobicContact CB-CE2 4.45Å; E71-F166 HydrophobicContact CB-CZ 3.85Å
72	A	95.7	Very high	91.7	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	151.3	-179.8	0	0	0	0	0	111.1	T63 F65 T158 Y159	T63-A72 PolarHBondContact N-O 3.38Å; T63-A72 PolarHBondContact O-N 2.97Å; T63-A72 PolarHBondContact OG1-O 2.98Å; F65-A72 HydrophobicContact CD2-CB 3.89Å; F65-A72 HydrophobicContact CE2-CB 3.59Å; A72-T158 VanDerWaalsContact CA-O 3.29Å; A72-T158 WeakPolarHBondContact CA-O 3.25Å; A72-Y159 HydrophobicContact CB-CD2 4.08Å
73	I	95.4	Very high	91	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	124.2	168.2	-58.1	177.4	0	0	0	108.4	L50 V60 L61 V157 T158 A161 H165 F166 Y169	L50-I73 HydrophobicContact CD1-CD1 4.23Å; L50-I73 HydrophobicContact CD1-CG1 4.06Å; L50-I73 HydrophobicContact CD1-CG2 4.04Å; V60-I73 HydrophobicContact CG1-CG2 3.55Å; L61-I73 WeakPolarHBondContact O-CA 3.37Å; I73-V157 WeakPolarHBondContact O-CA 3.45Å; I73-T158 PolarHBondContact N-O 3.26Å; I73-T158 PolarHBondContact O-N 3.32Å; I73-A161 HydrophobicContact CD1-CB 4.35Å; I73-A161 HydrophobicContact CG1-CB 3.94Å; I73-H165 HydrophobicContact CD1-CB 3.69Å; I73-H165 WeakPolarHBondContact CD1-O 3.39Å; I73-F166 HydrophobicContact CD1-CD1 3.69Å; I73-F166 HydrophobicContact CD1-CE1 3.82Å; I73-F166 HydrophobicContact CD1-CG 4.12Å; I73-F166 HydrophobicContact CD1-CZ 4.36Å; I73-F166 HydrophobicContact CG1-CD1 3.86Å; I73-F166 HydrophobicContact CG1-CE1 3.47Å; I73-F166 VanDerWaalsContact CG1-CE1 3.47Å; I73-F166 HydrophobicContact CG1-CZ 4.01Å; I73-Y169 HydrophobicContact CD1-CD2 4.04Å; I73-Y169 HydrophobicContact CD1-CE2 3.76Å; I73-Y169 HydrophobicContact CG2-CD2 4.5Å; I73-Y169 HydrophobicContact CG2-CE2 3.72Å
74	V	95.5	Very high	90.3	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	121.1	176.4	176.5	0	0	0	0	108.7	M44 V60 L61 T63 F65 L76 M155 T156 V157	M44-V74 HydrophobicContact CE-CB 4.44Å; M44-V74 HydrophobicContact CE-CG1 3.96Å; M44-V74 HydrophobicContact CE-CG2 3.94Å; M44-V74 HydrophobicContact SD-CB 4.49Å; M44-V74 HydrophobicContact SD-CG1 4.38Å; M44-V74 HydrophobicContact SD-CG2 4.2Å; V60-V74 CarbonylContact C-O 3.59Å; V60-V74 WeakPolarHBondContact CA-O 3.24Å; L61-V74 HydrophobicContact CB-CB 4.36Å; L61-V74 PolarHBondContact N-O 3.04Å; L61-V74 PolarHBondContact O-N 2.95Å; T63-V74 HydrophobicContact CG2-CB 4.41Å; T63-V74 HydrophobicContact CG2-CG2 4.16Å; T63-V74 WeakPolarHBondContact OG1-CG2 3.3Å; F65-V74 HydrophobicContact CE2-CG2 4.07Å; F65-V74 HydrophobicContact CZ-CG2 3.67Å; V74-L76 HydrophobicContact CG1-CD2 3.88Å; V74-L76 HydrophobicContact CG1-CG 4.11Å; V74-M155 HydrophobicContact CG1-CE 3.8Å; V74-M155 HydrophobicContact CG1-CG 3.99Å; V74-M155 HydrophobicContact CG1-SD 4.18Å; V74-M155 HydrophobicContact CG2-CE 4.19Å; V74-T156 WeakPolarHBondContact CA-O 3.22Å; V74-V157 HydrophobicContact CG2-CG1 4.45Å; V74-V157 HydrophobicContact CG2-CG2 4.38Å
75	T	93.8	Very high	90	Very high	20 Å²	20	59.2 Å²	59.2	12%	0.123	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	125.7	171.7	-56.9	0	0	0	0	108.6	C58 L59 V60 M155 T156	C58-T75 WeakPolarHBondContact SG-CG2 3.21Å; L59-T75 CarbonylContact O-C 3.55Å; L59-T75 WeakPolarHBondContact O-CA 3.25Å; V60-T75 HydrophobicContact CG2-CG2 4.27Å; T75-M155 CarbonylContact O-C 3.57Å; T75-M155 WeakPolarHBondContact O-CA 3.42Å; T75-T156 PolarHBondContact N-O 2.75Å; T75-T156 PolarHBondContact O-N 2.84Å
76	L	94.3	Very high	89.7	Confident	45 Å²	45	63.7 Å²	63.7	24%	0.236	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	119.2	174.5	-58.6	178.9	0	0	0	108.7	C58 L59 L61 V74 I153 E154 M155	C58-L76 CarbonylContact C-O 3.51Å; C58-L76 WeakPolarHBondContact CA-O 3.48Å; L59-L76 HydrophobicContact CB-CB 4.42Å; L59-L76 HydrophobicContact CD2-CD1 4.48Å; L59-L76 PolarHBondContact N-O 3.09Å; L59-L76 PolarHBondContact O-N 2.89Å; L61-L76 HydrophobicContact CD1-CD1 4.2Å; V74-L76 HydrophobicContact CG1-CD2 3.88Å; V74-L76 HydrophobicContact CG1-CG 4.11Å; L76-I153 HydrophobicContact CB-CG2 3.9Å; L76-I153 HydrophobicContact CD2-CG2 4.14Å; L76-E154 WeakPolarHBondContact CA-O 3.47Å; L76-M155 HydrophobicContact CD2-CB 3.83Å; L76-M155 HydrophobicContact CD2-CG 3.74Å; L76-M155 HydrophobicContact CD2-SD 4.02Å
77	Q	91.8	Very high	89.5	Confident	82 Å²	82	63.3 Å²	63.3	38%	0.383	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	136.1	-179.2	-176.8	169.5	-23.9	0	0	110.2	C58 S79 I153 E154	C58-Q77 HydrophobicContact CB-CG 4.39Å; Q77-S79 PolarHBondContact O-N 3.31Å; Q77-I153 CarbonylContact O-C 3.57Å; Q77-I153 WeakPolarHBondContact O-CA 3.47Å; Q77-E154 PolarHBondContact N-O 2.91Å; Q77-E154 PolarHBondContact O-N 2.78Å
78	K	90	Very high	89.5	Confident	107 Å²	107	57 Å²	57	47%	0.465	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	131	173	-71.5	-64.2	-169.9	144.8	0	110	K57 I153	K57-K78 HydrophobicContact CB-CB 3.96Å; K57-K78 HydrophobicContact CB-CG 3.93Å; K57-K78 HydrophobicContact CD-CB 4.34Å; K57-K78 HydrophobicContact CD-CG 4.47Å; K57-K78 PolarHBondContact O-N 3.23Å; K78-I153 HydrophobicContact CD-CG1 4.25Å
79	S	85.6	Confident	89.5	Confident	31 Å²	31	60.1 Å²	60.1	22%	0.217	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-65.8	143.4	171.6	55.7	0	0	0	0	110.5	Q77 G152	Q77-S79 PolarHBondContact O-N 3.31Å; S79-G152 PolarHBondContact N-O 2.86Å; S79-G152 PolarHBondContact OG-O 3.26Å
80	S	82.9	Confident	89.4	Confident	73 Å²	73	61.9 Å²	61.9	51%	0.51	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-66	147	168.8	-56.9	0	0	0	0	110.6	R238	S80-R238 PolarHBondContact O-NH2 2.92Å
81	F	86.8	Confident	89.1	Confident	126 Å²	126	57.9 Å²	57.9	55%	0.553	29%	0.294	S	S	*	.	P	Polyproline II helix	trans	-60.8	145.1	170.2	-70	-90.6	0	0	0	110.4	I150	F81-I150 HydrophobicContact CD1-CD1 3.52Å; F81-I150 HydrophobicContact CE1-CD1 3.47Å; F81-I150 VanDerWaalsContact CE1-CD1 3.47Å
82	P	84.7	Confident	88.9	Confident	27 Å²	27	57.2 Å²	57.2	18%	0.175	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-64.3	146.3	165.4	29	-32.4	0	0	0	109.5	T87 L88 I150	P82-T87 HydrophobicContact CB-CG2 3.47Å; P82-T87 VanDerWaalsContact CB-CG2 3.47Å; P82-T87 HydrophobicContact CG-CG2 3.89Å; P82-L88 HydrophobicContact CG-CD2 3.94Å; P82-L88 HydrophobicContact CG-CG 4.39Å; P82-L88 WeakPolarHBondContact O-CD2 3.33Å; P82-I150 HydrophobicContact CG-CG2 4.04Å
83	N	81.9	Confident	88.6	Confident	124 Å²	124	58.7 Å²	58.7	66%	0.663	30%	0.299	S	S	*	.			trans	-111.5	-8.4	176.2	62.1	-2.8	0	0	0	112.9
84	D	81.8	Confident	88.4	Confident	30 Å²	30	61.5 Å²	61.5	16%	0.16	32%	0.316	C	S	.	.			trans	-73.4	125.6	174.6	168.7	67.3	0	0	0	110.7	N86 T87 L88 S297	D84-N86 VanDerWaalsContact C-N 3.29Å; D84-N86 PolarHBondContact O-N 3.23Å; D84-N86 WeakPolarHBondContact OD2-CB 3.36Å; D84-N86 PolarHBondContact OD2-N 3.28Å; D84-T87 PolarHBondContact O-N 3.26Å; D84-T87 WeakPolarHBondContact OD2-CB 3.36Å; D84-T87 PolarHBondContact OD2-N 2.9Å; D84-T87 PolarHBondContact OD2-OG1 3.32Å; D84-L88 WeakPolarHBondContact O-CG 3.3Å; D84-L88 PolarHBondContact O-N 3.31Å; D84-S297 WeakPolarHBondContact CB-OG 3.39Å
85	P	87.6	Confident	88.1	Confident	62 Å²	62	67.2 Å²	67.2	40%	0.403	35%	0.347	S	S	.	.	H	α-helix	trans	-57.2	-37.1	-178.6	-27.5	35.3	0	0	0	114.2	L88 K89 V97	P85-L88 PolarHBondContact O-N 2.96Å; P85-K89 PolarHBondContact O-N 3.38Å; P85-V97 HydrophobicContact CB-CG1 3.94Å; P85-V97 HydrophobicContact CB-CG2 3.81Å
86	N	86.2	Confident	87.8	Confident	107 Å²	107	72.3 Å²	72.3	57%	0.572	37%	0.367	S	S	*	.	H	α-helix	trans	-70.3	-39.6	-179.7	-65.3	-43.9	0	0	0	111.2	D84 K89 R90	D84-N86 VanDerWaalsContact C-N 3.29Å; D84-N86 PolarHBondContact O-N 3.23Å; D84-N86 WeakPolarHBondContact OD2-CB 3.36Å; D84-N86 PolarHBondContact OD2-N 3.28Å; N86-K89 PolarHBondContact O-N 3.35Å; N86-R90 VanDerWaalsContact O-CB 3.3Å; N86-R90 WeakPolarHBondContact O-CB 3.5Å; N86-R90 PolarHBondContact O-N 3.09Å
87	T	86.3	Confident	87.4	Confident	17 Å²	17	73.4 Å²	73.4	10%	0.104	38%	0.376	C	S	.	.	H	α-helix	trans	-65.7	-42.5	174.6	-55.8	0	0	0	0	110.7	P82 D84 K89 R90 C91	P82-T87 HydrophobicContact CB-CG2 3.47Å; P82-T87 VanDerWaalsContact CB-CG2 3.47Å; P82-T87 HydrophobicContact CG-CG2 3.89Å; D84-T87 PolarHBondContact O-N 3.26Å; D84-T87 WeakPolarHBondContact OD2-CB 3.36Å; D84-T87 PolarHBondContact OD2-N 2.9Å; D84-T87 PolarHBondContact OD2-OG1 3.32Å; T87-K89 VanDerWaalsContact C-N 3.3Å; T87-K89 PolarHBondContact O-N 3.06Å; T87-R90 PolarHBondContact O-N 2.75Å; T87-R90 PolarHBondContact OG1-NH2 2.57Å; T87-C91 VanDerWaalsContact O-CB 3.24Å; T87-C91 WeakPolarHBondContact O-CB 3.37Å; T87-C91 PolarHBondContact O-N 3.14Å; T87-C91 PolarHBondContact O-SG 3.02Å
88	L	90.3	Very high	87.1	Confident	36 Å²	36	76.4 Å²	76.4	19%	0.188	39%	0.393	C	S	.	.	H	α-helix	trans	-60.2	-40.4	174.4	-74	167.9	0	0	0	112.2	P82 D84 P85 K92 V93 V94	P82-L88 HydrophobicContact CG-CD2 3.94Å; P82-L88 HydrophobicContact CG-CG 4.39Å; P82-L88 WeakPolarHBondContact O-CD2 3.33Å; D84-L88 WeakPolarHBondContact O-CG 3.3Å; D84-L88 PolarHBondContact O-N 3.31Å; P85-L88 PolarHBondContact O-N 2.96Å; L88-K92 PolarHBondContact O-N 3.41Å; L88-V93 HydrophobicContact CB-CB 4.38Å; L88-V93 HydrophobicContact CD2-CB 3.88Å; L88-V93 HydrophobicContact CD2-CG1 3.9Å; L88-V93 HydrophobicContact CD2-CG2 3.94Å; L88-V93 WeakPolarHBondContact O-CB 3.38Å; L88-V93 PolarHBondContact O-N 2.83Å; L88-V94 HydrophobicContact CB-CG2 4.05Å; L88-V94 PolarHBondContact O-N 2.84Å
89	K	89.5	Confident	86.4	Confident	108 Å²	108	74.1 Å²	74.1	47%	0.47	40%	0.4	S	S	.	.	H	α-helix	trans	-65.2	-50.3	173.8	-171.6	-177.2	178.4	-171	0	111.4	P85 N86 T87 C91 K92 V94 N95 V97	P85-K89 PolarHBondContact O-N 3.38Å; N86-K89 PolarHBondContact O-N 3.35Å; T87-K89 VanDerWaalsContact C-N 3.3Å; T87-K89 PolarHBondContact O-N 3.06Å; K89-C91 VanDerWaalsContact C-N 3.29Å; K89-C91 PolarHBondContact O-N 2.83Å; K89-K92 WeakPolarHBondContact O-CA 3.2Å; K89-K92 PolarHBondContact O-N 3.37Å; K89-V94 HydrophobicContact CB-CG2 4.44Å; K89-N95 WeakPolarHBondContact CE-O 3.36Å; K89-V97 HydrophobicContact CB-CG2 4.5Å
90	R	88.7	Confident	85.3	Confident	136 Å²	136	80.7 Å²	80.7	51%	0.513	43%	0.432	S	S	.	.	H	α-helix	trans	-58.5	-39.2	178.7	-177.7	173.9	64.7	-136.8	9	112.5	N86 T87 K92 D295	N86-R90 VanDerWaalsContact O-CB 3.3Å; N86-R90 WeakPolarHBondContact O-CB 3.5Å; N86-R90 PolarHBondContact O-N 3.09Å; T87-R90 PolarHBondContact O-N 2.75Å; T87-R90 PolarHBondContact OG1-NH2 2.57Å; R90-K92 PolarHBondContact O-N 3.3Å; R90-D295 IonicContact CZ-OD1 2.69Å; R90-D295 IonicContact NH1-OD1 3.77Å; R90-D295 IonicContact NH2-OD1 3.64Å; R90-D295 PolarHBondContact NH2-OD1 2.94Å; R90-D295 IonicContact NH2-OD2 3.69Å
91	C	88.2	Confident	83.8	Confident	22 Å²	22	86.1 Å²	86.1	15%	0.149	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	1.4	175.6	-70.4	0	0	0	0	113.6	T87 K89 V93 S149 I150	T87-C91 VanDerWaalsContact O-CB 3.24Å; T87-C91 WeakPolarHBondContact O-CB 3.37Å; T87-C91 PolarHBondContact O-N 3.14Å; T87-C91 PolarHBondContact O-SG 3.02Å; K89-C91 VanDerWaalsContact C-N 3.29Å; K89-C91 PolarHBondContact O-N 2.83Å; C91-V93 HydrophobicContact CB-CG2 3.97Å; C91-V93 PolarHBondContact O-N 3.17Å; C91-S149 PolarHBondContact O-OG 2.81Å; C91-I150 HydrophobicContact CB-CG2 3.62Å
92	K	89.5	Confident	82	Confident	48 Å²	48	87 Å²	87	21%	0.209	46%	0.457	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.7	33	-178.8	-56.7	-175.5	175.2	-172.3	0	113.5	L88 K89 R90 D122 T123 F124	L88-K92 PolarHBondContact O-N 3.41Å; K89-K92 WeakPolarHBondContact O-CA 3.2Å; K89-K92 PolarHBondContact O-N 3.37Å; R90-K92 PolarHBondContact O-N 3.3Å; K92-D122 WeakPolarHBondContact CE-OD1 3.35Å; K92-D122 WeakPolarHBondContact CE-OD2 3.4Å; K92-D122 IonicContact NZ-OD1 3.73Å; K92-D122 PolarHBondContact NZ-OD1 3.32Å; K92-D122 IonicContact NZ-OD2 3.51Å; K92-T123 PolarHBondContact NZ-O 2.93Å; K92-F124 HydrophobicContact CB-CD1 4.01Å; K92-F124 HydrophobicContact CB-CE1 3.77Å; K92-F124 HydrophobicContact CB-CZ 4.31Å; K92-F124 HydrophobicContact CG-CE1 4.48Å; K92-F124 WeakPolarHBondContact O-CE1 3.27Å
93	V	90.2	Very high	80.1	Confident	32 Å²	32	90.6 Å²	90.6	19%	0.194	48%	0.483	C	S	.	.	S	Bend	trans	-78.2	-35.3	170.6	-173	0	0	0	0	110.3	L88 C91 L147 I150	L88-V93 HydrophobicContact CB-CB 4.38Å; L88-V93 HydrophobicContact CD2-CB 3.88Å; L88-V93 HydrophobicContact CD2-CG1 3.9Å; L88-V93 HydrophobicContact CD2-CG2 3.94Å; L88-V93 WeakPolarHBondContact O-CB 3.38Å; L88-V93 PolarHBondContact O-N 2.83Å; C91-V93 HydrophobicContact CB-CG2 3.97Å; C91-V93 PolarHBondContact O-N 3.17Å; V93-L147 HydrophobicContact CG2-CD2 4.2Å; V93-I150 HydrophobicContact CG2-CD1 3.65Å; V93-I150 HydrophobicContact CG2-CG1 4.37Å; V93-I150 HydrophobicContact CG2-CG2 4.31Å
94	V	90.4	Very high	78.3	Confident	59 Å²	59	91.3 Å²	91.3	36%	0.358	49%	0.487	S	S	.	.			trans	-135.9	148.8	178.2	-62.1	0	0	0	0	110.8	L88 K89	L88-V94 HydrophobicContact CB-CG2 4.05Å; L88-V94 PolarHBondContact O-N 2.84Å; K89-V94 HydrophobicContact CB-CG2 4.44Å
95	N	88.7	Confident	76.1	Confident	119 Å²	119	97.3 Å²	97.3	64%	0.636	52%	0.519	S	S	*	.	S	Bend	trans	-79.1	-54.9	-178.7	-174.9	16	0	0	0	113.3	K89 F124	K89-N95 WeakPolarHBondContact CE-O 3.36Å; N95-F124 VanDerWaalsContact CA-CZ 3.48Å; N95-F124 HydrophobicContact CB-CE2 4.1Å; N95-F124 HydrophobicContact CB-CZ 3.88Å
96	K	88.2	Confident	74	Confident	127 Å²	127	100.8 Å²	100.8	55%	0.552	54%	0.54	S	S	*	.			trans	-126.9	140.5	-178.1	-169.1	171.9	-177.2	173.2	0	109.1	D114	K96-D114 IonicContact NZ-OD1 3.53Å; K96-D114 IonicContact NZ-OD2 3.59Å
97	V	85.8	Confident	71.6	Confident	68 Å²	68	103.5 Å²	103.5	41%	0.412	55%	0.554	S	S	.	*	P	Polyproline II helix	trans	-86.5	119.2	166.3	-179.8	0	0	0	0	106.6	P85 K89	P85-V97 HydrophobicContact CB-CG1 3.94Å; P85-V97 HydrophobicContact CB-CG2 3.81Å; K89-V97 HydrophobicContact CB-CG2 4.5Å
98	I	85.1	Confident	69.3	Low	145 Å²	145	109 Å²	109	74%	0.744	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-99.3	119.7	179.3	-57	173.9	0	0	0	107.5
99	G	76	Confident	66.6	Low	59 Å²	59	115.1 Å²	115.1	61%	0.608	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-72.8	132.2	171.6	0	0	0	0	0	110.4	H101	G99-H101 PolarHBondContact O-N 2.84Å
100	L	62.2	Low	64	Low	170 Å²	170	116 Å²	116	89%	0.89	63%	0.629	S	S	*	*			trans	-73.9	106.8	169.7	-77	160.5	0	0	0	108.4	I102	L100-I102 PolarHBondContact O-N 2.84Å
101	H	51.3	Low	61.5	Low	187 Å²	187	117.3 Å²	117.3	87%	0.866	64%	0.64	S	S	*	*			trans	-66.2	102.5	161.4	-76.6	-78.3	0	0	0	107.6	G99 S103	G99-H101 PolarHBondContact O-N 2.84Å; H101-S103 VanDerWaalsContact C-N 3.29Å; H101-S103 PolarHBondContact O-N 3.49Å
102	I	49.6	Very low	59	Low	144 Å²	144	125.5 Å²	125.5	74%	0.738	68%	0.676	S	S	*	*			trans	-73.1	95.1	164.8	-58.1	174.4	0	0	0	105.3	L100 N104	L100-I102 PolarHBondContact O-N 2.84Å; I102-N104 VanDerWaalsContact C-N 3.33Å; I102-N104 PolarHBondContact O-N 2.98Å
103	S	44.6	Very low	56.5	Low	103 Å²	103	130.6 Å²	130.6	72%	0.72	70%	0.701	S	S	*	*			trans	-66	95.1	170.4	54.3	0	0	0	0	108.2	H101	H101-S103 VanDerWaalsContact C-N 3.29Å; H101-S103 PolarHBondContact O-N 3.49Å
104	N	43.6	Very low	54.1	Low	138 Å²	138	135.6 Å²	135.6	74%	0.738	73%	0.727	S	S	*	*			trans	-74.3	119.2	154	-78	-19.2	0	0	0	106.4	I102 T106	I102-N104 VanDerWaalsContact C-N 3.33Å; I102-N104 PolarHBondContact O-N 2.98Å; N104-T106 PolarHBondContact O-N 2.72Å
105	D	36.9	Very low	51.3	Low	156 Å²	156	140.6 Å²	140.6	83%	0.834	74%	0.743	S	S	*	*	S	Bend	trans	-44.8	106	175	-70.1	-48	0	0	0	111.8
106	T	42.3	Very low	49	Very low	136 Å²	136	141.1 Å²	141.1	83%	0.834	75%	0.751	S	S	*	*			trans	-168.2	127.9	144.3	33.6	0	0	0	0	108	N104 D108	N104-T106 PolarHBondContact O-N 2.72Å; T106-D108 PolarHBondContact O-N 2.71Å
107	D	35.6	Very low	46.8	Very low	163 Å²	163	142 Å²	142	87%	0.872	76%	0.762	S	S	*	*			trans	-32.3	119.9	167	-69.3	-48.2	0	0	0	112.7
108	D	39.3	Very low	44.4	Very low	133 Å²	133	147.9 Å²	147.9	71%	0.711	79%	0.785	S	S	*	*				178.6	134.4	118.3	-116.1	-31.7	0	0	0	111.4	T106 C110	T106-D108 PolarHBondContact O-N 2.71Å; D108-C110 PolarHBondContact O-N 2.65Å
109	Q	32.8	Very low	42.2	Very low	165 Å²	165	147 Å²	147	77%	0.771	79%	0.787	S	S	*	*			trans	-1.7	103.1	162.1	-59.4	173	15.8	0	0	116.5
110	C	34.1	Very low	40.9	Very low	127 Å²	127	152.4 Å²	152.4	86%	0.858	80%	0.796	S	S	*	*			trans	-109.3	99.5	162.8	-74.5	0	0	0	0	109.3	D108 E112	D108-C110 PolarHBondContact O-N 2.65Å; C110-E112 PolarHBondContact O-N 2.84Å
111	H	37.5	Very low	40.4	Very low	163 Å²	163	152.2 Å²	152.2	76%	0.755	80%	0.796	S	S	*	*			trans	-50.5	125.9	162.7	-83.8	-83.6	0	0	0	110.2	E113	H111-E113 VanDerWaalsContact C-N 3.33Å; H111-E113 PolarHBondContact O-N 3.3Å
112	E	36.2	Very low	41	Very low	193 Å²	193	147.4 Å²	147.4	90%	0.902	78%	0.776	S	S	*	*			trans	-61.5	93.2	161.6	-73.8	180	153.6	0	0	108.7	C110 D114	C110-E112 PolarHBondContact O-N 2.84Å; E112-D114 VanDerWaalsContact C-N 3.31Å; E112-D114 PolarHBondContact O-N 2.78Å
113	E	36.6	Very low	42.5	Very low	156 Å²	156	145.8 Å²	145.8	73%	0.729	77%	0.774	S	S	*	*			trans	-91.7	72.1	157.5	-70	-163.1	149.8	0	0	108.7	H111 K115	H111-E113 VanDerWaalsContact C-N 3.33Å; H111-E113 PolarHBondContact O-N 3.3Å; E113-K115 PolarHBondContact O-N 3.43Å
114	D	38.3	Very low	44.4	Very low	137 Å²	137	144.9 Å²	144.9	73%	0.733	76%	0.757	S	S	*	*			trans	-74	74.6	158.6	-135.9	8.7	0	0	0	106.2	K96 E112	K96-D114 IonicContact NZ-OD1 3.53Å; K96-D114 IonicContact NZ-OD2 3.59Å; E112-D114 VanDerWaalsContact C-N 3.31Å; E112-D114 PolarHBondContact O-N 2.78Å
115	K	33	Very low	46.5	Very low	163 Å²	163	140.3 Å²	140.3	71%	0.709	74%	0.735	S	S	*	*			trans	-126.4	88.9	171.7	-80.6	-175.3	-178.6	168.5	0	107.9	E113	E113-K115 PolarHBondContact O-N 3.43Å
116	T	39.3	Very low	48.9	Very low	130 Å²	130	141 Å²	141	80%	0.798	73%	0.733	S	S	*	*	S	Bend	trans	-173.5	114.7	147.6	16.9	0	0	0	0	110.1
117	D	42	Very low	51.2	Low	145 Å²	145	139.9 Å²	139.9	78%	0.775	71%	0.714	S	S	*	*			trans	69.6	64.2	157.8	-55.9	-17.5	0	0	0	119.5	T119	D117-T119 VanDerWaalsContact C-N 3.33Å; D117-T119 PolarHBondContact O-N 2.86Å
118	E	36.9	Very low	53.9	Low	192 Å²	192	137.2 Å²	137.2	90%	0.897	70%	0.696	S	S	*	*			trans	-64.6	91.7	138.2	-66.9	-176.9	164.2	0	0	108.9
119	T	37.5	Very low	56.3	Low	128 Å²	128	133.6 Å²	133.6	79%	0.785	69%	0.685	S	S	*	*			trans	177.9	72	155.6	31.8	0	0	0	0	112	D117	D117-T119 VanDerWaalsContact C-N 3.33Å; D117-T119 PolarHBondContact O-N 2.86Å
120	E	49.8	Very low	59.3	Low	171 Å²	171	132.8 Å²	132.8	80%	0.799	68%	0.678	S	S	*	*			trans	-149	123.7	144.1	-117.4	173.7	-168.2	0	0	107	D122	E120-D122 HydrophobicContact CB-CB 4.43Å; E120-D122 PolarHBondContact O-N 2.77Å
121	N	50.7	Low	62.1	Low	167 Å²	167	130.2 Å²	130.2	89%	0.893	66%	0.662	S	S	*	*			trans	-75.3	60	-179.7	-140.4	9.3	0	0	0	108.1	T123	N121-T123 VanDerWaalsContact C-N 3.34Å; N121-T123 PolarHBondContact O-N 2.82Å
122	D	63.8	Low	64.9	Low	85 Å²	85	126.4 Å²	126.4	46%	0.455	65%	0.646	S	S	.	*			trans	-85.6	83.1	-163.5	-151	15.8	0	0	0	109	K92 E120 F124	K92-D122 WeakPolarHBondContact CE-OD1 3.35Å; K92-D122 WeakPolarHBondContact CE-OD2 3.4Å; K92-D122 IonicContact NZ-OD1 3.73Å; K92-D122 PolarHBondContact NZ-OD1 3.32Å; K92-D122 IonicContact NZ-OD2 3.51Å; E120-D122 HydrophobicContact CB-CB 4.43Å; E120-D122 PolarHBondContact O-N 2.77Å; D122-F124 PolarHBondContact O-N 2.89Å; D122-F124 VanDerWaalsContact O-N 3.16Å
123	T	81	Confident	67.5	Low	111 Å²	111	121.3 Å²	121.3	68%	0.681	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-58.2	120.3	179.2	40.7	0	0	0	0	109.6	K92 N121	K92-T123 PolarHBondContact NZ-O 2.93Å; N121-T123 VanDerWaalsContact C-N 3.34Å; N121-T123 PolarHBondContact O-N 2.82Å
124	F	85.6	Confident	70.2	Confident	83 Å²	83	121.4 Å²	121.4	36%	0.364	62%	0.622	S	S	.	*	P	Polyproline II helix	trans	-68.8	141.2	168.7	-88.1	-102.7	0	0	0	109.6	K92 N95 D122	K92-F124 HydrophobicContact CB-CD1 4.01Å; K92-F124 HydrophobicContact CB-CE1 3.77Å; K92-F124 HydrophobicContact CB-CZ 4.31Å; K92-F124 HydrophobicContact CG-CE1 4.48Å; K92-F124 WeakPolarHBondContact O-CE1 3.27Å; N95-F124 VanDerWaalsContact CA-CZ 3.48Å; N95-F124 HydrophobicContact CB-CE2 4.1Å; N95-F124 HydrophobicContact CB-CZ 3.88Å; D122-F124 PolarHBondContact O-N 2.89Å; D122-F124 VanDerWaalsContact O-N 3.16Å
125	P	86.7	Confident	72.8	Confident	43 Å²	43	120 Å²	120	28%	0.279	61%	0.614	S	S	.	*	P	Polyproline II helix	trans	-64.7	143.5	172.5	30.4	-36.2	0	0	0	110.1	W127 G146	P125-W127 PolarHBondContact O-N 2.96Å; P125-G146 WeakPolarHBondContact CG-O 3.38Å
126	E	88.4	Confident	75.7	Confident	169 Å²	169	118.2 Å²	118.2	79%	0.79	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-70.6	117.6	176.8	-172.6	-179.4	-177.7	0	0	110.2	Q128	E126-Q128 PolarHBondContact O-N 2.91Å
127	W	89.2	Confident	78.3	Confident	114 Å²	114	117.7 Å²	117.7	43%	0.432	60%	0.603	S	S	.	*	P	Polyproline II helix	trans	-77.2	122.9	179	-75	17.2	0	0	0	111.5	P125 A129 I143 N145 G146 L147	P125-W127 PolarHBondContact O-N 2.96Å; W127-A129 PolarHBondContact O-N 3.05Å; W127-I143 HydrophobicContact CD2-CG2 4.45Å; W127-I143 HydrophobicContact CE3-CD1 3.89Å; W127-I143 HydrophobicContact CE3-CG1 4.26Å; W127-I143 HydrophobicContact CE3-CG2 4.49Å; W127-I143 HydrophobicContact CZ3-CD1 4.41Å; W127-N145 WeakPolarHBondContact CA-O 3.37Å; W127-G146 PolarHBondContact NE1-O 2.8Å; W127-L147 HydrophobicContact CZ2-CD1 4.28Å; W127-L147 HydrophobicContact CZ2-CD2 3.67Å; W127-L147 HydrophobicContact CZ2-CG 4.16Å
128	Q	92.3	Very high	80.8	Confident	107 Å²	107	118 Å²	118	50%	0.5	59%	0.594	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-91.8	102.6	168.9	-65.5	-179.6	-0.4	0	0	109.8	E126 T144 N145	E126-Q128 PolarHBondContact O-N 2.91Å; Q128-T144 PolarHBondContact O-N 3.48Å; Q128-T144 PolarHBondContact O-OG1 3.17Å; Q128-N145 HydrophobicContact CB-CB 3.7Å; Q128-N145 HydrophobicContact CG-CB 3.78Å; Q128-N145 PolarHBondContact N-O 3.27Å; Q128-N145 VanDerWaalsContact N-O 3.16Å
129	A	91.4	Very high	83.5	Confident	57 Å²	57	113.5 Å²	113.5	47%	0.471	57%	0.573	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-114.2	130.5	-175.4	0	0	0	0	0	112.2	W127 L142 I143	W127-A129 PolarHBondContact O-N 3.05Å; A129-L142 CarbonylContact C-O 3.46Å; A129-L142 WeakPolarHBondContact CA-O 3.37Å; A129-I143 HydrophobicContact CB-CD1 3.43Å; A129-I143 VanDerWaalsContact CB-CD1 3.43Å
130	K	94.1	Very high	86.2	Confident	147 Å²	147	114 Å²	114	64%	0.639	56%	0.561	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-101.7	121.7	169.2	-177.4	177	179.9	177.8	0	109.9	I132 F141 L142	K130-I132 PolarHBondContact O-N 3.07Å; K130-F141 CarbonylContact O-C 3.59Å; K130-F141 WeakPolarHBondContact O-CA 3.12Å; K130-L142 HydrophobicContact CB-CB 4.42Å; K130-L142 PolarHBondContact N-O 3.43Å; K130-L142 PolarHBondContact O-N 3.4Å
131	S	94.3	Very high	88.4	Confident	74 Å²	74	111.1 Å²	111.1	52%	0.517	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	128.8	170.9	-175.1	0	0	0	0	110.4
132	I	94.7	Very high	90.4	Very high	82 Å²	82	107.5 Å²	107.5	42%	0.421	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	-42.4	177.5	-58.5	166.5	0	0	0	110.9	K130 R140 L142	K130-I132 PolarHBondContact O-N 3.07Å; I132-R140 HydrophobicContact CB-CB 4.41Å; I132-R140 HydrophobicContact CB-CG 4.32Å; I132-R140 HydrophobicContact CD1-CG 4.11Å; I132-R140 PolarHBondContact N-O 3.15Å; I132-L142 HydrophobicContact CD1-CB 3.77Å; I132-L142 HydrophobicContact CG1-CB 4.18Å
133	M	91.8	Very high	91.8	Very high	87 Å²	87	106.2 Å²	106.2	43%	0.429	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	141.7	-175.7	-175.1	-124.3	-73.1	0	0	109.9	N135 R140	M133-N135 HydrophobicContact SD-CB 4.22Å; M133-R140 HydrophobicContact CB-CB 4.17Å; M133-R140 PolarHBondContact N-O 3.35Å; M133-R140 PolarHBondContact O-N 2.89Å
134	K	93.8	Very high	92.2	Very high	158 Å²	158	105 Å²	105	69%	0.687	51%	0.512	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.9	123.9	166.7	176.4	174.8	174.2	175.7	0	108.1	Y138	K134-Y138 CarbonylContact C-O 3.58Å; K134-Y138 WeakPolarHBondContact CA-O 3.29Å
135	N	91.4	Very high	92.5	Very high	106 Å²	106	104 Å²	104	57%	0.567	51%	0.51	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.4	111.3	172.6	-175.7	28.7	0	0	0	109.2	M133 I137 Y138	M133-N135 HydrophobicContact SD-CB 4.22Å; N135-I137 PolarHBondContact O-N 2.49Å; N135-I137 VanDerWaalsContact O-N 3.13Å; N135-Y138 PolarHBondContact N-O 3.29Å; N135-Y138 WeakPolarHBondContact O-CA 3.25Å; N135-Y138 WeakPolarHBondContact O-CB 3.44Å; N135-Y138 VanDerWaalsContact O-CD2 3.32Å; N135-Y138 WeakPolarHBondContact O-CD2 3.31Å; N135-Y138 PolarHBondContact O-N 3.04Å
136	D	95	Very high	92.6	Very high	126 Å²	126	102 Å²	102	67%	0.674	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	-114.8	-175.1	-175.6	37.8	0	0	0	111.9
137	I	94.3	Very high	92.6	Very high	120 Å²	120	94.8 Å²	94.8	62%	0.615	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-6.4	177.5	63	171	0	0	0	114.1	N135 H139	N135-I137 PolarHBondContact O-N 2.49Å; N135-I137 VanDerWaalsContact O-N 3.13Å; I137-H139 PolarHBondContact O-CD2 3.06Å
138	Y	93.1	Very high	92.5	Very high	150 Å²	150	94.4 Å²	94.4	59%	0.588	47%	0.467	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.4	118.9	-177	-55.7	-78.8	0	0	0	110.8	K134 N135	K134-Y138 CarbonylContact C-O 3.58Å; K134-Y138 WeakPolarHBondContact CA-O 3.29Å; N135-Y138 PolarHBondContact N-O 3.29Å; N135-Y138 WeakPolarHBondContact O-CA 3.25Å; N135-Y138 WeakPolarHBondContact O-CB 3.44Å; N135-Y138 VanDerWaalsContact O-CD2 3.32Å; N135-Y138 WeakPolarHBondContact O-CD2 3.31Å; N135-Y138 PolarHBondContact O-N 3.04Å
139	H	94.4	Very high	92.2	Very high	98 Å²	98	92.9 Å²	92.9	45%	0.454	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	129.9	176.1	-58	-89.2	0	0	0	110.1	I137 F141	I137-H139 PolarHBondContact O-CD2 3.06Å; H139-F141 HydrophobicContact CB-CD2 4.38Å; H139-F141 HydrophobicContact CB-CE2 3.58Å; H139-F141 HydrophobicContact CB-CZ 4.1Å
140	R	94.8	Very high	92	Very high	138 Å²	138	90.9 Å²	90.9	52%	0.521	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	123.1	175.3	-169.1	171.3	73	171.8	1	110.3	I132 M133	I132-R140 HydrophobicContact CB-CB 4.41Å; I132-R140 HydrophobicContact CB-CG 4.32Å; I132-R140 HydrophobicContact CD1-CG 4.11Å; I132-R140 PolarHBondContact N-O 3.15Å; M133-R140 HydrophobicContact CB-CB 4.17Å; M133-R140 PolarHBondContact N-O 3.35Å; M133-R140 PolarHBondContact O-N 2.89Å
141	F	94.6	Very high	91.7	Very high	111 Å²	111	87.1 Å²	87.1	49%	0.487	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	151.4	176.8	-57.3	-84.7	0	0	0	110.8	K130 H139 I143	K130-F141 CarbonylContact O-C 3.59Å; K130-F141 WeakPolarHBondContact O-CA 3.12Å; H139-F141 HydrophobicContact CB-CD2 4.38Å; H139-F141 HydrophobicContact CB-CE2 3.58Å; H139-F141 HydrophobicContact CB-CZ 4.1Å; F141-I143 HydrophobicContact CB-CD1 4.25Å
142	L	93.5	Very high	91.4	Very high	91 Å²	91	85.2 Å²	85.2	48%	0.476	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	112	164.6	176.5	65	0	0	0	108	A129 K130 I132 T144	A129-L142 CarbonylContact C-O 3.46Å; A129-L142 WeakPolarHBondContact CA-O 3.37Å; K130-L142 HydrophobicContact CB-CB 4.42Å; K130-L142 PolarHBondContact N-O 3.43Å; K130-L142 PolarHBondContact O-N 3.4Å; I132-L142 HydrophobicContact CD1-CB 3.77Å; I132-L142 HydrophobicContact CG1-CB 4.18Å; L142-T144 HydrophobicContact CD2-CG2 4.23Å; L142-T144 HydrophobicContact CG-CG2 4.04Å
143	I	92.4	Very high	91.2	Very high	58 Å²	58	85.9 Å²	85.9	30%	0.297	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	128.4	173.9	-49.3	-55.3	0	0	0	108.3	W127 A129 F141 N145 L147	W127-I143 HydrophobicContact CD2-CG2 4.45Å; W127-I143 HydrophobicContact CE3-CD1 3.89Å; W127-I143 HydrophobicContact CE3-CG1 4.26Å; W127-I143 HydrophobicContact CE3-CG2 4.49Å; W127-I143 HydrophobicContact CZ3-CD1 4.41Å; A129-I143 HydrophobicContact CB-CD1 3.43Å; A129-I143 VanDerWaalsContact CB-CD1 3.43Å; F141-I143 HydrophobicContact CB-CD1 4.25Å; I143-N145 WeakPolarHBondContact CG2-O 3.43Å; I143-L147 HydrophobicContact CG2-CD1 4.02Å; I143-L147 HydrophobicContact CG2-CG 4.49Å
144	T	91.2	Very high	91.1	Very high	87 Å²	87	86.2 Å²	86.2	53%	0.534	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	-19.3	-175.6	54	0	0	0	0	113.6	Q128 L142	Q128-T144 PolarHBondContact O-N 3.48Å; Q128-T144 PolarHBondContact O-OG1 3.17Å; L142-T144 HydrophobicContact CD2-CG2 4.23Å; L142-T144 HydrophobicContact CG-CG2 4.04Å
145	N	91.4	Very high	91	Very high	61 Å²	61	82.1 Å²	82.1	33%	0.326	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	155.2	179.1	-162.4	6.6	0	0	0	109.5	W127 Q128 I143 E148	W127-N145 WeakPolarHBondContact CA-O 3.37Å; Q128-N145 HydrophobicContact CB-CB 3.7Å; Q128-N145 HydrophobicContact CG-CB 3.78Å; Q128-N145 PolarHBondContact N-O 3.27Å; Q128-N145 VanDerWaalsContact N-O 3.16Å; I143-N145 WeakPolarHBondContact CG2-O 3.43Å; N145-E148 PolarHBondContact OD1-OE1 2.78Å
146	G	87.7	Confident	91	Very high	2 Å²	2	81.2 Å²	81.2	2%	0.021	42%	0.415	C	S	.	.	S	Bend	trans	99.1	15.9	174.9	0	0	0	0	0	115.4	P125 W127 E148	P125-G146 WeakPolarHBondContact CG-O 3.38Å; W127-G146 PolarHBondContact NE1-O 2.8Å; G146-E148 WeakPolarHBondContact CA-OE1 3.3Å; G146-E148 PolarHBondContact N-OE1 2.95Å
147	L	89.4	Confident	90.9	Very high	16 Å²	16	77.3 Å²	77.3	8%	0.084	40%	0.396	C	S	.	.			trans	-139.2	33.7	-179.1	-72.6	177.5	0	0	0	111.3	V93 W127 I143 S149 I150 N151	V93-L147 HydrophobicContact CG2-CD2 4.2Å; W127-L147 HydrophobicContact CZ2-CD1 4.28Å; W127-L147 HydrophobicContact CZ2-CD2 3.67Å; W127-L147 HydrophobicContact CZ2-CG 4.16Å; I143-L147 HydrophobicContact CG2-CD1 4.02Å; I143-L147 HydrophobicContact CG2-CG 4.49Å; L147-S149 PolarHBondContact O-N 3.04Å; L147-I150 HydrophobicContact CB-CD1 4.19Å; L147-I150 HydrophobicContact CB-CG1 3.91Å; L147-I150 HydrophobicContact CD1-CD1 4.27Å; L147-I150 HydrophobicContact CD2-CD1 4.02Å; L147-I150 HydrophobicContact CD2-CG1 4.32Å; L147-I150 HydrophobicContact CG-CD1 4.4Å; L147-I150 VanDerWaalsContact O-CG1 3.3Å; L147-I150 WeakPolarHBondContact O-CG1 3.4Å; L147-I150 PolarHBondContact O-N 2.83Å; L147-I150 VanDerWaalsContact O-N 3.09Å; L147-N151 WeakPolarHBondContact O-CB 3.38Å; L147-N151 PolarHBondContact O-N 3.1Å; L147-N151 PolarHBondContact O-ND2 3.19Å; L147-N151 VanDerWaalsContact O-ND2 3.13Å
148	E	87.6	Confident	90.8	Very high	107 Å²	107	73 Å²	73	50%	0.5	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-36.2	-171	-64.5	60.9	-122.4	0	0	111.6	N145 G146 I150 N151	N145-E148 PolarHBondContact OD1-OE1 2.78Å; G146-E148 WeakPolarHBondContact CA-OE1 3.3Å; G146-E148 PolarHBondContact N-OE1 2.95Å; E148-I150 PolarHBondContact O-N 3.09Å; E148-I150 VanDerWaalsContact O-N 3.17Å; E148-N151 PolarHBondContact O-N 2.87Å
149	S	84.7	Confident	90.8	Very high	75 Å²	75	69.6 Å²	69.6	52%	0.524	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-22.4	179.4	59.4	0	0	0	0	114.3	C91 L147	C91-S149 PolarHBondContact O-OG 2.81Å; L147-S149 PolarHBondContact O-N 3.04Å
150	I	87.3	Confident	90.7	Very high	14 Å²	14	68.4 Å²	68.4	7%	0.072	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.3	-1.2	-176.4	57.8	156.7	0	0	0	113.4	F81 P82 C91 V93 L147 E148 G152	F81-I150 HydrophobicContact CD1-CD1 3.52Å; F81-I150 HydrophobicContact CE1-CD1 3.47Å; F81-I150 VanDerWaalsContact CE1-CD1 3.47Å; P82-I150 HydrophobicContact CG-CG2 4.04Å; C91-I150 HydrophobicContact CB-CG2 3.62Å; V93-I150 HydrophobicContact CG2-CD1 3.65Å; V93-I150 HydrophobicContact CG2-CG1 4.37Å; V93-I150 HydrophobicContact CG2-CG2 4.31Å; L147-I150 HydrophobicContact CB-CD1 4.19Å; L147-I150 HydrophobicContact CB-CG1 3.91Å; L147-I150 HydrophobicContact CD1-CD1 4.27Å; L147-I150 HydrophobicContact CD2-CD1 4.02Å; L147-I150 HydrophobicContact CD2-CG1 4.32Å; L147-I150 HydrophobicContact CG-CD1 4.4Å; L147-I150 VanDerWaalsContact O-CG1 3.3Å; L147-I150 WeakPolarHBondContact O-CG1 3.4Å; L147-I150 PolarHBondContact O-N 2.83Å; L147-I150 VanDerWaalsContact O-N 3.09Å; E148-I150 PolarHBondContact O-N 3.09Å; E148-I150 VanDerWaalsContact O-N 3.17Å; I150-G152 PolarHBondContact O-N 2.8Å
151	N	88.1	Confident	90.5	Very high	68 Å²	68	62.4 Å²	62.4	36%	0.364	34%	0.342	S	S	.	.			trans	-85.2	20	178.2	-78.1	-24.5	0	0	0	113	L147 E148	L147-N151 WeakPolarHBondContact O-CB 3.38Å; L147-N151 PolarHBondContact O-N 3.1Å; L147-N151 PolarHBondContact O-ND2 3.19Å; L147-N151 VanDerWaalsContact O-ND2 3.13Å; E148-N151 PolarHBondContact O-N 2.87Å
152	G	88.6	Confident	90.2	Very high	35 Å²	35	60.7 Å²	60.7	36%	0.361	34%	0.336	S	S	.	.			trans	-54.8	150.9	-179.7	0	0	0	0	0	113.8	S79 I150	S79-G152 PolarHBondContact N-O 2.86Å; S79-G152 PolarHBondContact OG-O 3.26Å; I150-G152 PolarHBondContact O-N 2.8Å
153	I	90.7	Very high	89.9	Confident	96 Å²	96	61.1 Å²	61.1	49%	0.492	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	123	172.5	-59.7	178.7	0	0	0	106.9	L76 Q77 K78	L76-I153 HydrophobicContact CB-CG2 3.9Å; L76-I153 HydrophobicContact CD2-CG2 4.14Å; Q77-I153 CarbonylContact O-C 3.57Å; Q77-I153 WeakPolarHBondContact O-CA 3.47Å; K78-I153 HydrophobicContact CD-CG1 4.25Å
154	E	89.1	Confident	89.3	Confident	93 Å²	93	63.2 Å²	63.2	44%	0.435	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	121.7	171.2	-70.4	170.6	-157	0	0	108.5	L76 Q77	L76-E154 WeakPolarHBondContact CA-O 3.47Å; Q77-E154 PolarHBondContact N-O 2.91Å; Q77-E154 PolarHBondContact O-N 2.78Å
155	M	92	Very high	89.1	Confident	73 Å²	73	61.1 Å²	61.1	36%	0.36	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	118.4	177.6	179	168.6	161.8	0	0	109.8	F39 M44 F65 V74 T75 L76 V157	F39-M155 HydrophobicContact CB-CE 4.27Å; F39-M155 WeakPolarHBondContact O-CE 3.33Å; M44-M155 HydrophobicContact CE-CE 3.39Å; M44-M155 HydrophobicContact CE-SD 4.18Å; F65-M155 HydrophobicContact CZ-CE 4.27Å; V74-M155 HydrophobicContact CG1-CE 3.8Å; V74-M155 HydrophobicContact CG1-CG 3.99Å; V74-M155 HydrophobicContact CG1-SD 4.18Å; V74-M155 HydrophobicContact CG2-CE 4.19Å; T75-M155 CarbonylContact O-C 3.57Å; T75-M155 WeakPolarHBondContact O-CA 3.42Å; L76-M155 HydrophobicContact CD2-CB 3.83Å; L76-M155 HydrophobicContact CD2-CG 3.74Å; L76-M155 HydrophobicContact CD2-SD 4.02Å; M155-V157 HydrophobicContact CE-CG2 3.39Å; M155-V157 HydrophobicContact CG-CG2 4.18Å
156	T	91.2	Very high	89	Confident	86 Å²	86	59.7 Å²	59.7	53%	0.528	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	128.5	171.6	-59.5	0	0	0	0	109.7	V74 T75	V74-T156 WeakPolarHBondContact CA-O 3.22Å; T75-T156 PolarHBondContact N-O 2.75Å; T75-T156 PolarHBondContact O-N 2.84Å
157	V	92.9	Very high	88.7	Confident	45 Å²	45	63.6 Å²	63.6	27%	0.273	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	124.7	178.6	-171.7	0	0	0	0	110.1	F39 F65 I73 V74 M155	F39-V157 HydrophobicContact CB-CG2 4.32Å; F39-V157 HydrophobicContact CD1-CG1 3.86Å; F39-V157 HydrophobicContact CD1-CG2 4.47Å; F39-V157 HydrophobicContact CE1-CG1 3.91Å; F39-V157 HydrophobicContact CG-CG1 4.41Å; F39-V157 HydrophobicContact CG-CG2 4.31Å; F65-V157 HydrophobicContact CE2-CG1 3.97Å; F65-V157 HydrophobicContact CZ-CG1 4.34Å; I73-V157 WeakPolarHBondContact O-CA 3.45Å; V74-V157 HydrophobicContact CG2-CG1 4.45Å; V74-V157 HydrophobicContact CG2-CG2 4.38Å; M155-V157 HydrophobicContact CE-CG2 3.39Å; M155-V157 HydrophobicContact CG-CG2 4.18Å
158	T	91.8	Very high	88.1	Confident	30 Å²	30	69.6 Å²	69.6	18%	0.184	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	108.1	164.6	-53.7	0	0	0	0	107.8	A72 I73 A161 H165	A72-T158 VanDerWaalsContact CA-O 3.29Å; A72-T158 WeakPolarHBondContact CA-O 3.25Å; I73-T158 PolarHBondContact N-O 3.26Å; I73-T158 PolarHBondContact O-N 3.32Å; T158-A161 HydrophobicContact CG2-CB 4.33Å; T158-H165 HydrophobicContact CG2-CB 4.45Å
159	Y	92.7	Very high	87.8	Confident	78 Å²	78	65.8 Å²	65.8	31%	0.306	36%	0.356	S	S	.	.			trans	-149.4	137.6	-178.8	166.3	-89.3	0	0	0	111.1	F39 D68 K70 A72	F39-Y159 AromaticContact CE1-CD1 3.8Å; F39-Y159 HydrophobicContact CE1-CD1 3.8Å; F39-Y159 HydrophobicContact CE1-CE1 4.45Å; F39-Y159 AromaticContact CE1-CG 3.85Å; F39-Y159 HydrophobicContact CE1-CG 3.85Å; F39-Y159 AromaticContact CZ-CD1 3.7Å; F39-Y159 HydrophobicContact CZ-CD1 3.7Å; F39-Y159 HydrophobicContact CZ-CE1 4.34Å; F39-Y159 HydrophobicContact CZ-CG 4.18Å; D68-Y159 PolarHBondContact OD2-OH 2.88Å; K70-Y159 HydrophobicContact CB-CE2 3.78Å; K70-Y159 HydrophobicContact CD-CE2 4.33Å; A72-Y159 HydrophobicContact CB-CD2 4.08Å
160	P	92.5	Very high	87.3	Confident	72 Å²	72	64.6 Å²	64.6	47%	0.468	35%	0.351	S	S	.	.	S	Bend	cis	-66.7	134.6	-14.9	29.2	-33.8	0	0	0	110.8	K70	K70-P160 HydrophobicContact CB-CB 4.04Å; K70-P160 HydrophobicContact CD-CB 3.86Å; K70-P160 HydrophobicContact CD-CG 4.36Å; K70-P160 HydrophobicContact CG-CB 4.27Å
161	A	91.3	Very high	86.4	Confident	12 Å²	12	71.2 Å²	71.2	10%	0.099	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-83.1	116.4	177.2	0	0	0	0	0	110.1	E71 I73 T158 H165 F166	E71-A161 PolarHBondContact O-N 3.29Å; I73-A161 HydrophobicContact CD1-CB 4.35Å; I73-A161 HydrophobicContact CG1-CB 3.94Å; T158-A161 HydrophobicContact CG2-CB 4.33Å; A161-H165 HydrophobicContact CB-CB 4.4Å; A161-F166 HydrophobicContact CB-CE1 4.46Å; A161-F166 HydrophobicContact CB-CE2 3.73Å; A161-F166 HydrophobicContact CB-CZ 3.59Å; A161-F166 WeakPolarHBondContact O-CE2 3.1Å
162	E	88.9	Confident	85.9	Confident	76 Å²	76	69.4 Å²	69.4	36%	0.355	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-77.4	162.2	168.6	-61.8	177.1	-163.5	0	0	112.7	H164 H165 F166	E162-H164 WeakPolarHBondContact CB-ND1 3.41Å; E162-H164 PolarHBondContact O-N 3.28Å; E162-H164 IonicContact OE2-CE1 3.04Å; E162-H164 PolarHBondContact OE2-CE1 3.24Å; E162-H164 IonicContact OE2-ND1 3.09Å; E162-H164 PolarHBondContact OE2-ND1 3.21Å; E162-H164 VanDerWaalsContact OE2-ND1 3.09Å; E162-H165 PolarHBondContact N-ND1 2.9Å; E162-H165 WeakPolarHBondContact O-CB 3.17Å; E162-H165 PolarHBondContact O-N 3.23Å; E162-H165 PolarHBondContact O-ND1 3.27Å; E162-F166 VanDerWaalsContact O-CD2 3.3Å; E162-F166 WeakPolarHBondContact O-CD2 3.22Å
163	S	86.6	Confident	85.6	Confident	99 Å²	99	71.1 Å²	71.1	69%	0.692	39%	0.385	S	S	*	.	H	α-helix	trans	-48.3	-38.7	-178.8	57.5	0	0	0	0	114.2	H165 F166 T167	S163-H165 VanDerWaalsContact C-N 3.28Å; S163-H165 PolarHBondContact O-N 2.8Å; S163-F166 PolarHBondContact O-N 2.85Å; S163-T167 PolarHBondContact O-OG1 3.14Å
164	H	80.5	Confident	85.5	Confident	103 Å²	103	71.7 Å²	71.7	48%	0.477	38%	0.381	S	S	.	.	H	α-helix	trans	-67	-25.5	-179.6	74.4	-98.1	0	0	0	113.4	E162 F166	E162-H164 WeakPolarHBondContact CB-ND1 3.41Å; E162-H164 PolarHBondContact O-N 3.28Å; E162-H164 IonicContact OE2-CE1 3.04Å; E162-H164 PolarHBondContact OE2-CE1 3.24Å; E162-H164 IonicContact OE2-ND1 3.09Å; E162-H164 PolarHBondContact OE2-ND1 3.21Å; E162-H164 VanDerWaalsContact OE2-ND1 3.09Å; H164-F166 VanDerWaalsContact C-N 3.33Å
165	H	85.8	Confident	85.6	Confident	42 Å²	42	70.7 Å²	70.7	19%	0.194	38%	0.376	C	S	.	.	H	α-helix	trans	-69.6	-32.6	176	-61.9	105.6	0	0	0	111.9	I73 T158 A161 E162 S163 R168	I73-H165 HydrophobicContact CD1-CB 3.69Å; I73-H165 WeakPolarHBondContact CD1-O 3.39Å; T158-H165 HydrophobicContact CG2-CB 4.45Å; A161-H165 HydrophobicContact CB-CB 4.4Å; E162-H165 PolarHBondContact N-ND1 2.9Å; E162-H165 WeakPolarHBondContact O-CB 3.17Å; E162-H165 PolarHBondContact O-N 3.23Å; E162-H165 PolarHBondContact O-ND1 3.27Å; S163-H165 VanDerWaalsContact C-N 3.28Å; S163-H165 PolarHBondContact O-N 2.8Å; H165-R168 WeakPolarHBondContact O-CG 3.34Å
166	F	88.8	Confident	85.7	Confident	31 Å²	31	72.6 Å²	72.6	14%	0.136	39%	0.387	C	S	.	.	H	α-helix	trans	-75.8	-29.2	-179.9	-62.1	-80.2	0	0	0	112.6	L50 H62 E71 I73 A161 E162 S163 H164 R168 Y169 A170	L50-F166 HydrophobicContact CD1-CD1 4.06Å; L50-F166 HydrophobicContact CD1-CE1 4.43Å; L50-F166 HydrophobicContact CD2-CD1 4.46Å; H62-F166 HydrophobicContact CB-CE1 4.32Å; H62-F166 AromaticContact CD2-CE1 3.36Å; H62-F166 WeakPolarHBondContact CD2-CE1 3.29Å; H62-F166 AromaticContact CD2-CZ 3.8Å; H62-F166 AromaticContact CE1-CE1 3.97Å; H62-F166 AromaticContact CG-CE1 3.69Å; H62-F166 AromaticContact NE2-CE1 3.59Å; H62-F166 AromaticContact NE2-CZ 3.67Å; E71-F166 HydrophobicContact CB-CE2 4.45Å; E71-F166 HydrophobicContact CB-CZ 3.85Å; I73-F166 HydrophobicContact CD1-CD1 3.69Å; I73-F166 HydrophobicContact CD1-CE1 3.82Å; I73-F166 HydrophobicContact CD1-CG 4.12Å; I73-F166 HydrophobicContact CD1-CZ 4.36Å; I73-F166 HydrophobicContact CG1-CD1 3.86Å; I73-F166 HydrophobicContact CG1-CE1 3.47Å; I73-F166 VanDerWaalsContact CG1-CE1 3.47Å; I73-F166 HydrophobicContact CG1-CZ 4.01Å; A161-F166 HydrophobicContact CB-CE1 4.46Å; A161-F166 HydrophobicContact CB-CE2 3.73Å; A161-F166 HydrophobicContact CB-CZ 3.59Å; A161-F166 WeakPolarHBondContact O-CE2 3.1Å; E162-F166 VanDerWaalsContact O-CD2 3.3Å; E162-F166 WeakPolarHBondContact O-CD2 3.22Å; S163-F166 PolarHBondContact O-N 2.85Å; H164-F166 VanDerWaalsContact C-N 3.33Å; F166-R168 PolarHBondContact O-N 3Å; F166-R168 VanDerWaalsContact O-N 3.09Å; F166-Y169 PolarHBondContact O-N 3.46Å; F166-A170 PolarHBondContact O-N 3.22Å
167	T	81.5	Confident	85.8	Confident	84 Å²	84	69.3 Å²	69.3	52%	0.515	37%	0.366	S	S	.	.	H	α-helix	trans	-56.3	-32.4	-175.5	-46.4	0	0	0	0	112.7	S163 Y169 A170	S163-T167 PolarHBondContact O-OG1 3.14Å; T167-Y169 PolarHBondContact O-N 2.84Å; T167-A170 PolarHBondContact O-N 2.79Å
168	R	77.1	Confident	86	Confident	143 Å²	143	71 Å²	71	54%	0.54	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-20.4	179.4	78	-169.8	-179.7	-161.2	-5.2	114.3	H165 F166	H165-R168 WeakPolarHBondContact O-CG 3.34Å; F166-R168 PolarHBondContact O-N 3Å; F166-R168 VanDerWaalsContact O-N 3.09Å
169	Y	82.2	Confident	86.2	Confident	27 Å²	27	69.6 Å²	69.6	11%	0.106	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107	-1.3	-179.3	-54.5	-71.1	0	0	0	113.9	L50 Q51 V60 I73 F166 T167 N171	L50-Y169 HydrophobicContact CB-CG 4.08Å; L50-Y169 HydrophobicContact CD1-CD2 3.83Å; L50-Y169 HydrophobicContact CD1-CE2 4.41Å; L50-Y169 HydrophobicContact CD1-CG 4.24Å; Q51-Y169 HydrophobicContact CB-CD1 4.31Å; V60-Y169 HydrophobicContact CB-CD1 4.27Å; V60-Y169 HydrophobicContact CB-CE1 3.99Å; V60-Y169 HydrophobicContact CG1-CD1 3.89Å; V60-Y169 HydrophobicContact CG1-CD2 4.17Å; V60-Y169 HydrophobicContact CG1-CE1 3.49Å; V60-Y169 VanDerWaalsContact CG1-CE1 3.49Å; V60-Y169 HydrophobicContact CG1-CE2 3.78Å; V60-Y169 HydrophobicContact CG1-CG 4.18Å; V60-Y169 HydrophobicContact CG2-CD1 4.25Å; V60-Y169 HydrophobicContact CG2-CE1 3.67Å; I73-Y169 HydrophobicContact CD1-CD2 4.04Å; I73-Y169 HydrophobicContact CD1-CE2 3.76Å; I73-Y169 HydrophobicContact CG2-CD2 4.5Å; I73-Y169 HydrophobicContact CG2-CE2 3.72Å; F166-Y169 PolarHBondContact O-N 3.46Å; T167-Y169 PolarHBondContact O-N 2.84Å; Y169-N171 PolarHBondContact O-N 2.99Å
170	A	74.4	Confident	86.4	Confident	50 Å²	50	68.2 Å²	68.2	41%	0.413	36%	0.362	S	S	.	.	S	Bend	trans	-59.3	115.1	172.2	0	0	0	0	0	108.3	F166 T167 S172 N368	F166-A170 PolarHBondContact O-N 3.22Å; T167-A170 PolarHBondContact O-N 2.79Å; A170-S172 PolarHBondContact O-N 3.37Å; A170-S172 VanDerWaalsContact O-N 3.17Å; A170-N368 WeakPolarHBondContact CB-ND2 3.36Å; A170-N368 PolarHBondContact O-ND2 3.33Å
171	N	68.6	Low	86.7	Confident	152 Å²	152	66.9 Å²	66.9	81%	0.813	35%	0.353	S	S	*	.			trans	-52.8	124.3	177.1	-82.8	-30	0	0	0	109.1	Y169	Y169-N171 PolarHBondContact O-N 2.99Å
172	S	76.5	Confident	86.9	Confident	30 Å²	30	68.1 Å²	68.1	21%	0.21	36%	0.364	C	S	.	.			trans	-149.8	135.5	177.8	67.2	0	0	0	0	108.5	A170 H366 N368	A170-S172 PolarHBondContact O-N 3.37Å; A170-S172 VanDerWaalsContact O-N 3.17Å; S172-H366 VanDerWaalsContact OG-CB 3.31Å; S172-H366 WeakPolarHBondContact OG-CB 3.42Å; S172-H366 PolarHBondContact OG-ND1 3.38Å; S172-N368 PolarHBondContact OG-OD1 2.81Å
173	S	83	Confident	87.3	Confident	71 Å²	71	64.9 Å²	64.9	50%	0.497	35%	0.349	S	S	.	.			trans	-55.7	149.1	166.5	45.8	0	0	0	0	110.5	H175 A367	S173-H175 PolarHBondContact OG-NE2 2.74Å; S173-A367 PolarHBondContact O-N 2.89Å
174	R	87.4	Confident	87.8	Confident	109 Å²	109	61 Å²	61	41%	0.411	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	137.4	169.9	-67.2	176.7	-179.2	159.5	3.8	108.3	F364 L365 H366	R174-F364 HydrophobicContact CB-CD2 4.32Å; R174-F364 HydrophobicContact CG-CD2 4.17Å; R174-F364 HydrophobicContact CG-CE2 4.46Å; R174-L365 CarbonylContact C-O 3.32Å; R174-L365 WeakPolarHBondContact CA-O 3.38Å; R174-H366 PolarHBondContact NE-CE1 3.35Å; R174-H366 PolarHBondContact NE-NE2 3.32Å; R174-H366 VanDerWaalsContact NE-NE2 3.1Å
175	H	91.3	Very high	88.5	Confident	71 Å²	71	62.7 Å²	62.7	33%	0.329	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	131	179.2	-63.3	-86.6	0	0	0	109.3	S173 F364 L365 F372	S173-H175 PolarHBondContact OG-NE2 2.74Å; H175-F364 CarbonylContact O-C 3.55Å; H175-F364 VanDerWaalsContact O-CA 3.22Å; H175-F364 WeakPolarHBondContact O-CA 3.36Å; H175-L365 PolarHBondContact N-O 2.69Å; H175-L365 PolarHBondContact O-N 2.93Å; H175-F372 HydrophobicContact CB-CD2 4.36Å; H175-F372 HydrophobicContact CB-CE2 3.59Å; H175-F372 HydrophobicContact CB-CZ 4.12Å; H175-F372 AromaticContact CD2-CE2 3.91Å; H175-F372 AromaticContact CD2-CZ 3.63Å; H175-F372 AromaticContact CG-CE2 3.75Å; H175-F372 AromaticContact CG-CZ 3.74Å
176	I	94.2	Very high	89	Confident	113 Å²	113	65.1 Å²	65.1	58%	0.579	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.2	136.2	171.8	-63.1	174.9	0	0	0	108.3	T362 M363	I176-T362 HydrophobicContact CG2-CG2 3.65Å; I176-M363 CarbonylContact C-O 3.54Å; I176-M363 WeakPolarHBondContact CA-O 3.45Å
177	I	94.3	Very high	89.3	Confident	18 Å²	18	64 Å²	64	9%	0.092	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	135	-178.4	-56	173	0	0	0	108.6	L183 T362 M363 L365 F372 I375	I177-L183 HydrophobicContact CG2-CD2 4.15Å; I177-T362 WeakPolarHBondContact O-CA 3.46Å; I177-M363 HydrophobicContact CB-CE 4.17Å; I177-M363 HydrophobicContact CB-CG 4.12Å; I177-M363 HydrophobicContact CD1-CE 4.17Å; I177-M363 HydrophobicContact CG2-CE 3.94Å; I177-M363 PolarHBondContact N-O 3.44Å; I177-M363 PolarHBondContact O-N 3.1Å; I177-L365 HydrophobicContact CD1-CB 3.93Å; I177-L365 HydrophobicContact CD1-CD1 3.48Å; I177-L365 VanDerWaalsContact CD1-CD1 3.48Å; I177-L365 HydrophobicContact CD1-CG 3.7Å; I177-F372 HydrophobicContact CD1-CD2 3.95Å; I177-F372 HydrophobicContact CD1-CE2 4.45Å; I177-I375 HydrophobicContact CD1-CD1 3.93Å
178	Q	95.9	Very high	90	Very high	79 Å²	79	60 Å²	60	37%	0.369	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	92.6	171.3	-64	-59.7	-20.3	0	0	108.7	T180 T360 T362	Q178-T180 PolarHBondContact O-N 3.06Å; Q178-T360 HydrophobicContact CB-CG2 3.84Å; Q178-T362 PolarHBondContact NE2-OG1 3.1Å; Q178-T362 VanDerWaalsContact NE2-OG1 3.09Å; Q178-T362 PolarHBondContact OE1-OG1 3.36Å
179	E	96.7	Very high	90.8	Very high	1 Å²	1	56.2 Å²	56.2	1%	0.005	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	107.6	-177	-167.2	-152.5	89.6	0	0	110.9	L183 Y184 I188 R257 Y312 T360 I361 M363	E179-L183 HydrophobicContact CB-CD2 4.41Å; E179-L183 HydrophobicContact CG-CB 4.32Å; E179-L183 HydrophobicContact CG-CD2 4.09Å; E179-L183 HydrophobicContact CG-CG 4.35Å; E179-Y184 WeakPolarHBondContact OE1-CB 3.49Å; E179-I188 HydrophobicContact CG-CD1 3.59Å; E179-I188 WeakPolarHBondContact OE2-CD1 3.48Å; E179-R257 PolarHBondContact O-NH2 3.43Å; E179-R257 IonicContact OE1-CZ 2.99Å; E179-R257 IonicContact OE1-NE 3.85Å; E179-R257 PolarHBondContact OE1-NE 3.45Å; E179-R257 IonicContact OE1-NH2 3.75Å; E179-R257 PolarHBondContact OE1-NH2 2.99Å; E179-Y312 PolarHBondContact OE1-OH 2.82Å; E179-Y312 WeakPolarHBondContact OE2-CE1 3.4Å; E179-Y312 PolarHBondContact OE2-OH 2.78Å; E179-T360 CarbonylContact O-C 3.6Å; E179-T360 VanDerWaalsContact O-CA 3.25Å; E179-T360 WeakPolarHBondContact O-CA 3.1Å; E179-I361 WeakPolarHBondContact CB-O 3.14Å; E179-I361 PolarHBondContact N-O 2.98Å; E179-I361 PolarHBondContact O-N 3.11Å; E179-M363 HydrophobicContact CB-CE 3.97Å; E179-M363 HydrophobicContact CB-SD 4.43Å; E179-M363 HydrophobicContact CG-CE 4.14Å
180	T	97.6	Very high	91.4	Very high	49 Å²	49	57.5 Å²	57.5	30%	0.301	31%	0.312	S	S	.	.			trans	-78.3	161.4	173	66.2	0	0	0	0	111	Q178 A182 L183 Y184 T360	Q178-T180 PolarHBondContact O-N 3.06Å; T180-A182 PolarHBondContact O-N 3.26Å; T180-L183 PolarHBondContact O-N 2.9Å; T180-L183 VanDerWaalsContact O-N 3.11Å; T180-L183 PolarHBondContact OG1-N 3.21Å; T180-L183 VanDerWaalsContact OG1-N 3.08Å; T180-Y184 PolarHBondContact O-N 3.09Å; T180-T360 HydrophobicContact CG2-CG2 4.46Å
181	P	97.3	Very high	92.4	Very high	44 Å²	44	56.4 Å²	56.4	29%	0.286	30%	0.298	S	S	.	.	H	α-helix	trans	-54.7	-37.3	171.9	-26.6	34.8	0	0	0	113.3	Y184 K185 A357 N358	P181-Y184 PolarHBondContact O-N 2.74Å; P181-K185 VanDerWaalsContact O-CB 3.3Å; P181-K185 WeakPolarHBondContact O-CB 3.42Å; P181-K185 PolarHBondContact O-N 3.06Å; P181-A357 WeakPolarHBondContact CB-O 3.34Å; P181-A357 WeakPolarHBondContact CG-O 3.35Å; P181-N358 VanDerWaalsContact CG-C 3.49Å; P181-N358 WeakPolarHBondContact CG-O 3.26Å
182	A	97	Very high	93.6	Very high	39 Å²	39	50.6 Å²	50.6	32%	0.322	27%	0.267	S	S	.	.	H	α-helix	trans	-65.4	-45.3	175.4	0	0	0	0	0	111.5	T180 Y184 K185 D186	T180-A182 PolarHBondContact O-N 3.26Å; A182-Y184 VanDerWaalsContact C-N 3.32Å; A182-Y184 PolarHBondContact O-N 3.14Å; A182-K185 PolarHBondContact O-N 3.37Å; A182-D186 VanDerWaalsContact O-CB 3.28Å; A182-D186 WeakPolarHBondContact O-CB 3.44Å; A182-D186 PolarHBondContact O-N 2.8Å
183	L	96.8	Very high	94.3	Very high	7 Å²	7	53.6 Å²	53.6	4%	0.037	29%	0.288	C	S	.	.	H	α-helix	trans	-61	-42	176.7	-174.7	66.2	0	0	0	111.8	I177 E179 T180 V187 I188 I375 H381	I177-L183 HydrophobicContact CG2-CD2 4.15Å; E179-L183 HydrophobicContact CB-CD2 4.41Å; E179-L183 HydrophobicContact CG-CB 4.32Å; E179-L183 HydrophobicContact CG-CD2 4.09Å; E179-L183 HydrophobicContact CG-CG 4.35Å; T180-L183 PolarHBondContact O-N 2.9Å; T180-L183 VanDerWaalsContact O-N 3.11Å; T180-L183 PolarHBondContact OG1-N 3.21Å; T180-L183 VanDerWaalsContact OG1-N 3.08Å; L183-V187 HydrophobicContact CD1-CB 3.94Å; L183-V187 HydrophobicContact CD1-CG1 4.46Å; L183-V187 HydrophobicContact CD1-CG2 3.8Å; L183-V187 WeakPolarHBondContact O-CB 3.43Å; L183-V187 PolarHBondContact O-N 3.35Å; L183-V187 VanDerWaalsContact O-N 3.13Å; L183-I188 PolarHBondContact O-N 2.91Å; L183-I188 VanDerWaalsContact O-N 3.14Å; L183-I375 HydrophobicContact CD1-CG1 4.41Å; L183-I375 HydrophobicContact CD1-CG2 4.27Å; L183-I375 HydrophobicContact CD2-CG1 4.49Å; L183-I375 HydrophobicContact CD2-CG2 4.21Å; L183-H381 HydrophobicContact CD1-CB 4.47Å
184	Y	96.9	Very high	94.7	Very high	17 Å²	17	57.2 Å²	57.2	7%	0.067	30%	0.297	C	S	.	.	I	π-helix	trans	-59.5	-52.5	175.1	-178.2	-111.1	0	0	0	111.5	E179 T180 P181 A182 I188 L189 C255 R257 Y312	E179-Y184 WeakPolarHBondContact OE1-CB 3.49Å; T180-Y184 PolarHBondContact O-N 3.09Å; P181-Y184 PolarHBondContact O-N 2.74Å; A182-Y184 VanDerWaalsContact C-N 3.32Å; A182-Y184 PolarHBondContact O-N 3.14Å; Y184-I188 HydrophobicContact CD2-CB 4.13Å; Y184-I188 HydrophobicContact CD2-CG2 4.01Å; Y184-I188 HydrophobicContact CE2-CG2 4.18Å; Y184-I188 PolarHBondContact O-N 3.16Å; Y184-L189 HydrophobicContact CD1-CD1 4.14Å; Y184-L189 HydrophobicContact CD1-CG 4.07Å; Y184-L189 HydrophobicContact CE1-CD1 3.79Å; Y184-L189 HydrophobicContact CE1-CD2 3.8Å; Y184-L189 HydrophobicContact CE1-CG 3.69Å; Y184-L189 HydrophobicContact CE2-CD2 4.17Å; Y184-L189 HydrophobicContact CE2-CG 4.32Å; Y184-L189 PolarHBondContact O-N 3.43Å; Y184-L189 WeakPolarHBondContact OH-CD2 3.3Å; Y184-C255 PolarHBondContact OH-SG 2.82Å; Y184-R257 HydrophobicContact CD1-CB 4.19Å; Y184-R257 HydrophobicContact CD1-CG 3.88Å; Y184-R257 HydrophobicContact CD2-CG 3.89Å; Y184-R257 HydrophobicContact CE1-CB 3.6Å; Y184-R257 HydrophobicContact CE1-CG 3.74Å; Y184-R257 HydrophobicContact CE2-CB 4.21Å; Y184-R257 HydrophobicContact CE2-CG 3.78Å; Y184-R257 HydrophobicContact CG-CG 3.95Å; Y184-Y312 WeakPolarHBondContact CD2-OH 3.2Å
185	K	96.2	Very high	94.5	Very high	140 Å²	140	58.4 Å²	58.4	61%	0.609	31%	0.305	S	S	*	.	I	π-helix	trans	-67.1	-46.5	-174.8	-176.3	-171.3	173.4	-169.9	0	112.9	P181 A182 P190	P181-K185 VanDerWaalsContact O-CB 3.3Å; P181-K185 WeakPolarHBondContact O-CB 3.42Å; P181-K185 PolarHBondContact O-N 3.06Å; A182-K185 PolarHBondContact O-N 3.37Å; K185-P190 VanDerWaalsContact O-CD 3.28Å; K185-P190 WeakPolarHBondContact O-CD 3.19Å
186	D	95.9	Very high	94.2	Very high	92 Å²	92	60 Å²	60	49%	0.492	32%	0.322	S	S	.	.	I	π-helix	trans	-93.6	-18.5	-165.6	-57.2	-28.3	0	0	0	112.3	A182	A182-D186 VanDerWaalsContact O-CB 3.28Å; A182-D186 WeakPolarHBondContact O-CB 3.44Å; A182-D186 PolarHBondContact O-N 2.8Å
187	V	95.5	Very high	93.8	Very high	8 Å²	8	60.2 Å²	60.2	5%	0.048	32%	0.319	C	S	.	.	I	π-helix	trans	-122.9	-54.5	-178	-175.9	0	0	0	0	112.4	L183 F191 A374 I375 N378	L183-V187 HydrophobicContact CD1-CB 3.94Å; L183-V187 HydrophobicContact CD1-CG1 4.46Å; L183-V187 HydrophobicContact CD1-CG2 3.8Å; L183-V187 WeakPolarHBondContact O-CB 3.43Å; L183-V187 PolarHBondContact O-N 3.35Å; L183-V187 VanDerWaalsContact O-N 3.13Å; V187-F191 WeakPolarHBondContact O-CB 3.41Å; V187-F191 PolarHBondContact O-N 3.26Å; V187-F191 VanDerWaalsContact O-N 3.09Å; V187-A374 HydrophobicContact CG1-CB 4.44Å; V187-I375 HydrophobicContact CG1-CG1 4.32Å; V187-N378 HydrophobicContact CG1-CB 4.21Å; V187-N378 HydrophobicContact CG2-CB 3.61Å
188	I	95.1	Very high	93.6	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	34%	0.342	C	S	.	.	I	π-helix	trans	-71.7	-48	-171.7	-63.9	173.9	0	0	0	111.5	E179 L183 Y184 F191 L192 M363 M371 I375	E179-I188 HydrophobicContact CG-CD1 3.59Å; E179-I188 WeakPolarHBondContact OE2-CD1 3.48Å; L183-I188 PolarHBondContact O-N 2.91Å; L183-I188 VanDerWaalsContact O-N 3.14Å; Y184-I188 HydrophobicContact CD2-CB 4.13Å; Y184-I188 HydrophobicContact CD2-CG2 4.01Å; Y184-I188 HydrophobicContact CE2-CG2 4.18Å; Y184-I188 PolarHBondContact O-N 3.16Å; I188-F191 WeakPolarHBondContact O-CB 3.34Å; I188-F191 PolarHBondContact O-N 3.1Å; I188-F191 VanDerWaalsContact O-N 3.17Å; I188-L192 HydrophobicContact CG2-CD1 3.73Å; I188-L192 HydrophobicContact CG2-CG 4.13Å; I188-L192 VanDerWaalsContact O-CG 3.25Å; I188-L192 WeakPolarHBondContact O-CG 3.29Å; I188-L192 PolarHBondContact O-N 3.18Å; I188-M363 HydrophobicContact CD1-CE 3.9Å; I188-M371 HydrophobicContact CG2-CE 4.22Å; I188-M371 HydrophobicContact CG2-SD 4.35Å; I188-I375 HydrophobicContact CD1-CD1 4.22Å; I188-I375 HydrophobicContact CG1-CD1 4.33Å; I188-I375 HydrophobicContact CG1-CG1 4.39Å
189	L	94.9	Very high	93.4	Very high	64 Å²	64	62.6 Å²	62.6	34%	0.335	33%	0.334	S	S	.	.	H	α-helix	trans	-57.7	-47.8	177.8	-78.9	-176.5	0	0	0	112.6	Y184 F191 L192 S193	Y184-L189 HydrophobicContact CD1-CD1 4.14Å; Y184-L189 HydrophobicContact CD1-CG 4.07Å; Y184-L189 HydrophobicContact CE1-CD1 3.79Å; Y184-L189 HydrophobicContact CE1-CD2 3.8Å; Y184-L189 HydrophobicContact CE1-CG 3.69Å; Y184-L189 HydrophobicContact CE2-CD2 4.17Å; Y184-L189 HydrophobicContact CE2-CG 4.32Å; Y184-L189 PolarHBondContact O-N 3.43Å; Y184-L189 WeakPolarHBondContact OH-CD2 3.3Å; L189-F191 PolarHBondContact O-N 3.34Å; L189-L192 PolarHBondContact O-N 3.01Å; L189-S193 WeakPolarHBondContact O-CB 3.45Å; L189-S193 PolarHBondContact O-N 3.45Å; L189-S193 PolarHBondContact O-OG 3.37Å
190	P	95	Very high	93.1	Very high	53 Å²	53	66 Å²	66	34%	0.344	36%	0.355	S	S	.	.	H	α-helix	trans	-58.1	-44.3	172.2	-29.1	36.2	0	0	0	113.3	K185 L192 S193 Q194	K185-P190 VanDerWaalsContact O-CD 3.28Å; K185-P190 WeakPolarHBondContact O-CD 3.19Å; P190-L192 PolarHBondContact O-N 2.98Å; P190-S193 PolarHBondContact O-N 3.48Å; P190-Q194 WeakPolarHBondContact O-CG 3.49Å; P190-Q194 PolarHBondContact O-N 2.98Å; P190-Q194 VanDerWaalsContact O-N 3.09Å
191	F	94	Very high	92.7	Very high	28 Å²	28	68.2 Å²	68.2	12%	0.123	36%	0.358	C	S	.	.	H	α-helix	trans	-59.2	-45.9	177.9	163.3	-95.2	0	0	0	112.2	V187 I188 L189 S193 Q194 K195 P370 M371 A374	V187-F191 WeakPolarHBondContact O-CB 3.41Å; V187-F191 PolarHBondContact O-N 3.26Å; V187-F191 VanDerWaalsContact O-N 3.09Å; I188-F191 WeakPolarHBondContact O-CB 3.34Å; I188-F191 PolarHBondContact O-N 3.1Å; I188-F191 VanDerWaalsContact O-N 3.17Å; L189-F191 PolarHBondContact O-N 3.34Å; F191-S193 VanDerWaalsContact C-N 3.32Å; F191-S193 PolarHBondContact O-N 2.86Å; F191-Q194 PolarHBondContact O-N 3.24Å; F191-K195 HydrophobicContact CE2-CD 4.3Å; F191-K195 PolarHBondContact O-N 2.88Å; F191-P370 HydrophobicContact CE2-CB 3.79Å; F191-P370 HydrophobicContact CZ-CB 3.85Å; F191-M371 HydrophobicContact CD1-CB 4.06Å; F191-M371 HydrophobicContact CD1-CE 4.27Å; F191-M371 HydrophobicContact CD1-CG 4.03Å; F191-M371 HydrophobicContact CE1-CB 3.55Å; F191-M371 HydrophobicContact CE1-CE 4.01Å; F191-M371 HydrophobicContact CE1-CG 3.99Å; F191-M371 HydrophobicContact CZ-CB 3.9Å; F191-A374 HydrophobicContact CB-CB 4.18Å; F191-A374 HydrophobicContact CD2-CB 3.74Å; F191-A374 HydrophobicContact CE2-CB 4.47Å; F191-A374 HydrophobicContact CG-CB 4.08Å
192	L	93.6	Very high	92.4	Very high	29 Å²	29	66.3 Å²	66.3	15%	0.152	35%	0.345	C	S	.	.	H	α-helix	trans	-64.6	-38.7	179.2	-67.2	171	0	0	0	112	I188 L189 P190 Q194 K195 Y317 M371	I188-L192 HydrophobicContact CG2-CD1 3.73Å; I188-L192 HydrophobicContact CG2-CG 4.13Å; I188-L192 VanDerWaalsContact O-CG 3.25Å; I188-L192 WeakPolarHBondContact O-CG 3.29Å; I188-L192 PolarHBondContact O-N 3.18Å; L189-L192 PolarHBondContact O-N 3.01Å; P190-L192 PolarHBondContact O-N 2.98Å; L192-Q194 VanDerWaalsContact C-N 3.31Å; L192-Q194 PolarHBondContact O-N 2.9Å; L192-K195 CarbonylContact O-C 3.6Å; L192-K195 VanDerWaalsContact O-C 3.32Å; L192-K195 PolarHBondContact O-N 2.98Å; L192-Y317 HydrophobicContact CD1-CD1 3.71Å; L192-Y317 HydrophobicContact CD1-CD2 4.27Å; L192-Y317 HydrophobicContact CD1-CE1 3.24Å; L192-Y317 HydrophobicContact CD1-CE2 3.88Å; L192-Y317 HydrophobicContact CD1-CG 4.19Å; L192-Y317 HydrophobicContact CD2-CD2 3.69Å; L192-Y317 HydrophobicContact CD2-CE1 4.28Å; L192-Y317 HydrophobicContact CD2-CE2 3.26Å; L192-Y317 HydrophobicContact CD2-CG 4.36Å; L192-Y317 HydrophobicContact CG-CE1 4.38Å; L192-Y317 HydrophobicContact CG-CE2 4.2Å; L192-M371 HydrophobicContact CD2-CE 3.87Å
193	S	92	Very high	92.1	Very high	93 Å²	93	66.9 Å²	66.9	65%	0.65	34%	0.343	S	S	*	.	H	α-helix	trans	-66.9	-32.1	178.6	-57.1	0	0	0	0	112.4	L189 P190 F191	L189-S193 WeakPolarHBondContact O-CB 3.45Å; L189-S193 PolarHBondContact O-N 3.45Å; L189-S193 PolarHBondContact O-OG 3.37Å; P190-S193 PolarHBondContact O-N 3.48Å; F191-S193 VanDerWaalsContact C-N 3.32Å; F191-S193 PolarHBondContact O-N 2.86Å
194	Q	91.1	Very high	91.9	Very high	148 Å²	148	69.2 Å²	69.2	69%	0.692	36%	0.355	S	S	*	.	H	α-helix	trans	-76.4	-27	177.4	-71.6	173.3	11.9	0	0	113.3	P190 F191 L192	P190-Q194 WeakPolarHBondContact O-CG 3.49Å; P190-Q194 PolarHBondContact O-N 2.98Å; P190-Q194 VanDerWaalsContact O-N 3.09Å; F191-Q194 PolarHBondContact O-N 3.24Å; L192-Q194 VanDerWaalsContact C-N 3.31Å; L192-Q194 PolarHBondContact O-N 2.9Å
195	K	82.5	Confident	91.6	Very high	134 Å²	134	68.6 Å²	68.6	58%	0.583	35%	0.353	S	S	*	.	S	Bend	trans	-132.4	63.1	-176.8	-64.9	-174.5	179.4	-179.5	0	111.1	F191 L192 K197	F191-K195 HydrophobicContact CE2-CD 4.3Å; F191-K195 PolarHBondContact O-N 2.88Å; L192-K195 CarbonylContact O-C 3.6Å; L192-K195 VanDerWaalsContact O-C 3.32Å; L192-K195 PolarHBondContact O-N 2.98Å; K195-K197 PolarHBondContact O-N 3.24Å
196	P	85.8	Confident	91.3	Very high	105 Å²	105	63.1 Å²	63.1	68%	0.682	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-63.6	136.5	178.7	28.2	-34.2	0	0	0	109.8
197	K	86.5	Confident	91.1	Very high	116 Å²	116	62 Å²	62	50%	0.504	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-78.4	151.9	170.4	-72.1	-170.9	178.7	-177.7	0	110.1	K195 L199 T315 F316	K195-K197 PolarHBondContact O-N 3.24Å; K197-L199 PolarHBondContact O-N 3Å; K197-T315 WeakPolarHBondContact CD-O 3.47Å; K197-T315 WeakPolarHBondContact CE-O 3.2Å; K197-T315 PolarHBondContact NZ-O 2.74Å; K197-F316 HydrophobicContact CB-CD1 4.44Å; K197-F316 HydrophobicContact CD-CD1 4.21Å; K197-F316 HydrophobicContact CD-CE1 4.42Å
198	D	89.1	Confident	90.7	Very high	110 Å²	110	62.7 Å²	62.7	59%	0.588	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-67	120.2	169.1	-176.7	13.7	0	0	0	110.3	T200	D198-T200 WeakPolarHBondContact OD1-CB 3.26Å; D198-T200 PolarHBondContact OD1-N 2.81Å; D198-T200 PolarHBondContact OD1-OG1 2.83Å
199	L	92	Very high	90.4	Very high	38 Å²	38	68.2 Å²	68.2	20%	0.199	37%	0.372	C	S	.	.			trans	-106.2	5	178.4	-56.4	-177.5	0	0	0	112.3	K197 W201 I202 D203 F316 R318	K197-L199 PolarHBondContact O-N 3Å; L199-W201 PolarHBondContact O-N 3.07Å; L199-I202 HydrophobicContact CD2-CD1 4.01Å; L199-I202 WeakPolarHBondContact O-CA 3.28Å; L199-I202 WeakPolarHBondContact O-CB 3.49Å; L199-I202 PolarHBondContact O-N 2.79Å; L199-D203 PolarHBondContact O-N 2.78Å; L199-F316 HydrophobicContact CD2-CB 3.9Å; L199-F316 HydrophobicContact CD2-CD1 4Å; L199-F316 HydrophobicContact CD2-CG 4.42Å; L199-R318 HydrophobicContact CD1-CB 4.48Å
200	T	90.8	Very high	89.9	Confident	71 Å²	71	66.9 Å²	66.9	44%	0.436	37%	0.37	S	S	.	.	H	α-helix	trans	-52.6	-37.3	-175.2	-59.1	0	0	0	0	112.4	D198 I202 D203 N204	D198-T200 WeakPolarHBondContact OD1-CB 3.26Å; D198-T200 PolarHBondContact OD1-N 2.81Å; D198-T200 PolarHBondContact OD1-OG1 2.83Å; T200-I202 VanDerWaalsContact C-N 3.31Å; T200-I202 PolarHBondContact O-N 2.87Å; T200-D203 PolarHBondContact O-N 2.93Å; T200-N204 WeakPolarHBondContact O-CB 3.36Å; T200-N204 PolarHBondContact O-N 3.24Å; T200-N204 PolarHBondContact O-ND2 2.94Å
201	W	88.7	Confident	89.4	Confident	96 Å²	96	67.2 Å²	67.2	36%	0.364	37%	0.367	S	S	.	.	H	α-helix	trans	-63.9	-36.6	177.3	76.6	-91.9	0	0	0	112.5	L199 V205 F316	L199-W201 PolarHBondContact O-N 3.07Å; W201-V205 WeakPolarHBondContact O-CG2 3.47Å; W201-V205 PolarHBondContact O-N 3.15Å; W201-F316 AromaticContact CZ2-CD2 3.74Å; W201-F316 HydrophobicContact CZ2-CD2 3.74Å; W201-F316 AromaticContact CZ2-CE2 3.81Å; W201-F316 HydrophobicContact CZ2-CE2 3.81Å; W201-F316 HydrophobicContact CZ2-CG 4.19Å; W201-F316 HydrophobicContact CZ2-CZ 4.33Å; W201-F316 AromaticContact NE1-CD1 3.75Å; W201-F316 AromaticContact NE1-CE1 3.47Å; W201-F316 AromaticContact NE1-CE2 3.97Å; W201-F316 AromaticContact NE1-CZ 3.59Å
202	I	91	Very high	89	Confident	4 Å²	4	72.3 Å²	72.3	2%	0.021	39%	0.391	C	S	.	.	H	α-helix	trans	-71.1	-46.6	177.2	-52.4	-176.4	0	0	0	109.6	L199 T200 N204 V205 V206 I247 F316 R318	L199-I202 HydrophobicContact CD2-CD1 4.01Å; L199-I202 WeakPolarHBondContact O-CA 3.28Å; L199-I202 WeakPolarHBondContact O-CB 3.49Å; L199-I202 PolarHBondContact O-N 2.79Å; T200-I202 VanDerWaalsContact C-N 3.31Å; T200-I202 PolarHBondContact O-N 2.87Å; I202-N204 VanDerWaalsContact C-N 3.26Å; I202-N204 PolarHBondContact O-N 3.33Å; I202-V205 PolarHBondContact O-N 3.14Å; I202-V205 VanDerWaalsContact O-N 3.1Å; I202-V206 HydrophobicContact CG2-CG2 4.45Å; I202-V206 PolarHBondContact O-N 3.13Å; I202-I247 HydrophobicContact CG2-CD1 4.21Å; I202-I247 HydrophobicContact CG2-CG2 3.52Å; I202-F316 HydrophobicContact CD1-CB 3.82Å; I202-F316 HydrophobicContact CD1-CG 4.27Å; I202-R318 HydrophobicContact CD1-CB 3.79Å; I202-R318 HydrophobicContact CD1-CG 4.41Å; I202-R318 HydrophobicContact CG2-CB 4.44Å; I202-R318 HydrophobicContact CG2-CG 3.94Å
203	D	91.6	Very high	88.8	Confident	52 Å²	52	76.4 Å²	76.4	28%	0.278	41%	0.413	S	S	.	.	H	α-helix	trans	-61	-38.3	179.3	-62.2	-41	0	0	0	111	L199 T200 V205 V206 A207 R318	L199-D203 PolarHBondContact O-N 2.78Å; T200-D203 PolarHBondContact O-N 2.93Å; D203-V205 PolarHBondContact O-N 2.87Å; D203-V206 PolarHBondContact O-N 3.41Å; D203-A207 WeakPolarHBondContact O-CB 3.38Å; D203-A207 PolarHBondContact O-N 3.3Å; D203-R318 IonicContact OD1-CZ 3.87Å; D203-R318 IonicContact OD1-NH1 3.52Å; D203-R318 IonicContact OD1-NH2 3.23Å; D203-R318 PolarHBondContact OD1-NH2 2.88Å
204	N	92.2	Very high	88.7	Confident	55 Å²	55	73.2 Å²	73.2	29%	0.294	39%	0.387	S	S	.	.	H	α-helix	trans	-65	-35.4	174.8	-73.9	-20.8	0	0	0	113.4	T200 I202 G208 I209 A210	T200-N204 WeakPolarHBondContact O-CB 3.36Å; T200-N204 PolarHBondContact O-N 3.24Å; T200-N204 PolarHBondContact O-ND2 2.94Å; I202-N204 VanDerWaalsContact C-N 3.26Å; I202-N204 PolarHBondContact O-N 3.33Å; N204-G208 PolarHBondContact O-N 2.87Å; N204-I209 HydrophobicContact CB-CB 4.3Å; N204-I209 WeakPolarHBondContact O-CA 3.44Å; N204-I209 PolarHBondContact O-N 3.46Å; N204-A210 HydrophobicContact CB-CB 3.92Å; N204-A210 PolarHBondContact O-N 2.84Å
205	V	90.4	Very high	88.9	Confident	4 Å²	4	68.1 Å²	68.1	2%	0.024	37%	0.366	C	S	.	.	H	α-helix	trans	-69.6	-48.1	175.6	169.7	0	0	0	0	110.1	W201 I202 D203 A207 G208 E211 T227 V229 I247	W201-V205 WeakPolarHBondContact O-CG2 3.47Å; W201-V205 PolarHBondContact O-N 3.15Å; I202-V205 PolarHBondContact O-N 3.14Å; I202-V205 VanDerWaalsContact O-N 3.1Å; D203-V205 PolarHBondContact O-N 2.87Å; V205-A207 VanDerWaalsContact C-N 3.35Å; V205-A207 PolarHBondContact O-N 2.7Å; V205-G208 PolarHBondContact O-N 3.39Å; V205-E211 HydrophobicContact CG2-CB 4.37Å; V205-E211 HydrophobicContact CG2-CG 4.44Å; V205-T227 HydrophobicContact CG1-CG2 4.16Å; V205-V229 HydrophobicContact CG1-CB 4.27Å; V205-V229 HydrophobicContact CG1-CG1 4.08Å; V205-V229 HydrophobicContact CG1-CG2 4.33Å; V205-I247 HydrophobicContact CG1-CD1 4.2Å
206	V	90.8	Very high	89.4	Confident	26 Å²	26	63.4 Å²	63.4	16%	0.158	35%	0.347	C	S	.	.	H	α-helix	trans	-62.3	-41.9	179.3	171.1	0	0	0	0	111.6	I202 D203 G208 N218 I247 H249	I202-V206 HydrophobicContact CG2-CG2 4.45Å; I202-V206 PolarHBondContact O-N 3.13Å; D203-V206 PolarHBondContact O-N 3.41Å; V206-G208 PolarHBondContact O-N 3.27Å; V206-N218 PolarHBondContact O-ND2 2.81Å; V206-I247 HydrophobicContact CG2-CB 4.46Å; V206-I247 HydrophobicContact CG2-CG2 3.79Å; V206-H249 HydrophobicContact CG1-CB 4.32Å; V206-H249 VanDerWaalsContact CG1-CD2 3.44Å; V206-H249 WeakPolarHBondContact CG1-CD2 3.17Å
207	A	90.5	Very high	89.9	Confident	67 Å²	67	60.8 Å²	60.8	55%	0.554	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-3.3	175.9	0	0	0	0	0	113.7	D203 V205 I209	D203-A207 WeakPolarHBondContact O-CB 3.38Å; D203-A207 PolarHBondContact O-N 3.3Å; V205-A207 VanDerWaalsContact C-N 3.35Å; V205-A207 PolarHBondContact O-N 2.7Å; A207-I209 VanDerWaalsContact C-N 3.25Å; A207-I209 HydrophobicContact CB-CD1 3.88Å; A207-I209 HydrophobicContact CB-CG1 3.98Å; A207-I209 PolarHBondContact O-N 3.05Å
208	G	87.9	Confident	90.3	Very high	23 Å²	23	58.7 Å²	58.7	24%	0.237	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.5	24.2	-177.7	0	0	0	0	0	113.5	N204 V205 V206 Q212	N204-G208 PolarHBondContact O-N 2.87Å; V205-G208 PolarHBondContact O-N 3.39Å; V206-G208 PolarHBondContact O-N 3.27Å; G208-Q212 VanDerWaalsContact O-CG 3.3Å; G208-Q212 WeakPolarHBondContact O-CG 3.42Å; G208-Q212 PolarHBondContact O-NE2 2.95Å
209	I	89.1	Confident	90.5	Very high	117 Å²	117	54.7 Å²	54.7	60%	0.6	30%	0.298	S	S	*	.	S	Bend	trans	-83.7	-35.7	176.8	-61.4	170.3	0	0	0	110.4	N204 A207	N204-I209 HydrophobicContact CB-CB 4.3Å; N204-I209 WeakPolarHBondContact O-CA 3.44Å; N204-I209 PolarHBondContact O-N 3.46Å; A207-I209 VanDerWaalsContact C-N 3.25Å; A207-I209 HydrophobicContact CB-CD1 3.88Å; A207-I209 HydrophobicContact CB-CG1 3.98Å; A207-I209 PolarHBondContact O-N 3.05Å
210	A	84.3	Confident	90.5	Very high	35 Å²	35	57.9 Å²	57.9	29%	0.289	33%	0.33	S	S	.	.	S	Bend	trans	-121.2	157.4	-177.8	0	0	0	0	0	112	N204 Q212	N204-A210 HydrophobicContact CB-CB 3.92Å; N204-A210 PolarHBondContact O-N 2.84Å; A210-Q212 PolarHBondContact O-N 3.47Å; A210-Q212 VanDerWaalsContact O-N 3.1Å
211	E	84.6	Confident	90.6	Very high	60 Å²	60	58.3 Å²	58.3	28%	0.28	33%	0.33	S	S	.	.			trans	53	29.8	175.5	-56.7	-149.2	-137.8	0	0	115.5	V205 D213 R214 T215 V229	V205-E211 HydrophobicContact CG2-CB 4.37Å; V205-E211 HydrophobicContact CG2-CG 4.44Å; E211-D213 PolarHBondContact O-N 2.98Å; E211-R214 HydrophobicContact CB-CB 4.39Å; E211-R214 CarbonylContact O-C 3.58Å; E211-R214 PolarHBondContact O-N 3.47Å; E211-R214 WeakPolarHBondContact OE2-CD 3.12Å; E211-R214 IonicContact OE2-CZ 3.81Å; E211-R214 IonicContact OE2-NH1 2.92Å; E211-R214 PolarHBondContact OE2-NH1 2.86Å; E211-T215 PolarHBondContact O-N 2.9Å; E211-T215 PolarHBondContact O-OG1 3.2Å; E211-V229 HydrophobicContact CB-CG2 4.17Å
212	Q	85.2	Confident	90.8	Very high	136 Å²	136	61.8 Å²	61.8	64%	0.636	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-56.1	-38.6	178.3	-65.5	-178.8	5.9	0	0	112.3	G208 A210 R214 T215	G208-Q212 VanDerWaalsContact O-CG 3.3Å; G208-Q212 WeakPolarHBondContact O-CG 3.42Å; G208-Q212 PolarHBondContact O-NE2 2.95Å; A210-Q212 PolarHBondContact O-N 3.47Å; A210-Q212 VanDerWaalsContact O-N 3.1Å; Q212-R214 PolarHBondContact O-N 3.13Å; Q212-T215 PolarHBondContact O-N 3.48Å
213	D	89	Confident	91	Very high	115 Å²	115	67 Å²	67	62%	0.615	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-68.4	-16	178.9	58.8	-53.1	0	0	0	113.7	E211	E211-D213 PolarHBondContact O-N 2.98Å
214	R	90.1	Very high	91.2	Very high	26 Å²	26	67.6 Å²	67.6	10%	0.098	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-111.2	-7.8	-177.1	-52.2	-171.7	74.7	-121.4	-1	112.3	E211 Q212 V229 L230 D231 W234	E211-R214 HydrophobicContact CB-CB 4.39Å; E211-R214 CarbonylContact O-C 3.58Å; E211-R214 PolarHBondContact O-N 3.47Å; E211-R214 WeakPolarHBondContact OE2-CD 3.12Å; E211-R214 IonicContact OE2-CZ 3.81Å; E211-R214 IonicContact OE2-NH1 2.92Å; E211-R214 PolarHBondContact OE2-NH1 2.86Å; Q212-R214 PolarHBondContact O-N 3.13Å; R214-V229 HydrophobicContact CB-CG2 4.25Å; R214-L230 HydrophobicContact CB-CB 4.32Å; R214-L230 VanDerWaalsContact CZ-O 3.29Å; R214-L230 PolarHBondContact NH1-O 2.85Å; R214-L230 PolarHBondContact O-N 3.03Å; R214-D231 PolarHBondContact NH1-O 3.14Å; R214-D231 VanDerWaalsContact NH2-C 3.31Å; R214-D231 PolarHBondContact NH2-O 3.27Å; R214-W234 PolarHBondContact NH2-O 2.93Å
215	T	93.8	Very high	91.5	Very high	40 Å²	40	65 Å²	65	25%	0.245	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	126.3	175.1	-61	0	0	0	0	109.7	E211 Q212 H217 N218 T227 L228	E211-T215 PolarHBondContact O-N 2.9Å; E211-T215 PolarHBondContact O-OG1 3.2Å; Q212-T215 PolarHBondContact O-N 3.48Å; T215-H217 WeakPolarHBondContact CG2-O 3.27Å; T215-N218 HydrophobicContact CG2-CB 4.3Å; T215-T227 HydrophobicContact CG2-CG2 3.79Å; T215-L228 CarbonylContact C-O 3.48Å
216	L	94.3	Very high	91.8	Very high	36 Å²	36	64.8 Å²	64.8	19%	0.188	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	-28.7	-179.6	-58.2	-178.9	0	0	0	112.3	L228 L230 T277 L278 K281	L216-L228 HydrophobicContact CB-CB 4.11Å; L216-L228 PolarHBondContact N-O 3.4Å; L216-L230 HydrophobicContact CD1-CD2 3.83Å; L216-L230 HydrophobicContact CD1-CG 4.1Å; L216-L230 HydrophobicContact CD2-CD1 4.23Å; L216-L230 HydrophobicContact CD2-CG 4.13Å; L216-L230 HydrophobicContact CG-CD2 4.45Å; L216-L230 HydrophobicContact CG-CG 4.17Å; L216-T277 HydrophobicContact CB-CG2 3.83Å; L216-T277 HydrophobicContact CD1-CG2 4.28Å; L216-L278 HydrophobicContact CD1-CD2 3.8Å; L216-L278 HydrophobicContact CD1-CG 4.49Å; L216-K281 HydrophobicContact CD2-CD 3.85Å
217	H	95.4	Very high	92.2	Very high	49 Å²	49	63.5 Å²	63.5	23%	0.227	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	145.8	179.3	179.6	71.8	0	0	0	109.4	T215 D219 F226 T227 L228 L273	T215-H217 WeakPolarHBondContact CG2-O 3.27Å; H217-D219 IonicContact CD2-OD1 3.96Å; H217-D219 IonicContact CE1-OD1 2.59Å; H217-D219 PolarHBondContact CE1-OD1 3.47Å; H217-D219 VanDerWaalsContact NE2-CG 3.28Å; H217-D219 IonicContact NE2-OD1 3.5Å; H217-D219 PolarHBondContact NE2-OD1 3.45Å; H217-D219 IonicContact NE2-OD2 2.62Å; H217-F226 AromaticContact CD2-CE2 3.82Å; H217-T227 CarbonylContact O-C 3.59Å; H217-T227 WeakPolarHBondContact O-CA 3.44Å; H217-T227 WeakPolarHBondContact O-CG2 3.48Å; H217-L228 HydrophobicContact CB-CB 3.97Å; H217-L228 HydrophobicContact CB-CD1 3.88Å; H217-L228 HydrophobicContact CB-CG 4.13Å; H217-L228 PolarHBondContact N-O 3.46Å; H217-L228 PolarHBondContact O-N 3.17Å; H217-L273 HydrophobicContact CB-CD2 4.14Å; H217-L273 VanDerWaalsContact CD2-CD2 3.48Å; H217-L273 WeakPolarHBondContact CD2-CD2 3.39Å; H217-L273 VanDerWaalsContact CG-CD2 3.44Å
218	N	94.8	Very high	92.5	Very high	72 Å²	72	60.4 Å²	60.4	39%	0.385	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	121.9	169.8	-161.5	26.2	0	0	0	109.6	V206 T215 T227 H249	V206-N218 PolarHBondContact O-ND2 2.81Å; T215-N218 HydrophobicContact CG2-CB 4.3Å; N218-T227 HydrophobicContact CB-CG2 4.33Å; N218-T227 WeakPolarHBondContact OD1-CB 3.48Å; N218-T227 PolarHBondContact OD1-OG1 3.36Å; N218-H249 PolarHBondContact OD1-CE1 2.67Å; N218-H249 PolarHBondContact OD1-NE2 3.28Å; N218-H249 VanDerWaalsContact OD1-NE2 3.15Å
219	D	93.8	Very high	92.9	Very high	26 Å²	26	59.5 Å²	59.5	14%	0.139	32%	0.317	C	S	.	.			trans	-76.5	162.2	175	-80.1	-35.4	0	0	0	112	H217 G225 F226 H249 R269	H217-D219 IonicContact CD2-OD1 3.96Å; H217-D219 IonicContact CE1-OD1 2.59Å; H217-D219 PolarHBondContact CE1-OD1 3.47Å; H217-D219 VanDerWaalsContact NE2-CG 3.28Å; H217-D219 IonicContact NE2-OD1 3.5Å; H217-D219 PolarHBondContact NE2-OD1 3.45Å; H217-D219 IonicContact NE2-OD2 2.62Å; D219-G225 VanDerWaalsContact CB-CA 3.49Å; D219-G225 WeakPolarHBondContact OD2-CA 3.43Å; D219-F226 PolarHBondContact N-O 2.68Å; D219-F226 VanDerWaalsContact N-O 3.08Å; D219-F226 WeakPolarHBondContact OD2-CD1 3.17Å; D219-F226 VanDerWaalsContact OD2-CE1 3.27Å; D219-F226 WeakPolarHBondContact OD2-CE1 3.43Å; D219-F226 PolarHBondContact OD2-N 3.15Å; D219-H249 PolarHBondContact O-CE1 3.4Å; D219-R269 VanDerWaalsContact CG-NH2 3.27Å; D219-R269 IonicContact OD1-CZ 3.49Å; D219-R269 IonicContact OD1-NH2 3.82Å; D219-R269 PolarHBondContact OD1-NH2 3.39Å; D219-R269 IonicContact OD2-CZ 3.41Å; D219-R269 IonicContact OD2-NH1 3.9Å; D219-R269 PolarHBondContact OD2-NH1 3.48Å; D219-R269 IonicContact OD2-NH2 3.2Å; D219-R269 PolarHBondContact OD2-NH2 3.22Å
220	A	91.5	Very high	93.1	Very high	105 Å²	105	54.5 Å²	54.5	87%	0.868	29%	0.292	S	S	*	.	S	Bend	trans	-92.5	-16.9	169.8	0	0	0	0	0	113
221	D	94.3	Very high	93.3	Very high	81 Å²	81	53.5 Å²	53.5	43%	0.433	28%	0.282	S	S	.	.			trans	-73.9	130.6	-175.2	-169.4	-63.4	0	0	0	110.9	M223 F224 G225 H249	D221-M223 WeakPolarHBondContact OD1-CA 3.48Å; D221-M223 PolarHBondContact OD1-N 3.14Å; D221-F224 PolarHBondContact OD1-N 3.1Å; D221-G225 WeakPolarHBondContact O-CA 3.5Å; D221-G225 PolarHBondContact O-N 2.72Å; D221-H249 PolarHBondContact O-ND1 2.82Å
222	E	93.2	Very high	92.9	Very high	169 Å²	169	56.1 Å²	56.1	79%	0.79	29%	0.29	S	S	*	.	S	Bend	trans	-80.9	-25.7	-177.7	-65.1	-177.3	176	0	0	113.3	H249 D250	E222-H249 CarbonylContact O-C 3.48Å; E222-D250 WeakPolarHBondContact O-CA 3.46Å; E222-D250 PolarHBondContact O-N 2.84Å
223	M	94.2	Very high	92.3	Very high	112 Å²	112	57.4 Å²	57.4	55%	0.552	29%	0.289	S	S	*	.	S	Bend	trans	-100.5	-41.5	-171.6	-173.6	173.4	-72.6	0	0	112.5	D221	D221-M223 WeakPolarHBondContact OD1-CA 3.48Å; D221-M223 PolarHBondContact OD1-N 3.14Å
224	F	96.9	Very high	91.9	Very high	65 Å²	65	52 Å²	52	29%	0.285	26%	0.26	S	S	.	.	S	Bend	trans	-123.1	11.2	-178	-62.1	-72.5	0	0	0	112.8	D221 C262 M266	D221-F224 PolarHBondContact OD1-N 3.1Å; F224-C262 VanDerWaalsContact CE1-O 3.32Å; F224-C262 WeakPolarHBondContact CE1-O 3.32Å; F224-M266 HydrophobicContact CB-CB 4.32Å; F224-M266 HydrophobicContact CB-SD 4.49Å; F224-M266 HydrophobicContact CD1-CB 4.25Å; F224-M266 VanDerWaalsContact O-CG 3.29Å; F224-M266 WeakPolarHBondContact O-CG 3.29Å
225	G	97.1	Very high	91.2	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.271	C	S	.	.			trans	-84.2	158.7	171.3	0	0	0	0	0	112.9	D219 D221 H249	D219-G225 VanDerWaalsContact CB-CA 3.49Å; D219-G225 WeakPolarHBondContact OD2-CA 3.43Å; D221-G225 WeakPolarHBondContact O-CA 3.5Å; D221-G225 PolarHBondContact O-N 2.72Å; G225-H249 PolarHBondContact O-N 3.06Å
226	F	97.9	Very high	90.5	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	157.4	176.3	62.5	-84.8	0	0	0	112.5	H217 D219 L228 I247 H249 M266 R269 I270 L273	H217-F226 AromaticContact CD2-CE2 3.82Å; D219-F226 PolarHBondContact N-O 2.68Å; D219-F226 VanDerWaalsContact N-O 3.08Å; D219-F226 WeakPolarHBondContact OD2-CD1 3.17Å; D219-F226 VanDerWaalsContact OD2-CE1 3.27Å; D219-F226 WeakPolarHBondContact OD2-CE1 3.43Å; D219-F226 PolarHBondContact OD2-N 3.15Å; F226-L228 HydrophobicContact CD2-CD2 4.21Å; F226-L228 HydrophobicContact CD2-CG 3.97Å; F226-L228 HydrophobicContact CE2-CD1 3.98Å; F226-L228 HydrophobicContact CE2-CD2 4.08Å; F226-L228 HydrophobicContact CE2-CG 3.71Å; F226-I247 CarbonylContact C-O 3.6Å; F226-I247 WeakPolarHBondContact CA-O 3.27Å; F226-I247 VanDerWaalsContact CB-O 3.27Å; F226-I247 WeakPolarHBondContact CB-O 3.48Å; F226-H249 WeakPolarHBondContact CA-NE2 3.39Å; F226-M266 HydrophobicContact CD1-CG 4.28Å; F226-R269 HydrophobicContact CE1-CB 3.9Å; F226-R269 HydrophobicContact CZ-CB 4.25Å; F226-I270 HydrophobicContact CB-CD1 4.13Å; F226-I270 HydrophobicContact CB-CG1 4.05Å; F226-I270 HydrophobicContact CD1-CD1 4.17Å; F226-I270 HydrophobicContact CD1-CG1 3.46Å; F226-I270 VanDerWaalsContact CD1-CG1 3.46Å; F226-I270 HydrophobicContact CD2-CG1 3.62Å; F226-I270 HydrophobicContact CE1-CG1 3.7Å; F226-I270 HydrophobicContact CE2-CB 4.36Å; F226-I270 HydrophobicContact CE2-CG1 3.83Å; F226-I270 HydrophobicContact CG-CD1 4.05Å; F226-I270 HydrophobicContact CG-CG1 3.42Å; F226-I270 VanDerWaalsContact CG-CG1 3.42Å; F226-I270 HydrophobicContact CZ-CB 4.41Å; F226-I270 HydrophobicContact CZ-CG1 3.87Å; F226-L273 HydrophobicContact CE2-CD2 4.08Å; F226-L273 HydrophobicContact CZ-CB 4.31Å; F226-L273 HydrophobicContact CZ-CD2 3.79Å
227	T	97.5	Very high	89.5	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	128.6	171.2	-44.1	0	0	0	0	109.5	V205 T215 H217 N218 G246 I247 H249	V205-T227 HydrophobicContact CG1-CG2 4.16Å; T215-T227 HydrophobicContact CG2-CG2 3.79Å; H217-T227 CarbonylContact O-C 3.59Å; H217-T227 WeakPolarHBondContact O-CA 3.44Å; H217-T227 WeakPolarHBondContact O-CG2 3.48Å; N218-T227 HydrophobicContact CB-CG2 4.33Å; N218-T227 WeakPolarHBondContact OD1-CB 3.48Å; N218-T227 PolarHBondContact OD1-OG1 3.36Å; T227-G246 CarbonylContact O-C 3.36Å; T227-G246 WeakPolarHBondContact O-CA 3.4Å; T227-I247 PolarHBondContact N-O 2.95Å; T227-I247 PolarHBondContact O-N 3.19Å; T227-H249 PolarHBondContact N-NE2 3.41Å; T227-H249 PolarHBondContact OG1-NE2 3.08Å
228	L	97.4	Very high	88.8	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.005	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	124.9	165.4	-66.2	171.1	0	0	0	109.1	T215 L216 H217 F226 L245 L273 F323	T215-L228 CarbonylContact C-O 3.48Å; L216-L228 HydrophobicContact CB-CB 4.11Å; L216-L228 PolarHBondContact N-O 3.4Å; H217-L228 HydrophobicContact CB-CB 3.97Å; H217-L228 HydrophobicContact CB-CD1 3.88Å; H217-L228 HydrophobicContact CB-CG 4.13Å; H217-L228 PolarHBondContact N-O 3.46Å; H217-L228 PolarHBondContact O-N 3.17Å; F226-L228 HydrophobicContact CD2-CD2 4.21Å; F226-L228 HydrophobicContact CD2-CG 3.97Å; F226-L228 HydrophobicContact CE2-CD1 3.98Å; F226-L228 HydrophobicContact CE2-CD2 4.08Å; F226-L228 HydrophobicContact CE2-CG 3.71Å; L228-L245 CarbonylContact C-O 3.6Å; L228-L245 VanDerWaalsContact CA-O 3.3Å; L228-L245 WeakPolarHBondContact CA-O 3.38Å; L228-L273 HydrophobicContact CD1-CB 4.34Å; L228-L273 HydrophobicContact CD1-CD2 4.26Å; L228-L273 HydrophobicContact CD1-CG 3.97Å; L228-F323 HydrophobicContact CD2-CE2 4.02Å
229	V	95.8	Very high	88.4	Confident	5 Å²	5	54.5 Å²	54.5	3%	0.03	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	137.5	-177.1	65.3	0	0	0	0	110.6	V205 E211 R214 C244 L245 I247	V205-V229 HydrophobicContact CG1-CB 4.27Å; V205-V229 HydrophobicContact CG1-CG1 4.08Å; V205-V229 HydrophobicContact CG1-CG2 4.33Å; E211-V229 HydrophobicContact CB-CG2 4.17Å; R214-V229 HydrophobicContact CB-CG2 4.25Å; V229-C244 WeakPolarHBondContact O-CA 3.36Å; V229-C244 PolarHBondContact O-SG 2.95Å; V229-C244 VanDerWaalsContact O-SG 3.36Å; V229-L245 HydrophobicContact CG1-CB 4.03Å; V229-L245 PolarHBondContact N-O 2.82Å; V229-L245 PolarHBondContact O-N 3.4Å; V229-I247 HydrophobicContact CG1-CD1 4.08Å
230	L	93.7	Very high	88.1	Confident	11 Å²	11	56.4 Å²	56.4	6%	0.058	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	132.8	172.7	-64.4	175.5	0	0	0	109.7	R214 L216 W234 C244 L278 Y282	R214-L230 HydrophobicContact CB-CB 4.32Å; R214-L230 VanDerWaalsContact CZ-O 3.29Å; R214-L230 PolarHBondContact NH1-O 2.85Å; R214-L230 PolarHBondContact O-N 3.03Å; L216-L230 HydrophobicContact CD1-CD2 3.83Å; L216-L230 HydrophobicContact CD1-CG 4.1Å; L216-L230 HydrophobicContact CD2-CD1 4.23Å; L216-L230 HydrophobicContact CD2-CG 4.13Å; L216-L230 HydrophobicContact CG-CD2 4.45Å; L216-L230 HydrophobicContact CG-CG 4.17Å; L230-W234 HydrophobicContact CD2-CE3 4Å; L230-W234 HydrophobicContact CD2-CZ3 3.76Å; L230-C244 HydrophobicContact CD2-CB 4.15Å; L230-L278 HydrophobicContact CD2-CD2 4.04Å; L230-Y282 WeakPolarHBondContact CD1-OH 3.43Å
231	D	87.8	Confident	87.8	Confident	15 Å²	15	55 Å²	55	8%	0.08	26%	0.258	C	S	.	.			trans	-77.4	141.9	179.5	-172.7	-55.5	0	0	0	110.3	R214 R233 W234 H243 L245	R214-D231 PolarHBondContact NH1-O 3.14Å; R214-D231 VanDerWaalsContact NH2-C 3.31Å; R214-D231 PolarHBondContact NH2-O 3.27Å; D231-R233 PolarHBondContact O-N 3.3Å; D231-R233 WeakPolarHBondContact OD1-CB 3.45Å; D231-R233 WeakPolarHBondContact OD1-CG 3.46Å; D231-R233 PolarHBondContact OD1-N 2.9Å; D231-R233 IonicContact OD1-NE 2.8Å; D231-W234 PolarHBondContact O-N 2.87Å; D231-W234 VanDerWaalsContact O-N 3.15Å; D231-H243 HydrophobicContact CB-CB 4.08Å; D231-H243 WeakPolarHBondContact CB-ND1 3.28Å; D231-H243 PolarHBondContact N-O 3.41Å; D231-H243 IonicContact OD2-CE1 3.44Å; D231-H243 PolarHBondContact OD2-CE1 3.27Å; D231-H243 IonicContact OD2-ND1 3.98Å; D231-H243 PolarHBondContact OD2-ND1 3.24Å; D231-H243 VanDerWaalsContact OD2-ND1 3.15Å; D231-L245 HydrophobicContact CB-CG 4.43Å
232	Y	77.6	Confident	87.6	Confident	115 Å²	115	51.2 Å²	51.2	45%	0.451	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-21.3	-177.5	74.6	-95	0	0	0	113.7	W234	Y232-W234 PolarHBondContact O-N 2.94Å
233	R	72.5	Confident	87.6	Confident	162 Å²	162	43.8 Å²	43.8	61%	0.611	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-20.5	179.3	-67.7	172.6	-164.3	-163	5.5	113.5	D231	D231-R233 PolarHBondContact O-N 3.3Å; D231-R233 WeakPolarHBondContact OD1-CB 3.45Å; D231-R233 WeakPolarHBondContact OD1-CG 3.46Å; D231-R233 PolarHBondContact OD1-N 2.9Å; D231-R233 IonicContact OD1-NE 2.8Å
234	W	81	Confident	87.6	Confident	2 Å²	2	38.5 Å²	38.5	1%	0.008	18%	0.177	C	C	.	.			trans	-102.8	129.9	178.5	-176.9	42.5	0	0	0	110.6	R21 R214 L230 D231 Y232 G236 R238 I239 E241 L242 H243 Y282	R21-W234 PolarHBondContact NH2-O 3.31Å; R214-W234 PolarHBondContact NH2-O 2.93Å; L230-W234 HydrophobicContact CD2-CE3 4Å; L230-W234 HydrophobicContact CD2-CZ3 3.76Å; D231-W234 PolarHBondContact O-N 2.87Å; D231-W234 VanDerWaalsContact O-N 3.15Å; Y232-W234 PolarHBondContact O-N 2.94Å; W234-G236 VanDerWaalsContact CE2-CA 3.44Å; W234-R238 PolarHBondContact NE1-O 3.07Å; W234-I239 HydrophobicContact CH2-CD1 3.97Å; W234-I239 HydrophobicContact CZ2-CD1 3.87Å; W234-E241 WeakPolarHBondContact CB-O 3.4Å; W234-E241 VanDerWaalsContact CG-O 3.27Å; W234-L242 HydrophobicContact CD2-CB 4.46Å; W234-L242 HydrophobicContact CD2-CD1 4.41Å; W234-L242 HydrophobicContact CE3-CD1 3.67Å; W234-L242 HydrophobicContact CH2-CB 4.19Å; W234-L242 HydrophobicContact CH2-CD1 3.54Å; W234-L242 HydrophobicContact CH2-CG 4.43Å; W234-L242 HydrophobicContact CZ2-CB 4.13Å; W234-L242 HydrophobicContact CZ2-CD1 4.3Å; W234-L242 HydrophobicContact CZ3-CB 4.41Å; W234-L242 HydrophobicContact CZ3-CD1 3.17Å; W234-L242 HydrophobicContact CZ3-CG 4.36Å; W234-H243 HydrophobicContact CB-CB 4.28Å; W234-Y282 HydrophobicContact CH2-CD1 4.16Å; W234-Y282 AromaticContact CH2-CD2 3.9Å; W234-Y282 HydrophobicContact CH2-CD2 3.9Å; W234-Y282 AromaticContact CH2-CE1 3.7Å; W234-Y282 HydrophobicContact CH2-CE1 3.7Å; W234-Y282 AromaticContact CH2-CE2 3.4Å; W234-Y282 HydrophobicContact CH2-CE2 3.4Å; W234-Y282 HydrophobicContact CH2-CG 4.26Å; W234-Y282 AromaticContact CH2-CZ 3.28Å; W234-Y282 HydrophobicContact CZ3-CD2 4.41Å; W234-Y282 HydrophobicContact CZ3-CE1 4.31Å; W234-Y282 AromaticContact CZ3-CE2 3.54Å; W234-Y282 HydrophobicContact CZ3-CE2 3.54Å; W234-Y282 AromaticContact CZ3-CZ 3.48Å; W234-Y282 VanDerWaalsContact CZ3-CZ 3.48Å; W234-Y282 VanDerWaalsContact CZ3-OH 3.32Å; W234-Y282 WeakPolarHBondContact CZ3-OH 3.11Å
235	D	75.6	Confident	87.6	Confident	61 Å²	61	35.8 Å²	35.8	33%	0.326	17%	0.165	S	C	.	.			trans	-84.2	-13.5	178.6	64.3	5.5	0	0	0	113.5	R21 L237	R21-D235 PolarHBondContact NH1-O 3.16Å; R21-D235 PolarHBondContact NH2-O 3.15Å; D235-L237 VanDerWaalsContact C-N 3.3Å; D235-L237 HydrophobicContact CB-CG 4.36Å; D235-L237 WeakPolarHBondContact OD1-CB 3.13Å; D235-L237 PolarHBondContact OD1-N 2.81Å; D235-L237 WeakPolarHBondContact OD2-CD1 3.42Å
236	G	77.7	Confident	87.6	Confident	23 Å²	23	35.8 Å²	35.8	24%	0.237	17%	0.165	C	C	.	.	S	Bend	trans	83.6	1.6	-176.7	0	0	0	0	0	114.3	W234	W234-G236 VanDerWaalsContact CE2-CA 3.44Å
237	L	74.4	Confident	87.6	Confident	102 Å²	102	35.9 Å²	35.9	53%	0.534	17%	0.166	S	C	.	.	S	Bend	trans	-85.2	-55	-179.2	-59.7	-178.6	0	0	0	110.7	D235	D235-L237 VanDerWaalsContact C-N 3.3Å; D235-L237 HydrophobicContact CB-CG 4.36Å; D235-L237 WeakPolarHBondContact OD1-CB 3.13Å; D235-L237 PolarHBondContact OD1-N 2.81Å; D235-L237 WeakPolarHBondContact OD2-CD1 3.42Å
238	R	79.8	Confident	87.6	Confident	79 Å²	79	35.9 Å²	35.9	30%	0.298	17%	0.166	S	C	.	.			trans	-98.8	115.4	-177.8	-71.8	176.3	173.4	172	-0.8	111.1	S80 W234 Q240 E241	S80-R238 PolarHBondContact O-NH2 2.92Å; W234-R238 PolarHBondContact NE1-O 3.07Å; R238-Q240 PolarHBondContact O-N 2.84Å; R238-E241 HydrophobicContact CB-CB 4.33Å; R238-E241 HydrophobicContact CB-CG 4.07Å; R238-E241 VanDerWaalsContact CD-OE1 3.23Å; R238-E241 WeakPolarHBondContact CD-OE1 3.47Å; R238-E241 IonicContact NH1-OE1 2.83Å; R238-E241 PolarHBondContact NH1-OE1 2.81Å; R238-E241 WeakPolarHBondContact O-CB 3.49Å; R238-E241 PolarHBondContact O-N 3.47Å
239	I	87.2	Confident	87.6	Confident	10 Å²	10	36.9 Å²	36.9	5%	0.051	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-64.4	-27.5	-176.9	-162.3	60.3	0	0	0	113.2	W234 E241 L242 Y282 I299 L301 H325	W234-I239 HydrophobicContact CH2-CD1 3.97Å; W234-I239 HydrophobicContact CZ2-CD1 3.87Å; I239-E241 PolarHBondContact O-N 3.5Å; I239-L242 HydrophobicContact CD1-CB 4.42Å; I239-L242 WeakPolarHBondContact O-CB 3.28Å; I239-L242 PolarHBondContact O-N 3.14Å; I239-Y282 HydrophobicContact CD1-CD2 4.39Å; I239-Y282 HydrophobicContact CD1-CG 4.03Å; I239-I299 HydrophobicContact CB-CG2 3.75Å; I239-I299 HydrophobicContact CD1-CG2 3.95Å; I239-I299 HydrophobicContact CG1-CG2 3.85Å; I239-I299 HydrophobicContact CG2-CG2 4.31Å; I239-L301 HydrophobicContact CD1-CB 4.22Å; I239-L301 HydrophobicContact CD1-CD1 4.34Å; I239-L301 HydrophobicContact CD1-CD2 4.16Å; I239-L301 HydrophobicContact CD1-CG 4.48Å; I239-L301 HydrophobicContact CG1-CB 4.07Å; I239-L301 HydrophobicContact CG1-CD1 3.93Å; I239-L301 HydrophobicContact CG1-CG 4.42Å; I239-H325 WeakPolarHBondContact O-CB 3.32Å
240	Q	86.4	Confident	87.6	Confident	67 Å²	67	38.3 Å²	38.3	31%	0.313	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	-66.4	-18.8	175	-64.2	76.3	14.9	0	0	112.5	R238 D327 S328	R238-Q240 PolarHBondContact O-N 2.84Å; Q240-D327 HydrophobicContact CG-CB 4.35Å; Q240-S328 VanDerWaalsContact O-CA 3.23Å; Q240-S328 WeakPolarHBondContact O-CA 3.49Å; Q240-S328 VanDerWaalsContact O-CB 3.27Å; Q240-S328 WeakPolarHBondContact O-CB 3.42Å
241	E	84.9	Confident	87.6	Confident	75 Å²	75	44.1 Å²	44.1	35%	0.35	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-94.7	5.4	175.7	-62.6	174.2	-166.1	0	0	112.3	W234 R238 I239 H243	W234-E241 WeakPolarHBondContact CB-O 3.4Å; W234-E241 VanDerWaalsContact CG-O 3.27Å; R238-E241 HydrophobicContact CB-CB 4.33Å; R238-E241 HydrophobicContact CB-CG 4.07Å; R238-E241 VanDerWaalsContact CD-OE1 3.23Å; R238-E241 WeakPolarHBondContact CD-OE1 3.47Å; R238-E241 IonicContact NH1-OE1 2.83Å; R238-E241 PolarHBondContact NH1-OE1 2.81Å; R238-E241 WeakPolarHBondContact O-CB 3.49Å; R238-E241 PolarHBondContact O-N 3.47Å; I239-E241 PolarHBondContact O-N 3.5Å; E241-H243 PolarHBondContact O-N 2.78Å
242	L	90.6	Very high	87.9	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.01	24%	0.237	C	C	.	.			trans	-45.1	124.1	176	166.5	63.8	0	0	0	110.9	W234 I239 L278 L301 I306 V324 H325	W234-L242 HydrophobicContact CD2-CB 4.46Å; W234-L242 HydrophobicContact CD2-CD1 4.41Å; W234-L242 HydrophobicContact CE3-CD1 3.67Å; W234-L242 HydrophobicContact CH2-CB 4.19Å; W234-L242 HydrophobicContact CH2-CD1 3.54Å; W234-L242 HydrophobicContact CH2-CG 4.43Å; W234-L242 HydrophobicContact CZ2-CB 4.13Å; W234-L242 HydrophobicContact CZ2-CD1 4.3Å; W234-L242 HydrophobicContact CZ3-CB 4.41Å; W234-L242 HydrophobicContact CZ3-CD1 3.17Å; W234-L242 HydrophobicContact CZ3-CG 4.36Å; I239-L242 HydrophobicContact CD1-CB 4.42Å; I239-L242 WeakPolarHBondContact O-CB 3.28Å; I239-L242 PolarHBondContact O-N 3.14Å; L242-L278 HydrophobicContact CD1-CD1 4.34Å; L242-L278 HydrophobicContact CD1-CD2 3.76Å; L242-L278 HydrophobicContact CD2-CD1 4.35Å; L242-L301 HydrophobicContact CD2-CD1 4.3Å; L242-L301 HydrophobicContact CD2-CD2 3.95Å; L242-I306 HydrophobicContact CD2-CG1 4.47Å; L242-V324 VanDerWaalsContact O-CA 3.31Å; L242-V324 WeakPolarHBondContact O-CA 3.23Å; L242-H325 HydrophobicContact CB-CB 4.27Å
243	H	92.8	Very high	88.8	Confident	13 Å²	13	46.3 Å²	46.3	6%	0.06	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	124.8	171.8	-162.6	-87	0	0	0	110.5	D231 W234 E241 H322 F323	D231-H243 HydrophobicContact CB-CB 4.08Å; D231-H243 WeakPolarHBondContact CB-ND1 3.28Å; D231-H243 PolarHBondContact N-O 3.41Å; D231-H243 IonicContact OD2-CE1 3.44Å; D231-H243 PolarHBondContact OD2-CE1 3.27Å; D231-H243 IonicContact OD2-ND1 3.98Å; D231-H243 PolarHBondContact OD2-ND1 3.24Å; D231-H243 VanDerWaalsContact OD2-ND1 3.15Å; W234-H243 HydrophobicContact CB-CB 4.28Å; E241-H243 PolarHBondContact O-N 2.78Å; H243-H322 AromaticContact CE1-ND1 3.54Å; H243-H322 AromaticContact NE2-ND1 3.47Å; H243-H322 PolarHBondContact NE2-ND1 3.04Å; H243-F323 WeakPolarHBondContact CA-O 3.27Å
244	C	95	Very high	90	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	148.7	-179.1	172.9	0	0	0	0	109.1	V229 L230 L278 F323	V229-C244 WeakPolarHBondContact O-CA 3.36Å; V229-C244 PolarHBondContact O-SG 2.95Å; V229-C244 VanDerWaalsContact O-SG 3.36Å; L230-C244 HydrophobicContact CD2-CB 4.15Å; C244-L278 HydrophobicContact CB-CD1 4.12Å; C244-L278 HydrophobicContact CB-CD2 4.16Å; C244-F323 HydrophobicContact CB-CB 4.05Å; C244-F323 PolarHBondContact N-O 3.27Å; C244-F323 PolarHBondContact O-N 3.13Å
245	L	96.5	Very high	90.8	Very high	9 Å²	9	40.2 Å²	40.2	5%	0.047	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	138	-179.7	-60.5	177.2	0	0	0	110.2	L228 V229 D231 I247 V321 H322	L228-L245 CarbonylContact C-O 3.6Å; L228-L245 VanDerWaalsContact CA-O 3.3Å; L228-L245 WeakPolarHBondContact CA-O 3.38Å; V229-L245 HydrophobicContact CG1-CB 4.03Å; V229-L245 PolarHBondContact N-O 2.82Å; V229-L245 PolarHBondContact O-N 3.4Å; D231-L245 HydrophobicContact CB-CG 4.43Å; L245-I247 HydrophobicContact CB-CG1 4.15Å; L245-V321 CarbonylContact C-O 3.59Å; L245-V321 VanDerWaalsContact CA-O 3.3Å; L245-V321 WeakPolarHBondContact CA-O 3.39Å; L245-H322 WeakPolarHBondContact CD2-ND1 3.35Å
246	G	97.7	Very high	91.8	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	107.9	162.5	0	0	0	0	0	110	T227 H320 V321	T227-G246 CarbonylContact O-C 3.36Å; T227-G246 WeakPolarHBondContact O-CA 3.4Å; G246-H320 CarbonylContact O-C 3.28Å; G246-H320 WeakPolarHBondContact O-CA 3.3Å; G246-V321 PolarHBondContact N-O 3.02Å; G246-V321 PolarHBondContact O-N 3.06Å
247	I	97.6	Very high	92.8	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.01	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	122	-172.6	-55.3	177.7	0	0	0	109	I202 V205 V206 F226 T227 V229 L245 R318 H320	I202-I247 HydrophobicContact CG2-CD1 4.21Å; I202-I247 HydrophobicContact CG2-CG2 3.52Å; V205-I247 HydrophobicContact CG1-CD1 4.2Å; V206-I247 HydrophobicContact CG2-CB 4.46Å; V206-I247 HydrophobicContact CG2-CG2 3.79Å; F226-I247 CarbonylContact C-O 3.6Å; F226-I247 WeakPolarHBondContact CA-O 3.27Å; F226-I247 VanDerWaalsContact CB-O 3.27Å; F226-I247 WeakPolarHBondContact CB-O 3.48Å; T227-I247 PolarHBondContact N-O 2.95Å; T227-I247 PolarHBondContact O-N 3.19Å; V229-I247 HydrophobicContact CG1-CD1 4.08Å; L245-I247 HydrophobicContact CB-CG1 4.15Å; I247-R318 HydrophobicContact CG2-CG 4.28Å; I247-H320 HydrophobicContact CG1-CB 4.34Å
248	A	97.7	Very high	93.9	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	143	175.8	0	0	0	0	0	111.5	L253 M266 F319	A248-L253 HydrophobicContact CB-CD2 3.95Å; A248-M266 HydrophobicContact CB-CE 4.29Å; A248-M266 HydrophobicContact CB-SD 4.39Å; A248-F319 HydrophobicContact CB-CB 4.32Å; A248-F319 HydrophobicContact CB-CD1 3.89Å; A248-F319 PolarHBondContact N-O 3.02Å
249	H	96.5	Very high	94.8	Very high	22 Å²	22	30 Å²	30	10%	0.102	14%	0.143	C	C	.	.	S	Bend	trans	-75	-38.1	-178.9	-65.2	175.8	0	0	0	112.6	V206 N218 D219 D221 E222 G225 F226 T227 Q251 R318	V206-H249 HydrophobicContact CG1-CB 4.32Å; V206-H249 VanDerWaalsContact CG1-CD2 3.44Å; V206-H249 WeakPolarHBondContact CG1-CD2 3.17Å; N218-H249 PolarHBondContact OD1-CE1 2.67Å; N218-H249 PolarHBondContact OD1-NE2 3.28Å; N218-H249 VanDerWaalsContact OD1-NE2 3.15Å; D219-H249 PolarHBondContact O-CE1 3.4Å; D221-H249 PolarHBondContact O-ND1 2.82Å; E222-H249 CarbonylContact O-C 3.48Å; G225-H249 PolarHBondContact O-N 3.06Å; F226-H249 WeakPolarHBondContact CA-NE2 3.39Å; T227-H249 PolarHBondContact N-NE2 3.41Å; T227-H249 PolarHBondContact OG1-NE2 3.08Å; H249-Q251 PolarHBondContact O-N 3.07Å; H249-Q251 VanDerWaalsContact O-N 3.1Å; H249-R318 PolarHBondContact O-NH1 3.42Å; H249-R318 VanDerWaalsContact O-NH1 3.09Å
250	D	96	Very high	95.4	Very high	35 Å²	35	32.9 Å²	32.9	19%	0.187	15%	0.153	C	C	.	.			trans	-59.9	117.6	-177.8	-174.8	3.9	0	0	0	110.9	E222 K252 L253	E222-D250 WeakPolarHBondContact O-CA 3.46Å; E222-D250 PolarHBondContact O-N 2.84Å; D250-K252 PolarHBondContact O-N 2.95Å; D250-K252 WeakPolarHBondContact OD1-CB 3.36Å; D250-K252 PolarHBondContact OD1-N 3.36Å; D250-L253 HydrophobicContact CB-CB 4.24Å; D250-L253 PolarHBondContact O-N 2.83Å
251	Q	93.9	Very high	95.9	Very high	133 Å²	133	31.8 Å²	31.8	62%	0.621	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-20.7	179.3	-42.3	-162.3	-16.2	0	0	113	H249 L253 R318	H249-Q251 PolarHBondContact O-N 3.07Å; H249-Q251 VanDerWaalsContact O-N 3.1Å; Q251-L253 VanDerWaalsContact C-N 3.33Å; Q251-R318 VanDerWaalsContact CA-CZ 3.45Å; Q251-R318 VanDerWaalsContact CA-NH1 3.33Å
252	K	94.6	Very high	96.6	Very high	173 Å²	173	31.6 Å²	31.6	75%	0.752	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-18.3	177.8	-60.3	176.7	-177.2	171.9	0	112.3	D250 T254	D250-K252 PolarHBondContact O-N 2.95Å; D250-K252 WeakPolarHBondContact OD1-CB 3.36Å; D250-K252 PolarHBondContact OD1-N 3.36Å; K252-T254 PolarHBondContact O-N 2.92Å
253	L	97.1	Very high	97	Very high	2 Å²	2	32.5 Å²	32.5	1%	0.01	16%	0.163	C	C	.	.			trans	-86.8	95.4	175.3	-169.8	70.9	0	0	0	109.4	A248 D250 Q251 D258 L259 M266 F319	A248-L253 HydrophobicContact CB-CD2 3.95Å; D250-L253 HydrophobicContact CB-CB 4.24Å; D250-L253 PolarHBondContact O-N 2.83Å; Q251-L253 VanDerWaalsContact C-N 3.33Å; L253-D258 HydrophobicContact CD1-CB 3.7Å; L253-L259 HydrophobicContact CD1-CD2 3.88Å; L253-L259 HydrophobicContact CD1-CG 4.48Å; L253-L259 HydrophobicContact CD2-CD2 4.18Å; L253-M266 HydrophobicContact CD2-CE 3.71Å; L253-F319 HydrophobicContact CB-CB 4.28Å; L253-F319 HydrophobicContact CD2-CB 3.77Å; L253-F319 HydrophobicContact CD2-CD1 3.74Å; L253-F319 HydrophobicContact CD2-CD2 4.44Å; L253-F319 HydrophobicContact CD2-CE1 4.45Å; L253-F319 HydrophobicContact CD2-CG 3.72Å; L253-F319 HydrophobicContact CG-CB 3.61Å; L253-F319 HydrophobicContact CG-CD1 4.46Å; L253-F319 HydrophobicContact CG-CD2 4.45Å; L253-F319 HydrophobicContact CG-CG 3.94Å; L253-F319 WeakPolarHBondContact O-CB 3.37Å; L253-F319 PolarHBondContact O-N 3.47Å
254	T	96.8	Very high	97.2	Very high	33 Å²	33	32.5 Å²	32.5	20%	0.202	16%	0.164	C	C	.	.			trans	-98.4	-39.2	-169.9	73	0	0	0	0	113.4	K252 D258 Y317 R318 F319	K252-T254 PolarHBondContact O-N 2.92Å; T254-D258 WeakPolarHBondContact CA-OD2 3.19Å; T254-D258 WeakPolarHBondContact CB-OD2 3.35Å; T254-D258 PolarHBondContact N-OD2 2.92Å; T254-D258 PolarHBondContact OG1-OD2 3.45Å; T254-Y317 WeakPolarHBondContact CB-O 3.25Å; T254-Y317 CarbonylContact O-C 3.49Å; T254-R318 CarbonylContact O-C 3.58Å; T254-R318 VanDerWaalsContact O-C 3.28Å; T254-R318 PolarHBondContact O-N 2.69Å; T254-F319 PolarHBondContact O-N 2.85Å
255	C	97.6	Very high	97.4	Very high	3 Å²	3	36.4 Å²	36.4	2%	0.02	19%	0.19	C	C	.	.	S	Bend	trans	-157.4	-174.6	-174.4	72.7	0	0	0	0	112.8	Y184 R257 D258 Y312 P314 Y317	Y184-C255 PolarHBondContact OH-SG 2.82Å; C255-R257 PolarHBondContact O-N 3.4Å; C255-D258 PolarHBondContact N-OD2 3.16Å; C255-D258 VanDerWaalsContact N-OD2 3.14Å; C255-D258 PolarHBondContact O-N 2.89Å; C255-D258 VanDerWaalsContact O-N 3.14Å; C255-Y312 HydrophobicContact CB-CE2 4.39Å; C255-P314 HydrophobicContact CB-CG 3.86Å; C255-Y317 HydrophobicContact CB-CD1 4.07Å; C255-Y317 HydrophobicContact CB-CE1 4.08Å
256	L	97.9	Very high	97.5	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-55.3	-33.6	-179.3	-174.3	57.4	0	0	0	113.7	D258 L259 Y312 H340 V345 Y356 I361	L256-D258 PolarHBondContact O-N 3.33Å; L256-L259 HydrophobicContact CD1-CD1 3.97Å; L256-L259 PolarHBondContact O-N 3.29Å; L256-Y312 HydrophobicContact CB-CD2 3.54Å; L256-Y312 HydrophobicContact CB-CE2 4.1Å; L256-Y312 HydrophobicContact CB-CG 4.23Å; L256-Y312 HydrophobicContact CD2-CD2 4.28Å; L256-Y312 HydrophobicContact CD2-CG 4.15Å; L256-H340 HydrophobicContact CD2-CB 4.32Å; L256-V345 HydrophobicContact CD1-CG1 4.13Å; L256-V345 HydrophobicContact CD1-CG2 4.13Å; L256-Y356 HydrophobicContact CD1-CD1 3.69Å; L256-Y356 HydrophobicContact CD1-CD2 3.96Å; L256-Y356 HydrophobicContact CD1-CE1 3.63Å; L256-Y356 HydrophobicContact CD1-CE2 3.92Å; L256-Y356 HydrophobicContact CD1-CG 3.86Å; L256-Y356 HydrophobicContact CD2-CD1 3.78Å; L256-Y356 HydrophobicContact CD2-CE1 3.72Å; L256-Y356 HydrophobicContact CG-CD1 3.49Å; L256-Y356 VanDerWaalsContact CG-CD1 3.49Å; L256-Y356 HydrophobicContact CG-CE1 3.77Å; L256-Y356 HydrophobicContact CG-CG 3.9Å; L256-Y356 VanDerWaalsContact O-CB 3.3Å; L256-Y356 WeakPolarHBondContact O-CB 3.46Å; L256-I361 HydrophobicContact CD2-CD1 4.27Å
257	R	98.2	Very high	97.5	Very high	7 Å²	7	36.1 Å²	36.1	3%	0.026	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-64.7	-25.7	179.8	-74.1	-85.7	-177	-157.9	3.3	113.6	E179 Y184 C255 R260 Y312 Y356 A357 R359 I361	E179-R257 PolarHBondContact O-NH2 3.43Å; E179-R257 IonicContact OE1-CZ 2.99Å; E179-R257 IonicContact OE1-NE 3.85Å; E179-R257 PolarHBondContact OE1-NE 3.45Å; E179-R257 IonicContact OE1-NH2 3.75Å; E179-R257 PolarHBondContact OE1-NH2 2.99Å; Y184-R257 HydrophobicContact CD1-CB 4.19Å; Y184-R257 HydrophobicContact CD1-CG 3.88Å; Y184-R257 HydrophobicContact CD2-CG 3.89Å; Y184-R257 HydrophobicContact CE1-CB 3.6Å; Y184-R257 HydrophobicContact CE1-CG 3.74Å; Y184-R257 HydrophobicContact CE2-CB 4.21Å; Y184-R257 HydrophobicContact CE2-CG 3.78Å; Y184-R257 HydrophobicContact CG-CG 3.95Å; C255-R257 PolarHBondContact O-N 3.4Å; R257-R260 PolarHBondContact O-NH1 2.88Å; R257-Y312 HydrophobicContact CG-CE2 3.92Å; R257-Y312 VanDerWaalsContact CG-OH 3.25Å; R257-Y312 WeakPolarHBondContact CG-OH 3.27Å; R257-Y312 PolarHBondContact NE-OH 3.05Å; R257-Y356 WeakPolarHBondContact CD-O 3.36Å; R257-Y356 PolarHBondContact NH1-O 3.48Å; R257-A357 PolarHBondContact NH1-O 2.84Å; R257-R359 PolarHBondContact NH1-O 3.2Å; R257-R359 PolarHBondContact NH2-O 2.97Å; R257-I361 HydrophobicContact CG-CD1 4.39Å
258	D	98	Very high	97.6	Very high	44 Å²	44	40.5 Å²	40.5	24%	0.235	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-85.8	-15.3	-175.9	-56.3	-33.1	0	0	0	112.3	L253 T254 C255 L256 R260	L253-D258 HydrophobicContact CD1-CB 3.7Å; T254-D258 WeakPolarHBondContact CA-OD2 3.19Å; T254-D258 WeakPolarHBondContact CB-OD2 3.35Å; T254-D258 PolarHBondContact N-OD2 2.92Å; T254-D258 PolarHBondContact OG1-OD2 3.45Å; C255-D258 PolarHBondContact N-OD2 3.16Å; C255-D258 VanDerWaalsContact N-OD2 3.14Å; C255-D258 PolarHBondContact O-N 2.89Å; C255-D258 VanDerWaalsContact O-N 3.14Å; L256-D258 PolarHBondContact O-N 3.33Å; D258-R260 PolarHBondContact O-NH1 2.81Å
259	L	98.6	Very high	97.6	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.225	C	C	.	.			trans	-66.1	142.8	-179.6	-71	179.2	0	0	0	112.4	L253 L256 H263 L267 I310 F319 V345 L349	L253-L259 HydrophobicContact CD1-CD2 3.88Å; L253-L259 HydrophobicContact CD1-CG 4.48Å; L253-L259 HydrophobicContact CD2-CD2 4.18Å; L256-L259 HydrophobicContact CD1-CD1 3.97Å; L256-L259 PolarHBondContact O-N 3.29Å; L259-H263 HydrophobicContact CD2-CB 3.92Å; L259-L267 HydrophobicContact CD1-CD1 4.15Å; L259-L267 HydrophobicContact CD2-CD1 4.19Å; L259-L267 HydrophobicContact CD2-CD2 4.2Å; L259-I310 HydrophobicContact CD1-CD1 4.36Å; L259-F319 HydrophobicContact CD1-CE2 3.57Å; L259-F319 HydrophobicContact CD1-CZ 3.91Å; L259-F319 HydrophobicContact CD2-CD2 4.4Å; L259-F319 HydrophobicContact CD2-CE2 3.96Å; L259-F319 HydrophobicContact CD2-CZ 4.05Å; L259-F319 HydrophobicContact CG-CD2 4.44Å; L259-F319 HydrophobicContact CG-CE2 3.92Å; L259-F319 HydrophobicContact CG-CZ 4.4Å; L259-V345 HydrophobicContact CD1-CG1 3.61Å; L259-L349 HydrophobicContact CB-CD1 3.77Å; L259-L349 HydrophobicContact CB-CD2 4.33Å; L259-L349 HydrophobicContact CD1-CD1 4.12Å; L259-L349 HydrophobicContact CG-CD1 4.49Å
260	R	98.4	Very high	97.7	Very high	71 Å²	71	44.4 Å²	44.4	27%	0.268	22%	0.221	S	C	.	.			trans	-145	164	-175.2	-65.5	-60	-179.3	-79.3	-5.4	109	R257 D258 C262 H263 D353	R257-R260 PolarHBondContact O-NH1 2.88Å; D258-R260 PolarHBondContact O-NH1 2.81Å; R260-C262 PolarHBondContact O-N 2.99Å; R260-C262 VanDerWaalsContact O-N 3.14Å; R260-H263 PolarHBondContact N-ND1 3.03Å; R260-H263 WeakPolarHBondContact O-CB 3.3Å; R260-H263 PolarHBondContact O-N 2.62Å; R260-H263 PolarHBondContact O-ND1 3.11Å; R260-D353 WeakPolarHBondContact CB-OD1 3.33Å; R260-D353 WeakPolarHBondContact CD-O 3.4Å
261	S	98.5	Very high	97.8	Very high	43 Å²	43	43.8 Å²	43.8	30%	0.301	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-56.7	-30.6	179.6	-61.9	0	0	0	0	112.5	H263 V264 L349 D353	S261-H263 PolarHBondContact O-N 3.5Å; S261-H263 VanDerWaalsContact O-N 3.15Å; S261-V264 VanDerWaalsContact O-CB 3.32Å; S261-V264 WeakPolarHBondContact O-CB 3.2Å; S261-V264 WeakPolarHBondContact O-CG2 3.38Å; S261-V264 PolarHBondContact O-N 3.5Å; S261-L349 PolarHBondContact OG-O 2.98Å; S261-D353 WeakPolarHBondContact CB-OD1 3.03Å; S261-D353 PolarHBondContact N-OD1 3.14Å; S261-D353 WeakPolarHBondContact OG-CA 2.89Å; S261-D353 VanDerWaalsContact OG-CB 3.29Å; S261-D353 WeakPolarHBondContact OG-CB 3.3Å; S261-D353 PolarHBondContact OG-OD1 2.86Å
262	C	98.2	Very high	98	Very high	72 Å²	72	43.6 Å²	43.6	49%	0.486	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-60	-23.1	175.4	63.1	0	0	0	0	113.8	F224 R260 P265	F224-C262 VanDerWaalsContact CE1-O 3.32Å; F224-C262 WeakPolarHBondContact CE1-O 3.32Å; R260-C262 PolarHBondContact O-N 2.99Å; R260-C262 VanDerWaalsContact O-N 3.14Å; C262-P265 WeakPolarHBondContact O-CD 3.21Å
263	H	98.5	Very high	98.2	Very high	20 Å²	20	37.4 Å²	37.4	9%	0.093	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-85	-14.2	178.1	-54.4	100.3	0	0	0	113.1	L259 R260 S261 M266 L267	L259-H263 HydrophobicContact CD2-CB 3.92Å; R260-H263 PolarHBondContact N-ND1 3.03Å; R260-H263 WeakPolarHBondContact O-CB 3.3Å; R260-H263 PolarHBondContact O-N 2.62Å; R260-H263 PolarHBondContact O-ND1 3.11Å; S261-H263 PolarHBondContact O-N 3.5Å; S261-H263 VanDerWaalsContact O-N 3.15Å; H263-M266 HydrophobicContact CB-CE 4.49Å; H263-M266 WeakPolarHBondContact O-CB 3.39Å; H263-M266 PolarHBondContact O-N 3.32Å; H263-L267 WeakPolarHBondContact O-CG 3.41Å; H263-L267 PolarHBondContact O-N 3.1Å
264	V	98.7	Very high	98.2	Very high	14 Å²	14	37.3 Å²	37.3	9%	0.085	19%	0.191	C	C	.	.	H	α-helix	trans	-53.6	-43.8	-176.3	168.8	0	0	0	0	113.1	S261 M266 L267 K268 I346 L349 E350	S261-V264 VanDerWaalsContact O-CB 3.32Å; S261-V264 WeakPolarHBondContact O-CB 3.2Å; S261-V264 WeakPolarHBondContact O-CG2 3.38Å; S261-V264 PolarHBondContact O-N 3.5Å; V264-M266 VanDerWaalsContact C-N 3.34Å; V264-M266 PolarHBondContact O-N 2.93Å; V264-L267 PolarHBondContact O-N 3.2Å; V264-K268 HydrophobicContact CG1-CD 4.14Å; V264-K268 HydrophobicContact CG1-CG 4.37Å; V264-K268 WeakPolarHBondContact O-CG 3.19Å; V264-K268 PolarHBondContact O-N 2.88Å; V264-I346 HydrophobicContact CG1-CG2 4.17Å; V264-L349 HydrophobicContact CG2-CB 3.65Å; V264-E350 HydrophobicContact CG1-CG 3.96Å; V264-E350 HydrophobicContact CG2-CG 4.36Å
265	P	98.4	Very high	98.2	Very high	82 Å²	82	38 Å²	38	53%	0.532	19%	0.19	S	C	.	.	H	α-helix	trans	-58	-43	175.2	-25.9	36.1	0	0	0	113.2	C262 R269	C262-P265 WeakPolarHBondContact O-CD 3.21Å; P265-R269 WeakPolarHBondContact O-CG 3.4Å; P265-R269 PolarHBondContact O-N 3.31Å
266	M	98.4	Very high	98.1	Very high	2 Å²	2	39.6 Å²	39.6	1%	0.01	20%	0.198	C	C	.	.	H	α-helix	trans	-64.2	-46.5	175.7	179.3	-172.2	73.7	0	0	111.2	F224 F226 A248 L253 H263 V264 K268 R269 I270	F224-M266 HydrophobicContact CB-CB 4.32Å; F224-M266 HydrophobicContact CB-SD 4.49Å; F224-M266 HydrophobicContact CD1-CB 4.25Å; F224-M266 VanDerWaalsContact O-CG 3.29Å; F224-M266 WeakPolarHBondContact O-CG 3.29Å; F226-M266 HydrophobicContact CD1-CG 4.28Å; A248-M266 HydrophobicContact CB-CE 4.29Å; A248-M266 HydrophobicContact CB-SD 4.39Å; L253-M266 HydrophobicContact CD2-CE 3.71Å; H263-M266 HydrophobicContact CB-CE 4.49Å; H263-M266 WeakPolarHBondContact O-CB 3.39Å; H263-M266 PolarHBondContact O-N 3.32Å; V264-M266 VanDerWaalsContact C-N 3.34Å; V264-M266 PolarHBondContact O-N 2.93Å; M266-K268 VanDerWaalsContact C-N 3.35Å; M266-K268 PolarHBondContact O-N 3.35Å; M266-R269 WeakPolarHBondContact O-CB 3.43Å; M266-R269 PolarHBondContact O-N 3.1Å; M266-R269 VanDerWaalsContact O-N 3.14Å; M266-I270 HydrophobicContact CE-CD1 4.32Å; M266-I270 HydrophobicContact CG-CD1 3.93Å; M266-I270 HydrophobicContact CG-CG1 4.43Å; M266-I270 WeakPolarHBondContact O-CG1 3.41Å; M266-I270 PolarHBondContact O-N 3.37Å; M266-I270 HydrophobicContact SD-CD1 4.47Å
267	L	98.8	Very high	98	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-60.8	-41.9	179.9	-64.6	178	0	0	0	112.3	L259 H263 V264 I270 L271 F319 L342 V345 I346 L349	L259-L267 HydrophobicContact CD1-CD1 4.15Å; L259-L267 HydrophobicContact CD2-CD1 4.19Å; L259-L267 HydrophobicContact CD2-CD2 4.2Å; H263-L267 WeakPolarHBondContact O-CG 3.41Å; H263-L267 PolarHBondContact O-N 3.1Å; V264-L267 PolarHBondContact O-N 3.2Å; L267-I270 PolarHBondContact O-N 3.03Å; L267-L271 WeakPolarHBondContact O-CB 3.39Å; L267-L271 PolarHBondContact O-N 3.34Å; L267-F319 HydrophobicContact CD2-CE1 3.71Å; L267-F319 HydrophobicContact CD2-CZ 3.58Å; L267-L342 HydrophobicContact CB-CD1 4.25Å; L267-L342 HydrophobicContact CD2-CD1 4.06Å; L267-V345 HydrophobicContact CD1-CG1 4.28Å; L267-I346 HydrophobicContact CB-CD1 4.01Å; L267-I346 HydrophobicContact CB-CG1 3.71Å; L267-I346 HydrophobicContact CD1-CG1 4.21Å; L267-L349 HydrophobicContact CD1-CD1 3.84Å
268	K	98.7	Very high	97.8	Very high	95 Å²	95	40 Å²	40	41%	0.413	20%	0.202	S	C	.	.	H	α-helix	trans	-62.9	-41.6	174	-74.8	-178.4	176.1	-179	0	111.9	V264 M266 L271 Q272 I346 E350	V264-K268 HydrophobicContact CG1-CD 4.14Å; V264-K268 HydrophobicContact CG1-CG 4.37Å; V264-K268 WeakPolarHBondContact O-CG 3.19Å; V264-K268 PolarHBondContact O-N 2.88Å; M266-K268 VanDerWaalsContact C-N 3.35Å; M266-K268 PolarHBondContact O-N 3.35Å; K268-L271 PolarHBondContact O-N 3.31Å; K268-Q272 WeakPolarHBondContact O-CB 3.42Å; K268-Q272 PolarHBondContact O-N 3.25Å; K268-I346 HydrophobicContact CG-CD1 4.09Å; K268-I346 HydrophobicContact CG-CG2 4.09Å; K268-E350 WeakPolarHBondContact CE-OE1 3.48Å; K268-E350 IonicContact NZ-OE1 2.84Å; K268-E350 PolarHBondContact NZ-OE1 3.34Å
269	R	98.2	Very high	97.6	Very high	103 Å²	103	41.4 Å²	41.4	39%	0.389	21%	0.206	S	C	.	.	H	α-helix	trans	-62.3	-46.2	174.9	-75	177.4	65.9	-133.7	-8.3	111.6	D219 F226 P265 M266 L271 Q272 L273	D219-R269 VanDerWaalsContact CG-NH2 3.27Å; D219-R269 IonicContact OD1-CZ 3.49Å; D219-R269 IonicContact OD1-NH2 3.82Å; D219-R269 PolarHBondContact OD1-NH2 3.39Å; D219-R269 IonicContact OD2-CZ 3.41Å; D219-R269 IonicContact OD2-NH1 3.9Å; D219-R269 PolarHBondContact OD2-NH1 3.48Å; D219-R269 IonicContact OD2-NH2 3.2Å; D219-R269 PolarHBondContact OD2-NH2 3.22Å; F226-R269 HydrophobicContact CE1-CB 3.9Å; F226-R269 HydrophobicContact CZ-CB 4.25Å; P265-R269 WeakPolarHBondContact O-CG 3.4Å; P265-R269 PolarHBondContact O-N 3.31Å; M266-R269 WeakPolarHBondContact O-CB 3.43Å; M266-R269 PolarHBondContact O-N 3.1Å; M266-R269 VanDerWaalsContact O-N 3.14Å; R269-L271 VanDerWaalsContact C-N 3.35Å; R269-L271 PolarHBondContact O-N 2.98Å; R269-Q272 PolarHBondContact O-N 3.25Å; R269-L273 WeakPolarHBondContact O-CB 3.46Å; R269-L273 PolarHBondContact O-N 2.92Å
270	I	98.4	Very high	97.3	Very high	0 Å²	0	48 Å²	48	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-55.7	-51.6	175.7	-69.9	165.5	0	0	0	109.9	F226 M266 L267 G274 V321 F323 L342	F226-I270 HydrophobicContact CB-CD1 4.13Å; F226-I270 HydrophobicContact CB-CG1 4.05Å; F226-I270 HydrophobicContact CD1-CD1 4.17Å; F226-I270 HydrophobicContact CD1-CG1 3.46Å; F226-I270 VanDerWaalsContact CD1-CG1 3.46Å; F226-I270 HydrophobicContact CD2-CG1 3.62Å; F226-I270 HydrophobicContact CE1-CG1 3.7Å; F226-I270 HydrophobicContact CE2-CB 4.36Å; F226-I270 HydrophobicContact CE2-CG1 3.83Å; F226-I270 HydrophobicContact CG-CD1 4.05Å; F226-I270 HydrophobicContact CG-CG1 3.42Å; F226-I270 VanDerWaalsContact CG-CG1 3.42Å; F226-I270 HydrophobicContact CZ-CB 4.41Å; F226-I270 HydrophobicContact CZ-CG1 3.87Å; M266-I270 HydrophobicContact CE-CD1 4.32Å; M266-I270 HydrophobicContact CG-CD1 3.93Å; M266-I270 HydrophobicContact CG-CG1 4.43Å; M266-I270 WeakPolarHBondContact O-CG1 3.41Å; M266-I270 PolarHBondContact O-N 3.37Å; M266-I270 HydrophobicContact SD-CD1 4.47Å; L267-I270 PolarHBondContact O-N 3.03Å; I270-G274 WeakPolarHBondContact O-CA 3.21Å; I270-G274 PolarHBondContact O-N 2.72Å; I270-V321 HydrophobicContact CG2-CB 4.01Å; I270-V321 HydrophobicContact CG2-CG1 4.22Å; I270-V321 HydrophobicContact CG2-CG2 3.92Å; I270-F323 HydrophobicContact CG2-CE2 3.86Å; I270-F323 HydrophobicContact CG2-CZ 3.77Å; I270-F323 WeakPolarHBondContact O-CZ 3.41Å; I270-L342 HydrophobicContact CG2-CD2 4.4Å
271	L	98.6	Very high	96.9	Very high	22 Å²	22	49.5 Å²	49.5	12%	0.115	24%	0.239	C	C	.	.	H	α-helix	trans	-58.8	-53.6	-178.8	-178.8	64.2	0	0	0	112.3	L267 K268 R269 R275 A308 L342 E343 I346	L267-L271 WeakPolarHBondContact O-CB 3.39Å; L267-L271 PolarHBondContact O-N 3.34Å; K268-L271 PolarHBondContact O-N 3.31Å; R269-L271 VanDerWaalsContact C-N 3.35Å; R269-L271 PolarHBondContact O-N 2.98Å; L271-R275 WeakPolarHBondContact O-CB 3.33Å; L271-R275 WeakPolarHBondContact O-CG 3.46Å; L271-R275 PolarHBondContact O-N 3.47Å; L271-R275 VanDerWaalsContact O-N 3.13Å; L271-A308 HydrophobicContact CD1-CB 3.56Å; L271-L342 HydrophobicContact CB-CD2 3.79Å; L271-L342 HydrophobicContact CD1-CD2 4.04Å; L271-L342 HydrophobicContact CG-CD2 4.45Å; L271-E343 HydrophobicContact CD2-CG 3.71Å; L271-I346 HydrophobicContact CD2-CD1 4.11Å
272	Q	97.9	Very high	96.4	Very high	130 Å²	130	49 Å²	49	61%	0.607	23%	0.231	S	C	*	.	H	α-helix	trans	-66.5	-50.9	-176.3	-176.8	176	7.5	0	0	111.1	K268 R269 G274 R275 D276	K268-Q272 WeakPolarHBondContact O-CB 3.42Å; K268-Q272 PolarHBondContact O-N 3.25Å; R269-Q272 PolarHBondContact O-N 3.25Å; Q272-G274 PolarHBondContact O-N 2.74Å; Q272-R275 PolarHBondContact O-N 2.97Å; Q272-D276 VanDerWaalsContact O-CB 3.29Å; Q272-D276 WeakPolarHBondContact O-CB 3.48Å; Q272-D276 PolarHBondContact O-N 2.75Å
273	L	97.4	Very high	95.7	Very high	42 Å²	42	46.7 Å²	46.7	22%	0.22	22%	0.215	C	C	.	.	H	α-helix	trans	-67.2	-37.9	-177.4	-171.8	61.7	0	0	0	111.8	H217 F226 L228 R269 T277	H217-L273 HydrophobicContact CB-CD2 4.14Å; H217-L273 VanDerWaalsContact CD2-CD2 3.48Å; H217-L273 WeakPolarHBondContact CD2-CD2 3.39Å; H217-L273 VanDerWaalsContact CG-CD2 3.44Å; F226-L273 HydrophobicContact CE2-CD2 4.08Å; F226-L273 HydrophobicContact CZ-CB 4.31Å; F226-L273 HydrophobicContact CZ-CD2 3.79Å; L228-L273 HydrophobicContact CD1-CB 4.34Å; L228-L273 HydrophobicContact CD1-CD2 4.26Å; L228-L273 HydrophobicContact CD1-CG 3.97Å; R269-L273 WeakPolarHBondContact O-CB 3.46Å; R269-L273 PolarHBondContact O-N 2.92Å; L273-T277 WeakPolarHBondContact O-CB 3.44Å; L273-T277 PolarHBondContact O-N 3.34Å; L273-T277 PolarHBondContact O-OG1 3.44Å
274	G	97.5	Very high	94.2	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-58	-53.6	174.4	0	0	0	0	0	111.5	I270 Q272 T277 L278	I270-G274 WeakPolarHBondContact O-CA 3.21Å; I270-G274 PolarHBondContact O-N 2.72Å; Q272-G274 PolarHBondContact O-N 2.74Å; G274-T277 PolarHBondContact O-N 2.83Å; G274-L278 WeakPolarHBondContact O-CB 3.36Å; G274-L278 VanDerWaalsContact O-CG 3.25Å; G274-L278 WeakPolarHBondContact O-CG 3.46Å; G274-L278 PolarHBondContact O-N 3.15Å
275	R	97.3	Very high	91.9	Very high	47 Å²	47	56.3 Å²	56.3	18%	0.177	26%	0.263	C	S	.	.	H	α-helix	trans	-61.2	-47.9	177	-75.5	-176.2	164.4	142.7	5.3	112.7	L271 Q272 T277 F279 K303 I306 E343	L271-R275 WeakPolarHBondContact O-CB 3.33Å; L271-R275 WeakPolarHBondContact O-CG 3.46Å; L271-R275 PolarHBondContact O-N 3.47Å; L271-R275 VanDerWaalsContact O-N 3.13Å; Q272-R275 PolarHBondContact O-N 2.97Å; R275-T277 VanDerWaalsContact C-N 3.32Å; R275-T277 PolarHBondContact O-N 2.8Å; R275-F279 WeakPolarHBondContact O-CB 3.35Å; R275-F279 PolarHBondContact O-N 2.97Å; R275-K303 PolarHBondContact NE-O 2.92Å; R275-I306 HydrophobicContact CB-CD1 4.37Å; R275-I306 HydrophobicContact CG-CB 4.15Å; R275-I306 HydrophobicContact CG-CD1 4.34Å; R275-I306 HydrophobicContact CG-CG2 4.15Å; R275-I306 PolarHBondContact NE-O 2.86Å; R275-I306 VanDerWaalsContact NE-O 3.12Å; R275-I306 PolarHBondContact NH2-O 3.44Å; R275-E343 IonicContact CZ-OE1 2.62Å; R275-E343 IonicContact NH1-OE1 3.9Å; R275-E343 PolarHBondContact NH1-OE1 2.62Å; R275-E343 IonicContact NH2-OE1 3.3Å; R275-E343 PolarHBondContact NH2-OE1 2.84Å
276	D	96.5	Very high	89.3	Confident	37 Å²	37	59.3 Å²	59.3	20%	0.198	27%	0.27	C	S	.	.	H	α-helix	trans	-63.6	-39.4	-177.5	-73.2	-10.4	0	0	0	112	Q272 R280 K303	Q272-D276 VanDerWaalsContact O-CB 3.29Å; Q272-D276 WeakPolarHBondContact O-CB 3.48Å; Q272-D276 PolarHBondContact O-N 2.75Å; D276-R280 VanDerWaalsContact O-CB 3.28Å; D276-R280 WeakPolarHBondContact O-CB 3.49Å; D276-R280 VanDerWaalsContact O-CG 3.27Å; D276-R280 WeakPolarHBondContact O-CG 3.3Å; D276-R280 PolarHBondContact O-N 3.39Å; D276-R280 PolarHBondContact O-NE 2.85Å; D276-R280 VanDerWaalsContact O-NE 3.13Å; D276-K303 WeakPolarHBondContact OD1-CE 3.32Å; D276-K303 IonicContact OD1-NZ 3.84Å; D276-K303 PolarHBondContact OD1-NZ 3.34Å
277	T	94.8	Very high	86.4	Confident	16 Å²	16	66 Å²	66	10%	0.098	31%	0.311	C	S	.	.	H	α-helix	trans	-73.7	-42.7	-177.7	-56.3	0	0	0	0	111.3	L216 L273 G274 R275 R280 K281	L216-T277 HydrophobicContact CB-CG2 3.83Å; L216-T277 HydrophobicContact CD1-CG2 4.28Å; L273-T277 WeakPolarHBondContact O-CB 3.44Å; L273-T277 PolarHBondContact O-N 3.34Å; L273-T277 PolarHBondContact O-OG1 3.44Å; G274-T277 PolarHBondContact O-N 2.83Å; R275-T277 VanDerWaalsContact C-N 3.32Å; R275-T277 PolarHBondContact O-N 2.8Å; T277-R280 PolarHBondContact OG1-NH2 2.84Å; T277-K281 VanDerWaalsContact O-CB 3.32Å; T277-K281 WeakPolarHBondContact O-CB 3.48Å; T277-K281 PolarHBondContact O-N 2.86Å
278	L	94.3	Very high	83.5	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-64.6	-45.4	174.9	-70.2	171	0	0	0	111.5	L216 L230 L242 C244 G274 K281 Y282 L301 I306 F323	L216-L278 HydrophobicContact CD1-CD2 3.8Å; L216-L278 HydrophobicContact CD1-CG 4.49Å; L230-L278 HydrophobicContact CD2-CD2 4.04Å; L242-L278 HydrophobicContact CD1-CD1 4.34Å; L242-L278 HydrophobicContact CD1-CD2 3.76Å; L242-L278 HydrophobicContact CD2-CD1 4.35Å; C244-L278 HydrophobicContact CB-CD1 4.12Å; C244-L278 HydrophobicContact CB-CD2 4.16Å; G274-L278 WeakPolarHBondContact O-CB 3.36Å; G274-L278 VanDerWaalsContact O-CG 3.25Å; G274-L278 WeakPolarHBondContact O-CG 3.46Å; G274-L278 PolarHBondContact O-N 3.15Å; L278-K281 PolarHBondContact O-N 3.48Å; L278-Y282 HydrophobicContact CD2-CD2 4.34Å; L278-Y282 HydrophobicContact CD2-CE2 3.99Å; L278-Y282 VanDerWaalsContact O-CD2 3.27Å; L278-Y282 WeakPolarHBondContact O-CD2 3.44Å; L278-Y282 PolarHBondContact O-N 2.84Å; L278-L301 HydrophobicContact CB-CD2 4.17Å; L278-I306 HydrophobicContact CB-CD1 3.86Å; L278-I306 HydrophobicContact CD1-CD1 4.47Å; L278-I306 HydrophobicContact CD1-CG2 4.12Å; L278-F323 HydrophobicContact CD1-CB 3.86Å; L278-F323 HydrophobicContact CD1-CD1 4.4Å; L278-F323 HydrophobicContact CD1-CG 4.25Å
279	F	93.7	Very high	80.5	Confident	73 Å²	73	73.3 Å²	73.3	32%	0.32	36%	0.363	S	S	.	.	H	α-helix	trans	-57.4	-54.3	173.4	175.6	-96.4	0	0	0	111.4	R275 K281 Y282 S283 L301 K303	R275-F279 WeakPolarHBondContact O-CB 3.35Å; R275-F279 PolarHBondContact O-N 2.97Å; F279-K281 PolarHBondContact O-N 3.46Å; F279-K281 VanDerWaalsContact O-N 3.08Å; F279-Y282 PolarHBondContact O-N 3.45Å; F279-Y282 VanDerWaalsContact O-N 3.14Å; F279-S283 WeakPolarHBondContact CA-OG 3.36Å; F279-S283 WeakPolarHBondContact CD2-OG 3.43Å; F279-S283 VanDerWaalsContact CE2-OG 3.26Å; F279-S283 WeakPolarHBondContact CE2-OG 3.42Å; F279-S283 WeakPolarHBondContact CG-OG 3.4Å; F279-S283 WeakPolarHBondContact O-CB 3.32Å; F279-S283 PolarHBondContact O-N 2.99Å; F279-S283 PolarHBondContact O-OG 3.36Å; F279-L301 WeakPolarHBondContact CD2-O 3.22Å; F279-K303 HydrophobicContact CB-CG 3.72Å; F279-K303 HydrophobicContact CD1-CG 4.44Å; F279-K303 HydrophobicContact CD2-CG 3.78Å; F279-K303 HydrophobicContact CG-CD 4.41Å; F279-K303 HydrophobicContact CG-CG 3.72Å
280	R	92	Very high	77.6	Confident	139 Å²	139	76.5 Å²	76.5	53%	0.525	39%	0.387	S	S	.	.	H	α-helix	trans	-56.5	-33.1	179.1	-80.3	-179.9	-81.6	117.8	-1.9	113.4	D276 T277	D276-R280 VanDerWaalsContact O-CB 3.28Å; D276-R280 WeakPolarHBondContact O-CB 3.49Å; D276-R280 VanDerWaalsContact O-CG 3.27Å; D276-R280 WeakPolarHBondContact O-CG 3.3Å; D276-R280 PolarHBondContact O-N 3.39Å; D276-R280 PolarHBondContact O-NE 2.85Å; D276-R280 VanDerWaalsContact O-NE 3.13Å; T277-R280 PolarHBondContact OG1-NH2 2.84Å
281	K	90	Very high	74.5	Confident	102 Å²	102	85.5 Å²	85.5	44%	0.443	43%	0.429	S	S	.	.	H	α-helix	trans	-78.2	-36.6	-179.9	-170.1	165.6	-178.2	164.6	0	112.9	L216 T277 L278 F279	L216-K281 HydrophobicContact CD2-CD 3.85Å; T277-K281 VanDerWaalsContact O-CB 3.32Å; T277-K281 WeakPolarHBondContact O-CB 3.48Å; T277-K281 PolarHBondContact O-N 2.86Å; L278-K281 PolarHBondContact O-N 3.48Å; F279-K281 PolarHBondContact O-N 3.46Å; F279-K281 VanDerWaalsContact O-N 3.08Å
282	Y	88.9	Confident	71.4	Confident	32 Å²	32	93.3 Å²	93.3	13%	0.125	47%	0.467	C	S	.	.	H	α-helix	trans	-121.1	10.4	-168.7	-58	-66.8	0	0	0	115.3	L230 W234 I239 L278 F279 L301	L230-Y282 WeakPolarHBondContact CD1-OH 3.43Å; W234-Y282 HydrophobicContact CH2-CD1 4.16Å; W234-Y282 AromaticContact CH2-CD2 3.9Å; W234-Y282 HydrophobicContact CH2-CD2 3.9Å; W234-Y282 AromaticContact CH2-CE1 3.7Å; W234-Y282 HydrophobicContact CH2-CE1 3.7Å; W234-Y282 AromaticContact CH2-CE2 3.4Å; W234-Y282 HydrophobicContact CH2-CE2 3.4Å; W234-Y282 HydrophobicContact CH2-CG 4.26Å; W234-Y282 AromaticContact CH2-CZ 3.28Å; W234-Y282 HydrophobicContact CZ3-CD2 4.41Å; W234-Y282 HydrophobicContact CZ3-CE1 4.31Å; W234-Y282 AromaticContact CZ3-CE2 3.54Å; W234-Y282 HydrophobicContact CZ3-CE2 3.54Å; W234-Y282 AromaticContact CZ3-CZ 3.48Å; W234-Y282 VanDerWaalsContact CZ3-CZ 3.48Å; W234-Y282 VanDerWaalsContact CZ3-OH 3.32Å; W234-Y282 WeakPolarHBondContact CZ3-OH 3.11Å; I239-Y282 HydrophobicContact CD1-CD2 4.39Å; I239-Y282 HydrophobicContact CD1-CG 4.03Å; L278-Y282 HydrophobicContact CD2-CD2 4.34Å; L278-Y282 HydrophobicContact CD2-CE2 3.99Å; L278-Y282 VanDerWaalsContact O-CD2 3.27Å; L278-Y282 WeakPolarHBondContact O-CD2 3.44Å; L278-Y282 PolarHBondContact O-N 2.84Å; F279-Y282 PolarHBondContact O-N 3.45Å; F279-Y282 VanDerWaalsContact O-N 3.14Å; Y282-L301 PolarHBondContact O-N 3.19Å
283	S	82.4	Confident	68.7	Low	23 Å²	23	91.8 Å²	91.8	16%	0.161	47%	0.471	C	S	.	.			trans	-109.1	9.7	-180	-50.8	0	0	0	0	114	F279 S285 L301	F279-S283 WeakPolarHBondContact CA-OG 3.36Å; F279-S283 WeakPolarHBondContact CD2-OG 3.43Å; F279-S283 VanDerWaalsContact CE2-OG 3.26Å; F279-S283 WeakPolarHBondContact CE2-OG 3.42Å; F279-S283 WeakPolarHBondContact CG-OG 3.4Å; F279-S283 WeakPolarHBondContact O-CB 3.32Å; F279-S283 PolarHBondContact O-N 2.99Å; F279-S283 PolarHBondContact O-OG 3.36Å; S283-S285 PolarHBondContact O-N 2.94Å; S283-S285 VanDerWaalsContact O-N 3.14Å; S283-L301 WeakPolarHBondContact CB-O 3.33Å; S283-L301 PolarHBondContact OG-O 2.65Å
284	K	66.4	Low	65.7	Low	181 Å²	181	93.6 Å²	93.6	79%	0.787	50%	0.5	S	S	*	.			trans	-79.3	100.3	-178.4	-70.3	-171.4	179.2	-176.5	0	111.3
285	S	52.2	Low	63.2	Low	55 Å²	55	98.2 Å²	98.2	39%	0.385	53%	0.525	S	S	.	.			trans	-85.8	119.2	159.9	172.5	0	0	0	0	108.7	S283 K298	S283-S285 PolarHBondContact O-N 2.94Å; S283-S285 VanDerWaalsContact O-N 3.14Å; S285-K298 WeakPolarHBondContact OG-CE 3.31Å; S285-K298 PolarHBondContact OG-NZ 2.79Å
286	E	42.5	Very low	60.7	Low	146 Å²	146	102 Å²	102	68%	0.682	55%	0.549	S	S	*	.			trans	52.6	110.4	158	-67	165.3	-146.5	0	0	118.4	K298	E286-K298 IonicContact OE1-NZ 2.77Å; E286-K298 PolarHBondContact OE1-NZ 2.93Å
287	T	38.4	Very low	58.5	Low	141 Å²	141	102.9 Å²	102.9	87%	0.865	56%	0.557	S	S	*	*			trans	177.4	127.7	130.9	28.3	0	0	0	0	110.9
288	S	36.7	Very low	56.8	Low	102 Å²	102	107.7 Å²	107.7	71%	0.713	58%	0.577	S	S	*	*	S	Bend	trans	89.6	104.4	157.5	-35.6	0	0	0	0	119.3
289	D	36.9	Very low	55.3	Low	148 Å²	148	110.1 Å²	110.1	79%	0.791	59%	0.589	S	S	*	*			trans	61.9	67.6	138.2	-51.8	-24.1	0	0	0	119.7
290	N	37.9	Very low	54.6	Low	169 Å²	169	111.3 Å²	111.3	90%	0.904	60%	0.598	S	S	*	*			trans	-163	96.8	137.8	-91.4	-31	0	0	0	111	M292	N290-M292 PolarHBondContact O-N 3.41Å
291	Q	32.2	Very low	54.4	Low	190 Å²	190	104.7 Å²	104.7	89%	0.888	57%	0.573	S	S	*	*			trans	-61.8	110.7	158.1	-94.6	172.2	23.3	0	0	108.7
292	M	33.9	Very low	54.5	Low	185 Å²	185	102 Å²	102	91%	0.911	57%	0.567	S	S	*	*			trans	165.6	82.1	144.6	-94.6	147.4	65	0	0	110.5	N290	N290-M292 PolarHBondContact O-N 3.41Å
293	S	40	Very low	54.7	Low	98 Å²	98	104.4 Å²	104.4	69%	0.685	58%	0.578	S	S	*	*			trans	171.1	109	145.5	55.4	0	0	0	0	108.9	D295	S293-D295 VanDerWaalsContact C-N 3.34Å; S293-D295 PolarHBondContact O-N 2.99Å; S293-D295 VanDerWaalsContact O-N 3.11Å
294	G	36.3	Very low	55.3	Low	81 Å²	81	109.1 Å²	109.1	84%	0.835	60%	0.601	S	S	*	*			trans	-82.9	41.3	-165.2	0	0	0	0	0	117.2
295	D	44.2	Very low	56.6	Low	98 Å²	98	103.1 Å²	103.1	52%	0.524	58%	0.576	S	S	.	*			trans	-151	76.5	179.5	-153.5	37.8	0	0	0	111.2	R90 S293	R90-D295 IonicContact CZ-OD1 2.69Å; R90-D295 IonicContact NH1-OD1 3.77Å; R90-D295 IonicContact NH2-OD1 3.64Å; R90-D295 PolarHBondContact NH2-OD1 2.94Å; R90-D295 IonicContact NH2-OD2 3.69Å; S293-D295 VanDerWaalsContact C-N 3.34Å; S293-D295 PolarHBondContact O-N 2.99Å; S293-D295 VanDerWaalsContact O-N 3.11Å
296	N	44	Very low	58.7	Low	127 Å²	127	100.5 Å²	100.5	68%	0.679	56%	0.558	S	S	*	*			trans	-143.6	79.6	172.3	-80.9	-43.6	0	0	0	108.7	K298	N296-K298 PolarHBondContact O-N 3.18Å; N296-K298 VanDerWaalsContact O-N 3.1Å
297	S	51.7	Low	61.3	Low	54 Å²	54	95.6 Å²	95.6	38%	0.378	54%	0.536	S	S	.	.			trans	-47.2	120.5	165	-46.7	0	0	0	0	108.3	D84 I299	D84-S297 WeakPolarHBondContact CB-OG 3.39Å; S297-I299 WeakPolarHBondContact O-CG1 3.36Å; S297-I299 PolarHBondContact O-N 2.68Å
298	K	58.5	Low	64.1	Low	117 Å²	117	88.9 Å²	88.9	51%	0.509	50%	0.495	S	S	.	.			trans	-41.7	95.4	-175.2	-166.5	172.6	-179.1	151.3	0	111.4	S285 E286 N296 I300	S285-K298 WeakPolarHBondContact OG-CE 3.31Å; S285-K298 PolarHBondContact OG-NZ 2.79Å; E286-K298 IonicContact OE1-NZ 2.77Å; E286-K298 PolarHBondContact OE1-NZ 2.93Å; N296-K298 PolarHBondContact O-N 3.18Å; N296-K298 VanDerWaalsContact O-N 3.1Å; K298-I300 HydrophobicContact CD-CD1 4.05Å; K298-I300 HydrophobicContact CG-CD1 3.97Å; K298-I300 HydrophobicContact CG-CG1 3.96Å; K298-I300 PolarHBondContact O-N 3.33Å; K298-I300 VanDerWaalsContact O-N 3.11Å
299	I	62.5	Low	67	Low	51 Å²	51	84.1 Å²	84.1	26%	0.262	46%	0.462	S	S	.	.			trans	-74.4	107.4	178.8	-58	179.8	0	0	0	107.1	I239 S297	I239-I299 HydrophobicContact CB-CG2 3.75Å; I239-I299 HydrophobicContact CD1-CG2 3.95Å; I239-I299 HydrophobicContact CG1-CG2 3.85Å; I239-I299 HydrophobicContact CG2-CG2 4.31Å; S297-I299 WeakPolarHBondContact O-CG1 3.36Å; S297-I299 PolarHBondContact O-N 2.68Å
300	I	78.7	Confident	69.9	Low	98 Å²	98	77.3 Å²	77.3	50%	0.503	43%	0.425	S	S	.	.			trans	-114.2	103.7	173.3	-58	172.9	0	0	0	106.5	K298	K298-I300 HydrophobicContact CD-CD1 4.05Å; K298-I300 HydrophobicContact CG-CD1 3.97Å; K298-I300 HydrophobicContact CG-CG1 3.96Å; K298-I300 PolarHBondContact O-N 3.33Å; K298-I300 VanDerWaalsContact O-N 3.11Å
301	L	88.8	Confident	72.7	Confident	1 Å²	1	70.1 Å²	70.1	1%	0.005	39%	0.386	C	S	.	.			trans	-94.1	134.1	167	-177.9	64.9	0	0	0	109.4	I239 L242 L278 F279 Y282 S283 Q305 I306	I239-L301 HydrophobicContact CD1-CB 4.22Å; I239-L301 HydrophobicContact CD1-CD1 4.34Å; I239-L301 HydrophobicContact CD1-CD2 4.16Å; I239-L301 HydrophobicContact CD1-CG 4.48Å; I239-L301 HydrophobicContact CG1-CB 4.07Å; I239-L301 HydrophobicContact CG1-CD1 3.93Å; I239-L301 HydrophobicContact CG1-CG 4.42Å; L242-L301 HydrophobicContact CD2-CD1 4.3Å; L242-L301 HydrophobicContact CD2-CD2 3.95Å; L278-L301 HydrophobicContact CB-CD2 4.17Å; F279-L301 WeakPolarHBondContact CD2-O 3.22Å; Y282-L301 PolarHBondContact O-N 3.19Å; S283-L301 WeakPolarHBondContact CB-O 3.33Å; S283-L301 PolarHBondContact OG-O 2.65Å; L301-Q305 HydrophobicContact CD1-CB 4.21Å; L301-I306 HydrophobicContact CD1-CG1 3.93Å; L301-I306 HydrophobicContact CD2-CD1 3.7Å; L301-I306 HydrophobicContact CD2-CG1 3.93Å; L301-I306 HydrophobicContact CG-CD1 4.15Å; L301-I306 HydrophobicContact CG-CG1 4.09Å
302	S	91.9	Very high	75.8	Confident	45 Å²	45	61 Å²	61	32%	0.315	34%	0.343	S	S	.	.			trans	-106.5	152.9	166.1	-176.1	0	0	0	0	110.9	D304 Q305	S302-D304 VanDerWaalsContact C-N 3.27Å; S302-D304 WeakPolarHBondContact CB-OD1 3.47Å; S302-D304 PolarHBondContact O-N 2.71Å; S302-D304 PolarHBondContact OG-OD1 2.6Å; S302-Q305 WeakPolarHBondContact O-CB 3.38Å; S302-Q305 PolarHBondContact O-N 3.45Å
303	K	93.7	Very high	78.6	Confident	82 Å²	82	53.1 Å²	53.1	36%	0.357	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-63.7	-32.8	-176.6	-67.7	-176.3	-170.8	-179.5	0	112.9	R275 D276 F279 Q305 I306	R275-K303 PolarHBondContact NE-O 2.92Å; D276-K303 WeakPolarHBondContact OD1-CE 3.32Å; D276-K303 IonicContact OD1-NZ 3.84Å; D276-K303 PolarHBondContact OD1-NZ 3.34Å; F279-K303 HydrophobicContact CB-CG 3.72Å; F279-K303 HydrophobicContact CD1-CG 4.44Å; F279-K303 HydrophobicContact CD2-CG 3.78Å; F279-K303 HydrophobicContact CG-CD 4.41Å; F279-K303 HydrophobicContact CG-CG 3.72Å; K303-Q305 PolarHBondContact O-N 2.59Å; K303-I306 WeakPolarHBondContact O-CB 3.27Å; K303-I306 PolarHBondContact O-N 3Å
304	D	94	Very high	81.2	Confident	122 Å²	122	49 Å²	49	65%	0.652	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-73.6	-13.6	176.3	63.1	-26.6	0	0	0	113.1	S302 I306	S302-D304 VanDerWaalsContact C-N 3.27Å; S302-D304 WeakPolarHBondContact CB-OD1 3.47Å; S302-D304 PolarHBondContact O-N 2.71Å; S302-D304 PolarHBondContact OG-OD1 2.6Å; D304-I306 VanDerWaalsContact C-N 3.29Å
305	Q	94.6	Very high	83.8	Confident	55 Å²	55	48 Å²	48	26%	0.257	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-85.8	-0.9	169.6	-61.2	176	-62.2	0	0	112.8	L301 S302 K303 H325 I326	L301-Q305 HydrophobicContact CD1-CB 4.21Å; S302-Q305 WeakPolarHBondContact O-CB 3.38Å; S302-Q305 PolarHBondContact O-N 3.45Å; K303-Q305 PolarHBondContact O-N 2.59Å; Q305-H325 CarbonylContact O-C 3.54Å; Q305-H325 WeakPolarHBondContact O-CA 3.05Å; Q305-I326 HydrophobicContact CB-CG2 4.18Å; Q305-I326 HydrophobicContact CG-CG2 4.44Å; Q305-I326 PolarHBondContact O-N 2.86Å
306	I	95.8	Very high	86.1	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.005	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	104.9	179.5	-52.8	169.6	0	0	0	109.3	L242 R275 L278 L301 K303 D304 F323 V324	L242-I306 HydrophobicContact CD2-CG1 4.47Å; R275-I306 HydrophobicContact CB-CD1 4.37Å; R275-I306 HydrophobicContact CG-CB 4.15Å; R275-I306 HydrophobicContact CG-CD1 4.34Å; R275-I306 HydrophobicContact CG-CG2 4.15Å; R275-I306 PolarHBondContact NE-O 2.86Å; R275-I306 VanDerWaalsContact NE-O 3.12Å; R275-I306 PolarHBondContact NH2-O 3.44Å; L278-I306 HydrophobicContact CB-CD1 3.86Å; L278-I306 HydrophobicContact CD1-CD1 4.47Å; L278-I306 HydrophobicContact CD1-CG2 4.12Å; L301-I306 HydrophobicContact CD1-CG1 3.93Å; L301-I306 HydrophobicContact CD2-CD1 3.7Å; L301-I306 HydrophobicContact CD2-CG1 3.93Å; L301-I306 HydrophobicContact CG-CD1 4.15Å; L301-I306 HydrophobicContact CG-CG1 4.09Å; K303-I306 WeakPolarHBondContact O-CB 3.27Å; K303-I306 PolarHBondContact O-N 3Å; D304-I306 VanDerWaalsContact C-N 3.29Å; I306-F323 HydrophobicContact CG2-CB 4.21Å; I306-F323 HydrophobicContact CG2-CD1 3.8Å; I306-V324 CarbonylContact C-O 3.57Å; I306-V324 WeakPolarHBondContact CA-O 3.47Å
307	L	96.1	Very high	88.5	Confident	43 Å²	43	41.8 Å²	41.8	23%	0.225	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	128.2	174.3	176.3	64.8	0	0	0	110.1	Y309 F323 V324 T334 I341	L307-Y309 HydrophobicContact CD2-CD1 4.19Å; L307-Y309 HydrophobicContact CG-CD1 4.09Å; L307-F323 WeakPolarHBondContact O-CA 3.15Å; L307-V324 HydrophobicContact CB-CG2 3.95Å; L307-V324 HydrophobicContact CD2-CG2 4.17Å; L307-V324 HydrophobicContact CG-CG2 4.36Å; L307-V324 PolarHBondContact N-O 2.96Å; L307-V324 PolarHBondContact O-N 3.38Å; L307-T334 HydrophobicContact CD2-CG2 4.12Å; L307-I341 HydrophobicContact CD1-CG1 4.39Å; L307-I341 HydrophobicContact CD1-CG2 4.42Å
308	A	97.5	Very high	90.6	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	129.8	174.3	0	0	0	0	0	110.9	L271 V321 H322 F323 L342	L271-A308 HydrophobicContact CD1-CB 3.56Å; A308-V321 HydrophobicContact CB-CG1 4.22Å; A308-H322 CarbonylContact C-O 3.58Å; A308-H322 VanDerWaalsContact CA-O 3.22Å; A308-H322 WeakPolarHBondContact CA-O 3.38Å; A308-F323 HydrophobicContact CB-CD1 3.91Å; A308-F323 HydrophobicContact CB-CE1 3.72Å; A308-F323 HydrophobicContact CB-CZ 4.3Å; A308-L342 HydrophobicContact CB-CB 3.91Å; A308-L342 HydrophobicContact CB-CD2 4.11Å; A308-L342 PolarHBondContact O-N 3.06Å
309	Y	97.6	Very high	92.5	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.008	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	163.6	-178.8	66.5	-82.8	0	0	0	113.2	L307 H311 H322 V324 T334 A339 H340	L307-Y309 HydrophobicContact CD2-CD1 4.19Å; L307-Y309 HydrophobicContact CG-CD1 4.09Å; Y309-H311 AromaticContact CE2-CD2 3.81Å; Y309-H311 AromaticContact CE2-NE2 3.55Å; Y309-H322 HydrophobicContact CD1-CB 4.04Å; Y309-H322 HydrophobicContact CD2-CB 4.24Å; Y309-H322 HydrophobicContact CE1-CB 3.66Å; Y309-H322 HydrophobicContact CE2-CB 3.88Å; Y309-H322 AromaticContact CE2-CD2 3.94Å; Y309-H322 HydrophobicContact CG-CB 4.32Å; Y309-H322 PolarHBondContact N-O 3.26Å; Y309-H322 PolarHBondContact O-N 3.27Å; Y309-V324 HydrophobicContact CD1-CG2 4.39Å; Y309-V324 HydrophobicContact CE1-CB 4.43Å; Y309-V324 HydrophobicContact CE1-CG1 3.88Å; Y309-V324 HydrophobicContact CE1-CG2 3.67Å; Y309-T334 HydrophobicContact CE1-CG2 3.94Å; Y309-A339 HydrophobicContact CD2-CB 3.48Å; Y309-A339 VanDerWaalsContact CD2-CB 3.48Å; Y309-A339 HydrophobicContact CE2-CB 4.05Å; Y309-A339 HydrophobicContact CG-CB 4.06Å; Y309-H340 CarbonylContact C-O 3.54Å; Y309-H340 WeakPolarHBondContact CA-O 3.19Å; Y309-H340 WeakPolarHBondContact CB-O 3.45Å
310	I	97.6	Very high	94.1	Very high	4 Å²	4	32.8 Å²	32.8	2%	0.021	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	141.3	178.2	-63.4	150.4	0	0	0	108.6	L259 F319 V321 A339 H340 L342 V345	L259-I310 HydrophobicContact CD1-CD1 4.36Å; I310-F319 HydrophobicContact CD1-CE2 3.69Å; I310-F319 HydrophobicContact CD1-CZ 3.54Å; I310-F319 HydrophobicContact CG1-CE2 4.03Å; I310-F319 HydrophobicContact CG1-CZ 3.94Å; I310-F319 HydrophobicContact CG2-CE2 4.09Å; I310-V321 HydrophobicContact CG1-CG2 4.07Å; I310-A339 CarbonylContact O-C 3.47Å; I310-A339 WeakPolarHBondContact O-CA 2.97Å; I310-H340 PolarHBondContact N-O 3.13Å; I310-H340 PolarHBondContact O-N 3.31Å; I310-L342 HydrophobicContact CD1-CD1 3.92Å; I310-V345 HydrophobicContact CD1-CB 4.36Å; I310-V345 HydrophobicContact CD1-CG1 4.03Å; I310-V345 HydrophobicContact CD1-CG2 4.09Å
311	H	96.8	Very high	95.1	Very high	18 Å²	18	28.1 Å²	28.1	8%	0.083	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	137.7	171.4	-76	143.2	0	0	0	112.3	Y309 H322 G333 R338	Y309-H311 AromaticContact CE2-CD2 3.81Å; Y309-H311 AromaticContact CE2-NE2 3.55Å; H311-H322 AromaticContact CE1-CD2 3.75Å; H311-H322 AromaticContact CE1-CE1 3.83Å; H311-H322 AromaticContact CE1-NE2 3.33Å; H311-H322 PolarHBondContact CE1-NE2 3.25Å; H311-H322 VanDerWaalsContact CE1-NE2 3.33Å; H311-H322 AromaticContact CG-NE2 3.73Å; H311-H322 AromaticContact ND1-CD2 3.5Å; H311-H322 PolarHBondContact ND1-CD2 3.49Å; H311-H322 AromaticContact ND1-CE1 3.7Å; H311-H322 AromaticContact ND1-NE2 2.87Å; H311-H322 PolarHBondContact ND1-NE2 2.97Å; H311-G333 PolarHBondContact CD2-O 3.01Å; H311-G333 WeakPolarHBondContact NE2-CA 3.35Å; H311-G333 PolarHBondContact NE2-O 2.72Å; H311-G333 VanDerWaalsContact NE2-O 3.13Å; H311-R338 CarbonylContact C-O 3.59Å; H311-R338 VanDerWaalsContact CA-O 3.28Å; H311-R338 WeakPolarHBondContact CA-O 3.47Å
312	Y	96.6	Very high	95.5	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.147	C	C	.	.	S	Bend	trans	-137.2	124.6	165.4	-163.5	-97.1	0	0	0	112.1	E179 Y184 C255 L256 R257 R338 H340 I361 M363	E179-Y312 PolarHBondContact OE1-OH 2.82Å; E179-Y312 WeakPolarHBondContact OE2-CE1 3.4Å; E179-Y312 PolarHBondContact OE2-OH 2.78Å; Y184-Y312 WeakPolarHBondContact CD2-OH 3.2Å; C255-Y312 HydrophobicContact CB-CE2 4.39Å; L256-Y312 HydrophobicContact CB-CD2 3.54Å; L256-Y312 HydrophobicContact CB-CE2 4.1Å; L256-Y312 HydrophobicContact CB-CG 4.23Å; L256-Y312 HydrophobicContact CD2-CD2 4.28Å; L256-Y312 HydrophobicContact CD2-CG 4.15Å; R257-Y312 HydrophobicContact CG-CE2 3.92Å; R257-Y312 VanDerWaalsContact CG-OH 3.25Å; R257-Y312 WeakPolarHBondContact CG-OH 3.27Å; R257-Y312 PolarHBondContact NE-OH 3.05Å; Y312-R338 PolarHBondContact N-O 2.65Å; Y312-R338 WeakPolarHBondContact O-CA 3.36Å; Y312-H340 WeakPolarHBondContact CB-NE2 3.32Å; Y312-I361 HydrophobicContact CD1-CB 4.19Å; Y312-I361 HydrophobicContact CD1-CD1 4.27Å; Y312-I361 HydrophobicContact CD1-CG2 3.44Å; Y312-I361 VanDerWaalsContact CD1-CG2 3.44Å; Y312-I361 HydrophobicContact CE1-CB 3.97Å; Y312-I361 HydrophobicContact CE1-CD1 3.93Å; Y312-I361 HydrophobicContact CE1-CG2 3.76Å; Y312-I361 HydrophobicContact CE2-CD1 4.49Å; Y312-I361 HydrophobicContact CG-CG2 4.3Å; Y312-M363 HydrophobicContact CE1-SD 4.23Å
313	P	94.3	Very high	95.7	Very high	19 Å²	19	26.5 Å²	26.5	12%	0.123	13%	0.132	C	C	.	.	S	Bend	cis	-68.1	145.9	-10.3	29.7	-33.7	0	0	0	110.6	M363 L365	P313-M363 HydrophobicContact CG-SD 4.05Å; P313-L365 HydrophobicContact CG-CD2 3.86Å
314	P	94.5	Very high	95.7	Very high	12 Å²	12	22.6 Å²	22.6	8%	0.078	12%	0.115	C	C	.	.			trans	-72.4	158	175.3	32.6	-36.1	0	0	0	110.9	C255 F316 Y317	C255-P314 HydrophobicContact CB-CG 3.86Å; P314-F316 WeakPolarHBondContact CB-O 3.41Å; P314-Y317 HydrophobicContact CG-CD1 4.2Å; P314-Y317 HydrophobicContact CG-CD2 4.33Å; P314-Y317 HydrophobicContact CG-CE1 4.15Å; P314-Y317 HydrophobicContact CG-CE2 4.27Å; P314-Y317 HydrophobicContact CG-CG 4.3Å
315	T	89.8	Confident	95.7	Very high	58 Å²	58	16.9 Å²	16.9	36%	0.356	8%	0.084	S	C	.	.	S	Bend	trans	-72.9	-37.7	172	-61.6	0	0	0	0	111.5	K197	K197-T315 WeakPolarHBondContact CD-O 3.47Å; K197-T315 WeakPolarHBondContact CE-O 3.2Å; K197-T315 PolarHBondContact NZ-O 2.74Å
316	F	92.9	Very high	95.5	Very high	60 Å²	60	19.1 Å²	19.1	26%	0.263	10%	0.097	S	C	.	.	S	Bend	trans	-118.8	128	176.4	-60.7	-81.5	0	0	0	108.3	K197 L199 W201 I202 P314 R318	K197-F316 HydrophobicContact CB-CD1 4.44Å; K197-F316 HydrophobicContact CD-CD1 4.21Å; K197-F316 HydrophobicContact CD-CE1 4.42Å; L199-F316 HydrophobicContact CD2-CB 3.9Å; L199-F316 HydrophobicContact CD2-CD1 4Å; L199-F316 HydrophobicContact CD2-CG 4.42Å; W201-F316 AromaticContact CZ2-CD2 3.74Å; W201-F316 HydrophobicContact CZ2-CD2 3.74Å; W201-F316 AromaticContact CZ2-CE2 3.81Å; W201-F316 HydrophobicContact CZ2-CE2 3.81Å; W201-F316 HydrophobicContact CZ2-CG 4.19Å; W201-F316 HydrophobicContact CZ2-CZ 4.33Å; W201-F316 AromaticContact NE1-CD1 3.75Å; W201-F316 AromaticContact NE1-CE1 3.47Å; W201-F316 AromaticContact NE1-CE2 3.97Å; W201-F316 AromaticContact NE1-CZ 3.59Å; I202-F316 HydrophobicContact CD1-CB 3.82Å; I202-F316 HydrophobicContact CD1-CG 4.27Å; P314-F316 WeakPolarHBondContact CB-O 3.41Å; F316-R318 PolarHBondContact O-N 3.04Å
317	Y	95.4	Very high	95.2	Very high	36 Å²	36	24.1 Å²	24.1	14%	0.141	12%	0.124	C	C	.	.	S	Bend	trans	-80.7	58.7	-178.7	-82.9	-96.2	0	0	0	111.1	L192 T254 C255 P314 M371	L192-Y317 HydrophobicContact CD1-CD1 3.71Å; L192-Y317 HydrophobicContact CD1-CD2 4.27Å; L192-Y317 HydrophobicContact CD1-CE1 3.24Å; L192-Y317 HydrophobicContact CD1-CE2 3.88Å; L192-Y317 HydrophobicContact CD1-CG 4.19Å; L192-Y317 HydrophobicContact CD2-CD2 3.69Å; L192-Y317 HydrophobicContact CD2-CE1 4.28Å; L192-Y317 HydrophobicContact CD2-CE2 3.26Å; L192-Y317 HydrophobicContact CD2-CG 4.36Å; L192-Y317 HydrophobicContact CG-CE1 4.38Å; L192-Y317 HydrophobicContact CG-CE2 4.2Å; T254-Y317 WeakPolarHBondContact CB-O 3.25Å; T254-Y317 CarbonylContact O-C 3.49Å; C255-Y317 HydrophobicContact CB-CD1 4.07Å; C255-Y317 HydrophobicContact CB-CE1 4.08Å; P314-Y317 HydrophobicContact CG-CD1 4.2Å; P314-Y317 HydrophobicContact CG-CD2 4.33Å; P314-Y317 HydrophobicContact CG-CE1 4.15Å; P314-Y317 HydrophobicContact CG-CE2 4.27Å; P314-Y317 HydrophobicContact CG-CG 4.3Å; Y317-M371 HydrophobicContact CE2-CE 4.33Å; Y317-M371 VanDerWaalsContact OH-CE 3.29Å; Y317-M371 WeakPolarHBondContact OH-CE 3.21Å
318	R	95	Very high	94.4	Very high	8 Å²	8	23.2 Å²	23.2	3%	0.03	12%	0.121	C	C	.	.	S	Bend	trans	-131.8	128.7	163.9	-179.2	61.4	63.9	107.3	17.4	106.4	L199 I202 D203 I247 H249 Q251 T254 F316 H320	L199-R318 HydrophobicContact CD1-CB 4.48Å; I202-R318 HydrophobicContact CD1-CB 3.79Å; I202-R318 HydrophobicContact CD1-CG 4.41Å; I202-R318 HydrophobicContact CG2-CB 4.44Å; I202-R318 HydrophobicContact CG2-CG 3.94Å; D203-R318 IonicContact OD1-CZ 3.87Å; D203-R318 IonicContact OD1-NH1 3.52Å; D203-R318 IonicContact OD1-NH2 3.23Å; D203-R318 PolarHBondContact OD1-NH2 2.88Å; I247-R318 HydrophobicContact CG2-CG 4.28Å; H249-R318 PolarHBondContact O-NH1 3.42Å; H249-R318 VanDerWaalsContact O-NH1 3.09Å; Q251-R318 VanDerWaalsContact CA-CZ 3.45Å; Q251-R318 VanDerWaalsContact CA-NH1 3.33Å; T254-R318 CarbonylContact O-C 3.58Å; T254-R318 VanDerWaalsContact O-C 3.28Å; T254-R318 PolarHBondContact O-N 2.69Å; F316-R318 PolarHBondContact O-N 3.04Å; R318-H320 PolarHBondContact O-N 3.47Å; R318-H320 PolarHBondContact O-ND1 2.89Å
319	F	98.1	Very high	93	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.009	15%	0.148	C	C	.	.			trans	-63.8	127.3	-174.5	-179.1	-92.1	0	0	0	111.8	A248 L253 T254 L259 L267 I310 V321	A248-F319 HydrophobicContact CB-CB 4.32Å; A248-F319 HydrophobicContact CB-CD1 3.89Å; A248-F319 PolarHBondContact N-O 3.02Å; L253-F319 HydrophobicContact CB-CB 4.28Å; L253-F319 HydrophobicContact CD2-CB 3.77Å; L253-F319 HydrophobicContact CD2-CD1 3.74Å; L253-F319 HydrophobicContact CD2-CD2 4.44Å; L253-F319 HydrophobicContact CD2-CE1 4.45Å; L253-F319 HydrophobicContact CD2-CG 3.72Å; L253-F319 HydrophobicContact CG-CB 3.61Å; L253-F319 HydrophobicContact CG-CD1 4.46Å; L253-F319 HydrophobicContact CG-CD2 4.45Å; L253-F319 HydrophobicContact CG-CG 3.94Å; L253-F319 WeakPolarHBondContact O-CB 3.37Å; L253-F319 PolarHBondContact O-N 3.47Å; T254-F319 PolarHBondContact O-N 2.85Å; L259-F319 HydrophobicContact CD1-CE2 3.57Å; L259-F319 HydrophobicContact CD1-CZ 3.91Å; L259-F319 HydrophobicContact CD2-CD2 4.4Å; L259-F319 HydrophobicContact CD2-CE2 3.96Å; L259-F319 HydrophobicContact CD2-CZ 4.05Å; L259-F319 HydrophobicContact CG-CD2 4.44Å; L259-F319 HydrophobicContact CG-CE2 3.92Å; L259-F319 HydrophobicContact CG-CZ 4.4Å; L267-F319 HydrophobicContact CD2-CE1 3.71Å; L267-F319 HydrophobicContact CD2-CZ 3.58Å; I310-F319 HydrophobicContact CD1-CE2 3.69Å; I310-F319 HydrophobicContact CD1-CZ 3.54Å; I310-F319 HydrophobicContact CG1-CE2 4.03Å; I310-F319 HydrophobicContact CG1-CZ 3.94Å; I310-F319 HydrophobicContact CG2-CE2 4.09Å; F319-V321 HydrophobicContact CE1-CG2 3.94Å; F319-V321 HydrophobicContact CZ-CG2 4.13Å
320	H	97.6	Very high	91.4	Very high	22 Å²	22	27.2 Å²	27.2	10%	0.102	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	147.5	177	56	-80.1	0	0	0	111.4	G246 I247 R318 H322	G246-H320 CarbonylContact O-C 3.28Å; G246-H320 WeakPolarHBondContact O-CA 3.3Å; I247-H320 HydrophobicContact CG1-CB 4.34Å; R318-H320 PolarHBondContact O-N 3.47Å; R318-H320 PolarHBondContact O-ND1 2.89Å; H320-H322 AromaticContact CD2-CE1 3.57Å; H320-H322 AromaticContact CD2-NE2 3.24Å; H320-H322 PolarHBondContact CD2-NE2 3.22Å; H320-H322 AromaticContact NE2-CE1 3.78Å; H320-H322 AromaticContact NE2-NE2 3.3Å; H320-H322 PolarHBondContact NE2-NE2 3.4Å
321	V	98.1	Very high	89.8	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	133.3	174.3	176.8	0	0	0	0	108.4	L245 G246 I270 A308 I310 F319 F323 L342	L245-V321 CarbonylContact C-O 3.59Å; L245-V321 VanDerWaalsContact CA-O 3.3Å; L245-V321 WeakPolarHBondContact CA-O 3.39Å; G246-V321 PolarHBondContact N-O 3.02Å; G246-V321 PolarHBondContact O-N 3.06Å; I270-V321 HydrophobicContact CG2-CB 4.01Å; I270-V321 HydrophobicContact CG2-CG1 4.22Å; I270-V321 HydrophobicContact CG2-CG2 3.92Å; A308-V321 HydrophobicContact CB-CG1 4.22Å; I310-V321 HydrophobicContact CG1-CG2 4.07Å; F319-V321 HydrophobicContact CE1-CG2 3.94Å; F319-V321 HydrophobicContact CZ-CG2 4.13Å; V321-F323 HydrophobicContact CB-CE2 4.21Å; V321-F323 HydrophobicContact CG1-CD2 4.17Å; V321-F323 HydrophobicContact CG1-CE2 3.65Å; V321-F323 HydrophobicContact CG1-CZ 3.99Å; V321-L342 HydrophobicContact CG1-CD2 3.71Å; V321-L342 HydrophobicContact CG2-CD1 4.36Å; V321-L342 HydrophobicContact CG2-CD2 4.11Å
322	H	96.8	Very high	88.4	Confident	12 Å²	12	32.4 Å²	32.4	6%	0.056	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	135	170.5	-63.7	-79.4	0	0	0	110.3	H243 L245 A308 Y309 H311 H320	H243-H322 AromaticContact CE1-ND1 3.54Å; H243-H322 AromaticContact NE2-ND1 3.47Å; H243-H322 PolarHBondContact NE2-ND1 3.04Å; L245-H322 WeakPolarHBondContact CD2-ND1 3.35Å; A308-H322 CarbonylContact C-O 3.58Å; A308-H322 VanDerWaalsContact CA-O 3.22Å; A308-H322 WeakPolarHBondContact CA-O 3.38Å; Y309-H322 HydrophobicContact CD1-CB 4.04Å; Y309-H322 HydrophobicContact CD2-CB 4.24Å; Y309-H322 HydrophobicContact CE1-CB 3.66Å; Y309-H322 HydrophobicContact CE2-CB 3.88Å; Y309-H322 AromaticContact CE2-CD2 3.94Å; Y309-H322 HydrophobicContact CG-CB 4.32Å; Y309-H322 PolarHBondContact N-O 3.26Å; Y309-H322 PolarHBondContact O-N 3.27Å; H311-H322 AromaticContact CE1-CD2 3.75Å; H311-H322 AromaticContact CE1-CE1 3.83Å; H311-H322 AromaticContact CE1-NE2 3.33Å; H311-H322 PolarHBondContact CE1-NE2 3.25Å; H311-H322 VanDerWaalsContact CE1-NE2 3.33Å; H311-H322 AromaticContact CG-NE2 3.73Å; H311-H322 AromaticContact ND1-CD2 3.5Å; H311-H322 PolarHBondContact ND1-CD2 3.49Å; H311-H322 AromaticContact ND1-CE1 3.7Å; H311-H322 AromaticContact ND1-NE2 2.87Å; H311-H322 PolarHBondContact ND1-NE2 2.97Å; H320-H322 AromaticContact CD2-CE1 3.57Å; H320-H322 AromaticContact CD2-NE2 3.24Å; H320-H322 PolarHBondContact CD2-NE2 3.22Å; H320-H322 AromaticContact NE2-CE1 3.78Å; H320-H322 AromaticContact NE2-NE2 3.3Å; H320-H322 PolarHBondContact NE2-NE2 3.4Å
323	F	96.6	Very high	87.5	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	124.5	166.9	-67.4	-94.3	0	0	0	108.7	L228 H243 C244 I270 L278 I306 L307 A308 V321	L228-F323 HydrophobicContact CD2-CE2 4.02Å; H243-F323 WeakPolarHBondContact CA-O 3.27Å; C244-F323 HydrophobicContact CB-CB 4.05Å; C244-F323 PolarHBondContact N-O 3.27Å; C244-F323 PolarHBondContact O-N 3.13Å; I270-F323 HydrophobicContact CG2-CE2 3.86Å; I270-F323 HydrophobicContact CG2-CZ 3.77Å; I270-F323 WeakPolarHBondContact O-CZ 3.41Å; L278-F323 HydrophobicContact CD1-CB 3.86Å; L278-F323 HydrophobicContact CD1-CD1 4.4Å; L278-F323 HydrophobicContact CD1-CG 4.25Å; I306-F323 HydrophobicContact CG2-CB 4.21Å; I306-F323 HydrophobicContact CG2-CD1 3.8Å; L307-F323 WeakPolarHBondContact O-CA 3.15Å; A308-F323 HydrophobicContact CB-CD1 3.91Å; A308-F323 HydrophobicContact CB-CE1 3.72Å; A308-F323 HydrophobicContact CB-CZ 4.3Å; V321-F323 HydrophobicContact CB-CE2 4.21Å; V321-F323 HydrophobicContact CG1-CD2 4.17Å; V321-F323 HydrophobicContact CG1-CE2 3.65Å; V321-F323 HydrophobicContact CG1-CZ 3.99Å
324	V	94.5	Very high	87.1	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.006	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	161.2	179	-57.7	0	0	0	0	111.4	L242 I306 L307 Y309	L242-V324 VanDerWaalsContact O-CA 3.31Å; L242-V324 WeakPolarHBondContact O-CA 3.23Å; I306-V324 CarbonylContact C-O 3.57Å; I306-V324 WeakPolarHBondContact CA-O 3.47Å; L307-V324 HydrophobicContact CB-CG2 3.95Å; L307-V324 HydrophobicContact CD2-CG2 4.17Å; L307-V324 HydrophobicContact CG-CG2 4.36Å; L307-V324 PolarHBondContact N-O 2.96Å; L307-V324 PolarHBondContact O-N 3.38Å; Y309-V324 HydrophobicContact CD1-CG2 4.39Å; Y309-V324 HydrophobicContact CE1-CB 4.43Å; Y309-V324 HydrophobicContact CE1-CG1 3.88Å; Y309-V324 HydrophobicContact CE1-CG2 3.67Å
325	H	93.2	Very high	86.7	Confident	2 Å²	2	35.9 Å²	35.9	1%	0.009	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	142.9	165.1	-164.1	-87.9	0	0	0	110.4	I239 L242 Q305 D327 S328	I239-H325 WeakPolarHBondContact O-CB 3.32Å; L242-H325 HydrophobicContact CB-CB 4.27Å; Q305-H325 CarbonylContact O-C 3.54Å; Q305-H325 WeakPolarHBondContact O-CA 3.05Å; H325-D327 VanDerWaalsContact C-N 3.26Å; H325-D327 IonicContact CE1-OD2 2.82Å; H325-D327 PolarHBondContact CE1-OD2 3.33Å; H325-D327 VanDerWaalsContact CE1-OD2 3.3Å; H325-D327 WeakPolarHBondContact ND1-CB 3.38Å; H325-D327 PolarHBondContact ND1-N 3.04Å; H325-D327 IonicContact ND1-OD2 3.94Å; H325-D327 PolarHBondContact O-N 2.82Å; H325-S328 WeakPolarHBondContact O-CB 3.49Å; H325-S328 PolarHBondContact O-N 2.87Å; H325-S328 PolarHBondContact O-OG 3.21Å
326	I	91.7	Very high	86.6	Confident	101 Å²	101	37.6 Å²	37.6	52%	0.518	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-35.3	-180	-166.5	165.2	0	0	0	112.4	Q305 S328	Q305-I326 HydrophobicContact CB-CG2 4.18Å; Q305-I326 HydrophobicContact CG-CG2 4.44Å; Q305-I326 PolarHBondContact O-N 2.86Å; I326-S328 PolarHBondContact O-N 3.12Å
327	D	88.5	Confident	86.4	Confident	107 Å²	107	36.6 Å²	36.6	57%	0.572	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.1	14.5	173.6	-54.7	-37.6	0	0	0	113.7	Q240 H325 G329	Q240-D327 HydrophobicContact CG-CB 4.35Å; H325-D327 VanDerWaalsContact C-N 3.26Å; H325-D327 IonicContact CE1-OD2 2.82Å; H325-D327 PolarHBondContact CE1-OD2 3.33Å; H325-D327 VanDerWaalsContact CE1-OD2 3.3Å; H325-D327 WeakPolarHBondContact ND1-CB 3.38Å; H325-D327 PolarHBondContact ND1-N 3.04Å; H325-D327 IonicContact ND1-OD2 3.94Å; H325-D327 PolarHBondContact O-N 2.82Å; D327-G329 PolarHBondContact O-N 3.42Å
328	S	80.4	Confident	86.3	Confident	23 Å²	23	37.8 Å²	37.8	16%	0.161	22%	0.224	C	C	.	.			trans	-60.3	132.2	171.4	56.4	0	0	0	0	109.4	Q240 H325 I326	Q240-S328 VanDerWaalsContact O-CA 3.23Å; Q240-S328 WeakPolarHBondContact O-CA 3.49Å; Q240-S328 VanDerWaalsContact O-CB 3.27Å; Q240-S328 WeakPolarHBondContact O-CB 3.42Å; H325-S328 WeakPolarHBondContact O-CB 3.49Å; H325-S328 PolarHBondContact O-N 2.87Å; H325-S328 PolarHBondContact O-OG 3.21Å; I326-S328 PolarHBondContact O-N 3.12Å
329	G	67.3	Low	86.3	Confident	56 Å²	56	38.2 Å²	38.2	58%	0.577	23%	0.229	S	C	*	.			trans	-57.1	161.3	-178.5	0	0	0	0	0	112.6	D327 N331	D327-G329 PolarHBondContact O-N 3.42Å; G329-N331 PolarHBondContact O-N 3.11Å
330	D	64.6	Low	86.3	Confident	31 Å²	31	39.5 Å²	39.5	17%	0.166	24%	0.235	C	C	.	.			trans	-66.7	93.8	-179.6	-172.5	-6.5	0	0	0	111.5	R55 N56 Y332	R55-D330 IonicContact CZ-OD2 3.09Å; R55-D330 IonicContact NE-OD2 2.84Å; R55-D330 IonicContact NH1-OD2 2.65Å; R55-D330 PolarHBondContact NH1-OD2 2.78Å; R55-D330 IonicContact NH2-OD2 3.96Å; R55-D330 PolarHBondContact NH2-OD2 3.15Å; N56-D330 PolarHBondContact ND2-O 2.88Å; N56-D330 VanDerWaalsContact ND2-O 3.16Å; N56-D330 PolarHBondContact OD1-O 3.2Å; D330-Y332 VanDerWaalsContact C-N 3.35Å; D330-Y332 PolarHBondContact OD1-N 2.71Å
331	N	64.2	Low	86.3	Confident	71 Å²	71	42 Å²	42	38%	0.38	25%	0.249	S	C	.	.			trans	-96.5	18	176.2	64.5	10.6	0	0	0	112.6	G329 G333	G329-N331 PolarHBondContact O-N 3.11Å; N331-G333 PolarHBondContact O-N 3.43Å; N331-G333 WeakPolarHBondContact OD1-CA 3.37Å; N331-G333 PolarHBondContact OD1-N 3.14Å
332	Y	66	Low	86.3	Confident	60 Å²	60	42 Å²	42	24%	0.235	25%	0.249	C	C	.	.	S	Bend	trans	57.8	-1.6	-170.9	-51.7	-79.9	0	0	0	115.6	D53 D330 N335	D53-Y332 PolarHBondContact OD2-OH 3.16Å; D330-Y332 VanDerWaalsContact C-N 3.35Å; D330-Y332 PolarHBondContact OD1-N 2.71Å; Y332-N335 WeakPolarHBondContact CA-ND2 3.34Å; Y332-N335 PolarHBondContact O-ND2 2.77Å
333	G	78.2	Confident	86.4	Confident	5 Å²	5	43.7 Å²	43.7	5%	0.052	26%	0.257	C	S	.	.	S	Bend	trans	-72.2	-38.9	-179.2	0	0	0	0	0	111.5	H311 N331 N335 A339	H311-G333 PolarHBondContact CD2-O 3.01Å; H311-G333 WeakPolarHBondContact NE2-CA 3.35Å; H311-G333 PolarHBondContact NE2-O 2.72Å; H311-G333 VanDerWaalsContact NE2-O 3.13Å; N331-G333 PolarHBondContact O-N 3.43Å; N331-G333 WeakPolarHBondContact OD1-CA 3.37Å; N331-G333 PolarHBondContact OD1-N 3.14Å; G333-N335 VanDerWaalsContact C-N 3.34Å; G333-N335 PolarHBondContact O-N 2.95Å; G333-A339 WeakPolarHBondContact O-CB 3.23Å
334	T	86	Confident	86.4	Confident	51 Å²	51	47.6 Å²	47.6	31%	0.313	28%	0.275	S	S	.	.	S	Bend	trans	-87.7	7.3	-176.9	52.6	0	0	0	0	114.4	L307 Y309 A336	L307-T334 HydrophobicContact CD2-CG2 4.12Å; Y309-T334 HydrophobicContact CE1-CG2 3.94Å; T334-A336 PolarHBondContact O-N 3.08Å
335	N	86.9	Confident	86.6	Confident	47 Å²	47	47.6 Å²	47.6	25%	0.251	28%	0.275	S	S	.	.			trans	-61.6	137.2	177.9	-78.2	-22.3	0	0	0	111.8	Y332 G333 C337 R338 A339 F364	Y332-N335 WeakPolarHBondContact CA-ND2 3.34Å; Y332-N335 PolarHBondContact O-ND2 2.77Å; G333-N335 VanDerWaalsContact C-N 3.34Å; G333-N335 PolarHBondContact O-N 2.95Å; N335-C337 PolarHBondContact O-N 3.27Å; N335-R338 CarbonylContact O-C 3.45Å; N335-R338 WeakPolarHBondContact O-CA 3.46Å; N335-R338 PolarHBondContact O-N 3.05Å; N335-A339 PolarHBondContact O-N 2.85Å; N335-F364 HydrophobicContact CB-CE1 4.4Å
336	A	86.9	Confident	86.9	Confident	94 Å²	94	47.9 Å²	47.9	78%	0.777	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-26.8	-174.2	0	0	0	0	0	115.2	T334 R338	T334-A336 PolarHBondContact O-N 3.08Å; A336-R338 VanDerWaalsContact C-N 3.27Å; A336-R338 PolarHBondContact O-N 2.89Å
337	C	87.9	Confident	87.2	Confident	39 Å²	39	48.7 Å²	48.7	26%	0.264	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	17.4	175.9	-65.5	0	0	0	0	113.2	N335 M363 F364	N335-C337 PolarHBondContact O-N 3.27Å; C337-M363 WeakPolarHBondContact O-CA 3.44Å; C337-F364 HydrophobicContact CB-CD1 3.76Å
338	R	93.4	Very high	87.7	Confident	62 Å²	62	44.6 Å²	44.6	23%	0.234	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-143	-48.5	-179.7	-165.4	-172.8	-177.6	170.9	0.8	111.8	H311 Y312 N335 A336 F364	H311-R338 CarbonylContact C-O 3.59Å; H311-R338 VanDerWaalsContact CA-O 3.28Å; H311-R338 WeakPolarHBondContact CA-O 3.47Å; Y312-R338 PolarHBondContact N-O 2.65Å; Y312-R338 WeakPolarHBondContact O-CA 3.36Å; N335-R338 CarbonylContact O-C 3.45Å; N335-R338 WeakPolarHBondContact O-CA 3.46Å; N335-R338 PolarHBondContact O-N 3.05Å; A336-R338 VanDerWaalsContact C-N 3.27Å; A336-R338 PolarHBondContact O-N 2.89Å; R338-F364 HydrophobicContact CB-CE1 3.83Å; R338-F364 HydrophobicContact CB-CZ 4.48Å; R338-F364 HydrophobicContact CG-CE1 4.48Å
339	A	95.6	Very high	88.6	Confident	16 Å²	16	43.5 Å²	43.5	13%	0.132	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	129.9	179.1	0	0	0	0	0	111.9	Y309 I310 G333 N335	Y309-A339 HydrophobicContact CD2-CB 3.48Å; Y309-A339 VanDerWaalsContact CD2-CB 3.48Å; Y309-A339 HydrophobicContact CE2-CB 4.05Å; Y309-A339 HydrophobicContact CG-CB 4.06Å; I310-A339 CarbonylContact O-C 3.47Å; I310-A339 WeakPolarHBondContact O-CA 2.97Å; G333-A339 WeakPolarHBondContact O-CB 3.23Å; N335-A339 PolarHBondContact O-N 2.85Å
340	H	97.4	Very high	90.1	Very high	29 Å²	29	45.5 Å²	45.5	13%	0.134	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	113.1	168.7	-64.9	-91.2	0	0	0	108.9	L256 Y309 I310 Y312 L342 V345	L256-H340 HydrophobicContact CD2-CB 4.32Å; Y309-H340 CarbonylContact C-O 3.54Å; Y309-H340 WeakPolarHBondContact CA-O 3.19Å; Y309-H340 WeakPolarHBondContact CB-O 3.45Å; I310-H340 PolarHBondContact N-O 3.13Å; I310-H340 PolarHBondContact O-N 3.31Å; Y312-H340 WeakPolarHBondContact CB-NE2 3.32Å; H340-L342 PolarHBondContact O-N 3.17Å; H340-V345 HydrophobicContact CB-CG2 3.85Å
341	I	97.5	Very high	91.7	Very high	76 Å²	76	51.5 Å²	51.5	39%	0.39	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	130.9	-179.3	-59.6	174.2	0	0	0	109.6	L307 E343 E344 V345	L307-I341 HydrophobicContact CD1-CG1 4.39Å; L307-I341 HydrophobicContact CD1-CG2 4.42Å; I341-E343 VanDerWaalsContact C-N 3.32Å; I341-E343 HydrophobicContact CG2-CB 4.37Å; I341-E343 WeakPolarHBondContact CG2-OE2 3.27Å; I341-E343 PolarHBondContact O-N 3.19Å; I341-E344 HydrophobicContact CB-CB 4.43Å; I341-E344 HydrophobicContact CB-CG 4.03Å; I341-E344 HydrophobicContact CG2-CG 4.39Å; I341-E344 WeakPolarHBondContact O-CB 3.32Å; I341-E344 PolarHBondContact O-N 2.91Å; I341-E344 VanDerWaalsContact O-N 3.11Å; I341-V345 WeakPolarHBondContact O-CG2 3.35Å; I341-V345 PolarHBondContact O-N 3.41Å
342	L	98.4	Very high	93.3	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-62.7	-38.1	-171.6	179.5	57.1	0	0	0	112.2	L267 I270 L271 A308 I310 V321 H340 E344 V345 I346	L267-L342 HydrophobicContact CB-CD1 4.25Å; L267-L342 HydrophobicContact CD2-CD1 4.06Å; I270-L342 HydrophobicContact CG2-CD2 4.4Å; L271-L342 HydrophobicContact CB-CD2 3.79Å; L271-L342 HydrophobicContact CD1-CD2 4.04Å; L271-L342 HydrophobicContact CG-CD2 4.45Å; A308-L342 HydrophobicContact CB-CB 3.91Å; A308-L342 HydrophobicContact CB-CD2 4.11Å; A308-L342 PolarHBondContact O-N 3.06Å; I310-L342 HydrophobicContact CD1-CD1 3.92Å; V321-L342 HydrophobicContact CG1-CD2 3.71Å; V321-L342 HydrophobicContact CG2-CD1 4.36Å; V321-L342 HydrophobicContact CG2-CD2 4.11Å; H340-L342 PolarHBondContact O-N 3.17Å; L342-E344 VanDerWaalsContact C-N 3.31Å; L342-E344 PolarHBondContact O-N 3.09Å; L342-V345 WeakPolarHBondContact O-CB 3.07Å; L342-V345 PolarHBondContact O-N 3.2Å; L342-I346 HydrophobicContact CD1-CD1 4.24Å; L342-I346 HydrophobicContact CD1-CG1 4.29Å; L342-I346 HydrophobicContact CG-CD1 3.99Å; L342-I346 WeakPolarHBondContact O-CG1 3.28Å; L342-I346 PolarHBondContact O-N 3.48Å
343	E	98.3	Very high	94.9	Very high	47 Å²	47	51.5 Å²	51.5	22%	0.22	27%	0.269	C	S	.	.	H	α-helix	trans	-62.5	-36.4	175.6	-69.5	93.3	140	0	0	113.2	L271 R275 I341 R347	L271-E343 HydrophobicContact CD2-CG 3.71Å; R275-E343 IonicContact CZ-OE1 2.62Å; R275-E343 IonicContact NH1-OE1 3.9Å; R275-E343 PolarHBondContact NH1-OE1 2.62Å; R275-E343 IonicContact NH2-OE1 3.3Å; R275-E343 PolarHBondContact NH2-OE1 2.84Å; I341-E343 VanDerWaalsContact C-N 3.32Å; I341-E343 HydrophobicContact CG2-CB 4.37Å; I341-E343 WeakPolarHBondContact CG2-OE2 3.27Å; I341-E343 PolarHBondContact O-N 3.19Å; E343-R347 PolarHBondContact O-N 3.34Å; E343-R347 VanDerWaalsContact O-N 3.1Å; E343-R347 PolarHBondContact O-NE 2.92Å
344	E	98.3	Very high	95.8	Very high	82 Å²	82	54.5 Å²	54.5	38%	0.383	28%	0.283	S	S	.	.	H	α-helix	trans	-69.9	-41.4	174.2	-61.9	-62.7	161.6	0	0	110.1	I341 L342 I346 R347 N348	I341-E344 HydrophobicContact CB-CB 4.43Å; I341-E344 HydrophobicContact CB-CG 4.03Å; I341-E344 HydrophobicContact CG2-CG 4.39Å; I341-E344 WeakPolarHBondContact O-CB 3.32Å; I341-E344 PolarHBondContact O-N 2.91Å; I341-E344 VanDerWaalsContact O-N 3.11Å; L342-E344 VanDerWaalsContact C-N 3.31Å; L342-E344 PolarHBondContact O-N 3.09Å; E344-I346 VanDerWaalsContact C-N 3.34Å; E344-I346 PolarHBondContact O-N 2.52Å; E344-R347 PolarHBondContact O-N 2.77Å; E344-R347 IonicContact OE1-CZ 2.78Å; E344-R347 IonicContact OE1-NH1 3.68Å; E344-R347 IonicContact OE1-NH2 3.12Å; E344-R347 PolarHBondContact OE1-NH2 2.83Å; E344-R347 IonicContact OE2-CZ 2.71Å; E344-R347 IonicContact OE2-NE 2.65Å; E344-R347 IonicContact OE2-NH1 3.84Å; E344-R347 IonicContact OE2-NH2 2.6Å; E344-R347 PolarHBondContact OE2-NH2 3.3Å; E344-N348 WeakPolarHBondContact O-CB 3.12Å; E344-N348 PolarHBondContact O-N 3.13Å; E344-N348 PolarHBondContact O-ND2 2.8Å
345	V	98.6	Very high	96.4	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-59.3	-45.2	176.4	172.7	0	0	0	0	111.6	L256 L259 L267 I310 H340 I341 L342 N348 L349 Y356	L256-V345 HydrophobicContact CD1-CG1 4.13Å; L256-V345 HydrophobicContact CD1-CG2 4.13Å; L259-V345 HydrophobicContact CD1-CG1 3.61Å; L267-V345 HydrophobicContact CD1-CG1 4.28Å; I310-V345 HydrophobicContact CD1-CB 4.36Å; I310-V345 HydrophobicContact CD1-CG1 4.03Å; I310-V345 HydrophobicContact CD1-CG2 4.09Å; H340-V345 HydrophobicContact CB-CG2 3.85Å; I341-V345 WeakPolarHBondContact O-CG2 3.35Å; I341-V345 PolarHBondContact O-N 3.41Å; L342-V345 WeakPolarHBondContact O-CB 3.07Å; L342-V345 PolarHBondContact O-N 3.2Å; V345-N348 PolarHBondContact O-N 3.07Å; V345-L349 HydrophobicContact CG1-CD1 3.95Å; V345-L349 WeakPolarHBondContact O-CD1 3.43Å; V345-L349 WeakPolarHBondContact O-CG 3.14Å; V345-L349 PolarHBondContact O-N 3.33Å; V345-L349 VanDerWaalsContact O-N 3.14Å; V345-Y356 VanDerWaalsContact CA-OH 3.27Å; V345-Y356 WeakPolarHBondContact CA-OH 3.37Å; V345-Y356 HydrophobicContact CB-CE2 4.3Å; V345-Y356 HydrophobicContact CG1-CE2 3.79Å; V345-Y356 HydrophobicContact CG2-CE2 4.42Å; V345-Y356 VanDerWaalsContact CG2-OH 3.28Å; V345-Y356 WeakPolarHBondContact CG2-OH 3.24Å
346	I	98.8	Very high	97	Very high	9 Å²	9	52.8 Å²	52.8	5%	0.046	27%	0.268	C	S	.	.	H	α-helix	trans	-60	-52.8	175.7	-70.9	164.2	0	0	0	110.4	V264 L267 K268 L271 L342 E344 N348 L349 E350	V264-I346 HydrophobicContact CG1-CG2 4.17Å; L267-I346 HydrophobicContact CB-CD1 4.01Å; L267-I346 HydrophobicContact CB-CG1 3.71Å; L267-I346 HydrophobicContact CD1-CG1 4.21Å; K268-I346 HydrophobicContact CG-CD1 4.09Å; K268-I346 HydrophobicContact CG-CG2 4.09Å; L271-I346 HydrophobicContact CD2-CD1 4.11Å; L342-I346 HydrophobicContact CD1-CD1 4.24Å; L342-I346 HydrophobicContact CD1-CG1 4.29Å; L342-I346 HydrophobicContact CG-CD1 3.99Å; L342-I346 WeakPolarHBondContact O-CG1 3.28Å; L342-I346 PolarHBondContact O-N 3.48Å; E344-I346 VanDerWaalsContact C-N 3.34Å; E344-I346 PolarHBondContact O-N 2.52Å; I346-N348 VanDerWaalsContact C-N 3.32Å; I346-N348 PolarHBondContact O-N 2.84Å; I346-L349 PolarHBondContact O-N 2.89Å; I346-L349 VanDerWaalsContact O-N 3.13Å; I346-E350 HydrophobicContact CG2-CG 4.34Å; I346-E350 WeakPolarHBondContact O-CG 3.27Å; I346-E350 PolarHBondContact O-N 3.37Å
347	R	98.7	Very high	97.5	Very high	117 Å²	117	49.2 Å²	49.2	44%	0.442	24%	0.239	S	C	.	.	H	α-helix	trans	-60.6	-39.9	-178.9	-80.9	-174.2	-74.6	168.5	-9.8	113	E343 E344 L349 E350 Q351	E343-R347 PolarHBondContact O-N 3.34Å; E343-R347 VanDerWaalsContact O-N 3.1Å; E343-R347 PolarHBondContact O-NE 2.92Å; E344-R347 PolarHBondContact O-N 2.77Å; E344-R347 IonicContact OE1-CZ 2.78Å; E344-R347 IonicContact OE1-NH1 3.68Å; E344-R347 IonicContact OE1-NH2 3.12Å; E344-R347 PolarHBondContact OE1-NH2 2.83Å; E344-R347 IonicContact OE2-CZ 2.71Å; E344-R347 IonicContact OE2-NE 2.65Å; E344-R347 IonicContact OE2-NH1 3.84Å; E344-R347 IonicContact OE2-NH2 2.6Å; E344-R347 PolarHBondContact OE2-NH2 3.3Å; R347-L349 VanDerWaalsContact C-N 3.33Å; R347-L349 PolarHBondContact O-N 2.84Å; R347-E350 PolarHBondContact O-N 2.81Å; R347-Q351 WeakPolarHBondContact O-CG 3.29Å; R347-Q351 PolarHBondContact O-N 3.16Å; R347-Q351 VanDerWaalsContact O-N 3.1Å
348	N	98.6	Very high	98	Very high	21 Å²	21	52.2 Å²	52.2	11%	0.112	25%	0.252	C	S	.	.	H	α-helix	trans	-61.2	-42.5	176.5	-72	-32.1	0	0	0	111.8	E344 V345 I346 Q351 D352 Y355 Y356	E344-N348 WeakPolarHBondContact O-CB 3.12Å; E344-N348 PolarHBondContact O-N 3.13Å; E344-N348 PolarHBondContact O-ND2 2.8Å; V345-N348 PolarHBondContact O-N 3.07Å; I346-N348 VanDerWaalsContact C-N 3.32Å; I346-N348 PolarHBondContact O-N 2.84Å; N348-Q351 PolarHBondContact O-N 2.82Å; N348-D352 PolarHBondContact O-N 3.42Å; N348-Y355 HydrophobicContact CB-CD1 3.51Å; N348-Y355 HydrophobicContact CB-CD2 4.33Å; N348-Y355 HydrophobicContact CB-CE1 3.48Å; N348-Y355 VanDerWaalsContact CB-CE1 3.48Å; N348-Y355 HydrophobicContact CB-CE2 4.36Å; N348-Y355 HydrophobicContact CB-CG 3.91Å; N348-Y355 VanDerWaalsContact CG-CZ 3.49Å; N348-Y355 WeakPolarHBondContact ND2-CE1 3.36Å; N348-Y355 PolarHBondContact OD1-OH 3.47Å; N348-Y356 HydrophobicContact CB-CE2 4.11Å; N348-Y356 PolarHBondContact ND2-OH 3.43Å
349	L	98.7	Very high	98.2	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-75.8	-23	178.9	-71.1	163	0	0	0	113.7	L259 S261 V264 L267 V345 I346 R347 Q351 Y356	L259-L349 HydrophobicContact CB-CD1 3.77Å; L259-L349 HydrophobicContact CB-CD2 4.33Å; L259-L349 HydrophobicContact CD1-CD1 4.12Å; L259-L349 HydrophobicContact CG-CD1 4.49Å; S261-L349 PolarHBondContact OG-O 2.98Å; V264-L349 HydrophobicContact CG2-CB 3.65Å; L267-L349 HydrophobicContact CD1-CD1 3.84Å; V345-L349 HydrophobicContact CG1-CD1 3.95Å; V345-L349 WeakPolarHBondContact O-CD1 3.43Å; V345-L349 WeakPolarHBondContact O-CG 3.14Å; V345-L349 PolarHBondContact O-N 3.33Å; V345-L349 VanDerWaalsContact O-N 3.14Å; I346-L349 PolarHBondContact O-N 2.89Å; I346-L349 VanDerWaalsContact O-N 3.13Å; R347-L349 VanDerWaalsContact C-N 3.33Å; R347-L349 PolarHBondContact O-N 2.84Å; L349-Q351 VanDerWaalsContact C-N 3.32Å; L349-Y356 HydrophobicContact CD1-CD2 4.32Å; L349-Y356 HydrophobicContact CD1-CE2 4.27Å; L349-Y356 HydrophobicContact CD2-CD2 3.98Å; L349-Y356 HydrophobicContact CD2-CE2 4.48Å; L349-Y356 HydrophobicContact CG-CD2 4.02Å; L349-Y356 HydrophobicContact CG-CE2 4.03Å
350	E	98.6	Very high	98.3	Very high	98 Å²	98	55.3 Å²	55.3	46%	0.458	27%	0.267	S	S	.	.	H	α-helix	trans	-72.3	-29.2	169.4	-71.7	175.6	144.3	0	0	111.9	V264 K268 I346 R347	V264-E350 HydrophobicContact CG1-CG 3.96Å; V264-E350 HydrophobicContact CG2-CG 4.36Å; K268-E350 WeakPolarHBondContact CE-OE1 3.48Å; K268-E350 IonicContact NZ-OE1 2.84Å; K268-E350 PolarHBondContact NZ-OE1 3.34Å; I346-E350 HydrophobicContact CG2-CG 4.34Å; I346-E350 WeakPolarHBondContact O-CG 3.27Å; I346-E350 PolarHBondContact O-N 3.37Å; R347-E350 PolarHBondContact O-N 2.81Å
351	Q	98.4	Very high	98.3	Very high	157 Å²	157	54 Å²	54	73%	0.734	26%	0.261	S	S	*	.	H	α-helix	trans	-83.6	-39.9	177	-71	177.9	-5.5	0	0	112.7	R347 N348 L349	R347-Q351 WeakPolarHBondContact O-CG 3.29Å; R347-Q351 PolarHBondContact O-N 3.16Å; R347-Q351 VanDerWaalsContact O-N 3.1Å; N348-Q351 PolarHBondContact O-N 2.82Å; L349-Q351 VanDerWaalsContact C-N 3.32Å
352	D	98.6	Very high	98.3	Very high	65 Å²	65	52.8 Å²	52.8	35%	0.348	26%	0.257	S	S	.	.			trans	-148.3	115.7	-176.8	172.9	15	0	0	0	111.2	N348 L354 Y355	N348-D352 PolarHBondContact O-N 3.42Å; D352-L354 PolarHBondContact O-N 3.32Å; D352-L354 PolarHBondContact OD1-N 3.31Å; D352-Y355 HydrophobicContact CB-CD2 4.46Å; D352-Y355 VanDerWaalsContact O-CB 3.26Å; D352-Y355 WeakPolarHBondContact O-CB 3.37Å; D352-Y355 PolarHBondContact O-N 2.71Å; D352-Y355 VanDerWaalsContact O-N 3.14Å; D352-Y355 WeakPolarHBondContact OD2-CA 3.39Å; D352-Y355 PolarHBondContact OD2-N 3.11Å
353	D	98.5	Very high	98.1	Very high	66 Å²	66	52.8 Å²	52.8	35%	0.353	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-34.7	177.3	177.9	67.5	0	0	0	113	R260 S261	R260-D353 WeakPolarHBondContact CB-OD1 3.33Å; R260-D353 WeakPolarHBondContact CD-O 3.4Å; S261-D353 WeakPolarHBondContact CB-OD1 3.03Å; S261-D353 PolarHBondContact N-OD1 3.14Å; S261-D353 WeakPolarHBondContact OG-CA 2.89Å; S261-D353 VanDerWaalsContact OG-CB 3.29Å; S261-D353 WeakPolarHBondContact OG-CB 3.3Å; S261-D353 PolarHBondContact OG-OD1 2.86Å
354	L	98.3	Very high	97.8	Very high	69 Å²	69	52 Å²	52	36%	0.361	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	11.9	-175.5	-59.6	179.5	0	0	0	112.7	D352 Y356 A357 N358	D352-L354 PolarHBondContact O-N 3.32Å; D352-L354 PolarHBondContact OD1-N 3.31Å; L354-Y356 PolarHBondContact O-N 3.06Å; L354-A357 HydrophobicContact CB-CB 4.36Å; L354-A357 HydrophobicContact CD2-CB 4.45Å; L354-A357 WeakPolarHBondContact O-CA 3.36Å; L354-A357 WeakPolarHBondContact O-CB 3.43Å; L354-A357 PolarHBondContact O-N 2.9Å; L354-N358 VanDerWaalsContact CB-ND2 3.3Å; L354-N358 WeakPolarHBondContact CB-ND2 2.87Å; L354-N358 WeakPolarHBondContact O-CB 3.44Å; L354-N358 PolarHBondContact O-N 3.13Å
355	Y	98.6	Very high	97.4	Very high	59 Å²	59	48.3 Å²	48.3	23%	0.231	24%	0.236	C	C	.	.	H	α-helix	trans	-51.3	-52.3	-172.9	-176.6	-98	0	0	0	112.9	N348 D352 R359	N348-Y355 HydrophobicContact CB-CD1 3.51Å; N348-Y355 HydrophobicContact CB-CD2 4.33Å; N348-Y355 HydrophobicContact CB-CE1 3.48Å; N348-Y355 VanDerWaalsContact CB-CE1 3.48Å; N348-Y355 HydrophobicContact CB-CE2 4.36Å; N348-Y355 HydrophobicContact CB-CG 3.91Å; N348-Y355 VanDerWaalsContact CG-CZ 3.49Å; N348-Y355 WeakPolarHBondContact ND2-CE1 3.36Å; N348-Y355 PolarHBondContact OD1-OH 3.47Å; D352-Y355 HydrophobicContact CB-CD2 4.46Å; D352-Y355 VanDerWaalsContact O-CB 3.26Å; D352-Y355 WeakPolarHBondContact O-CB 3.37Å; D352-Y355 PolarHBondContact O-N 2.71Å; D352-Y355 VanDerWaalsContact O-N 3.14Å; D352-Y355 WeakPolarHBondContact OD2-CA 3.39Å; D352-Y355 PolarHBondContact OD2-N 3.11Å; Y355-R359 VanDerWaalsContact CZ-NH1 3.27Å; Y355-R359 VanDerWaalsContact O-CB 3.28Å; Y355-R359 WeakPolarHBondContact O-CB 3.35Å; Y355-R359 WeakPolarHBondContact O-CG 3.35Å; Y355-R359 PolarHBondContact O-N 2.54Å; Y355-R359 PolarHBondContact OH-NH1 3.29Å
356	Y	98.4	Very high	96.9	Very high	2 Å²	2	51 Å²	51	1%	0.008	25%	0.248	C	C	.	.	H	α-helix	trans	-77.5	-23.3	179.4	-69.2	-69	0	0	0	113.4	L256 R257 V345 N348 L349 L354 I361	L256-Y356 HydrophobicContact CD1-CD1 3.69Å; L256-Y356 HydrophobicContact CD1-CD2 3.96Å; L256-Y356 HydrophobicContact CD1-CE1 3.63Å; L256-Y356 HydrophobicContact CD1-CE2 3.92Å; L256-Y356 HydrophobicContact CD1-CG 3.86Å; L256-Y356 HydrophobicContact CD2-CD1 3.78Å; L256-Y356 HydrophobicContact CD2-CE1 3.72Å; L256-Y356 HydrophobicContact CG-CD1 3.49Å; L256-Y356 VanDerWaalsContact CG-CD1 3.49Å; L256-Y356 HydrophobicContact CG-CE1 3.77Å; L256-Y356 HydrophobicContact CG-CG 3.9Å; L256-Y356 VanDerWaalsContact O-CB 3.3Å; L256-Y356 WeakPolarHBondContact O-CB 3.46Å; R257-Y356 WeakPolarHBondContact CD-O 3.36Å; R257-Y356 PolarHBondContact NH1-O 3.48Å; V345-Y356 VanDerWaalsContact CA-OH 3.27Å; V345-Y356 WeakPolarHBondContact CA-OH 3.37Å; V345-Y356 HydrophobicContact CB-CE2 4.3Å; V345-Y356 HydrophobicContact CG1-CE2 3.79Å; V345-Y356 HydrophobicContact CG2-CE2 4.42Å; V345-Y356 VanDerWaalsContact CG2-OH 3.28Å; V345-Y356 WeakPolarHBondContact CG2-OH 3.24Å; N348-Y356 HydrophobicContact CB-CE2 4.11Å; N348-Y356 PolarHBondContact ND2-OH 3.43Å; L349-Y356 HydrophobicContact CD1-CD2 4.32Å; L349-Y356 HydrophobicContact CD1-CE2 4.27Å; L349-Y356 HydrophobicContact CD2-CD2 3.98Å; L349-Y356 HydrophobicContact CD2-CE2 4.48Å; L349-Y356 HydrophobicContact CG-CD2 4.02Å; L349-Y356 HydrophobicContact CG-CE2 4.03Å; L354-Y356 PolarHBondContact O-N 3.06Å; Y356-I361 HydrophobicContact CD1-CD1 4.37Å
357	A	98.1	Very high	96.4	Very high	20 Å²	20	52.1 Å²	52.1	17%	0.165	26%	0.258	C	S	.	.	H	α-helix	trans	-69.1	-38.5	173.7	0	0	0	0	0	111.5	P181 R257 L354	P181-A357 WeakPolarHBondContact CB-O 3.34Å; P181-A357 WeakPolarHBondContact CG-O 3.35Å; R257-A357 PolarHBondContact NH1-O 2.84Å; L354-A357 HydrophobicContact CB-CB 4.36Å; L354-A357 HydrophobicContact CD2-CB 4.45Å; L354-A357 WeakPolarHBondContact O-CA 3.36Å; L354-A357 WeakPolarHBondContact O-CB 3.43Å; L354-A357 PolarHBondContact O-N 2.9Å
358	N	98.1	Very high	95.8	Very high	101 Å²	101	49.4 Å²	49.4	54%	0.54	25%	0.253	S	S	.	.	H	α-helix	trans	-100.6	-24.4	-168.6	-68.3	-18.2	0	0	0	114.4	P181 L354	P181-N358 VanDerWaalsContact CG-C 3.49Å; P181-N358 WeakPolarHBondContact CG-O 3.26Å; L354-N358 VanDerWaalsContact CB-ND2 3.3Å; L354-N358 WeakPolarHBondContact CB-ND2 2.87Å; L354-N358 WeakPolarHBondContact O-CB 3.44Å; L354-N358 PolarHBondContact O-N 3.13Å
359	R	97.7	Very high	95.3	Very high	86 Å²	86	50.9 Å²	50.9	33%	0.325	26%	0.261	S	S	.	.	S	Bend	trans	-75	155.6	-176.6	73.4	179.3	-70.8	176.4	6.6	112.9	R257 Y355 I361	R257-R359 PolarHBondContact NH1-O 3.2Å; R257-R359 PolarHBondContact NH2-O 2.97Å; Y355-R359 VanDerWaalsContact CZ-NH1 3.27Å; Y355-R359 VanDerWaalsContact O-CB 3.28Å; Y355-R359 WeakPolarHBondContact O-CB 3.35Å; Y355-R359 WeakPolarHBondContact O-CG 3.35Å; Y355-R359 PolarHBondContact O-N 2.54Å; Y355-R359 PolarHBondContact OH-NH1 3.29Å; R359-I361 HydrophobicContact CG-CG1 3.82Å
360	T	98.1	Very high	94.8	Very high	58 Å²	58	54.1 Å²	54.1	36%	0.356	28%	0.282	S	S	.	.			trans	-73.5	133.6	157.6	-58.4	0	0	0	0	109.1	Q178 E179 T180	Q178-T360 HydrophobicContact CB-CG2 3.84Å; E179-T360 CarbonylContact O-C 3.6Å; E179-T360 VanDerWaalsContact O-CA 3.25Å; E179-T360 WeakPolarHBondContact O-CA 3.1Å; T180-T360 HydrophobicContact CG2-CG2 4.46Å
361	I	97.4	Very high	94.5	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	120.1	176.9	-54.5	176.6	0	0	0	108.3	E179 L256 R257 Y312 Y356 R359	E179-I361 WeakPolarHBondContact CB-O 3.14Å; E179-I361 PolarHBondContact N-O 2.98Å; E179-I361 PolarHBondContact O-N 3.11Å; L256-I361 HydrophobicContact CD2-CD1 4.27Å; R257-I361 HydrophobicContact CG-CD1 4.39Å; Y312-I361 HydrophobicContact CD1-CB 4.19Å; Y312-I361 HydrophobicContact CD1-CD1 4.27Å; Y312-I361 HydrophobicContact CD1-CG2 3.44Å; Y312-I361 VanDerWaalsContact CD1-CG2 3.44Å; Y312-I361 HydrophobicContact CE1-CB 3.97Å; Y312-I361 HydrophobicContact CE1-CD1 3.93Å; Y312-I361 HydrophobicContact CE1-CG2 3.76Å; Y312-I361 HydrophobicContact CE2-CD1 4.49Å; Y312-I361 HydrophobicContact CG-CG2 4.3Å; Y356-I361 HydrophobicContact CD1-CD1 4.37Å; R359-I361 HydrophobicContact CG-CG1 3.82Å
362	T	96.4	Very high	94.3	Very high	51 Å²	51	44.2 Å²	44.2	31%	0.313	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	123.8	172.6	-52.4	0	0	0	0	109.3	I176 I177 Q178	I176-T362 HydrophobicContact CG2-CG2 3.65Å; I177-T362 WeakPolarHBondContact O-CA 3.46Å; Q178-T362 PolarHBondContact NE2-OG1 3.1Å; Q178-T362 VanDerWaalsContact NE2-OG1 3.09Å; Q178-T362 PolarHBondContact OE1-OG1 3.36Å
363	M	94.7	Very high	93.9	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	171.4	176	63.8	178.9	-178.4	0	0	110.7	I176 I177 E179 I188 Y312 P313 C337 L365 I375	I176-M363 CarbonylContact C-O 3.54Å; I176-M363 WeakPolarHBondContact CA-O 3.45Å; I177-M363 HydrophobicContact CB-CE 4.17Å; I177-M363 HydrophobicContact CB-CG 4.12Å; I177-M363 HydrophobicContact CD1-CE 4.17Å; I177-M363 HydrophobicContact CG2-CE 3.94Å; I177-M363 PolarHBondContact N-O 3.44Å; I177-M363 PolarHBondContact O-N 3.1Å; E179-M363 HydrophobicContact CB-CE 3.97Å; E179-M363 HydrophobicContact CB-SD 4.43Å; E179-M363 HydrophobicContact CG-CE 4.14Å; I188-M363 HydrophobicContact CD1-CE 3.9Å; Y312-M363 HydrophobicContact CE1-SD 4.23Å; P313-M363 HydrophobicContact CG-SD 4.05Å; C337-M363 WeakPolarHBondContact O-CA 3.44Å; M363-L365 HydrophobicContact CE-CD1 4.24Å; M363-I375 HydrophobicContact CE-CD1 3.92Å
364	F	91.1	Very high	93.7	Very high	30 Å²	30	41.4 Å²	41.4	13%	0.132	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	145.8	164.6	73.6	-93.9	0	0	0	111.8	R174 H175 N335 C337 R338	R174-F364 HydrophobicContact CB-CD2 4.32Å; R174-F364 HydrophobicContact CG-CD2 4.17Å; R174-F364 HydrophobicContact CG-CE2 4.46Å; H175-F364 CarbonylContact O-C 3.55Å; H175-F364 VanDerWaalsContact O-CA 3.22Å; H175-F364 WeakPolarHBondContact O-CA 3.36Å; N335-F364 HydrophobicContact CB-CE1 4.4Å; C337-F364 HydrophobicContact CB-CD1 3.76Å; R338-F364 HydrophobicContact CB-CE1 3.83Å; R338-F364 HydrophobicContact CB-CZ 4.48Å; R338-F364 HydrophobicContact CG-CE1 4.48Å
365	L	91.3	Very high	93.5	Very high	5 Å²	5	38.3 Å²	38.3	3%	0.026	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	153	169.9	-65	-179.8	0	0	0	110.4	R174 H175 I177 P313 M363 M371 F372 I375	R174-L365 CarbonylContact C-O 3.32Å; R174-L365 WeakPolarHBondContact CA-O 3.38Å; H175-L365 PolarHBondContact N-O 2.69Å; H175-L365 PolarHBondContact O-N 2.93Å; I177-L365 HydrophobicContact CD1-CB 3.93Å; I177-L365 HydrophobicContact CD1-CD1 3.48Å; I177-L365 VanDerWaalsContact CD1-CD1 3.48Å; I177-L365 HydrophobicContact CD1-CG 3.7Å; P313-L365 HydrophobicContact CG-CD2 3.86Å; M363-L365 HydrophobicContact CE-CD1 4.24Å; L365-M371 HydrophobicContact CD1-CB 4.05Å; L365-M371 HydrophobicContact CD1-CG 3.89Å; L365-M371 HydrophobicContact CD1-SD 3.9Å; L365-M371 HydrophobicContact CD2-SD 4.12Å; L365-F372 HydrophobicContact CB-CB 4.08Å; L365-F372 HydrophobicContact CB-CD2 4.27Å; L365-F372 HydrophobicContact CD1-CB 4.07Å; L365-I375 HydrophobicContact CD1-CD1 3.79Å
366	H	88.4	Confident	93.1	Very high	57 Å²	57	37.9 Å²	37.9	26%	0.264	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	142.5	168.3	-79.3	-110.5	0	0	0	110	S172 R174 N368 N369 F372	S172-H366 VanDerWaalsContact OG-CB 3.31Å; S172-H366 WeakPolarHBondContact OG-CB 3.42Å; S172-H366 PolarHBondContact OG-ND1 3.38Å; R174-H366 PolarHBondContact NE-CE1 3.35Å; R174-H366 PolarHBondContact NE-NE2 3.32Å; R174-H366 VanDerWaalsContact NE-NE2 3.1Å; H366-N368 VanDerWaalsContact CB-OD1 3.27Å; H366-N368 WeakPolarHBondContact CB-OD1 3.42Å; H366-N368 PolarHBondContact O-N 3.34Å; H366-N368 VanDerWaalsContact O-N 3.17Å; H366-N369 HydrophobicContact CB-CB 4.32Å; H366-N369 WeakPolarHBondContact O-CB 3.35Å; H366-N369 PolarHBondContact O-N 3.29Å; H366-F372 WeakPolarHBondContact O-CB 3.3Å
367	A	88	Confident	92.7	Very high	31 Å²	31	44.9 Å²	44.9	26%	0.256	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-26.8	-178.6	0	0	0	0	0	113.5	S173 N369 F372	S173-A367 PolarHBondContact O-N 2.89Å; A367-N369 VanDerWaalsContact C-N 3.34Å; A367-F372 HydrophobicContact CB-CD1 4.49Å; A367-F372 HydrophobicContact CB-CE1 4.34Å; A367-F372 WeakPolarHBondContact O-CD1 3.42Å
368	N	85.8	Confident	92	Very high	60 Å²	60	47.7 Å²	47.7	32%	0.321	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-1.5	175.8	65.9	0.8	0	0	0	113.5	A170 S172 H366 P370	A170-N368 WeakPolarHBondContact CB-ND2 3.36Å; A170-N368 PolarHBondContact O-ND2 3.33Å; S172-N368 PolarHBondContact OG-OD1 2.81Å; H366-N368 VanDerWaalsContact CB-OD1 3.27Å; H366-N368 WeakPolarHBondContact CB-OD1 3.42Å; H366-N368 PolarHBondContact O-N 3.34Å; H366-N368 VanDerWaalsContact O-N 3.17Å; N368-P370 WeakPolarHBondContact O-CD 3.38Å
369	N	87.3	Confident	90.3	Very high	53 Å²	53	46.3 Å²	46.3	28%	0.283	26%	0.256	S	S	.	.			trans	-72.6	126.9	178.9	-172.2	-46	0	0	0	109.1	H366 A367 M371 F372 T373	H366-N369 HydrophobicContact CB-CB 4.32Å; H366-N369 WeakPolarHBondContact O-CB 3.35Å; H366-N369 PolarHBondContact O-N 3.29Å; A367-N369 VanDerWaalsContact C-N 3.34Å; N369-M371 PolarHBondContact O-N 2.83Å; N369-M371 VanDerWaalsContact O-N 3.08Å; N369-M371 VanDerWaalsContact OD1-CB 3.25Å; N369-M371 WeakPolarHBondContact OD1-CB 3.06Å; N369-M371 PolarHBondContact OD1-N 2.74Å; N369-F372 HydrophobicContact CB-CB 4.33Å; N369-F372 WeakPolarHBondContact O-CA 3.48Å; N369-F372 VanDerWaalsContact O-CB 3.26Å; N369-F372 WeakPolarHBondContact O-CB 3.32Å; N369-F372 PolarHBondContact O-N 3.41Å; N369-T373 PolarHBondContact O-N 3.44Å
370	P	89.4	Confident	88.4	Confident	67 Å²	67	46.9 Å²	46.9	44%	0.435	27%	0.273	S	S	.	.	H	α-helix	trans	-57.3	-27.5	179.5	-25.8	34.5	0	0	0	114.4	F191 N368 T373 A374	F191-P370 HydrophobicContact CE2-CB 3.79Å; F191-P370 HydrophobicContact CZ-CB 3.85Å; N368-P370 WeakPolarHBondContact O-CD 3.38Å; P370-T373 PolarHBondContact O-N 2.91Å; P370-A374 PolarHBondContact O-N 3.2Å
371	M	91.9	Very high	86.2	Confident	10 Å²	10	48.8 Å²	48.8	5%	0.049	28%	0.278	C	S	.	.	H	α-helix	trans	-66.6	-37.8	173.8	-172.9	-172.9	-70.5	0	0	111.7	I188 F191 L192 Y317 L365 N369 T373 A374 I375	I188-M371 HydrophobicContact CG2-CE 4.22Å; I188-M371 HydrophobicContact CG2-SD 4.35Å; F191-M371 HydrophobicContact CD1-CB 4.06Å; F191-M371 HydrophobicContact CD1-CE 4.27Å; F191-M371 HydrophobicContact CD1-CG 4.03Å; F191-M371 HydrophobicContact CE1-CB 3.55Å; F191-M371 HydrophobicContact CE1-CE 4.01Å; F191-M371 HydrophobicContact CE1-CG 3.99Å; F191-M371 HydrophobicContact CZ-CB 3.9Å; L192-M371 HydrophobicContact CD2-CE 3.87Å; Y317-M371 HydrophobicContact CE2-CE 4.33Å; Y317-M371 VanDerWaalsContact OH-CE 3.29Å; Y317-M371 WeakPolarHBondContact OH-CE 3.21Å; L365-M371 HydrophobicContact CD1-CB 4.05Å; L365-M371 HydrophobicContact CD1-CG 3.89Å; L365-M371 HydrophobicContact CD1-SD 3.9Å; L365-M371 HydrophobicContact CD2-SD 4.12Å; N369-M371 PolarHBondContact O-N 2.83Å; N369-M371 VanDerWaalsContact O-N 3.08Å; N369-M371 VanDerWaalsContact OD1-CB 3.25Å; N369-M371 WeakPolarHBondContact OD1-CB 3.06Å; N369-M371 PolarHBondContact OD1-N 2.74Å; M371-T373 VanDerWaalsContact C-N 3.34Å; M371-A374 PolarHBondContact O-N 3.27Å; M371-I375 HydrophobicContact CG-CD1 4.21Å; M371-I375 WeakPolarHBondContact O-CG1 3.36Å; M371-I375 PolarHBondContact O-N 3.27Å
372	F	93.1	Very high	84.2	Confident	37 Å²	37	51.9 Å²	51.9	16%	0.162	29%	0.294	C	S	.	.	H	α-helix	trans	-62.4	-45.3	175	179.8	-102.9	0	0	0	110.4	H175 I177 L365 H366 A367 N369 A374 I375 C376	H175-F372 HydrophobicContact CB-CD2 4.36Å; H175-F372 HydrophobicContact CB-CE2 3.59Å; H175-F372 HydrophobicContact CB-CZ 4.12Å; H175-F372 AromaticContact CD2-CE2 3.91Å; H175-F372 AromaticContact CD2-CZ 3.63Å; H175-F372 AromaticContact CG-CE2 3.75Å; H175-F372 AromaticContact CG-CZ 3.74Å; I177-F372 HydrophobicContact CD1-CD2 3.95Å; I177-F372 HydrophobicContact CD1-CE2 4.45Å; L365-F372 HydrophobicContact CB-CB 4.08Å; L365-F372 HydrophobicContact CB-CD2 4.27Å; L365-F372 HydrophobicContact CD1-CB 4.07Å; H366-F372 WeakPolarHBondContact O-CB 3.3Å; A367-F372 HydrophobicContact CB-CD1 4.49Å; A367-F372 HydrophobicContact CB-CE1 4.34Å; A367-F372 WeakPolarHBondContact O-CD1 3.42Å; N369-F372 HydrophobicContact CB-CB 4.33Å; N369-F372 WeakPolarHBondContact O-CA 3.48Å; N369-F372 VanDerWaalsContact O-CB 3.26Å; N369-F372 WeakPolarHBondContact O-CB 3.32Å; N369-F372 PolarHBondContact O-N 3.41Å; F372-A374 VanDerWaalsContact C-N 3.33Å; F372-A374 PolarHBondContact O-N 3.28Å; F372-I375 PolarHBondContact O-N 3.49Å; F372-C376 VanDerWaalsContact CZ-SG 3.59Å; F372-C376 PolarHBondContact O-N 2.97Å; F372-C376 PolarHBondContact O-SG 3.33Å; F372-C376 VanDerWaalsContact O-SG 3.38Å
373	T	91.7	Very high	81.8	Confident	60 Å²	60	54.1 Å²	54.1	37%	0.368	31%	0.311	S	S	.	.	H	α-helix	trans	-57.8	-44.3	174.7	-50.6	0	0	0	0	111.9	N369 P370 M371 I375 C376 Q377	N369-T373 PolarHBondContact O-N 3.44Å; P370-T373 PolarHBondContact O-N 2.91Å; M371-T373 VanDerWaalsContact C-N 3.34Å; T373-I375 VanDerWaalsContact C-N 3.34Å; T373-I375 PolarHBondContact O-N 2.89Å; T373-C376 PolarHBondContact O-N 2.77Å; T373-Q377 HydrophobicContact CG2-CG 4.43Å; T373-Q377 VanDerWaalsContact O-CG 3.29Å; T373-Q377 WeakPolarHBondContact O-CG 3.42Å; T373-Q377 PolarHBondContact O-N 3.16Å
374	A	92.9	Very high	79.7	Confident	13 Å²	13	60 Å²	60	11%	0.107	34%	0.342	C	S	.	.	H	α-helix	trans	-62.4	-39.5	178	0	0	0	0	0	112.6	V187 F191 P370 M371 F372 Q377 N378	V187-A374 HydrophobicContact CG1-CB 4.44Å; F191-A374 HydrophobicContact CB-CB 4.18Å; F191-A374 HydrophobicContact CD2-CB 3.74Å; F191-A374 HydrophobicContact CE2-CB 4.47Å; F191-A374 HydrophobicContact CG-CB 4.08Å; P370-A374 PolarHBondContact O-N 3.2Å; M371-A374 PolarHBondContact O-N 3.27Å; F372-A374 VanDerWaalsContact C-N 3.33Å; F372-A374 PolarHBondContact O-N 3.28Å; A374-Q377 PolarHBondContact O-N 2.76Å; A374-N378 PolarHBondContact O-N 3.18Å; A374-N378 PolarHBondContact O-ND2 2.95Å
375	I	93.9	Very high	77.5	Confident	4 Å²	4	64.2 Å²	64.2	2%	0.021	37%	0.369	C	S	.	.	H	α-helix	trans	-64.2	-47.7	174.5	-68	166.1	0	0	0	110.4	I177 L183 V187 I188 M363 L365 M371 F372 T373 Q377 N378 I382	I177-I375 HydrophobicContact CD1-CD1 3.93Å; L183-I375 HydrophobicContact CD1-CG1 4.41Å; L183-I375 HydrophobicContact CD1-CG2 4.27Å; L183-I375 HydrophobicContact CD2-CG1 4.49Å; L183-I375 HydrophobicContact CD2-CG2 4.21Å; V187-I375 HydrophobicContact CG1-CG1 4.32Å; I188-I375 HydrophobicContact CD1-CD1 4.22Å; I188-I375 HydrophobicContact CG1-CD1 4.33Å; I188-I375 HydrophobicContact CG1-CG1 4.39Å; M363-I375 HydrophobicContact CE-CD1 3.92Å; L365-I375 HydrophobicContact CD1-CD1 3.79Å; M371-I375 HydrophobicContact CG-CD1 4.21Å; M371-I375 WeakPolarHBondContact O-CG1 3.36Å; M371-I375 PolarHBondContact O-N 3.27Å; F372-I375 PolarHBondContact O-N 3.49Å; T373-I375 VanDerWaalsContact C-N 3.34Å; T373-I375 PolarHBondContact O-N 2.89Å; I375-Q377 VanDerWaalsContact C-N 3.31Å; I375-Q377 PolarHBondContact O-N 3.21Å; I375-N378 PolarHBondContact O-N 3.03Å; I375-I382 HydrophobicContact CG2-CD1 4.07Å; I375-I382 HydrophobicContact CG2-CG1 4.41Å
376	C	91.7	Very high	74.9	Confident	49 Å²	49	71 Å²	71	33%	0.331	41%	0.406	S	S	.	.	H	α-helix	trans	-63.5	-31.2	177.7	-68.1	0	0	0	0	114.1	F372 T373 N378 S379 I382	F372-C376 VanDerWaalsContact CZ-SG 3.59Å; F372-C376 PolarHBondContact O-N 2.97Å; F372-C376 PolarHBondContact O-SG 3.33Å; F372-C376 VanDerWaalsContact O-SG 3.38Å; T373-C376 PolarHBondContact O-N 2.77Å; C376-N378 VanDerWaalsContact C-N 3.32Å; C376-S379 VanDerWaalsContact C-OG 3.31Å; C376-S379 WeakPolarHBondContact O-CB 3.35Å; C376-S379 PolarHBondContact O-OG 2.95Å; C376-I382 HydrophobicContact CB-CD1 4.46Å
377	Q	89.2	Confident	72.2	Confident	150 Å²	150	73.3 Å²	73.3	70%	0.701	43%	0.428	S	S	*	.	H	α-helix	trans	-73.3	-25.2	177.3	-74.1	171.5	-14.6	0	0	112.9	T373 A374 I375 S379	T373-Q377 HydrophobicContact CG2-CG 4.43Å; T373-Q377 VanDerWaalsContact O-CG 3.29Å; T373-Q377 WeakPolarHBondContact O-CG 3.42Å; T373-Q377 PolarHBondContact O-N 3.16Å; A374-Q377 PolarHBondContact O-N 2.76Å; I375-Q377 VanDerWaalsContact C-N 3.31Å; I375-Q377 PolarHBondContact O-N 3.21Å; Q377-S379 VanDerWaalsContact C-N 3.32Å; Q377-S379 PolarHBondContact O-N 3.05Å
378	N	83.3	Confident	69.3	Low	79 Å²	79	76 Å²	76	42%	0.422	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	34.4	179	-71.4	-80.6	0	0	0	111.9	V187 A374 I375 C376 S380	V187-N378 HydrophobicContact CG1-CB 4.21Å; V187-N378 HydrophobicContact CG2-CB 3.61Å; A374-N378 PolarHBondContact O-N 3.18Å; A374-N378 PolarHBondContact O-ND2 2.95Å; I375-N378 PolarHBondContact O-N 3.03Å; C376-N378 VanDerWaalsContact C-N 3.32Å; N378-S380 PolarHBondContact O-N 2.96Å
379	S	62.1	Low	66.9	Low	71 Å²	71	79 Å²	79	50%	0.497	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	48.4	-170.4	-70.6	0	0	0	0	115.9	C376 Q377 H381 I382	C376-S379 VanDerWaalsContact C-OG 3.31Å; C376-S379 WeakPolarHBondContact O-CB 3.35Å; C376-S379 PolarHBondContact O-OG 2.95Å; Q377-S379 VanDerWaalsContact C-N 3.32Å; Q377-S379 PolarHBondContact O-N 3.05Å; S379-H381 VanDerWaalsContact C-N 3.27Å; S379-I382 WeakPolarHBondContact OG-CD1 3.38Å
380	S	57.8	Low	64.4	Low	99 Å²	99	89.6 Å²	89.6	69%	0.692	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-4.5	148.7	49.4	0	0	0	0	112.5	N378	N378-S380 PolarHBondContact O-N 2.96Å
381	H	53.6	Low	63.2	Low	98 Å²	98	90.7 Å²	90.7	45%	0.454	53%	0.526	S	S	.	.	S	Bend	trans	-126.3	7.5	-167.1	-69.8	-62.6	0	0	0	117.1	L183 S379 S383	L183-H381 HydrophobicContact CD1-CB 4.47Å; S379-H381 VanDerWaalsContact C-N 3.27Å; H381-S383 PolarHBondContact O-N 3.46Å
382	I	54.4	Low	61.7	Low	65 Å²	65	94.9 Å²	94.9	33%	0.333	55%	0.551	S	S	.	*			trans	-96.3	95.3	-178.3	-45.9	-170.8	0	0	0	110.4	I375 C376 S379 I384	I375-I382 HydrophobicContact CG2-CD1 4.07Å; I375-I382 HydrophobicContact CG2-CG1 4.41Å; C376-I382 HydrophobicContact CB-CD1 4.46Å; S379-I382 WeakPolarHBondContact OG-CD1 3.38Å; I382-I384 HydrophobicContact CB-CG1 4.29Å; I382-I384 HydrophobicContact CG2-CB 4.3Å; I382-I384 HydrophobicContact CG2-CD1 4.13Å; I382-I384 HydrophobicContact CG2-CG1 3.21Å; I382-I384 PolarHBondContact O-N 2.95Å; I382-I384 VanDerWaalsContact O-N 3.13Å
383	S	46.6	Very low	59.9	Low	98 Å²	98	98.2 Å²	98.2	69%	0.685	57%	0.572	S	S	*	*			trans	-74.5	84.2	148.6	59.8	0	0	0	0	106.7	H381 V385	H381-S383 PolarHBondContact O-N 3.46Å; S383-V385 PolarHBondContact O-N 3Å
384	I	49.8	Very low	58.1	Low	125 Å²	125	100.4 Å²	100.4	64%	0.641	58%	0.584	S	S	*	*			trans	-59.2	133.6	160	-57.8	-175.3	0	0	0	103.4	I382 D386	I382-I384 HydrophobicContact CB-CG1 4.29Å; I382-I384 HydrophobicContact CG2-CB 4.3Å; I382-I384 HydrophobicContact CG2-CD1 4.13Å; I382-I384 HydrophobicContact CG2-CG1 3.21Å; I382-I384 PolarHBondContact O-N 2.95Å; I382-I384 VanDerWaalsContact O-N 3.13Å; I384-D386 PolarHBondContact O-N 3.33Å
385	V	44.6	Very low	55.9	Low	117 Å²	117	105.9 Å²	105.9	71%	0.709	61%	0.614	S	S	*	*			trans	-52.1	97.9	175.5	178.9	0	0	0	0	106.8	S383 S387	S383-V385 PolarHBondContact O-N 3Å; V385-S387 PolarHBondContact O-N 3.39Å
386	D	36.9	Very low	53.3	Low	147 Å²	147	112.7 Å²	112.7	79%	0.786	65%	0.654	S	S	*	*			trans	-61.5	114.8	172.6	-87.3	-32.2	0	0	0	104.5	I384 A388	I384-D386 PolarHBondContact O-N 3.33Å; D386-A388 PolarHBondContact O-N 3.31Å; D386-A388 VanDerWaalsContact O-N 3.07Å
387	S	31.7	Very low	50.6	Low	106 Å²	106	117.2 Å²	117.2	74%	0.741	68%	0.677	S	S	*	*			trans	-41.3	116.3	159.4	40.8	0	0	0	0	107.8	V385	V385-S387 PolarHBondContact O-N 3.39Å
388	A	28.6	Very low	47.6	Very low	87 Å²	87	114.7 Å²	114.7	72%	0.719	68%	0.675	S	S	*	*			trans	-50.8	138.3	168.2	0	0	0	0	0	108.6	D386	D386-A388 PolarHBondContact O-N 3.31Å; D386-A388 VanDerWaalsContact O-N 3.07Å
389	P	34.9	Very low	44.7	Very low	125 Å²	125	117.7 Å²	117.7	81%	0.812	70%	0.696	S	S	*	*			trans	-64.7	149.5	171.5	30	-31.5	0	0	0	109.1
390	E	35.2	Very low	43.1	Very low	274 Å²	274	121.9 Å²	121.9	100%	1.28	71%	0.714	S	S	*	*			trans	-24.6	0	-175.4	-68.2	-179.7	153.2	0	0	118.4

Retrieved 390 of 390 residues in 71.9 ms (Link to these results)

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