A0A077YZW2_TRITR Loading...

Mothers against decapentaplegic homolog

AlphaFold DB , UniProt , Accession A0A077YZW2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 471 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	54.3	Low	41.1	Very low	247 Å²	247	148.5 Å²	148.5	100%	1.217	87%	0.874	S	S	*	*				0	107.5	0	-77	-176.7	-135	0	0	107.9
2	M	34.1	Very low	42.5	Very low	191 Å²	191	145 Å²	145	94%	0.941	86%	0.859	S	S	*	*			trans	-80.9	128.3	-173.4	-74	170.5	168.1	0	0	111
3	S	38	Very low	44.2	Very low	104 Å²	104	140.7 Å²	140.7	73%	0.727	84%	0.837	S	S	*	*			trans	-104.8	105.9	163.7	163.2	0	0	0	0	107.5
4	M	40.8	Very low	46.8	Very low	182 Å²	182	134.1 Å²	134.1	90%	0.897	80%	0.796	S	S	*	*			trans	-76.8	124.4	175	-76	-154.5	-104.3	0	0	110.8	G6	M4-G6 PolarHBondContact O-N 3.24Å
5	F	40.2	Very low	49.7	Very low	206 Å²	206	132.3 Å²	132.3	90%	0.904	79%	0.789	S	S	*	*			trans	-70.1	113.4	166.4	-78	-96.4	0	0	0	109.7	A7	F5-A7 PolarHBondContact O-N 3.35Å
6	G	36.3	Very low	52.3	Low	80 Å²	80	125.9 Å²	125.9	83%	0.825	75%	0.749	S	S	*	*			trans	-78.8	101.3	170.5	0	0	0	0	0	110.9	M4 G8	M4-G6 PolarHBondContact O-N 3.24Å; G6-G8 PolarHBondContact O-N 3.36Å
7	A	37.9	Very low	54.7	Low	97 Å²	97	118.7 Å²	118.7	80%	0.802	71%	0.707	S	S	*	*			trans	-69.8	108.4	164.9	0	0	0	0	0	109	F5 L9	F5-A7 PolarHBondContact O-N 3.35Å; A7-L9 PolarHBondContact O-N 3.21Å
8	G	37	Very low	56.8	Low	71 Å²	71	120.8 Å²	120.8	73%	0.732	71%	0.705	S	S	*	*			trans	-64.9	112	172.6	0	0	0	0	0	110.6	G6 L10	G6-G8 PolarHBondContact O-N 3.36Å; G8-L10 PolarHBondContact O-N 3.18Å
9	L	37	Very low	58.8	Low	180 Å²	180	118.6 Å²	118.6	94%	0.942	69%	0.686	S	S	*	*			trans	-53.9	107.4	169.3	-88.6	136.1	0	0	0	110.1	A7 S11	A7-L9 PolarHBondContact O-N 3.21Å; L9-S11 PolarHBondContact O-N 3.48Å; L9-S11 VanDerWaalsContact O-N 3.15Å
10	L	46.5	Very low	60.6	Low	169 Å²	169	112.7 Å²	112.7	89%	0.885	65%	0.652	S	S	*	*			trans	-64.4	110.4	169.7	-75.4	161.5	0	0	0	108.4	G8	G8-L10 PolarHBondContact O-N 3.18Å
11	S	49.5	Very low	62.1	Low	107 Å²	107	108.3 Å²	108.3	75%	0.748	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-52.8	134.6	171	-166.9	0	0	0	0	109.3	L9	L9-S11 PolarHBondContact O-N 3.48Å; L9-S11 VanDerWaalsContact O-N 3.15Å
12	P	57.9	Low	63.9	Low	106 Å²	106	100.7 Å²	100.7	69%	0.688	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-54.9	142.2	-175.9	18.8	-30.3	0	0	0	110.8	N14	P12-N14 PolarHBondContact O-N 3.33Å; P12-N14 VanDerWaalsContact O-N 3.15Å
13	P	65.3	Low	66.7	Low	89 Å²	89	94.4 Å²	94.4	58%	0.578	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-58.7	123.7	-177.2	21.9	-30.8	0	0	0	109.7	P15	P13-P15 VanDerWaalsContact O-N 3.17Å
14	N	79.8	Confident	69.3	Low	49 Å²	49	92.5 Å²	92.5	26%	0.262	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-54.8	121	179.8	179.2	-12.4	0	0	0	109.4	P12 I16 V17 K18 K52	P12-N14 PolarHBondContact O-N 3.33Å; P12-N14 VanDerWaalsContact O-N 3.15Å; N14-I16 PolarHBondContact O-N 3.25Å; N14-I16 VanDerWaalsContact O-N 3.12Å; N14-I16 VanDerWaalsContact OD1-CG2 3.31Å; N14-I16 WeakPolarHBondContact OD1-CG2 3.45Å; N14-I16 PolarHBondContact OD1-N 3.09Å; N14-V17 HydrophobicContact CB-CB 4.36Å; N14-V17 HydrophobicContact CB-CG2 3.91Å; N14-V17 WeakPolarHBondContact O-CB 3.22Å; N14-V17 PolarHBondContact O-N 3.17Å; N14-K18 PolarHBondContact O-N 3.31Å; N14-K52 PolarHBondContact ND2-NZ 3.27Å
15	P	90.3	Very high	71.6	Confident	106 Å²	106	85.1 Å²	85.1	69%	0.688	51%	0.513	S	S	*	.	H	α-helix	trans	-57.2	-34.2	-171.1	20.4	-33.3	0	0	0	112.9	P13 V17 K18 K19	P13-P15 VanDerWaalsContact O-N 3.17Å; P15-V17 VanDerWaalsContact C-N 3.33Å; P15-V17 PolarHBondContact O-N 3.37Å; P15-K18 PolarHBondContact O-N 3.44Å; P15-K19 PolarHBondContact O-N 3.18Å
16	I	92	Very high	73.4	Confident	30 Å²	30	78.7 Å²	78.7	15%	0.154	49%	0.493	C	S	.	.	H	α-helix	trans	-68	-33.3	178	-154.7	172.2	0	0	0	112.5	N14 K19 L20 V48 L57 D61	N14-I16 PolarHBondContact O-N 3.25Å; N14-I16 VanDerWaalsContact O-N 3.12Å; N14-I16 VanDerWaalsContact OD1-CG2 3.31Å; N14-I16 WeakPolarHBondContact OD1-CG2 3.45Å; N14-I16 PolarHBondContact OD1-N 3.09Å; I16-K19 PolarHBondContact O-N 3.48Å; I16-L20 HydrophobicContact CG1-CD1 4.29Å; I16-L20 HydrophobicContact CG1-CG 4.46Å; I16-L20 WeakPolarHBondContact O-CB 3.22Å; I16-L20 VanDerWaalsContact O-CG 3.3Å; I16-L20 WeakPolarHBondContact O-CG 3.43Å; I16-L20 PolarHBondContact O-N 3.4Å; I16-V48 HydrophobicContact CG2-CG1 3.94Å; I16-V48 HydrophobicContact CG2-CG2 4.26Å; I16-L57 HydrophobicContact CD1-CD1 3.85Å; I16-L57 HydrophobicContact CD1-CD2 3.78Å; I16-L57 HydrophobicContact CD1-CG 3.63Å; I16-L57 HydrophobicContact CG2-CD2 4.42Å; I16-D61 HydrophobicContact CD1-CB 4.43Å
17	V	93	Very high	75.2	Confident	4 Å²	4	78.5 Å²	78.5	2%	0.024	47%	0.473	C	S	.	.	H	α-helix	trans	-65.4	-45.4	176.1	171.5	0	0	0	0	109	N14 P15 K19 L20 V21 E41 V44 K45 V48	N14-V17 HydrophobicContact CB-CB 4.36Å; N14-V17 HydrophobicContact CB-CG2 3.91Å; N14-V17 WeakPolarHBondContact O-CB 3.22Å; N14-V17 PolarHBondContact O-N 3.17Å; P15-V17 VanDerWaalsContact C-N 3.33Å; P15-V17 PolarHBondContact O-N 3.37Å; V17-K19 VanDerWaalsContact C-N 3.32Å; V17-K19 PolarHBondContact O-N 3.48Å; V17-L20 PolarHBondContact O-N 2.94Å; V17-V21 HydrophobicContact CG1-CG2 4.25Å; V17-V21 WeakPolarHBondContact O-CB 3.36Å; V17-V21 VanDerWaalsContact O-CG2 3.23Å; V17-V21 WeakPolarHBondContact O-CG2 3.4Å; V17-V21 PolarHBondContact O-N 3.25Å; V17-E41 HydrophobicContact CG1-CG 4.34Å; V17-V44 HydrophobicContact CB-CG1 4.46Å; V17-V44 HydrophobicContact CG1-CB 4.5Å; V17-V44 HydrophobicContact CG1-CG1 4.09Å; V17-K45 HydrophobicContact CB-CG 4.46Å; V17-K45 HydrophobicContact CG1-CG 3.6Å; V17-K45 HydrophobicContact CG2-CG 4.08Å; V17-V48 HydrophobicContact CG2-CB 4.23Å; V17-V48 HydrophobicContact CG2-CG1 4.33Å; V17-V48 HydrophobicContact CG2-CG2 3.99Å
18	K	92.1	Very high	76.7	Confident	156 Å²	156	80.8 Å²	80.8	68%	0.678	47%	0.472	S	S	*	.	H	α-helix	trans	-59.4	-45	177.9	-168	179	-179.8	-177.8	0	111	N14 P15 S22	N14-K18 PolarHBondContact O-N 3.31Å; P15-K18 PolarHBondContact O-N 3.44Å; K18-S22 PolarHBondContact O-N 3.44Å; K18-S22 PolarHBondContact O-OG 2.94Å
19	K	94.6	Very high	78	Confident	80 Å²	80	85.3 Å²	85.3	35%	0.348	48%	0.479	S	S	.	.	H	α-helix	trans	-59.7	-51.1	175.5	-177.1	-173.3	174.8	-166.2	0	112.3	P15 I16 V17 V21 S22 L23 D61 T65	P15-K19 PolarHBondContact O-N 3.18Å; I16-K19 PolarHBondContact O-N 3.48Å; V17-K19 VanDerWaalsContact C-N 3.32Å; V17-K19 PolarHBondContact O-N 3.48Å; K19-V21 VanDerWaalsContact C-N 3.34Å; K19-V21 PolarHBondContact O-N 2.99Å; K19-S22 PolarHBondContact O-N 2.94Å; K19-S22 PolarHBondContact O-OG 3.38Å; K19-L23 HydrophobicContact CG-CD1 4.29Å; K19-L23 WeakPolarHBondContact O-CG 3.38Å; K19-L23 PolarHBondContact O-N 3.04Å; K19-D61 WeakPolarHBondContact CD-OD1 3.19Å; K19-D61 VanDerWaalsContact CE-OD1 3.3Å; K19-D61 WeakPolarHBondContact CE-OD1 3.43Å; K19-D61 IonicContact NZ-OD1 2.72Å; K19-D61 PolarHBondContact NZ-OD1 3.05Å; K19-D61 IonicContact NZ-OD2 2.73Å; K19-D61 PolarHBondContact NZ-OD2 3.07Å; K19-T65 PolarHBondContact NZ-OG1 3.12Å
20	L	95	Very high	79.5	Confident	0 Å²	0	80.9 Å²	80.9	0%	0	46%	0.459	C	S	.	.	H	α-helix	trans	-66.5	-36.1	-177.3	-72.1	172.2	0	0	0	112.5	I16 V17 L23 V44 V48 L60 I64 W101	I16-L20 HydrophobicContact CG1-CD1 4.29Å; I16-L20 HydrophobicContact CG1-CG 4.46Å; I16-L20 WeakPolarHBondContact O-CB 3.22Å; I16-L20 VanDerWaalsContact O-CG 3.3Å; I16-L20 WeakPolarHBondContact O-CG 3.43Å; I16-L20 PolarHBondContact O-N 3.4Å; V17-L20 PolarHBondContact O-N 2.94Å; L20-L23 PolarHBondContact O-N 3.47Å; L20-V44 HydrophobicContact CB-CG1 3.77Å; L20-V44 HydrophobicContact CD1-CG1 4.14Å; L20-V48 HydrophobicContact CD1-CG2 3.88Å; L20-L60 HydrophobicContact CD1-CD2 3.82Å; L20-L60 HydrophobicContact CD1-CG 4.49Å; L20-L60 HydrophobicContact CD2-CG 4.42Å; L20-I64 HydrophobicContact CD2-CB 4.18Å; L20-I64 HydrophobicContact CD2-CG1 4.13Å; L20-I64 HydrophobicContact CD2-CG2 4.36Å; L20-W101 HydrophobicContact CB-CZ2 4.31Å; L20-W101 PolarHBondContact O-NE1 3.23Å
21	V	93.1	Very high	80.6	Confident	20 Å²	20	78.5 Å²	78.5	12%	0.121	45%	0.454	C	S	.	.	H	α-helix	trans	-67.6	-37.9	174.5	172.7	0	0	0	0	111	V17 K19 L23 R24 E41 V44	V17-V21 HydrophobicContact CG1-CG2 4.25Å; V17-V21 WeakPolarHBondContact O-CB 3.36Å; V17-V21 VanDerWaalsContact O-CG2 3.23Å; V17-V21 WeakPolarHBondContact O-CG2 3.4Å; V17-V21 PolarHBondContact O-N 3.25Å; K19-V21 VanDerWaalsContact C-N 3.34Å; K19-V21 PolarHBondContact O-N 2.99Å; V21-L23 PolarHBondContact O-N 3.41Å; V21-R24 WeakPolarHBondContact O-CB 3.5Å; V21-R24 WeakPolarHBondContact O-CD 3.41Å; V21-R24 VanDerWaalsContact O-CG 3.28Å; V21-R24 WeakPolarHBondContact O-CG 3.5Å; V21-R24 PolarHBondContact O-N 3.04Å; V21-E41 HydrophobicContact CG2-CB 4.45Å; V21-E41 HydrophobicContact CG2-CG 4.42Å; V21-V44 HydrophobicContact CG2-CB 3.85Å; V21-V44 HydrophobicContact CG2-CG1 4.1Å; V21-V44 HydrophobicContact CG2-CG2 3.77Å
22	S	92.1	Very high	81.5	Confident	88 Å²	88	77 Å²	77	62%	0.615	44%	0.436	S	S	*	.	H	α-helix	trans	-70.5	-18.7	177.8	61.7	0	0	0	0	114.1	K18 K19 R24	K18-S22 PolarHBondContact O-N 3.44Å; K18-S22 PolarHBondContact O-OG 2.94Å; K19-S22 PolarHBondContact O-N 2.94Å; K19-S22 PolarHBondContact O-OG 3.38Å; S22-R24 VanDerWaalsContact C-N 3.32Å
23	L	93	Very high	82.6	Confident	59 Å²	59	80.6 Å²	80.6	31%	0.309	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	7.7	177.9	-69.3	173	0	0	0	113.7	K19 L20 V21 I64	K19-L23 HydrophobicContact CG-CD1 4.29Å; K19-L23 WeakPolarHBondContact O-CG 3.38Å; K19-L23 PolarHBondContact O-N 3.04Å; L20-L23 PolarHBondContact O-N 3.47Å; V21-L23 PolarHBondContact O-N 3.41Å; L23-I64 HydrophobicContact CB-CG2 3.84Å; L23-I64 HydrophobicContact CD1-CG2 3.85Å; L23-I64 HydrophobicContact CG-CG2 4.49Å
24	R	91.6	Very high	83.5	Confident	63 Å²	63	82.4 Å²	82.4	24%	0.238	44%	0.436	C	S	.	.			trans	-59.4	149.4	175.8	69.1	-172.5	-175.8	164.5	9.4	111.5	V21 S22 E32 M100	V21-R24 WeakPolarHBondContact O-CB 3.5Å; V21-R24 WeakPolarHBondContact O-CD 3.41Å; V21-R24 VanDerWaalsContact O-CG 3.28Å; V21-R24 WeakPolarHBondContact O-CG 3.5Å; V21-R24 PolarHBondContact O-N 3.04Å; S22-R24 VanDerWaalsContact C-N 3.32Å; R24-E32 IonicContact CZ-OE1 3.08Å; R24-E32 IonicContact CZ-OE2 3.52Å; R24-E32 IonicContact NE-OE1 3.25Å; R24-E32 IonicContact NE-OE2 3.56Å; R24-E32 IonicContact NH1-OE1 3.75Å; R24-E32 IonicContact NH1-OE2 3.61Å; R24-E32 PolarHBondContact NH1-OE2 3.34Å; R24-E32 IonicContact NH2-OE1 2.94Å; R24-E32 PolarHBondContact NH2-OE1 3.25Å; R24-E32 VanDerWaalsContact NH2-OE1 3.08Å; R24-E32 IonicContact NH2-OE2 3.87Å; R24-E32 PolarHBondContact NH2-OE2 3.39Å; R24-M100 CarbonylContact C-O 3.55Å; R24-M100 VanDerWaalsContact CA-O 3.29Å; R24-M100 WeakPolarHBondContact CA-O 3.49Å; R24-M100 HydrophobicContact CB-CG 4.37Å; R24-M100 WeakPolarHBondContact CB-O 3.48Å
25	A	88.6	Confident	83.9	Confident	27 Å²	27	86 Å²	86	22%	0.223	45%	0.451	C	S	.	.			trans	-74.5	142.6	169.2	0	0	0	0	0	109.7	M100 P104	A25-M100 PolarHBondContact N-O 3.47Å; A25-P104 HydrophobicContact CB-CG 4.13Å
26	S	79.2	Confident	83.7	Confident	71 Å²	71	83.1 Å²	83.1	50%	0.497	43%	0.429	S	S	.	.			trans	-120.3	148.3	173.3	-173.9	0	0	0	0	108.9
27	L	74.1	Confident	83.4	Confident	77 Å²	77	86.3 Å²	86.3	40%	0.403	44%	0.443	S	S	.	.			trans	-79.4	133.2	161.8	-68.7	170.4	0	0	0	107.8	N29 V30 P104 D105	L27-N29 PolarHBondContact O-N 3Å; L27-V30 HydrophobicContact CB-CB 4.3Å; L27-V30 HydrophobicContact CB-CG2 4.03Å; L27-P104 HydrophobicContact CD2-CB 4.44Å; L27-P104 HydrophobicContact CD2-CG 3.72Å; L27-P104 HydrophobicContact CG-CB 3.99Å; L27-P104 HydrophobicContact CG-CG 3.71Å; L27-D105 HydrophobicContact CD1-CB 4.48Å; L27-D105 HydrophobicContact CD2-CB 4.23Å
28	D	68.5	Low	83.3	Confident	144 Å²	144	91.2 Å²	91.2	77%	0.77	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	134.4	173.2	-64.5	-39.9	0	0	0	109	V30	D28-V30 PolarHBondContact O-N 3.02Å
29	N	63.8	Low	83.3	Confident	166 Å²	166	85.3 Å²	85.3	89%	0.888	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.1	16.5	174.1	-51.4	-63.2	0	0	0	117.8	L27	L27-N29 PolarHBondContact O-N 3Å
30	V	69.6	Low	83.2	Confident	87 Å²	87	82 Å²	82	53%	0.527	42%	0.424	S	S	.	.			trans	-110.3	113.4	172.9	-175.3	0	0	0	0	110.5	L27 D28 E32	L27-V30 HydrophobicContact CB-CB 4.3Å; L27-V30 HydrophobicContact CB-CG2 4.03Å; D28-V30 PolarHBondContact O-N 3.02Å; V30-E32 PolarHBondContact O-N 3.37Å
31	P	69	Low	83.1	Confident	120 Å²	120	85.3 Å²	85.3	78%	0.779	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-61.1	120.1	174.3	-18.7	29.8	0	0	0	110.2
32	E	69.3	Low	83.2	Confident	76 Å²	76	89.7 Å²	89.7	36%	0.355	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-74.9	135.6	174.9	-74.8	-168.8	-152.3	0	0	111.4	R24 V30	R24-E32 IonicContact CZ-OE1 3.08Å; R24-E32 IonicContact CZ-OE2 3.52Å; R24-E32 IonicContact NE-OE1 3.25Å; R24-E32 IonicContact NE-OE2 3.56Å; R24-E32 IonicContact NH1-OE1 3.75Å; R24-E32 IonicContact NH1-OE2 3.61Å; R24-E32 PolarHBondContact NH1-OE2 3.34Å; R24-E32 IonicContact NH2-OE1 2.94Å; R24-E32 PolarHBondContact NH2-OE1 3.25Å; R24-E32 VanDerWaalsContact NH2-OE1 3.08Å; R24-E32 IonicContact NH2-OE2 3.87Å; R24-E32 PolarHBondContact NH2-OE2 3.39Å; V30-E32 PolarHBondContact O-N 3.37Å
33	R	81	Confident	83.4	Confident	181 Å²	181	85.5 Å²	85.5	68%	0.683	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-69.4	135.4	173.9	-63.6	-176.8	-68.9	-103.8	-0.6	109.7	E35 E36 Q37	R33-E35 PolarHBondContact O-N 3.21Å; R33-E35 VanDerWaalsContact O-N 3.11Å; R33-E36 WeakPolarHBondContact O-CA 3.49Å; R33-E36 VanDerWaalsContact O-CB 3.28Å; R33-E36 WeakPolarHBondContact O-CB 3.35Å; R33-E36 PolarHBondContact O-N 2.64Å; R33-Q37 PolarHBondContact O-N 2.88Å
34	E	84.8	Confident	83.5	Confident	126 Å²	126	82.7 Å²	82.7	59%	0.589	41%	0.413	S	S	*	.	H	α-helix	trans	-54.2	-34.3	178.4	-166.8	-168	162.8	0	0	112.6	E36 Q37 K38	E34-E36 VanDerWaalsContact C-N 3.31Å; E34-E36 PolarHBondContact O-N 3.42Å; E34-Q37 PolarHBondContact O-N 3.23Å; E34-K38 WeakPolarHBondContact O-CG 3.37Å; E34-K38 PolarHBondContact O-N 3.46Å; E34-K38 WeakPolarHBondContact OE1-CE 3.16Å; E34-K38 IonicContact OE1-NZ 2.75Å; E34-K38 PolarHBondContact OE1-NZ 3.31Å
35	E	86.3	Confident	83.7	Confident	124 Å²	124	84.1 Å²	84.1	58%	0.579	42%	0.421	S	S	*	.	H	α-helix	trans	-60.2	-39.6	174.9	-164	-160.3	144	0	0	112.3	R33 K38 W39 R89	R33-E35 PolarHBondContact O-N 3.21Å; R33-E35 VanDerWaalsContact O-N 3.11Å; E35-K38 PolarHBondContact O-N 3.11Å; E35-W39 WeakPolarHBondContact O-CB 3.47Å; E35-W39 PolarHBondContact O-N 3.42Å; E35-R89 IonicContact OE1-CZ 2.84Å; E35-R89 IonicContact OE1-NH2 3.69Å; E35-R89 PolarHBondContact OE1-NH2 2.94Å
36	E	86.6	Confident	84	Confident	47 Å²	47	84.7 Å²	84.7	22%	0.22	42%	0.423	C	S	.	.	H	α-helix	trans	-67.3	-42.7	179	-164	64	-154.9	0	0	110.5	R33 E34 K38 W39 C40 R89	R33-E36 WeakPolarHBondContact O-CA 3.49Å; R33-E36 VanDerWaalsContact O-CB 3.28Å; R33-E36 WeakPolarHBondContact O-CB 3.35Å; R33-E36 PolarHBondContact O-N 2.64Å; E34-E36 VanDerWaalsContact C-N 3.31Å; E34-E36 PolarHBondContact O-N 3.42Å; E36-K38 PolarHBondContact O-N 3.2Å; E36-W39 WeakPolarHBondContact O-CB 3.41Å; E36-W39 PolarHBondContact O-N 2.77Å; E36-W39 VanDerWaalsContact O-N 3.16Å; E36-C40 PolarHBondContact O-N 2.77Å; E36-C40 PolarHBondContact O-SG 3.43Å; E36-R89 IonicContact OE1-NH1 3.79Å; E36-R89 IonicContact OE2-CZ 3.29Å; E36-R89 IonicContact OE2-NH1 2.95Å; E36-R89 PolarHBondContact OE2-NH1 3.4Å; E36-R89 IonicContact OE2-NH2 2.71Å
37	Q	86.4	Confident	84.8	Confident	97 Å²	97	81.3 Å²	81.3	45%	0.453	40%	0.4	S	S	.	.	H	α-helix	trans	-61.8	-46	176.6	-170.3	173.6	28.6	0	0	111.8	R33 E34 W39 C40 E41	R33-Q37 PolarHBondContact O-N 2.88Å; E34-Q37 PolarHBondContact O-N 3.23Å; Q37-W39 VanDerWaalsContact C-N 3.27Å; Q37-W39 PolarHBondContact O-N 3.36Å; Q37-C40 PolarHBondContact O-N 2.95Å; Q37-E41 PolarHBondContact O-N 3.15Å
38	K	90.4	Very high	85.9	Confident	107 Å²	107	77.9 Å²	77.9	47%	0.465	38%	0.382	S	S	.	.	H	α-helix	trans	-60.9	-37.6	174.5	-73.5	174.7	-177.3	165.8	0	111.7	E34 E35 E36 K42	E34-K38 WeakPolarHBondContact O-CG 3.37Å; E34-K38 PolarHBondContact O-N 3.46Å; E34-K38 WeakPolarHBondContact OE1-CE 3.16Å; E34-K38 IonicContact OE1-NZ 2.75Å; E34-K38 PolarHBondContact OE1-NZ 3.31Å; E35-K38 PolarHBondContact O-N 3.11Å; E36-K38 PolarHBondContact O-N 3.2Å; K38-K42 WeakPolarHBondContact O-CG 3.28Å; K38-K42 PolarHBondContact O-N 3.41Å
39	W	92.9	Very high	87.1	Confident	32 Å²	32	78.1 Å²	78.1	12%	0.121	38%	0.376	C	S	.	.	H	α-helix	trans	-68	-45.4	177.2	-175.2	87.4	0	0	0	111.8	E35 E36 Q37 E41 K42 A43 V86 R89 I96 M100	E35-W39 WeakPolarHBondContact O-CB 3.47Å; E35-W39 PolarHBondContact O-N 3.42Å; E36-W39 WeakPolarHBondContact O-CB 3.41Å; E36-W39 PolarHBondContact O-N 2.77Å; E36-W39 VanDerWaalsContact O-N 3.16Å; Q37-W39 VanDerWaalsContact C-N 3.27Å; Q37-W39 PolarHBondContact O-N 3.36Å; W39-E41 VanDerWaalsContact C-N 3.33Å; W39-E41 PolarHBondContact O-N 3.3Å; W39-K42 WeakPolarHBondContact O-CB 3.27Å; W39-K42 PolarHBondContact O-N 3.27Å; W39-K42 VanDerWaalsContact O-N 3.16Å; W39-A43 HydrophobicContact CH2-CB 4.45Å; W39-A43 HydrophobicContact CZ3-CB 4.36Å; W39-A43 PolarHBondContact O-N 3.34Å; W39-V86 HydrophobicContact CZ2-CB 3.87Å; W39-V86 HydrophobicContact CZ2-CG1 4.27Å; W39-V86 HydrophobicContact CZ2-CG2 4.37Å; W39-V86 PolarHBondContact NE1-O 3.24Å; W39-V86 VanDerWaalsContact NE1-O 3.08Å; W39-R89 HydrophobicContact CZ2-CB 4.31Å; W39-I96 HydrophobicContact CH2-CG1 4.22Å; W39-I96 HydrophobicContact CH2-CG2 3.68Å; W39-I96 HydrophobicContact CZ3-CG2 4.28Å; W39-M100 HydrophobicContact CZ3-CE 4.11Å
40	C	92.2	Very high	88.5	Confident	11 Å²	11	74 Å²	74	7%	0.074	35%	0.35	C	S	.	.	H	α-helix	trans	-57.8	-45.1	175.9	-73	0	0	0	0	111.7	E36 Q37 K42 A43 V44 M100	E36-C40 PolarHBondContact O-N 2.77Å; E36-C40 PolarHBondContact O-SG 3.43Å; Q37-C40 PolarHBondContact O-N 2.95Å; C40-K42 VanDerWaalsContact C-N 3.33Å; C40-K42 PolarHBondContact O-N 3.14Å; C40-A43 WeakPolarHBondContact O-CB 3.4Å; C40-A43 PolarHBondContact O-N 3.21Å; C40-A43 VanDerWaalsContact O-N 3.15Å; C40-V44 WeakPolarHBondContact O-CG2 3.35Å; C40-V44 PolarHBondContact O-N 3.11Å; C40-M100 HydrophobicContact CB-CE 3.9Å; C40-M100 HydrophobicContact CB-SD 4.48Å
41	E	93.4	Very high	89.8	Confident	68 Å²	68	69.9 Å²	69.9	32%	0.318	33%	0.325	S	S	.	.	H	α-helix	trans	-60.1	-42.6	177	-166.3	-171.8	172.1	0	0	111.8	V17 V21 Q37 W39 V44 K45	V17-E41 HydrophobicContact CG1-CG 4.34Å; V21-E41 HydrophobicContact CG2-CB 4.45Å; V21-E41 HydrophobicContact CG2-CG 4.42Å; Q37-E41 PolarHBondContact O-N 3.15Å; W39-E41 VanDerWaalsContact C-N 3.33Å; W39-E41 PolarHBondContact O-N 3.3Å; E41-V44 PolarHBondContact O-N 3.17Å; E41-K45 VanDerWaalsContact CD-NZ 3.31Å; E41-K45 HydrophobicContact CG-CD 4.28Å; E41-K45 WeakPolarHBondContact O-CB 3.46Å; E41-K45 VanDerWaalsContact O-CG 3.23Å; E41-K45 WeakPolarHBondContact O-CG 3.44Å; E41-K45 PolarHBondContact O-N 2.82Å; E41-K45 WeakPolarHBondContact OE1-CE 3.46Å; E41-K45 IonicContact OE1-NZ 3.98Å; E41-K45 PolarHBondContact OE1-NZ 3.37Å; E41-K45 IonicContact OE2-NZ 2.63Å
42	K	94.4	Very high	91	Very high	112 Å²	112	70 Å²	70	49%	0.487	31%	0.313	S	S	.	.	H	α-helix	trans	-63.1	-41.3	174.5	-72.1	173.7	179.4	178	0	112.2	K38 W39 C40 K45 S46 V86	K38-K42 WeakPolarHBondContact O-CG 3.28Å; K38-K42 PolarHBondContact O-N 3.41Å; W39-K42 WeakPolarHBondContact O-CB 3.27Å; W39-K42 PolarHBondContact O-N 3.27Å; W39-K42 VanDerWaalsContact O-N 3.16Å; C40-K42 VanDerWaalsContact C-N 3.33Å; C40-K42 PolarHBondContact O-N 3.14Å; K42-K45 PolarHBondContact O-N 2.95Å; K42-S46 WeakPolarHBondContact O-CB 3.34Å; K42-S46 PolarHBondContact O-N 2.99Å; K42-V86 HydrophobicContact CB-CG1 4.27Å
43	A	95.7	Very high	92.1	Very high	0 Å²	0	75 Å²	75	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-62.9	-45.3	178.6	0	0	0	0	0	111.8	W39 C40 S46 L47 V86 M100	W39-A43 HydrophobicContact CH2-CB 4.45Å; W39-A43 HydrophobicContact CZ3-CB 4.36Å; W39-A43 PolarHBondContact O-N 3.34Å; C40-A43 WeakPolarHBondContact O-CB 3.4Å; C40-A43 PolarHBondContact O-N 3.21Å; C40-A43 VanDerWaalsContact O-N 3.15Å; A43-S46 PolarHBondContact O-N 2.86Å; A43-L47 PolarHBondContact O-N 2.83Å; A43-V86 HydrophobicContact CB-CG1 3.83Å; A43-V86 HydrophobicContact CB-CG2 4.26Å; A43-M100 HydrophobicContact CB-CE 3.89Å
44	V	96.3	Very high	92.7	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-67.2	-44.5	177.1	176.9	0	0	0	0	110.9	V17 L20 V21 C40 E41 S46 L47 V48 M100 W101	V17-V44 HydrophobicContact CB-CG1 4.46Å; V17-V44 HydrophobicContact CG1-CB 4.5Å; V17-V44 HydrophobicContact CG1-CG1 4.09Å; L20-V44 HydrophobicContact CB-CG1 3.77Å; L20-V44 HydrophobicContact CD1-CG1 4.14Å; V21-V44 HydrophobicContact CG2-CB 3.85Å; V21-V44 HydrophobicContact CG2-CG1 4.1Å; V21-V44 HydrophobicContact CG2-CG2 3.77Å; C40-V44 WeakPolarHBondContact O-CG2 3.35Å; C40-V44 PolarHBondContact O-N 3.11Å; E41-V44 PolarHBondContact O-N 3.17Å; V44-S46 VanDerWaalsContact C-N 3.28Å; V44-S46 PolarHBondContact O-N 3.22Å; V44-L47 PolarHBondContact O-N 3.39Å; V44-L47 VanDerWaalsContact O-N 3.15Å; V44-V48 HydrophobicContact CG1-CG2 4.12Å; V44-V48 WeakPolarHBondContact O-CB 3.33Å; V44-V48 VanDerWaalsContact O-CG2 3.32Å; V44-V48 WeakPolarHBondContact O-CG2 3.3Å; V44-V48 PolarHBondContact O-N 3.39Å; V44-M100 HydrophobicContact CG2-SD 3.54Å; V44-M100 VanDerWaalsContact CG2-SD 3.54Å; V44-W101 HydrophobicContact CG2-CH2 4.21Å; V44-W101 HydrophobicContact CG2-CZ2 3.78Å
45	K	95.2	Very high	93.2	Very high	94 Å²	94	66.2 Å²	66.2	41%	0.409	32%	0.323	S	S	.	.	H	α-helix	trans	-55.3	-44.4	174.5	-76.7	175	-179.6	169.6	0	111.7	V17 E41 K42 K49	V17-K45 HydrophobicContact CB-CG 4.46Å; V17-K45 HydrophobicContact CG1-CG 3.6Å; V17-K45 HydrophobicContact CG2-CG 4.08Å; E41-K45 VanDerWaalsContact CD-NZ 3.31Å; E41-K45 HydrophobicContact CG-CD 4.28Å; E41-K45 WeakPolarHBondContact O-CB 3.46Å; E41-K45 VanDerWaalsContact O-CG 3.23Å; E41-K45 WeakPolarHBondContact O-CG 3.44Å; E41-K45 PolarHBondContact O-N 2.82Å; E41-K45 WeakPolarHBondContact OE1-CE 3.46Å; E41-K45 IonicContact OE1-NZ 3.98Å; E41-K45 PolarHBondContact OE1-NZ 3.37Å; E41-K45 IonicContact OE2-NZ 2.63Å; K42-K45 PolarHBondContact O-N 2.95Å; K45-K49 PolarHBondContact O-N 3.07Å; K45-K49 VanDerWaalsContact O-N 3.09Å
46	S	94.2	Very high	93.6	Very high	39 Å²	39	62 Å²	62	27%	0.273	30%	0.304	S	S	.	.	H	α-helix	trans	-63.7	-44.4	177	-174.1	0	0	0	0	111.9	K42 A43 V44 K49 K50	K42-S46 WeakPolarHBondContact O-CB 3.34Å; K42-S46 PolarHBondContact O-N 2.99Å; A43-S46 PolarHBondContact O-N 2.86Å; V44-S46 VanDerWaalsContact C-N 3.28Å; V44-S46 PolarHBondContact O-N 3.22Å; S46-K49 PolarHBondContact O-N 3.39Å; S46-K50 PolarHBondContact O-N 2.97Å
47	L	96.6	Very high	94	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-62	-50.8	177.2	-174	58.8	0	0	0	111.5	A43 V44 K49 K50 L51 L60 I76 Y97 W101 V131	A43-L47 PolarHBondContact O-N 2.83Å; V44-L47 PolarHBondContact O-N 3.39Å; V44-L47 VanDerWaalsContact O-N 3.15Å; L47-K49 VanDerWaalsContact C-N 3.25Å; L47-K49 PolarHBondContact O-N 2.96Å; L47-K50 WeakPolarHBondContact O-CA 3.41Å; L47-K50 WeakPolarHBondContact O-CB 3.31Å; L47-K50 PolarHBondContact O-N 2.92Å; L47-L51 HydrophobicContact CD1-CD1 3.99Å; L47-L51 HydrophobicContact CD1-CD2 4.26Å; L47-L51 HydrophobicContact CD1-CG 3.94Å; L47-L51 HydrophobicContact CD2-CD1 4.27Å; L47-L51 HydrophobicContact CG-CD1 3.81Å; L47-L51 HydrophobicContact CG-CG 4.11Å; L47-L51 WeakPolarHBondContact O-CG 3.48Å; L47-L51 PolarHBondContact O-N 2.92Å; L47-L60 HydrophobicContact CD2-CD1 4.44Å; L47-L60 HydrophobicContact CD2-CD2 3.65Å; L47-L60 HydrophobicContact CG-CD2 4.24Å; L47-I76 HydrophobicContact CD1-CG2 3.88Å; L47-Y97 HydrophobicContact CB-CE1 4.09Å; L47-Y97 WeakPolarHBondContact CB-OH 3.31Å; L47-Y97 HydrophobicContact CD1-CE2 4.04Å; L47-Y97 HydrophobicContact CD2-CD1 4.01Å; L47-Y97 HydrophobicContact CD2-CE1 3.66Å; L47-Y97 HydrophobicContact CD2-CE2 4.25Å; L47-Y97 HydrophobicContact CD2-CG 4.44Å; L47-Y97 HydrophobicContact CG-CE1 4.32Å; L47-W101 HydrophobicContact CD2-CH2 3.75Å; L47-W101 HydrophobicContact CD2-CZ3 4.04Å; L47-V131 HydrophobicContact CD1-CG2 4.1Å
48	V	96.3	Very high	94.4	Very high	4 Å²	4	62 Å²	62	2%	0.024	31%	0.309	C	S	.	.	H	α-helix	trans	-57.1	-40.9	179.6	170.4	0	0	0	0	110.7	I16 V17 L20 V44 K50 L51 K52 L57	I16-V48 HydrophobicContact CG2-CG1 3.94Å; I16-V48 HydrophobicContact CG2-CG2 4.26Å; V17-V48 HydrophobicContact CG2-CB 4.23Å; V17-V48 HydrophobicContact CG2-CG1 4.33Å; V17-V48 HydrophobicContact CG2-CG2 3.99Å; L20-V48 HydrophobicContact CD1-CG2 3.88Å; V44-V48 HydrophobicContact CG1-CG2 4.12Å; V44-V48 WeakPolarHBondContact O-CB 3.33Å; V44-V48 VanDerWaalsContact O-CG2 3.32Å; V44-V48 WeakPolarHBondContact O-CG2 3.3Å; V44-V48 PolarHBondContact O-N 3.39Å; V48-K50 VanDerWaalsContact C-N 3.32Å; V48-K50 PolarHBondContact O-N 3.26Å; V48-L51 PolarHBondContact O-N 3.42Å; V48-K52 HydrophobicContact CG1-CD 4.33Å; V48-K52 HydrophobicContact CG1-CG 4.38Å; V48-K52 WeakPolarHBondContact O-CB 3.21Å; V48-K52 VanDerWaalsContact O-CG 3.3Å; V48-K52 WeakPolarHBondContact O-CG 3.23Å; V48-K52 PolarHBondContact O-N 2.78Å; V48-L57 HydrophobicContact CB-CD1 4.31Å; V48-L57 HydrophobicContact CG1-CD1 4Å; V48-L57 HydrophobicContact CG1-CD2 4.23Å; V48-L57 HydrophobicContact CG2-CD1 3.98Å
49	K	94.2	Very high	94.7	Very high	150 Å²	150	58.7 Å²	58.7	65%	0.652	30%	0.295	S	S	*	.	H	α-helix	trans	-62.3	-37	175.7	-173.7	177.1	-179.7	177.6	0	112.6	K45 S46 L47	K45-K49 PolarHBondContact O-N 3.07Å; K45-K49 VanDerWaalsContact O-N 3.09Å; S46-K49 PolarHBondContact O-N 3.39Å; L47-K49 VanDerWaalsContact C-N 3.25Å; L47-K49 PolarHBondContact O-N 2.96Å
50	K	94	Very high	94.8	Very high	79 Å²	79	57.2 Å²	57.2	34%	0.343	29%	0.289	S	S	.	.	H	α-helix	trans	-70.9	-47.7	176.1	-71.5	169.2	178.4	-87.2	0	111.2	S46 L47 V48 K52 K53 S54 I76	S46-K50 PolarHBondContact O-N 2.97Å; L47-K50 WeakPolarHBondContact O-CA 3.41Å; L47-K50 WeakPolarHBondContact O-CB 3.31Å; L47-K50 PolarHBondContact O-N 2.92Å; V48-K50 VanDerWaalsContact C-N 3.32Å; V48-K50 PolarHBondContact O-N 3.26Å; K50-K52 VanDerWaalsContact C-N 3.34Å; K50-K52 PolarHBondContact O-N 3.24Å; K50-K53 WeakPolarHBondContact O-CB 3.38Å; K50-K53 PolarHBondContact O-N 2.98Å; K50-K53 VanDerWaalsContact O-N 3.08Å; K50-S54 PolarHBondContact O-N 3.41Å; K50-I76 HydrophobicContact CD-CG2 4.42Å
51	L	96.4	Very high	94.9	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-71.7	-26	-176.4	-59.4	-177.1	0	0	0	113.7	L47 V48 K53 S54 G55 M56 L57 L60 I74 I76	L47-L51 HydrophobicContact CD1-CD1 3.99Å; L47-L51 HydrophobicContact CD1-CD2 4.26Å; L47-L51 HydrophobicContact CD1-CG 3.94Å; L47-L51 HydrophobicContact CD2-CD1 4.27Å; L47-L51 HydrophobicContact CG-CD1 3.81Å; L47-L51 HydrophobicContact CG-CG 4.11Å; L47-L51 WeakPolarHBondContact O-CG 3.48Å; L47-L51 PolarHBondContact O-N 2.92Å; V48-L51 PolarHBondContact O-N 3.42Å; L51-K53 PolarHBondContact O-N 3.34Å; L51-S54 WeakPolarHBondContact CA-OG 3.36Å; L51-S54 PolarHBondContact O-N 2.9Å; L51-S54 PolarHBondContact O-OG 3.12Å; L51-G55 PolarHBondContact O-N 3.43Å; L51-M56 HydrophobicContact CD2-CB 4.2Å; L51-M56 PolarHBondContact O-N 3.17Å; L51-M56 VanDerWaalsContact O-N 3.16Å; L51-L57 HydrophobicContact CB-CB 4.36Å; L51-L57 HydrophobicContact CB-CD1 4.49Å; L51-L60 HydrophobicContact CD1-CB 3.77Å; L51-L60 HydrophobicContact CD1-CD2 3.49Å; L51-L60 VanDerWaalsContact CD1-CD2 3.49Å; L51-L60 HydrophobicContact CD1-CG 4.16Å; L51-I74 HydrophobicContact CD1-CG2 3.7Å; L51-I74 HydrophobicContact CD2-CG2 3.75Å; L51-I74 HydrophobicContact CG-CG2 4.4Å; L51-I76 HydrophobicContact CD2-CG2 4.23Å
52	K	94.5	Very high	95	Very high	122 Å²	122	60 Å²	60	53%	0.53	30%	0.301	S	S	.	.	H	α-helix	trans	-60.6	-31.9	168.8	-81.1	-173.5	175.6	-164.9	0	112.6	N14 V48 K50 L57	N14-K52 PolarHBondContact ND2-NZ 3.27Å; V48-K52 HydrophobicContact CG1-CD 4.33Å; V48-K52 HydrophobicContact CG1-CG 4.38Å; V48-K52 WeakPolarHBondContact O-CB 3.21Å; V48-K52 VanDerWaalsContact O-CG 3.3Å; V48-K52 WeakPolarHBondContact O-CG 3.23Å; V48-K52 PolarHBondContact O-N 2.78Å; K50-K52 VanDerWaalsContact C-N 3.34Å; K50-K52 PolarHBondContact O-N 3.24Å; K52-L57 HydrophobicContact CG-CD2 3.79Å
53	K	92.8	Very high	95.1	Very high	182 Å²	182	54.6 Å²	54.6	79%	0.791	28%	0.278	S	S	*	.	H	α-helix	trans	-78.8	-32.2	178.3	-63.7	-174.3	-179.8	-166.9	0	112.5	K50 L51	K50-K53 WeakPolarHBondContact O-CB 3.38Å; K50-K53 PolarHBondContact O-N 2.98Å; K50-K53 VanDerWaalsContact O-N 3.08Å; L51-K53 PolarHBondContact O-N 3.34Å
54	S	93.6	Very high	95.1	Very high	62 Å²	62	54.8 Å²	54.8	43%	0.434	28%	0.279	S	S	.	.	H	α-helix	trans	-91.1	-7.3	178.7	60.5	0	0	0	0	114.2	K50 L51 M56	K50-S54 PolarHBondContact O-N 3.41Å; L51-S54 WeakPolarHBondContact CA-OG 3.36Å; L51-S54 PolarHBondContact O-N 2.9Å; L51-S54 PolarHBondContact O-OG 3.12Å; S54-M56 VanDerWaalsContact C-N 3.32Å; S54-M56 PolarHBondContact O-N 2.97Å
55	G	94.6	Very high	95	Very high	60 Å²	60	58.2 Å²	58.2	62%	0.619	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.5	14.5	-178.8	0	0	0	0	0	114.7	L51	L51-G55 PolarHBondContact O-N 3.43Å
56	M	95.2	Very high	94.9	Very high	36 Å²	36	58.8 Å²	58.8	18%	0.177	31%	0.305	C	S	.	.			trans	-99.2	9.6	-174.8	-54.8	-177.7	91.2	0	0	113.8	L51 S54 D58 E59 L60 C73 T75	L51-M56 HydrophobicContact CD2-CB 4.2Å; L51-M56 PolarHBondContact O-N 3.17Å; L51-M56 VanDerWaalsContact O-N 3.16Å; S54-M56 VanDerWaalsContact C-N 3.32Å; S54-M56 PolarHBondContact O-N 2.97Å; M56-D58 VanDerWaalsContact C-N 3.35Å; M56-D58 PolarHBondContact O-N 2.97Å; M56-E59 PolarHBondContact O-N 2.71Å; M56-L60 PolarHBondContact O-N 3.39Å; M56-L60 VanDerWaalsContact O-N 3.07Å; M56-C73 WeakPolarHBondContact CE-O 3.27Å; M56-T75 PolarHBondContact SD-N 3.39Å; M56-T75 VanDerWaalsContact SD-N 3.43Å; M56-T75 PolarHBondContact SD-OG1 3.06Å; M56-T75 VanDerWaalsContact SD-OG1 3.35Å
57	L	95.6	Very high	94.9	Very high	19 Å²	19	65.2 Å²	65.2	10%	0.099	32%	0.323	C	S	.	.	H	α-helix	trans	-64.2	-40.7	-175.1	-176.8	61.7	0	0	0	112.1	I16 V48 L51 K52 E59 L60 D61	I16-L57 HydrophobicContact CD1-CD1 3.85Å; I16-L57 HydrophobicContact CD1-CD2 3.78Å; I16-L57 HydrophobicContact CD1-CG 3.63Å; I16-L57 HydrophobicContact CG2-CD2 4.42Å; V48-L57 HydrophobicContact CB-CD1 4.31Å; V48-L57 HydrophobicContact CG1-CD1 4Å; V48-L57 HydrophobicContact CG1-CD2 4.23Å; V48-L57 HydrophobicContact CG2-CD1 3.98Å; L51-L57 HydrophobicContact CB-CB 4.36Å; L51-L57 HydrophobicContact CB-CD1 4.49Å; K52-L57 HydrophobicContact CG-CD2 3.79Å; L57-E59 VanDerWaalsContact C-N 3.33Å; L57-L60 WeakPolarHBondContact O-CB 3.48Å; L57-L60 PolarHBondContact O-N 3.39Å; L57-D61 PolarHBondContact O-N 3.49Å
58	D	94.7	Very high	94.6	Very high	124 Å²	124	67.7 Å²	67.7	66%	0.663	34%	0.337	S	S	*	.	H	α-helix	trans	-68.8	-34.8	179.4	-60.2	-25.9	0	0	0	111.3	M56 L60 D61 K62	M56-D58 VanDerWaalsContact C-N 3.35Å; M56-D58 PolarHBondContact O-N 2.97Å; D58-L60 VanDerWaalsContact C-N 3.34Å; D58-D61 PolarHBondContact O-N 3.15Å; D58-K62 VanDerWaalsContact O-CB 3.27Å; D58-K62 WeakPolarHBondContact O-CB 3.34Å; D58-K62 PolarHBondContact O-N 2.79Å
59	E	94.9	Very high	94.4	Very high	39 Å²	39	69.5 Å²	69.5	18%	0.182	35%	0.349	C	S	.	.	H	α-helix	trans	-66.7	-35.5	173.7	-63.6	-70.2	178.2	0	0	111.5	M56 L57 A63 K72	M56-E59 PolarHBondContact O-N 2.71Å; L57-E59 VanDerWaalsContact C-N 3.33Å; E59-A63 VanDerWaalsContact O-CB 3.28Å; E59-A63 WeakPolarHBondContact O-CB 3.49Å; E59-A63 PolarHBondContact O-N 3.02Å; E59-K72 HydrophobicContact CG-CD 4.45Å; E59-K72 WeakPolarHBondContact OE1-CD 3.43Å; E59-K72 WeakPolarHBondContact OE1-CE 3.29Å; E59-K72 IonicContact OE1-NZ 3.02Å; E59-K72 PolarHBondContact OE1-NZ 2.93Å
60	L	96	Very high	94.4	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-65	-49.2	170.5	176.9	69.3	0	0	0	111.9	L20 L47 L51 M56 L57 D58 K62 A63 I64 I74	L20-L60 HydrophobicContact CD1-CD2 3.82Å; L20-L60 HydrophobicContact CD1-CG 4.49Å; L20-L60 HydrophobicContact CD2-CG 4.42Å; L47-L60 HydrophobicContact CD2-CD1 4.44Å; L47-L60 HydrophobicContact CD2-CD2 3.65Å; L47-L60 HydrophobicContact CG-CD2 4.24Å; L51-L60 HydrophobicContact CD1-CB 3.77Å; L51-L60 HydrophobicContact CD1-CD2 3.49Å; L51-L60 VanDerWaalsContact CD1-CD2 3.49Å; L51-L60 HydrophobicContact CD1-CG 4.16Å; M56-L60 PolarHBondContact O-N 3.39Å; M56-L60 VanDerWaalsContact O-N 3.07Å; L57-L60 WeakPolarHBondContact O-CB 3.48Å; L57-L60 PolarHBondContact O-N 3.39Å; D58-L60 VanDerWaalsContact C-N 3.34Å; L60-K62 VanDerWaalsContact C-N 3.26Å; L60-K62 PolarHBondContact O-N 2.82Å; L60-A63 PolarHBondContact O-N 3.41Å; L60-I64 HydrophobicContact CD1-CD1 4.13Å; L60-I64 HydrophobicContact CD1-CG1 3.76Å; L60-I64 HydrophobicContact CG-CG1 4.28Å; L60-I64 WeakPolarHBondContact O-CG1 3.42Å; L60-I64 PolarHBondContact O-N 3.44Å; L60-I74 VanDerWaalsContact CA-CD1 3.44Å; L60-I74 HydrophobicContact CB-CD1 3.87Å; L60-I74 HydrophobicContact CB-CG2 4.42Å; L60-I74 HydrophobicContact CD1-CD1 3.68Å; L60-I74 HydrophobicContact CG-CD1 4.39Å
61	D	95	Very high	94.5	Very high	36 Å²	36	65.4 Å²	65.4	19%	0.193	33%	0.334	C	S	.	.	H	α-helix	trans	-57.8	-43.2	178.7	-170.4	66.8	0	0	0	111.2	I16 K19 L57 D58 T65	I16-D61 HydrophobicContact CD1-CB 4.43Å; K19-D61 WeakPolarHBondContact CD-OD1 3.19Å; K19-D61 VanDerWaalsContact CE-OD1 3.3Å; K19-D61 WeakPolarHBondContact CE-OD1 3.43Å; K19-D61 IonicContact NZ-OD1 2.72Å; K19-D61 PolarHBondContact NZ-OD1 3.05Å; K19-D61 IonicContact NZ-OD2 2.73Å; K19-D61 PolarHBondContact NZ-OD2 3.07Å; L57-D61 PolarHBondContact O-N 3.49Å; D58-D61 PolarHBondContact O-N 3.15Å; D61-T65 WeakPolarHBondContact O-CB 3.39Å; D61-T65 PolarHBondContact O-N 3.16Å; D61-T65 PolarHBondContact O-OG1 3.11Å
62	K	95.2	Very high	94.5	Very high	101 Å²	101	71.7 Å²	71.7	44%	0.439	36%	0.362	S	S	.	.	H	α-helix	trans	-61	-50.9	174.6	-173.8	-179.8	178.9	-178.3	0	112.1	D58 L60 I64 T65 M66 T71	D58-K62 VanDerWaalsContact O-CB 3.27Å; D58-K62 WeakPolarHBondContact O-CB 3.34Å; D58-K62 PolarHBondContact O-N 2.79Å; L60-K62 VanDerWaalsContact C-N 3.26Å; L60-K62 PolarHBondContact O-N 2.82Å; K62-I64 PolarHBondContact O-N 3.25Å; K62-T65 PolarHBondContact O-N 3.49Å; K62-M66 HydrophobicContact CD-SD 4.04Å; K62-M66 WeakPolarHBondContact CE-SD 3.02Å; K62-M66 HydrophobicContact CG-CG 4.18Å; K62-M66 HydrophobicContact CG-SD 3.44Å; K62-M66 WeakPolarHBondContact CG-SD 3.27Å; K62-M66 VanDerWaalsContact O-CB 3.28Å; K62-M66 WeakPolarHBondContact O-CB 3.36Å; K62-M66 WeakPolarHBondContact O-CG 3.4Å; K62-M66 PolarHBondContact O-N 3.47Å; K62-T71 HydrophobicContact CG-CG2 4.37Å
63	A	95.5	Very high	94.6	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-59.8	-45.2	-179.1	0	0	0	0	0	112.6	E59 L60 R67 T71 I74 Y134	E59-A63 VanDerWaalsContact O-CB 3.28Å; E59-A63 WeakPolarHBondContact O-CB 3.49Å; E59-A63 PolarHBondContact O-N 3.02Å; L60-A63 PolarHBondContact O-N 3.41Å; A63-R67 WeakPolarHBondContact O-CA 3.42Å; A63-R67 PolarHBondContact O-N 2.79Å; A63-T71 HydrophobicContact CB-CG2 4.3Å; A63-I74 HydrophobicContact CB-CD1 3.83Å; A63-Y134 VanDerWaalsContact O-CD2 3.29Å; A63-Y134 WeakPolarHBondContact O-CD2 3.29Å; A63-Y134 VanDerWaalsContact O-CE2 3.25Å; A63-Y134 WeakPolarHBondContact O-CE2 3.37Å
64	I	95.6	Very high	94.9	Very high	4 Å²	4	58.1 Å²	58.1	2%	0.021	31%	0.305	C	S	.	.	H	α-helix	trans	-70.8	-38.3	179.9	-57.3	-53.4	0	0	0	111.8	L20 L23 L60 K62 W101 P133 Y134	L20-I64 HydrophobicContact CD2-CB 4.18Å; L20-I64 HydrophobicContact CD2-CG1 4.13Å; L20-I64 HydrophobicContact CD2-CG2 4.36Å; L23-I64 HydrophobicContact CB-CG2 3.84Å; L23-I64 HydrophobicContact CD1-CG2 3.85Å; L23-I64 HydrophobicContact CG-CG2 4.49Å; L60-I64 HydrophobicContact CD1-CD1 4.13Å; L60-I64 HydrophobicContact CD1-CG1 3.76Å; L60-I64 HydrophobicContact CG-CG1 4.28Å; L60-I64 WeakPolarHBondContact O-CG1 3.42Å; L60-I64 PolarHBondContact O-N 3.44Å; K62-I64 PolarHBondContact O-N 3.25Å; I64-W101 HydrophobicContact CD1-CB 4.02Å; I64-W101 HydrophobicContact CD1-CD2 3.72Å; I64-W101 HydrophobicContact CD1-CE3 3.91Å; I64-W101 HydrophobicContact CD1-CG 3.74Å; I64-W101 HydrophobicContact CG1-CD2 4.3Å; I64-W101 HydrophobicContact CG1-CG 4.46Å; I64-W101 HydrophobicContact CG2-CG 4.3Å; I64-P133 HydrophobicContact CD1-CG 3.36Å; I64-Y134 HydrophobicContact CD1-CE2 4.16Å
65	T	94.5	Very high	95.1	Very high	72 Å²	72	55.6 Å²	55.6	44%	0.442	29%	0.287	S	S	.	.	H	α-helix	trans	-73.3	-46.5	-179	-55.2	0	0	0	0	111.9	K19 D61 K62	K19-T65 PolarHBondContact NZ-OG1 3.12Å; D61-T65 WeakPolarHBondContact O-CB 3.39Å; D61-T65 PolarHBondContact O-N 3.16Å; D61-T65 PolarHBondContact O-OG1 3.11Å; K62-T65 PolarHBondContact O-N 3.49Å
66	M	93.9	Very high	95.2	Very high	106 Å²	106	53 Å²	53	52%	0.522	26%	0.258	S	S	.	.	H	α-helix	trans	-78.9	-20.7	-177.2	-68.1	-177.4	57.9	0	0	113.6	K62 D68	K62-M66 HydrophobicContact CD-SD 4.04Å; K62-M66 WeakPolarHBondContact CE-SD 3.02Å; K62-M66 HydrophobicContact CG-CG 4.18Å; K62-M66 HydrophobicContact CG-SD 3.44Å; K62-M66 WeakPolarHBondContact CG-SD 3.27Å; K62-M66 VanDerWaalsContact O-CB 3.28Å; K62-M66 WeakPolarHBondContact O-CB 3.36Å; K62-M66 WeakPolarHBondContact O-CG 3.4Å; K62-M66 PolarHBondContact O-N 3.47Å; M66-D68 HydrophobicContact CB-CB 4.15Å; M66-D68 PolarHBondContact O-N 2.74Å
67	R	94	Very high	95.2	Very high	173 Å²	173	55.6 Å²	55.6	65%	0.653	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	36	-176.2	-47.6	-166.5	174.9	-179.4	-3.2	113.9	A63 Y134	A63-R67 WeakPolarHBondContact O-CA 3.42Å; A63-R67 PolarHBondContact O-N 2.79Å; R67-Y134 VanDerWaalsContact CA-CE1 3.42Å; R67-Y134 HydrophobicContact CB-CD1 4.35Å; R67-Y134 HydrophobicContact CB-CE1 3.53Å; R67-Y134 HydrophobicContact CB-CE2 4.41Å; R67-Y134 WeakPolarHBondContact CB-OH 3.48Å; R67-Y134 HydrophobicContact CG-CE1 4.28Å; R67-Y134 VanDerWaalsContact CG-OH 3.24Å; R67-Y134 WeakPolarHBondContact CG-OH 3.5Å; R67-Y134 WeakPolarHBondContact O-CD1 3.34Å
68	D	90.5	Very high	95.2	Very high	53 Å²	53	57.4 Å²	57.4	28%	0.283	28%	0.284	S	S	.	.			trans	-112.5	127.6	-170.7	-178.6	11.3	0	0	0	112.2	M66 Q70 T71	M66-D68 HydrophobicContact CB-CB 4.15Å; M66-D68 PolarHBondContact O-N 2.74Å; D68-Q70 VanDerWaalsContact C-N 3.28Å; D68-Q70 PolarHBondContact O-N 3.05Å; D68-Q70 WeakPolarHBondContact OD1-CB 3.48Å; D68-Q70 PolarHBondContact OD1-N 3.48Å; D68-T71 HydrophobicContact CB-CG2 4.27Å; D68-T71 WeakPolarHBondContact O-CG2 3.47Å; D68-T71 PolarHBondContact O-N 3.17Å; D68-T71 PolarHBondContact O-OG1 2.9Å
69	S	92.1	Very high	95.2	Very high	42 Å²	42	53.8 Å²	53.8	29%	0.294	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-21	175.9	68.1	0	0	0	0	113.8	T71 H117 Y134 H135	S69-T71 PolarHBondContact O-N 3.43Å; S69-H117 PolarHBondContact O-NE2 2.98Å; S69-Y134 VanDerWaalsContact CB-O 3.27Å; S69-Y134 WeakPolarHBondContact CB-O 3.25Å; S69-H135 PolarHBondContact O-CD2 3.45Å; S69-H135 PolarHBondContact O-NE2 3.08Å
70	Q	94.4	Very high	95	Very high	134 Å²	134	61.2 Å²	61.2	63%	0.626	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-2	179	-60.8	-60	-32.4	0	0	113.5	D68	D68-Q70 VanDerWaalsContact C-N 3.28Å; D68-Q70 PolarHBondContact O-N 3.05Å; D68-Q70 WeakPolarHBondContact OD1-CB 3.48Å; D68-Q70 PolarHBondContact OD1-N 3.48Å
71	T	94.8	Very high	94.7	Very high	8 Å²	8	64.8 Å²	64.8	5%	0.049	33%	0.327	C	S	.	.	S	Bend	trans	-64.8	162.1	171.3	54.6	0	0	0	0	112	K62 A63 D68 S69 N132 H135	K62-T71 HydrophobicContact CG-CG2 4.37Å; A63-T71 HydrophobicContact CB-CG2 4.3Å; D68-T71 HydrophobicContact CB-CG2 4.27Å; D68-T71 WeakPolarHBondContact O-CG2 3.47Å; D68-T71 PolarHBondContact O-N 3.17Å; D68-T71 PolarHBondContact O-OG1 2.9Å; S69-T71 PolarHBondContact O-N 3.43Å; T71-N132 PolarHBondContact OG1-ND2 2.77Å; T71-H135 PolarHBondContact O-CE1 3.25Å; T71-H135 VanDerWaalsContact O-CE1 3.31Å; T71-H135 PolarHBondContact O-NE2 3.31Å
72	K	96.3	Very high	94.6	Very high	133 Å²	133	63.5 Å²	63.5	58%	0.578	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-65.7	160.1	-179.3	-64.6	-175.8	-168.2	148.2	0	111.6	E59 N132 H135	E59-K72 HydrophobicContact CG-CD 4.45Å; E59-K72 WeakPolarHBondContact OE1-CD 3.43Å; E59-K72 WeakPolarHBondContact OE1-CE 3.29Å; E59-K72 IonicContact OE1-NZ 3.02Å; E59-K72 PolarHBondContact OE1-NZ 2.93Å; K72-N132 PolarHBondContact O-ND2 3.04Å; K72-H135 VanDerWaalsContact C-CE1 3.46Å; K72-H135 PolarHBondContact O-CE1 3.35Å
73	C	97.6	Very high	94.6	Very high	18 Å²	18	64.4 Å²	64.4	12%	0.122	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-59.1	142.8	167.6	-68.6	0	0	0	0	108.7	M56 T75 F120 H135	M56-C73 WeakPolarHBondContact CE-O 3.27Å; C73-T75 HydrophobicContact CB-CG2 4.25Å; C73-F120 HydrophobicContact CB-CD2 3.87Å; C73-H135 VanDerWaalsContact CA-CE1 3.46Å; C73-H135 WeakPolarHBondContact CA-CE1 3.25Å; C73-H135 PolarHBondContact N-CE1 2.95Å; C73-H135 VanDerWaalsContact N-CE1 3.34Å; C73-H135 VanDerWaalsContact SG-CE1 3.58Å
74	I	97.8	Very high	94.5	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	33%	0.327	C	S	.	.			trans	-114.1	109.4	172.4	-61.2	162.1	0	0	0	105.7	L51 L60 A63 C130 V131 N132	L51-I74 HydrophobicContact CD1-CG2 3.7Å; L51-I74 HydrophobicContact CD2-CG2 3.75Å; L51-I74 HydrophobicContact CG-CG2 4.4Å; L60-I74 VanDerWaalsContact CA-CD1 3.44Å; L60-I74 HydrophobicContact CB-CD1 3.87Å; L60-I74 HydrophobicContact CB-CG2 4.42Å; L60-I74 HydrophobicContact CD1-CD1 3.68Å; L60-I74 HydrophobicContact CG-CD1 4.39Å; A63-I74 HydrophobicContact CB-CD1 3.83Å; I74-C130 CarbonylContact O-C 3.59Å; I74-C130 VanDerWaalsContact O-CA 3.25Å; I74-C130 WeakPolarHBondContact O-CA 3.27Å; I74-V131 HydrophobicContact CB-CG2 4.28Å; I74-V131 HydrophobicContact CG2-CG2 3.8Å; I74-V131 VanDerWaalsContact O-CG2 3.29Å; I74-V131 WeakPolarHBondContact O-CG2 3.37Å; I74-V131 PolarHBondContact O-N 2.83Å; I74-N132 HydrophobicContact CB-CB 4.09Å; I74-N132 HydrophobicContact CD1-CB 3.72Å; I74-N132 HydrophobicContact CG1-CB 3.98Å
75	T	97.8	Very high	94.5	Very high	10 Å²	10	70.3 Å²	70.3	6%	0.061	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	149.5	-169	57.8	0	0	0	0	112.9	M56 C73 F120 E128 V129	M56-T75 PolarHBondContact SD-N 3.39Å; M56-T75 VanDerWaalsContact SD-N 3.43Å; M56-T75 PolarHBondContact SD-OG1 3.06Å; M56-T75 VanDerWaalsContact SD-OG1 3.35Å; C73-T75 HydrophobicContact CB-CG2 4.25Å; T75-F120 HydrophobicContact CG2-CB 3.74Å; T75-F120 HydrophobicContact CG2-CD1 3.99Å; T75-F120 HydrophobicContact CG2-CD2 3.74Å; T75-F120 HydrophobicContact CG2-CE2 4.31Å; T75-F120 HydrophobicContact CG2-CG 3.56Å; T75-E128 HydrophobicContact CG2-CB 4.36Å; T75-E128 PolarHBondContact OG1-OE1 3.19Å; T75-V129 WeakPolarHBondContact CA-O 3.37Å
76	I	97	Very high	94.4	Very high	4 Å²	4	67.1 Å²	67.1	2%	0.021	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	154.2	164.2	64.6	172.6	0	0	0	109.5	L47 K50 L51 R78 L84 P93 E128 V129 V131	L47-I76 HydrophobicContact CD1-CG2 3.88Å; K50-I76 HydrophobicContact CD-CG2 4.42Å; L51-I76 HydrophobicContact CD2-CG2 4.23Å; I76-R78 PolarHBondContact O-N 3.35Å; I76-L84 HydrophobicContact CD1-CD2 4.4Å; I76-P93 HydrophobicContact CD1-CB 3.72Å; I76-P93 HydrophobicContact CD1-CG 4.44Å; I76-E128 WeakPolarHBondContact O-CA 3.37Å; I76-V129 HydrophobicContact CD1-CG1 4.25Å; I76-V129 HydrophobicContact CG1-CG1 3.56Å; I76-V129 PolarHBondContact N-O 3.37Å; I76-V129 WeakPolarHBondContact O-CG1 3.48Å; I76-V129 PolarHBondContact O-N 3.01Å; I76-V131 HydrophobicContact CD1-CG1 3.83Å; I76-V131 HydrophobicContact CG1-CG1 3.89Å; I76-V131 HydrophobicContact CG2-CG2 4.16Å
77	P	96.1	Very high	94.2	Very high	91 Å²	91	65 Å²	65	59%	0.591	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59	135.2	173.1	-24.8	34.2	0	0	0	112
78	R	96	Very high	93.9	Very high	58 Å²	58	65.6 Å²	65.6	22%	0.219	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-76.3	133.8	174.8	179.8	178.8	-68.3	-93.4	0.4	110	I76 F122 K126 E127	I76-R78 PolarHBondContact O-N 3.35Å; R78-F122 PolarHBondContact NH2-O 3.21Å; R78-K126 VanDerWaalsContact CD-O 3.28Å; R78-K126 WeakPolarHBondContact CD-O 3.4Å; R78-K126 PolarHBondContact NE-O 2.99Å; R78-E127 WeakPolarHBondContact CB-O 3.24Å; R78-E127 PolarHBondContact N-O 3.41Å
79	S	94.5	Very high	93.9	Very high	47 Å²	47	67 Å²	67	33%	0.329	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-78.8	163.4	171	59.3	0	0	0	0	111.5	D81 G82 R83	S79-D81 PolarHBondContact O-N 3.21Å; S79-D81 VanDerWaalsContact O-N 3.14Å; S79-D81 PolarHBondContact OG-OD1 3.17Å; S79-G82 PolarHBondContact O-N 3.24Å; S79-G82 VanDerWaalsContact OG-C 3.32Å; S79-G82 WeakPolarHBondContact OG-CA 3.39Å; S79-G82 PolarHBondContact OG-N 3.1Å; S79-G82 VanDerWaalsContact OG-N 3.17Å; S79-R83 PolarHBondContact OG-N 2.84Å; S79-R83 PolarHBondContact OG-O 3.4Å
80	L	91	Very high	93.9	Very high	196 Å²	196	70.9 Å²	70.9	100%	1.026	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-36.1	178.1	-65.9	174.9	0	0	0	113.5
81	D	90.2	Very high	93.8	Very high	75 Å²	75	65.4 Å²	65.4	40%	0.401	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	5.6	178.5	74	-16.5	0	0	0	113.4	S79 R83	S79-D81 PolarHBondContact O-N 3.21Å; S79-D81 VanDerWaalsContact O-N 3.14Å; S79-D81 PolarHBondContact OG-OD1 3.17Å; D81-R83 PolarHBondContact O-N 2.93Å; D81-R83 VanDerWaalsContact O-N 3.16Å; D81-R83 PolarHBondContact OD1-N 2.96Å; D81-R83 IonicContact OD2-CZ 2.75Å; D81-R83 IonicContact OD2-NE 3.09Å; D81-R83 PolarHBondContact OD2-NE 2.92Å; D81-R83 IonicContact OD2-NH2 2.77Å; D81-R83 PolarHBondContact OD2-NH2 2.97Å
82	G	91.9	Very high	93.8	Very high	8 Å²	8	66.8 Å²	66.8	8%	0.082	34%	0.336	C	S	.	.	S	Bend	trans	69.4	1	-177.7	0	0	0	0	0	116.1	S79 P93	S79-G82 PolarHBondContact O-N 3.24Å; S79-G82 VanDerWaalsContact OG-C 3.32Å; S79-G82 WeakPolarHBondContact OG-CA 3.39Å; S79-G82 PolarHBondContact OG-N 3.1Å; S79-G82 VanDerWaalsContact OG-N 3.17Å; G82-P93 VanDerWaalsContact O-CD 3.27Å; G82-P93 WeakPolarHBondContact O-CD 3.32Å
83	R	94.2	Very high	93.9	Very high	120 Å²	120	60.7 Å²	60.7	45%	0.453	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-100.7	138.6	-177.8	-64.1	-179.4	-63	-171	-4.5	112.7	S79 D81 G91 L92	S79-R83 PolarHBondContact OG-N 2.84Å; S79-R83 PolarHBondContact OG-O 3.4Å; D81-R83 PolarHBondContact O-N 2.93Å; D81-R83 VanDerWaalsContact O-N 3.16Å; D81-R83 PolarHBondContact OD1-N 2.96Å; D81-R83 IonicContact OD2-CZ 2.75Å; D81-R83 IonicContact OD2-NE 3.09Å; D81-R83 PolarHBondContact OD2-NE 2.92Å; D81-R83 IonicContact OD2-NH2 2.77Å; D81-R83 PolarHBondContact OD2-NH2 2.97Å; R83-G91 CarbonylContact C-O 3.44Å; R83-G91 WeakPolarHBondContact CA-O 3.22Å; R83-L92 HydrophobicContact CG-CD2 3.97Å
84	L	95	Very high	93.8	Very high	17 Å²	17	60.1 Å²	60.1	9%	0.089	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	130	170.7	-179.8	66.5	0	0	0	110	I76 V86 K90 G91 P93 I96 Y97	I76-L84 HydrophobicContact CD1-CD2 4.4Å; L84-V86 HydrophobicContact CD2-CG2 4.1Å; L84-V86 HydrophobicContact CG-CG2 4.12Å; L84-K90 WeakPolarHBondContact O-CA 3.15Å; L84-G91 PolarHBondContact N-O 2.82Å; L84-G91 PolarHBondContact O-N 3.46Å; L84-P93 HydrophobicContact CB-CB 4.07Å; L84-P93 HydrophobicContact CD2-CB 4.35Å; L84-I96 HydrophobicContact CB-CD1 4.29Å; L84-I96 HydrophobicContact CD2-CD1 4.36Å; L84-Y97 HydrophobicContact CD2-CE2 3.88Å; L84-Y97 WeakPolarHBondContact CD2-OH 3.2Å
85	Q	94.7	Very high	93.8	Very high	111 Å²	111	61.1 Å²	61.1	52%	0.519	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	127	170.6	-173.8	171.3	-19.9	0	0	110.5	S87 R89 K90	Q85-S87 PolarHBondContact NE2-O 2.8Å; Q85-S87 VanDerWaalsContact NE2-O 3.13Å; Q85-R89 WeakPolarHBondContact CA-O 3.3Å; Q85-K90 HydrophobicContact CB-CG 4.02Å; Q85-K90 HydrophobicContact CG-CG 3.99Å
86	V	92.6	Very high	93.7	Very high	5 Å²	5	61.5 Å²	61.5	3%	0.03	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	112	171.3	-177.4	0	0	0	0	108.3	W39 K42 A43 L84 Q88 R89	W39-V86 HydrophobicContact CZ2-CB 3.87Å; W39-V86 HydrophobicContact CZ2-CG1 4.27Å; W39-V86 HydrophobicContact CZ2-CG2 4.37Å; W39-V86 PolarHBondContact NE1-O 3.24Å; W39-V86 VanDerWaalsContact NE1-O 3.08Å; K42-V86 HydrophobicContact CB-CG1 4.27Å; A43-V86 HydrophobicContact CB-CG1 3.83Å; A43-V86 HydrophobicContact CB-CG2 4.26Å; L84-V86 HydrophobicContact CD2-CG2 4.1Å; L84-V86 HydrophobicContact CG-CG2 4.12Å; V86-Q88 PolarHBondContact O-N 3.4Å; V86-R89 PolarHBondContact N-O 3.41Å; V86-R89 PolarHBondContact O-N 3.1Å; V86-R89 VanDerWaalsContact O-N 3.09Å
87	S	89.8	Confident	93.7	Very high	61 Å²	61	61.3 Å²	61.3	43%	0.427	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.9	-119.2	-173.2	-160.1	0	0	0	0	110.4	Q85	Q85-S87 PolarHBondContact NE2-O 2.8Å; Q85-S87 VanDerWaalsContact NE2-O 3.13Å
88	Q	88.5	Confident	93.7	Very high	187 Å²	187	57 Å²	57	87%	0.874	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	0	-179	-65	175.5	0.4	0	0	113	V86	V86-Q88 PolarHBondContact O-N 3.4Å
89	R	90.1	Very high	93.7	Very high	82 Å²	82	58.3 Å²	58.3	31%	0.309	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	138.6	-177.4	-55.7	-173.6	-173.2	172.6	-0.6	110.8	E35 E36 W39 Q85 V86	E35-R89 IonicContact OE1-CZ 2.84Å; E35-R89 IonicContact OE1-NH2 3.69Å; E35-R89 PolarHBondContact OE1-NH2 2.94Å; E36-R89 IonicContact OE1-NH1 3.79Å; E36-R89 IonicContact OE2-CZ 3.29Å; E36-R89 IonicContact OE2-NH1 2.95Å; E36-R89 PolarHBondContact OE2-NH1 3.4Å; E36-R89 IonicContact OE2-NH2 2.71Å; W39-R89 HydrophobicContact CZ2-CB 4.31Å; Q85-R89 WeakPolarHBondContact CA-O 3.3Å; V86-R89 PolarHBondContact N-O 3.41Å; V86-R89 PolarHBondContact O-N 3.1Å; V86-R89 VanDerWaalsContact O-N 3.09Å
90	K	91.7	Very high	93.7	Very high	123 Å²	123	56.7 Å²	56.7	54%	0.535	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	135.2	172.2	-70.2	-173.5	175.5	-175	0	109.2	L84 Q85	L84-K90 WeakPolarHBondContact O-CA 3.15Å; Q85-K90 HydrophobicContact CB-CG 4.02Å; Q85-K90 HydrophobicContact CG-CG 3.99Å
91	G	92.9	Very high	93.9	Very high	19 Å²	19	47.8 Å²	47.8	20%	0.196	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	169.9	178.4	0	0	0	0	0	111.8	R83 L84	R83-G91 CarbonylContact C-O 3.44Å; R83-G91 WeakPolarHBondContact CA-O 3.22Å; L84-G91 PolarHBondContact N-O 2.82Å; L84-G91 PolarHBondContact O-N 3.46Å
92	L	95.3	Very high	94.1	Very high	37 Å²	37	47.4 Å²	47.4	19%	0.194	22%	0.224	C	C	.	.			trans	-73.9	132.9	176.6	-66	174.3	0	0	0	109.7	R83 H94 V95 I96 H109 F122	R83-L92 HydrophobicContact CG-CD2 3.97Å; L92-H94 PolarHBondContact O-N 3.09Å; L92-V95 HydrophobicContact CB-CB 4.12Å; L92-V95 HydrophobicContact CB-CG2 3.77Å; L92-V95 HydrophobicContact CD1-CG2 4.31Å; L92-V95 WeakPolarHBondContact O-CB 3.46Å; L92-V95 PolarHBondContact O-N 3.09Å; L92-V95 VanDerWaalsContact O-N 3.17Å; L92-I96 WeakPolarHBondContact O-CG1 3.46Å; L92-I96 PolarHBondContact O-N 3.19Å; L92-H109 HydrophobicContact CD1-CB 3.59Å; L92-F122 HydrophobicContact CD1-CE1 4.44Å; L92-F122 HydrophobicContact CD1-CZ 4.43Å; L92-F122 HydrophobicContact CD2-CE1 4.25Å; L92-F122 HydrophobicContact CD2-CE2 3.83Å; L92-F122 HydrophobicContact CD2-CZ 3.46Å; L92-F122 VanDerWaalsContact CD2-CZ 3.46Å; L92-F122 HydrophobicContact CG-CZ 4.47Å
93	P	96.6	Very high	94.3	Very high	5 Å²	5	48.8 Å²	48.8	3%	0.032	23%	0.227	C	C	.	.	H	α-helix	trans	-62.5	-46.4	-168.9	20.9	-31.4	0	0	0	112.8	I76 G82 L84 V95 I96 Y97 V129 V131	I76-P93 HydrophobicContact CD1-CB 3.72Å; I76-P93 HydrophobicContact CD1-CG 4.44Å; G82-P93 VanDerWaalsContact O-CD 3.27Å; G82-P93 WeakPolarHBondContact O-CD 3.32Å; L84-P93 HydrophobicContact CB-CB 4.07Å; L84-P93 HydrophobicContact CD2-CB 4.35Å; P93-V95 VanDerWaalsContact C-N 3.32Å; P93-V95 PolarHBondContact O-N 3.26Å; P93-I96 PolarHBondContact O-N 2.93Å; P93-Y97 WeakPolarHBondContact O-CD2 3.48Å; P93-Y97 PolarHBondContact O-N 2.73Å; P93-V129 HydrophobicContact CB-CG1 4.39Å; P93-V129 HydrophobicContact CG-CG1 3.71Å; P93-V129 HydrophobicContact CG-CG2 4.16Å; P93-V131 HydrophobicContact CB-CG1 3.84Å
94	H	96.7	Very high	94.1	Very high	6 Å²	6	44.6 Å²	44.6	3%	0.028	22%	0.216	C	C	.	.	H	α-helix	trans	-61.4	-38.9	176.5	63.9	-72.4	0	0	0	112.4	L92 C98 F122 Y136	L92-H94 PolarHBondContact O-N 3.09Å; H94-C98 VanDerWaalsContact O-CB 3.24Å; H94-C98 WeakPolarHBondContact O-CB 3.29Å; H94-C98 PolarHBondContact O-N 3.49Å; H94-C98 PolarHBondContact O-SG 3.34Å; H94-F122 AromaticContact CE1-CD1 3.32Å; H94-F122 WeakPolarHBondContact CE1-CD1 3.32Å; H94-F122 AromaticContact CE1-CD2 3.55Å; H94-F122 AromaticContact CE1-CE1 3.88Å; H94-F122 AromaticContact CE1-CG 3.14Å; H94-F122 WeakPolarHBondContact CE1-CG 3.4Å; H94-F122 WeakPolarHBondContact ND1-CB 3.41Å; H94-F122 AromaticContact ND1-CD1 3.99Å; H94-F122 AromaticContact ND1-CD2 3.41Å; H94-F122 WeakPolarHBondContact ND1-CD2 3.31Å; H94-F122 AromaticContact ND1-CG 3.31Å; H94-F122 VanDerWaalsContact ND1-CG 3.31Å; H94-F122 WeakPolarHBondContact ND1-CG 3.16Å; H94-F122 AromaticContact NE2-CD1 3.99Å; H94-F122 AromaticContact NE2-CG 3.98Å; H94-Y136 HydrophobicContact CB-CD2 4.25Å; H94-Y136 HydrophobicContact CB-CE1 3.96Å; H94-Y136 HydrophobicContact CB-CE2 3.6Å; H94-Y136 VanDerWaalsContact CB-CZ 3.42Å; H94-Y136 WeakPolarHBondContact CB-OH 3.39Å; H94-Y136 AromaticContact CD2-CE1 3.84Å
95	V	96.6	Very high	93.8	Very high	21 Å²	21	47 Å²	47	13%	0.127	23%	0.229	C	C	.	.	H	α-helix	trans	-63.7	-47.3	176	179.6	0	0	0	0	111.3	L92 P93 Y97 C98 K99 L106 H109 L112	L92-V95 HydrophobicContact CB-CB 4.12Å; L92-V95 HydrophobicContact CB-CG2 3.77Å; L92-V95 HydrophobicContact CD1-CG2 4.31Å; L92-V95 WeakPolarHBondContact O-CB 3.46Å; L92-V95 PolarHBondContact O-N 3.09Å; L92-V95 VanDerWaalsContact O-N 3.17Å; P93-V95 VanDerWaalsContact C-N 3.32Å; P93-V95 PolarHBondContact O-N 3.26Å; V95-Y97 VanDerWaalsContact C-N 3.3Å; V95-Y97 PolarHBondContact O-N 3.33Å; V95-C98 PolarHBondContact O-N 3.23Å; V95-K99 WeakPolarHBondContact O-CB 3.27Å; V95-K99 PolarHBondContact O-N 3.06Å; V95-L106 HydrophobicContact CB-CD2 4.47Å; V95-L106 HydrophobicContact CG1-CD2 3.81Å; V95-L106 HydrophobicContact CG1-CG 4.41Å; V95-H109 HydrophobicContact CG2-CB 3.44Å; V95-H109 VanDerWaalsContact CG2-CB 3.44Å; V95-L112 HydrophobicContact CG2-CD1 4.41Å
96	I	95.9	Very high	93.6	Very high	18 Å²	18	41.8 Å²	41.8	9%	0.092	21%	0.205	C	C	.	.	H	α-helix	trans	-54.3	-49.7	-180	-71.7	166.3	0	0	0	110.4	W39 L84 L92 P93 M100	W39-I96 HydrophobicContact CH2-CG1 4.22Å; W39-I96 HydrophobicContact CH2-CG2 3.68Å; W39-I96 HydrophobicContact CZ3-CG2 4.28Å; L84-I96 HydrophobicContact CB-CD1 4.29Å; L84-I96 HydrophobicContact CD2-CD1 4.36Å; L92-I96 WeakPolarHBondContact O-CG1 3.46Å; L92-I96 PolarHBondContact O-N 3.19Å; P93-I96 PolarHBondContact O-N 2.93Å; I96-M100 WeakPolarHBondContact O-CB 3.43Å; I96-M100 PolarHBondContact O-N 2.71Å; I96-M100 VanDerWaalsContact O-N 3.08Å
97	Y	97.1	Very high	93.3	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-80.5	-32	-173.8	-64.2	-55.2	0	0	0	113.1	L47 L84 P93 V95 M100 W101 V131	L47-Y97 HydrophobicContact CB-CE1 4.09Å; L47-Y97 WeakPolarHBondContact CB-OH 3.31Å; L47-Y97 HydrophobicContact CD1-CE2 4.04Å; L47-Y97 HydrophobicContact CD2-CD1 4.01Å; L47-Y97 HydrophobicContact CD2-CE1 3.66Å; L47-Y97 HydrophobicContact CD2-CE2 4.25Å; L47-Y97 HydrophobicContact CD2-CG 4.44Å; L47-Y97 HydrophobicContact CG-CE1 4.32Å; L84-Y97 HydrophobicContact CD2-CE2 3.88Å; L84-Y97 WeakPolarHBondContact CD2-OH 3.2Å; P93-Y97 WeakPolarHBondContact O-CD2 3.48Å; P93-Y97 PolarHBondContact O-N 2.73Å; V95-Y97 VanDerWaalsContact C-N 3.3Å; V95-Y97 PolarHBondContact O-N 3.33Å; Y97-M100 PolarHBondContact O-N 3.34Å; Y97-W101 HydrophobicContact CD1-CE3 4.13Å; Y97-W101 AromaticContact CD1-CH2 3.67Å; Y97-W101 HydrophobicContact CD1-CH2 3.67Å; Y97-W101 AromaticContact CD1-CZ3 3.22Å; Y97-W101 HydrophobicContact CD1-CZ3 3.22Å; Y97-W101 HydrophobicContact CE1-CH2 4.18Å; Y97-W101 HydrophobicContact CE1-CZ3 4.14Å; Y97-W101 HydrophobicContact CG-CE3 4.4Å; Y97-W101 AromaticContact CG-CZ3 3.69Å; Y97-W101 HydrophobicContact CG-CZ3 3.69Å; Y97-W101 PolarHBondContact O-N 3.43Å; Y97-W101 VanDerWaalsContact O-N 3.12Å; Y97-V131 HydrophobicContact CD2-CB 3.59Å; Y97-V131 HydrophobicContact CD2-CG1 3.7Å; Y97-V131 HydrophobicContact CD2-CG2 4.34Å; Y97-V131 HydrophobicContact CE2-CB 4.17Å; Y97-V131 HydrophobicContact CE2-CG1 4Å; Y97-V131 HydrophobicContact CG-CB 4.41Å
98	C	97.2	Very high	93.1	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63.7	-43.5	168.8	-69.2	0	0	0	0	111.6	H94 V95 M100 R102 Y103 L106 L112	H94-C98 VanDerWaalsContact O-CB 3.24Å; H94-C98 WeakPolarHBondContact O-CB 3.29Å; H94-C98 PolarHBondContact O-N 3.49Å; H94-C98 PolarHBondContact O-SG 3.34Å; V95-C98 PolarHBondContact O-N 3.23Å; C98-M100 VanDerWaalsContact C-N 3.3Å; C98-M100 PolarHBondContact O-N 3.32Å; C98-R102 WeakPolarHBondContact O-CA 3.43Å; C98-R102 PolarHBondContact O-N 3.45Å; C98-Y103 HydrophobicContact CB-CD2 4.37Å; C98-Y103 PolarHBondContact O-N 3.16Å; C98-L106 HydrophobicContact CB-CD2 4.05Å; C98-L112 HydrophobicContact CB-CD1 3.79Å; C98-L112 HydrophobicContact CB-CD2 4.33Å
99	K	94.9	Very high	93.2	Very high	86 Å²	86	37.4 Å²	37.4	37%	0.374	18%	0.179	S	C	.	.	H	α-helix	trans	-60.6	-42.4	177.4	-173.4	170.5	-173.4	152	0	111.6	V95 Y103 P104 L106	V95-K99 WeakPolarHBondContact O-CB 3.27Å; V95-K99 PolarHBondContact O-N 3.06Å; K99-Y103 VanDerWaalsContact CA-O 3.3Å; K99-Y103 WeakPolarHBondContact CA-O 3.28Å; K99-Y103 CarbonylContact O-C 3.6Å; K99-P104 WeakPolarHBondContact CE-O 3.44Å; K99-P104 WeakPolarHBondContact O-CA 3.35Å; K99-L106 HydrophobicContact CB-CB 4.26Å; K99-L106 HydrophobicContact CB-CD2 4.38Å; K99-L106 WeakPolarHBondContact CD-O 3.25Å; K99-L106 WeakPolarHBondContact CE-O 3.38Å; K99-L106 HydrophobicContact CG-CB 4.35Å; K99-L106 PolarHBondContact NZ-O 3.44Å
100	M	94.7	Very high	93.2	Very high	14 Å²	14	35.3 Å²	35.3	7%	0.069	17%	0.172	C	C	.	.	H	α-helix	trans	-67.5	-44.5	-178.5	-173.5	170.6	-60.6	0	0	113.8	R24 A25 W39 C40 A43 V44 I96 Y97 C98	R24-M100 CarbonylContact C-O 3.55Å; R24-M100 VanDerWaalsContact CA-O 3.29Å; R24-M100 WeakPolarHBondContact CA-O 3.49Å; R24-M100 HydrophobicContact CB-CG 4.37Å; R24-M100 WeakPolarHBondContact CB-O 3.48Å; A25-M100 PolarHBondContact N-O 3.47Å; W39-M100 HydrophobicContact CZ3-CE 4.11Å; C40-M100 HydrophobicContact CB-CE 3.9Å; C40-M100 HydrophobicContact CB-SD 4.48Å; A43-M100 HydrophobicContact CB-CE 3.89Å; V44-M100 HydrophobicContact CG2-SD 3.54Å; V44-M100 VanDerWaalsContact CG2-SD 3.54Å; I96-M100 WeakPolarHBondContact O-CB 3.43Å; I96-M100 PolarHBondContact O-N 2.71Å; I96-M100 VanDerWaalsContact O-N 3.08Å; Y97-M100 PolarHBondContact O-N 3.34Å; C98-M100 VanDerWaalsContact C-N 3.3Å; C98-M100 PolarHBondContact O-N 3.32Å
101	W	96	Very high	93.2	Very high	8 Å²	8	30.8 Å²	30.8	3%	0.03	15%	0.153	C	C	.	.	H	α-helix	trans	-106.5	-10.8	-170	-73.2	-62.2	0	0	0	115.3	L20 V44 L47 I64 Y97 P133	L20-W101 HydrophobicContact CB-CZ2 4.31Å; L20-W101 PolarHBondContact O-NE1 3.23Å; V44-W101 HydrophobicContact CG2-CH2 4.21Å; V44-W101 HydrophobicContact CG2-CZ2 3.78Å; L47-W101 HydrophobicContact CD2-CH2 3.75Å; L47-W101 HydrophobicContact CD2-CZ3 4.04Å; I64-W101 HydrophobicContact CD1-CB 4.02Å; I64-W101 HydrophobicContact CD1-CD2 3.72Å; I64-W101 HydrophobicContact CD1-CE3 3.91Å; I64-W101 HydrophobicContact CD1-CG 3.74Å; I64-W101 HydrophobicContact CG1-CD2 4.3Å; I64-W101 HydrophobicContact CG1-CG 4.46Å; I64-W101 HydrophobicContact CG2-CG 4.3Å; Y97-W101 HydrophobicContact CD1-CE3 4.13Å; Y97-W101 AromaticContact CD1-CH2 3.67Å; Y97-W101 HydrophobicContact CD1-CH2 3.67Å; Y97-W101 AromaticContact CD1-CZ3 3.22Å; Y97-W101 HydrophobicContact CD1-CZ3 3.22Å; Y97-W101 HydrophobicContact CE1-CH2 4.18Å; Y97-W101 HydrophobicContact CE1-CZ3 4.14Å; Y97-W101 HydrophobicContact CG-CE3 4.4Å; Y97-W101 AromaticContact CG-CZ3 3.69Å; Y97-W101 HydrophobicContact CG-CZ3 3.69Å; Y97-W101 PolarHBondContact O-N 3.43Å; Y97-W101 VanDerWaalsContact O-N 3.12Å; W101-P133 HydrophobicContact CB-CB 4.39Å; W101-P133 HydrophobicContact CB-CG 3.99Å; W101-P133 HydrophobicContact CE3-CG 4.15Å
102	R	94.8	Very high	93.3	Very high	67 Å²	67	30.6 Å²	30.6	25%	0.253	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-135.6	-49.5	-176.1	-64.7	-173.8	72.8	-170.6	5.5	114.2	C98 P104 P133 Y134 Y136	C98-R102 WeakPolarHBondContact O-CA 3.43Å; C98-R102 PolarHBondContact O-N 3.45Å; R102-P104 WeakPolarHBondContact O-CD 3.32Å; R102-P133 VanDerWaalsContact CD-C 3.46Å; R102-P133 WeakPolarHBondContact CD-O 3.38Å; R102-P133 HydrophobicContact CG-CB 4Å; R102-P133 PolarHBondContact NH1-O 2.84Å; R102-Y134 HydrophobicContact CG-CE1 4.12Å; R102-Y134 HydrophobicContact CG-CE2 4.48Å; R102-Y136 PolarHBondContact NH1-O 3.03Å
103	Y	94.2	Very high	93.2	Very high	37 Å²	37	35 Å²	35	15%	0.145	17%	0.165	C	C	.	.			trans	-127.6	76	-166.2	-51.1	-56.5	0	0	0	111.1	C98 K99 D105 L106 L112 K138	C98-Y103 HydrophobicContact CB-CD2 4.37Å; C98-Y103 PolarHBondContact O-N 3.16Å; K99-Y103 VanDerWaalsContact CA-O 3.3Å; K99-Y103 WeakPolarHBondContact CA-O 3.28Å; K99-Y103 CarbonylContact O-C 3.6Å; Y103-D105 PolarHBondContact O-N 2.84Å; Y103-D105 VanDerWaalsContact O-N 3.11Å; Y103-L106 WeakPolarHBondContact O-CB 3.14Å; Y103-L106 PolarHBondContact O-N 3.44Å; Y103-L112 HydrophobicContact CD2-CD2 3.91Å; Y103-L112 HydrophobicContact CE2-CD2 4Å; Y103-K138 HydrophobicContact CD1-CB 3.98Å; Y103-K138 HydrophobicContact CD1-CD 3.79Å; Y103-K138 HydrophobicContact CD2-CB 4.04Å; Y103-K138 HydrophobicContact CE1-CB 3.68Å; Y103-K138 HydrophobicContact CE1-CD 4.23Å; Y103-K138 HydrophobicContact CE2-CB 3.76Å; Y103-K138 HydrophobicContact CG-CB 4.14Å; Y103-K138 HydrophobicContact CG-CD 4Å; Y103-K138 PolarHBondContact OH-N 3.04Å
104	P	91.8	Very high	93.2	Very high	33 Å²	33	36.5 Å²	36.5	21%	0.214	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-22.1	-174.7	24.4	-33.1	0	0	0	113.4	A25 L27 K99 R102	A25-P104 HydrophobicContact CB-CG 4.13Å; L27-P104 HydrophobicContact CD2-CB 4.44Å; L27-P104 HydrophobicContact CD2-CG 3.72Å; L27-P104 HydrophobicContact CG-CB 3.99Å; L27-P104 HydrophobicContact CG-CG 3.71Å; K99-P104 WeakPolarHBondContact CE-O 3.44Å; K99-P104 WeakPolarHBondContact O-CA 3.35Å; R102-P104 WeakPolarHBondContact O-CD 3.32Å
105	D	88.2	Confident	93.2	Very high	68 Å²	68	36.8 Å²	36.8	36%	0.364	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87	2.5	174.3	71.1	-36.6	0	0	0	114.2	L27 Y103 Q107 K138	L27-D105 HydrophobicContact CD1-CB 4.48Å; L27-D105 HydrophobicContact CD2-CB 4.23Å; Y103-D105 PolarHBondContact O-N 2.84Å; Y103-D105 VanDerWaalsContact O-N 3.11Å; D105-Q107 VanDerWaalsContact O-CG 3.24Å; D105-Q107 WeakPolarHBondContact O-CG 3.41Å; D105-Q107 PolarHBondContact O-N 3.39Å; D105-K138 IonicContact OD1-NZ 3.56Å; D105-K138 PolarHBondContact OD1-NZ 3.21Å; D105-K138 IonicContact OD2-NZ 3.08Å; D105-K138 PolarHBondContact OD2-NZ 3.32Å
106	L	91	Very high	93.2	Very high	1 Å²	1	42 Å²	42	1%	0.005	22%	0.215	C	C	.	.			trans	-61.2	128.7	177.9	-173.5	71.2	0	0	0	111	V95 C98 K99 Y103 Q111 L112	V95-L106 HydrophobicContact CB-CD2 4.47Å; V95-L106 HydrophobicContact CG1-CD2 3.81Å; V95-L106 HydrophobicContact CG1-CG 4.41Å; C98-L106 HydrophobicContact CB-CD2 4.05Å; K99-L106 HydrophobicContact CB-CB 4.26Å; K99-L106 HydrophobicContact CB-CD2 4.38Å; K99-L106 WeakPolarHBondContact CD-O 3.25Å; K99-L106 WeakPolarHBondContact CE-O 3.38Å; K99-L106 HydrophobicContact CG-CB 4.35Å; K99-L106 PolarHBondContact NZ-O 3.44Å; Y103-L106 WeakPolarHBondContact O-CB 3.14Å; Y103-L106 PolarHBondContact O-N 3.44Å; L106-Q111 HydrophobicContact CD1-CB 3.57Å; L106-Q111 HydrophobicContact CD1-CG 4.5Å; L106-L112 HydrophobicContact CD1-CD2 3.96Å; L106-L112 HydrophobicContact CD1-CG 3.99Å; L106-L112 HydrophobicContact CD2-CD1 3.67Å; L106-L112 HydrophobicContact CD2-CD2 4.07Å; L106-L112 HydrophobicContact CD2-CG 3.93Å
107	Q	85.2	Confident	93.2	Very high	97 Å²	97	44.5 Å²	44.5	45%	0.453	23%	0.226	S	C	.	.			trans	-114.3	-36.2	-176	-53.5	-163.3	0.1	0	0	112.8	D105 Q298	D105-Q107 VanDerWaalsContact O-CG 3.24Å; D105-Q107 WeakPolarHBondContact O-CG 3.41Å; D105-Q107 PolarHBondContact O-N 3.39Å; Q107-Q298 VanDerWaalsContact OE1-OE1 3.05Å
108	S	86.6	Confident	93.2	Very high	17 Å²	17	44.9 Å²	44.9	12%	0.119	23%	0.228	C	C	.	.			trans	-131.9	148.8	-178.6	-177.9	0	0	0	0	112.3	H110 Q111	S108-H110 PolarHBondContact O-N 3.44Å; S108-H110 PolarHBondContact OG-N 3.43Å; S108-Q111 WeakPolarHBondContact O-CB 3.34Å; S108-Q111 PolarHBondContact O-N 2.63Å; S108-Q111 VanDerWaalsContact O-N 3.13Å
109	H	90.1	Very high	93.2	Very high	47 Å²	47	51 Å²	51	22%	0.218	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-59.4	-26.8	169.2	71.8	-56.8	0	0	0	113.7	L92 V95 Q111 L112	L92-H109 HydrophobicContact CD1-CB 3.59Å; V95-H109 HydrophobicContact CG2-CB 3.44Å; V95-H109 VanDerWaalsContact CG2-CB 3.44Å; H109-Q111 PolarHBondContact O-N 3.16Å; H109-L112 PolarHBondContact O-N 2.96Å
110	H	88.9	Confident	93.3	Very high	37 Å²	37	49.5 Å²	49.5	17%	0.171	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-58.7	-33.5	176.9	-68	-47	0	0	0	110.5	S108 L112 I139 Y343 I345 E352	S108-H110 PolarHBondContact O-N 3.44Å; S108-H110 PolarHBondContact OG-N 3.43Å; H110-L112 PolarHBondContact O-N 2.92Å; H110-I139 WeakPolarHBondContact O-CD1 3.28Å; H110-Y343 HydrophobicContact CB-CD2 3.92Å; H110-Y343 HydrophobicContact CB-CE2 3.88Å; H110-Y343 AromaticContact CD2-CD1 3.62Å; H110-Y343 AromaticContact CD2-CD2 3.48Å; H110-Y343 VanDerWaalsContact CD2-CD2 3.48Å; H110-Y343 WeakPolarHBondContact CD2-CD2 3.17Å; H110-Y343 AromaticContact CD2-CE1 3.6Å; H110-Y343 AromaticContact CD2-CE2 3.46Å; H110-Y343 VanDerWaalsContact CD2-CE2 3.46Å; H110-Y343 WeakPolarHBondContact CD2-CE2 3.11Å; H110-Y343 AromaticContact CD2-CG 3.55Å; H110-Y343 AromaticContact CD2-CZ 3.52Å; H110-Y343 AromaticContact CE1-CE1 3.97Å; H110-Y343 AromaticContact CE1-CZ 3.63Å; H110-Y343 AromaticContact CG-CD2 3.8Å; H110-Y343 AromaticContact CG-CE2 3.54Å; H110-Y343 AromaticContact CG-CZ 3.86Å; H110-Y343 AromaticContact ND1-CE2 3.97Å; H110-Y343 AromaticContact ND1-CZ 3.95Å; H110-Y343 AromaticContact NE2-CD1 3.71Å; H110-Y343 AromaticContact NE2-CE1 3.3Å; H110-Y343 VanDerWaalsContact NE2-CE1 3.3Å; H110-Y343 WeakPolarHBondContact NE2-CE1 3.39Å; H110-Y343 AromaticContact NE2-CE2 3.84Å; H110-Y343 AromaticContact NE2-CZ 3.37Å; H110-I345 HydrophobicContact CB-CD1 4.03Å; H110-I345 WeakPolarHBondContact O-CD1 3.35Å; H110-E352 IonicContact NE2-OE2 3.56Å
111	Q	92	Very high	93.5	Very high	29 Å²	29	48.9 Å²	48.9	14%	0.136	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-68	-0.9	178.9	-62.7	177.2	-74.3	0	0	114.1	L106 S108 H109 K138 I139 I345	L106-Q111 HydrophobicContact CD1-CB 3.57Å; L106-Q111 HydrophobicContact CD1-CG 4.5Å; S108-Q111 WeakPolarHBondContact O-CB 3.34Å; S108-Q111 PolarHBondContact O-N 2.63Å; S108-Q111 VanDerWaalsContact O-N 3.13Å; H109-Q111 PolarHBondContact O-N 3.16Å; Q111-K138 CarbonylContact O-C 3.46Å; Q111-K138 VanDerWaalsContact O-CA 3.29Å; Q111-K138 WeakPolarHBondContact O-CA 3.29Å; Q111-I139 PolarHBondContact O-N 2.87Å; Q111-I345 HydrophobicContact CB-CD1 4.34Å; Q111-I345 HydrophobicContact CG-CD1 4.22Å; Q111-I345 HydrophobicContact CG-CG1 4.48Å
112	L	95.1	Very high	93.5	Very high	15 Å²	15	50.4 Å²	50.4	8%	0.079	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	131.9	179.2	-64.7	179.2	0	0	0	111.1	V95 C98 Y103 L106 H109 H110 Y136 M137	V95-L112 HydrophobicContact CG2-CD1 4.41Å; C98-L112 HydrophobicContact CB-CD1 3.79Å; C98-L112 HydrophobicContact CB-CD2 4.33Å; Y103-L112 HydrophobicContact CD2-CD2 3.91Å; Y103-L112 HydrophobicContact CE2-CD2 4Å; L106-L112 HydrophobicContact CD1-CD2 3.96Å; L106-L112 HydrophobicContact CD1-CG 3.99Å; L106-L112 HydrophobicContact CD2-CD1 3.67Å; L106-L112 HydrophobicContact CD2-CD2 4.07Å; L106-L112 HydrophobicContact CD2-CG 3.93Å; H109-L112 PolarHBondContact O-N 2.96Å; H110-L112 PolarHBondContact O-N 2.92Å; L112-Y136 HydrophobicContact CB-CD1 4.31Å; L112-Y136 HydrophobicContact CD1-CG 4.5Å; L112-M137 WeakPolarHBondContact CA-O 3.44Å
113	K	94.5	Very high	93.4	Very high	129 Å²	129	50.9 Å²	50.9	56%	0.561	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.7	130.8	167.9	-172.2	178.6	179.2	177.8	0	109.7	Y136 M137 I139	K113-Y136 CarbonylContact O-C 3.54Å; K113-Y136 WeakPolarHBondContact O-CA 3.24Å; K113-M137 PolarHBondContact N-O 3.2Å; K113-M137 PolarHBondContact O-N 2.86Å; K113-I139 HydrophobicContact CB-CD1 4.22Å; K113-I139 HydrophobicContact CB-CG1 4.14Å
114	P	96.7	Very high	93.4	Very high	37 Å²	37	53.4 Å²	53.4	24%	0.24	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	147.8	174	29.2	-34.3	0	0	0	111.2	A121 H135 Y136	P114-A121 HydrophobicContact CB-CB 3.44Å; P114-A121 VanDerWaalsContact CB-CB 3.44Å; P114-A121 HydrophobicContact CG-CB 3.85Å; P114-H135 CarbonylContact C-O 3.51Å; P114-H135 VanDerWaalsContact CA-O 3.29Å; P114-H135 WeakPolarHBondContact CA-O 3.08Å; P114-Y136 HydrophobicContact CB-CD1 4.38Å; P114-Y136 HydrophobicContact CB-CE1 4.33Å
115	V	96.4	Very high	93.4	Very high	12 Å²	12	59 Å²	59	7%	0.073	31%	0.305	C	S	.	.			trans	-65.7	148.1	167.2	-61.4	0	0	0	0	110	H117 C118 H135 M137	V115-H117 WeakPolarHBondContact CG2-CE1 3.47Å; V115-H117 PolarHBondContact O-N 2.88Å; V115-C118 HydrophobicContact CG2-CB 3.85Å; V115-C118 WeakPolarHBondContact O-CB 3.34Å; V115-C118 PolarHBondContact O-N 2.86Å; V115-H135 HydrophobicContact CG2-CB 4Å; V115-H135 PolarHBondContact N-O 3.47Å; V115-M137 HydrophobicContact CG1-CE 4.29Å; V115-M137 HydrophobicContact CG1-CG 4.08Å; V115-M137 HydrophobicContact CG1-SD 4.29Å
116	S	95.5	Very high	93.8	Very high	130 Å²	130	60.2 Å²	60.2	91%	0.909	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-30.4	-172.1	50	0	0	0	0	113.8
117	H	96	Very high	94	Very high	70 Å²	70	68.6 Å²	68.6	32%	0.324	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	0.9	179.3	59.4	-75.6	0	0	0	114.3	S69 V115 Q119	S69-H117 PolarHBondContact O-NE2 2.98Å; V115-H117 WeakPolarHBondContact CG2-CE1 3.47Å; V115-H117 PolarHBondContact O-N 2.88Å; H117-Q119 PolarHBondContact O-N 3.41Å
118	C	97.3	Very high	94.6	Very high	8 Å²	8	67.2 Å²	67.2	5%	0.054	34%	0.339	C	S	.	.			trans	-74.5	107.4	178.4	-170.4	0	0	0	0	111.3	V115 F120 A121 H135	V115-C118 HydrophobicContact CG2-CB 3.85Å; V115-C118 WeakPolarHBondContact O-CB 3.34Å; V115-C118 PolarHBondContact O-N 2.86Å; C118-F120 VanDerWaalsContact C-N 3.29Å; C118-F120 PolarHBondContact O-N 3.44Å; C118-A121 HydrophobicContact CB-CB 4.28Å; C118-A121 PolarHBondContact SG-N 2.93Å; C118-H135 HydrophobicContact CB-CB 4.25Å; C118-H135 PolarHBondContact SG-ND1 3.41Å
119	Q	97.4	Very high	95.1	Very high	130 Å²	130	66.5 Å²	66.5	61%	0.607	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-13.9	-177.2	-62.1	-177.3	4.4	0	0	114.2	H117 L124 K126	H117-Q119 PolarHBondContact O-N 3.41Å; Q119-L124 WeakPolarHBondContact O-CD1 3.4Å; Q119-K126 WeakPolarHBondContact O-CD 3.27Å; Q119-K126 WeakPolarHBondContact O-CE 3.25Å; Q119-K126 PolarHBondContact O-NZ 3.33Å
120	F	97.9	Very high	95.5	Very high	53 Å²	53	64.2 Å²	64.2	23%	0.232	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.3	27	-175.2	-61.5	-90.5	0	0	0	112.2	C73 T75 C118 K126 E128 C130	C73-F120 HydrophobicContact CB-CD2 3.87Å; T75-F120 HydrophobicContact CG2-CB 3.74Å; T75-F120 HydrophobicContact CG2-CD1 3.99Å; T75-F120 HydrophobicContact CG2-CD2 3.74Å; T75-F120 HydrophobicContact CG2-CE2 4.31Å; T75-F120 HydrophobicContact CG2-CG 3.56Å; C118-F120 VanDerWaalsContact C-N 3.29Å; C118-F120 PolarHBondContact O-N 3.44Å; F120-K126 HydrophobicContact CD1-CD 4.13Å; F120-K126 HydrophobicContact CE1-CD 4.47Å; F120-E128 HydrophobicContact CD1-CB 3.98Å; F120-E128 HydrophobicContact CE1-CB 4.35Å; F120-C130 HydrophobicContact CB-CB 3.99Å; F120-C130 WeakPolarHBondContact O-CB 3.42Å; F120-C130 PolarHBondContact O-N 3.48Å
121	A	97.3	Very high	95.9	Very high	2 Å²	2	62.5 Å²	62.5	2%	0.017	32%	0.316	C	S	.	.			trans	-53.3	145.3	177.5	0	0	0	0	0	111.7	P114 C118 S123 L124	P114-A121 HydrophobicContact CB-CB 3.44Å; P114-A121 VanDerWaalsContact CB-CB 3.44Å; P114-A121 HydrophobicContact CG-CB 3.85Å; C118-A121 HydrophobicContact CB-CB 4.28Å; C118-A121 PolarHBondContact SG-N 2.93Å; A121-S123 PolarHBondContact O-N 3.17Å; A121-S123 VanDerWaalsContact O-N 3.13Å; A121-L124 HydrophobicContact CB-CD1 4.12Å; A121-L124 HydrophobicContact CB-CG 4.14Å; A121-L124 WeakPolarHBondContact O-CB 3.39Å; A121-L124 PolarHBondContact O-N 3.08Å
122	F	96	Very high	96.2	Very high	39 Å²	39	61.1 Å²	61.1	17%	0.171	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-55.4	-35.5	-176.7	-179.9	-96.2	0	0	0	113.6	R78 L92 H94 L124 K125 V129 Y136	R78-F122 PolarHBondContact NH2-O 3.21Å; L92-F122 HydrophobicContact CD1-CE1 4.44Å; L92-F122 HydrophobicContact CD1-CZ 4.43Å; L92-F122 HydrophobicContact CD2-CE1 4.25Å; L92-F122 HydrophobicContact CD2-CE2 3.83Å; L92-F122 HydrophobicContact CD2-CZ 3.46Å; L92-F122 VanDerWaalsContact CD2-CZ 3.46Å; L92-F122 HydrophobicContact CG-CZ 4.47Å; H94-F122 AromaticContact CE1-CD1 3.32Å; H94-F122 WeakPolarHBondContact CE1-CD1 3.32Å; H94-F122 AromaticContact CE1-CD2 3.55Å; H94-F122 AromaticContact CE1-CE1 3.88Å; H94-F122 AromaticContact CE1-CG 3.14Å; H94-F122 WeakPolarHBondContact CE1-CG 3.4Å; H94-F122 WeakPolarHBondContact ND1-CB 3.41Å; H94-F122 AromaticContact ND1-CD1 3.99Å; H94-F122 AromaticContact ND1-CD2 3.41Å; H94-F122 WeakPolarHBondContact ND1-CD2 3.31Å; H94-F122 AromaticContact ND1-CG 3.31Å; H94-F122 VanDerWaalsContact ND1-CG 3.31Å; H94-F122 WeakPolarHBondContact ND1-CG 3.16Å; H94-F122 AromaticContact NE2-CD1 3.99Å; H94-F122 AromaticContact NE2-CG 3.98Å; F122-L124 VanDerWaalsContact C-N 3.27Å; F122-L124 PolarHBondContact O-N 3.04Å; F122-K125 PolarHBondContact O-N 3.32Å; F122-V129 HydrophobicContact CB-CG2 4.03Å; F122-V129 HydrophobicContact CD2-CG2 3.84Å; F122-V129 HydrophobicContact CG-CG2 4.45Å; F122-Y136 PolarHBondContact N-OH 2.86Å; F122-Y136 VanDerWaalsContact N-OH 3.15Å
123	S	92.5	Very high	96.3	Very high	78 Å²	78	60.4 Å²	60.4	55%	0.545	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-66.6	-22.2	178.8	51	0	0	0	0	114.2	A121 K125	A121-S123 PolarHBondContact O-N 3.17Å; A121-S123 VanDerWaalsContact O-N 3.13Å; S123-K125 PolarHBondContact O-N 3.41Å
124	L	94.8	Very high	96.4	Very high	89 Å²	89	55.1 Å²	55.1	47%	0.466	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-74.5	-5.5	-179.4	-61.9	175.8	0	0	0	113.7	Q119 A121 F122 K126	Q119-L124 WeakPolarHBondContact O-CD1 3.4Å; A121-L124 HydrophobicContact CB-CD1 4.12Å; A121-L124 HydrophobicContact CB-CG 4.14Å; A121-L124 WeakPolarHBondContact O-CB 3.39Å; A121-L124 PolarHBondContact O-N 3.08Å; F122-L124 VanDerWaalsContact C-N 3.27Å; F122-L124 PolarHBondContact O-N 3.04Å; L124-K126 HydrophobicContact CB-CG 4.18Å; L124-K126 PolarHBondContact O-N 3.12Å
125	K	92.8	Very high	96.5	Very high	152 Å²	152	53.4 Å²	53.4	66%	0.661	27%	0.271	S	S	*	.			trans	51.4	26	176.6	-61.6	178.6	-177.8	175.5	0	115.3	F122 S123	F122-K125 PolarHBondContact O-N 3.32Å; S123-K125 PolarHBondContact O-N 3.41Å
126	K	95.9	Very high	96.6	Very high	93 Å²	93	53 Å²	53	40%	0.404	27%	0.269	S	S	.	.			trans	-68.8	164.3	174.3	-64.8	-172.9	176.3	-178.5	0	112.3	R78 Q119 F120 L124 E128	R78-K126 VanDerWaalsContact CD-O 3.28Å; R78-K126 WeakPolarHBondContact CD-O 3.4Å; R78-K126 PolarHBondContact NE-O 2.99Å; Q119-K126 WeakPolarHBondContact O-CD 3.27Å; Q119-K126 WeakPolarHBondContact O-CE 3.25Å; Q119-K126 PolarHBondContact O-NZ 3.33Å; F120-K126 HydrophobicContact CD1-CD 4.13Å; F120-K126 HydrophobicContact CE1-CD 4.47Å; L124-K126 HydrophobicContact CB-CG 4.18Å; L124-K126 PolarHBondContact O-N 3.12Å; K126-E128 PolarHBondContact O-N 2.81Å
127	E	96.2	Very high	96.6	Very high	176 Å²	176	51.2 Å²	51.2	82%	0.822	25%	0.247	S	C	*	.	S	Bend	trans	-59.1	-25.5	176.1	-62.8	-172	166.7	0	0	113.4	R78	R78-E127 WeakPolarHBondContact CB-O 3.24Å; R78-E127 PolarHBondContact N-O 3.41Å
128	E	96.8	Very high	96.5	Very high	68 Å²	68	50.5 Å²	50.5	32%	0.318	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	156.3	172.9	-66	-168.8	100.8	0	0	111.5	T75 I76 F120 K126	T75-E128 HydrophobicContact CG2-CB 4.36Å; T75-E128 PolarHBondContact OG1-OE1 3.19Å; I76-E128 WeakPolarHBondContact O-CA 3.37Å; F120-E128 HydrophobicContact CD1-CB 3.98Å; F120-E128 HydrophobicContact CE1-CB 4.35Å; K126-E128 PolarHBondContact O-N 2.81Å
129	V	97.4	Very high	96.2	Very high	2 Å²	2	53 Å²	53	1%	0.012	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	132	177.4	56.8	0	0	0	0	110.9	T75 I76 P93 F122	T75-V129 WeakPolarHBondContact CA-O 3.37Å; I76-V129 HydrophobicContact CD1-CG1 4.25Å; I76-V129 HydrophobicContact CG1-CG1 3.56Å; I76-V129 PolarHBondContact N-O 3.37Å; I76-V129 WeakPolarHBondContact O-CG1 3.48Å; I76-V129 PolarHBondContact O-N 3.01Å; P93-V129 HydrophobicContact CB-CG1 4.39Å; P93-V129 HydrophobicContact CG-CG1 3.71Å; P93-V129 HydrophobicContact CG-CG2 4.16Å; F122-V129 HydrophobicContact CB-CG2 4.03Å; F122-V129 HydrophobicContact CD2-CG2 3.84Å; F122-V129 HydrophobicContact CG-CG2 4.45Å
130	C	98.2	Very high	95.5	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	128.7	171.6	-170.1	0	0	0	0	110.6	I74 F120 N132 H135 Y136	I74-C130 CarbonylContact O-C 3.59Å; I74-C130 VanDerWaalsContact O-CA 3.25Å; I74-C130 WeakPolarHBondContact O-CA 3.27Å; F120-C130 HydrophobicContact CB-CB 3.99Å; F120-C130 WeakPolarHBondContact O-CB 3.42Å; F120-C130 PolarHBondContact O-N 3.48Å; C130-N132 PolarHBondContact SG-N 2.86Å; C130-H135 PolarHBondContact SG-ND1 2.79Å; C130-H135 VanDerWaalsContact SG-ND1 3.39Å; C130-Y136 VanDerWaalsContact O-CE2 3.32Å; C130-Y136 WeakPolarHBondContact O-CE2 3.36Å; C130-Y136 PolarHBondContact O-OH 2.94Å
131	V	97.8	Very high	94.6	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	27%	0.274	C	S	.	.			trans	-116	9.4	175.1	-65.6	0	0	0	0	112.7	L47 I74 I76 P93 Y97 P133	L47-V131 HydrophobicContact CD1-CG2 4.1Å; I74-V131 HydrophobicContact CB-CG2 4.28Å; I74-V131 HydrophobicContact CG2-CG2 3.8Å; I74-V131 VanDerWaalsContact O-CG2 3.29Å; I74-V131 WeakPolarHBondContact O-CG2 3.37Å; I74-V131 PolarHBondContact O-N 2.83Å; I76-V131 HydrophobicContact CD1-CG1 3.83Å; I76-V131 HydrophobicContact CG1-CG1 3.89Å; I76-V131 HydrophobicContact CG2-CG2 4.16Å; P93-V131 HydrophobicContact CB-CG1 3.84Å; Y97-V131 HydrophobicContact CD2-CB 3.59Å; Y97-V131 HydrophobicContact CD2-CG1 3.7Å; Y97-V131 HydrophobicContact CD2-CG2 4.34Å; Y97-V131 HydrophobicContact CE2-CB 4.17Å; Y97-V131 HydrophobicContact CE2-CG1 4Å; Y97-V131 HydrophobicContact CG-CB 4.41Å; V131-P133 VanDerWaalsContact O-CD 3.25Å; V131-P133 WeakPolarHBondContact O-CD 2.78Å
132	N	97.7	Very high	93.8	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.292	C	S	.	.			trans	-64.9	112.7	171.1	-174.6	-18.8	0	0	0	108.7	T71 K72 I74 C130 Y134 H135 Y136	T71-N132 PolarHBondContact OG1-ND2 2.77Å; K72-N132 PolarHBondContact O-ND2 3.04Å; I74-N132 HydrophobicContact CB-CB 4.09Å; I74-N132 HydrophobicContact CD1-CB 3.72Å; I74-N132 HydrophobicContact CG1-CB 3.98Å; C130-N132 PolarHBondContact SG-N 2.86Å; N132-Y134 PolarHBondContact O-N 3.34Å; N132-Y134 PolarHBondContact OD1-N 2.85Å; N132-H135 HydrophobicContact CB-CB 4.18Å; N132-H135 PolarHBondContact ND2-CD2 3.32Å; N132-H135 PolarHBondContact ND2-NE2 2.67Å; N132-H135 WeakPolarHBondContact O-CB 3.4Å; N132-H135 PolarHBondContact O-N 2.75Å; N132-Y136 WeakPolarHBondContact O-CD2 3.29Å
133	P	97.5	Very high	93.2	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-66.2	-21.8	-176.5	29.7	-36.4	0	0	0	112.4	I64 W101 R102 V131 H135 Y136	I64-P133 HydrophobicContact CD1-CG 3.36Å; W101-P133 HydrophobicContact CB-CB 4.39Å; W101-P133 HydrophobicContact CB-CG 3.99Å; W101-P133 HydrophobicContact CE3-CG 4.15Å; R102-P133 VanDerWaalsContact CD-C 3.46Å; R102-P133 WeakPolarHBondContact CD-O 3.38Å; R102-P133 HydrophobicContact CG-CB 4Å; R102-P133 PolarHBondContact NH1-O 2.84Å; V131-P133 VanDerWaalsContact O-CD 3.25Å; V131-P133 WeakPolarHBondContact O-CD 2.78Å; P133-H135 PolarHBondContact O-N 3.44Å; P133-Y136 PolarHBondContact O-N 3.21Å
134	Y	97.5	Very high	93.1	Very high	18 Å²	18	61.6 Å²	61.6	7%	0.071	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-79.3	-5.6	175.7	-64.6	-81.3	0	0	0	113.7	A63 I64 R67 S69 R102 N132 Y136	A63-Y134 VanDerWaalsContact O-CD2 3.29Å; A63-Y134 WeakPolarHBondContact O-CD2 3.29Å; A63-Y134 VanDerWaalsContact O-CE2 3.25Å; A63-Y134 WeakPolarHBondContact O-CE2 3.37Å; I64-Y134 HydrophobicContact CD1-CE2 4.16Å; R67-Y134 VanDerWaalsContact CA-CE1 3.42Å; R67-Y134 HydrophobicContact CB-CD1 4.35Å; R67-Y134 HydrophobicContact CB-CE1 3.53Å; R67-Y134 HydrophobicContact CB-CE2 4.41Å; R67-Y134 WeakPolarHBondContact CB-OH 3.48Å; R67-Y134 HydrophobicContact CG-CE1 4.28Å; R67-Y134 VanDerWaalsContact CG-OH 3.24Å; R67-Y134 WeakPolarHBondContact CG-OH 3.5Å; R67-Y134 WeakPolarHBondContact O-CD1 3.34Å; S69-Y134 VanDerWaalsContact CB-O 3.27Å; S69-Y134 WeakPolarHBondContact CB-O 3.25Å; R102-Y134 HydrophobicContact CG-CE1 4.12Å; R102-Y134 HydrophobicContact CG-CE2 4.48Å; N132-Y134 PolarHBondContact O-N 3.34Å; N132-Y134 PolarHBondContact OD1-N 2.85Å; Y134-Y136 VanDerWaalsContact C-N 3.33Å
135	H	98	Very high	92.8	Very high	2 Å²	2	60.7 Å²	60.7	1%	0.009	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-90.1	2.9	170.8	-72.9	-163.2	0	0	0	113.5	S69 T71 K72 C73 P114 V115 C118 C130 N132 P133	S69-H135 PolarHBondContact O-CD2 3.45Å; S69-H135 PolarHBondContact O-NE2 3.08Å; T71-H135 PolarHBondContact O-CE1 3.25Å; T71-H135 VanDerWaalsContact O-CE1 3.31Å; T71-H135 PolarHBondContact O-NE2 3.31Å; K72-H135 VanDerWaalsContact C-CE1 3.46Å; K72-H135 PolarHBondContact O-CE1 3.35Å; C73-H135 VanDerWaalsContact CA-CE1 3.46Å; C73-H135 WeakPolarHBondContact CA-CE1 3.25Å; C73-H135 PolarHBondContact N-CE1 2.95Å; C73-H135 VanDerWaalsContact N-CE1 3.34Å; C73-H135 VanDerWaalsContact SG-CE1 3.58Å; P114-H135 CarbonylContact C-O 3.51Å; P114-H135 VanDerWaalsContact CA-O 3.29Å; P114-H135 WeakPolarHBondContact CA-O 3.08Å; V115-H135 HydrophobicContact CG2-CB 4Å; V115-H135 PolarHBondContact N-O 3.47Å; C118-H135 HydrophobicContact CB-CB 4.25Å; C118-H135 PolarHBondContact SG-ND1 3.41Å; C130-H135 PolarHBondContact SG-ND1 2.79Å; C130-H135 VanDerWaalsContact SG-ND1 3.39Å; N132-H135 HydrophobicContact CB-CB 4.18Å; N132-H135 PolarHBondContact ND2-CD2 3.32Å; N132-H135 PolarHBondContact ND2-NE2 2.67Å; N132-H135 WeakPolarHBondContact O-CB 3.4Å; N132-H135 PolarHBondContact O-N 2.75Å; P133-H135 PolarHBondContact O-N 3.44Å
136	Y	97.8	Very high	92.8	Very high	4 Å²	4	55.2 Å²	55.2	2%	0.016	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	122.6	177.2	-62	-89.3	0	0	0	110.5	H94 R102 L112 K113 P114 F122 C130 N132 P133 Y134	H94-Y136 HydrophobicContact CB-CD2 4.25Å; H94-Y136 HydrophobicContact CB-CE1 3.96Å; H94-Y136 HydrophobicContact CB-CE2 3.6Å; H94-Y136 VanDerWaalsContact CB-CZ 3.42Å; H94-Y136 WeakPolarHBondContact CB-OH 3.39Å; H94-Y136 AromaticContact CD2-CE1 3.84Å; R102-Y136 PolarHBondContact NH1-O 3.03Å; L112-Y136 HydrophobicContact CB-CD1 4.31Å; L112-Y136 HydrophobicContact CD1-CG 4.5Å; K113-Y136 CarbonylContact O-C 3.54Å; K113-Y136 WeakPolarHBondContact O-CA 3.24Å; P114-Y136 HydrophobicContact CB-CD1 4.38Å; P114-Y136 HydrophobicContact CB-CE1 4.33Å; F122-Y136 PolarHBondContact N-OH 2.86Å; F122-Y136 VanDerWaalsContact N-OH 3.15Å; C130-Y136 VanDerWaalsContact O-CE2 3.32Å; C130-Y136 WeakPolarHBondContact O-CE2 3.36Å; C130-Y136 PolarHBondContact O-OH 2.94Å; N132-Y136 WeakPolarHBondContact O-CD2 3.29Å; P133-Y136 PolarHBondContact O-N 3.21Å; Y134-Y136 VanDerWaalsContact C-N 3.33Å
137	M	95.2	Very high	92.7	Very high	91 Å²	91	50.8 Å²	50.8	45%	0.448	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	138.9	174.8	-62.6	-178.5	-65.7	0	0	109.4	L112 K113 V115	L112-M137 WeakPolarHBondContact CA-O 3.44Å; K113-M137 PolarHBondContact N-O 3.2Å; K113-M137 PolarHBondContact O-N 2.86Å; V115-M137 HydrophobicContact CG1-CE 4.29Å; V115-M137 HydrophobicContact CG1-CG 4.08Å; V115-M137 HydrophobicContact CG1-SD 4.29Å
138	K	93.9	Very high	92.6	Very high	55 Å²	55	46 Å²	46	24%	0.239	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	133	170.5	-170.9	177	179.6	-174.1	0	108.2	Y103 D105 Q111 E140	Y103-K138 HydrophobicContact CD1-CB 3.98Å; Y103-K138 HydrophobicContact CD1-CD 3.79Å; Y103-K138 HydrophobicContact CD2-CB 4.04Å; Y103-K138 HydrophobicContact CE1-CB 3.68Å; Y103-K138 HydrophobicContact CE1-CD 4.23Å; Y103-K138 HydrophobicContact CE2-CB 3.76Å; Y103-K138 HydrophobicContact CG-CB 4.14Å; Y103-K138 HydrophobicContact CG-CD 4Å; Y103-K138 PolarHBondContact OH-N 3.04Å; D105-K138 IonicContact OD1-NZ 3.56Å; D105-K138 PolarHBondContact OD1-NZ 3.21Å; D105-K138 IonicContact OD2-NZ 3.08Å; D105-K138 PolarHBondContact OD2-NZ 3.32Å; Q111-K138 CarbonylContact O-C 3.46Å; Q111-K138 VanDerWaalsContact O-CA 3.29Å; Q111-K138 WeakPolarHBondContact O-CA 3.29Å; K138-E140 PolarHBondContact O-N 2.93Å
139	I	91.1	Very high	92.3	Very high	62 Å²	62	42.9 Å²	42.9	32%	0.318	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-74.6	116.5	173.4	-67.6	164.4	0	0	0	107.2	H110 Q111 K113 I345	H110-I139 WeakPolarHBondContact O-CD1 3.28Å; Q111-I139 PolarHBondContact O-N 2.87Å; K113-I139 HydrophobicContact CB-CD1 4.22Å; K113-I139 HydrophobicContact CB-CG1 4.14Å; I139-I345 HydrophobicContact CB-CD1 4.13Å; I139-I345 HydrophobicContact CB-CG1 4.18Å; I139-I345 HydrophobicContact CD1-CD1 3.64Å; I139-I345 HydrophobicContact CD1-CG1 4.41Å; I139-I345 HydrophobicContact CG1-CD1 4.47Å; I139-I345 HydrophobicContact CG2-CD1 4.3Å; I139-I345 HydrophobicContact CG2-CG1 3.93Å
140	E	82.8	Confident	91.8	Very high	165 Å²	165	46.4 Å²	46.4	77%	0.771	26%	0.257	S	S	*	.	P	Polyproline II helix	trans	-85.3	150.6	175.6	-65.1	-179.8	176.4	0	0	110	K138	K138-E140 PolarHBondContact O-N 2.93Å
141	N	79.4	Confident	90.9	Very high	88 Å²	88	50.7 Å²	50.7	47%	0.471	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-72.2	126.4	171.4	-70.4	-16.4	0	0	0	108.4	G346 G347	N141-G346 WeakPolarHBondContact OD1-CA 3.19Å; N141-G346 PolarHBondContact OD1-N 3.1Å; N141-G347 PolarHBondContact OD1-N 3.31Å
142	P	80.5	Confident	89.3	Confident	61 Å²	61	52.4 Å²	52.4	40%	0.396	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-61.9	142.9	175.7	27.5	-33.2	0	0	0	109.6	L144 G346	P142-L144 PolarHBondContact O-N 3.36Å; P142-G346 VanDerWaalsContact CD-C 3.41Å; P142-G346 WeakPolarHBondContact CD-O 3.46Å
143	V	84.1	Confident	87	Confident	143 Å²	143	60.2 Å²	60.2	87%	0.867	33%	0.33	S	S	*	.			trans	-71	115	171.2	-178.6	0	0	0	0	107.7
144	L	90	Very high	84.3	Confident	24 Å²	24	67.3 Å²	67.3	13%	0.126	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-80.1	134.3	178.1	-61.7	172.1	0	0	0	109.7	P142 Y272 N391 Q392 A395 W452	P142-L144 PolarHBondContact O-N 3.36Å; L144-Y272 HydrophobicContact CD1-CD1 3.77Å; L144-Y272 HydrophobicContact CD1-CD2 3.97Å; L144-Y272 HydrophobicContact CD1-CE1 4.13Å; L144-Y272 HydrophobicContact CD1-CE2 4.29Å; L144-Y272 HydrophobicContact CD1-CG 3.67Å; L144-N391 HydrophobicContact CD1-CB 3.8Å; L144-N391 HydrophobicContact CD2-CB 4.08Å; L144-Q392 HydrophobicContact CD2-CB 4.28Å; L144-A395 HydrophobicContact CD2-CB 4.46Å; L144-W452 HydrophobicContact CB-CH2 3.79Å; L144-W452 HydrophobicContact CB-CZ3 4.25Å; L144-W452 HydrophobicContact CD1-CH2 4.25Å; L144-W452 HydrophobicContact CD1-CZ3 3.84Å
145	P	89.3	Confident	81.7	Confident	71 Å²	71	70.2 Å²	70.2	46%	0.461	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-67.8	144	178.5	29.1	-34.5	0	0	0	110.5	W452	P145-W452 WeakPolarHBondContact O-CZ2 3.07Å
146	A	92.8	Very high	79.2	Confident	36 Å²	36	76.4 Å²	76.4	30%	0.298	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-65	146.3	175.1	0	0	0	0	0	111.8	S269 E271	A146-S269 WeakPolarHBondContact CB-OG 3.4Å; A146-E271 HydrophobicContact CB-CG 4Å
147	I	93.6	Very high	76.9	Confident	1 Å²	1	82.6 Å²	82.6	1%	0.005	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	128	175.6	-54.2	-59.8	0	0	0	108.9	V149 V270 L398 V402 W452 V456	I147-V149 HydrophobicContact CG2-CG2 4.48Å; I147-V270 PolarHBondContact N-O 2.86Å; I147-V270 PolarHBondContact O-N 2.88Å; I147-L398 HydrophobicContact CD1-CB 4.28Å; I147-L398 HydrophobicContact CD1-CD2 4.25Å; I147-L398 HydrophobicContact CD1-CG 4.08Å; I147-L398 HydrophobicContact CG1-CD2 3.84Å; I147-L398 HydrophobicContact CG1-CG 3.99Å; I147-L398 HydrophobicContact CG2-CG 4.42Å; I147-V402 HydrophobicContact CG2-CG2 3.72Å; I147-W452 HydrophobicContact CD1-CH2 4.24Å; I147-W452 HydrophobicContact CD1-CZ2 3.82Å; I147-W452 HydrophobicContact CG1-CD2 4.48Å; I147-W452 HydrophobicContact CG1-CH2 4.37Å; I147-W452 HydrophobicContact CG1-CZ2 3.52Å; I147-V456 HydrophobicContact CB-CG2 3.9Å; I147-V456 HydrophobicContact CG1-CG2 4.24Å; I147-V456 HydrophobicContact CG2-CG1 4.42Å; I147-V456 HydrophobicContact CG2-CG2 3.83Å
148	L	92.8	Very high	74.7	Confident	75 Å²	75	84.4 Å²	84.4	39%	0.393	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	120.7	176.9	-58.4	-178.2	0	0	0	109.9	M264 C267 F268	L148-M264 HydrophobicContact CD1-CE 3.65Å; L148-C267 HydrophobicContact CB-CB 4.2Å; L148-F268 CarbonylContact C-O 3.46Å; L148-F268 WeakPolarHBondContact CA-O 3.21Å
149	V	91.2	Very high	72.8	Confident	2 Å²	2	88.1 Å²	88.1	1%	0.012	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	119.9	176.9	-173.4	0	0	0	0	109.1	I147 K151 C267 F268 V270 V456 Q459 M460	I147-V149 HydrophobicContact CG2-CG2 4.48Å; V149-K151 PolarHBondContact O-N 3.35Å; V149-C267 CarbonylContact O-C 3.58Å; V149-C267 WeakPolarHBondContact O-CA 3.29Å; V149-F268 HydrophobicContact CB-CB 4.47Å; V149-F268 PolarHBondContact N-O 2.91Å; V149-F268 PolarHBondContact O-N 2.84Å; V149-V270 HydrophobicContact CG2-CG2 4.11Å; V149-V456 HydrophobicContact CG2-CB 4.43Å; V149-V456 HydrophobicContact CG2-CG1 3.82Å; V149-V456 HydrophobicContact CG2-CG2 4.44Å; V149-Q459 HydrophobicContact CB-CB 4.09Å; V149-Q459 HydrophobicContact CG1-CB 3.89Å; V149-Q459 HydrophobicContact CG2-CB 4.31Å; V149-M460 HydrophobicContact CG1-CG 3.65Å
150	P	86.4	Confident	71.4	Confident	77 Å²	77	91.2 Å²	91.2	50%	0.5	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	134.7	176.6	-23.2	33.3	0	0	0	111.3	G152	P150-G152 PolarHBondContact O-N 2.55Å
151	K	78.6	Confident	70.3	Confident	90 Å²	90	89 Å²	89	39%	0.391	47%	0.47	S	S	.	.			trans	-67.5	114.9	170.1	-68.5	-179.8	-177.1	163.7	0	107.5	V149 Q153 R265 D266 F268	V149-K151 PolarHBondContact O-N 3.35Å; K151-Q153 PolarHBondContact O-N 3.14Å; K151-R265 PolarHBondContact NZ-O 3.39Å; K151-D266 WeakPolarHBondContact CB-O 3.27Å; K151-D266 WeakPolarHBondContact CG-O 3.42Å; K151-D266 PolarHBondContact N-O 3.18Å; K151-F268 HydrophobicContact CB-CE2 4.3Å; K151-F268 HydrophobicContact CD-CE2 4.42Å; K151-F268 HydrophobicContact CD-CZ 4.27Å; K151-F268 HydrophobicContact CG-CD2 3.8Å; K151-F268 HydrophobicContact CG-CE1 4.42Å; K151-F268 HydrophobicContact CG-CE2 3.52Å; K151-F268 HydrophobicContact CG-CG 4.39Å; K151-F268 HydrophobicContact CG-CZ 3.85Å
152	G	64.9	Low	69.6	Low	35 Å²	35	90.6 Å²	90.6	36%	0.361	48%	0.475	S	S	.	.			trans	-50.6	130.6	169.6	0	0	0	0	0	109.7	P150 Q154 E461	P150-G152 PolarHBondContact O-N 2.55Å; G152-Q154 VanDerWaalsContact C-N 3.33Å; G152-Q154 PolarHBondContact O-N 2.89Å; G152-E461 WeakPolarHBondContact CA-OE1 3.34Å
153	Q	49.3	Very low	69	Low	165 Å²	165	93.7 Å²	93.7	77%	0.771	48%	0.484	S	S	*	.			trans	-62.1	104	169.1	-71.1	-178.2	5.9	0	0	105.6	K151	K151-Q153 PolarHBondContact O-N 3.14Å
154	Q	40.8	Very low	68.3	Low	149 Å²	149	93.3 Å²	93.3	70%	0.696	47%	0.473	S	S	*	.			trans	-44.4	139	171.5	-79.3	-176.7	-3.2	0	0	108.3	G152 Q156	G152-Q154 VanDerWaalsContact C-N 3.33Å; G152-Q154 PolarHBondContact O-N 2.89Å; Q154-Q156 PolarHBondContact O-N 2.58Å
155	P	42.6	Very low	67.4	Low	79 Å²	79	98.3 Å²	98.3	51%	0.513	50%	0.495	S	S	.	.	S	Bend	trans	-68.7	51.4	-177.2	-16.8	29.8	0	0	0	113.7	Q157 Q158 Q159	P155-Q157 PolarHBondContact O-N 3.19Å; P155-Q158 HydrophobicContact CB-CB 3.95Å; P155-Q158 HydrophobicContact CB-CG 4.22Å; P155-Q158 PolarHBondContact O-N 2.8Å; P155-Q159 PolarHBondContact O-N 2.86Å
156	Q	46.2	Very low	66.5	Low	132 Å²	132	101.1 Å²	101.1	62%	0.617	50%	0.502	S	S	*	.	H	α-helix	trans	-63.4	-27.2	169.5	-71.1	-173.9	4	0	0	110.6	Q154 Q160	Q154-Q156 PolarHBondContact O-N 2.58Å; Q156-Q160 PolarHBondContact O-N 3.02Å
157	Q	48.9	Very low	65.5	Low	133 Å²	133	105.1 Å²	105.1	62%	0.621	52%	0.515	S	S	*	.	H	α-helix	trans	-72.7	-30.1	173.7	-69.9	-174.2	17.6	0	0	113.5	P155 Q160 Q161	P155-Q157 PolarHBondContact O-N 3.19Å; Q157-Q160 PolarHBondContact O-N 2.84Å; Q157-Q161 PolarHBondContact O-N 2.81Å
158	Q	50.1	Low	64.4	Low	129 Å²	129	111.3 Å²	111.3	60%	0.603	54%	0.543	S	S	*	.	H	α-helix	trans	-71.9	-32.7	175.6	-77.7	-178	7.9	0	0	112	P155 Q162	P155-Q158 HydrophobicContact CB-CB 3.95Å; P155-Q158 HydrophobicContact CB-CG 4.22Å; P155-Q158 PolarHBondContact O-N 2.8Å; Q158-Q162 PolarHBondContact O-N 3.04Å
159	Q	54.4	Low	63.4	Low	133 Å²	133	114 Å²	114	62%	0.621	55%	0.554	S	S	*	*	H	α-helix	trans	-68.3	-36.6	171.9	-83.6	-178.2	4.3	0	0	112.5	P155 Q163	P155-Q159 PolarHBondContact O-N 2.86Å; Q159-Q163 WeakPolarHBondContact O-CG 3.38Å; Q159-Q163 PolarHBondContact O-N 3.24Å
160	Q	60.4	Low	62.4	Low	127 Å²	127	119.9 Å²	119.9	59%	0.593	58%	0.582	S	S	*	*	H	α-helix	trans	-69.8	-37.2	175	-78.6	-176.7	6.7	0	0	112.8	Q156 Q157 Q163 Q164	Q156-Q160 PolarHBondContact O-N 3.02Å; Q157-Q160 PolarHBondContact O-N 2.84Å; Q160-Q163 PolarHBondContact O-N 2.87Å; Q160-Q164 PolarHBondContact O-N 3.38Å
161	Q	60.6	Low	61.5	Low	118 Å²	118	122.1 Å²	122.1	55%	0.551	59%	0.585	S	S	*	*	H	α-helix	trans	-69.8	-36	175.3	-77.8	-177.7	10.9	0	0	112.7	Q157 Q164 Q165	Q157-Q161 PolarHBondContact O-N 2.81Å; Q161-Q164 PolarHBondContact O-N 2.8Å; Q161-Q165 PolarHBondContact O-N 2.7Å
162	Q	63.5	Low	61	Low	123 Å²	123	124 Å²	124	58%	0.575	60%	0.595	S	S	*	*	H	α-helix	trans	-66.8	-38.1	172.8	-80.9	-177.3	8.4	0	0	112.3	Q158 Q165 Q166	Q158-Q162 PolarHBondContact O-N 3.04Å; Q162-Q165 PolarHBondContact O-N 2.84Å; Q162-Q166 PolarHBondContact O-N 3.39Å
163	Q	69.4	Low	61	Low	126 Å²	126	129 Å²	129	59%	0.589	61%	0.609	S	S	*	*	H	α-helix	trans	-67.1	-37.8	174.2	-76.6	-179.8	15.5	0	0	112.2	Q159 Q160 Q166 H167	Q159-Q163 WeakPolarHBondContact O-CG 3.38Å; Q159-Q163 PolarHBondContact O-N 3.24Å; Q160-Q163 PolarHBondContact O-N 2.87Å; Q163-Q166 PolarHBondContact O-N 3.05Å; Q163-H167 PolarHBondContact O-N 2.84Å
164	Q	69.8	Low	61.5	Low	135 Å²	135	128.4 Å²	128.4	63%	0.631	61%	0.607	S	S	*	*	H	α-helix	trans	-68.2	-38.7	175.2	-79.7	-178	9.2	0	0	112.8	Q160 Q161 H167 Q168	Q160-Q164 PolarHBondContact O-N 3.38Å; Q161-Q164 PolarHBondContact O-N 2.8Å; Q164-H167 PolarHBondContact O-N 3.43Å; Q164-Q168 PolarHBondContact O-N 2.89Å
165	Q	69.2	Low	62.4	Low	128 Å²	128	128.2 Å²	128.2	60%	0.598	61%	0.606	S	S	*	*	H	α-helix	trans	-65.6	-38.2	174.5	-80.3	-177.2	8.8	0	0	112.3	Q161 Q162 H167 Q168 Q169	Q161-Q165 PolarHBondContact O-N 2.7Å; Q162-Q165 PolarHBondContact O-N 2.84Å; Q165-H167 VanDerWaalsContact C-N 3.34Å; Q165-Q168 PolarHBondContact O-N 3.06Å; Q165-Q169 PolarHBondContact O-N 3.2Å
166	Q	70.8	Confident	63.1	Low	131 Å²	131	131.7 Å²	131.7	61%	0.612	62%	0.615	S	S	*	*	H	α-helix	trans	-64.6	-38.6	172.7	-77.6	-175.6	2.5	0	0	112.1	Q162 Q163 Q169 Q170	Q162-Q166 PolarHBondContact O-N 3.39Å; Q163-Q166 PolarHBondContact O-N 3.05Å; Q166-Q169 PolarHBondContact O-N 3.38Å; Q166-Q170 PolarHBondContact O-N 3.47Å
167	H	72.9	Confident	63.6	Low	120 Å²	120	133.4 Å²	133.4	56%	0.556	62%	0.623	S	S	*	*	H	α-helix	trans	-67.3	-37.3	176.5	-121.1	73.1	0	0	0	112.7	Q163 Q164 Q165 Q170 Q171	Q163-H167 PolarHBondContact O-N 2.84Å; Q164-H167 PolarHBondContact O-N 3.43Å; Q165-H167 VanDerWaalsContact C-N 3.34Å; H167-Q170 PolarHBondContact O-N 3.01Å; H167-Q171 PolarHBondContact O-N 2.97Å
168	Q	70.3	Confident	63.9	Low	130 Å²	130	130.9 Å²	130.9	61%	0.607	63%	0.625	S	S	*	*	H	α-helix	trans	-68.9	-37.8	175.9	-103.5	179	13	0	0	113	Q164 Q165 Q170 Q171 Q172	Q164-Q168 PolarHBondContact O-N 2.89Å; Q165-Q168 PolarHBondContact O-N 3.06Å; Q168-Q170 VanDerWaalsContact C-N 3.33Å; Q168-Q170 PolarHBondContact O-N 3.18Å; Q168-Q171 PolarHBondContact O-N 2.93Å; Q168-Q172 PolarHBondContact O-N 3.43Å; Q168-Q172 VanDerWaalsContact O-N 3.09Å
169	Q	71	Confident	64.1	Low	131 Å²	131	130.2 Å²	130.2	61%	0.612	63%	0.629	S	S	*	*	H	α-helix	trans	-65.4	-36.1	174.9	-80.6	-176.6	9	0	0	112.3	Q165 Q166 Q173	Q165-Q169 PolarHBondContact O-N 3.2Å; Q166-Q169 PolarHBondContact O-N 3.38Å; Q169-Q173 PolarHBondContact O-N 3.01Å
170	Q	70.9	Confident	63.5	Low	127 Å²	127	129.3 Å²	129.3	59%	0.593	63%	0.633	S	S	*	*	H	α-helix	trans	-67.7	-36.1	174.9	-78.7	-177.3	5.7	0	0	112.7	Q166 H167 Q168 Q174	Q166-Q170 PolarHBondContact O-N 3.47Å; H167-Q170 PolarHBondContact O-N 3.01Å; Q168-Q170 VanDerWaalsContact C-N 3.33Å; Q168-Q170 PolarHBondContact O-N 3.18Å; Q170-Q174 PolarHBondContact O-N 3.06Å
171	Q	68.2	Low	62.7	Low	124 Å²	124	131.3 Å²	131.3	58%	0.579	65%	0.648	S	S	*	*	H	α-helix	trans	-71.5	-34.9	177	-74.8	-176.3	12.1	0	0	113.2	H167 Q168 Q174 H175	H167-Q171 PolarHBondContact O-N 2.97Å; Q168-Q171 PolarHBondContact O-N 2.93Å; Q171-Q174 PolarHBondContact O-N 2.84Å; Q171-H175 PolarHBondContact O-N 2.96Å
172	Q	66.5	Low	61.6	Low	129 Å²	129	129.7 Å²	129.7	60%	0.603	66%	0.663	S	S	*	*	H	α-helix	trans	-68.5	-33	175.4	-78.8	-176.9	7.7	0	0	112.9	Q168 Q174 H175 Q176	Q168-Q172 PolarHBondContact O-N 3.43Å; Q168-Q172 VanDerWaalsContact O-N 3.09Å; Q172-Q174 VanDerWaalsContact C-N 3.33Å; Q172-Q174 PolarHBondContact O-N 3.36Å; Q172-H175 PolarHBondContact O-N 3.45Å; Q172-Q176 PolarHBondContact O-N 3.24Å
173	Q	64.5	Low	60.4	Low	140 Å²	140	130 Å²	130	65%	0.654	68%	0.678	S	S	*	*	H	α-helix	trans	-68.4	-30.5	174.6	-77	-177.2	10	0	0	112.9	Q169	Q169-Q173 PolarHBondContact O-N 3.01Å
174	Q	61.7	Low	58.9	Low	153 Å²	153	127 Å²	127	72%	0.715	68%	0.681	S	S	*	*	H	α-helix	trans	-75.9	-31.1	173.9	-77.5	-176.2	2.8	0	0	113.1	Q170 Q171 Q172	Q170-Q174 PolarHBondContact O-N 3.06Å; Q171-Q174 PolarHBondContact O-N 2.84Å; Q172-Q174 VanDerWaalsContact C-N 3.33Å; Q172-Q174 PolarHBondContact O-N 3.36Å
175	H	58.7	Low	57.5	Low	145 Å²	145	129.5 Å²	129.5	67%	0.671	69%	0.69	S	S	*	*	H	α-helix	trans	-77.6	-28.2	179	-112.9	69.4	0	0	0	114.1	Q171 Q172 Q177 A178	Q171-H175 PolarHBondContact O-N 2.96Å; Q172-H175 PolarHBondContact O-N 3.45Å; H175-Q177 VanDerWaalsContact C-N 3.25Å; H175-Q177 PolarHBondContact O-N 2.98Å; H175-A178 PolarHBondContact O-N 2.89Å
176	Q	57.5	Low	56	Low	151 Å²	151	131 Å²	131	71%	0.706	70%	0.698	S	S	*	*	H	α-helix	trans	-71.5	-16.9	176.3	-83.3	177.9	11.7	0	0	114	Q172 A178	Q172-Q176 PolarHBondContact O-N 3.24Å; Q176-A178 VanDerWaalsContact C-N 3.31Å
177	Q	55.8	Low	54.4	Low	168 Å²	168	133.1 Å²	133.1	79%	0.785	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	-11.4	173.5	-70.4	-176.1	-1.3	0	0	113.5	H175	H175-Q177 VanDerWaalsContact C-N 3.25Å; H175-Q177 PolarHBondContact O-N 2.98Å
178	A	56.4	Low	52.6	Low	80 Å²	80	131.1 Å²	131.1	66%	0.661	72%	0.724	S	S	*	*	S	Bend	trans	-97.6	-9.5	-177.2	0	0	0	0	0	115	H175 Q176	H175-A178 PolarHBondContact O-N 2.89Å; Q176-A178 VanDerWaalsContact C-N 3.31Å
179	V	53.5	Low	51.2	Low	115 Å²	115	133.7 Å²	133.7	70%	0.697	74%	0.738	S	S	*	*			trans	-122	69.9	-173.6	-160.8	0	0	0	0	110.6
180	T	42	Very low	50.3	Low	114 Å²	114	132.4 Å²	132.4	70%	0.699	74%	0.742	S	S	*	*			trans	-122.9	86.8	163.5	48.1	0	0	0	0	107.9
181	N	43.2	Very low	48.8	Very low	170 Å²	170	130.9 Å²	130.9	91%	0.909	75%	0.745	S	S	*	*			trans	-177	121.9	159.1	-93	-23	0	0	0	108.6
182	G	38.2	Very low	47.4	Very low	84 Å²	84	130.7 Å²	130.7	87%	0.866	76%	0.756	S	S	*	*			trans	123.5	93.5	164.3	0	0	0	0	0	114.9
183	S	38.1	Very low	46.3	Very low	128 Å²	128	128.9 Å²	128.9	90%	0.895	76%	0.758	S	S	*	*			trans	-73.5	156.9	174.5	48.6	0	0	0	0	115.1
184	G	36.8	Very low	45.1	Very low	64 Å²	64	130.1 Å²	130.1	66%	0.66	77%	0.769	S	S	*	*			trans	134	107.9	149.6	0	0	0	0	0	114.6
185	F	40.5	Very low	43.9	Very low	187 Å²	187	126.1 Å²	126.1	82%	0.82	77%	0.769	S	S	*	*				67.1	137	112.5	-91.8	-103.9	0	0	0	114.9
186	E	38.2	Very low	42.9	Very low	160 Å²	160	126.6 Å²	126.6	75%	0.748	78%	0.782	S	S	*	*			cis	-169	179.9	7	-142.6	176.6	176.8	0	0	108.4
187	L	36.8	Very low	42	Very low	175 Å²	175	128.1 Å²	128.1	92%	0.916	79%	0.789	S	S	*	*			trans	-79.9	160.4	-162.4	-70.6	140.1	0	0	0	117.7
188	G	35.2	Very low	41.2	Very low	79 Å²	79	126.1 Å²	126.1	81%	0.814	79%	0.791	S	S	*	*			trans	-167.6	103.7	162	0	0	0	0	0	114.8
189	M	42.1	Very low	40.2	Very low	183 Å²	183	132.1 Å²	132.1	90%	0.901	81%	0.805	S	S	*	*			trans	-103.9	-178	164.5	-97.6	-102.1	148.9	0	0	108.1
190	P	51.3	Low	39.3	Very low	105 Å²	105	138.2 Å²	138.2	68%	0.682	82%	0.815	S	S	*	*			cis	-149.5	172.7	13.6	42.5	-20.6	0	0	0	119.2
191	S	39.3	Very low	38.9	Very low	95 Å²	95	142.1 Å²	142.1	66%	0.664	83%	0.828	S	S	*	*				61.8	142.9	128.9	64.7	0	0	0	0	128
192	C	39.3	Very low	38.4	Very low	119 Å²	119	142.9 Å²	142.9	80%	0.804	83%	0.826	S	S	*	*			trans	132.6	140.1	137.3	-69.9	0	0	0	0	113.4
193	S	43.5	Very low	38	Very low	92 Å²	92	146.8 Å²	146.8	64%	0.643	83%	0.826	S	S	*	*			cis	178.2	153.2	-21.2	42.6	0	0	0	0	109.1
194	N	39.7	Very low	37.7	Very low	166 Å²	166	147.1 Å²	147.1	89%	0.888	82%	0.822	S	S	*	*			trans	77.8	134.5	162.9	-56.5	-13.7	0	0	0	117.9
195	G	35.6	Very low	37.3	Very low	69 Å²	69	155.1 Å²	155.1	71%	0.711	83%	0.833	S	S	*	*			cis	136	120.1	14.8	0	0	0	0	0	106.6
196	T	37.9	Very low	36.8	Very low	154 Å²	154	151.7 Å²	151.7	95%	0.945	83%	0.832	S	S	*	*				170.9	151.4	102.8	-34.5	0	0	0	0	109.5
197	Q	38.5	Very low	36.6	Very low	184 Å²	184	149.7 Å²	149.7	86%	0.86	83%	0.833	S	S	*	*			trans	-82.9	167.7	-169.5	-73	-172.7	-25.6	0	0	117
198	P	38.5	Very low	36.5	Very low	126 Å²	126	149.8 Å²	149.8	82%	0.818	83%	0.832	S	S	*	*			trans	-105.5	153.3	177.3	38.5	-28.6	0	0	0	115.3
199	E	35.4	Very low	36.1	Very low	206 Å²	206	151.7 Å²	151.7	96%	0.963	83%	0.828	S	S	*	*			trans	-101.7	153.6	172.1	-96	-170.1	132.2	0	0	113.4
200	R	34.7	Very low	35.5	Very low	242 Å²	242	148.3 Å²	148.3	91%	0.913	82%	0.823	S	S	*	*			trans	-103.1	138.8	-172.8	-177.2	-175.2	-172	177.1	2.3	109.9
201	M	33.9	Very low	34.4	Very low	196 Å²	196	152 Å²	152	97%	0.966	83%	0.828	S	S	*	*			trans	-126.6	138.5	171.9	-116	178.4	-176	0	0	112.5
202	E	32.8	Very low	34	Very low	187 Å²	187	157.4 Å²	157.4	87%	0.874	84%	0.84	S	S	*	*			trans	-84.2	162	-173.6	-69.4	-170.5	132.7	0	0	114.7
203	L	30.8	Very low	33.6	Very low	166 Å²	166	160.7 Å²	160.7	87%	0.869	84%	0.843	S	S	*	*			trans	-72.2	135.7	175.6	-122.1	86	0	0	0	112.5
204	V	31.7	Very low	32.8	Very low	134 Å²	134	163.8 Å²	163.8	81%	0.812	85%	0.853	S	S	*	*			trans	-128.2	123.1	162.9	178.2	0	0	0	0	109.7
205	R	27	Very low	32.4	Very low	233 Å²	233	161.5 Å²	161.5	88%	0.879	85%	0.85	S	S	*	*			trans	-85.9	148.4	166.1	-83.8	-179.8	172.8	178.6	-1.9	109.8
206	S	31.7	Very low	32	Very low	114 Å²	114	162 Å²	162	80%	0.797	85%	0.854	S	S	*	*			trans	-146.7	143.2	158	-78	0	0	0	0	111.1
207	P	33.8	Very low	31.7	Very low	119 Å²	119	160.3 Å²	160.3	77%	0.773	84%	0.844	S	S	*	*			trans	-102.2	160.1	-175.1	38.9	-31.5	0	0	0	112.5
208	I	34.6	Very low	31.2	Very low	176 Å²	176	157 Å²	157	90%	0.903	84%	0.838	S	S	*	*			trans	-133.9	132.9	163.8	-63.7	-178.3	0	0	0	110.6
209	V	25.7	Very low	30.8	Very low	119 Å²	119	159.4 Å²	159.4	72%	0.721	84%	0.839	S	S	*	*			trans	-91.2	145.5	-179.7	167.2	0	0	0	0	109.9
210	S	29.5	Very low	30.7	Very low	113 Å²	113	156 Å²	156	79%	0.79	83%	0.827	S	S	*	*			trans	-151.2	119.1	147.2	53.3	0	0	0	0	111.1
211	K	27.7	Very low	30.7	Very low	181 Å²	181	149.4 Å²	149.4	79%	0.787	81%	0.814	S	S	*	*			trans	-81.1	142.6	170.9	-66	172.7	174.4	176.1	0	109.3
212	F	31.1	Very low	30.7	Very low	209 Å²	209	147.7 Å²	147.7	92%	0.917	81%	0.808	S	S	*	*			trans	-141.2	145.9	148.7	-91.9	-76.7	0	0	0	111
213	E	30.7	Very low	30.8	Very low	188 Å²	188	148.3 Å²	148.3	88%	0.879	80%	0.804	S	S	*	*			trans	-85.7	166.4	-161.3	-70.5	171.7	132.3	0	0	114.3
214	N	26.7	Very low	30.9	Very low	157 Å²	157	145.4 Å²	145.4	84%	0.84	80%	0.795	S	S	*	*			trans	-70.1	137.9	-173.7	-154.5	22.4	0	0	0	113
215	S	32.1	Very low	30.9	Very low	118 Å²	118	142.3 Å²	142.3	83%	0.825	79%	0.79	S	S	*	*			trans	-164.7	139	148	-83.5	0	0	0	0	110.7
216	G	27.3	Very low	31.4	Very low	79 Å²	79	136.6 Å²	136.6	81%	0.814	78%	0.784	S	S	*	*			trans	-68.7	162.9	-159.4	0	0	0	0	0	117.1
217	V	30.9	Very low	31.4	Very low	120 Å²	120	139.7 Å²	139.7	73%	0.727	79%	0.791	S	S	*	*			trans	-137.7	139.8	174.6	-177.2	0	0	0	0	109.8
218	P	29.5	Very low	31.4	Very low	113 Å²	113	137.4 Å²	137.4	73%	0.734	78%	0.782	S	S	*	*			trans	-83.5	179.6	-179	17.6	0.4	0	0	0	113
219	E	29	Very low	31.2	Very low	178 Å²	178	133.6 Å²	133.6	83%	0.832	77%	0.769	S	S	*	*	S	Bend	trans	-46.9	144.2	-174.4	-61.8	170.8	123.5	0	0	117.1
220	N	33.5	Very low	31.3	Very low	134 Å²	134	134.7 Å²	134.7	72%	0.717	78%	0.776	S	S	*	*			trans	59.5	91.5	166.8	-55	-57.3	0	0	0	116.3
221	V	34.7	Very low	31.3	Very low	104 Å²	104	138.5 Å²	138.5	63%	0.63	78%	0.775	S	S	*	*			trans	-106.9	102.4	168.9	-150.1	0	0	0	0	109.2	Y223	V221-Y223 PolarHBondContact O-N 3.49Å
222	D	34.5	Very low	31.4	Very low	160 Å²	160	135.3 Å²	135.3	86%	0.856	77%	0.772	S	S	*	*			trans	-61.4	114.7	148	-96.6	-47.7	0	0	0	106.3	P224	D222-P224 VanDerWaalsContact O-CD 3.31Å; D222-P224 WeakPolarHBondContact O-CD 3.39Å
223	Y	34.1	Very low	31.4	Very low	199 Å²	199	133.1 Å²	133.1	78%	0.78	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-73.7	119.3	179.3	-128.3	-90.4	0	0	0	109	V221	V221-Y223 PolarHBondContact O-N 3.49Å
224	P	32.8	Very low	31.3	Very low	105 Å²	105	132.4 Å²	132.4	68%	0.682	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-70	151.9	167.5	-6	24	0	0	0	109.4	D222	D222-P224 VanDerWaalsContact O-CD 3.31Å; D222-P224 WeakPolarHBondContact O-CD 3.39Å
225	G	31.8	Very low	31.5	Very low	69 Å²	69	132.2 Å²	132.2	71%	0.711	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-55.5	160.6	-177	0	0	0	0	0	114.7	D227	G225-D227 PolarHBondContact O-N 2.69Å
226	P	38	Very low	31.3	Very low	114 Å²	114	135 Å²	135	74%	0.74	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-85	120.1	-165.8	33	-30.3	0	0	0	111.4	A228	P226-A228 HydrophobicContact CB-CB 4.45Å
227	D	32.1	Very low	31.6	Very low	178 Å²	178	134.9 Å²	134.9	95%	0.952	75%	0.747	S	S	*	*			trans	-88.1	86.7	144.9	-75.7	-38	0	0	0	106.9	G225	G225-D227 PolarHBondContact O-N 2.69Å
228	A	33.2	Very low	31.7	Very low	72 Å²	72	135.7 Å²	135.7	60%	0.595	76%	0.755	S	S	*	*			trans	-125.4	129.9	169.2	0	0	0	0	0	109.2	P226 T230	P226-A228 HydrophobicContact CB-CB 4.45Å; A228-T230 PolarHBondContact O-N 3.17Å
229	P	29.9	Very low	31.8	Very low	96 Å²	96	138.3 Å²	138.3	62%	0.623	76%	0.761	S	S	*	*			trans	-66.5	135.8	-172.8	25.5	-30.8	0	0	0	111	Y231	P229-Y231 HydrophobicContact CG-CE2 4.33Å; P229-Y231 WeakPolarHBondContact O-CD2 3.35Å; P229-Y231 PolarHBondContact O-N 3.48Å; P229-Y231 VanDerWaalsContact O-N 3.16Å
230	T	28.9	Very low	32.1	Very low	141 Å²	141	135 Å²	135	87%	0.865	76%	0.758	S	S	*	*			trans	-61.8	109.5	177	-36	0	0	0	0	109.8	A228	A228-T230 PolarHBondContact O-N 3.17Å
231	Y	29	Very low	31.8	Very low	194 Å²	194	131.2 Å²	131.2	76%	0.761	75%	0.75	S	S	*	*			trans	-88.2	122.5	163.6	-66.2	-81.6	0	0	0	108.1	P229 I233	P229-Y231 HydrophobicContact CG-CE2 4.33Å; P229-Y231 WeakPolarHBondContact O-CD2 3.35Å; P229-Y231 PolarHBondContact O-N 3.48Å; P229-Y231 VanDerWaalsContact O-N 3.16Å; Y231-I233 PolarHBondContact O-N 3.47Å; Y231-I233 VanDerWaalsContact O-N 3.15Å
232	P	29.5	Very low	31.8	Very low	114 Å²	114	137.3 Å²	137.3	74%	0.74	76%	0.763	S	S	*	*			trans	-67.7	115.5	174.1	26.5	-30.3	0	0	0	108.5	K234	P232-K234 VanDerWaalsContact C-N 3.29Å; P232-K234 PolarHBondContact O-N 3.36Å
233	I	32.6	Very low	31.7	Very low	162 Å²	162	136.3 Å²	136.3	83%	0.831	76%	0.757	S	S	*	*			trans	-70.4	95	165.3	-59.1	176.1	0	0	0	106	Y231 L235	Y231-I233 PolarHBondContact O-N 3.47Å; Y231-I233 VanDerWaalsContact O-N 3.15Å; I233-L235 PolarHBondContact O-N 2.76Å; I233-L235 VanDerWaalsContact O-N 3.17Å
234	K	27.7	Very low	31.6	Very low	174 Å²	174	132.9 Å²	132.9	76%	0.757	75%	0.752	S	S	*	*			trans	-66.2	106.9	160.8	-93.6	-176.7	173.3	-176.7	0	107.4	P232 E236	P232-K234 VanDerWaalsContact C-N 3.29Å; P232-K234 PolarHBondContact O-N 3.36Å; K234-E236 VanDerWaalsContact C-N 3.28Å; K234-E236 PolarHBondContact O-N 3.34Å; K234-E236 VanDerWaalsContact O-N 3.11Å
235	L	31.4	Very low	31.8	Very low	153 Å²	153	136.2 Å²	136.2	80%	0.801	76%	0.758	S	S	*	*			trans	-72.7	90.3	159	-165.3	74.6	0	0	0	106.5	I233 S237	I233-L235 PolarHBondContact O-N 2.76Å; I233-L235 VanDerWaalsContact O-N 3.17Å; L235-S237 VanDerWaalsContact C-N 3.35Å; L235-S237 PolarHBondContact O-N 3.44Å
236	E	27.9	Very low	31.9	Very low	176 Å²	176	140.3 Å²	140.3	82%	0.822	76%	0.764	S	S	*	*			trans	-67.7	97.4	171.2	-82	-179.8	164.6	0	0	108.9	K234	K234-E236 VanDerWaalsContact C-N 3.28Å; K234-E236 PolarHBondContact O-N 3.34Å; K234-E236 VanDerWaalsContact O-N 3.11Å
237	S	33.3	Very low	32.2	Very low	76 Å²	76	142 Å²	142	53%	0.531	77%	0.772	S	S	.	*	P	Polyproline II helix	trans	-99.4	139.8	156.8	-46	0	0	0	0	106.9	L235 I239	L235-S237 VanDerWaalsContact C-N 3.35Å; L235-S237 PolarHBondContact O-N 3.44Å; S237-I239 PolarHBondContact O-N 3.31Å
238	P	33.4	Very low	32.4	Very low	138 Å²	138	141.3 Å²	141.3	90%	0.896	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-65.1	122.7	-179.1	-14.4	28.3	0	0	0	110.6
239	I	31	Very low	32.4	Very low	167 Å²	167	142.3 Å²	142.3	86%	0.856	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-70.3	130.6	-178.2	-72.3	167.3	0	0	0	110.8	S237	S237-I239 PolarHBondContact O-N 3.31Å
240	S	34.4	Very low	33	Very low	110 Å²	110	147 Å²	147	77%	0.769	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-70.5	137.7	162.5	-179.2	0	0	0	0	110.4
241	G	28	Very low	33.4	Very low	54 Å²	54	146.8 Å²	146.8	56%	0.557	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-77.1	173.6	175.6	0	0	0	0	0	114.5
242	Y	34	Very low	34.1	Very low	231 Å²	231	146.5 Å²	146.5	91%	0.906	79%	0.791	S	S	*	*			trans	106.6	89.2	168.2	-56.7	-70.8	0	0	0	117.4
243	I	33.4	Very low	34.4	Very low	140 Å²	140	149.1 Å²	149.1	72%	0.718	79%	0.793	S	S	*	*			trans	-34.7	155.9	149.6	40	169.4	0	0	0	118.8
244	N	31.1	Very low	34.7	Very low	127 Å²	127	148.1 Å²	148.1	68%	0.679	80%	0.795	S	S	*	*			trans	86.8	136.9	154.1	-63.3	-10.1	0	0	0	117
245	E	36.9	Very low	35.2	Very low	174 Å²	174	145.6 Å²	145.6	81%	0.813	80%	0.8	S	S	*	*			cis	-164.1	161.9	15.2	-110.4	157.2	150.2	0	0	109.9
246	D	34.2	Very low	35.7	Very low	156 Å²	156	143.3 Å²	143.3	83%	0.834	79%	0.794	S	S	*	*			trans	-65	149.5	-177.8	-61.8	-63	0	0	0	115.7
247	V	43.5	Very low	36.3	Very low	150 Å²	150	144.9 Å²	144.9	91%	0.909	80%	0.801	S	S	*	*			trans	-154.4	126.9	151.1	-96.7	0	0	0	0	111.3
248	D	36.7	Very low	36.4	Very low	163 Å²	163	144.5 Å²	144.5	87%	0.872	81%	0.809	S	S	*	*			trans	-71.8	148.7	-176.2	-78.3	-58.5	0	0	0	116
249	A	33.9	Very low	36.6	Very low	92 Å²	92	145 Å²	145	76%	0.76	80%	0.804	S	S	*	*			trans	22.3	124.5	146.7	0	0	0	0	0	121.7
250	M	43.1	Very low	37.1	Very low	195 Å²	195	145.3 Å²	145.3	96%	0.961	80%	0.802	S	S	*	*				-156.3	135.7	128.1	-93.8	-152.7	159.3	0	0	111.8
251	D	36	Very low	37.5	Very low	136 Å²	136	148 Å²	148	73%	0.727	81%	0.807	S	S	*	*			trans	-90.3	135.4	-176.4	-169.6	15.5	0	0	0	110.6
252	H	43.6	Very low	38.1	Very low	189 Å²	189	150.9 Å²	150.9	88%	0.875	81%	0.814	S	S	*	*			trans	-154.8	116.4	159.4	-98.7	-51.4	0	0	0	112
253	Q	35.3	Very low	38.7	Very low	168 Å²	168	145.9 Å²	145.9	79%	0.785	81%	0.806	S	S	*	*			trans	-62	132.9	169.9	-66	164.1	6	0	0	112.1
254	T	39.4	Very low	39.4	Very low	141 Å²	141	145.9 Å²	145.9	87%	0.865	81%	0.805	S	S	*	*			trans	-157.6	119.8	138.3	45.5	0	0	0	0	111.5
255	S	38.5	Very low	40.7	Very low	122 Å²	122	150.3 Å²	150.3	85%	0.853	81%	0.812	S	S	*	*			trans	-4.4	158.9	162.2	-59	0	0	0	0	123.9
256	P	41.8	Very low	42.8	Very low	105 Å²	105	147.5 Å²	147.5	68%	0.682	80%	0.803	S	S	*	*			trans	-102.8	139.4	-159.7	36.9	-25.9	0	0	0	113.3
257	H	40.2	Very low	45.1	Very low	208 Å²	208	142.1 Å²	142.1	96%	0.963	78%	0.777	S	S	*	*			trans	-169.4	133	155	-82.7	-35.2	0	0	0	109.7
258	G	36.3	Very low	47.2	Very low	69 Å²	69	138.9 Å²	138.9	71%	0.711	75%	0.751	S	S	*	*			trans	142.5	91.9	158.8	0	0	0	0	0	116.5
259	N	37	Very low	49.9	Very low	147 Å²	147	134.4 Å²	134.4	79%	0.786	73%	0.733	S	S	*	*			trans	43.1	91.1	139.8	-61.2	-12.5	0	0	0	119.1
260	H	40.8	Very low	52.7	Low	175 Å²	175	130.3 Å²	130.3	81%	0.81	70%	0.698	S	S	*	*			trans	-100.5	20.2	164.3	-151.6	-66	0	0	0	113.5
261	L	44.1	Very low	55.1	Low	167 Å²	167	126.5 Å²	126.5	87%	0.874	68%	0.678	S	S	*	*			trans	-97.8	6	-175	-83.9	158.6	0	0	0	115.1
262	T	40.1	Very low	57.8	Low	114 Å²	114	121.9 Å²	121.9	70%	0.699	65%	0.651	S	S	*	*			trans	-107.6	2.4	-169.7	20.1	0	0	0	0	116.6
263	V	46.2	Very low	60	Low	125 Å²	125	117.1 Å²	117.1	76%	0.758	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.6	43.2	-179.2	-160.8	0	0	0	0	112.5
264	M	49.7	Very low	62.6	Low	141 Å²	141	113 Å²	113	70%	0.695	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.6	-2.3	172.1	-69.7	-162.8	96	0	0	114.2	L148 D266	L148-M264 HydrophobicContact CD1-CE 3.65Å; M264-D266 VanDerWaalsContact C-N 3.3Å; M264-D266 PolarHBondContact O-N 2.78Å
265	R	58.2	Low	65.1	Low	219 Å²	219	107.3 Å²	107.3	83%	0.826	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-16.1	-176	-81.6	-174.5	173.8	170.5	-0.8	114.5	K151	K151-R265 PolarHBondContact NZ-O 3.39Å
266	D	79.6	Confident	67.7	Low	116 Å²	116	106.7 Å²	106.7	62%	0.62	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.8	32.9	-172.1	-61.1	-32	0	0	0	113.6	K151 M264	K151-D266 WeakPolarHBondContact CB-O 3.27Å; K151-D266 WeakPolarHBondContact CG-O 3.42Å; K151-D266 PolarHBondContact N-O 3.18Å; M264-D266 VanDerWaalsContact C-N 3.3Å; M264-D266 PolarHBondContact O-N 2.78Å
267	C	84.1	Confident	70.2	Confident	43 Å²	43	106 Å²	106	29%	0.291	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-122.3	148.8	172.6	-62.7	0	0	0	0	111.9	L148 V149	L148-C267 HydrophobicContact CB-CB 4.2Å; V149-C267 CarbonylContact O-C 3.58Å; V149-C267 WeakPolarHBondContact O-CA 3.29Å
268	F	87.3	Confident	72.9	Confident	81 Å²	81	96.8 Å²	96.8	36%	0.355	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	136.1	160.3	-62.6	-72.9	0	0	0	109.3	L148 V149 K151 Q459	L148-F268 CarbonylContact C-O 3.46Å; L148-F268 WeakPolarHBondContact CA-O 3.21Å; V149-F268 HydrophobicContact CB-CB 4.47Å; V149-F268 PolarHBondContact N-O 2.91Å; V149-F268 PolarHBondContact O-N 2.84Å; K151-F268 HydrophobicContact CB-CE2 4.3Å; K151-F268 HydrophobicContact CD-CE2 4.42Å; K151-F268 HydrophobicContact CD-CZ 4.27Å; K151-F268 HydrophobicContact CG-CD2 3.8Å; K151-F268 HydrophobicContact CG-CE1 4.42Å; K151-F268 HydrophobicContact CG-CE2 3.52Å; K151-F268 HydrophobicContact CG-CG 4.39Å; K151-F268 HydrophobicContact CG-CZ 3.85Å; F268-Q459 HydrophobicContact CB-CB 4.45Å; F268-Q459 HydrophobicContact CB-CG 4.17Å; F268-Q459 HydrophobicContact CD2-CB 4.03Å; F268-Q459 HydrophobicContact CD2-CG 4.34Å; F268-Q459 HydrophobicContact CG-CB 4.46Å; F268-Q459 HydrophobicContact CG-CG 4.32Å
269	S	91.8	Very high	75.8	Confident	70 Å²	70	93.5 Å²	93.5	49%	0.49	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	121.7	172.3	-176.1	0	0	0	0	109.3	A146	A146-S269 WeakPolarHBondContact CB-OG 3.4Å
270	V	92.8	Very high	78.7	Confident	6 Å²	6	87.2 Å²	87.2	4%	0.036	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	104.2	-179.4	-173.9	0	0	0	0	109.8	I147 V149 W452 R455 V456 Q459	I147-V270 PolarHBondContact N-O 2.86Å; I147-V270 PolarHBondContact O-N 2.88Å; V149-V270 HydrophobicContact CG2-CG2 4.11Å; V270-W452 PolarHBondContact O-NE1 2.96Å; V270-R455 HydrophobicContact CG1-CB 3.51Å; V270-V456 HydrophobicContact CB-CG2 4.02Å; V270-V456 HydrophobicContact CG1-CG2 3.95Å; V270-V456 HydrophobicContact CG2-CG2 4.31Å; V270-Q459 HydrophobicContact CG2-CG 4.09Å
271	E	93.7	Very high	81.4	Confident	115 Å²	115	78.9 Å²	78.9	54%	0.537	41%	0.406	S	S	.	.			trans	-83.7	141.8	-179	-67.9	177	-176.3	0	0	112.8	A146 H273	A146-E271 HydrophobicContact CB-CG 4Å; E271-H273 PolarHBondContact O-ND1 3.09Å
272	Y	93.3	Very high	84	Confident	39 Å²	39	71.5 Å²	71.5	15%	0.153	37%	0.369	C	S	.	.			trans	-70.6	136.4	172.5	-178.9	-94	0	0	0	111	L144 E274 N391 W452	L144-Y272 HydrophobicContact CD1-CD1 3.77Å; L144-Y272 HydrophobicContact CD1-CD2 3.97Å; L144-Y272 HydrophobicContact CD1-CE1 4.13Å; L144-Y272 HydrophobicContact CD1-CE2 4.29Å; L144-Y272 HydrophobicContact CD1-CG 3.67Å; Y272-E274 HydrophobicContact CE1-CB 4.24Å; Y272-E274 VanDerWaalsContact CE1-OE2 3.27Å; Y272-E274 WeakPolarHBondContact CE1-OE2 3.23Å; Y272-E274 PolarHBondContact OH-OE1 2.8Å; Y272-E274 PolarHBondContact OH-OE2 2.92Å; Y272-N391 PolarHBondContact OH-ND2 2.9Å; Y272-W452 HydrophobicContact CD2-CB 3.94Å; Y272-W452 AromaticContact CD2-CD2 3.65Å; Y272-W452 HydrophobicContact CD2-CD2 3.65Å; Y272-W452 AromaticContact CD2-CE3 3.36Å; Y272-W452 HydrophobicContact CD2-CE3 3.36Å; Y272-W452 AromaticContact CD2-CG 3.95Å; Y272-W452 HydrophobicContact CD2-CG 3.95Å; Y272-W452 AromaticContact CD2-CZ3 3.95Å; Y272-W452 HydrophobicContact CD2-CZ3 3.95Å; Y272-W452 HydrophobicContact CE2-CE3 4.18Å; Y272-W452 HydrophobicContact CG-CD2 4.25Å; Y272-W452 HydrophobicContact CG-CE3 4.11Å; Y272-W452 HydrophobicContact CG-CZ3 4.38Å
273	H	90.1	Very high	86.8	Confident	89 Å²	89	66.1 Å²	66.1	41%	0.412	34%	0.336	S	S	.	.			trans	-128.7	130.5	174.8	-69.9	69.3	0	0	0	108.6	E271 P275 Q451 R455	E271-H273 PolarHBondContact O-ND1 3.09Å; H273-P275 WeakPolarHBondContact O-CD 3.33Å; H273-Q451 PolarHBondContact O-OE1 2.75Å; H273-R455 PolarHBondContact CE1-NH1 3.15Å; H273-R455 VanDerWaalsContact CE1-NH1 3.35Å; H273-R455 PolarHBondContact ND1-NH1 3.09Å
274	E	89	Confident	89.3	Confident	80 Å²	80	62.1 Å²	62.1	37%	0.374	31%	0.307	S	S	.	.			trans	-78.2	122.8	179.8	-167.5	69.4	-132.8	0	0	109.9	Y272 Y344	Y272-E274 HydrophobicContact CE1-CB 4.24Å; Y272-E274 VanDerWaalsContact CE1-OE2 3.27Å; Y272-E274 WeakPolarHBondContact CE1-OE2 3.23Å; Y272-E274 PolarHBondContact OH-OE1 2.8Å; Y272-E274 PolarHBondContact OH-OE2 2.92Å; E274-Y344 WeakPolarHBondContact OE1-CE1 3.49Å; E274-Y344 PolarHBondContact OE2-OH 2.8Å
275	P	93.1	Very high	91.7	Very high	22 Å²	22	55.6 Å²	55.6	14%	0.143	28%	0.275	C	S	.	.			trans	-75.6	158.8	178.4	31	-35.9	0	0	0	111.9	H273 F277 N447	H273-P275 WeakPolarHBondContact O-CD 3.33Å; P275-F277 WeakPolarHBondContact CG-O 3.21Å; P275-F277 PolarHBondContact O-N 2.73Å; P275-N447 HydrophobicContact CB-CB 4.35Å; P275-N447 HydrophobicContact CG-CB 3.77Å
276	P	92.2	Very high	93.6	Very high	110 Å²	110	48.4 Å²	48.4	71%	0.714	25%	0.252	S	S	*	.	S	Bend	trans	-62.5	-25.4	176.4	25	-34.7	0	0	0	113.6
277	F	95.6	Very high	94.4	Very high	90 Å²	90	49.1 Å²	49.1	40%	0.395	26%	0.255	S	S	.	.	S	Bend	trans	-117.9	112.1	172	-56.8	-82.6	0	0	0	108.5	P275 C279 H295 A296 N447	P275-F277 WeakPolarHBondContact CG-O 3.21Å; P275-F277 PolarHBondContact O-N 2.73Å; F277-C279 VanDerWaalsContact C-N 3.34Å; F277-H295 HydrophobicContact CB-CB 4.45Å; F277-H295 HydrophobicContact CD1-CB 3.68Å; F277-H295 HydrophobicContact CE1-CB 4.04Å; F277-H295 HydrophobicContact CG-CB 4.05Å; F277-A296 CarbonylContact C-O 3.56Å; F277-A296 WeakPolarHBondContact CA-O 3.38Å; F277-N447 VanDerWaalsContact O-CB 3.25Å; F277-N447 WeakPolarHBondContact O-CB 3.28Å; F277-N447 PolarHBondContact O-ND2 3.29Å
278	W	95.7	Very high	95.1	Very high	14 Å²	14	50.8 Å²	50.8	5%	0.053	26%	0.258	C	S	.	.	S	Bend	trans	-73.7	-27.8	-175.5	65.7	-87.6	0	0	0	112.3	A296 Q298 L301 F342 Y344 V349 F446 N447	W278-A296 HydrophobicContact CZ2-CB 4.11Å; W278-A296 PolarHBondContact N-O 2.98Å; W278-A296 VanDerWaalsContact N-O 3.1Å; W278-Q298 PolarHBondContact NE1-O 3.43Å; W278-L301 HydrophobicContact CZ2-CB 4.43Å; W278-F342 HydrophobicContact CH2-CB 3.98Å; W278-Y344 HydrophobicContact CB-CD1 4.16Å; W278-Y344 HydrophobicContact CD2-CG 4.38Å; W278-Y344 HydrophobicContact CE3-CG 4.31Å; W278-Y344 HydrophobicContact CG-CD1 4.34Å; W278-V349 HydrophobicContact CE3-CG2 4.34Å; W278-V349 HydrophobicContact CH2-CG1 4.15Å; W278-V349 HydrophobicContact CZ3-CG1 3.75Å; W278-V349 HydrophobicContact CZ3-CG2 3.97Å; W278-F446 HydrophobicContact CE3-CD1 4.28Å; W278-F446 HydrophobicContact CE3-CE1 4.41Å; W278-F446 HydrophobicContact CZ3-CD1 4.16Å; W278-F446 AromaticContact CZ3-CE1 3.83Å; W278-F446 HydrophobicContact CZ3-CE1 3.83Å; W278-N447 PolarHBondContact O-N 2.98Å
279	C	97.4	Very high	95.6	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	160.8	172.6	77.1	0	0	0	0	114.7	F277 A296 H445 F446	F277-C279 VanDerWaalsContact C-N 3.34Å; C279-A296 PolarHBondContact O-N 2.85Å; C279-A296 WeakPolarHBondContact SG-CB 3.3Å; C279-H445 CarbonylContact C-O 3.58Å; C279-H445 WeakPolarHBondContact CA-O 3.49Å; C279-H445 WeakPolarHBondContact CB-O 3.34Å; C279-F446 HydrophobicContact CB-CD1 3.83Å; C279-F446 HydrophobicContact CB-CE1 4.22Å
280	S	98.1	Very high	95.9	Very high	15 Å²	15	50 Å²	50	11%	0.105	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	136.1	169.6	-57	0	0	0	0	109.9	F294 H295 L444 H445 N447	S280-F294 CarbonylContact C-O 3.54Å; S280-F294 VanDerWaalsContact CA-O 3.29Å; S280-F294 WeakPolarHBondContact CA-O 3.48Å; S280-H295 PolarHBondContact OG-CD2 3.23Å; S280-L444 CarbonylContact O-C 3.59Å; S280-L444 WeakPolarHBondContact O-CA 3.23Å; S280-H445 PolarHBondContact N-O 3.35Å; S280-H445 PolarHBondContact O-N 2.91Å; S280-N447 PolarHBondContact OG-ND2 2.86Å
281	V	98.6	Very high	96.1	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	122.5	-173	-172.4	0	0	0	0	109.9	A293 F294 L301 V303 F315 I442 E443 L444	V281-A293 WeakPolarHBondContact O-CA 3.35Å; V281-F294 HydrophobicContact CB-CB 4.45Å; V281-F294 PolarHBondContact N-O 3.41Å; V281-F294 PolarHBondContact O-N 2.9Å; V281-L301 HydrophobicContact CG2-CD2 3.69Å; V281-V303 HydrophobicContact CG1-CG2 4.42Å; V281-F315 HydrophobicContact CB-CD1 4.11Å; V281-F315 HydrophobicContact CB-CE1 4.25Å; V281-F315 HydrophobicContact CG1-CD1 3.9Å; V281-F315 HydrophobicContact CG1-CE1 3.98Å; V281-I442 HydrophobicContact CG1-CB 3.83Å; V281-I442 HydrophobicContact CG1-CD1 3.95Å; V281-I442 HydrophobicContact CG1-CG1 4.43Å; V281-I442 HydrophobicContact CG1-CG2 4.03Å; V281-E443 WeakPolarHBondContact CA-O 3.46Å; V281-L444 HydrophobicContact CG2-CD2 4.17Å; V281-L444 HydrophobicContact CG2-CG 4.18Å
282	S	98.7	Very high	96.2	Very high	13 Å²	13	54.3 Å²	54.3	9%	0.091	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	133.9	173.6	-69.9	0	0	0	0	110.8	R289 I442 E443	S282-R289 PolarHBondContact OG-NH2 2.83Å; S282-R289 VanDerWaalsContact OG-NH2 3.09Å; S282-I442 CarbonylContact O-C 3.51Å; S282-I442 WeakPolarHBondContact O-CA 3.26Å; S282-E443 PolarHBondContact N-O 3.38Å; S282-E443 PolarHBondContact O-N 3.38Å
283	Y	98.7	Very high	96.3	Very high	1 Å²	1	53.6 Å²	53.6	0%	0.004	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	142.1	178.2	174.9	-120.2	0	0	0	112.1	E285 V290 L317 L320 R333 C440 W441 I442	Y283-E285 HydrophobicContact CE1-CG 3.7Å; Y283-E285 WeakPolarHBondContact OH-CG 3.24Å; Y283-E285 PolarHBondContact OH-OE1 2.83Å; Y283-V290 HydrophobicContact CD1-CB 3.75Å; Y283-V290 HydrophobicContact CD1-CG1 4.02Å; Y283-V290 HydrophobicContact CE1-CB 4.03Å; Y283-V290 HydrophobicContact CE1-CG1 4.07Å; Y283-V290 PolarHBondContact O-N 3.35Å; Y283-L317 HydrophobicContact CD1-CD2 4.14Å; Y283-L317 HydrophobicContact CD2-CD1 3.75Å; Y283-L317 HydrophobicContact CD2-CD2 3.9Å; Y283-L317 HydrophobicContact CD2-CG 4.38Å; Y283-L317 HydrophobicContact CE2-CD1 3.78Å; Y283-L317 HydrophobicContact CG-CD1 4.38Å; Y283-L317 HydrophobicContact CG-CD2 3.68Å; Y283-L320 HydrophobicContact CD1-CD1 3.56Å; Y283-L320 HydrophobicContact CE1-CD1 4.28Å; Y283-L320 HydrophobicContact CG-CD1 4.24Å; Y283-R333 PolarHBondContact OH-NH1 2.9Å; Y283-R333 VanDerWaalsContact OH-NH1 3.11Å; Y283-C440 HydrophobicContact CE2-CB 4.07Å; Y283-C440 PolarHBondContact OH-SG 3.25Å; Y283-C440 VanDerWaalsContact OH-SG 3.33Å; Y283-W441 VanDerWaalsContact CD2-O 3.25Å; Y283-W441 WeakPolarHBondContact CD2-O 3.17Å; Y283-I442 HydrophobicContact CD2-CG2 3.95Å
284	Y	98.8	Very high	96.7	Very high	40 Å²	40	51.2 Å²	51.2	16%	0.157	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	142.6	-179.5	-65.6	-96.9	0	0	0	111.3	K288 R289 W441 E443	Y284-K288 CarbonylContact C-O 3.51Å; Y284-K288 VanDerWaalsContact CA-O 3.26Å; Y284-K288 WeakPolarHBondContact CA-O 3.15Å; Y284-R289 VanDerWaalsContact CD1-CA 3.5Å; Y284-R289 HydrophobicContact CD1-CB 3.88Å; Y284-R289 HydrophobicContact CD1-CG 4.41Å; Y284-R289 HydrophobicContact CE1-CB 3.61Å; Y284-R289 HydrophobicContact CE1-CG 4.01Å; Y284-W441 VanDerWaalsContact CB-CZ2 3.49Å; Y284-W441 AromaticContact CD1-CH2 4Å; Y284-W441 HydrophobicContact CD1-CH2 4Å; Y284-W441 AromaticContact CD1-CZ2 3.72Å; Y284-W441 HydrophobicContact CD1-CZ2 3.72Å; Y284-W441 HydrophobicContact CD2-CD2 4.19Å; Y284-W441 AromaticContact CD2-CE3 3.94Å; Y284-W441 HydrophobicContact CD2-CE3 3.94Å; Y284-W441 AromaticContact CD2-CH2 3.53Å; Y284-W441 HydrophobicContact CD2-CH2 3.53Å; Y284-W441 AromaticContact CD2-CZ2 3.79Å; Y284-W441 HydrophobicContact CD2-CZ2 3.79Å; Y284-W441 AromaticContact CD2-CZ3 3.63Å; Y284-W441 HydrophobicContact CD2-CZ3 3.63Å; Y284-W441 HydrophobicContact CE1-CH2 4.25Å; Y284-W441 HydrophobicContact CE1-CZ2 4.37Å; Y284-W441 AromaticContact CE2-CH2 3.8Å; Y284-W441 HydrophobicContact CE2-CH2 3.8Å; Y284-W441 HydrophobicContact CE2-CZ2 4.41Å; Y284-W441 AromaticContact CE2-CZ3 3.94Å; Y284-W441 HydrophobicContact CE2-CZ3 3.94Å; Y284-W441 HydrophobicContact CG-CD2 4.19Å; Y284-W441 AromaticContact CG-CE2 3.7Å; Y284-W441 HydrophobicContact CG-CE3 4.38Å; Y284-W441 AromaticContact CG-CH2 3.65Å; Y284-W441 HydrophobicContact CG-CH2 3.65Å; Y284-W441 AromaticContact CG-CZ2 3.4Å; Y284-W441 HydrophobicContact CG-CZ2 3.4Å; Y284-W441 HydrophobicContact CG-CZ3 4.15Å; Y284-W441 PolarHBondContact N-O 3.47Å; Y284-W441 PolarHBondContact O-N 3.04Å; Y284-E443 HydrophobicContact CE2-CB 3.91Å; Y284-E443 PolarHBondContact OH-OE1 3.12Å
285	E	98.6	Very high	97.1	Very high	5 Å²	5	52 Å²	52	2%	0.023	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	111.7	166.9	-66.6	179.5	-177	0	0	107.5	Y283 N287 K288 V290 N322 R325 V329 R333 P439	Y283-E285 HydrophobicContact CE1-CG 3.7Å; Y283-E285 WeakPolarHBondContact OH-CG 3.24Å; Y283-E285 PolarHBondContact OH-OE1 2.83Å; E285-N287 PolarHBondContact O-N 2.83Å; E285-K288 PolarHBondContact N-O 2.82Å; E285-K288 PolarHBondContact O-N 3.46Å; E285-V290 HydrophobicContact CB-CG2 3.98Å; E285-V290 HydrophobicContact CG-CG2 3.86Å; E285-N322 WeakPolarHBondContact OE2-CB 3.4Å; E285-N322 PolarHBondContact OE2-ND2 3.35Å; E285-R325 IonicContact OE1-CZ 2.73Å; E285-R325 VanDerWaalsContact OE1-CZ 3.25Å; E285-R325 IonicContact OE1-NE 2.86Å; E285-R325 PolarHBondContact OE1-NE 2.85Å; E285-R325 IonicContact OE1-NH2 3.98Å; E285-R325 PolarHBondContact OE1-NH2 2.78Å; E285-R325 IonicContact OE2-CZ 3.39Å; E285-R325 IonicContact OE2-NE 3.35Å; E285-R325 PolarHBondContact OE2-NE 2.85Å; E285-R325 VanDerWaalsContact OE2-NE 3.08Å; E285-R325 IonicContact OE2-NH2 3.22Å; E285-V329 HydrophobicContact CB-CG1 4.02Å; E285-V329 VanDerWaalsContact CD-CG1 3.45Å; E285-V329 HydrophobicContact CG-CG1 3.68Å; E285-V329 WeakPolarHBondContact OE2-CG1 3.25Å; E285-R333 IonicContact OE1-CZ 2.65Å; E285-R333 IonicContact OE1-NE 3.92Å; E285-R333 IonicContact OE1-NH1 2.86Å; E285-R333 PolarHBondContact OE1-NH1 2.8Å; E285-P439 WeakPolarHBondContact CA-O 3.44Å
286	M	97.7	Very high	97.2	Very high	67 Å²	67	50.9 Å²	50.9	33%	0.33	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.4	-120	-170.5	-52	-69.9	-71.3	0	0	111.1	V329 T436 T438 W441	M286-V329 HydrophobicContact CG-CG2 4.15Å; M286-T436 CarbonylContact C-O 3.6Å; M286-T436 WeakPolarHBondContact CA-O 3.47Å; M286-T436 WeakPolarHBondContact CB-O 3.3Å; M286-T438 WeakPolarHBondContact CA-O 3.41Å; M286-T438 PolarHBondContact N-O 2.77Å; M286-W441 PolarHBondContact O-NE1 3.12Å
287	N	97.3	Very high	97.2	Very high	131 Å²	131	48.2 Å²	48.2	70%	0.701	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.9	6	177.1	65.3	-24.6	0	0	0	113.7	E285 T436	E285-N287 PolarHBondContact O-N 2.83Å; N287-T436 HydrophobicContact CB-CG2 4.17Å
288	K	98	Very high	97	Very high	79 Å²	79	46.6 Å²	46.6	34%	0.343	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	128.2	-174	-171.8	-178.3	-178.7	-174	0	110.9	Y284 E285 N322 T324	Y284-K288 CarbonylContact C-O 3.51Å; Y284-K288 VanDerWaalsContact CA-O 3.26Å; Y284-K288 WeakPolarHBondContact CA-O 3.15Å; E285-K288 PolarHBondContact N-O 2.82Å; E285-K288 PolarHBondContact O-N 3.46Å; K288-N322 PolarHBondContact NZ-OD1 2.83Å; K288-T324 WeakPolarHBondContact CD-OG1 3.46Å; K288-T324 PolarHBondContact NZ-OG1 3.24Å
289	R	98.1	Very high	96.8	Very high	129 Å²	129	47.4 Å²	47.4	49%	0.487	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	135.7	170.1	-167.7	176.6	-179.2	-162.1	3	110	S282 Y284	S282-R289 PolarHBondContact OG-NH2 2.83Å; S282-R289 VanDerWaalsContact OG-NH2 3.09Å; Y284-R289 VanDerWaalsContact CD1-CA 3.5Å; Y284-R289 HydrophobicContact CD1-CB 3.88Å; Y284-R289 HydrophobicContact CD1-CG 4.41Å; Y284-R289 HydrophobicContact CE1-CB 3.61Å; Y284-R289 HydrophobicContact CE1-CG 4.01Å
290	V	98.4	Very high	96.6	Very high	4 Å²	4	48.6 Å²	48.6	2%	0.024	25%	0.253	C	S	.	.			trans	-130.7	121.3	-176.8	178.3	0	0	0	0	109.6	Y283 E285 L320 N322	Y283-V290 HydrophobicContact CD1-CB 3.75Å; Y283-V290 HydrophobicContact CD1-CG1 4.02Å; Y283-V290 HydrophobicContact CE1-CB 4.03Å; Y283-V290 HydrophobicContact CE1-CG1 4.07Å; Y283-V290 PolarHBondContact O-N 3.35Å; E285-V290 HydrophobicContact CB-CG2 3.98Å; E285-V290 HydrophobicContact CG-CG2 3.86Å; V290-L320 HydrophobicContact CG1-CB 4.01Å; V290-N322 HydrophobicContact CG1-CB 4.08Å; V290-N322 HydrophobicContact CG2-CB 4.07Å
291	G	96.7	Very high	96.5	Very high	43 Å²	43	47.9 Å²	47.9	44%	0.443	25%	0.249	S	C	.	.	S	Bend	trans	80.6	-179.7	-177.3	0	0	0	0	0	114
292	E	95.7	Very high	96.5	Very high	170 Å²	170	49.2 Å²	49.2	79%	0.794	26%	0.256	S	S	*	.	P	Polyproline II helix	trans	-81.3	161.2	175.4	-62.5	-175.5	162.6	0	0	111.4
293	A	96.9	Very high	96.5	Very high	24 Å²	24	48.6 Å²	48.6	20%	0.198	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-69.7	133.2	169.8	0	0	0	0	0	110.3	V281 H295	V281-A293 WeakPolarHBondContact O-CA 3.35Å; A293-H295 PolarHBondContact O-CE1 3.27Å; A293-H295 PolarHBondContact O-ND1 3.13Å
294	F	97.1	Very high	96.5	Very high	38 Å²	38	48.7 Å²	48.7	17%	0.167	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	136.3	169.6	-172	-82.2	0	0	0	109.9	S280 V281 A296 L301 A312 F315	S280-F294 CarbonylContact C-O 3.54Å; S280-F294 VanDerWaalsContact CA-O 3.29Å; S280-F294 WeakPolarHBondContact CA-O 3.48Å; V281-F294 HydrophobicContact CB-CB 4.45Å; V281-F294 PolarHBondContact N-O 3.41Å; V281-F294 PolarHBondContact O-N 2.9Å; F294-A296 HydrophobicContact CE1-CB 4.28Å; F294-L301 HydrophobicContact CD1-CD1 3.84Å; F294-L301 HydrophobicContact CD1-CD2 3.83Å; F294-L301 HydrophobicContact CE1-CD1 3.31Å; F294-L301 HydrophobicContact CE1-CD2 4Å; F294-L301 HydrophobicContact CE1-CG 4.25Å; F294-L301 HydrophobicContact CZ-CD1 3.7Å; F294-A312 WeakPolarHBondContact CZ-O 3.46Å; F294-F315 HydrophobicContact CB-CB 4.11Å; F294-F315 HydrophobicContact CB-CD1 3.55Å; F294-F315 HydrophobicContact CB-CD2 3.98Å; F294-F315 HydrophobicContact CB-CE1 3.83Å; F294-F315 HydrophobicContact CB-CE2 4.23Å; F294-F315 HydrophobicContact CB-CG 3.63Å; F294-F315 HydrophobicContact CB-CZ 4.16Å; F294-F315 HydrophobicContact CD1-CB 4.33Å; F294-F315 HydrophobicContact CD2-CB 3.72Å; F294-F315 AromaticContact CD2-CD2 3.96Å; F294-F315 HydrophobicContact CD2-CD2 3.96Å; F294-F315 AromaticContact CD2-CG 3.89Å; F294-F315 HydrophobicContact CD2-CG 3.89Å; F294-F315 HydrophobicContact CE2-CB 4.2Å; F294-F315 HydrophobicContact CG-CB 3.78Å; F294-F315 HydrophobicContact CG-CD1 4.17Å; F294-F315 HydrophobicContact CG-CD2 4.27Å; F294-F315 AromaticContact CG-CG 3.85Å; F294-F315 HydrophobicContact CG-CG 3.85Å
295	H	97.2	Very high	96.5	Very high	96 Å²	96	47.6 Å²	47.6	44%	0.444	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	114.1	180	-59.4	80.6	0	0	0	109.6	F277 S280 A293 S297	F277-H295 HydrophobicContact CB-CB 4.45Å; F277-H295 HydrophobicContact CD1-CB 3.68Å; F277-H295 HydrophobicContact CE1-CB 4.04Å; F277-H295 HydrophobicContact CG-CB 4.05Å; S280-H295 PolarHBondContact OG-CD2 3.23Å; A293-H295 PolarHBondContact O-CE1 3.27Å; A293-H295 PolarHBondContact O-ND1 3.13Å; H295-S297 PolarHBondContact O-N 3.11Å
296	A	95.8	Very high	96.4	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	111.8	-173.7	0	0	0	0	0	111.2	F277 W278 C279 F294 L301	F277-A296 CarbonylContact C-O 3.56Å; F277-A296 WeakPolarHBondContact CA-O 3.38Å; W278-A296 HydrophobicContact CZ2-CB 4.11Å; W278-A296 PolarHBondContact N-O 2.98Å; W278-A296 VanDerWaalsContact N-O 3.1Å; C279-A296 PolarHBondContact O-N 2.85Å; C279-A296 WeakPolarHBondContact SG-CB 3.3Å; F294-A296 HydrophobicContact CE1-CB 4.28Å; A296-L301 HydrophobicContact CB-CB 4.29Å; A296-L301 HydrophobicContact CB-CD2 4.06Å
297	S	92.1	Very high	96.3	Very high	53 Å²	53	52.8 Å²	52.8	37%	0.371	28%	0.284	S	S	.	.			trans	-94.1	-33.2	172.6	56.1	0	0	0	0	112.5	H295	H295-S297 PolarHBondContact O-N 3.11Å
298	Q	91.9	Very high	96.2	Very high	56 Å²	56	48.6 Å²	48.6	26%	0.262	26%	0.262	S	S	.	.	S	Bend	trans	-76.6	144.4	175.1	-57.5	-52.6	-50.9	0	0	110.2	Q107 W278 S300 E313	Q107-Q298 VanDerWaalsContact OE1-OE1 3.05Å; W278-Q298 PolarHBondContact NE1-O 3.43Å; Q298-S300 PolarHBondContact O-N 2.93Å; Q298-E313 HydrophobicContact CB-CG 3.97Å; Q298-E313 HydrophobicContact CG-CG 3.74Å
299	P	91.1	Very high	95.8	Very high	32 Å²	32	49.7 Å²	49.7	21%	0.208	28%	0.277	C	S	.	.	S	Bend	trans	-63.1	-6.9	178.2	-15.9	31.1	0	0	0	114	Y343 Y344	P299-Y343 CarbonylContact O-C 3.55Å; P299-Y343 WeakPolarHBondContact O-CA 3.3Å; P299-Y344 PolarHBondContact O-N 3.08Å
300	S	93.8	Very high	95.4	Very high	24 Å²	24	48.5 Å²	48.5	17%	0.168	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	128.1	175.3	176.4	0	0	0	0	109.9	Q298 F342	Q298-S300 PolarHBondContact O-N 2.93Å; S300-F342 WeakPolarHBondContact CA-O 3.2Å
301	L	96.2	Very high	94.9	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.005	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	132.1	175.5	169.6	62	0	0	0	109.1	W278 V281 F294 A296 V303 E313 F315 R341 F342	W278-L301 HydrophobicContact CZ2-CB 4.43Å; V281-L301 HydrophobicContact CG2-CD2 3.69Å; F294-L301 HydrophobicContact CD1-CD1 3.84Å; F294-L301 HydrophobicContact CD1-CD2 3.83Å; F294-L301 HydrophobicContact CE1-CD1 3.31Å; F294-L301 HydrophobicContact CE1-CD2 4Å; F294-L301 HydrophobicContact CE1-CG 4.25Å; F294-L301 HydrophobicContact CZ-CD1 3.7Å; A296-L301 HydrophobicContact CB-CB 4.29Å; A296-L301 HydrophobicContact CB-CD2 4.06Å; L301-V303 HydrophobicContact CD2-CG2 4.15Å; L301-V303 HydrophobicContact CG-CG2 4.22Å; L301-E313 CarbonylContact C-O 3.53Å; L301-F315 HydrophobicContact CD1-CB 4.14Å; L301-R341 CarbonylContact O-C 3.59Å; L301-R341 WeakPolarHBondContact O-CA 3.48Å; L301-F342 PolarHBondContact N-O 3.02Å; L301-F342 PolarHBondContact O-N 3.38Å
302	T	98.1	Very high	94.5	Very high	27 Å²	27	51.5 Å²	51.5	17%	0.166	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	124.5	167.6	-54.2	0	0	0	0	109.8	D304 E313 R314 F315 A340 L354	T302-D304 HydrophobicContact CG2-CB 4.2Å; T302-E313 PolarHBondContact N-O 2.93Å; T302-R314 CarbonylContact O-C 3.56Å; T302-R314 VanDerWaalsContact O-CA 3.26Å; T302-R314 WeakPolarHBondContact O-CA 3.36Å; T302-F315 PolarHBondContact O-N 2.99Å; T302-A340 WeakPolarHBondContact CA-O 3.41Å; T302-L354 HydrophobicContact CG2-CD1 4.11Å
303	V	98.6	Very high	94.4	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	111.9	170.6	-174.7	0	0	0	0	107.6	V281 L301 F315 L317 G339 A340 F342 F422 I442	V281-V303 HydrophobicContact CG1-CG2 4.42Å; L301-V303 HydrophobicContact CD2-CG2 4.15Å; L301-V303 HydrophobicContact CG-CG2 4.22Å; V303-F315 WeakPolarHBondContact CA-O 3.41Å; V303-F315 HydrophobicContact CG1-CB 4.38Å; V303-F315 HydrophobicContact CG1-CD1 4.19Å; V303-F315 HydrophobicContact CG1-CG 4.49Å; V303-F315 HydrophobicContact CG2-CB 4.15Å; V303-F315 HydrophobicContact CG2-CD1 4.35Å; V303-L317 HydrophobicContact CG1-CD1 3.66Å; V303-L317 HydrophobicContact CG1-CD2 3.94Å; V303-L317 HydrophobicContact CG1-CG 3.75Å; V303-G339 CarbonylContact O-C 3.56Å; V303-G339 VanDerWaalsContact O-CA 3.27Å; V303-G339 WeakPolarHBondContact O-CA 3.2Å; V303-A340 PolarHBondContact N-O 3.04Å; V303-A340 PolarHBondContact O-N 3.08Å; V303-F342 HydrophobicContact CB-CE2 4.24Å; V303-F342 HydrophobicContact CG2-CD2 3.97Å; V303-F342 HydrophobicContact CG2-CE2 3.75Å; V303-F422 HydrophobicContact CB-CZ 4.19Å; V303-F422 HydrophobicContact CG1-CE2 4.37Å; V303-F422 HydrophobicContact CG1-CZ 3.86Å; V303-I442 HydrophobicContact CB-CD1 4.38Å; V303-I442 HydrophobicContact CG1-CD1 4.32Å; V303-I442 HydrophobicContact CG1-CG2 4.29Å; V303-I442 HydrophobicContact CG2-CD1 4.06Å
304	D	98.6	Very high	94.4	Very high	3 Å²	3	49.9 Å²	49.9	2%	0.016	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	169.7	-170.4	69.8	50.9	0	0	0	113.5	T302 F306 R314 F315 C316 L317 G337	T302-D304 HydrophobicContact CG2-CB 4.2Å; D304-F306 VanDerWaalsContact C-N 3.34Å; D304-F306 HydrophobicContact CB-CD2 4.02Å; D304-F306 WeakPolarHBondContact OD1-CB 3.08Å; D304-F306 PolarHBondContact OD1-N 2.88Å; D304-R314 IonicContact OD1-NH2 3.96Å; D304-R314 PolarHBondContact OD1-NH2 3.12Å; D304-R314 IonicContact OD2-CZ 2.58Å; D304-R314 VanDerWaalsContact OD2-CZ 3.22Å; D304-R314 IonicContact OD2-NE 2.78Å; D304-R314 PolarHBondContact OD2-NE 3.28Å; D304-R314 IonicContact OD2-NH2 2.81Å; D304-R314 PolarHBondContact OD2-NH2 3.24Å; D304-F315 PolarHBondContact N-O 3.36Å; D304-F315 VanDerWaalsContact N-O 3.08Å; D304-C316 PolarHBondContact OD1-SG 3.15Å; D304-L317 WeakPolarHBondContact O-CB 3.32Å; D304-L317 WeakPolarHBondContact O-CG 3.25Å; D304-L317 PolarHBondContact O-N 2.75Å; D304-G337 WeakPolarHBondContact CB-O 3.15Å
305	G	98.2	Very high	94.4	Very high	18 Å²	18	48.6 Å²	48.6	19%	0.186	28%	0.282	C	S	.	.	S	Bend	trans	-90.1	10.3	-178.7	0	0	0	0	0	114.4	G318 G337	G305-G318 WeakPolarHBondContact O-CA 3.36Å; G305-G337 PolarHBondContact N-O 2.8Å
306	F	97.5	Very high	94.4	Very high	97 Å²	97	44.1 Å²	44.1	43%	0.425	26%	0.261	S	S	.	.	S	Bend	trans	-91.9	-166.5	-178.5	-54.2	-60	0	0	0	111.4	D304 C316 G318 R338	D304-F306 VanDerWaalsContact C-N 3.34Å; D304-F306 HydrophobicContact CB-CD2 4.02Å; D304-F306 WeakPolarHBondContact OD1-CB 3.08Å; D304-F306 PolarHBondContact OD1-N 2.88Å; F306-C316 VanDerWaalsContact O-CB 3.28Å; F306-C316 WeakPolarHBondContact O-CB 3.2Å; F306-G318 WeakPolarHBondContact O-CA 3.3Å; F306-G318 PolarHBondContact O-N 2.77Å; F306-R338 HydrophobicContact CE2-CG 4.12Å; F306-R338 HydrophobicContact CZ-CG 4.34Å
307	C	96.2	Very high	94.5	Very high	83 Å²	83	44.1 Å²	44.1	56%	0.561	26%	0.261	S	S	*	.			trans	-132	32.1	-163.8	-54.7	0	0	0	0	114.6	P309 Q319	C307-P309 WeakPolarHBondContact O-CD 3.42Å; C307-Q319 HydrophobicContact CB-CB 4.16Å
308	D	93.9	Very high	94.8	Very high	43 Å²	43	42.8 Å²	42.8	23%	0.23	26%	0.256	C	S	.	.			trans	-85.2	115.1	175.3	-177.2	-7.6	0	0	0	110.4	S310 N311 R314 C316	D308-S310 PolarHBondContact OD1-N 3.36Å; D308-S310 PolarHBondContact OD1-OG 3.22Å; D308-N311 WeakPolarHBondContact OD2-CB 3.34Å; D308-R314 IonicContact OD2-NH1 3.21Å; D308-R314 PolarHBondContact OD2-NH1 3.37Å; D308-C316 PolarHBondContact N-SG 2.73Å; D308-C316 VanDerWaalsContact N-SG 3.37Å; D308-C316 VanDerWaalsContact O-CB 3.3Å; D308-C316 WeakPolarHBondContact O-CB 3.42Å; D308-C316 PolarHBondContact O-SG 3.46Å
309	P	90.4	Very high	94.9	Very high	102 Å²	102	43.6 Å²	43.6	66%	0.662	26%	0.26	S	S	*	.	S	Bend	trans	-78.6	-17.1	-177.4	29.5	-34.4	0	0	0	114.5	C307 Q319	C307-P309 WeakPolarHBondContact O-CD 3.42Å; P309-Q319 VanDerWaalsContact CA-OE1 3.23Å; P309-Q319 VanDerWaalsContact CB-OE1 3.22Å
310	S	88.8	Confident	95.2	Very high	104 Å²	104	43.3 Å²	43.3	73%	0.727	26%	0.256	S	S	*	.	S	Bend	trans	-116.3	-1.9	-155.2	63	0	0	0	0	114.8	D308	D308-S310 PolarHBondContact OD1-N 3.36Å; D308-S310 PolarHBondContact OD1-OG 3.22Å
311	N	88	Confident	95.3	Very high	55 Å²	55	47.2 Å²	47.2	29%	0.294	28%	0.284	S	S	.	.			trans	-92.2	116.5	-171.5	-172.2	-35.9	0	0	0	111.7	D308 E313 R314	D308-N311 WeakPolarHBondContact OD2-CB 3.34Å; N311-E313 PolarHBondContact O-N 3.42Å; N311-E313 VanDerWaalsContact O-N 3.14Å; N311-E313 WeakPolarHBondContact OD1-CA 3.29Å; N311-E313 WeakPolarHBondContact OD1-CB 3.39Å; N311-E313 PolarHBondContact OD1-N 3.06Å; N311-R314 HydrophobicContact CB-CB 4Å; N311-R314 HydrophobicContact CB-CG 4.29Å; N311-R314 WeakPolarHBondContact ND2-CD 3.24Å; N311-R314 PolarHBondContact O-N 2.91Å; N311-R314 PolarHBondContact OD1-N 2.94Å
312	A	89.1	Confident	95.3	Very high	56 Å²	56	48.2 Å²	48.2	46%	0.463	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-12.2	-179.4	0	0	0	0	0	114.7	F294	F294-A312 WeakPolarHBondContact CZ-O 3.46Å
313	E	92.8	Very high	95.2	Very high	94 Å²	94	53.9 Å²	53.9	44%	0.439	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	0	175.1	-63.3	178.5	-173.6	0	0	112.3	Q298 L301 T302 N311	Q298-E313 HydrophobicContact CB-CG 3.97Å; Q298-E313 HydrophobicContact CG-CG 3.74Å; L301-E313 CarbonylContact C-O 3.53Å; T302-E313 PolarHBondContact N-O 2.93Å; N311-E313 PolarHBondContact O-N 3.42Å; N311-E313 VanDerWaalsContact O-N 3.14Å; N311-E313 WeakPolarHBondContact OD1-CA 3.29Å; N311-E313 WeakPolarHBondContact OD1-CB 3.39Å; N311-E313 PolarHBondContact OD1-N 3.06Å
314	R	96.7	Very high	95.1	Very high	65 Å²	65	58 Å²	58	25%	0.245	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	118.5	-176.1	-59.1	177.3	62.2	-149.5	-0.6	112.6	T302 D304 D308 N311 C316	T302-R314 CarbonylContact O-C 3.56Å; T302-R314 VanDerWaalsContact O-CA 3.26Å; T302-R314 WeakPolarHBondContact O-CA 3.36Å; D304-R314 IonicContact OD1-NH2 3.96Å; D304-R314 PolarHBondContact OD1-NH2 3.12Å; D304-R314 IonicContact OD2-CZ 2.58Å; D304-R314 VanDerWaalsContact OD2-CZ 3.22Å; D304-R314 IonicContact OD2-NE 2.78Å; D304-R314 PolarHBondContact OD2-NE 3.28Å; D304-R314 IonicContact OD2-NH2 2.81Å; D304-R314 PolarHBondContact OD2-NH2 3.24Å; D308-R314 IonicContact OD2-NH1 3.21Å; D308-R314 PolarHBondContact OD2-NH1 3.37Å; N311-R314 HydrophobicContact CB-CB 4Å; N311-R314 HydrophobicContact CB-CG 4.29Å; N311-R314 WeakPolarHBondContact ND2-CD 3.24Å; N311-R314 PolarHBondContact O-N 2.91Å; N311-R314 PolarHBondContact OD1-N 2.94Å; R314-C316 PolarHBondContact NH2-SG 3.36Å; R314-C316 PolarHBondContact O-N 2.77Å
315	F	97.7	Very high	95	Very high	12 Å²	12	60.8 Å²	60.8	5%	0.053	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	92.6	166.3	-173.2	-166.1	0	0	0	109.6	V281 F294 L301 T302 V303 D304 L317 L320	V281-F315 HydrophobicContact CB-CD1 4.11Å; V281-F315 HydrophobicContact CB-CE1 4.25Å; V281-F315 HydrophobicContact CG1-CD1 3.9Å; V281-F315 HydrophobicContact CG1-CE1 3.98Å; F294-F315 HydrophobicContact CB-CB 4.11Å; F294-F315 HydrophobicContact CB-CD1 3.55Å; F294-F315 HydrophobicContact CB-CD2 3.98Å; F294-F315 HydrophobicContact CB-CE1 3.83Å; F294-F315 HydrophobicContact CB-CE2 4.23Å; F294-F315 HydrophobicContact CB-CG 3.63Å; F294-F315 HydrophobicContact CB-CZ 4.16Å; F294-F315 HydrophobicContact CD1-CB 4.33Å; F294-F315 HydrophobicContact CD2-CB 3.72Å; F294-F315 AromaticContact CD2-CD2 3.96Å; F294-F315 HydrophobicContact CD2-CD2 3.96Å; F294-F315 AromaticContact CD2-CG 3.89Å; F294-F315 HydrophobicContact CD2-CG 3.89Å; F294-F315 HydrophobicContact CE2-CB 4.2Å; F294-F315 HydrophobicContact CG-CB 3.78Å; F294-F315 HydrophobicContact CG-CD1 4.17Å; F294-F315 HydrophobicContact CG-CD2 4.27Å; F294-F315 AromaticContact CG-CG 3.85Å; F294-F315 HydrophobicContact CG-CG 3.85Å; L301-F315 HydrophobicContact CD1-CB 4.14Å; T302-F315 PolarHBondContact O-N 2.99Å; V303-F315 WeakPolarHBondContact CA-O 3.41Å; V303-F315 HydrophobicContact CG1-CB 4.38Å; V303-F315 HydrophobicContact CG1-CD1 4.19Å; V303-F315 HydrophobicContact CG1-CG 4.49Å; V303-F315 HydrophobicContact CG2-CB 4.15Å; V303-F315 HydrophobicContact CG2-CD1 4.35Å; D304-F315 PolarHBondContact N-O 3.36Å; D304-F315 VanDerWaalsContact N-O 3.08Å; F315-L317 HydrophobicContact CD1-CD2 4.08Å; F315-L317 HydrophobicContact CD2-CD2 4.16Å; F315-L317 HydrophobicContact CE1-CD2 3.92Å; F315-L317 HydrophobicContact CE2-CD2 4Å; F315-L317 HydrophobicContact CG-CD2 4.21Å; F315-L317 HydrophobicContact CZ-CD2 3.87Å; F315-L317 PolarHBondContact O-N 3.13Å; F315-L320 HydrophobicContact CE2-CD1 3.98Å; F315-L320 HydrophobicContact CZ-CD1 4.17Å
316	C	97.7	Very high	95	Very high	1 Å²	1	63.2 Å²	63.2	1%	0.007	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	107.4	-179.2	-75.3	0	0	0	0	111.4	D304 F306 D308 R314 Q319	D304-C316 PolarHBondContact OD1-SG 3.15Å; F306-C316 VanDerWaalsContact O-CB 3.28Å; F306-C316 WeakPolarHBondContact O-CB 3.2Å; D308-C316 PolarHBondContact N-SG 2.73Å; D308-C316 VanDerWaalsContact N-SG 3.37Å; D308-C316 VanDerWaalsContact O-CB 3.3Å; D308-C316 WeakPolarHBondContact O-CB 3.42Å; D308-C316 PolarHBondContact O-SG 3.46Å; R314-C316 PolarHBondContact NH2-SG 3.36Å; R314-C316 PolarHBondContact O-N 2.77Å; C316-Q319 HydrophobicContact CB-CG 4.41Å; C316-Q319 WeakPolarHBondContact O-CG 3.3Å; C316-Q319 PolarHBondContact O-NE2 2.76Å
317	L	98.1	Very high	95	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	38%	0.377	C	S	.	.			trans	-78	-23.4	-179.5	-55.5	-178.2	0	0	0	112.4	Y283 V303 D304 F315 Q319 L320 R333 I336 F422	Y283-L317 HydrophobicContact CD1-CD2 4.14Å; Y283-L317 HydrophobicContact CD2-CD1 3.75Å; Y283-L317 HydrophobicContact CD2-CD2 3.9Å; Y283-L317 HydrophobicContact CD2-CG 4.38Å; Y283-L317 HydrophobicContact CE2-CD1 3.78Å; Y283-L317 HydrophobicContact CG-CD1 4.38Å; Y283-L317 HydrophobicContact CG-CD2 3.68Å; V303-L317 HydrophobicContact CG1-CD1 3.66Å; V303-L317 HydrophobicContact CG1-CD2 3.94Å; V303-L317 HydrophobicContact CG1-CG 3.75Å; D304-L317 WeakPolarHBondContact O-CB 3.32Å; D304-L317 WeakPolarHBondContact O-CG 3.25Å; D304-L317 PolarHBondContact O-N 2.75Å; F315-L317 HydrophobicContact CD1-CD2 4.08Å; F315-L317 HydrophobicContact CD2-CD2 4.16Å; F315-L317 HydrophobicContact CE1-CD2 3.92Å; F315-L317 HydrophobicContact CE2-CD2 4Å; F315-L317 HydrophobicContact CG-CD2 4.21Å; F315-L317 HydrophobicContact CZ-CD2 3.87Å; F315-L317 PolarHBondContact O-N 3.13Å; L317-Q319 VanDerWaalsContact C-N 3.3Å; L317-Q319 PolarHBondContact O-N 2.77Å; L317-L320 HydrophobicContact CD2-CD1 3.94Å; L317-L320 WeakPolarHBondContact O-CB 3.45Å; L317-L320 PolarHBondContact O-N 2.96Å; L317-L320 VanDerWaalsContact O-N 3.12Å; L317-R333 VanDerWaalsContact O-CZ 3.28Å; L317-R333 PolarHBondContact O-NH1 2.77Å; L317-R333 PolarHBondContact O-NH2 2.83Å; L317-I336 HydrophobicContact CD1-CD1 4.05Å; L317-F422 HydrophobicContact CD1-CE2 4Å; L317-F422 HydrophobicContact CD1-CZ 4.4Å
318	G	97.3	Very high	95	Very high	25 Å²	25	63 Å²	63	26%	0.258	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-33.5	-174.6	0	0	0	0	0	113.9	G305 F306 R333	G305-G318 WeakPolarHBondContact O-CA 3.36Å; F306-G318 WeakPolarHBondContact O-CA 3.3Å; F306-G318 PolarHBondContact O-N 2.77Å; G318-R333 VanDerWaalsContact C-NH2 3.3Å; G318-R333 VanDerWaalsContact CA-NH2 3.32Å; G318-R333 PolarHBondContact O-NH2 2.81Å
319	Q	95.2	Very high	95.2	Very high	74 Å²	74	61 Å²	61	35%	0.346	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-18	176.6	57.5	174.5	1.7	0	0	114.5	C307 P309 C316 L317 S321	C307-Q319 HydrophobicContact CB-CB 4.16Å; P309-Q319 VanDerWaalsContact CA-OE1 3.23Å; P309-Q319 VanDerWaalsContact CB-OE1 3.22Å; C316-Q319 HydrophobicContact CB-CG 4.41Å; C316-Q319 WeakPolarHBondContact O-CG 3.3Å; C316-Q319 PolarHBondContact O-NE2 2.76Å; L317-Q319 VanDerWaalsContact C-N 3.3Å; L317-Q319 PolarHBondContact O-N 2.77Å; Q319-S321 PolarHBondContact O-N 2.88Å
320	L	96.9	Very high	95.5	Very high	25 Å²	25	60 Å²	60	13%	0.131	36%	0.359	C	S	.	.			trans	-70.9	127.9	-174.3	-58	178.5	0	0	0	110.4	Y283 V290 F315 L317 R325 R333	Y283-L320 HydrophobicContact CD1-CD1 3.56Å; Y283-L320 HydrophobicContact CE1-CD1 4.28Å; Y283-L320 HydrophobicContact CG-CD1 4.24Å; V290-L320 HydrophobicContact CG1-CB 4.01Å; F315-L320 HydrophobicContact CE2-CD1 3.98Å; F315-L320 HydrophobicContact CZ-CD1 4.17Å; L317-L320 HydrophobicContact CD2-CD1 3.94Å; L317-L320 WeakPolarHBondContact O-CB 3.45Å; L317-L320 PolarHBondContact O-N 2.96Å; L317-L320 VanDerWaalsContact O-N 3.12Å; L320-R325 PolarHBondContact O-NH2 3.09Å; L320-R333 PolarHBondContact O-NH2 3.17Å
321	S	96.2	Very high	96	Very high	107 Å²	107	59.1 Å²	59.1	75%	0.748	34%	0.343	S	S	*	.			trans	-90.8	142.7	179.5	-70.1	0	0	0	0	111.8	Q319	Q319-S321 PolarHBondContact O-N 2.88Å
322	N	96.4	Very high	96.4	Very high	21 Å²	21	56.6 Å²	56.6	11%	0.112	33%	0.33	C	S	.	.			trans	-147.1	112.9	170.1	-179.9	16.2	0	0	0	109.7	E285 K288 V290 T324 R325	E285-N322 WeakPolarHBondContact OE2-CB 3.4Å; E285-N322 PolarHBondContact OE2-ND2 3.35Å; K288-N322 PolarHBondContact NZ-OD1 2.83Å; V290-N322 HydrophobicContact CG1-CB 4.08Å; V290-N322 HydrophobicContact CG2-CB 4.07Å; N322-T324 PolarHBondContact O-N 3.24Å; N322-T324 PolarHBondContact OD1-N 2.98Å; N322-T324 PolarHBondContact OD1-OG1 3.34Å; N322-R325 HydrophobicContact CB-CB 4.24Å; N322-R325 VanDerWaalsContact O-CB 3.22Å; N322-R325 WeakPolarHBondContact O-CB 3.35Å; N322-R325 PolarHBondContact O-N 3.45Å
323	V	95.9	Very high	96.9	Very high	146 Å²	146	55.2 Å²	55.2	89%	0.885	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-20.5	-177.4	-61.3	0	0	0	0	113.5
324	T	94.9	Very high	97.1	Very high	87 Å²	87	57.3 Å²	57.3	53%	0.534	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	19.3	179.3	63.8	0	0	0	0	112.4	K288 N322 T326	K288-T324 WeakPolarHBondContact CD-OG1 3.46Å; K288-T324 PolarHBondContact NZ-OG1 3.24Å; N322-T324 PolarHBondContact O-N 3.24Å; N322-T324 PolarHBondContact OD1-N 2.98Å; N322-T324 PolarHBondContact OD1-OG1 3.34Å; T324-T326 PolarHBondContact O-N 3.07Å
325	R	97.3	Very high	97.2	Very high	62 Å²	62	56.7 Å²	56.7	23%	0.234	32%	0.32	C	S	.	.			trans	-70.1	126.7	-176.1	-173	178	-71	143	-1.5	111.1	E285 L320 N322 V329 I330	E285-R325 IonicContact OE1-CZ 2.73Å; E285-R325 VanDerWaalsContact OE1-CZ 3.25Å; E285-R325 IonicContact OE1-NE 2.86Å; E285-R325 PolarHBondContact OE1-NE 2.85Å; E285-R325 IonicContact OE1-NH2 3.98Å; E285-R325 PolarHBondContact OE1-NH2 2.78Å; E285-R325 IonicContact OE2-CZ 3.39Å; E285-R325 IonicContact OE2-NE 3.35Å; E285-R325 PolarHBondContact OE2-NE 2.85Å; E285-R325 VanDerWaalsContact OE2-NE 3.08Å; E285-R325 IonicContact OE2-NH2 3.22Å; L320-R325 PolarHBondContact O-NH2 3.09Å; N322-R325 HydrophobicContact CB-CB 4.24Å; N322-R325 VanDerWaalsContact O-CB 3.22Å; N322-R325 WeakPolarHBondContact O-CB 3.35Å; N322-R325 PolarHBondContact O-N 3.45Å; R325-V329 HydrophobicContact CG-CB 3.79Å; R325-V329 HydrophobicContact CG-CG1 3.65Å; R325-I330 HydrophobicContact CG-CG1 3.81Å
326	T	97.3	Very high	97.2	Very high	69 Å²	69	56.1 Å²	56.1	42%	0.423	32%	0.317	S	S	.	.			trans	-88.2	162.6	179.5	66.4	0	0	0	0	112	T324 N328 V329 I330	T324-T326 PolarHBondContact O-N 3.07Å; T326-N328 VanDerWaalsContact C-N 3.27Å; T326-N328 PolarHBondContact O-N 3.39Å; T326-V329 WeakPolarHBondContact O-CB 3.36Å; T326-V329 PolarHBondContact O-N 3.17Å; T326-V329 WeakPolarHBondContact OG1-CG2 2.85Å; T326-I330 PolarHBondContact O-N 3.18Å
327	G	97.6	Very high	97.2	Very high	54 Å²	54	57.2 Å²	57.2	56%	0.557	33%	0.328	S	S	*	.	H	α-helix	trans	-55.7	-38.9	177.7	0	0	0	0	0	113.7	V329 I330 E331	G327-V329 VanDerWaalsContact C-N 3.28Å; G327-V329 PolarHBondContact O-N 2.97Å; G327-I330 PolarHBondContact O-N 2.89Å; G327-E331 PolarHBondContact O-N 3.48Å
328	N	96.3	Very high	97.2	Very high	122 Å²	122	64 Å²	64	65%	0.652	35%	0.354	S	S	*	.	H	α-helix	trans	-62	-35.1	176	-72.6	-22	0	0	0	112.8	T326 A332	T326-N328 VanDerWaalsContact C-N 3.27Å; T326-N328 PolarHBondContact O-N 3.39Å; N328-A332 WeakPolarHBondContact O-CB 3.45Å; N328-A332 PolarHBondContact O-N 3.06Å; N328-A332 VanDerWaalsContact O-N 3.12Å
329	V	98.2	Very high	97.3	Very high	1 Å²	1	62.9 Å²	62.9	1%	0.006	34%	0.342	C	S	.	.	H	α-helix	trans	-74.5	-42.8	177.2	177.9	0	0	0	0	110.7	E285 M286 R325 T326 G327 E331 A332 R333 P439	E285-V329 HydrophobicContact CB-CG1 4.02Å; E285-V329 VanDerWaalsContact CD-CG1 3.45Å; E285-V329 HydrophobicContact CG-CG1 3.68Å; E285-V329 WeakPolarHBondContact OE2-CG1 3.25Å; M286-V329 HydrophobicContact CG-CG2 4.15Å; R325-V329 HydrophobicContact CG-CB 3.79Å; R325-V329 HydrophobicContact CG-CG1 3.65Å; T326-V329 WeakPolarHBondContact O-CB 3.36Å; T326-V329 PolarHBondContact O-N 3.17Å; T326-V329 WeakPolarHBondContact OG1-CG2 2.85Å; G327-V329 VanDerWaalsContact C-N 3.28Å; G327-V329 PolarHBondContact O-N 2.97Å; V329-E331 VanDerWaalsContact C-N 3.26Å; V329-E331 PolarHBondContact O-N 3.37Å; V329-A332 PolarHBondContact O-N 2.75Å; V329-R333 HydrophobicContact CG1-CG 4.29Å; V329-R333 WeakPolarHBondContact O-CB 3.49Å; V329-R333 VanDerWaalsContact O-CG 3.26Å; V329-R333 WeakPolarHBondContact O-CG 3.37Å; V329-R333 PolarHBondContact O-N 2.81Å; V329-P439 HydrophobicContact CB-CB 4.37Å; V329-P439 HydrophobicContact CG2-CB 3.88Å
330	I	97.9	Very high	97.4	Very high	81 Å²	81	59.3 Å²	59.3	42%	0.415	33%	0.325	S	S	.	.	H	α-helix	trans	-55.4	-46.4	174.6	-65	172.2	0	0	0	110.1	R325 T326 G327 R333 K334	R325-I330 HydrophobicContact CG-CG1 3.81Å; T326-I330 PolarHBondContact O-N 3.18Å; G327-I330 PolarHBondContact O-N 2.89Å; I330-R333 PolarHBondContact O-N 3.13Å; I330-K334 PolarHBondContact O-N 2.88Å
331	E	97.6	Very high	97.5	Very high	85 Å²	85	60.7 Å²	60.7	40%	0.397	33%	0.329	S	S	.	.	H	α-helix	trans	-66.5	-43.8	-179.5	-166.1	58.1	-157.4	0	0	112.5	G327 V329 R333 K334 H335	G327-E331 PolarHBondContact O-N 3.48Å; V329-E331 VanDerWaalsContact C-N 3.26Å; V329-E331 PolarHBondContact O-N 3.37Å; E331-R333 VanDerWaalsContact C-N 3.32Å; E331-R333 PolarHBondContact O-N 2.66Å; E331-K334 WeakPolarHBondContact O-CB 3.5Å; E331-K334 PolarHBondContact O-N 3.09Å; E331-K334 IonicContact OE2-NZ 2.77Å; E331-K334 PolarHBondContact OE2-NZ 3.01Å; E331-H335 IonicContact OE1-CE1 3.96Å; E331-H335 IonicContact OE1-NE2 3.54Å
332	A	98	Very high	97.6	Very high	2 Å²	2	55.6 Å²	55.6	2%	0.017	29%	0.293	C	S	.	.	H	α-helix	trans	-61.7	-39.6	176.3	0	0	0	0	0	112.5	N328 V329 K334 H335 I336 P439	N328-A332 WeakPolarHBondContact O-CB 3.45Å; N328-A332 PolarHBondContact O-N 3.06Å; N328-A332 VanDerWaalsContact O-N 3.12Å; V329-A332 PolarHBondContact O-N 2.75Å; A332-K334 VanDerWaalsContact C-N 3.32Å; A332-K334 PolarHBondContact O-N 3.12Å; A332-H335 PolarHBondContact O-N 2.89Å; A332-H335 VanDerWaalsContact O-N 3.08Å; A332-I336 PolarHBondContact O-N 2.86Å; A332-P439 HydrophobicContact CB-CB 3.67Å; A332-P439 HydrophobicContact CB-CG 3.42Å; A332-P439 VanDerWaalsContact CB-CG 3.42Å
333	R	98.4	Very high	97.6	Very high	27 Å²	27	55.3 Å²	55.3	10%	0.102	29%	0.291	C	S	.	.	H	α-helix	trans	-60.4	-38	178.3	-74	170.3	60.9	80.4	2.2	112.7	Y283 E285 L317 G318 L320 V329 I330 E331 H335 I336 C440	Y283-R333 PolarHBondContact OH-NH1 2.9Å; Y283-R333 VanDerWaalsContact OH-NH1 3.11Å; E285-R333 IonicContact OE1-CZ 2.65Å; E285-R333 IonicContact OE1-NE 3.92Å; E285-R333 IonicContact OE1-NH1 2.86Å; E285-R333 PolarHBondContact OE1-NH1 2.8Å; L317-R333 VanDerWaalsContact O-CZ 3.28Å; L317-R333 PolarHBondContact O-NH1 2.77Å; L317-R333 PolarHBondContact O-NH2 2.83Å; G318-R333 VanDerWaalsContact C-NH2 3.3Å; G318-R333 VanDerWaalsContact CA-NH2 3.32Å; G318-R333 PolarHBondContact O-NH2 2.81Å; L320-R333 PolarHBondContact O-NH2 3.17Å; V329-R333 HydrophobicContact CG1-CG 4.29Å; V329-R333 WeakPolarHBondContact O-CB 3.49Å; V329-R333 VanDerWaalsContact O-CG 3.26Å; V329-R333 WeakPolarHBondContact O-CG 3.37Å; V329-R333 PolarHBondContact O-N 2.81Å; I330-R333 PolarHBondContact O-N 3.13Å; E331-R333 VanDerWaalsContact C-N 3.32Å; E331-R333 PolarHBondContact O-N 2.66Å; R333-H335 PolarHBondContact O-N 2.86Å; R333-I336 HydrophobicContact CG-CD1 4.44Å; R333-I336 PolarHBondContact O-N 3.32Å; R333-C440 VanDerWaalsContact CG-SG 3.53Å
334	K	97.8	Very high	97.5	Very high	138 Å²	138	49.5 Å²	49.5	60%	0.6	25%	0.253	S	S	*	.	H	α-helix	trans	-59.7	-30.6	175.8	-65.9	174.1	-170.1	164.9	0	112.6	I330 E331 A332	I330-K334 PolarHBondContact O-N 2.88Å; E331-K334 WeakPolarHBondContact O-CB 3.5Å; E331-K334 PolarHBondContact O-N 3.09Å; E331-K334 IonicContact OE2-NZ 2.77Å; E331-K334 PolarHBondContact OE2-NZ 3.01Å; A332-K334 VanDerWaalsContact C-N 3.32Å; A332-K334 PolarHBondContact O-N 3.12Å
335	H	98.3	Very high	97.4	Very high	51 Å²	51	46 Å²	46	24%	0.236	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-3.9	-176.8	-67.4	-31.5	0	0	0	114.4	E331 A332 R333 G337 S355 Y357 V423	E331-H335 IonicContact OE1-CE1 3.96Å; E331-H335 IonicContact OE1-NE2 3.54Å; A332-H335 PolarHBondContact O-N 2.89Å; A332-H335 VanDerWaalsContact O-N 3.08Å; R333-H335 PolarHBondContact O-N 2.86Å; H335-G337 VanDerWaalsContact C-N 3.35Å; H335-S355 PolarHBondContact O-OG 3.44Å; H335-Y357 HydrophobicContact CB-CD2 3.61Å; H335-Y357 HydrophobicContact CB-CE2 3.72Å; H335-Y357 HydrophobicContact CB-CG 4.05Å; H335-Y357 AromaticContact CD2-CZ 3.99Å; H335-Y357 AromaticContact CE1-CZ 3.87Å; H335-Y357 PolarHBondContact CE1-OH 3.2Å; H335-Y357 AromaticContact CG-CD2 3.99Å; H335-Y357 AromaticContact CG-CE2 3.57Å; H335-Y357 AromaticContact CG-CZ 3.71Å; H335-Y357 AromaticContact ND1-CE2 3.45Å; H335-Y357 WeakPolarHBondContact ND1-CE2 3.4Å; H335-Y357 AromaticContact ND1-CZ 3.63Å; H335-V423 HydrophobicContact CB-CG1 4.21Å; H335-V423 HydrophobicContact CB-CG2 3.66Å
336	I	98.6	Very high	96.9	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.005	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-47	173.9	-61.2	177	0	0	0	109.2	L317 A332 R333 R338 G339 S355 F422 C440	L317-I336 HydrophobicContact CD1-CD1 4.05Å; A332-I336 PolarHBondContact O-N 2.86Å; R333-I336 HydrophobicContact CG-CD1 4.44Å; R333-I336 PolarHBondContact O-N 3.32Å; I336-R338 PolarHBondContact O-N 2.8Å; I336-G339 VanDerWaalsContact O-CA 3.31Å; I336-G339 WeakPolarHBondContact O-CA 3.45Å; I336-G339 PolarHBondContact O-N 2.6Å; I336-S355 WeakPolarHBondContact O-CB 3.19Å; I336-S355 PolarHBondContact O-OG 2.74Å; I336-F422 HydrophobicContact CD1-CB 4.43Å; I336-F422 HydrophobicContact CD1-CG 4.4Å; I336-F422 HydrophobicContact CG1-CB 3.99Å; I336-F422 HydrophobicContact CG1-CD1 4.49Å; I336-F422 HydrophobicContact CG1-CG 4.2Å; I336-F422 HydrophobicContact CG2-CD1 3.98Å; I336-F422 HydrophobicContact CG2-CE1 4.2Å; I336-F422 HydrophobicContact CG2-CG 4.44Å; I336-C440 HydrophobicContact CD1-CB 4.21Å
337	G	97.9	Very high	96.7	Very high	23 Å²	23	40.4 Å²	40.4	24%	0.237	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	56	-125.9	178.4	0	0	0	0	0	111.4	D304 G305 H335 G339	D304-G337 WeakPolarHBondContact CB-O 3.15Å; G305-G337 PolarHBondContact N-O 2.8Å; H335-G337 VanDerWaalsContact C-N 3.35Å; G337-G339 PolarHBondContact O-N 2.92Å
338	R	97.8	Very high	96.6	Very high	144 Å²	144	39.9 Å²	39.9	54%	0.543	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-9.3	174.4	-59.7	-176.9	-62.7	-160.2	-5.1	114.2	F306 I336 L354 D356	F306-R338 HydrophobicContact CE2-CG 4.12Å; F306-R338 HydrophobicContact CZ-CG 4.34Å; I336-R338 PolarHBondContact O-N 2.8Å; R338-L354 HydrophobicContact CB-CB 3.69Å; R338-L354 PolarHBondContact NE-O 3.41Å; R338-L354 PolarHBondContact NH2-O 3.02Å; R338-D356 IonicContact NH2-OD1 2.8Å
339	G	98.4	Very high	96.7	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	16%	0.159	C	C	.	.			trans	62.9	-129.3	171.4	0	0	0	0	0	114.4	V303 I336 G337 L354 S355	V303-G339 CarbonylContact O-C 3.56Å; V303-G339 VanDerWaalsContact O-CA 3.27Å; V303-G339 WeakPolarHBondContact O-CA 3.2Å; I336-G339 VanDerWaalsContact O-CA 3.31Å; I336-G339 WeakPolarHBondContact O-CA 3.45Å; I336-G339 PolarHBondContact O-N 2.6Å; G337-G339 PolarHBondContact O-N 2.92Å; G339-L354 CarbonylContact O-C 3.46Å; G339-L354 WeakPolarHBondContact O-CA 3.45Å; G339-L354 PolarHBondContact O-N 2.7Å; G339-S355 PolarHBondContact O-N 2.78Å
340	A	98.7	Very high	96.6	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	138.4	-176.1	0	0	0	0	0	111.1	T302 V303 F342 E352 I359 F422	T302-A340 WeakPolarHBondContact CA-O 3.41Å; V303-A340 PolarHBondContact N-O 3.04Å; V303-A340 PolarHBondContact O-N 3.08Å; A340-F342 HydrophobicContact CB-CE2 3.81Å; A340-F342 HydrophobicContact CB-CZ 3.85Å; A340-E352 CarbonylContact C-O 3.57Å; A340-E352 VanDerWaalsContact CA-O 3.3Å; A340-E352 WeakPolarHBondContact CA-O 3.31Å; A340-I359 HydrophobicContact CB-CD1 3.73Å; A340-I359 HydrophobicContact CB-CG2 4.3Å; A340-F422 HydrophobicContact CB-CE1 3.94Å; A340-F422 HydrophobicContact CB-CZ 4.46Å
341	R	98.2	Very high	96.7	Very high	54 Å²	54	31.7 Å²	31.7	20%	0.204	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	129.3	171.5	177.8	168.3	63.9	-173.1	0.3	109.8	L301 Y343 A351 E352 L354	L301-R341 CarbonylContact O-C 3.59Å; L301-R341 WeakPolarHBondContact O-CA 3.48Å; R341-Y343 HydrophobicContact CG-CD1 4.3Å; R341-A351 CarbonylContact O-C 3.56Å; R341-A351 WeakPolarHBondContact O-CA 3.39Å; R341-E352 HydrophobicContact CB-CB 4.39Å; R341-E352 IonicContact CZ-OE1 2.67Å; R341-E352 IonicContact CZ-OE2 3.04Å; R341-E352 PolarHBondContact N-O 3.44Å; R341-E352 IonicContact NE-OE2 3.35Å; R341-E352 PolarHBondContact NE-OE2 3.3Å; R341-E352 IonicContact NH2-OE1 3.84Å; R341-E352 PolarHBondContact NH2-OE1 3.34Å; R341-E352 IonicContact NH2-OE2 3.91Å; R341-E352 PolarHBondContact NH2-OE2 2.91Å; R341-E352 PolarHBondContact O-N 3.21Å; R341-L354 HydrophobicContact CB-CD1 3.76Å; R341-L354 HydrophobicContact CB-CG 4.12Å
342	F	98.1	Very high	96.7	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	128.1	172.7	-56.4	-85.2	0	0	0	108.4	W278 S300 L301 V303 A340 F350 A351 I388 V420 I442 L444	W278-F342 HydrophobicContact CH2-CB 3.98Å; S300-F342 WeakPolarHBondContact CA-O 3.2Å; L301-F342 PolarHBondContact N-O 3.02Å; L301-F342 PolarHBondContact O-N 3.38Å; V303-F342 HydrophobicContact CB-CE2 4.24Å; V303-F342 HydrophobicContact CG2-CD2 3.97Å; V303-F342 HydrophobicContact CG2-CE2 3.75Å; A340-F342 HydrophobicContact CB-CE2 3.81Å; A340-F342 HydrophobicContact CB-CZ 3.85Å; F342-F350 VanDerWaalsContact CA-O 3.26Å; F342-F350 WeakPolarHBondContact CA-O 3.45Å; F342-A351 HydrophobicContact CD1-CB 3.88Å; F342-A351 HydrophobicContact CE1-CB 3.66Å; F342-I388 HydrophobicContact CD1-CD1 3.96Å; F342-I388 HydrophobicContact CE1-CD1 4.23Å; F342-V420 HydrophobicContact CE1-CG2 4.07Å; F342-V420 HydrophobicContact CZ-CB 4.49Å; F342-V420 HydrophobicContact CZ-CG1 4.45Å; F342-V420 HydrophobicContact CZ-CG2 4.13Å; F342-I442 HydrophobicContact CE2-CD1 3.68Å; F342-I442 HydrophobicContact CZ-CD1 3.69Å; F342-L444 HydrophobicContact CD1-CD2 3.7Å; F342-L444 HydrophobicContact CD2-CD2 4.22Å; F342-L444 HydrophobicContact CE1-CD1 4.15Å; F342-L444 HydrophobicContact CE1-CD2 3.89Å; F342-L444 HydrophobicContact CE2-CD2 4.4Å; F342-L444 HydrophobicContact CG-CD2 3.88Å; F342-L444 HydrophobicContact CZ-CD1 4.29Å; F342-L444 HydrophobicContact CZ-CD2 4.25Å
343	Y	95.9	Very high	96.7	Very high	14 Å²	14	29 Å²	29	6%	0.055	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	135.3	178	58.2	-87.6	0	0	0	111.6	H110 P299 R341 I345 V349 F350 E352	H110-Y343 HydrophobicContact CB-CD2 3.92Å; H110-Y343 HydrophobicContact CB-CE2 3.88Å; H110-Y343 AromaticContact CD2-CD1 3.62Å; H110-Y343 AromaticContact CD2-CD2 3.48Å; H110-Y343 VanDerWaalsContact CD2-CD2 3.48Å; H110-Y343 WeakPolarHBondContact CD2-CD2 3.17Å; H110-Y343 AromaticContact CD2-CE1 3.6Å; H110-Y343 AromaticContact CD2-CE2 3.46Å; H110-Y343 VanDerWaalsContact CD2-CE2 3.46Å; H110-Y343 WeakPolarHBondContact CD2-CE2 3.11Å; H110-Y343 AromaticContact CD2-CG 3.55Å; H110-Y343 AromaticContact CD2-CZ 3.52Å; H110-Y343 AromaticContact CE1-CE1 3.97Å; H110-Y343 AromaticContact CE1-CZ 3.63Å; H110-Y343 AromaticContact CG-CD2 3.8Å; H110-Y343 AromaticContact CG-CE2 3.54Å; H110-Y343 AromaticContact CG-CZ 3.86Å; H110-Y343 AromaticContact ND1-CE2 3.97Å; H110-Y343 AromaticContact ND1-CZ 3.95Å; H110-Y343 AromaticContact NE2-CD1 3.71Å; H110-Y343 AromaticContact NE2-CE1 3.3Å; H110-Y343 VanDerWaalsContact NE2-CE1 3.3Å; H110-Y343 WeakPolarHBondContact NE2-CE1 3.39Å; H110-Y343 AromaticContact NE2-CE2 3.84Å; H110-Y343 AromaticContact NE2-CZ 3.37Å; P299-Y343 CarbonylContact O-C 3.55Å; P299-Y343 WeakPolarHBondContact O-CA 3.3Å; R341-Y343 HydrophobicContact CG-CD1 4.3Å; Y343-I345 HydrophobicContact CD2-CG2 3.84Å; Y343-I345 HydrophobicContact CE2-CG2 4.05Å; Y343-V349 WeakPolarHBondContact O-CA 3.24Å; Y343-F350 HydrophobicContact CD1-CB 4.05Å; Y343-F350 HydrophobicContact CD2-CB 4.03Å; Y343-F350 AromaticContact CD2-CD2 3.91Å; Y343-F350 HydrophobicContact CD2-CD2 3.91Å; Y343-F350 HydrophobicContact CD2-CG 4.28Å; Y343-F350 HydrophobicContact CE1-CB 3.5Å; Y343-F350 VanDerWaalsContact CE1-CB 3.5Å; Y343-F350 HydrophobicContact CE1-CG 4.34Å; Y343-F350 HydrophobicContact CE2-CB 3.46Å; Y343-F350 VanDerWaalsContact CE2-CB 3.46Å; Y343-F350 HydrophobicContact CE2-CD1 4.37Å; Y343-F350 AromaticContact CE2-CD2 3.34Å; Y343-F350 HydrophobicContact CE2-CD2 3.34Å; Y343-F350 HydrophobicContact CE2-CE2 4.14Å; Y343-F350 AromaticContact CE2-CG 3.48Å; Y343-F350 HydrophobicContact CE2-CG 3.48Å; Y343-F350 VanDerWaalsContact CE2-CG 3.48Å; Y343-F350 HydrophobicContact CG-CB 4.3Å; Y343-F350 AromaticContact CZ-CD2 3.92Å; Y343-F350 AromaticContact CZ-CG 3.52Å; Y343-F350 PolarHBondContact N-O 2.63Å; Y343-F350 VanDerWaalsContact N-O 3.12Å; Y343-F350 PolarHBondContact O-N 3.41Å; Y343-F350 WeakPolarHBondContact OH-CB 3.3Å; Y343-F350 WeakPolarHBondContact OH-CG 3.47Å; Y343-E352 HydrophobicContact CE1-CB 4.28Å
344	Y	94.7	Very high	96.7	Very high	24 Å²	24	29.4 Å²	29.4	9%	0.094	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	124.2	177.4	179.6	-127.2	0	0	0	109.9	E274 W278 P299 E348 V349 N391	E274-Y344 WeakPolarHBondContact OE1-CE1 3.49Å; E274-Y344 PolarHBondContact OE2-OH 2.8Å; W278-Y344 HydrophobicContact CB-CD1 4.16Å; W278-Y344 HydrophobicContact CD2-CG 4.38Å; W278-Y344 HydrophobicContact CE3-CG 4.31Å; W278-Y344 HydrophobicContact CG-CD1 4.34Å; P299-Y344 PolarHBondContact O-N 3.08Å; Y344-E348 CarbonylContact C-O 3.47Å; Y344-E348 WeakPolarHBondContact CA-O 3.33Å; Y344-E348 WeakPolarHBondContact CD2-O 3.5Å; Y344-V349 HydrophobicContact CD2-CG2 3.79Å; Y344-N391 PolarHBondContact OH-ND2 3.43Å
345	I	91.7	Very high	96.8	Very high	14 Å²	14	23 Å²	23	7%	0.072	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	127.7	-175	178.4	172.2	0	0	0	110.9	H110 Q111 I139 Y343 G347 E348 F350	H110-I345 HydrophobicContact CB-CD1 4.03Å; H110-I345 WeakPolarHBondContact O-CD1 3.35Å; Q111-I345 HydrophobicContact CB-CD1 4.34Å; Q111-I345 HydrophobicContact CG-CD1 4.22Å; Q111-I345 HydrophobicContact CG-CG1 4.48Å; I139-I345 HydrophobicContact CB-CD1 4.13Å; I139-I345 HydrophobicContact CB-CG1 4.18Å; I139-I345 HydrophobicContact CD1-CD1 3.64Å; I139-I345 HydrophobicContact CD1-CG1 4.41Å; I139-I345 HydrophobicContact CG1-CD1 4.47Å; I139-I345 HydrophobicContact CG2-CD1 4.3Å; I139-I345 HydrophobicContact CG2-CG1 3.93Å; Y343-I345 HydrophobicContact CD2-CG2 3.84Å; Y343-I345 HydrophobicContact CE2-CG2 4.05Å; I345-G347 PolarHBondContact O-N 2.98Å; I345-E348 PolarHBondContact N-O 3.45Å; I345-E348 WeakPolarHBondContact O-CA 3.37Å; I345-E348 WeakPolarHBondContact O-CB 3.49Å; I345-E348 PolarHBondContact O-N 3.35Å; I345-F350 HydrophobicContact CG2-CD2 3.8Å; I345-F350 HydrophobicContact CG2-CE2 3.62Å
346	G	87.6	Confident	96.8	Very high	11 Å²	11	26.6 Å²	26.6	11%	0.113	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.6	29.8	171.3	0	0	0	0	0	113	N141 P142 E348	N141-G346 WeakPolarHBondContact OD1-CA 3.19Å; N141-G346 PolarHBondContact OD1-N 3.1Å; P142-G346 VanDerWaalsContact CD-C 3.41Å; P142-G346 WeakPolarHBondContact CD-O 3.46Å; G346-E348 VanDerWaalsContact C-N 3.27Å; G346-E348 PolarHBondContact O-N 3.44Å
347	G	92.3	Very high	96.8	Very high	3 Å²	3	31.4 Å²	31.4	3%	0.031	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.6	8.6	-172.1	0	0	0	0	0	114.9	N141 I345 N391	N141-G347 PolarHBondContact OD1-N 3.31Å; I345-G347 PolarHBondContact O-N 2.98Å; G347-N391 VanDerWaalsContact O-CB 3.3Å; G347-N391 WeakPolarHBondContact O-CB 3.22Å; G347-N391 VanDerWaalsContact O-CG 3.29Å; G347-N391 PolarHBondContact O-N 2.85Å
348	E	96.2	Very high	96.8	Very high	43 Å²	43	30.9 Å²	30.9	20%	0.201	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	145.1	-180	-50.3	-166.6	128.7	0	0	111.2	Y344 I345 G346 F350 K387 F389 N390	Y344-E348 CarbonylContact C-O 3.47Å; Y344-E348 WeakPolarHBondContact CA-O 3.33Å; Y344-E348 WeakPolarHBondContact CD2-O 3.5Å; I345-E348 PolarHBondContact N-O 3.45Å; I345-E348 WeakPolarHBondContact O-CA 3.37Å; I345-E348 WeakPolarHBondContact O-CB 3.49Å; I345-E348 PolarHBondContact O-N 3.35Å; G346-E348 VanDerWaalsContact C-N 3.27Å; G346-E348 PolarHBondContact O-N 3.44Å; E348-F350 HydrophobicContact CB-CD2 4.41Å; E348-F350 HydrophobicContact CB-CE2 3.71Å; E348-F350 HydrophobicContact CB-CZ 4.35Å; E348-F350 WeakPolarHBondContact OE2-CZ 3.32Å; E348-K387 VanDerWaalsContact CD-CE 3.47Å; E348-K387 VanDerWaalsContact OE1-CE 3.31Å; E348-K387 WeakPolarHBondContact OE1-CE 3.41Å; E348-K387 IonicContact OE1-NZ 3.51Å; E348-K387 PolarHBondContact OE1-NZ 3.23Å; E348-K387 WeakPolarHBondContact OE2-CE 3.45Å; E348-K387 IonicContact OE2-NZ 3.62Å; E348-K387 PolarHBondContact OE2-NZ 3.04Å; E348-F389 WeakPolarHBondContact CA-O 3.33Å; E348-N390 PolarHBondContact OE1-ND2 3.32Å
349	V	97.6	Very high	96.9	Very high	2 Å²	2	24.1 Å²	24.1	1%	0.012	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	132.4	173.8	-172.7	0	0	0	0	109.4	W278 Y343 Y344 K387 I388 F389 F446	W278-V349 HydrophobicContact CE3-CG2 4.34Å; W278-V349 HydrophobicContact CH2-CG1 4.15Å; W278-V349 HydrophobicContact CZ3-CG1 3.75Å; W278-V349 HydrophobicContact CZ3-CG2 3.97Å; Y343-V349 WeakPolarHBondContact O-CA 3.24Å; Y344-V349 HydrophobicContact CD2-CG2 3.79Å; V349-K387 CarbonylContact O-C 3.13Å; V349-I388 HydrophobicContact CB-CG1 4.03Å; V349-I388 HydrophobicContact CG1-CD1 3.83Å; V349-I388 HydrophobicContact CG1-CG1 3.83Å; V349-I388 VanDerWaalsContact O-CG1 3.32Å; V349-I388 WeakPolarHBondContact O-CG1 3.5Å; V349-I388 PolarHBondContact O-N 2.83Å; V349-F389 HydrophobicContact CB-CB 3.93Å; V349-F389 HydrophobicContact CG2-CB 4.13Å; V349-F389 PolarHBondContact N-O 3.17Å; V349-F389 PolarHBondContact O-N 3.49Å; V349-F389 VanDerWaalsContact O-N 3.14Å; V349-F446 HydrophobicContact CB-CE1 4.39Å; V349-F446 HydrophobicContact CB-CZ 4.08Å; V349-F446 HydrophobicContact CG1-CE1 4.01Å; V349-F446 HydrophobicContact CG1-CZ 3.91Å; V349-F446 HydrophobicContact CG2-CD1 4.44Å; V349-F446 HydrophobicContact CG2-CE1 4.02Å; V349-F446 HydrophobicContact CG2-CZ 4.04Å
350	F	98.1	Very high	96.9	Very high	30 Å²	30	24.6 Å²	24.6	13%	0.132	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	147.2	176.7	-64.1	-101.3	0	0	0	110.7	F342 Y343 I345 E348 L386 K387	F342-F350 VanDerWaalsContact CA-O 3.26Å; F342-F350 WeakPolarHBondContact CA-O 3.45Å; Y343-F350 HydrophobicContact CD1-CB 4.05Å; Y343-F350 HydrophobicContact CD2-CB 4.03Å; Y343-F350 AromaticContact CD2-CD2 3.91Å; Y343-F350 HydrophobicContact CD2-CD2 3.91Å; Y343-F350 HydrophobicContact CD2-CG 4.28Å; Y343-F350 HydrophobicContact CE1-CB 3.5Å; Y343-F350 VanDerWaalsContact CE1-CB 3.5Å; Y343-F350 HydrophobicContact CE1-CG 4.34Å; Y343-F350 HydrophobicContact CE2-CB 3.46Å; Y343-F350 VanDerWaalsContact CE2-CB 3.46Å; Y343-F350 HydrophobicContact CE2-CD1 4.37Å; Y343-F350 AromaticContact CE2-CD2 3.34Å; Y343-F350 HydrophobicContact CE2-CD2 3.34Å; Y343-F350 HydrophobicContact CE2-CE2 4.14Å; Y343-F350 AromaticContact CE2-CG 3.48Å; Y343-F350 HydrophobicContact CE2-CG 3.48Å; Y343-F350 VanDerWaalsContact CE2-CG 3.48Å; Y343-F350 HydrophobicContact CG-CB 4.3Å; Y343-F350 AromaticContact CZ-CD2 3.92Å; Y343-F350 AromaticContact CZ-CG 3.52Å; Y343-F350 PolarHBondContact N-O 2.63Å; Y343-F350 VanDerWaalsContact N-O 3.12Å; Y343-F350 PolarHBondContact O-N 3.41Å; Y343-F350 WeakPolarHBondContact OH-CB 3.3Å; Y343-F350 WeakPolarHBondContact OH-CG 3.47Å; I345-F350 HydrophobicContact CG2-CD2 3.8Å; I345-F350 HydrophobicContact CG2-CE2 3.62Å; E348-F350 HydrophobicContact CB-CD2 4.41Å; E348-F350 HydrophobicContact CB-CE2 3.71Å; E348-F350 HydrophobicContact CB-CZ 4.35Å; E348-F350 WeakPolarHBondContact OE2-CZ 3.32Å; F350-L386 CarbonylContact C-O 3.53Å; F350-L386 VanDerWaalsContact CA-O 3.27Å; F350-L386 WeakPolarHBondContact CA-O 3.38Å; F350-K387 HydrophobicContact CD1-CB 3.89Å; F350-K387 HydrophobicContact CD1-CG 4.39Å; F350-K387 HydrophobicContact CE1-CB 3.69Å; F350-K387 HydrophobicContact CE1-CG 4.03Å; F350-K387 HydrophobicContact CZ-CB 4.32Å; F350-K387 HydrophobicContact CZ-CD 4.4Å; F350-K387 HydrophobicContact CZ-CG 4.16Å
351	A	98.6	Very high	96.9	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	126.6	167.1	0	0	0	0	0	109.5	R341 F342 I359 N385 L386 I388	R341-A351 CarbonylContact O-C 3.56Å; R341-A351 WeakPolarHBondContact O-CA 3.39Å; F342-A351 HydrophobicContact CD1-CB 3.88Å; F342-A351 HydrophobicContact CE1-CB 3.66Å; A351-I359 HydrophobicContact CB-CD1 4.43Å; A351-N385 CarbonylContact O-C 3.55Å; A351-N385 WeakPolarHBondContact O-CA 3.45Å; A351-L386 PolarHBondContact N-O 2.91Å; A351-L386 PolarHBondContact O-N 3.42Å; A351-I388 HydrophobicContact CB-CD1 4.18Å; A351-I388 HydrophobicContact CB-CG2 3.63Å
352	E	98.4	Very high	96.9	Very high	31 Å²	31	23.4 Å²	23.4	15%	0.145	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	127.5	178.5	-179.5	-176.1	179.5	0	0	110	H110 A340 R341 Y343 L354 C384 N385	H110-E352 IonicContact NE2-OE2 3.56Å; A340-E352 CarbonylContact C-O 3.57Å; A340-E352 VanDerWaalsContact CA-O 3.3Å; A340-E352 WeakPolarHBondContact CA-O 3.31Å; R341-E352 HydrophobicContact CB-CB 4.39Å; R341-E352 IonicContact CZ-OE1 2.67Å; R341-E352 IonicContact CZ-OE2 3.04Å; R341-E352 PolarHBondContact N-O 3.44Å; R341-E352 IonicContact NE-OE2 3.35Å; R341-E352 PolarHBondContact NE-OE2 3.3Å; R341-E352 IonicContact NH2-OE1 3.84Å; R341-E352 PolarHBondContact NH2-OE1 3.34Å; R341-E352 IonicContact NH2-OE2 3.91Å; R341-E352 PolarHBondContact NH2-OE2 2.91Å; R341-E352 PolarHBondContact O-N 3.21Å; Y343-E352 HydrophobicContact CE1-CB 4.28Å; E352-L354 HydrophobicContact CG-CD2 3.98Å; E352-L354 PolarHBondContact O-N 2.94Å; E352-C384 WeakPolarHBondContact CA-O 3.41Å; E352-N385 HydrophobicContact CB-CB 3.93Å; E352-N385 HydrophobicContact CG-CB 4.17Å
353	C	98.6	Very high	96.9	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	106.2	179.9	-171.8	0	0	0	0	110.2	Y357 I359 V380 P381 G383 C384	C353-Y357 PolarHBondContact SG-O 3.45Å; C353-I359 HydrophobicContact CB-CD1 4.24Å; C353-I359 HydrophobicContact CB-CG1 4.16Å; C353-V380 HydrophobicContact CB-CG1 3.95Å; C353-P381 VanDerWaalsContact CB-O 3.24Å; C353-P381 WeakPolarHBondContact CB-O 3.49Å; C353-G383 PolarHBondContact O-N 3.07Å; C353-C384 PolarHBondContact N-O 3.43Å
354	L	98.2	Very high	97	Very high	35 Å²	35	23.7 Å²	23.7	18%	0.183	12%	0.119	C	C	.	.			trans	-92.5	-18.7	175.5	-57.3	-175.2	0	0	0	112.6	T302 R338 G339 R341 E352	T302-L354 HydrophobicContact CG2-CD1 4.11Å; R338-L354 HydrophobicContact CB-CB 3.69Å; R338-L354 PolarHBondContact NE-O 3.41Å; R338-L354 PolarHBondContact NH2-O 3.02Å; G339-L354 CarbonylContact O-C 3.46Å; G339-L354 WeakPolarHBondContact O-CA 3.45Å; G339-L354 PolarHBondContact O-N 2.7Å; R341-L354 HydrophobicContact CB-CD1 3.76Å; R341-L354 HydrophobicContact CB-CG 4.12Å; E352-L354 HydrophobicContact CG-CD2 3.98Å; E352-L354 PolarHBondContact O-N 2.94Å
355	S	98.5	Very high	97.2	Very high	4 Å²	4	22.7 Å²	22.7	3%	0.028	12%	0.115	C	C	.	.	S	Bend	trans	-65.3	151.3	173.6	-176.7	0	0	0	0	111.3	H335 I336 G339 Y357 P382	H335-S355 PolarHBondContact O-OG 3.44Å; I336-S355 WeakPolarHBondContact O-CB 3.19Å; I336-S355 PolarHBondContact O-OG 2.74Å; G339-S355 PolarHBondContact O-N 2.78Å; S355-Y357 VanDerWaalsContact CB-O 3.29Å; S355-Y357 WeakPolarHBondContact CB-O 3.41Å; S355-Y357 PolarHBondContact O-N 3.12Å; S355-Y357 PolarHBondContact OG-N 3.34Å; S355-Y357 PolarHBondContact OG-O 2.82Å; S355-P382 VanDerWaalsContact O-CB 3.31Å; S355-P382 WeakPolarHBondContact O-CB 3.29Å
356	D	98.4	Very high	97.5	Very high	125 Å²	125	22.1 Å²	22.1	67%	0.668	11%	0.112	S	C	*	.	S	Bend	trans	-73	-7.1	169.5	-54.8	-35.6	0	0	0	111.8	R338 P382	R338-D356 IonicContact NH2-OD1 2.8Å; D356-P382 VanDerWaalsContact C-CG 3.43Å; D356-P382 WeakPolarHBondContact O-CG 3.3Å
357	Y	98.5	Very high	98	Very high	103 Å²	103	21.6 Å²	21.6	40%	0.404	11%	0.107	S	C	.	.	S	Bend	trans	-115.5	144.7	174.3	-67.5	-95.8	0	0	0	110.5	H335 C353 S355 V423	H335-Y357 HydrophobicContact CB-CD2 3.61Å; H335-Y357 HydrophobicContact CB-CE2 3.72Å; H335-Y357 HydrophobicContact CB-CG 4.05Å; H335-Y357 AromaticContact CD2-CZ 3.99Å; H335-Y357 AromaticContact CE1-CZ 3.87Å; H335-Y357 PolarHBondContact CE1-OH 3.2Å; H335-Y357 AromaticContact CG-CD2 3.99Å; H335-Y357 AromaticContact CG-CE2 3.57Å; H335-Y357 AromaticContact CG-CZ 3.71Å; H335-Y357 AromaticContact ND1-CE2 3.45Å; H335-Y357 WeakPolarHBondContact ND1-CE2 3.4Å; H335-Y357 AromaticContact ND1-CZ 3.63Å; C353-Y357 PolarHBondContact SG-O 3.45Å; S355-Y357 VanDerWaalsContact CB-O 3.29Å; S355-Y357 WeakPolarHBondContact CB-O 3.41Å; S355-Y357 PolarHBondContact O-N 3.12Å; S355-Y357 PolarHBondContact OG-N 3.34Å; S355-Y357 PolarHBondContact OG-O 2.82Å; Y357-V423 HydrophobicContact CD1-CG1 4.13Å; Y357-V423 HydrophobicContact CG-CG1 4.38Å
358	A	98.7	Very high	98.3	Very high	12 Å²	12	26.5 Å²	26.5	10%	0.099	13%	0.129	C	C	.	.			trans	-61.4	150.4	-179.4	0	0	0	0	0	112.8	F360 K379 V380 V423	A358-F360 HydrophobicContact CB-CE2 4.21Å; A358-F360 HydrophobicContact CB-CZ 4.18Å; A358-K379 HydrophobicContact CB-CD 4.41Å; A358-K379 HydrophobicContact CB-CG 3.95Å; A358-V380 WeakPolarHBondContact CA-O 3.28Å; A358-V380 WeakPolarHBondContact CB-O 3.46Å; A358-V423 WeakPolarHBondContact O-CA 3.37Å; A358-V423 PolarHBondContact O-N 3.34Å
359	I	98.8	Very high	98.3	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.005	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	158.7	164	65.3	179	0	0	0	109.8	A340 A351 C353 V361 V380 V420 S421 F422	A340-I359 HydrophobicContact CB-CD1 3.73Å; A340-I359 HydrophobicContact CB-CG2 4.3Å; A351-I359 HydrophobicContact CB-CD1 4.43Å; C353-I359 HydrophobicContact CB-CD1 4.24Å; C353-I359 HydrophobicContact CB-CG1 4.16Å; I359-V361 HydrophobicContact CD1-CG2 4.42Å; I359-V361 HydrophobicContact CG1-CG2 4.46Å; I359-V380 HydrophobicContact CD1-CB 4.26Å; I359-V380 HydrophobicContact CG1-CB 3.68Å; I359-V380 HydrophobicContact CG1-CG1 4.4Å; I359-V380 HydrophobicContact CG1-CG2 4.24Å; I359-V380 PolarHBondContact N-O 2.98Å; I359-V380 VanDerWaalsContact N-O 3.09Å; I359-V380 PolarHBondContact O-N 3.31Å; I359-V420 HydrophobicContact CB-CG1 3.99Å; I359-V420 HydrophobicContact CD1-CG1 4.23Å; I359-V420 HydrophobicContact CG1-CG1 4.43Å; I359-S421 CarbonylContact C-O 3.41Å; I359-S421 WeakPolarHBondContact CA-O 3.23Å; I359-F422 HydrophobicContact CG2-CD1 3.77Å; I359-F422 HydrophobicContact CG2-CE1 4.14Å
360	F	98.8	Very high	98.3	Very high	10 Å²	10	32.2 Å²	32.2	4%	0.044	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	121.3	-176.4	-59.4	-95.1	0	0	0	108.3	A358 V377 C378 K379 V420 S421 K424 G425 W426 Y430	A358-F360 HydrophobicContact CB-CE2 4.21Å; A358-F360 HydrophobicContact CB-CZ 4.18Å; F360-V377 HydrophobicContact CB-CG1 3.76Å; F360-C378 CarbonylContact C-O 3.59Å; F360-C378 WeakPolarHBondContact CA-O 3.23Å; F360-K379 HydrophobicContact CD1-CB 3.96Å; F360-K379 HydrophobicContact CD1-CG 4.07Å; F360-K379 HydrophobicContact CE1-CB 3.93Å; F360-K379 HydrophobicContact CE1-CD 3.9Å; F360-K379 HydrophobicContact CE1-CG 3.64Å; F360-K379 HydrophobicContact CZ-CD 4.36Å; F360-K379 HydrophobicContact CZ-CG 4.2Å; F360-V420 CarbonylContact O-C 3.54Å; F360-V420 VanDerWaalsContact O-CA 3.23Å; F360-V420 WeakPolarHBondContact O-CA 3.32Å; F360-S421 PolarHBondContact N-O 2.72Å; F360-S421 PolarHBondContact O-N 2.89Å; F360-K424 VanDerWaalsContact CD2-C 3.43Å; F360-K424 WeakPolarHBondContact CD2-O 3.44Å; F360-K424 VanDerWaalsContact CE2-C 3.43Å; F360-G425 VanDerWaalsContact CD1-CA 3.41Å; F360-W426 HydrophobicContact CB-CE3 4.09Å; F360-W426 HydrophobicContact CB-CZ3 3.68Å; F360-W426 WeakPolarHBondContact O-CH2 3.31Å; F360-W426 VanDerWaalsContact O-CZ3 3.23Å; F360-W426 WeakPolarHBondContact O-CZ3 3.19Å; F360-Y430 HydrophobicContact CD1-CE2 4.37Å; F360-Y430 AromaticContact CE1-CE1 3.88Å; F360-Y430 HydrophobicContact CE1-CE1 3.88Å; F360-Y430 HydrophobicContact CE1-CE2 4.4Å; F360-Y430 AromaticContact CE1-CZ 3.61Å; F360-Y430 WeakPolarHBondContact CE1-OH 3.48Å
361	V	98.8	Very high	98.2	Very high	1 Å²	1	34 Å²	34	1%	0.006	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	125.7	-168.3	-179	0	0	0	0	109.7	I359 V377 C378 V380 L386 I388 I418 V420	I359-V361 HydrophobicContact CD1-CG2 4.42Å; I359-V361 HydrophobicContact CG1-CG2 4.46Å; V361-V377 CarbonylContact O-C 3.57Å; V361-C378 PolarHBondContact N-O 3.43Å; V361-C378 PolarHBondContact O-N 3.47Å; V361-V380 HydrophobicContact CG2-CG2 3.96Å; V361-L386 HydrophobicContact CB-CD2 4.38Å; V361-I388 HydrophobicContact CG1-CB 4.44Å; V361-I388 HydrophobicContact CG1-CG2 3.78Å; V361-I418 HydrophobicContact CG1-CG2 3.83Å; V361-V420 HydrophobicContact CB-CG2 4.46Å; V361-V420 HydrophobicContact CG1-CG2 4.23Å; V361-V420 HydrophobicContact CG2-CG1 4.11Å; V361-V420 HydrophobicContact CG2-CG2 4.02Å
362	Q	98.7	Very high	98.2	Very high	29 Å²	29	39.3 Å²	39.3	14%	0.136	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	106.3	165.8	-179.8	-179.7	69.2	0	0	108.1	A375 V377 I418 R419 W426	Q362-A375 PolarHBondContact NE2-O 2.99Å; Q362-V377 HydrophobicContact CB-CG2 4.31Å; Q362-I418 WeakPolarHBondContact O-CG2 3.14Å; Q362-R419 PolarHBondContact N-O 2.73Å; Q362-R419 PolarHBondContact O-N 3.37Å; Q362-R419 VanDerWaalsContact O-N 3.09Å; Q362-W426 HydrophobicContact CB-CH2 3.97Å; Q362-W426 HydrophobicContact CB-CZ2 3.5Å; Q362-W426 HydrophobicContact CG-CZ2 4.48Å
363	S	98.6	Very high	98.2	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.007	22%	0.219	C	C	.	.			trans	-123.7	111.2	174.8	170.8	0	0	0	0	109.7	N365 C366 N367 I388 I418	S363-N365 VanDerWaalsContact C-N 3.25Å; S363-N365 PolarHBondContact O-N 3.35Å; S363-C366 PolarHBondContact O-N 3.48Å; S363-C366 PolarHBondContact OG-N 3.03Å; S363-N367 WeakPolarHBondContact O-CB 3.41Å; S363-N367 PolarHBondContact O-N 3.16Å; S363-N367 PolarHBondContact O-ND2 2.92Å; S363-N367 PolarHBondContact O-OD1 3.38Å; S363-I388 WeakPolarHBondContact CB-O 3.45Å; S363-I388 PolarHBondContact OG-O 3.33Å; S363-I418 VanDerWaalsContact OG-CD1 3.25Å; S363-I418 WeakPolarHBondContact OG-CD1 3.43Å
364	P	98.3	Very high	98.1	Very high	18 Å²	18	48.2 Å²	48.2	12%	0.117	25%	0.245	C	C	.	.	H	α-helix	trans	-57.9	-36.8	176	-28.7	38.6	0	0	0	113.2	N367 Q368 M415	P364-N367 PolarHBondContact O-N 3.06Å; P364-Q368 WeakPolarHBondContact O-CB 3.48Å; P364-Q368 PolarHBondContact O-N 2.84Å; P364-M415 HydrophobicContact CB-CE 4.26Å; P364-M415 HydrophobicContact CB-SD 3.42Å; P364-M415 WeakPolarHBondContact CB-SD 3.44Å
365	N	98.3	Very high	98	Very high	4 Å²	4	48.8 Å²	48.8	2%	0.021	26%	0.255	C	S	.	.	H	α-helix	trans	-63.2	-46.5	175.6	-179.5	-90.6	0	0	0	112.1	S363 R369 F389 N390 E393 M415	S363-N365 VanDerWaalsContact C-N 3.25Å; S363-N365 PolarHBondContact O-N 3.35Å; N365-R369 PolarHBondContact O-N 2.9Å; N365-R369 VanDerWaalsContact O-N 3.12Å; N365-R369 PolarHBondContact OD1-NH2 2.87Å; N365-R369 VanDerWaalsContact OD1-NH2 3.08Å; N365-F389 HydrophobicContact CB-CD2 3.56Å; N365-F389 HydrophobicContact CB-CE2 3.81Å; N365-F389 HydrophobicContact CB-CG 4.44Å; N365-F389 WeakPolarHBondContact OD1-CA 3.41Å; N365-N390 PolarHBondContact OD1-N 3.27Å; N365-E393 PolarHBondContact OD1-OE2 3.2Å; N365-M415 VanDerWaalsContact CA-CE 3.41Å; N365-M415 HydrophobicContact CB-CE 3.98Å
366	C	98.1	Very high	98	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.007	27%	0.267	C	S	.	.	H	α-helix	trans	-63.3	-45.6	175.1	-175.1	0	0	0	0	111.6	S363 Q368 R369 Y370	S363-C366 PolarHBondContact O-N 3.48Å; S363-C366 PolarHBondContact OG-N 3.03Å; C366-Q368 VanDerWaalsContact C-N 3.33Å; C366-Q368 PolarHBondContact O-N 3.1Å; C366-R369 WeakPolarHBondContact O-CB 3.05Å; C366-R369 PolarHBondContact O-N 3.43Å; C366-Y370 VanDerWaalsContact O-CD2 3.22Å; C366-Y370 WeakPolarHBondContact O-CD2 3.31Å; C366-Y370 PolarHBondContact O-N 3.42Å; C366-Y370 VanDerWaalsContact SG-CE2 3.6Å
367	N	98.2	Very high	98	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-61	-43.3	-179.1	-68.4	-16.2	0	0	0	111.1	S363 P364 Y370 G371 W372 H373 P374 T376	S363-N367 WeakPolarHBondContact O-CB 3.41Å; S363-N367 PolarHBondContact O-N 3.16Å; S363-N367 PolarHBondContact O-ND2 2.92Å; S363-N367 PolarHBondContact O-OD1 3.38Å; P364-N367 PolarHBondContact O-N 3.06Å; N367-Y370 PolarHBondContact O-N 3.35Å; N367-G371 PolarHBondContact O-N 2.82Å; N367-G371 VanDerWaalsContact O-N 3.09Å; N367-W372 HydrophobicContact CB-CB 4.25Å; N367-W372 PolarHBondContact O-N 3.47Å; N367-H373 PolarHBondContact ND2-O 2.88Å; N367-P374 PolarHBondContact ND2-O 2.93Å; N367-T376 PolarHBondContact ND2-N 3.31Å; N367-T376 PolarHBondContact ND2-O 2.87Å
368	Q	97.5	Very high	98	Very high	106 Å²	106	41.6 Å²	41.6	50%	0.495	23%	0.227	S	C	.	.	H	α-helix	trans	-62.7	-42.6	175.6	-177.6	171.5	-21.8	0	0	112.4	P364 C366 Y370 G371 M415	P364-Q368 WeakPolarHBondContact O-CB 3.48Å; P364-Q368 PolarHBondContact O-N 2.84Å; C366-Q368 VanDerWaalsContact C-N 3.33Å; C366-Q368 PolarHBondContact O-N 3.1Å; Q368-Y370 PolarHBondContact O-N 3.08Å; Q368-G371 PolarHBondContact O-N 3.45Å; Q368-G371 VanDerWaalsContact O-N 3.09Å; Q368-M415 HydrophobicContact CB-CE 4.45Å
369	R	97.2	Very high	98	Very high	63 Å²	63	46.9 Å²	46.9	24%	0.238	25%	0.247	C	C	.	.	H	α-helix	trans	-55.2	-39.6	177.2	-175.3	-167.6	-60.8	124.5	13.6	112.4	N365 C366 K387 E393	N365-R369 PolarHBondContact O-N 2.9Å; N365-R369 VanDerWaalsContact O-N 3.12Å; N365-R369 PolarHBondContact OD1-NH2 2.87Å; N365-R369 VanDerWaalsContact OD1-NH2 3.08Å; C366-R369 WeakPolarHBondContact O-CB 3.05Å; C366-R369 PolarHBondContact O-N 3.43Å; R369-K387 PolarHBondContact NH1-O 2.94Å; R369-E393 IonicContact CZ-OE1 2.7Å; R369-E393 IonicContact CZ-OE2 2.8Å; R369-E393 IonicContact NE-OE1 3.17Å; R369-E393 PolarHBondContact NE-OE1 2.91Å; R369-E393 IonicContact NE-OE2 2.83Å; R369-E393 PolarHBondContact NE-OE2 3.16Å; R369-E393 IonicContact NH2-OE1 3.84Å; R369-E393 IonicContact NH2-OE2 2.6Å; R369-E393 PolarHBondContact NH2-OE2 3.41Å
370	Y	96.8	Very high	98	Very high	103 Å²	103	47.1 Å²	47.1	40%	0.404	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	5.4	-178.7	-63.9	-67.7	0	0	0	113.9	C366 N367 Q368 W372	C366-Y370 VanDerWaalsContact O-CD2 3.22Å; C366-Y370 WeakPolarHBondContact O-CD2 3.31Å; C366-Y370 PolarHBondContact O-N 3.42Å; C366-Y370 VanDerWaalsContact SG-CE2 3.6Å; N367-Y370 PolarHBondContact O-N 3.35Å; Q368-Y370 PolarHBondContact O-N 3.08Å; Y370-W372 VanDerWaalsContact C-N 3.25Å; Y370-W372 HydrophobicContact CD2-CE3 4.18Å; Y370-W372 AromaticContact CD2-CH2 3.82Å; Y370-W372 HydrophobicContact CD2-CH2 3.82Å; Y370-W372 HydrophobicContact CD2-CZ2 4.47Å; Y370-W372 AromaticContact CD2-CZ3 3.63Å; Y370-W372 HydrophobicContact CD2-CZ3 3.63Å; Y370-W372 HydrophobicContact CE2-CH2 4.49Å; Y370-W372 HydrophobicContact CE2-CZ3 4.44Å; Y370-W372 HydrophobicContact CG-CE3 4.39Å; Y370-W372 AromaticContact CG-CH2 3.89Å; Y370-W372 HydrophobicContact CG-CH2 3.89Å; Y370-W372 HydrophobicContact CG-CZ2 4.1Å; Y370-W372 HydrophobicContact CG-CZ3 4.03Å; Y370-W372 PolarHBondContact O-N 3.03Å
371	G	97.4	Very high	98	Very high	68 Å²	68	49.2 Å²	49.2	70%	0.701	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	68	21.7	-178.8	0	0	0	0	0	114.3	N367 Q368	N367-G371 PolarHBondContact O-N 2.82Å; N367-G371 VanDerWaalsContact O-N 3.09Å; Q368-G371 PolarHBondContact O-N 3.45Å; Q368-G371 VanDerWaalsContact O-N 3.09Å
372	W	97.6	Very high	97.9	Very high	111 Å²	111	52.1 Å²	52.1	42%	0.42	28%	0.282	S	S	.	.			trans	-86.5	157.2	176.3	-60.1	-26.9	0	0	0	111.6	N367 Y370 T376 C378	N367-W372 HydrophobicContact CB-CB 4.25Å; N367-W372 PolarHBondContact O-N 3.47Å; Y370-W372 VanDerWaalsContact C-N 3.25Å; Y370-W372 HydrophobicContact CD2-CE3 4.18Å; Y370-W372 AromaticContact CD2-CH2 3.82Å; Y370-W372 HydrophobicContact CD2-CH2 3.82Å; Y370-W372 HydrophobicContact CD2-CZ2 4.47Å; Y370-W372 AromaticContact CD2-CZ3 3.63Å; Y370-W372 HydrophobicContact CD2-CZ3 3.63Å; Y370-W372 HydrophobicContact CE2-CH2 4.49Å; Y370-W372 HydrophobicContact CE2-CZ3 4.44Å; Y370-W372 HydrophobicContact CG-CE3 4.39Å; Y370-W372 AromaticContact CG-CH2 3.89Å; Y370-W372 HydrophobicContact CG-CH2 3.89Å; Y370-W372 HydrophobicContact CG-CZ2 4.1Å; Y370-W372 HydrophobicContact CG-CZ3 4.03Å; Y370-W372 PolarHBondContact O-N 3.03Å; W372-T376 HydrophobicContact CB-CG2 4.17Å; W372-T376 HydrophobicContact CD2-CG2 4.39Å; W372-T376 HydrophobicContact CE3-CG2 4.18Å; W372-T376 HydrophobicContact CG-CG2 4.42Å; W372-C378 WeakPolarHBondContact CZ3-SG 3.5Å
373	H	97.5	Very high	97.8	Very high	135 Å²	135	53.7 Å²	53.7	63%	0.625	31%	0.306	S	S	*	.			trans	-54.1	137.5	173	-175.4	-90.1	0	0	0	110.5	N367 A375 T376	N367-H373 PolarHBondContact ND2-O 2.88Å; H373-A375 WeakPolarHBondContact ND1-CB 3.41Å; H373-A375 PolarHBondContact ND1-N 3.05Å; H373-A375 VanDerWaalsContact ND1-N 3.16Å; H373-A375 PolarHBondContact O-N 3.11Å; H373-T376 VanDerWaalsContact O-CB 3.24Å; H373-T376 WeakPolarHBondContact O-CB 3.42Å; H373-T376 PolarHBondContact O-N 3.14Å; H373-T376 PolarHBondContact O-OG1 2.75Å
374	P	96.6	Very high	97.7	Very high	82 Å²	82	56.4 Å²	56.4	53%	0.532	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-25.4	-174.8	-28.9	35.5	0	0	0	114.7	N367	N367-P374 PolarHBondContact ND2-O 2.93Å
375	A	97.1	Very high	97.7	Very high	47 Å²	47	59.8 Å²	59.8	39%	0.388	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	1	176.9	0	0	0	0	0	115.1	Q362 H373	Q362-A375 PolarHBondContact NE2-O 2.99Å; H373-A375 WeakPolarHBondContact ND1-CB 3.41Å; H373-A375 PolarHBondContact ND1-N 3.05Å; H373-A375 VanDerWaalsContact ND1-N 3.16Å; H373-A375 PolarHBondContact O-N 3.11Å
376	T	98.1	Very high	97.7	Very high	48 Å²	48	61 Å²	61	29%	0.294	35%	0.348	S	S	.	.			trans	-57	142.4	178.6	-68.1	0	0	0	0	111.7	N367 W372 H373	N367-T376 PolarHBondContact ND2-N 3.31Å; N367-T376 PolarHBondContact ND2-O 2.87Å; W372-T376 HydrophobicContact CB-CG2 4.17Å; W372-T376 HydrophobicContact CD2-CG2 4.39Å; W372-T376 HydrophobicContact CE3-CG2 4.18Å; W372-T376 HydrophobicContact CG-CG2 4.42Å; H373-T376 VanDerWaalsContact O-CB 3.24Å; H373-T376 WeakPolarHBondContact O-CB 3.42Å; H373-T376 PolarHBondContact O-N 3.14Å; H373-T376 PolarHBondContact O-OG1 2.75Å
377	V	98.6	Very high	97.7	Very high	17 Å²	17	63.7 Å²	63.7	10%	0.103	36%	0.359	C	S	.	.			trans	-116	111.8	-179.4	-177.7	0	0	0	0	109.2	F360 V361 Q362 W426	F360-V377 HydrophobicContact CB-CG1 3.76Å; V361-V377 CarbonylContact O-C 3.57Å; Q362-V377 HydrophobicContact CB-CG2 4.31Å; V377-W426 WeakPolarHBondContact CB-O 3.32Å; V377-W426 HydrophobicContact CG1-CD2 4.1Å; V377-W426 HydrophobicContact CG1-CE3 3.87Å; V377-W426 HydrophobicContact CG1-CH2 3.88Å; V377-W426 HydrophobicContact CG1-CZ2 4.12Å; V377-W426 HydrophobicContact CG1-CZ3 3.73Å; V377-W426 HydrophobicContact CG2-CD2 3.96Å; V377-W426 VanDerWaalsContact CG2-CE2 3.48Å; V377-W426 HydrophobicContact CG2-CG 4.35Å; V377-W426 HydrophobicContact CG2-CH2 4.34Å; V377-W426 HydrophobicContact CG2-CZ2 3.73Å; V377-W426 WeakPolarHBondContact CG2-O 3.48Å
378	C	98.3	Very high	97.7	Very high	17 Å²	17	63.7 Å²	63.7	12%	0.115	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	123.9	-178.6	-56.8	0	0	0	0	110.3	F360 V361 W372 L386	F360-C378 CarbonylContact C-O 3.59Å; F360-C378 WeakPolarHBondContact CA-O 3.23Å; V361-C378 PolarHBondContact N-O 3.43Å; V361-C378 PolarHBondContact O-N 3.47Å; W372-C378 WeakPolarHBondContact CZ3-SG 3.5Å; C378-L386 HydrophobicContact CB-CD2 3.79Å
379	K	98.5	Very high	97.7	Very high	123 Å²	123	58.6 Å²	58.6	54%	0.535	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	128.4	171.3	-177.7	-178.9	179.2	-173.9	0	109.7	A358 F360	A358-K379 HydrophobicContact CB-CD 4.41Å; A358-K379 HydrophobicContact CB-CG 3.95Å; F360-K379 HydrophobicContact CD1-CB 3.96Å; F360-K379 HydrophobicContact CD1-CG 4.07Å; F360-K379 HydrophobicContact CE1-CB 3.93Å; F360-K379 HydrophobicContact CE1-CD 3.9Å; F360-K379 HydrophobicContact CE1-CG 3.64Å; F360-K379 HydrophobicContact CZ-CD 4.36Å; F360-K379 HydrophobicContact CZ-CG 4.2Å
380	V	98.6	Very high	97.7	Very high	5 Å²	5	56.6 Å²	56.6	3%	0.03	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	105.6	171.2	-173.2	0	0	0	0	108.1	C353 A358 I359 V361 C384 L386	C353-V380 HydrophobicContact CB-CG1 3.95Å; A358-V380 WeakPolarHBondContact CA-O 3.28Å; A358-V380 WeakPolarHBondContact CB-O 3.46Å; I359-V380 HydrophobicContact CD1-CB 4.26Å; I359-V380 HydrophobicContact CG1-CB 3.68Å; I359-V380 HydrophobicContact CG1-CG1 4.4Å; I359-V380 HydrophobicContact CG1-CG2 4.24Å; I359-V380 PolarHBondContact N-O 2.98Å; I359-V380 VanDerWaalsContact N-O 3.09Å; I359-V380 PolarHBondContact O-N 3.31Å; V361-V380 HydrophobicContact CG2-CG2 3.96Å; V380-C384 HydrophobicContact CG1-CB 3.98Å; V380-C384 WeakPolarHBondContact CG1-O 3.33Å; V380-L386 HydrophobicContact CG2-CB 3.84Å; V380-L386 HydrophobicContact CG2-CD2 3.97Å
381	P	98.6	Very high	97.7	Very high	54 Å²	54	51.9 Å²	51.9	35%	0.351	31%	0.311	S	S	.	.			trans	-65.3	162.2	178.5	-21.2	33.4	0	0	0	113.3	C353 G383 C384	C353-P381 VanDerWaalsContact CB-O 3.24Å; C353-P381 WeakPolarHBondContact CB-O 3.49Å; P381-G383 PolarHBondContact O-N 3.22Å; P381-C384 VanDerWaalsContact O-CB 3.31Å; P381-C384 WeakPolarHBondContact O-CB 3.28Å; P381-C384 PolarHBondContact O-N 3.34Å
382	P	98.4	Very high	97.6	Very high	63 Å²	63	52 Å²	52	41%	0.409	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.6	130.9	172.7	-29.4	37.7	0	0	0	113	S355 D356 C384	S355-P382 VanDerWaalsContact O-CB 3.31Å; S355-P382 WeakPolarHBondContact O-CB 3.29Å; D356-P382 VanDerWaalsContact C-CG 3.43Å; D356-P382 WeakPolarHBondContact O-CG 3.3Å; P382-C384 PolarHBondContact O-N 2.84Å
383	G	95.5	Very high	97.5	Very high	62 Å²	62	49.7 Å²	49.7	64%	0.639	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.6	-6.9	-179.5	0	0	0	0	0	115.1	C353 P381	C353-G383 PolarHBondContact O-N 3.07Å; P381-G383 PolarHBondContact O-N 3.22Å
384	C	97.8	Very high	97.5	Very high	57 Å²	57	43.3 Å²	43.3	39%	0.385	26%	0.258	S	S	.	.			trans	-88.8	161.4	175.3	-59.7	0	0	0	0	111.8	E352 C353 V380 P381 P382	E352-C384 WeakPolarHBondContact CA-O 3.41Å; C353-C384 PolarHBondContact N-O 3.43Å; V380-C384 HydrophobicContact CG1-CB 3.98Å; V380-C384 WeakPolarHBondContact CG1-O 3.33Å; P381-C384 VanDerWaalsContact O-CB 3.31Å; P381-C384 WeakPolarHBondContact O-CB 3.28Å; P381-C384 PolarHBondContact O-N 3.34Å; P382-C384 PolarHBondContact O-N 2.84Å
385	N	97	Very high	97.5	Very high	89 Å²	89	39.5 Å²	39.5	48%	0.476	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	159.9	171.7	67.5	87.4	0	0	0	111.2	A351 E352	A351-N385 CarbonylContact O-C 3.55Å; A351-N385 WeakPolarHBondContact O-CA 3.45Å; E352-N385 HydrophobicContact CB-CB 3.93Å; E352-N385 HydrophobicContact CG-CB 4.17Å
386	L	97.8	Very high	97.5	Very high	30 Å²	30	40.5 Å²	40.5	16%	0.157	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	134.2	179.7	177.9	64.2	0	0	0	109.2	F350 A351 V361 C378 V380 I388	F350-L386 CarbonylContact C-O 3.53Å; F350-L386 VanDerWaalsContact CA-O 3.27Å; F350-L386 WeakPolarHBondContact CA-O 3.38Å; A351-L386 PolarHBondContact N-O 2.91Å; A351-L386 PolarHBondContact O-N 3.42Å; V361-L386 HydrophobicContact CB-CD2 4.38Å; C378-L386 HydrophobicContact CB-CD2 3.79Å; V380-L386 HydrophobicContact CG2-CB 3.84Å; V380-L386 HydrophobicContact CG2-CD2 3.97Å; L386-I388 HydrophobicContact CB-CG2 4.3Å; L386-I388 HydrophobicContact CD2-CG2 4.16Å; L386-I388 HydrophobicContact CG-CG2 4.09Å; L386-I388 WeakPolarHBondContact O-CG2 3.26Å; L386-I388 PolarHBondContact O-N 2.72Å
387	K	98	Very high	97.4	Very high	57 Å²	57	39.6 Å²	39.6	25%	0.248	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	103.1	168.7	-173.9	-176.5	-60.8	-175	0	109.2	E348 V349 F350 R369	E348-K387 VanDerWaalsContact CD-CE 3.47Å; E348-K387 VanDerWaalsContact OE1-CE 3.31Å; E348-K387 WeakPolarHBondContact OE1-CE 3.41Å; E348-K387 IonicContact OE1-NZ 3.51Å; E348-K387 PolarHBondContact OE1-NZ 3.23Å; E348-K387 WeakPolarHBondContact OE2-CE 3.45Å; E348-K387 IonicContact OE2-NZ 3.62Å; E348-K387 PolarHBondContact OE2-NZ 3.04Å; V349-K387 CarbonylContact O-C 3.13Å; F350-K387 HydrophobicContact CD1-CB 3.89Å; F350-K387 HydrophobicContact CD1-CG 4.39Å; F350-K387 HydrophobicContact CE1-CB 3.69Å; F350-K387 HydrophobicContact CE1-CG 4.03Å; F350-K387 HydrophobicContact CZ-CB 4.32Å; F350-K387 HydrophobicContact CZ-CD 4.4Å; F350-K387 HydrophobicContact CZ-CG 4.16Å; R369-K387 PolarHBondContact NH1-O 2.94Å
388	I	98.5	Very high	97.3	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	-19.9	-172.9	64.9	167.6	0	0	0	112.8	F342 V349 A351 V361 S363 L386 I418 F446	F342-I388 HydrophobicContact CD1-CD1 3.96Å; F342-I388 HydrophobicContact CE1-CD1 4.23Å; V349-I388 HydrophobicContact CB-CG1 4.03Å; V349-I388 HydrophobicContact CG1-CD1 3.83Å; V349-I388 HydrophobicContact CG1-CG1 3.83Å; V349-I388 VanDerWaalsContact O-CG1 3.32Å; V349-I388 WeakPolarHBondContact O-CG1 3.5Å; V349-I388 PolarHBondContact O-N 2.83Å; A351-I388 HydrophobicContact CB-CD1 4.18Å; A351-I388 HydrophobicContact CB-CG2 3.63Å; V361-I388 HydrophobicContact CG1-CB 4.44Å; V361-I388 HydrophobicContact CG1-CG2 3.78Å; S363-I388 WeakPolarHBondContact CB-O 3.45Å; S363-I388 PolarHBondContact OG-O 3.33Å; L386-I388 HydrophobicContact CB-CG2 4.3Å; L386-I388 HydrophobicContact CD2-CG2 4.16Å; L386-I388 HydrophobicContact CG-CG2 4.09Å; L386-I388 WeakPolarHBondContact O-CG2 3.26Å; L386-I388 PolarHBondContact O-N 2.72Å; I388-I418 HydrophobicContact CB-CD1 3.86Å; I388-I418 HydrophobicContact CD1-CD1 3.85Å; I388-I418 HydrophobicContact CD1-CG2 4.32Å; I388-I418 HydrophobicContact CG1-CD1 3.92Å; I388-I418 VanDerWaalsContact O-CD1 3.27Å; I388-I418 WeakPolarHBondContact O-CD1 3.46Å; I388-F446 HydrophobicContact CD1-CZ 4.09Å
389	F	98.4	Very high	97.3	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	148.7	178.9	-160.8	-94.6	0	0	0	111.9	E348 V349 N365 N391 F394 M415 I418 F446 P449	E348-F389 WeakPolarHBondContact CA-O 3.33Å; V349-F389 HydrophobicContact CB-CB 3.93Å; V349-F389 HydrophobicContact CG2-CB 4.13Å; V349-F389 PolarHBondContact N-O 3.17Å; V349-F389 PolarHBondContact O-N 3.49Å; V349-F389 VanDerWaalsContact O-N 3.14Å; N365-F389 HydrophobicContact CB-CD2 3.56Å; N365-F389 HydrophobicContact CB-CE2 3.81Å; N365-F389 HydrophobicContact CB-CG 4.44Å; N365-F389 WeakPolarHBondContact OD1-CA 3.41Å; F389-N391 WeakPolarHBondContact CE1-OD1 3.34Å; F389-F394 HydrophobicContact CE1-CB 4.02Å; F389-F394 HydrophobicContact CE1-CG 4.45Å; F389-F394 HydrophobicContact CZ-CB 3.65Å; F389-F394 HydrophobicContact CZ-CD1 4.47Å; F389-F394 AromaticContact CZ-CD2 3.99Å; F389-F394 HydrophobicContact CZ-CD2 3.99Å; F389-F394 AromaticContact CZ-CG 3.78Å; F389-F394 HydrophobicContact CZ-CG 3.78Å; F389-M415 VanDerWaalsContact CE2-O 3.29Å; F389-M415 WeakPolarHBondContact CE2-O 3.27Å; F389-I418 HydrophobicContact CB-CD1 4.3Å; F389-I418 HydrophobicContact CD2-CD1 4.41Å; F389-F446 HydrophobicContact CB-CD2 4.14Å; F389-F446 HydrophobicContact CB-CE2 3.49Å; F389-F446 VanDerWaalsContact CB-CE2 3.49Å; F389-F446 HydrophobicContact CB-CZ 4.13Å; F389-F446 HydrophobicContact CD1-CD2 4.08Å; F389-F446 HydrophobicContact CD1-CE2 4.3Å; F389-F446 AromaticContact CD2-CD2 3.6Å; F389-F446 HydrophobicContact CD2-CD2 3.6Å; F389-F446 AromaticContact CD2-CE2 3.55Å; F389-F446 HydrophobicContact CD2-CE2 3.55Å; F389-F446 HydrophobicContact CE1-CD2 4.41Å; F389-F446 AromaticContact CE2-CD2 3.96Å; F389-F446 HydrophobicContact CE2-CD2 3.96Å; F389-F446 HydrophobicContact CE2-CE2 4.35Å; F389-F446 AromaticContact CG-CD2 3.66Å; F389-F446 HydrophobicContact CG-CD2 3.66Å; F389-F446 AromaticContact CG-CE2 3.52Å; F389-F446 HydrophobicContact CG-CE2 3.52Å; F389-F446 HydrophobicContact CZ-CD2 4.34Å; F389-P449 HydrophobicContact CE1-CB 4.3Å; F389-P449 HydrophobicContact CE1-CG 3.53Å; F389-P449 HydrophobicContact CZ-CB 3.97Å; F389-P449 HydrophobicContact CZ-CG 3.7Å
390	N	97	Very high	97.2	Very high	20 Å²	20	40.8 Å²	40.8	11%	0.107	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	124	170.8	175.6	-58.4	0	0	0	109.7	E348 N365 Q392 E393 F394	E348-N390 PolarHBondContact OE1-ND2 3.32Å; N365-N390 PolarHBondContact OD1-N 3.27Å; N390-Q392 VanDerWaalsContact C-N 3.35Å; N390-Q392 PolarHBondContact O-N 3.16Å; N390-Q392 WeakPolarHBondContact OD1-CA 3.45Å; N390-Q392 VanDerWaalsContact OD1-CB 3.27Å; N390-Q392 WeakPolarHBondContact OD1-CB 3.25Å; N390-Q392 PolarHBondContact OD1-N 2.88Å; N390-E393 HydrophobicContact CB-CB 4.23Å; N390-E393 HydrophobicContact CB-CG 4.06Å; N390-E393 PolarHBondContact O-N 2.89Å; N390-E393 PolarHBondContact OD1-N 3.01Å; N390-F394 PolarHBondContact O-N 3.02Å; N390-F394 VanDerWaalsContact O-N 3.1Å
391	N	95.9	Very high	97.1	Very high	4 Å²	4	41.2 Å²	41.2	2%	0.021	24%	0.244	C	C	.	.	H	α-helix	trans	-66.4	-32.9	-177.1	-76.1	-4.4	0	0	0	113.1	L144 Y272 Y344 G347 F389 F394 A395	L144-N391 HydrophobicContact CD1-CB 3.8Å; L144-N391 HydrophobicContact CD2-CB 4.08Å; Y272-N391 PolarHBondContact OH-ND2 2.9Å; Y344-N391 PolarHBondContact OH-ND2 3.43Å; G347-N391 VanDerWaalsContact O-CB 3.3Å; G347-N391 WeakPolarHBondContact O-CB 3.22Å; G347-N391 VanDerWaalsContact O-CG 3.29Å; G347-N391 PolarHBondContact O-N 2.85Å; F389-N391 WeakPolarHBondContact CE1-OD1 3.34Å; N391-F394 PolarHBondContact O-N 3.31Å; N391-A395 VanDerWaalsContact O-CB 3.3Å; N391-A395 WeakPolarHBondContact O-CB 3.41Å; N391-A395 PolarHBondContact O-N 3.04Å
392	Q	95.4	Very high	96.9	Very high	70 Å²	70	39 Å²	39	33%	0.327	23%	0.229	S	C	.	.	H	α-helix	trans	-69.4	-39.1	178.5	-172.9	61.8	49.9	0	0	111.4	L144 N390 A395 T396	L144-Q392 HydrophobicContact CD2-CB 4.28Å; N390-Q392 VanDerWaalsContact C-N 3.35Å; N390-Q392 PolarHBondContact O-N 3.16Å; N390-Q392 WeakPolarHBondContact OD1-CA 3.45Å; N390-Q392 VanDerWaalsContact OD1-CB 3.27Å; N390-Q392 WeakPolarHBondContact OD1-CB 3.25Å; N390-Q392 PolarHBondContact OD1-N 2.88Å; Q392-A395 PolarHBondContact O-N 3.04Å; Q392-T396 PolarHBondContact O-N 2.96Å; Q392-T396 PolarHBondContact O-OG1 2.96Å
393	E	96.5	Very high	96.7	Very high	63 Å²	63	41 Å²	41	29%	0.294	24%	0.242	S	C	.	.	H	α-helix	trans	-64.7	-43.3	173.4	-69.1	169.1	-167.3	0	0	110.8	N365 R369 N390 T396 L397	N365-E393 PolarHBondContact OD1-OE2 3.2Å; R369-E393 IonicContact CZ-OE1 2.7Å; R369-E393 IonicContact CZ-OE2 2.8Å; R369-E393 IonicContact NE-OE1 3.17Å; R369-E393 PolarHBondContact NE-OE1 2.91Å; R369-E393 IonicContact NE-OE2 2.83Å; R369-E393 PolarHBondContact NE-OE2 3.16Å; R369-E393 IonicContact NH2-OE1 3.84Å; R369-E393 IonicContact NH2-OE2 2.6Å; R369-E393 PolarHBondContact NH2-OE2 3.41Å; N390-E393 HydrophobicContact CB-CB 4.23Å; N390-E393 HydrophobicContact CB-CG 4.06Å; N390-E393 PolarHBondContact O-N 2.89Å; N390-E393 PolarHBondContact OD1-N 3.01Å; E393-T396 PolarHBondContact O-N 2.78Å; E393-L397 PolarHBondContact O-N 3.4Å
394	F	97.5	Very high	96.6	Very high	1 Å²	1	44.8 Å²	44.8	0%	0.004	24%	0.243	C	C	.	.	H	α-helix	trans	-63.8	-43.3	174.6	-179.7	-101.9	0	0	0	112.4	F389 N390 N391 T396 L397 L398 L412 M415 C416 P449 W452 L453	F389-F394 HydrophobicContact CE1-CB 4.02Å; F389-F394 HydrophobicContact CE1-CG 4.45Å; F389-F394 HydrophobicContact CZ-CB 3.65Å; F389-F394 HydrophobicContact CZ-CD1 4.47Å; F389-F394 AromaticContact CZ-CD2 3.99Å; F389-F394 HydrophobicContact CZ-CD2 3.99Å; F389-F394 AromaticContact CZ-CG 3.78Å; F389-F394 HydrophobicContact CZ-CG 3.78Å; N390-F394 PolarHBondContact O-N 3.02Å; N390-F394 VanDerWaalsContact O-N 3.1Å; N391-F394 PolarHBondContact O-N 3.31Å; F394-T396 VanDerWaalsContact C-N 3.3Å; F394-T396 PolarHBondContact O-N 3.39Å; F394-L397 PolarHBondContact O-N 3.16Å; F394-L398 HydrophobicContact CE1-CD2 4.09Å; F394-L398 WeakPolarHBondContact O-CB 3.26Å; F394-L398 PolarHBondContact O-N 3.15Å; F394-L412 HydrophobicContact CE2-CB 4.26Å; F394-M415 HydrophobicContact CD2-CB 4.02Å; F394-M415 HydrophobicContact CE2-CB 3.96Å; F394-C416 VanDerWaalsContact CZ-SG 3.55Å; F394-P449 HydrophobicContact CD1-CB 3.9Å; F394-P449 HydrophobicContact CE1-CB 3.7Å; F394-P449 HydrophobicContact CG-CB 4.46Å; F394-P449 HydrophobicContact CZ-CB 4.11Å; F394-W452 HydrophobicContact CD1-CE3 4.38Å; F394-W452 HydrophobicContact CE1-CE3 4.49Å; F394-L453 HydrophobicContact CZ-CB 4.43Å
395	A	96.4	Very high	96.3	Very high	2 Å²	2	43.4 Å²	43.4	2%	0.017	24%	0.239	C	C	.	.	H	α-helix	trans	-56.6	-45.3	176	0	0	0	0	0	111.8	L144 N391 Q392 L398 S399 W452	L144-A395 HydrophobicContact CD2-CB 4.46Å; N391-A395 VanDerWaalsContact O-CB 3.3Å; N391-A395 WeakPolarHBondContact O-CB 3.41Å; N391-A395 PolarHBondContact O-N 3.04Å; Q392-A395 PolarHBondContact O-N 3.04Å; A395-L398 PolarHBondContact O-N 2.92Å; A395-S399 WeakPolarHBondContact O-CB 3.5Å; A395-S399 PolarHBondContact O-N 3.49Å; A395-W452 HydrophobicContact CB-CH2 3.41Å; A395-W452 VanDerWaalsContact CB-CH2 3.41Å; A395-W452 HydrophobicContact CB-CZ3 3.47Å; A395-W452 VanDerWaalsContact CB-CZ3 3.47Å
396	T	96.5	Very high	96.1	Very high	69 Å²	69	41.4 Å²	41.4	42%	0.423	23%	0.226	S	C	.	.	H	α-helix	trans	-62.4	-47.3	178.7	-54.5	0	0	0	0	110.3	Q392 E393 F394 L398 S399 M400	Q392-T396 PolarHBondContact O-N 2.96Å; Q392-T396 PolarHBondContact O-OG1 2.96Å; E393-T396 PolarHBondContact O-N 2.78Å; F394-T396 VanDerWaalsContact C-N 3.3Å; F394-T396 PolarHBondContact O-N 3.39Å; T396-L398 PolarHBondContact O-N 3.48Å; T396-S399 PolarHBondContact O-N 2.94Å; T396-M400 HydrophobicContact CG2-SD 4.05Å; T396-M400 WeakPolarHBondContact O-CB 3.48Å; T396-M400 VanDerWaalsContact O-CG 3.27Å; T396-M400 WeakPolarHBondContact O-CG 3.31Å; T396-M400 PolarHBondContact O-N 3.39Å
397	L	96.6	Very high	96	Very high	28 Å²	28	45.4 Å²	45.4	15%	0.147	24%	0.244	C	C	.	.	H	α-helix	trans	-63.4	-41.4	177.8	-177.7	60	0	0	0	112.6	E393 F394 M400 S401 L412 M415	E393-L397 PolarHBondContact O-N 3.4Å; F394-L397 PolarHBondContact O-N 3.16Å; L397-M400 PolarHBondContact O-N 3.28Å; L397-S401 WeakPolarHBondContact O-CB 3.27Å; L397-S401 PolarHBondContact O-N 3.17Å; L397-S401 PolarHBondContact O-OG 2.85Å; L397-L412 HydrophobicContact CD1-CD2 4.38Å; L397-L412 HydrophobicContact CD2-CD2 3.56Å; L397-L412 HydrophobicContact CG-CD1 4.34Å; L397-L412 HydrophobicContact CG-CD2 3.67Å; L397-M415 HydrophobicContact CD2-CE 3.64Å; L397-M415 HydrophobicContact CD2-CG 4.05Å; L397-M415 HydrophobicContact CD2-SD 4.25Å
398	L	97.3	Very high	95.8	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-60.6	-50.5	176.4	178.6	54.4	0	0	0	110.8	I147 F394 A395 T396 M400 S401 V402 V409 L412 W452 L453 V456	I147-L398 HydrophobicContact CD1-CB 4.28Å; I147-L398 HydrophobicContact CD1-CD2 4.25Å; I147-L398 HydrophobicContact CD1-CG 4.08Å; I147-L398 HydrophobicContact CG1-CD2 3.84Å; I147-L398 HydrophobicContact CG1-CG 3.99Å; I147-L398 HydrophobicContact CG2-CG 4.42Å; F394-L398 HydrophobicContact CE1-CD2 4.09Å; F394-L398 WeakPolarHBondContact O-CB 3.26Å; F394-L398 PolarHBondContact O-N 3.15Å; A395-L398 PolarHBondContact O-N 2.92Å; T396-L398 PolarHBondContact O-N 3.48Å; L398-M400 VanDerWaalsContact C-N 3.33Å; L398-M400 PolarHBondContact O-N 3.3Å; L398-S401 PolarHBondContact O-N 2.91Å; L398-S401 VanDerWaalsContact O-N 3.07Å; L398-V402 PolarHBondContact O-N 3.32Å; L398-V409 HydrophobicContact CD1-CG1 3.82Å; L398-L412 HydrophobicContact CB-CD1 4.14Å; L398-L412 HydrophobicContact CD1-CD1 3.87Å; L398-W452 HydrophobicContact CD2-CD2 4.04Å; L398-W452 HydrophobicContact CD2-CE3 4.34Å; L398-W452 HydrophobicContact CD2-CG 4.17Å; L398-L453 HydrophobicContact CD1-CD1 3.6Å; L398-V456 HydrophobicContact CD1-CB 4.47Å; L398-V456 HydrophobicContact CD1-CG1 4.24Å; L398-V456 HydrophobicContact CD1-CG2 4.45Å; L398-V456 HydrophobicContact CD2-CG2 4.13Å; L398-V456 HydrophobicContact CG-CG2 4.46Å
399	S	96.5	Very high	95.7	Very high	61 Å²	61	44.2 Å²	44.2	43%	0.427	25%	0.245	S	C	.	.	H	α-helix	trans	-57.6	-44.5	176.8	-172.3	0	0	0	0	112.1	A395 T396 S401 P403	A395-S399 WeakPolarHBondContact O-CB 3.5Å; A395-S399 PolarHBondContact O-N 3.49Å; T396-S399 PolarHBondContact O-N 2.94Å; S399-S401 VanDerWaalsContact C-N 3.28Å; S399-S401 PolarHBondContact O-N 3.15Å; S399-P403 WeakPolarHBondContact O-CD 3.28Å
400	M	96.1	Very high	95.6	Very high	122 Å²	122	50.3 Å²	50.3	60%	0.601	27%	0.269	S	S	*	.	H	α-helix	trans	-68.5	-24.1	177.4	-70.6	177.6	67.6	0	0	113.6	T396 L397 L398 P403 H404	T396-M400 HydrophobicContact CG2-SD 4.05Å; T396-M400 WeakPolarHBondContact O-CB 3.48Å; T396-M400 VanDerWaalsContact O-CG 3.27Å; T396-M400 WeakPolarHBondContact O-CG 3.31Å; T396-M400 PolarHBondContact O-N 3.39Å; L397-M400 PolarHBondContact O-N 3.28Å; L398-M400 VanDerWaalsContact C-N 3.33Å; L398-M400 PolarHBondContact O-N 3.3Å; M400-P403 WeakPolarHBondContact O-CD 3.48Å; M400-H404 PolarHBondContact O-CE1 2.88Å; M400-H404 VanDerWaalsContact O-CE1 3.22Å; M400-H404 PolarHBondContact O-ND1 3.45Å
401	S	96.5	Very high	95.6	Very high	13 Å²	13	51.7 Å²	51.7	9%	0.091	28%	0.283	C	S	.	.	H	α-helix	trans	-85.1	-24.5	-178.4	-58.3	0	0	0	0	112.8	L397 L398 S399 H404	L397-S401 WeakPolarHBondContact O-CB 3.27Å; L397-S401 PolarHBondContact O-N 3.17Å; L397-S401 PolarHBondContact O-OG 2.85Å; L398-S401 PolarHBondContact O-N 2.91Å; L398-S401 VanDerWaalsContact O-N 3.07Å; S399-S401 VanDerWaalsContact C-N 3.28Å; S399-S401 PolarHBondContact O-N 3.15Å; S401-H404 WeakPolarHBondContact O-CB 3.47Å; S401-H404 PolarHBondContact O-N 2.91Å
402	V	95.3	Very high	95.6	Very high	7 Å²	7	52.1 Å²	52.1	4%	0.042	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-54.6	-46.7	179.9	170	0	0	0	0	113.1	I147 L398 H404 G405 V409 V456	I147-V402 HydrophobicContact CG2-CG2 3.72Å; L398-V402 PolarHBondContact O-N 3.32Å; V402-H404 PolarHBondContact O-N 2.8Å; V402-H404 VanDerWaalsContact O-N 3.15Å; V402-G405 PolarHBondContact O-N 3.42Å; V402-G405 VanDerWaalsContact O-N 3.14Å; V402-V409 HydrophobicContact CG2-CG2 4.12Å; V402-V456 HydrophobicContact CG2-CG1 3.82Å
403	P	93.4	Very high	95.7	Very high	105 Å²	105	51.1 Å²	51.1	68%	0.682	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-63.6	-18.8	177.4	-23.4	34.7	0	0	0	114.5	S399 M400 G405	S399-P403 WeakPolarHBondContact O-CD 3.28Å; M400-P403 WeakPolarHBondContact O-CD 3.48Å; P403-G405 VanDerWaalsContact C-N 3.29Å
404	H	93.6	Very high	95.7	Very high	143 Å²	143	57.5 Å²	57.5	66%	0.662	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-87.9	2.9	179.8	-59.4	89.9	0	0	0	112.8	M400 S401 V402 A408	M400-H404 PolarHBondContact O-CE1 2.88Å; M400-H404 VanDerWaalsContact O-CE1 3.22Å; M400-H404 PolarHBondContact O-ND1 3.45Å; S401-H404 WeakPolarHBondContact O-CB 3.47Å; S401-H404 PolarHBondContact O-N 2.91Å; V402-H404 PolarHBondContact O-N 2.8Å; V402-H404 VanDerWaalsContact O-N 3.15Å; H404-A408 HydrophobicContact CB-CB 3.54Å
405	G	92.3	Very high	95.7	Very high	28 Å²	28	58.3 Å²	58.3	29%	0.289	31%	0.309	S	S	.	.			trans	89.4	178.7	172.5	0	0	0	0	0	114.9	V402 P403 E407 A408 V409	V402-G405 PolarHBondContact O-N 3.42Å; V402-G405 VanDerWaalsContact O-N 3.14Å; P403-G405 VanDerWaalsContact C-N 3.29Å; G405-E407 PolarHBondContact O-N 3.4Å; G405-A408 PolarHBondContact O-N 3.08Å; G405-V409 PolarHBondContact O-N 3.42Å
406	F	93.5	Very high	95.8	Very high	47 Å²	47	58.2 Å²	58.2	21%	0.206	31%	0.308	C	S	.	.	H	α-helix	trans	-56	-45.9	-170.6	-175.9	-87.6	0	0	0	113.2	A408 V409 Y410 L457 M460 E461 P463	F406-A408 VanDerWaalsContact C-N 3.35Å; F406-A408 PolarHBondContact O-N 2.94Å; F406-V409 PolarHBondContact O-N 2.96Å; F406-Y410 HydrophobicContact CE1-CD2 4.16Å; F406-Y410 HydrophobicContact CE1-CG 4.28Å; F406-Y410 HydrophobicContact CZ-CD2 4.39Å; F406-Y410 VanDerWaalsContact O-CB 3.28Å; F406-Y410 WeakPolarHBondContact O-CB 3.36Å; F406-Y410 PolarHBondContact O-N 3.33Å; F406-L457 HydrophobicContact CD2-CD2 3.83Å; F406-L457 HydrophobicContact CE1-CD2 4.49Å; F406-L457 HydrophobicContact CE2-CB 4.24Å; F406-L457 HydrophobicContact CE2-CD2 3.65Å; F406-L457 HydrophobicContact CG-CD2 4.33Å; F406-L457 HydrophobicContact CZ-CD2 4Å; F406-M460 HydrophobicContact CD2-CB 4.1Å; F406-E461 WeakPolarHBondContact CB-O 3.22Å; F406-E461 WeakPolarHBondContact CD2-O 3.32Å; F406-P463 HydrophobicContact CD1-CB 4.48Å
407	E	94	Very high	95.8	Very high	113 Å²	113	56 Å²	56	53%	0.528	30%	0.295	S	S	.	.	H	α-helix	trans	-63.2	-39	-177.4	-69.7	-65.2	167.8	0	0	112.8	G405 Y410 A411 P463	G405-E407 PolarHBondContact O-N 3.4Å; E407-Y410 PolarHBondContact O-N 3.42Å; E407-A411 WeakPolarHBondContact O-CB 3.29Å; E407-A411 PolarHBondContact O-N 3.27Å; E407-P463 WeakPolarHBondContact OE1-CB 3.5Å
408	A	95.3	Very high	95.9	Very high	33 Å²	33	54.7 Å²	54.7	27%	0.273	29%	0.288	S	S	.	.	H	α-helix	trans	-64.8	-43.2	177.9	0	0	0	0	0	111.1	H404 G405 F406	H404-A408 HydrophobicContact CB-CB 3.54Å; G405-A408 PolarHBondContact O-N 3.08Å; F406-A408 VanDerWaalsContact C-N 3.35Å; F406-A408 PolarHBondContact O-N 2.94Å
409	V	96.3	Very high	96	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-67	-47.4	175	179	0	0	0	0	110.5	L398 V402 G405 F406 A411 L412 L453 V456 L457 M460	L398-V409 HydrophobicContact CD1-CG1 3.82Å; V402-V409 HydrophobicContact CG2-CG2 4.12Å; G405-V409 PolarHBondContact O-N 3.42Å; F406-V409 PolarHBondContact O-N 2.96Å; V409-A411 VanDerWaalsContact C-N 3.26Å; V409-A411 PolarHBondContact O-N 2.98Å; V409-L412 WeakPolarHBondContact O-CB 3.49Å; V409-L412 WeakPolarHBondContact O-CG 3.39Å; V409-L412 PolarHBondContact O-N 3.23Å; V409-L453 HydrophobicContact CG1-CD1 3.49Å; V409-L453 VanDerWaalsContact CG1-CD1 3.49Å; V409-L453 WeakPolarHBondContact O-CD1 3.18Å; V409-V456 HydrophobicContact CG1-CG1 3.99Å; V409-L457 HydrophobicContact CB-CD2 3.91Å; V409-L457 HydrophobicContact CG1-CD2 3.6Å; V409-L457 HydrophobicContact CG1-CG 3.87Å; V409-M460 HydrophobicContact CB-SD 3.93Å; V409-M460 HydrophobicContact CG1-SD 4.14Å; V409-M460 HydrophobicContact CG2-CE 3.85Å; V409-M460 HydrophobicContact CG2-SD 3.64Å
410	Y	95.8	Very high	96.1	Very high	127 Å²	127	55.9 Å²	55.9	50%	0.498	28%	0.283	S	S	.	.	H	α-helix	trans	-58.2	-38.4	-179.8	-175.4	-97.2	0	0	0	112.2	F406 E407 L412 T413 L457	F406-Y410 HydrophobicContact CE1-CD2 4.16Å; F406-Y410 HydrophobicContact CE1-CG 4.28Å; F406-Y410 HydrophobicContact CZ-CD2 4.39Å; F406-Y410 VanDerWaalsContact O-CB 3.28Å; F406-Y410 WeakPolarHBondContact O-CB 3.36Å; F406-Y410 PolarHBondContact O-N 3.33Å; E407-Y410 PolarHBondContact O-N 3.42Å; Y410-L412 PolarHBondContact O-N 3.33Å; Y410-L412 VanDerWaalsContact O-N 3.17Å; Y410-T413 VanDerWaalsContact O-CB 3.31Å; Y410-T413 WeakPolarHBondContact O-CB 3.47Å; Y410-T413 PolarHBondContact O-N 3.37Å; Y410-T413 PolarHBondContact O-OG1 2.85Å; Y410-L457 HydrophobicContact CD2-CD1 4.09Å
411	A	96	Very high	96.2	Very high	50 Å²	50	50.1 Å²	50.1	41%	0.413	26%	0.255	S	S	.	.	H	α-helix	trans	-59.2	-26.1	175.6	0	0	0	0	0	113.5	E407 V409 T413 R414	E407-A411 WeakPolarHBondContact O-CB 3.29Å; E407-A411 PolarHBondContact O-N 3.27Å; V409-A411 VanDerWaalsContact C-N 3.26Å; V409-A411 PolarHBondContact O-N 2.98Å; A411-T413 PolarHBondContact O-N 3.04Å; A411-R414 PolarHBondContact O-N 3.45Å
412	L	97.3	Very high	96.4	Very high	13 Å²	13	49.6 Å²	49.6	7%	0.068	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-66.2	-12.6	176.5	-59	-176.8	0	0	0	113.6	F394 L397 L398 V409 Y410 R414 M415 L453	F394-L412 HydrophobicContact CE2-CB 4.26Å; L397-L412 HydrophobicContact CD1-CD2 4.38Å; L397-L412 HydrophobicContact CD2-CD2 3.56Å; L397-L412 HydrophobicContact CG-CD1 4.34Å; L397-L412 HydrophobicContact CG-CD2 3.67Å; L398-L412 HydrophobicContact CB-CD1 4.14Å; L398-L412 HydrophobicContact CD1-CD1 3.87Å; V409-L412 WeakPolarHBondContact O-CB 3.49Å; V409-L412 WeakPolarHBondContact O-CG 3.39Å; V409-L412 PolarHBondContact O-N 3.23Å; Y410-L412 PolarHBondContact O-N 3.33Å; Y410-L412 VanDerWaalsContact O-N 3.17Å; L412-R414 PolarHBondContact O-N 2.73Å; L412-R414 VanDerWaalsContact O-N 3.1Å; L412-M415 HydrophobicContact CB-CG 4.45Å; L412-M415 HydrophobicContact CD2-CG 4.04Å; L412-M415 WeakPolarHBondContact O-CA 3.17Å; L412-M415 VanDerWaalsContact O-CB 3.23Å; L412-M415 WeakPolarHBondContact O-CB 3.31Å; L412-M415 PolarHBondContact O-N 3.38Å; L412-L453 HydrophobicContact CB-CD1 4.02Å; L412-L453 HydrophobicContact CB-CD2 4.36Å; L412-L453 HydrophobicContact CD1-CD1 4.46Å
413	T	97.3	Very high	96.5	Very high	49 Å²	49	50.1 Å²	50.1	30%	0.301	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-51	-36.1	170.2	-55.2	0	0	0	0	111	Y410 A411 M415 C416 L450 L453	Y410-T413 VanDerWaalsContact O-CB 3.31Å; Y410-T413 WeakPolarHBondContact O-CB 3.47Å; Y410-T413 PolarHBondContact O-N 3.37Å; Y410-T413 PolarHBondContact O-OG1 2.85Å; A411-T413 PolarHBondContact O-N 3.04Å; T413-M415 VanDerWaalsContact C-N 3.27Å; T413-M415 PolarHBondContact O-N 3.08Å; T413-C416 PolarHBondContact O-N 2.94Å; T413-C416 VanDerWaalsContact O-N 3.16Å; T413-L450 HydrophobicContact CG2-CD2 4.11Å; T413-L453 WeakPolarHBondContact OG1-CD2 3.46Å
414	R	96.2	Very high	96.7	Very high	197 Å²	197	49.2 Å²	49.2	74%	0.743	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-64.8	-28.6	177.5	-62.7	179.7	-177	171	3.5	113.1	A411 L412 C416 T417	A411-R414 PolarHBondContact O-N 3.45Å; L412-R414 PolarHBondContact O-N 2.73Å; L412-R414 VanDerWaalsContact O-N 3.1Å; R414-C416 PolarHBondContact O-N 2.71Å; R414-T417 PolarHBondContact O-N 3.26Å
415	M	97.2	Very high	96.9	Very high	17 Å²	17	42.6 Å²	42.6	8%	0.084	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-67.3	-30.2	177.3	-59.3	-64.1	-72.6	0	0	111.4	P364 N365 Q368 F389 F394 L397 L412 T413 T417	P364-M415 HydrophobicContact CB-CE 4.26Å; P364-M415 HydrophobicContact CB-SD 3.42Å; P364-M415 WeakPolarHBondContact CB-SD 3.44Å; N365-M415 VanDerWaalsContact CA-CE 3.41Å; N365-M415 HydrophobicContact CB-CE 3.98Å; Q368-M415 HydrophobicContact CB-CE 4.45Å; F389-M415 VanDerWaalsContact CE2-O 3.29Å; F389-M415 WeakPolarHBondContact CE2-O 3.27Å; F394-M415 HydrophobicContact CD2-CB 4.02Å; F394-M415 HydrophobicContact CE2-CB 3.96Å; L397-M415 HydrophobicContact CD2-CE 3.64Å; L397-M415 HydrophobicContact CD2-CG 4.05Å; L397-M415 HydrophobicContact CD2-SD 4.25Å; L412-M415 HydrophobicContact CB-CG 4.45Å; L412-M415 HydrophobicContact CD2-CG 4.04Å; L412-M415 WeakPolarHBondContact O-CA 3.17Å; L412-M415 VanDerWaalsContact O-CB 3.23Å; L412-M415 WeakPolarHBondContact O-CB 3.31Å; L412-M415 PolarHBondContact O-N 3.38Å; T413-M415 VanDerWaalsContact C-N 3.27Å; T413-M415 PolarHBondContact O-N 3.08Å; M415-T417 VanDerWaalsContact C-N 3.27Å; M415-T417 PolarHBondContact O-N 3.29Å
416	C	98	Very high	97.2	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-82.5	-2.2	-178.2	-48.8	0	0	0	0	113.9	F394 T413 R414 F446 P449 L450	F394-C416 VanDerWaalsContact CZ-SG 3.55Å; T413-C416 PolarHBondContact O-N 2.94Å; T413-C416 VanDerWaalsContact O-N 3.16Å; R414-C416 PolarHBondContact O-N 2.71Å; C416-F446 PolarHBondContact O-N 2.65Å; C416-P449 HydrophobicContact CB-CB 4.36Å; C416-L450 HydrophobicContact CB-CD1 4.41Å; C416-L450 HydrophobicContact CB-CD2 3.55Å; C416-L450 HydrophobicContact CB-CG 3.58Å
417	T	98.2	Very high	97.4	Very high	24 Å²	24	39.9 Å²	39.9	15%	0.147	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	122.6	178	-60.3	0	0	0	0	110.5	R414 M415 E443 L444 H445	R414-T417 PolarHBondContact O-N 3.26Å; M415-T417 VanDerWaalsContact C-N 3.27Å; M415-T417 PolarHBondContact O-N 3.29Å; T417-E443 HydrophobicContact CG2-CG 3.51Å; T417-L444 WeakPolarHBondContact CA-O 3.26Å; T417-H445 PolarHBondContact OG1-CD2 2.73Å; T417-H445 PolarHBondContact OG1-NE2 2.86Å
418	I	98.6	Very high	97.5	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	137.7	175.2	-63.7	-173.2	0	0	0	109.1	V361 Q362 S363 I388 F389 V420 L444 F446	V361-I418 HydrophobicContact CG1-CG2 3.83Å; Q362-I418 WeakPolarHBondContact O-CG2 3.14Å; S363-I418 VanDerWaalsContact OG-CD1 3.25Å; S363-I418 WeakPolarHBondContact OG-CD1 3.43Å; I388-I418 HydrophobicContact CB-CD1 3.86Å; I388-I418 HydrophobicContact CD1-CD1 3.85Å; I388-I418 HydrophobicContact CD1-CG2 4.32Å; I388-I418 HydrophobicContact CG1-CD1 3.92Å; I388-I418 VanDerWaalsContact O-CD1 3.27Å; I388-I418 WeakPolarHBondContact O-CD1 3.46Å; F389-I418 HydrophobicContact CB-CD1 4.3Å; F389-I418 HydrophobicContact CD2-CD1 4.41Å; I418-V420 HydrophobicContact CG2-CG2 4.14Å; I418-L444 HydrophobicContact CB-CB 4.48Å; I418-L444 HydrophobicContact CB-CD1 4.46Å; I418-L444 HydrophobicContact CG2-CD1 4.33Å; I418-L444 PolarHBondContact N-O 3.24Å; I418-L444 PolarHBondContact O-N 2.84Å; I418-F446 HydrophobicContact CD1-CD2 4.48Å; I418-F446 HydrophobicContact CD1-CE2 3.31Å; I418-F446 HydrophobicContact CD1-CZ 3.64Å; I418-F446 HydrophobicContact CG1-CE2 3.83Å; I418-F446 HydrophobicContact CG1-CZ 4.26Å
419	R	98.8	Very high	97.4	Very high	86 Å²	86	44.1 Å²	44.1	33%	0.325	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	136.3	176.7	-56.2	-172.8	175.1	116	0.6	111.5	Q362 I435 W441 I442 E443	Q362-R419 PolarHBondContact N-O 2.73Å; Q362-R419 PolarHBondContact O-N 3.37Å; Q362-R419 VanDerWaalsContact O-N 3.09Å; R419-I435 HydrophobicContact CB-CD1 3.34Å; R419-I435 HydrophobicContact CG-CD1 4.15Å; R419-W441 HydrophobicContact CG-CZ3 4.32Å; R419-I442 WeakPolarHBondContact CA-O 3.41Å; R419-E443 HydrophobicContact CG-CG 4.3Å; R419-E443 IonicContact CZ-OE2 3.21Å; R419-E443 IonicContact NE-OE2 2.63Å; R419-E443 PolarHBondContact NE-OE2 3.25Å; R419-E443 IonicContact NH2-OE2 2.93Å; R419-E443 PolarHBondContact NH2-OE2 2.91Å
420	V	98.8	Very high	97.4	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	120.8	-178.2	-174.3	0	0	0	0	110.3	F342 I359 F360 V361 I418 W441 I442 L444	F342-V420 HydrophobicContact CE1-CG2 4.07Å; F342-V420 HydrophobicContact CZ-CB 4.49Å; F342-V420 HydrophobicContact CZ-CG1 4.45Å; F342-V420 HydrophobicContact CZ-CG2 4.13Å; I359-V420 HydrophobicContact CB-CG1 3.99Å; I359-V420 HydrophobicContact CD1-CG1 4.23Å; I359-V420 HydrophobicContact CG1-CG1 4.43Å; F360-V420 CarbonylContact O-C 3.54Å; F360-V420 VanDerWaalsContact O-CA 3.23Å; F360-V420 WeakPolarHBondContact O-CA 3.32Å; V361-V420 HydrophobicContact CB-CG2 4.46Å; V361-V420 HydrophobicContact CG1-CG2 4.23Å; V361-V420 HydrophobicContact CG2-CG1 4.11Å; V361-V420 HydrophobicContact CG2-CG2 4.02Å; I418-V420 HydrophobicContact CG2-CG2 4.14Å; V420-W441 CarbonylContact O-C 3.52Å; V420-W441 WeakPolarHBondContact O-CA 3.44Å; V420-W441 VanDerWaalsContact O-CB 3.3Å; V420-W441 WeakPolarHBondContact O-CB 3.18Å; V420-I442 HydrophobicContact CB-CD1 4.28Å; V420-I442 HydrophobicContact CB-CG1 3.83Å; V420-I442 PolarHBondContact N-O 2.96Å; V420-I442 PolarHBondContact O-N 3.11Å; V420-L444 HydrophobicContact CB-CD1 4.45Å; V420-L444 HydrophobicContact CG2-CD1 3.67Å
421	S	98.9	Very high	97.5	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	139.1	172.7	-177.1	0	0	0	0	110.7	I359 F360 K424 T438 C440	I359-S421 CarbonylContact C-O 3.41Å; I359-S421 WeakPolarHBondContact CA-O 3.23Å; F360-S421 PolarHBondContact N-O 2.72Å; F360-S421 PolarHBondContact O-N 2.89Å; S421-K424 WeakPolarHBondContact CB-O 3.44Å; S421-K424 PolarHBondContact OG-O 3.4Å; S421-T438 WeakPolarHBondContact OG-CB 3.43Å; S421-T438 WeakPolarHBondContact OG-CG2 3.47Å; S421-T438 PolarHBondContact OG-OG1 3.49Å; S421-T438 VanDerWaalsContact OG-OG1 3.12Å; S421-C440 PolarHBondContact OG-O 3.39Å
422	F	98.8	Very high	97.6	Very high	2 Å²	2	54.5 Å²	54.5	1%	0.009	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	138.7	174	-63.5	-87.4	0	0	0	110.2	V303 L317 I336 A340 I359 K424 C440 I442	V303-F422 HydrophobicContact CB-CZ 4.19Å; V303-F422 HydrophobicContact CG1-CE2 4.37Å; V303-F422 HydrophobicContact CG1-CZ 3.86Å; L317-F422 HydrophobicContact CD1-CE2 4Å; L317-F422 HydrophobicContact CD1-CZ 4.4Å; I336-F422 HydrophobicContact CD1-CB 4.43Å; I336-F422 HydrophobicContact CD1-CG 4.4Å; I336-F422 HydrophobicContact CG1-CB 3.99Å; I336-F422 HydrophobicContact CG1-CD1 4.49Å; I336-F422 HydrophobicContact CG1-CG 4.2Å; I336-F422 HydrophobicContact CG2-CD1 3.98Å; I336-F422 HydrophobicContact CG2-CE1 4.2Å; I336-F422 HydrophobicContact CG2-CG 4.44Å; A340-F422 HydrophobicContact CB-CE1 3.94Å; A340-F422 HydrophobicContact CB-CZ 4.46Å; I359-F422 HydrophobicContact CG2-CD1 3.77Å; I359-F422 HydrophobicContact CG2-CE1 4.14Å; F422-K424 PolarHBondContact O-N 3.12Å; F422-C440 HydrophobicContact CB-CB 4.4Å; F422-C440 PolarHBondContact N-O 3.08Å; F422-I442 HydrophobicContact CE2-CD1 4.17Å; F422-I442 HydrophobicContact CE2-CG1 4.02Å; F422-I442 HydrophobicContact CE2-CG2 3.97Å; F422-I442 HydrophobicContact CZ-CD1 4.09Å; F422-I442 HydrophobicContact CZ-CG1 4.42Å
423	V	98.3	Very high	97.6	Very high	18 Å²	18	59.9 Å²	59.9	11%	0.109	28%	0.281	C	S	.	.	S	Bend	trans	69.4	-42.4	170.4	-172.3	0	0	0	0	114.7	H335 Y357 A358	H335-V423 HydrophobicContact CB-CG1 4.21Å; H335-V423 HydrophobicContact CB-CG2 3.66Å; Y357-V423 HydrophobicContact CD1-CG1 4.13Å; Y357-V423 HydrophobicContact CG-CG1 4.38Å; A358-V423 WeakPolarHBondContact O-CA 3.37Å; A358-V423 PolarHBondContact O-N 3.34Å
424	K	98.2	Very high	97.6	Very high	86 Å²	86	61.1 Å²	61.1	37%	0.374	29%	0.289	S	S	.	.			trans	-116.7	126.7	-175.5	-54.9	-58.1	-178.8	-171.4	0	110.9	F360 S421 F422 P439	F360-K424 VanDerWaalsContact CD2-C 3.43Å; F360-K424 WeakPolarHBondContact CD2-O 3.44Å; F360-K424 VanDerWaalsContact CE2-C 3.43Å; S421-K424 WeakPolarHBondContact CB-O 3.44Å; S421-K424 PolarHBondContact OG-O 3.4Å; F422-K424 PolarHBondContact O-N 3.12Å; K424-P439 HydrophobicContact CB-CG 4.34Å; K424-P439 HydrophobicContact CG-CG 3.77Å
425	G	97.7	Very high	97.7	Very high	4 Å²	4	52.4 Å²	52.4	4%	0.041	26%	0.257	C	S	.	.			trans	-78.4	163	172.4	0	0	0	0	0	113.5	F360	F360-G425 VanDerWaalsContact CD1-CA 3.41Å
426	W	98.6	Very high	97.8	Very high	6 Å²	6	54.4 Å²	54.4	2%	0.023	27%	0.27	C	S	.	.			trans	-143.4	168.6	171.8	82.6	97.7	0	0	0	109.6	F360 Q362 V377 Y430 R432 I435 T438	F360-W426 HydrophobicContact CB-CE3 4.09Å; F360-W426 HydrophobicContact CB-CZ3 3.68Å; F360-W426 WeakPolarHBondContact O-CH2 3.31Å; F360-W426 VanDerWaalsContact O-CZ3 3.23Å; F360-W426 WeakPolarHBondContact O-CZ3 3.19Å; Q362-W426 HydrophobicContact CB-CH2 3.97Å; Q362-W426 HydrophobicContact CB-CZ2 3.5Å; Q362-W426 HydrophobicContact CG-CZ2 4.48Å; V377-W426 WeakPolarHBondContact CB-O 3.32Å; V377-W426 HydrophobicContact CG1-CD2 4.1Å; V377-W426 HydrophobicContact CG1-CE3 3.87Å; V377-W426 HydrophobicContact CG1-CH2 3.88Å; V377-W426 HydrophobicContact CG1-CZ2 4.12Å; V377-W426 HydrophobicContact CG1-CZ3 3.73Å; V377-W426 HydrophobicContact CG2-CD2 3.96Å; V377-W426 VanDerWaalsContact CG2-CE2 3.48Å; V377-W426 HydrophobicContact CG2-CG 4.35Å; V377-W426 HydrophobicContact CG2-CH2 4.34Å; V377-W426 HydrophobicContact CG2-CZ2 3.73Å; V377-W426 WeakPolarHBondContact CG2-O 3.48Å; W426-Y430 WeakPolarHBondContact O-CD2 3.34Å; W426-R432 CarbonylContact C-O 3.48Å; W426-R432 WeakPolarHBondContact CA-O 3.44Å; W426-R432 HydrophobicContact CB-CB 3.91Å; W426-R432 WeakPolarHBondContact CB-O 3.43Å; W426-I435 HydrophobicContact CD2-CB 4.09Å; W426-I435 HydrophobicContact CD2-CG1 4.04Å; W426-I435 HydrophobicContact CE3-CG1 4.2Å; W426-I435 HydrophobicContact CG-CB 4.32Å; W426-I435 HydrophobicContact CH2-CD1 3.69Å; W426-I435 HydrophobicContact CH2-CG1 4.21Å; W426-I435 HydrophobicContact CZ2-CB 4.16Å; W426-I435 HydrophobicContact CZ2-CD1 3.65Å; W426-I435 HydrophobicContact CZ2-CG1 4.01Å; W426-I435 HydrophobicContact CZ3-CD1 4.15Å; W426-I435 HydrophobicContact CZ3-CG1 4.29Å; W426-T438 HydrophobicContact CB-CG2 3.82Å; W426-T438 HydrophobicContact CD2-CG2 4.37Å; W426-T438 HydrophobicContact CE3-CG2 4.1Å; W426-T438 HydrophobicContact CG-CG2 4.3Å
427	G	97.4	Very high	97.8	Very high	12 Å²	12	56 Å²	56	12%	0.124	28%	0.283	C	S	.	.	S	Bend	trans	107.1	-166.6	-179.5	0	0	0	0	0	112.2	D429 Y430 R432 Q433	G427-D429 PolarHBondContact O-N 3.02Å; G427-D429 VanDerWaalsContact O-N 3.12Å; G427-Y430 PolarHBondContact O-N 3.35Å; G427-R432 PolarHBondContact N-O 3.01Å; G427-Q433 PolarHBondContact O-NE2 2.93Å
428	A	95.5	Very high	97.8	Very high	93 Å²	93	54.8 Å²	54.8	77%	0.769	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-37.7	-170.6	0	0	0	0	0	113.7	Y430	A428-Y430 VanDerWaalsContact C-N 3.34Å; A428-Y430 PolarHBondContact O-N 3.12Å
429	D	93.2	Very high	97.8	Very high	142 Å²	142	55 Å²	55	76%	0.759	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	4.7	-175.2	-53	-47.1	0	0	0	114.2	G427	G427-D429 PolarHBondContact O-N 3.02Å; G427-D429 VanDerWaalsContact O-N 3.12Å
430	Y	96.9	Very high	97.8	Very high	71 Å²	71	51 Å²	51	28%	0.278	26%	0.262	S	S	.	.	S	Bend	trans	-128.8	152.4	-172.5	-61.9	-81.2	0	0	0	111.9	F360 W426 G427 A428 R432 Q433	F360-Y430 HydrophobicContact CD1-CE2 4.37Å; F360-Y430 AromaticContact CE1-CE1 3.88Å; F360-Y430 HydrophobicContact CE1-CE1 3.88Å; F360-Y430 HydrophobicContact CE1-CE2 4.4Å; F360-Y430 AromaticContact CE1-CZ 3.61Å; F360-Y430 WeakPolarHBondContact CE1-OH 3.48Å; W426-Y430 WeakPolarHBondContact O-CD2 3.34Å; G427-Y430 PolarHBondContact O-N 3.35Å; A428-Y430 VanDerWaalsContact C-N 3.34Å; A428-Y430 PolarHBondContact O-N 3.12Å; Y430-R432 PolarHBondContact O-N 3.33Å; Y430-R432 VanDerWaalsContact O-N 3.13Å; Y430-Q433 PolarHBondContact O-NE2 3.4Å
431	R	97	Very high	97.8	Very high	244 Å²	244	51.5 Å²	51.5	92%	0.921	26%	0.264	S	S	*	.	S	Bend	trans	-55.7	-31.8	172.8	-179.2	178.1	172.6	-172.8	-0.6	112.8
432	R	97.9	Very high	97.8	Very high	81 Å²	81	51.5 Å²	51.5	31%	0.306	26%	0.264	S	S	.	.			trans	-86.4	117	178.9	-66.7	174	-178.6	77.5	6.3	108.7	W426 G427 Y430 A437	W426-R432 CarbonylContact C-O 3.48Å; W426-R432 WeakPolarHBondContact CA-O 3.44Å; W426-R432 HydrophobicContact CB-CB 3.91Å; W426-R432 WeakPolarHBondContact CB-O 3.43Å; G427-R432 PolarHBondContact N-O 3.01Å; Y430-R432 PolarHBondContact O-N 3.33Å; Y430-R432 VanDerWaalsContact O-N 3.13Å; R432-A437 HydrophobicContact CB-CB 4.08Å; R432-A437 WeakPolarHBondContact CD-O 3.4Å; R432-A437 HydrophobicContact CG-CB 4.03Å; R432-A437 PolarHBondContact NE-O 2.78Å; R432-A437 VanDerWaalsContact NE-O 3.1Å
433	Q	97.6	Very high	97.8	Very high	125 Å²	125	52.5 Å²	52.5	58%	0.584	27%	0.268	S	S	*	.			trans	-87.4	-27.7	-178.5	-64	-58.6	-48.3	0	0	112.9	G427 Y430	G427-Q433 PolarHBondContact O-NE2 2.93Å; Y430-Q433 PolarHBondContact O-NE2 3.4Å
434	T	97.9	Very high	97.8	Very high	76 Å²	76	51.7 Å²	51.7	47%	0.466	26%	0.263	S	S	.	.	S	Bend	trans	-115.8	153.2	178.4	64.9	0	0	0	0	111.1	T436 A437	T434-T436 PolarHBondContact O-N 3.39Å; T434-T436 PolarHBondContact OG1-OG1 3.36Å; T434-A437 WeakPolarHBondContact O-CB 3.41Å; T434-A437 PolarHBondContact O-N 3.29Å
435	I	98.3	Very high	97.8	Very high	14 Å²	14	50.7 Å²	50.7	7%	0.072	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-65.3	-30.4	175.7	-163.8	171.9	0	0	0	112.3	R419 W426 A437 T438 W441	R419-I435 HydrophobicContact CB-CD1 3.34Å; R419-I435 HydrophobicContact CG-CD1 4.15Å; W426-I435 HydrophobicContact CD2-CB 4.09Å; W426-I435 HydrophobicContact CD2-CG1 4.04Å; W426-I435 HydrophobicContact CE3-CG1 4.2Å; W426-I435 HydrophobicContact CG-CB 4.32Å; W426-I435 HydrophobicContact CH2-CD1 3.69Å; W426-I435 HydrophobicContact CH2-CG1 4.21Å; W426-I435 HydrophobicContact CZ2-CB 4.16Å; W426-I435 HydrophobicContact CZ2-CD1 3.65Å; W426-I435 HydrophobicContact CZ2-CG1 4.01Å; W426-I435 HydrophobicContact CZ3-CD1 4.15Å; W426-I435 HydrophobicContact CZ3-CG1 4.29Å; I435-A437 PolarHBondContact O-N 2.88Å; I435-T438 HydrophobicContact CG1-CG2 4.42Å; I435-T438 WeakPolarHBondContact O-CB 3.48Å; I435-T438 WeakPolarHBondContact O-CG2 3.35Å; I435-T438 PolarHBondContact O-N 3.44Å; I435-T438 PolarHBondContact O-OG1 3.14Å; I435-W441 HydrophobicContact CD1-CB 3.97Å; I435-W441 HydrophobicContact CD1-CD2 3.62Å; I435-W441 HydrophobicContact CD1-CE3 3.4Å; I435-W441 VanDerWaalsContact CD1-CE3 3.4Å; I435-W441 HydrophobicContact CD1-CG 3.9Å; I435-W441 HydrophobicContact CD1-CZ3 4.08Å; I435-W441 HydrophobicContact CG1-CB 4.05Å; I435-W441 HydrophobicContact CG1-CD2 3.72Å; I435-W441 HydrophobicContact CG1-CE3 4.02Å; I435-W441 HydrophobicContact CG1-CG 3.74Å; I435-W441 HydrophobicContact CG2-CD2 4.46Å; I435-W441 HydrophobicContact CG2-CE3 4.5Å; I435-W441 HydrophobicContact CG2-CH2 4.28Å; I435-W441 HydrophobicContact CG2-CZ2 4.24Å; I435-W441 HydrophobicContact CG2-CZ3 4.39Å
436	T	98.3	Very high	97.8	Very high	59 Å²	59	50.7 Å²	50.7	36%	0.362	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-65.1	-11	176.8	52.3	0	0	0	0	113.7	M286 N287 T434 W441	M286-T436 CarbonylContact C-O 3.6Å; M286-T436 WeakPolarHBondContact CA-O 3.47Å; M286-T436 WeakPolarHBondContact CB-O 3.3Å; N287-T436 HydrophobicContact CB-CG2 4.17Å; T434-T436 PolarHBondContact O-N 3.39Å; T434-T436 PolarHBondContact OG1-OG1 3.36Å; T436-W441 HydrophobicContact CG2-CZ2 4.33Å
437	A	98	Very high	97.7	Very high	32 Å²	32	52.2 Å²	52.2	26%	0.264	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-89.4	-5.7	170.8	0	0	0	0	0	113.3	R432 T434 I435	R432-A437 HydrophobicContact CB-CB 4.08Å; R432-A437 WeakPolarHBondContact CD-O 3.4Å; R432-A437 HydrophobicContact CG-CB 4.03Å; R432-A437 PolarHBondContact NE-O 2.78Å; R432-A437 VanDerWaalsContact NE-O 3.1Å; T434-A437 WeakPolarHBondContact O-CB 3.41Å; T434-A437 PolarHBondContact O-N 3.29Å; I435-A437 PolarHBondContact O-N 2.88Å
438	T	98.4	Very high	97.7	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.262	C	S	.	.	S	Bend	trans	-83.6	142.6	174.9	80.4	0	0	0	0	110.7	M286 S421 W426 I435 C440 W441	M286-T438 WeakPolarHBondContact CA-O 3.41Å; M286-T438 PolarHBondContact N-O 2.77Å; S421-T438 WeakPolarHBondContact OG-CB 3.43Å; S421-T438 WeakPolarHBondContact OG-CG2 3.47Å; S421-T438 PolarHBondContact OG-OG1 3.49Å; S421-T438 VanDerWaalsContact OG-OG1 3.12Å; W426-T438 HydrophobicContact CB-CG2 3.82Å; W426-T438 HydrophobicContact CD2-CG2 4.37Å; W426-T438 HydrophobicContact CE3-CG2 4.1Å; W426-T438 HydrophobicContact CG-CG2 4.3Å; I435-T438 HydrophobicContact CG1-CG2 4.42Å; I435-T438 WeakPolarHBondContact O-CB 3.48Å; I435-T438 WeakPolarHBondContact O-CG2 3.35Å; I435-T438 PolarHBondContact O-N 3.44Å; I435-T438 PolarHBondContact O-OG1 3.14Å; T438-C440 VanDerWaalsContact C-N 3.34Å; T438-C440 PolarHBondContact O-N 3.37Å; T438-W441 VanDerWaalsContact OG1-CD1 3.25Å
439	P	98.4	Very high	97.8	Very high	5 Å²	5	47.4 Å²	47.4	3%	0.032	23%	0.226	C	C	.	.	S	Bend	trans	-68.7	-31.5	-174.5	25	-33.2	0	0	0	113.5	E285 V329 A332 K424	E285-P439 WeakPolarHBondContact CA-O 3.44Å; V329-P439 HydrophobicContact CB-CB 4.37Å; V329-P439 HydrophobicContact CG2-CB 3.88Å; A332-P439 HydrophobicContact CB-CB 3.67Å; A332-P439 HydrophobicContact CB-CG 3.42Å; A332-P439 VanDerWaalsContact CB-CG 3.42Å; K424-P439 HydrophobicContact CB-CG 4.34Å; K424-P439 HydrophobicContact CG-CG 3.77Å
440	C	98.7	Very high	98	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	20%	0.201	C	C	.	.	S	Bend	trans	-146.6	117.3	-174.6	-62.6	0	0	0	0	109.4	Y283 R333 I336 S421 F422 T438	Y283-C440 HydrophobicContact CE2-CB 4.07Å; Y283-C440 PolarHBondContact OH-SG 3.25Å; Y283-C440 VanDerWaalsContact OH-SG 3.33Å; R333-C440 VanDerWaalsContact CG-SG 3.53Å; I336-C440 HydrophobicContact CD1-CB 4.21Å; S421-C440 PolarHBondContact OG-O 3.39Å; F422-C440 HydrophobicContact CB-CB 4.4Å; F422-C440 PolarHBondContact N-O 3.08Å; T438-C440 VanDerWaalsContact C-N 3.34Å; T438-C440 PolarHBondContact O-N 3.37Å
441	W	98.8	Very high	98	Very high	12 Å²	12	43.4 Å²	43.4	5%	0.045	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	162.3	176.2	62.7	-81.5	0	0	0	111.5	Y283 Y284 M286 R419 V420 I435 T436 T438 E443	Y283-W441 VanDerWaalsContact CD2-O 3.25Å; Y283-W441 WeakPolarHBondContact CD2-O 3.17Å; Y284-W441 VanDerWaalsContact CB-CZ2 3.49Å; Y284-W441 AromaticContact CD1-CH2 4Å; Y284-W441 HydrophobicContact CD1-CH2 4Å; Y284-W441 AromaticContact CD1-CZ2 3.72Å; Y284-W441 HydrophobicContact CD1-CZ2 3.72Å; Y284-W441 HydrophobicContact CD2-CD2 4.19Å; Y284-W441 AromaticContact CD2-CE3 3.94Å; Y284-W441 HydrophobicContact CD2-CE3 3.94Å; Y284-W441 AromaticContact CD2-CH2 3.53Å; Y284-W441 HydrophobicContact CD2-CH2 3.53Å; Y284-W441 AromaticContact CD2-CZ2 3.79Å; Y284-W441 HydrophobicContact CD2-CZ2 3.79Å; Y284-W441 AromaticContact CD2-CZ3 3.63Å; Y284-W441 HydrophobicContact CD2-CZ3 3.63Å; Y284-W441 HydrophobicContact CE1-CH2 4.25Å; Y284-W441 HydrophobicContact CE1-CZ2 4.37Å; Y284-W441 AromaticContact CE2-CH2 3.8Å; Y284-W441 HydrophobicContact CE2-CH2 3.8Å; Y284-W441 HydrophobicContact CE2-CZ2 4.41Å; Y284-W441 AromaticContact CE2-CZ3 3.94Å; Y284-W441 HydrophobicContact CE2-CZ3 3.94Å; Y284-W441 HydrophobicContact CG-CD2 4.19Å; Y284-W441 AromaticContact CG-CE2 3.7Å; Y284-W441 HydrophobicContact CG-CE3 4.38Å; Y284-W441 AromaticContact CG-CH2 3.65Å; Y284-W441 HydrophobicContact CG-CH2 3.65Å; Y284-W441 AromaticContact CG-CZ2 3.4Å; Y284-W441 HydrophobicContact CG-CZ2 3.4Å; Y284-W441 HydrophobicContact CG-CZ3 4.15Å; Y284-W441 PolarHBondContact N-O 3.47Å; Y284-W441 PolarHBondContact O-N 3.04Å; M286-W441 PolarHBondContact O-NE1 3.12Å; R419-W441 HydrophobicContact CG-CZ3 4.32Å; V420-W441 CarbonylContact O-C 3.52Å; V420-W441 WeakPolarHBondContact O-CA 3.44Å; V420-W441 VanDerWaalsContact O-CB 3.3Å; V420-W441 WeakPolarHBondContact O-CB 3.18Å; I435-W441 HydrophobicContact CD1-CB 3.97Å; I435-W441 HydrophobicContact CD1-CD2 3.62Å; I435-W441 HydrophobicContact CD1-CE3 3.4Å; I435-W441 VanDerWaalsContact CD1-CE3 3.4Å; I435-W441 HydrophobicContact CD1-CG 3.9Å; I435-W441 HydrophobicContact CD1-CZ3 4.08Å; I435-W441 HydrophobicContact CG1-CB 4.05Å; I435-W441 HydrophobicContact CG1-CD2 3.72Å; I435-W441 HydrophobicContact CG1-CE3 4.02Å; I435-W441 HydrophobicContact CG1-CG 3.74Å; I435-W441 HydrophobicContact CG2-CD2 4.46Å; I435-W441 HydrophobicContact CG2-CE3 4.5Å; I435-W441 HydrophobicContact CG2-CH2 4.28Å; I435-W441 HydrophobicContact CG2-CZ2 4.24Å; I435-W441 HydrophobicContact CG2-CZ3 4.39Å; T436-W441 HydrophobicContact CG2-CZ2 4.33Å; T438-W441 VanDerWaalsContact OG1-CD1 3.25Å; W441-E443 HydrophobicContact CZ3-CB 3.99Å
442	I	98.9	Very high	97.9	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	151.6	176.6	56.2	171.6	0	0	0	110.7	V281 S282 Y283 V303 F342 R419 V420 F422 L444	V281-I442 HydrophobicContact CG1-CB 3.83Å; V281-I442 HydrophobicContact CG1-CD1 3.95Å; V281-I442 HydrophobicContact CG1-CG1 4.43Å; V281-I442 HydrophobicContact CG1-CG2 4.03Å; S282-I442 CarbonylContact O-C 3.51Å; S282-I442 WeakPolarHBondContact O-CA 3.26Å; Y283-I442 HydrophobicContact CD2-CG2 3.95Å; V303-I442 HydrophobicContact CB-CD1 4.38Å; V303-I442 HydrophobicContact CG1-CD1 4.32Å; V303-I442 HydrophobicContact CG1-CG2 4.29Å; V303-I442 HydrophobicContact CG2-CD1 4.06Å; F342-I442 HydrophobicContact CE2-CD1 3.68Å; F342-I442 HydrophobicContact CZ-CD1 3.69Å; R419-I442 WeakPolarHBondContact CA-O 3.41Å; V420-I442 HydrophobicContact CB-CD1 4.28Å; V420-I442 HydrophobicContact CB-CG1 3.83Å; V420-I442 PolarHBondContact N-O 2.96Å; V420-I442 PolarHBondContact O-N 3.11Å; F422-I442 HydrophobicContact CE2-CD1 4.17Å; F422-I442 HydrophobicContact CE2-CG1 4.02Å; F422-I442 HydrophobicContact CE2-CG2 3.97Å; F422-I442 HydrophobicContact CZ-CD1 4.09Å; F422-I442 HydrophobicContact CZ-CG1 4.42Å; I442-L444 HydrophobicContact CD1-CD1 3.95Å; I442-L444 HydrophobicContact CD1-CG 4.44Å; I442-L444 HydrophobicContact CG1-CD1 4.14Å
443	E	98.8	Very high	97.9	Very high	23 Å²	23	28.2 Å²	28.2	11%	0.107	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	121.1	170.6	-167.2	164.4	59.8	0	0	108.3	V281 S282 Y284 T417 R419 W441 H445	V281-E443 WeakPolarHBondContact CA-O 3.46Å; S282-E443 PolarHBondContact N-O 3.38Å; S282-E443 PolarHBondContact O-N 3.38Å; Y284-E443 HydrophobicContact CE2-CB 3.91Å; Y284-E443 PolarHBondContact OH-OE1 3.12Å; T417-E443 HydrophobicContact CG2-CG 3.51Å; R419-E443 HydrophobicContact CG-CG 4.3Å; R419-E443 IonicContact CZ-OE2 3.21Å; R419-E443 IonicContact NE-OE2 2.63Å; R419-E443 PolarHBondContact NE-OE2 3.25Å; R419-E443 IonicContact NH2-OE2 2.93Å; R419-E443 PolarHBondContact NH2-OE2 2.91Å; W441-E443 HydrophobicContact CZ3-CB 3.99Å; E443-H445 IonicContact OE1-NE2 2.71Å
444	L	98.7	Very high	97.8	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	129.9	174.9	-58.5	96.4	0	0	0	108.9	S280 V281 F342 T417 I418 V420 I442 F446	S280-L444 CarbonylContact O-C 3.59Å; S280-L444 WeakPolarHBondContact O-CA 3.23Å; V281-L444 HydrophobicContact CG2-CD2 4.17Å; V281-L444 HydrophobicContact CG2-CG 4.18Å; F342-L444 HydrophobicContact CD1-CD2 3.7Å; F342-L444 HydrophobicContact CD2-CD2 4.22Å; F342-L444 HydrophobicContact CE1-CD1 4.15Å; F342-L444 HydrophobicContact CE1-CD2 3.89Å; F342-L444 HydrophobicContact CE2-CD2 4.4Å; F342-L444 HydrophobicContact CG-CD2 3.88Å; F342-L444 HydrophobicContact CZ-CD1 4.29Å; F342-L444 HydrophobicContact CZ-CD2 4.25Å; T417-L444 WeakPolarHBondContact CA-O 3.26Å; I418-L444 HydrophobicContact CB-CB 4.48Å; I418-L444 HydrophobicContact CB-CD1 4.46Å; I418-L444 HydrophobicContact CG2-CD1 4.33Å; I418-L444 PolarHBondContact N-O 3.24Å; I418-L444 PolarHBondContact O-N 2.84Å; V420-L444 HydrophobicContact CB-CD1 4.45Å; V420-L444 HydrophobicContact CG2-CD1 3.67Å; I442-L444 HydrophobicContact CD1-CD1 3.95Å; I442-L444 HydrophobicContact CD1-CG 4.44Å; I442-L444 HydrophobicContact CG1-CD1 4.14Å; L444-F446 HydrophobicContact CB-CE1 4.41Å
445	H	98.4	Very high	97.7	Very high	65 Å²	65	28.2 Å²	28.2	30%	0.301	14%	0.143	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	127.3	169.2	-70.3	173.1	0	0	0	109.4	C279 S280 T417 E443 L450	C279-H445 CarbonylContact C-O 3.58Å; C279-H445 WeakPolarHBondContact CA-O 3.49Å; C279-H445 WeakPolarHBondContact CB-O 3.34Å; S280-H445 PolarHBondContact N-O 3.35Å; S280-H445 PolarHBondContact O-N 2.91Å; T417-H445 PolarHBondContact OG1-CD2 2.73Å; T417-H445 PolarHBondContact OG1-NE2 2.86Å; E443-H445 IonicContact OE1-NE2 2.71Å; H445-L450 HydrophobicContact CB-CD1 3.91Å
446	F	97.9	Very high	97.5	Very high	4 Å²	4	27.6 Å²	27.6	2%	0.018	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	107.7	175.8	-59.8	-43.7	0	0	0	111	W278 C279 V349 I388 F389 C416 I418 L444 G448 P449 L450	W278-F446 HydrophobicContact CE3-CD1 4.28Å; W278-F446 HydrophobicContact CE3-CE1 4.41Å; W278-F446 HydrophobicContact CZ3-CD1 4.16Å; W278-F446 AromaticContact CZ3-CE1 3.83Å; W278-F446 HydrophobicContact CZ3-CE1 3.83Å; C279-F446 HydrophobicContact CB-CD1 3.83Å; C279-F446 HydrophobicContact CB-CE1 4.22Å; V349-F446 HydrophobicContact CB-CE1 4.39Å; V349-F446 HydrophobicContact CB-CZ 4.08Å; V349-F446 HydrophobicContact CG1-CE1 4.01Å; V349-F446 HydrophobicContact CG1-CZ 3.91Å; V349-F446 HydrophobicContact CG2-CD1 4.44Å; V349-F446 HydrophobicContact CG2-CE1 4.02Å; V349-F446 HydrophobicContact CG2-CZ 4.04Å; I388-F446 HydrophobicContact CD1-CZ 4.09Å; F389-F446 HydrophobicContact CB-CD2 4.14Å; F389-F446 HydrophobicContact CB-CE2 3.49Å; F389-F446 VanDerWaalsContact CB-CE2 3.49Å; F389-F446 HydrophobicContact CB-CZ 4.13Å; F389-F446 HydrophobicContact CD1-CD2 4.08Å; F389-F446 HydrophobicContact CD1-CE2 4.3Å; F389-F446 AromaticContact CD2-CD2 3.6Å; F389-F446 HydrophobicContact CD2-CD2 3.6Å; F389-F446 AromaticContact CD2-CE2 3.55Å; F389-F446 HydrophobicContact CD2-CE2 3.55Å; F389-F446 HydrophobicContact CE1-CD2 4.41Å; F389-F446 AromaticContact CE2-CD2 3.96Å; F389-F446 HydrophobicContact CE2-CD2 3.96Å; F389-F446 HydrophobicContact CE2-CE2 4.35Å; F389-F446 AromaticContact CG-CD2 3.66Å; F389-F446 HydrophobicContact CG-CD2 3.66Å; F389-F446 AromaticContact CG-CE2 3.52Å; F389-F446 HydrophobicContact CG-CE2 3.52Å; F389-F446 HydrophobicContact CZ-CD2 4.34Å; C416-F446 PolarHBondContact O-N 2.65Å; I418-F446 HydrophobicContact CD1-CD2 4.48Å; I418-F446 HydrophobicContact CD1-CE2 3.31Å; I418-F446 HydrophobicContact CD1-CZ 3.64Å; I418-F446 HydrophobicContact CG1-CE2 3.83Å; I418-F446 HydrophobicContact CG1-CZ 4.26Å; L444-F446 HydrophobicContact CB-CE1 4.41Å; F446-G448 PolarHBondContact O-N 2.97Å; F446-P449 HydrophobicContact CB-CB 4.4Å; F446-P449 HydrophobicContact CB-CG 3.87Å; F446-P449 WeakPolarHBondContact O-CD 3.09Å; F446-L450 WeakPolarHBondContact O-CB 3.3Å; F446-L450 WeakPolarHBondContact O-CG 3.47Å; F446-L450 PolarHBondContact O-N 3.02Å
447	N	97.5	Very high	97.4	Very high	39 Å²	39	25.8 Å²	25.8	21%	0.209	13%	0.128	C	C	.	.	H	α-helix	trans	-69.2	-34.8	-168.1	-66.4	-24	0	0	0	112.4	P275 F277 W278 S280 L450 Q451	P275-N447 HydrophobicContact CB-CB 4.35Å; P275-N447 HydrophobicContact CG-CB 3.77Å; F277-N447 VanDerWaalsContact O-CB 3.25Å; F277-N447 WeakPolarHBondContact O-CB 3.28Å; F277-N447 PolarHBondContact O-ND2 3.29Å; W278-N447 PolarHBondContact O-N 2.98Å; S280-N447 PolarHBondContact OG-ND2 2.86Å; N447-L450 PolarHBondContact O-N 2.94Å; N447-Q451 VanDerWaalsContact O-CB 3.25Å; N447-Q451 WeakPolarHBondContact O-CB 3.33Å; N447-Q451 PolarHBondContact O-N 3.08Å
448	G	96.3	Very high	97.1	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-63.3	-57.5	177.7	0	0	0	0	0	111.8	F446 L450 Q451 W452	F446-G448 PolarHBondContact O-N 2.97Å; G448-L450 VanDerWaalsContact C-N 3.31Å; G448-L450 PolarHBondContact O-N 2.89Å; G448-Q451 PolarHBondContact O-N 3.21Å; G448-W452 WeakPolarHBondContact O-CB 3.42Å; G448-W452 PolarHBondContact O-N 2.8Å
449	P	97.2	Very high	96.8	Very high	4 Å²	4	32.1 Å²	32.1	3%	0.026	16%	0.159	C	C	.	.	H	α-helix	trans	-52.5	-43.3	172	-31.5	37.4	0	0	0	114.2	F389 F394 C416 F446 W452 L453	F389-P449 HydrophobicContact CE1-CB 4.3Å; F389-P449 HydrophobicContact CE1-CG 3.53Å; F389-P449 HydrophobicContact CZ-CB 3.97Å; F389-P449 HydrophobicContact CZ-CG 3.7Å; F394-P449 HydrophobicContact CD1-CB 3.9Å; F394-P449 HydrophobicContact CE1-CB 3.7Å; F394-P449 HydrophobicContact CG-CB 4.46Å; F394-P449 HydrophobicContact CZ-CB 4.11Å; C416-P449 HydrophobicContact CB-CB 4.36Å; F446-P449 HydrophobicContact CB-CB 4.4Å; F446-P449 HydrophobicContact CB-CG 3.87Å; F446-P449 WeakPolarHBondContact O-CD 3.09Å; P449-W452 PolarHBondContact O-N 3.47Å; P449-L453 WeakPolarHBondContact O-CB 3.45Å; P449-L453 PolarHBondContact O-N 2.87Å
450	L	97.8	Very high	96.4	Very high	45 Å²	45	33.3 Å²	33.3	24%	0.236	16%	0.164	C	C	.	.	H	α-helix	trans	-63.5	-45.9	176.9	-76.2	169.3	0	0	0	112.5	T413 C416 H445 F446 N447 G448 W452 L453 D454	T413-L450 HydrophobicContact CG2-CD2 4.11Å; C416-L450 HydrophobicContact CB-CD1 4.41Å; C416-L450 HydrophobicContact CB-CD2 3.55Å; C416-L450 HydrophobicContact CB-CG 3.58Å; H445-L450 HydrophobicContact CB-CD1 3.91Å; F446-L450 WeakPolarHBondContact O-CB 3.3Å; F446-L450 WeakPolarHBondContact O-CG 3.47Å; F446-L450 PolarHBondContact O-N 3.02Å; N447-L450 PolarHBondContact O-N 2.94Å; G448-L450 VanDerWaalsContact C-N 3.31Å; G448-L450 PolarHBondContact O-N 2.89Å; L450-W452 VanDerWaalsContact C-N 3.3Å; L450-W452 PolarHBondContact O-N 3.09Å; L450-L453 WeakPolarHBondContact O-CB 3.36Å; L450-L453 PolarHBondContact O-N 3.21Å; L450-D454 WeakPolarHBondContact O-CB 3.38Å; L450-D454 PolarHBondContact O-N 2.63Å
451	Q	96.6	Very high	95.7	Very high	83 Å²	83	39.2 Å²	39.2	39%	0.388	19%	0.192	S	C	.	.	H	α-helix	trans	-63.1	-39.5	177.7	-177.9	179.3	44.6	0	0	111.1	H273 N447 G448 D454 R455	H273-Q451 PolarHBondContact O-OE1 2.75Å; N447-Q451 VanDerWaalsContact O-CB 3.25Å; N447-Q451 WeakPolarHBondContact O-CB 3.33Å; N447-Q451 PolarHBondContact O-N 3.08Å; G448-Q451 PolarHBondContact O-N 3.21Å; Q451-D454 PolarHBondContact O-N 3.14Å; Q451-R455 WeakPolarHBondContact O-CG 3.45Å; Q451-R455 PolarHBondContact O-N 3.18Å; Q451-R455 VanDerWaalsContact O-N 3.08Å
452	W	96.4	Very high	94.9	Very high	3 Å²	3	40.9 Å²	40.9	1%	0.011	21%	0.213	C	C	.	.	H	α-helix	trans	-65.3	-43.9	177.6	-163.3	11.5	0	0	0	111.7	L144 P145 I147 V270 Y272 F394 A395 L398 G448 P449 L450 R455 V456	L144-W452 HydrophobicContact CB-CH2 3.79Å; L144-W452 HydrophobicContact CB-CZ3 4.25Å; L144-W452 HydrophobicContact CD1-CH2 4.25Å; L144-W452 HydrophobicContact CD1-CZ3 3.84Å; P145-W452 WeakPolarHBondContact O-CZ2 3.07Å; I147-W452 HydrophobicContact CD1-CH2 4.24Å; I147-W452 HydrophobicContact CD1-CZ2 3.82Å; I147-W452 HydrophobicContact CG1-CD2 4.48Å; I147-W452 HydrophobicContact CG1-CH2 4.37Å; I147-W452 HydrophobicContact CG1-CZ2 3.52Å; V270-W452 PolarHBondContact O-NE1 2.96Å; Y272-W452 HydrophobicContact CD2-CB 3.94Å; Y272-W452 AromaticContact CD2-CD2 3.65Å; Y272-W452 HydrophobicContact CD2-CD2 3.65Å; Y272-W452 AromaticContact CD2-CE3 3.36Å; Y272-W452 HydrophobicContact CD2-CE3 3.36Å; Y272-W452 AromaticContact CD2-CG 3.95Å; Y272-W452 HydrophobicContact CD2-CG 3.95Å; Y272-W452 AromaticContact CD2-CZ3 3.95Å; Y272-W452 HydrophobicContact CD2-CZ3 3.95Å; Y272-W452 HydrophobicContact CE2-CE3 4.18Å; Y272-W452 HydrophobicContact CG-CD2 4.25Å; Y272-W452 HydrophobicContact CG-CE3 4.11Å; Y272-W452 HydrophobicContact CG-CZ3 4.38Å; F394-W452 HydrophobicContact CD1-CE3 4.38Å; F394-W452 HydrophobicContact CE1-CE3 4.49Å; A395-W452 HydrophobicContact CB-CH2 3.41Å; A395-W452 VanDerWaalsContact CB-CH2 3.41Å; A395-W452 HydrophobicContact CB-CZ3 3.47Å; A395-W452 VanDerWaalsContact CB-CZ3 3.47Å; L398-W452 HydrophobicContact CD2-CD2 4.04Å; L398-W452 HydrophobicContact CD2-CE3 4.34Å; L398-W452 HydrophobicContact CD2-CG 4.17Å; G448-W452 WeakPolarHBondContact O-CB 3.42Å; G448-W452 PolarHBondContact O-N 2.8Å; P449-W452 PolarHBondContact O-N 3.47Å; L450-W452 VanDerWaalsContact C-N 3.3Å; L450-W452 PolarHBondContact O-N 3.09Å; W452-R455 PolarHBondContact O-N 3.4Å; W452-V456 WeakPolarHBondContact O-CG2 3.48Å; W452-V456 PolarHBondContact O-N 3.26Å; W452-V456 VanDerWaalsContact O-N 3.12Å
453	L	96.8	Very high	94.1	Very high	4 Å²	4	43.7 Å²	43.7	2%	0.021	23%	0.231	C	C	.	.	H	α-helix	trans	-59.6	-47.6	175.1	-174.5	67.6	0	0	0	111.9	F394 L398 V409 L412 T413 P449 L450 R455 V456 L457	F394-L453 HydrophobicContact CZ-CB 4.43Å; L398-L453 HydrophobicContact CD1-CD1 3.6Å; V409-L453 HydrophobicContact CG1-CD1 3.49Å; V409-L453 VanDerWaalsContact CG1-CD1 3.49Å; V409-L453 WeakPolarHBondContact O-CD1 3.18Å; L412-L453 HydrophobicContact CB-CD1 4.02Å; L412-L453 HydrophobicContact CB-CD2 4.36Å; L412-L453 HydrophobicContact CD1-CD1 4.46Å; T413-L453 WeakPolarHBondContact OG1-CD2 3.46Å; P449-L453 WeakPolarHBondContact O-CB 3.45Å; P449-L453 PolarHBondContact O-N 2.87Å; L450-L453 WeakPolarHBondContact O-CB 3.36Å; L450-L453 PolarHBondContact O-N 3.21Å; L453-R455 VanDerWaalsContact C-N 3.34Å; L453-R455 PolarHBondContact O-N 2.97Å; L453-V456 PolarHBondContact O-N 3.28Å; L453-V456 VanDerWaalsContact O-N 3.17Å; L453-L457 HydrophobicContact CG-CD1 3.99Å; L453-L457 WeakPolarHBondContact O-CG 3.47Å; L453-L457 PolarHBondContact O-N 3.27Å
454	D	96	Very high	93.1	Very high	99 Å²	99	48 Å²	48	53%	0.529	26%	0.264	S	S	.	.	H	α-helix	trans	-58.1	-44	178.2	179	72.7	0	0	0	112.1	L450 Q451 V456 L457 T458	L450-D454 WeakPolarHBondContact O-CB 3.38Å; L450-D454 PolarHBondContact O-N 2.63Å; Q451-D454 PolarHBondContact O-N 3.14Å; D454-V456 VanDerWaalsContact C-N 3.34Å; D454-V456 PolarHBondContact O-N 3.01Å; D454-L457 PolarHBondContact O-N 3Å; D454-T458 WeakPolarHBondContact O-CB 3.38Å; D454-T458 PolarHBondContact O-N 3.28Å; D454-T458 PolarHBondContact O-OG1 2.77Å
455	R	95.3	Very high	92.1	Very high	102 Å²	102	54 Å²	54	39%	0.385	30%	0.296	S	S	.	.	H	α-helix	trans	-65.4	-35.4	176.7	-70	-176.9	76.2	173.4	4.1	112.8	V270 H273 Q451 W452 L453 Q459	V270-R455 HydrophobicContact CG1-CB 3.51Å; H273-R455 PolarHBondContact CE1-NH1 3.15Å; H273-R455 VanDerWaalsContact CE1-NH1 3.35Å; H273-R455 PolarHBondContact ND1-NH1 3.09Å; Q451-R455 WeakPolarHBondContact O-CG 3.45Å; Q451-R455 PolarHBondContact O-N 3.18Å; Q451-R455 VanDerWaalsContact O-N 3.08Å; W452-R455 PolarHBondContact O-N 3.4Å; L453-R455 VanDerWaalsContact C-N 3.34Å; L453-R455 PolarHBondContact O-N 2.97Å; R455-Q459 WeakPolarHBondContact O-CG 3.38Å
456	V	95.1	Very high	91.1	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-66.8	-50.7	173.9	169.6	0	0	0	0	110.2	I147 V149 V270 L398 V402 V409 W452 L453 D454 T458 Q459 M460	I147-V456 HydrophobicContact CB-CG2 3.9Å; I147-V456 HydrophobicContact CG1-CG2 4.24Å; I147-V456 HydrophobicContact CG2-CG1 4.42Å; I147-V456 HydrophobicContact CG2-CG2 3.83Å; V149-V456 HydrophobicContact CG2-CB 4.43Å; V149-V456 HydrophobicContact CG2-CG1 3.82Å; V149-V456 HydrophobicContact CG2-CG2 4.44Å; V270-V456 HydrophobicContact CB-CG2 4.02Å; V270-V456 HydrophobicContact CG1-CG2 3.95Å; V270-V456 HydrophobicContact CG2-CG2 4.31Å; L398-V456 HydrophobicContact CD1-CB 4.47Å; L398-V456 HydrophobicContact CD1-CG1 4.24Å; L398-V456 HydrophobicContact CD1-CG2 4.45Å; L398-V456 HydrophobicContact CD2-CG2 4.13Å; L398-V456 HydrophobicContact CG-CG2 4.46Å; V402-V456 HydrophobicContact CG2-CG1 3.82Å; V409-V456 HydrophobicContact CG1-CG1 3.99Å; W452-V456 WeakPolarHBondContact O-CG2 3.48Å; W452-V456 PolarHBondContact O-N 3.26Å; W452-V456 VanDerWaalsContact O-N 3.12Å; L453-V456 PolarHBondContact O-N 3.28Å; L453-V456 VanDerWaalsContact O-N 3.17Å; D454-V456 VanDerWaalsContact C-N 3.34Å; D454-V456 PolarHBondContact O-N 3.01Å; V456-T458 PolarHBondContact O-N 3.32Å; V456-Q459 PolarHBondContact O-N 3.3Å; V456-M460 HydrophobicContact CG1-SD 4.08Å; V456-M460 WeakPolarHBondContact O-CG 3.07Å; V456-M460 PolarHBondContact O-N 3.43Å
457	L	94.6	Very high	90.2	Very high	21 Å²	21	66.3 Å²	66.3	11%	0.11	36%	0.357	C	S	.	.	H	α-helix	trans	-57.9	-36.5	179.2	-73.1	168.4	0	0	0	112.3	F406 V409 Y410 L453 D454 Q459 M460	F406-L457 HydrophobicContact CD2-CD2 3.83Å; F406-L457 HydrophobicContact CE1-CD2 4.49Å; F406-L457 HydrophobicContact CE2-CB 4.24Å; F406-L457 HydrophobicContact CE2-CD2 3.65Å; F406-L457 HydrophobicContact CG-CD2 4.33Å; F406-L457 HydrophobicContact CZ-CD2 4Å; V409-L457 HydrophobicContact CB-CD2 3.91Å; V409-L457 HydrophobicContact CG1-CD2 3.6Å; V409-L457 HydrophobicContact CG1-CG 3.87Å; Y410-L457 HydrophobicContact CD2-CD1 4.09Å; L453-L457 HydrophobicContact CG-CD1 3.99Å; L453-L457 WeakPolarHBondContact O-CG 3.47Å; L453-L457 PolarHBondContact O-N 3.27Å; D454-L457 PolarHBondContact O-N 3Å; L457-Q459 PolarHBondContact O-N 2.97Å; L457-M460 PolarHBondContact O-N 3.13Å; L457-M460 VanDerWaalsContact O-N 3.11Å
458	T	92.7	Very high	89.3	Confident	96 Å²	96	69 Å²	69	59%	0.589	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-22.9	177	-58.3	0	0	0	0	113.3	D454 V456	D454-T458 WeakPolarHBondContact O-CB 3.38Å; D454-T458 PolarHBondContact O-N 3.28Å; D454-T458 PolarHBondContact O-OG1 2.77Å; V456-T458 PolarHBondContact O-N 3.32Å
459	Q	91.1	Very high	88.9	Confident	69 Å²	69	74.1 Å²	74.1	32%	0.322	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-10.1	176.8	-58	-54.5	-54.2	0	0	113.3	V149 F268 V270 R455 V456 L457	V149-Q459 HydrophobicContact CB-CB 4.09Å; V149-Q459 HydrophobicContact CG1-CB 3.89Å; V149-Q459 HydrophobicContact CG2-CB 4.31Å; F268-Q459 HydrophobicContact CB-CB 4.45Å; F268-Q459 HydrophobicContact CB-CG 4.17Å; F268-Q459 HydrophobicContact CD2-CB 4.03Å; F268-Q459 HydrophobicContact CD2-CG 4.34Å; F268-Q459 HydrophobicContact CG-CB 4.46Å; F268-Q459 HydrophobicContact CG-CG 4.32Å; V270-Q459 HydrophobicContact CG2-CG 4.09Å; R455-Q459 WeakPolarHBondContact O-CG 3.38Å; V456-Q459 PolarHBondContact O-N 3.3Å; L457-Q459 PolarHBondContact O-N 2.97Å
460	M	90.7	Very high	88	Confident	30 Å²	30	83.4 Å²	83.4	15%	0.148	45%	0.447	C	S	.	.	S	Bend	trans	-89.8	151.7	-178.6	-65.4	-178.4	81.1	0	0	111.1	V149 F406 V409 V456 L457	V149-M460 HydrophobicContact CG1-CG 3.65Å; F406-M460 HydrophobicContact CD2-CB 4.1Å; V409-M460 HydrophobicContact CB-SD 3.93Å; V409-M460 HydrophobicContact CG1-SD 4.14Å; V409-M460 HydrophobicContact CG2-CE 3.85Å; V409-M460 HydrophobicContact CG2-SD 3.64Å; V456-M460 HydrophobicContact CG1-SD 4.08Å; V456-M460 WeakPolarHBondContact O-CG 3.07Å; V456-M460 PolarHBondContact O-N 3.43Å; L457-M460 PolarHBondContact O-N 3.13Å; L457-M460 VanDerWaalsContact O-N 3.11Å
461	E	84.8	Confident	86.2	Confident	125 Å²	125	88.8 Å²	88.8	58%	0.584	48%	0.482	S	S	*	.			trans	-64.3	142.3	164.9	-65.4	-179	178.7	0	0	109.1	G152 F406	G152-E461 WeakPolarHBondContact CA-OE1 3.34Å; F406-E461 WeakPolarHBondContact CB-O 3.22Å; F406-E461 WeakPolarHBondContact CD2-O 3.32Å
462	G	81.4	Confident	85.7	Confident	47 Å²	47	89.1 Å²	89.1	49%	0.485	49%	0.487	S	S	.	.			trans	-63.7	-176.7	-178.5	0	0	0	0	0	113.6	S464	G462-S464 PolarHBondContact O-N 3.15Å
463	P	82.1	Confident	85.2	Confident	58 Å²	58	93.6 Å²	93.6	38%	0.377	51%	0.512	S	S	.	.			trans	-59.3	139	179.1	25.8	-34.1	0	0	0	111.4	F406 E407 N465	F406-P463 HydrophobicContact CD1-CB 4.48Å; E407-P463 WeakPolarHBondContact OE1-CB 3.5Å; P463-N465 PolarHBondContact O-N 3.04Å
464	S	77.3	Confident	84.5	Confident	115 Å²	115	98.6 Å²	98.6	80%	0.804	54%	0.539	S	S	*	.	S	Bend	trans	-67.1	-26.2	179.8	58.4	0	0	0	0	113.1	G462	G462-S464 PolarHBondContact O-N 3.15Å
465	N	78	Confident	83.8	Confident	125 Å²	125	98.6 Å²	98.6	67%	0.668	54%	0.54	S	S	*	.	S	Bend	trans	-86	117.4	180	-66.9	-17.3	0	0	0	109.5	P463 I467	P463-N465 PolarHBondContact O-N 3.04Å; N465-I467 PolarHBondContact O-N 3.26Å
466	Q	77.2	Confident	83.1	Confident	180 Å²	180	98.4 Å²	98.4	84%	0.841	55%	0.55	S	S	*	.	P	Polyproline II helix	trans	-64.8	129.1	170.5	-66.7	-174.2	2.6	0	0	109.5
467	I	78.4	Confident	82.3	Confident	147 Å²	147	104.9 Å²	104.9	75%	0.754	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-84.8	122.2	173.3	-60.6	172.1	0	0	0	107.3	N465	N465-I467 PolarHBondContact O-N 3.26Å
468	N	80	Confident	81.4	Confident	97 Å²	97	110.9 Å²	110.9	52%	0.519	62%	0.62	S	S	.	*	P	Polyproline II helix	trans	-75.7	134.4	176.3	-70	-27.8	0	0	0	109.7	F470 T471	N468-F470 PolarHBondContact O-N 3.17Å; N468-F470 VanDerWaalsContact O-N 3.12Å; N468-T471 HydrophobicContact CB-CG2 4.5Å; N468-T471 PolarHBondContact O-N 3.31Å; N468-T471 PolarHBondContact O-OG1 3.4Å; N468-T471 VanDerWaalsContact O-OG1 3.11Å
469	S	86.8	Confident	80.6	Confident	107 Å²	107	112.1 Å²	112.1	75%	0.748	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	-3.7	176.9	58.2	0	0	0	0	114.5
470	F	79	Confident	79.7	Confident	198 Å²	198	115.7 Å²	115.7	87%	0.868	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.3	-5.1	-175.6	-60.4	-78.7	0	0	0	113.7	N468	N468-F470 PolarHBondContact O-N 3.17Å; N468-F470 VanDerWaalsContact O-N 3.12Å
471	T	60.8	Low	78.7	Confident	159 Å²	159	123.5 Å²	123.5	98%	0.975	69%	0.693	S	S	*	*			trans	-108.1	0	173	52.8	0	0	0	0	109	N468	N468-T471 HydrophobicContact CB-CG2 4.5Å; N468-T471 PolarHBondContact O-N 3.31Å; N468-T471 PolarHBondContact O-OG1 3.4Å; N468-T471 VanDerWaalsContact O-OG1 3.11Å

Retrieved 471 of 471 residues in 131.3 ms (Link to these results)

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