A0A3Q0KGW5_SCHMA Loading...

Asp_protease domain-containing protein

AlphaFold DB (A0A5K4EFZ3), UniProt , Accession A0A3Q0KGW5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 371 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	53.1	Low	64.7	Low	186 Å²	186	95.1 Å²	95.1	92%	0.916	56%	0.563	S	S	*	*				0	-63.5	0	-113.9	-163	-79.2	0	0	113.7	I3 E4 V5	M1-I3 PolarHBondContact O-N 3.36Å; M1-E4 VanDerWaalsContact CA-OE2 3.28Å; M1-E4 WeakPolarHBondContact CA-OE2 3.35Å; M1-E4 PolarHBondContact N-OE2 2.96Å; M1-E4 PolarHBondContact O-N 2.63Å; M1-V5 WeakPolarHBondContact O-CG2 3.04Å; M1-V5 PolarHBondContact O-N 3.08Å
2	L	60.9	Low	64.9	Low	137 Å²	137	89.4 Å²	89.4	72%	0.717	53%	0.53	S	S	*	.	H	α-helix	trans	-63.8	-43.6	-178.9	-155.1	78.7	0	0	0	113	E4 V5 E6	L2-E4 PolarHBondContact O-N 2.88Å; L2-V5 PolarHBondContact O-N 2.97Å; L2-E6 PolarHBondContact O-N 2.88Å
3	I	65.9	Low	65.4	Low	61 Å²	61	88.6 Å²	88.6	31%	0.313	52%	0.521	S	S	.	.	H	α-helix	trans	-64.2	-39.7	178.9	-58.8	167.2	0	0	0	111.9	M1 V5 E6 S7 F14 L16 A44	M1-I3 PolarHBondContact O-N 3.36Å; I3-V5 VanDerWaalsContact C-N 3.28Å; I3-V5 PolarHBondContact O-N 3.4Å; I3-E6 PolarHBondContact O-N 2.85Å; I3-S7 WeakPolarHBondContact O-CB 3.07Å; I3-S7 PolarHBondContact O-N 2.92Å; I3-S7 PolarHBondContact O-OG 3.15Å; I3-F14 HydrophobicContact CB-CD2 4.45Å; I3-F14 HydrophobicContact CG2-CD1 3.99Å; I3-F14 HydrophobicContact CG2-CD2 3.84Å; I3-F14 HydrophobicContact CG2-CE1 4Å; I3-F14 HydrophobicContact CG2-CE2 3.86Å; I3-F14 HydrophobicContact CG2-CG 3.9Å; I3-F14 HydrophobicContact CG2-CZ 3.92Å; I3-L16 HydrophobicContact CD1-CD1 3.91Å; I3-L16 HydrophobicContact CD1-CD2 3.78Å; I3-L16 HydrophobicContact CD1-CG 4.22Å; I3-A44 HydrophobicContact CG2-CB 4.47Å
4	E	65.1	Low	66	Low	47 Å²	47	85.5 Å²	85.5	22%	0.22	50%	0.498	C	S	.	.	H	α-helix	trans	-63.9	-34.9	176.4	-68.8	164.7	134.1	0	0	111.4	M1 L2 G8 F14 R49	M1-E4 VanDerWaalsContact CA-OE2 3.28Å; M1-E4 WeakPolarHBondContact CA-OE2 3.35Å; M1-E4 PolarHBondContact N-OE2 2.96Å; M1-E4 PolarHBondContact O-N 2.63Å; L2-E4 PolarHBondContact O-N 2.88Å; E4-G8 PolarHBondContact O-N 3.49Å; E4-G8 VanDerWaalsContact O-N 3.14Å; E4-F14 HydrophobicContact CG-CE2 4.02Å; E4-R49 IonicContact OE1-NH2 3.39Å; E4-R49 PolarHBondContact OE1-NH2 2.78Å
5	V	67	Low	66.7	Low	117 Å²	117	85.1 Å²	85.1	71%	0.709	49%	0.49	S	S	*	.	H	α-helix	trans	-71.9	-42.4	178.2	173	0	0	0	0	111.4	M1 L2 I3	M1-V5 WeakPolarHBondContact O-CG2 3.04Å; M1-V5 PolarHBondContact O-N 3.08Å; L2-V5 PolarHBondContact O-N 2.97Å; I3-V5 VanDerWaalsContact C-N 3.28Å; I3-V5 PolarHBondContact O-N 3.4Å
6	E	66.9	Low	67.4	Low	164 Å²	164	81.3 Å²	81.3	77%	0.766	47%	0.467	S	S	*	.	H	α-helix	trans	-78.4	-34	179.8	-71.2	-166.7	164.4	0	0	113.6	L2 I3	L2-E6 PolarHBondContact O-N 2.88Å; I3-E6 PolarHBondContact O-N 2.85Å
7	S	66.9	Low	68.1	Low	53 Å²	53	77.7 Å²	77.7	37%	0.371	45%	0.448	S	S	.	.	H	α-helix	trans	-81	-19.6	178.9	63	0	0	0	0	113.7	I3 I9	I3-S7 WeakPolarHBondContact O-CB 3.07Å; I3-S7 PolarHBondContact O-N 2.92Å; I3-S7 PolarHBondContact O-OG 3.15Å; S7-I9 PolarHBondContact O-N 2.95Å; S7-I9 PolarHBondContact OG-N 3.45Å
8	G	69.6	Low	68.7	Low	67 Å²	67	76.8 Å²	76.8	69%	0.691	44%	0.436	S	S	*	.			trans	70.2	6.2	-172.8	0	0	0	0	0	114.2	E4	E4-G8 PolarHBondContact O-N 3.49Å; E4-G8 VanDerWaalsContact O-N 3.14Å
9	I	66.6	Low	69.1	Low	68 Å²	68	81.9 Å²	81.9	35%	0.349	46%	0.456	S	S	.	.			trans	-97.5	114.2	-178.1	-55.8	171	0	0	0	108.6	S7 V12 F14	S7-I9 PolarHBondContact O-N 2.95Å; S7-I9 PolarHBondContact OG-N 3.45Å; I9-V12 HydrophobicContact CG2-CB 3.92Å; I9-V12 HydrophobicContact CG2-CG2 3.48Å; I9-V12 VanDerWaalsContact CG2-CG2 3.48Å; I9-F14 HydrophobicContact CB-CZ 4.12Å; I9-F14 HydrophobicContact CD1-CZ 4.42Å; I9-F14 HydrophobicContact CG2-CZ 4.42Å
10	S	65.7	Low	69.3	Low	110 Å²	110	81.4 Å²	81.4	77%	0.769	47%	0.469	S	S	*	.			trans	-102.9	147.8	176.2	-169	0	0	0	0	111.5
11	G	64.3	Low	69.5	Low	36 Å²	36	84.6 Å²	84.6	37%	0.371	48%	0.48	S	S	.	.	S	Bend	trans	82.5	13.4	172.3	0	0	0	0	0	115.2
12	V	66.6	Low	70.6	Confident	27 Å²	27	79.4 Å²	79.4	16%	0.164	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	139.1	-178.1	-167.8	0	0	0	0	108.4	I9 P46 I47	I9-V12 HydrophobicContact CG2-CB 3.92Å; I9-V12 HydrophobicContact CG2-CG2 3.48Å; I9-V12 VanDerWaalsContact CG2-CG2 3.48Å; V12-P46 HydrophobicContact CG1-CB 3.49Å; V12-P46 VanDerWaalsContact CG1-CB 3.49Å; V12-I47 VanDerWaalsContact CG1-C 3.47Å; V12-I47 WeakPolarHBondContact CG1-O 3.43Å
13	D	72	Confident	71.3	Confident	79 Å²	79	74.4 Å²	74.4	42%	0.422	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	148.9	170.8	-70	-23.5	0	0	0	108.5	I47 R49	D13-I47 PolarHBondContact N-O 2.97Å; D13-I47 WeakPolarHBondContact O-CA 3.32Å; D13-I47 PolarHBondContact O-N 2.91Å; D13-R49 HydrophobicContact CB-CG 4.45Å; D13-R49 IonicContact OD1-CZ 3.41Å; D13-R49 IonicContact OD1-NE 2.78Å; D13-R49 PolarHBondContact OD1-NE 3.39Å; D13-R49 IonicContact OD1-NH2 3.15Å; D13-R49 PolarHBondContact OD1-NH2 2.75Å; D13-R49 VanDerWaalsContact OD1-NH2 3.15Å; D13-R49 WeakPolarHBondContact OD2-CG 3.44Å; D13-R49 IonicContact OD2-NE 3.88Å
14	F	73.1	Confident	71.3	Confident	45 Å²	45	77.4 Å²	77.4	20%	0.197	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	129.4	179.1	-71.2	-90.1	0	0	0	110.1	I3 E4 I9 A44 V45 P46	I3-F14 HydrophobicContact CB-CD2 4.45Å; I3-F14 HydrophobicContact CG2-CD1 3.99Å; I3-F14 HydrophobicContact CG2-CD2 3.84Å; I3-F14 HydrophobicContact CG2-CE1 4Å; I3-F14 HydrophobicContact CG2-CE2 3.86Å; I3-F14 HydrophobicContact CG2-CG 3.9Å; I3-F14 HydrophobicContact CG2-CZ 3.92Å; E4-F14 HydrophobicContact CG-CE2 4.02Å; I9-F14 HydrophobicContact CB-CZ 4.12Å; I9-F14 HydrophobicContact CD1-CZ 4.42Å; I9-F14 HydrophobicContact CG2-CZ 4.42Å; F14-A44 HydrophobicContact CD1-CB 3.95Å; F14-V45 WeakPolarHBondContact CA-O 3.28Å; F14-P46 HydrophobicContact CD1-CB 4.48Å; F14-P46 HydrophobicContact CE1-CB 4.2Å
15	E	77	Confident	71.4	Confident	80 Å²	80	78.5 Å²	78.5	37%	0.374	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	122.7	161.4	-167.2	168.9	112	0	0	108.6	V22 A44 V45 I47	E15-V22 HydrophobicContact CG-CG1 3.52Å; E15-V22 HydrophobicContact CG-CG2 4.33Å; E15-V22 WeakPolarHBondContact OE1-CG2 3.49Å; E15-A44 CarbonylContact O-C 3.59Å; E15-A44 WeakPolarHBondContact O-CA 3.28Å; E15-V45 PolarHBondContact N-O 3.14Å; E15-V45 PolarHBondContact O-N 3.34Å; E15-I47 HydrophobicContact CB-CD1 3.65Å; E15-I47 HydrophobicContact CB-CG1 4.18Å; E15-I47 HydrophobicContact CG-CD1 4.46Å
16	L	77.7	Confident	71.2	Confident	24 Å²	24	79.5 Å²	79.5	13%	0.126	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	130.6	175.3	-71.3	165.7	0	0	0	108.8	I3 V22 L23 V25 F43 A44	I3-L16 HydrophobicContact CD1-CD1 3.91Å; I3-L16 HydrophobicContact CD1-CD2 3.78Å; I3-L16 HydrophobicContact CD1-CG 4.22Å; L16-V22 CarbonylContact O-C 3.57Å; L16-L23 HydrophobicContact CB-CB 4.28Å; L16-L23 HydrophobicContact CB-CD1 4.3Å; L16-L23 PolarHBondContact O-N 3.18Å; L16-V25 HydrophobicContact CD1-CG2 4.05Å; L16-F43 CarbonylContact C-O 3.57Å; L16-F43 WeakPolarHBondContact CA-O 3.14Å; L16-A44 HydrophobicContact CD2-CB 3.8Å
17	S	80.1	Confident	71	Confident	20 Å²	20	78.4 Å²	78.4	14%	0.14	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	144.7	170.1	63.4	0	0	0	0	111.4	Q21 L42 F43	S17-Q21 CarbonylContact C-O 3.58Å; S17-Q21 WeakPolarHBondContact CA-O 3.08Å; S17-Q21 WeakPolarHBondContact CB-O 3.33Å; S17-L42 WeakPolarHBondContact O-CA 3.43Å; S17-F43 PolarHBondContact N-O 3.13Å; S17-F43 PolarHBondContact O-N 3.22Å; S17-F43 WeakPolarHBondContact OG-CB 3.28Å
18	R	78.6	Confident	70.9	Confident	62 Å²	62	81.3 Å²	81.3	23%	0.234	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	126	174.1	-172.3	-176.2	67.8	178.3	-4.5	107.9	G20 Q21 L23 G35 D40 L42	R18-G20 PolarHBondContact O-N 2.95Å; R18-G20 VanDerWaalsContact O-N 3.14Å; R18-Q21 PolarHBondContact N-O 3.28Å; R18-Q21 PolarHBondContact O-N 3.5Å; R18-L23 HydrophobicContact CB-CD1 4.2Å; R18-L23 HydrophobicContact CB-CD2 4.45Å; R18-L23 HydrophobicContact CB-CG 4.38Å; R18-G35 PolarHBondContact NH1-O 3.48Å; R18-D40 VanDerWaalsContact CD-OD2 3.28Å; R18-D40 WeakPolarHBondContact CD-OD2 3.48Å; R18-D40 IonicContact CZ-OD2 2.76Å; R18-D40 IonicContact NE-OD2 3.58Å; R18-D40 IonicContact NH1-OD2 3.74Å; R18-D40 PolarHBondContact NH1-OD2 2.84Å; R18-L42 HydrophobicContact CB-CD2 3.82Å; R18-L42 HydrophobicContact CG-CD2 4.1Å
19	E	76.7	Confident	70.9	Confident	174 Å²	174	80 Å²	80	81%	0.813	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	37.4	-179.6	-61.4	179.2	164.1	0	0	113.3	Q21	E19-Q21 VanDerWaalsContact C-N 3.27Å; E19-Q21 PolarHBondContact O-N 3.04Å
20	G	71.8	Confident	71.2	Confident	70 Å²	70	80.2 Å²	80.2	72%	0.722	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	78	1.1	-178.2	0	0	0	0	0	115.5	R18	R18-G20 PolarHBondContact O-N 2.95Å; R18-G20 VanDerWaalsContact O-N 3.14Å
21	Q	74.1	Confident	71.6	Confident	149 Å²	149	80.7 Å²	80.7	70%	0.696	46%	0.463	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.4	124.7	174.6	-67.1	-174.8	-3.6	0	0	111.3	S17 R18 E19 L23	S17-Q21 CarbonylContact C-O 3.58Å; S17-Q21 WeakPolarHBondContact CA-O 3.08Å; S17-Q21 WeakPolarHBondContact CB-O 3.33Å; R18-Q21 PolarHBondContact N-O 3.28Å; R18-Q21 PolarHBondContact O-N 3.5Å; E19-Q21 VanDerWaalsContact C-N 3.27Å; E19-Q21 PolarHBondContact O-N 3.04Å; Q21-L23 PolarHBondContact O-N 3.22Å
22	V	77	Confident	72	Confident	78 Å²	78	86.8 Å²	86.8	47%	0.473	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	123.1	176.7	-179.4	0	0	0	0	110.4	E15 L16	E15-V22 HydrophobicContact CG-CG1 3.52Å; E15-V22 HydrophobicContact CG-CG2 4.33Å; E15-V22 WeakPolarHBondContact OE1-CG2 3.49Å; L16-V22 CarbonylContact O-C 3.57Å
23	L	74.2	Confident	72.3	Confident	31 Å²	31	93.3 Å²	93.3	16%	0.162	51%	0.509	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	114.8	174.6	-62.6	174.4	0	0	0	109.2	L16 R18 Q21 V25 I36 L42	L16-L23 HydrophobicContact CB-CB 4.28Å; L16-L23 HydrophobicContact CB-CD1 4.3Å; L16-L23 PolarHBondContact O-N 3.18Å; R18-L23 HydrophobicContact CB-CD1 4.2Å; R18-L23 HydrophobicContact CB-CD2 4.45Å; R18-L23 HydrophobicContact CB-CG 4.38Å; Q21-L23 PolarHBondContact O-N 3.22Å; L23-V25 VanDerWaalsContact C-N 3.33Å; L23-V25 HydrophobicContact CB-CG2 3.94Å; L23-V25 PolarHBondContact O-N 3.42Å; L23-I36 HydrophobicContact CD1-CD1 4.15Å; L23-I36 HydrophobicContact CD1-CG1 4.16Å; L23-L42 HydrophobicContact CD1-CD2 3.75Å
24	C	66	Low	72.2	Confident	124 Å²	124	90.5 Å²	90.5	84%	0.838	50%	0.496	S	S	*	.			trans	-74	86.3	170.1	-90	0	0	0	0	110.4
25	V	67	Low	72.3	Confident	70 Å²	70	90 Å²	90	42%	0.424	50%	0.503	S	S	.	.			trans	-91.5	116.7	177	-167.9	0	0	0	0	109.2	L16 L23 T29	L16-V25 HydrophobicContact CD1-CG2 4.05Å; L23-V25 VanDerWaalsContact C-N 3.33Å; L23-V25 HydrophobicContact CB-CG2 3.94Å; L23-V25 PolarHBondContact O-N 3.42Å; V25-T29 HydrophobicContact CG1-CG2 4.48Å
26	Q	62.9	Low	72.4	Confident	139 Å²	139	87.9 Å²	87.9	65%	0.65	49%	0.494	S	S	*	.			trans	-89.4	161.1	167.8	-66.3	-179.3	-18.1	0	0	109.1	T28 T29	Q26-T28 PolarHBondContact O-N 3.22Å; Q26-T29 PolarHBondContact N-OG1 3.11Å; Q26-T29 VanDerWaalsContact N-OG1 3.13Å; Q26-T29 WeakPolarHBondContact O-CB 3.29Å; Q26-T29 PolarHBondContact O-N 2.88Å; Q26-T29 PolarHBondContact O-OG1 2.69Å
27	S	62.6	Low	72.4	Confident	140 Å²	140	96 Å²	96	98%	0.979	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-15.9	178.1	-41.1	0	0	0	0	114
28	T	65.1	Low	72.2	Confident	115 Å²	115	102.5 Å²	102.5	71%	0.706	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.8	0.2	179.2	54.6	0	0	0	0	114.6	Q26 N30	Q26-T28 PolarHBondContact O-N 3.22Å; T28-N30 PolarHBondContact O-N 2.91Å
29	T	69.2	Low	72.2	Confident	40 Å²	40	108.1 Å²	108.1	25%	0.245	59%	0.585	C	S	.	*			trans	-80.8	118.3	-178.5	-55.8	0	0	0	0	109.6	V25 Q26 K33 A34	V25-T29 HydrophobicContact CG1-CG2 4.48Å; Q26-T29 PolarHBondContact N-OG1 3.11Å; Q26-T29 VanDerWaalsContact N-OG1 3.13Å; Q26-T29 WeakPolarHBondContact O-CB 3.29Å; Q26-T29 PolarHBondContact O-N 2.88Å; Q26-T29 PolarHBondContact O-OG1 2.69Å; T29-K33 HydrophobicContact CG2-CB 4.02Å; T29-A34 HydrophobicContact CG2-CB 3.96Å
30	N	73.4	Confident	72.4	Confident	72 Å²	72	102.1 Å²	102.1	39%	0.385	56%	0.559	S	S	.	*			trans	-83	163	170.7	66.8	-10.7	0	0	0	110.7	T28 E32 K33 A34	T28-N30 PolarHBondContact O-N 2.91Å; N30-E32 PolarHBondContact O-N 3.09Å; N30-K33 PolarHBondContact O-N 2.9Å; N30-K33 WeakPolarHBondContact OD1-CB 3.37Å; N30-K33 WeakPolarHBondContact OD1-CD 3.45Å; N30-K33 WeakPolarHBondContact OD1-CG 3.36Å; N30-K33 PolarHBondContact OD1-N 2.65Å; N30-A34 PolarHBondContact O-N 3.44Å
31	I	74.5	Confident	72.7	Confident	119 Å²	119	104.7 Å²	104.7	61%	0.61	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.4	-42.5	-178.8	-65.1	174.3	0	0	0	111.3	K33 A34 G35 I36	I31-K33 PolarHBondContact O-N 3.48Å; I31-A34 PolarHBondContact O-N 2.89Å; I31-G35 PolarHBondContact O-N 3.4Å; I31-I36 HydrophobicContact CG2-CB 3.89Å; I31-I36 HydrophobicContact CG2-CG2 4.2Å; I31-I36 PolarHBondContact O-N 2.82Å
32	E	72.7	Confident	73	Confident	164 Å²	164	100.4 Å²	100.4	77%	0.766	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-44.1	177.5	-63.9	179.1	167.8	0	0	112.9	N30 A34 G35	N30-E32 PolarHBondContact O-N 3.09Å; E32-A34 VanDerWaalsContact C-N 3.33Å; E32-G35 PolarHBondContact O-N 3.35Å; E32-G35 VanDerWaalsContact O-N 3.11Å
33	K	72.4	Confident	73	Confident	165 Å²	165	102.3 Å²	102.3	72%	0.717	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-25.6	176.5	-75.3	174.1	-178.4	179.5	0	112.9	T29 N30 I31 G35	T29-K33 HydrophobicContact CG2-CB 4.02Å; N30-K33 PolarHBondContact O-N 2.9Å; N30-K33 WeakPolarHBondContact OD1-CB 3.37Å; N30-K33 WeakPolarHBondContact OD1-CD 3.45Å; N30-K33 WeakPolarHBondContact OD1-CG 3.36Å; N30-K33 PolarHBondContact OD1-N 2.65Å; I31-K33 PolarHBondContact O-N 3.48Å; K33-G35 PolarHBondContact O-N 3.03Å
34	A	70.2	Confident	73.2	Confident	19 Å²	19	103 Å²	103	16%	0.157	55%	0.55	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-8.7	170.4	0	0	0	0	0	112.3	T29 N30 I31 E32 I36	T29-A34 HydrophobicContact CG2-CB 3.96Å; N30-A34 PolarHBondContact O-N 3.44Å; I31-A34 PolarHBondContact O-N 2.89Å; E32-A34 VanDerWaalsContact C-N 3.33Å; A34-I36 HydrophobicContact CB-CD1 3.65Å; A34-I36 HydrophobicContact CB-CG1 3.85Å; A34-I36 PolarHBondContact O-N 2.98Å
35	G	75.6	Confident	73.8	Confident	34 Å²	34	101 Å²	101	35%	0.351	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.8	15.9	179.1	0	0	0	0	0	113.8	R18 I31 E32 K33	R18-G35 PolarHBondContact NH1-O 3.48Å; I31-G35 PolarHBondContact O-N 3.4Å; E32-G35 PolarHBondContact O-N 3.35Å; E32-G35 VanDerWaalsContact O-N 3.11Å; K33-G35 PolarHBondContact O-N 3.03Å
36	I	77.9	Confident	74.1	Confident	37 Å²	37	100.8 Å²	100.8	19%	0.19	53%	0.533	C	S	.	.	P	Polyproline II helix	trans	-77.8	126	-179.2	-60	165.7	0	0	0	108.2	L23 I31 A34 D40 L42	L23-I36 HydrophobicContact CD1-CD1 4.15Å; L23-I36 HydrophobicContact CD1-CG1 4.16Å; I31-I36 HydrophobicContact CG2-CB 3.89Å; I31-I36 HydrophobicContact CG2-CG2 4.2Å; I31-I36 PolarHBondContact O-N 2.82Å; A34-I36 HydrophobicContact CB-CD1 3.65Å; A34-I36 HydrophobicContact CB-CG1 3.85Å; A34-I36 PolarHBondContact O-N 2.98Å; I36-D40 WeakPolarHBondContact CA-OD2 3.35Å; I36-D40 HydrophobicContact CG2-CB 4.23Å; I36-L42 HydrophobicContact CD1-CD1 3.95Å; I36-L42 HydrophobicContact CG1-CD1 4.45Å; I36-L42 HydrophobicContact CG1-CD2 4.4Å; I36-L42 HydrophobicContact CG2-CD1 4.11Å
37	R	79.1	Confident	74.5	Confident	195 Å²	195	97.7 Å²	97.7	74%	0.736	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-103.2	165	176.4	-62.7	179.1	-176.7	174.4	2.4	110.5	D40	R37-D40 PolarHBondContact N-OD2 3.49Å; R37-D40 WeakPolarHBondContact O-CB 3.22Å; R37-D40 PolarHBondContact O-N 3.25Å
38	D	76.2	Confident	74.4	Confident	155 Å²	155	96 Å²	96	83%	0.829	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	139.1	168.3	-148.3	17.7	0	0	0	109
39	E	77.2	Confident	74	Confident	180 Å²	180	97 Å²	97	84%	0.841	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.7	8.4	-172.6	-51.7	-66.3	161.5	0	0	117	L41	E39-L41 PolarHBondContact O-N 3.25Å
40	D	80.4	Confident	72.9	Confident	48 Å²	48	106.2 Å²	106.2	26%	0.257	53%	0.527	S	S	.	.			trans	-71.8	126.5	172	-80.9	-3.3	0	0	0	111.4	R18 I36 R37 L42	R18-D40 VanDerWaalsContact CD-OD2 3.28Å; R18-D40 WeakPolarHBondContact CD-OD2 3.48Å; R18-D40 IonicContact CZ-OD2 2.76Å; R18-D40 IonicContact NE-OD2 3.58Å; R18-D40 IonicContact NH1-OD2 3.74Å; R18-D40 PolarHBondContact NH1-OD2 2.84Å; I36-D40 WeakPolarHBondContact CA-OD2 3.35Å; I36-D40 HydrophobicContact CG2-CB 4.23Å; R37-D40 PolarHBondContact N-OD2 3.49Å; R37-D40 WeakPolarHBondContact O-CB 3.22Å; R37-D40 PolarHBondContact O-N 3.25Å; D40-L42 PolarHBondContact O-N 3.2Å
41	L	78.6	Confident	71.3	Confident	124 Å²	124	110.7 Å²	110.7	65%	0.649	55%	0.551	S	S	*	*			trans	-79.5	118.9	171.2	-173.5	71.3	0	0	0	110.4	E39 F43	E39-L41 PolarHBondContact O-N 3.25Å; L41-F43 HydrophobicContact CD2-CE2 3.8Å; L41-F43 HydrophobicContact CD2-CZ 3.74Å; L41-F43 HydrophobicContact CG-CE2 4.22Å; L41-F43 HydrophobicContact CG-CZ 4.44Å
42	L	80.2	Confident	69.3	Low	60 Å²	60	111.3 Å²	111.3	31%	0.314	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.1	132.9	176.5	-59.5	175.6	0	0	0	110.3	S17 R18 L23 I36 D40	S17-L42 WeakPolarHBondContact O-CA 3.43Å; R18-L42 HydrophobicContact CB-CD2 3.82Å; R18-L42 HydrophobicContact CG-CD2 4.1Å; L23-L42 HydrophobicContact CD1-CD2 3.75Å; I36-L42 HydrophobicContact CD1-CD1 3.95Å; I36-L42 HydrophobicContact CG1-CD1 4.45Å; I36-L42 HydrophobicContact CG1-CD2 4.4Å; I36-L42 HydrophobicContact CG2-CD1 4.11Å; D40-L42 PolarHBondContact O-N 3.2Å
43	F	78.3	Confident	67.4	Low	117 Å²	117	110.9 Å²	110.9	51%	0.513	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.5	124.3	169	-65.3	-91.6	0	0	0	108.9	L16 S17 L41	L16-F43 CarbonylContact C-O 3.57Å; L16-F43 WeakPolarHBondContact CA-O 3.14Å; S17-F43 PolarHBondContact N-O 3.13Å; S17-F43 PolarHBondContact O-N 3.22Å; S17-F43 WeakPolarHBondContact OG-CB 3.28Å; L41-F43 HydrophobicContact CD2-CE2 3.8Å; L41-F43 HydrophobicContact CD2-CZ 3.74Å; L41-F43 HydrophobicContact CG-CE2 4.22Å; L41-F43 HydrophobicContact CG-CZ 4.44Å
44	A	77.8	Confident	65.5	Low	47 Å²	47	110.4 Å²	110.4	39%	0.388	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.3	114.6	176	0	0	0	0	0	109.6	I3 F14 E15 L16	I3-A44 HydrophobicContact CG2-CB 4.47Å; F14-A44 HydrophobicContact CD1-CB 3.95Å; E15-A44 CarbonylContact O-C 3.59Å; E15-A44 WeakPolarHBondContact O-CA 3.28Å; L16-A44 HydrophobicContact CD2-CB 3.8Å
45	V	77.9	Confident	63.9	Low	81 Å²	81	115 Å²	115	49%	0.491	60%	0.595	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.5	122.4	177.2	-176.6	0	0	0	0	109.2	F14 E15 I47	F14-V45 WeakPolarHBondContact CA-O 3.28Å; E15-V45 PolarHBondContact N-O 3.14Å; E15-V45 PolarHBondContact O-N 3.34Å; V45-I47 PolarHBondContact O-N 3.24Å
46	P	74.7	Confident	61.7	Low	65 Å²	65	123.3 Å²	123.3	42%	0.422	62%	0.621	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-66.1	122	176	21.1	-27.3	0	0	0	111.7	V12 F14	V12-P46 HydrophobicContact CG1-CB 3.49Å; V12-P46 VanDerWaalsContact CG1-CB 3.49Å; F14-P46 HydrophobicContact CD1-CB 4.48Å; F14-P46 HydrophobicContact CE1-CB 4.2Å
47	I	70.7	Confident	59.7	Low	74 Å²	74	127.2 Å²	127.2	38%	0.379	65%	0.652	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105	119	169.7	-55.8	174.6	0	0	0	109	V12 D13 E15 V45 R49	V12-I47 VanDerWaalsContact CG1-C 3.47Å; V12-I47 WeakPolarHBondContact CG1-O 3.43Å; D13-I47 PolarHBondContact N-O 2.97Å; D13-I47 WeakPolarHBondContact O-CA 3.32Å; D13-I47 PolarHBondContact O-N 2.91Å; E15-I47 HydrophobicContact CB-CD1 3.65Å; E15-I47 HydrophobicContact CB-CG1 4.18Å; E15-I47 HydrophobicContact CG-CD1 4.46Å; V45-I47 PolarHBondContact O-N 3.24Å; I47-R49 PolarHBondContact O-N 3.15Å
48	P	60.7	Low	57.3	Low	104 Å²	104	121.8 Å²	121.8	68%	0.675	66%	0.656	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-57.3	126.2	173.9	-11.9	19.1	0	0	0	110.8	R50	P48-R50 PolarHBondContact O-N 3.39Å
49	R	57.3	Low	55	Low	136 Å²	136	118.3 Å²	118.3	51%	0.513	66%	0.658	S	S	.	*			trans	-57.4	104.1	177.2	-78.6	-174.2	176.2	148.1	15.5	110.4	E4 D13 I47	E4-R49 IonicContact OE1-NH2 3.39Å; E4-R49 PolarHBondContact OE1-NH2 2.78Å; D13-R49 HydrophobicContact CB-CG 4.45Å; D13-R49 IonicContact OD1-CZ 3.41Å; D13-R49 IonicContact OD1-NE 2.78Å; D13-R49 PolarHBondContact OD1-NE 3.39Å; D13-R49 IonicContact OD1-NH2 3.15Å; D13-R49 PolarHBondContact OD1-NH2 2.75Å; D13-R49 VanDerWaalsContact OD1-NH2 3.15Å; D13-R49 WeakPolarHBondContact OD2-CG 3.44Å; D13-R49 IonicContact OD2-NE 3.88Å; I47-R49 PolarHBondContact O-N 3.15Å
50	R	45.3	Very low	53.1	Low	235 Å²	235	113.2 Å²	113.2	89%	0.887	64%	0.642	S	S	*	*			trans	-86.4	112.6	176.7	-135.2	173.7	177	173.4	-1.7	108.3	P48 T52	P48-R50 PolarHBondContact O-N 3.39Å; R50-T52 PolarHBondContact O-N 2.98Å; R50-T52 VanDerWaalsContact O-N 3.15Å
51	N	39.1	Very low	51.1	Low	165 Å²	165	115.3 Å²	115.3	88%	0.882	66%	0.66	S	S	*	*			trans	-51.2	122.2	171.8	-92.2	-18	0	0	0	109.6	N53	N51-N53 PolarHBondContact O-N 3.2Å; N51-N53 VanDerWaalsContact O-N 3.08Å
52	T	33.6	Very low	49.2	Very low	132 Å²	132	115.6 Å²	115.6	81%	0.81	66%	0.658	S	S	*	*	S	Bend	trans	-68	101.9	-174.6	39.7	0	0	0	0	111.1	R50	R50-T52 PolarHBondContact O-N 2.98Å; R50-T52 VanDerWaalsContact O-N 3.15Å
53	N	31.3	Very low	47.1	Very low	156 Å²	156	115.5 Å²	115.5	83%	0.834	66%	0.661	S	S	*	*			trans	-165.9	76.1	149.6	-95.1	-19.6	0	0	0	107.3	N51	N51-N53 PolarHBondContact O-N 3.2Å; N51-N53 VanDerWaalsContact O-N 3.08Å
54	E	34.3	Very low	45.4	Very low	154 Å²	154	114.5 Å²	114.5	72%	0.72	66%	0.664	S	S	*	*	S	Bend	trans	174.3	123.7	139.3	-94.8	166	-172.7	0	0	112.5	K73	E54-K73 VanDerWaalsContact OE1-CE 3.28Å; E54-K73 WeakPolarHBondContact OE1-CE 3.31Å; E54-K73 IonicContact OE1-NZ 2.63Å; E54-K73 PolarHBondContact OE1-NZ 2.83Å
55	S	35.4	Very low	43.5	Very low	115 Å²	115	115.5 Å²	115.5	80%	0.804	67%	0.666	S	S	*	*			trans	-16.2	121.7	164.8	-47.8	0	0	0	0	119.2
56	K	29.2	Very low	42	Very low	209 Å²	209	115.6 Å²	115.6	91%	0.909	66%	0.664	S	S	*	*			trans	-1.3	117.4	144.9	-63.8	178.8	176.8	-178.2	0	117.8
57	S	36	Very low	40.6	Very low	120 Å²	120	113.7 Å²	113.7	84%	0.839	65%	0.65	S	S	*	*			trans	-160.8	123.1	131.7	58.5	0	0	0	0	109
58	G	29	Very low	39.7	Very low	80 Å²	80	114.1 Å²	114.1	83%	0.825	65%	0.653	S	S	*	*			trans	-76.9	171.2	-173.3	0	0	0	0	0	115.2
59	G	28.4	Very low	39.2	Very low	83 Å²	83	111 Å²	111	86%	0.856	63%	0.629	S	S	*	*			trans	67.4	93.3	157.4	0	0	0	0	0	115.8
60	S	36.6	Very low	38.8	Very low	73 Å²	73	113.4 Å²	113.4	51%	0.51	64%	0.643	S	S	.	*			trans	-144.1	103.6	156.8	50.8	0	0	0	0	111.1	H62	S60-H62 PolarHBondContact O-CD2 3.48Å; S60-H62 VanDerWaalsContact O-CD2 3.26Å; S60-H62 PolarHBondContact O-N 3.43Å; S60-H62 PolarHBondContact OG-CE1 3.32Å; S60-H62 VanDerWaalsContact OG-CE1 3.23Å; S60-H62 PolarHBondContact OG-NE2 2.75Å
61	S	37.9	Very low	38.9	Very low	92 Å²	92	106.7 Å²	106.7	64%	0.643	63%	0.632	S	S	*	*			trans	-38.8	112.3	136.1	50.9	0	0	0	0	109.2	P63	S61-P63 WeakPolarHBondContact O-CD 3.32Å
62	H	39.2	Very low	39.5	Very low	130 Å²	130	100.1 Å²	100.1	60%	0.602	60%	0.597	S	S	*	*			trans	-103.3	103.3	171.3	-72.1	-71.3	0	0	0	108.1	S60	S60-H62 PolarHBondContact O-CD2 3.48Å; S60-H62 VanDerWaalsContact O-CD2 3.26Å; S60-H62 PolarHBondContact O-N 3.43Å; S60-H62 PolarHBondContact OG-CE1 3.32Å; S60-H62 VanDerWaalsContact OG-CE1 3.23Å; S60-H62 PolarHBondContact OG-NE2 2.75Å
63	P	36.9	Very low	40	Very low	58 Å²	58	101.2 Å²	101.2	38%	0.377	59%	0.59	S	S	.	*			trans	-85.1	130.2	157.6	32.1	-24.9	0	0	0	108.1	S61	S61-P63 WeakPolarHBondContact O-CD 3.32Å
64	V	42.3	Very low	40.7	Very low	96 Å²	96	96.1 Å²	96.1	58%	0.582	57%	0.565	S	S	*	*	S	Bend	trans	64.2	137.5	168.9	-134.7	0	0	0	0	115.8	L66	V64-L66 PolarHBondContact O-N 2.99Å
65	P	38.3	Very low	41	Very low	67 Å²	67	94 Å²	94	44%	0.435	56%	0.564	S	S	.	*			trans	-75	54.1	-176.6	32.3	-37.3	0	0	0	112.6	L67	P65-L67 PolarHBondContact O-N 3.32Å
66	L	46	Very low	41.1	Very low	84 Å²	84	94.5 Å²	94.5	44%	0.44	57%	0.568	S	S	.	*			trans	-64.1	122.2	159.4	-157.3	79.1	0	0	0	106.8	V64 D68	V64-L66 PolarHBondContact O-N 2.99Å; L66-D68 PolarHBondContact O-N 3.43Å
67	L	45.9	Very low	41.6	Very low	25 Å²	25	87 Å²	87	13%	0.131	54%	0.542	C	S	.	.			trans	-47.2	118.6	175.8	-85.2	154.6	0	0	0	110.2	P65 F69 F90 L101 R104 N105	P65-L67 PolarHBondContact O-N 3.32Å; L67-F69 HydrophobicContact CB-CD2 4.32Å; L67-F69 HydrophobicContact CB-CE1 4.07Å; L67-F69 HydrophobicContact CB-CE2 3.84Å; L67-F69 HydrophobicContact CB-CZ 3.67Å; L67-F69 HydrophobicContact CD1-CE1 4.35Å; L67-F69 HydrophobicContact CD1-CZ 4.06Å; L67-F69 WeakPolarHBondContact O-CD2 3.12Å; L67-F69 WeakPolarHBondContact O-CE2 3.42Å; L67-F69 PolarHBondContact O-N 3.49Å; L67-F90 HydrophobicContact CD1-CZ 4.39Å; L67-L101 HydrophobicContact CD1-CD1 3.18Å; L67-L101 HydrophobicContact CD1-CG 4.4Å; L67-R104 HydrophobicContact CD1-CB 4.45Å; L67-R104 HydrophobicContact CD2-CB 4.48Å; L67-R104 HydrophobicContact CG-CB 4.04Å; L67-N105 HydrophobicContact CD1-CB 3.91Å
68	D	51.3	Low	41.9	Very low	83 Å²	83	87 Å²	87	44%	0.444	54%	0.542	S	S	.	.			trans	-71.8	87.1	171.1	-176.3	14	0	0	0	109.3	L66 K70 S71	L66-D68 PolarHBondContact O-N 3.43Å; D68-K70 PolarHBondContact O-N 3.02Å; D68-K70 VanDerWaalsContact OD1-CB 3.22Å; D68-K70 WeakPolarHBondContact OD1-CB 3.34Å; D68-K70 WeakPolarHBondContact OD1-CG 3.25Å; D68-K70 PolarHBondContact OD1-N 3.36Å; D68-K70 VanDerWaalsContact OD1-N 3.17Å; D68-S71 PolarHBondContact O-N 3.33Å; D68-S71 VanDerWaalsContact O-N 3.14Å; D68-S71 PolarHBondContact O-OG 3.07Å
69	F	51	Low	43	Very low	38 Å²	38	86.9 Å²	86.9	17%	0.167	54%	0.541	C	S	.	.	G	3₁₀ helix	trans	-61.4	-11.3	178.4	-67.3	-73.8	0	0	0	113.2	L67 S71 I72 I86 F90 L108 F122	L67-F69 HydrophobicContact CB-CD2 4.32Å; L67-F69 HydrophobicContact CB-CE1 4.07Å; L67-F69 HydrophobicContact CB-CE2 3.84Å; L67-F69 HydrophobicContact CB-CZ 3.67Å; L67-F69 HydrophobicContact CD1-CE1 4.35Å; L67-F69 HydrophobicContact CD1-CZ 4.06Å; L67-F69 WeakPolarHBondContact O-CD2 3.12Å; L67-F69 WeakPolarHBondContact O-CE2 3.42Å; L67-F69 PolarHBondContact O-N 3.49Å; F69-S71 PolarHBondContact O-N 2.99Å; F69-I72 HydrophobicContact CD1-CD1 3.68Å; F69-I72 HydrophobicContact CE1-CD1 4.21Å; F69-I72 PolarHBondContact O-N 3.17Å; F69-I86 HydrophobicContact CD1-CD1 4.2Å; F69-I86 HydrophobicContact CD1-CG2 3.92Å; F69-I86 HydrophobicContact CE1-CG2 3.9Å; F69-F90 AromaticContact CE1-CE2 3.95Å; F69-F90 HydrophobicContact CE1-CE2 3.95Å; F69-F90 HydrophobicContact CE1-CZ 4.27Å; F69-L108 HydrophobicContact CE1-CD1 4.39Å; F69-L108 HydrophobicContact CE2-CD1 3.91Å; F69-L108 HydrophobicContact CZ-CD1 3.38Å; F69-F122 AromaticContact CD1-CE2 3.97Å; F69-F122 HydrophobicContact CD1-CE2 3.97Å; F69-F122 AromaticContact CD2-CE2 3.81Å; F69-F122 HydrophobicContact CD2-CE2 3.81Å; F69-F122 HydrophobicContact CE1-CE2 4.15Å; F69-F122 HydrophobicContact CE2-CD2 4.35Å; F69-F122 AromaticContact CE2-CE2 3.97Å; F69-F122 HydrophobicContact CE2-CE2 3.97Å; F69-F122 AromaticContact CG-CE2 3.83Å; F69-F122 HydrophobicContact CG-CE2 3.83Å; F69-F122 HydrophobicContact CG-CZ 4.44Å; F69-F122 HydrophobicContact CZ-CD2 4.4Å; F69-F122 HydrophobicContact CZ-CE2 4.16Å
70	K	47.1	Very low	44.3	Very low	187 Å²	187	87 Å²	87	81%	0.813	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-65.7	-24.9	174	-63	178	179	174.2	0	112.5	D68 I72	D68-K70 PolarHBondContact O-N 3.02Å; D68-K70 VanDerWaalsContact OD1-CB 3.22Å; D68-K70 WeakPolarHBondContact OD1-CB 3.34Å; D68-K70 WeakPolarHBondContact OD1-CG 3.25Å; D68-K70 PolarHBondContact OD1-N 3.36Å; D68-K70 VanDerWaalsContact OD1-N 3.17Å; K70-I72 VanDerWaalsContact C-N 3.31Å
71	S	47.3	Very low	45.6	Very low	93 Å²	93	84.4 Å²	84.4	65%	0.65	51%	0.513	S	S	*	.	G	3₁₀ helix	trans	-77.6	-14.7	176.8	65.6	0	0	0	0	113.7	D68 F69 K73	D68-S71 PolarHBondContact O-N 3.33Å; D68-S71 VanDerWaalsContact O-N 3.14Å; D68-S71 PolarHBondContact O-OG 3.07Å; F69-S71 PolarHBondContact O-N 2.99Å; S71-K73 PolarHBondContact O-N 2.87Å
72	I	51.9	Low	47.2	Very low	27 Å²	27	83.2 Å²	83.2	14%	0.138	50%	0.499	C	S	.	.	S	Bend	trans	-81.3	106	178	-54.5	-172.3	0	0	0	108.8	F69 K70 V74 I86 F90	F69-I72 HydrophobicContact CD1-CD1 3.68Å; F69-I72 HydrophobicContact CE1-CD1 4.21Å; F69-I72 PolarHBondContact O-N 3.17Å; K70-I72 VanDerWaalsContact C-N 3.31Å; I72-V74 VanDerWaalsContact C-N 3.27Å; I72-V74 HydrophobicContact CG2-CG1 4.49Å; I72-V74 PolarHBondContact O-N 3.33Å; I72-I86 HydrophobicContact CD1-CG2 4.34Å; I72-F90 HydrophobicContact CD1-CE2 3.81Å; I72-F90 HydrophobicContact CD1-CZ 3.74Å
73	K	44.5	Very low	49.1	Very low	155 Å²	155	77.4 Å²	77.4	67%	0.674	47%	0.473	S	S	*	.			trans	-67.7	84.5	169.5	-73.6	-175.2	-179.3	177.2	0	110.2	E54 S71	E54-K73 VanDerWaalsContact OE1-CE 3.28Å; E54-K73 WeakPolarHBondContact OE1-CE 3.31Å; E54-K73 IonicContact OE1-NZ 2.63Å; E54-K73 PolarHBondContact OE1-NZ 2.83Å; S71-K73 PolarHBondContact O-N 2.87Å
74	V	46.3	Very low	51.2	Low	49 Å²	49	78.3 Å²	78.3	30%	0.297	47%	0.472	S	S	.	.			trans	-77.1	132.5	167.2	-102.4	0	0	0	0	109.8	I72 S76 A85 I86	I72-V74 VanDerWaalsContact C-N 3.27Å; I72-V74 HydrophobicContact CG2-CG1 4.49Å; I72-V74 PolarHBondContact O-N 3.33Å; V74-S76 PolarHBondContact O-N 3.17Å; V74-A85 HydrophobicContact CG1-CB 3.66Å; V74-I86 HydrophobicContact CG1-CG1 3.99Å
75	P	41	Very low	53	Low	109 Å²	109	75 Å²	75	71%	0.708	46%	0.455	S	S	*	.			trans	-55.1	133	171.2	-20.8	30.5	0	0	0	110	S77	P75-S77 PolarHBondContact O-N 2.78Å
76	S	36.4	Very low	54.9	Low	127 Å²	127	72 Å²	72	89%	0.888	44%	0.435	S	S	*	.			trans	-41.5	98.7	-177.3	54.2	0	0	0	0	112.8	V74	V74-S76 PolarHBondContact O-N 3.17Å
77	S	39.7	Very low	56.7	Low	51 Å²	51	69.5 Å²	69.5	36%	0.357	42%	0.42	S	S	.	.			trans	-124.8	114.8	166.9	57.2	0	0	0	0	108.5	P75 G79	P75-S77 PolarHBondContact O-N 2.78Å; S77-G79 PolarHBondContact O-N 2.84Å
78	S	42.1	Very low	58.4	Low	120 Å²	120	73.1 Å²	73.1	84%	0.839	43%	0.434	S	S	*	.			trans	-64.2	124.6	180	-46.1	0	0	0	0	110.7	S80	S78-S80 PolarHBondContact O-N 3.06Å
79	G	52.1	Low	59.7	Low	78 Å²	78	72.6 Å²	72.6	80%	0.804	43%	0.429	S	S	*	.	S	Bend	trans	78.1	-33.2	145.9	0	0	0	0	0	120.6	S77	S77-G79 PolarHBondContact O-N 2.84Å
80	S	55.9	Low	61	Low	84 Å²	84	71.2 Å²	71.2	59%	0.587	42%	0.423	S	S	*	.	S	Bend	trans	-138.8	-13.3	-177.5	81.9	0	0	0	0	116	S78 R119	S78-S80 PolarHBondContact O-N 3.06Å; S80-R119 PolarHBondContact O-NH1 2.89Å; S80-R119 PolarHBondContact O-NH2 3.35Å; S80-R119 VanDerWaalsContact O-NH2 3.09Å
81	G	65	Low	62.6	Low	20 Å²	20	65.6 Å²	65.6	21%	0.206	40%	0.402	C	S	.	.	S	Bend	trans	-88.7	-8.1	-178.5	0	0	0	0	0	115.2	E84 A85	G81-E84 PolarHBondContact O-N 2.7Å; G81-A85 WeakPolarHBondContact O-CB 3.48Å; G81-A85 PolarHBondContact O-N 2.89Å
82	I	71.1	Confident	64	Low	66 Å²	66	66.7 Å²	66.7	34%	0.338	41%	0.405	S	S	.	.	H	α-helix	trans	-58.9	-48.3	-171	-57.4	171	0	0	0	112.7	E84 A85 I86	I82-E84 VanDerWaalsContact C-N 3.28Å; I82-E84 PolarHBondContact O-N 2.87Å; I82-A85 PolarHBondContact O-N 3.37Å; I82-I86 HydrophobicContact CG2-CD1 3.72Å; I82-I86 HydrophobicContact CG2-CG1 4.34Å; I82-I86 WeakPolarHBondContact O-CG1 3.31Å; I82-I86 PolarHBondContact O-N 3.26Å
83	P	78.1	Confident	64.9	Low	8 Å²	8	66.5 Å²	66.5	5%	0.052	41%	0.409	C	S	.	.	H	α-helix	trans	-62	-38.1	-179.5	-21.7	33.7	0	0	0	112.1	R87 F118 R119 F122	P83-R87 WeakPolarHBondContact O-CB 3.47Å; P83-R87 PolarHBondContact O-N 2.64Å; P83-F118 VanDerWaalsContact O-CE1 3.31Å; P83-F118 WeakPolarHBondContact O-CE1 3.43Å; P83-R119 HydrophobicContact CB-CB 4.32Å; P83-R119 HydrophobicContact CB-CG 4.29Å; P83-R119 HydrophobicContact CG-CG 4.27Å; P83-F122 HydrophobicContact CB-CB 4.48Å; P83-F122 HydrophobicContact CB-CD1 3.95Å; P83-F122 HydrophobicContact CB-CG 4.31Å; P83-F122 HydrophobicContact CG-CD1 3.81Å; P83-F122 HydrophobicContact CG-CE1 4.23Å
84	E	81.1	Confident	66.1	Low	78 Å²	78	62.5 Å²	62.5	36%	0.364	41%	0.405	S	S	.	.	H	α-helix	trans	-73.1	-37.1	179.8	-161.5	-169	156.5	0	0	112	G81 I82 R87 K88	G81-E84 PolarHBondContact O-N 2.7Å; I82-E84 VanDerWaalsContact C-N 3.28Å; I82-E84 PolarHBondContact O-N 2.87Å; E84-R87 PolarHBondContact O-N 2.86Å; E84-K88 WeakPolarHBondContact O-CB 3.46Å; E84-K88 WeakPolarHBondContact O-CG 3.36Å; E84-K88 PolarHBondContact O-N 2.89Å; E84-K88 WeakPolarHBondContact OE1-CE 3.47Å; E84-K88 IonicContact OE1-NZ 2.69Å; E84-K88 PolarHBondContact OE1-NZ 3.14Å
85	A	80.1	Confident	67.3	Low	27 Å²	27	64.8 Å²	64.8	22%	0.223	42%	0.423	C	S	.	.	H	α-helix	trans	-64.7	-42.5	175.7	0	0	0	0	0	111.6	V74 G81 I82 K88 H89	V74-A85 HydrophobicContact CG1-CB 3.66Å; G81-A85 WeakPolarHBondContact O-CB 3.48Å; G81-A85 PolarHBondContact O-N 2.89Å; I82-A85 PolarHBondContact O-N 3.37Å; A85-K88 PolarHBondContact O-N 2.9Å; A85-H89 PolarHBondContact O-N 3.46Å
86	I	79.2	Confident	68.8	Low	4 Å²	4	69 Å²	69	2%	0.021	43%	0.425	C	S	.	.	H	α-helix	trans	-64.5	-48.1	175.3	-67.9	171.7	0	0	0	110.5	F69 I72 V74 I82 K88 H89 F90 F118 F122	F69-I86 HydrophobicContact CD1-CD1 4.2Å; F69-I86 HydrophobicContact CD1-CG2 3.92Å; F69-I86 HydrophobicContact CE1-CG2 3.9Å; I72-I86 HydrophobicContact CD1-CG2 4.34Å; V74-I86 HydrophobicContact CG1-CG1 3.99Å; I82-I86 HydrophobicContact CG2-CD1 3.72Å; I82-I86 HydrophobicContact CG2-CG1 4.34Å; I82-I86 WeakPolarHBondContact O-CG1 3.31Å; I82-I86 PolarHBondContact O-N 3.26Å; I86-K88 VanDerWaalsContact C-N 3.31Å; I86-K88 PolarHBondContact O-N 3.05Å; I86-H89 WeakPolarHBondContact O-CA 3.07Å; I86-H89 VanDerWaalsContact O-CB 3.31Å; I86-H89 WeakPolarHBondContact O-CB 3.39Å; I86-H89 PolarHBondContact O-N 2.86Å; I86-F90 HydrophobicContact CG2-CD2 3.86Å; I86-F90 HydrophobicContact CG2-CE2 3.56Å; I86-F90 VanDerWaalsContact O-CD2 3.25Å; I86-F90 WeakPolarHBondContact O-CD2 3.39Å; I86-F90 PolarHBondContact O-N 3.38Å; I86-F118 HydrophobicContact CG2-CZ 4.28Å; I86-F122 HydrophobicContact CD1-CE1 4.35Å; I86-F122 HydrophobicContact CD1-CE2 3.58Å; I86-F122 HydrophobicContact CD1-CZ 3.4Å; I86-F122 VanDerWaalsContact CD1-CZ 3.4Å
87	R	83	Confident	70.3	Confident	30 Å²	30	65.8 Å²	65.8	11%	0.113	40%	0.396	C	S	.	.	H	α-helix	trans	-56.7	-45.1	176.3	-165.7	-172.4	72.1	86.2	3.9	111.9	P83 E84 H89 F90 L91 I112 F118	P83-R87 WeakPolarHBondContact O-CB 3.47Å; P83-R87 PolarHBondContact O-N 2.64Å; E84-R87 PolarHBondContact O-N 2.86Å; R87-H89 VanDerWaalsContact C-N 3.32Å; R87-H89 PolarHBondContact O-N 2.76Å; R87-F90 PolarHBondContact O-N 2.87Å; R87-L91 HydrophobicContact CG-CD1 4.3Å; R87-L91 WeakPolarHBondContact O-CG 3.38Å; R87-L91 PolarHBondContact O-N 3.26Å; R87-I112 WeakPolarHBondContact CD-O 3.15Å; R87-I112 HydrophobicContact CG-CG1 4.25Å; R87-I112 WeakPolarHBondContact CG-O 3.42Å; R87-I112 PolarHBondContact NH1-O 3.42Å; R87-F118 HydrophobicContact CB-CD1 3.73Å; R87-F118 HydrophobicContact CB-CD2 4.41Å; R87-F118 HydrophobicContact CB-CE1 3.7Å; R87-F118 HydrophobicContact CB-CE2 4.36Å; R87-F118 HydrophobicContact CB-CG 4.1Å; R87-F118 HydrophobicContact CB-CZ 4.02Å; R87-F118 HydrophobicContact CG-CB 4.35Å; R87-F118 HydrophobicContact CG-CD1 3.98Å; R87-F118 HydrophobicContact CG-CD2 3.92Å; R87-F118 HydrophobicContact CG-CE1 4.26Å; R87-F118 HydrophobicContact CG-CE2 4.18Å; R87-F118 HydrophobicContact CG-CG 3.8Å; R87-F118 HydrophobicContact CG-CZ 4.35Å
88	K	81.2	Confident	72	Confident	101 Å²	101	66.4 Å²	66.4	44%	0.439	40%	0.395	S	S	.	.	H	α-helix	trans	-63.7	-36.6	175.3	-77.3	178	-176.4	166.4	0	111.7	E84 A85 I86 L91 T92	E84-K88 WeakPolarHBondContact O-CB 3.46Å; E84-K88 WeakPolarHBondContact O-CG 3.36Å; E84-K88 PolarHBondContact O-N 2.89Å; E84-K88 WeakPolarHBondContact OE1-CE 3.47Å; E84-K88 IonicContact OE1-NZ 2.69Å; E84-K88 PolarHBondContact OE1-NZ 3.14Å; A85-K88 PolarHBondContact O-N 2.9Å; I86-K88 VanDerWaalsContact C-N 3.31Å; I86-K88 PolarHBondContact O-N 3.05Å; K88-L91 PolarHBondContact O-N 3.41Å; K88-T92 VanDerWaalsContact O-CB 3.29Å; K88-T92 WeakPolarHBondContact O-CB 3.48Å; K88-T92 VanDerWaalsContact O-CG2 3.28Å; K88-T92 WeakPolarHBondContact O-CG2 3.28Å; K88-T92 PolarHBondContact O-N 3.18Å; K88-T92 PolarHBondContact O-OG1 3.27Å
89	H	80.5	Confident	73.5	Confident	72 Å²	72	63.9 Å²	63.9	33%	0.333	38%	0.377	S	S	.	.	H	α-helix	trans	-60.3	-46.4	175.3	-172.3	69.7	0	0	0	111.5	A85 I86 R87 L91 T92 G93 Q97	A85-H89 PolarHBondContact O-N 3.46Å; I86-H89 WeakPolarHBondContact O-CA 3.07Å; I86-H89 VanDerWaalsContact O-CB 3.31Å; I86-H89 WeakPolarHBondContact O-CB 3.39Å; I86-H89 PolarHBondContact O-N 2.86Å; R87-H89 VanDerWaalsContact C-N 3.32Å; R87-H89 PolarHBondContact O-N 2.76Å; H89-L91 PolarHBondContact O-N 3.16Å; H89-T92 PolarHBondContact O-N 2.87Å; H89-T92 PolarHBondContact O-OG1 3.09Å; H89-G93 WeakPolarHBondContact O-CA 3.4Å; H89-G93 PolarHBondContact O-N 2.86Å; H89-Q97 PolarHBondContact O-OE1 2.87Å
90	F	77.5	Confident	74.5	Confident	10 Å²	10	62.7 Å²	62.7	4%	0.044	35%	0.352	C	S	.	.	H	α-helix	trans	-66.6	-36.7	176.6	-74.8	-73.3	0	0	0	113.3	L67 F69 I72 I86 R87 Q97 L98 L101 I112	L67-F90 HydrophobicContact CD1-CZ 4.39Å; F69-F90 AromaticContact CE1-CE2 3.95Å; F69-F90 HydrophobicContact CE1-CE2 3.95Å; F69-F90 HydrophobicContact CE1-CZ 4.27Å; I72-F90 HydrophobicContact CD1-CE2 3.81Å; I72-F90 HydrophobicContact CD1-CZ 3.74Å; I86-F90 HydrophobicContact CG2-CD2 3.86Å; I86-F90 HydrophobicContact CG2-CE2 3.56Å; I86-F90 VanDerWaalsContact O-CD2 3.25Å; I86-F90 WeakPolarHBondContact O-CD2 3.39Å; I86-F90 PolarHBondContact O-N 3.38Å; R87-F90 PolarHBondContact O-N 2.87Å; F90-Q97 HydrophobicContact CD1-CB 4.12Å; F90-L98 HydrophobicContact CB-CD2 4.15Å; F90-L98 WeakPolarHBondContact O-CD2 3.2Å; F90-L101 HydrophobicContact CB-CD2 4.31Å; F90-L101 HydrophobicContact CD1-CB 4.05Å; F90-L101 HydrophobicContact CD1-CD2 4Å; F90-L101 HydrophobicContact CD1-CG 4.48Å; F90-L101 HydrophobicContact CD2-CD2 4.21Å; F90-L101 HydrophobicContact CE1-CB 3.95Å; F90-L101 HydrophobicContact CE1-CD1 4.3Å; F90-L101 HydrophobicContact CE1-CD2 4.38Å; F90-L101 HydrophobicContact CE1-CG 4.44Å; F90-L101 HydrophobicContact CE2-CD1 4.39Å; F90-L101 HydrophobicContact CG-CD2 3.92Å; F90-L101 HydrophobicContact CZ-CD1 4.14Å; F90-I112 HydrophobicContact CB-CD1 3.61Å
91	L	80.2	Confident	75.3	Confident	69 Å²	69	58.8 Å²	58.8	36%	0.361	32%	0.324	S	S	.	.	H	α-helix	trans	-74.5	-30.9	177.6	-73.4	173.2	0	0	0	113.8	R87 K88 H89 I112	R87-L91 HydrophobicContact CG-CD1 4.3Å; R87-L91 WeakPolarHBondContact O-CG 3.38Å; R87-L91 PolarHBondContact O-N 3.26Å; K88-L91 PolarHBondContact O-N 3.41Å; H89-L91 PolarHBondContact O-N 3.16Å; L91-I112 HydrophobicContact CD2-CD1 4.25Å; L91-I112 HydrophobicContact CD2-CG1 3.95Å; L91-I112 HydrophobicContact CG-CD1 4.32Å; L91-I112 HydrophobicContact CG-CG1 4.01Å
92	T	77.6	Confident	75.7	Confident	116 Å²	116	59.4 Å²	59.4	71%	0.712	33%	0.331	S	S	*	.	H	α-helix	trans	-90	-17.1	178.3	55.7	0	0	0	0	112.7	K88 H89	K88-T92 VanDerWaalsContact O-CB 3.29Å; K88-T92 WeakPolarHBondContact O-CB 3.48Å; K88-T92 VanDerWaalsContact O-CG2 3.28Å; K88-T92 WeakPolarHBondContact O-CG2 3.28Å; K88-T92 PolarHBondContact O-N 3.18Å; K88-T92 PolarHBondContact O-OG1 3.27Å; H89-T92 PolarHBondContact O-N 2.87Å; H89-T92 PolarHBondContact O-OG1 3.09Å
93	G	71.1	Confident	75.6	Confident	23 Å²	23	63.6 Å²	63.6	24%	0.237	35%	0.349	C	S	.	.	S	Bend	trans	-69.8	167.1	177.6	0	0	0	0	0	113.7	H89	H89-G93 WeakPolarHBondContact O-CA 3.4Å; H89-G93 PolarHBondContact O-N 2.86Å
94	A	69.8	Low	74.9	Confident	70 Å²	70	69.6 Å²	69.6	58%	0.579	37%	0.371	S	S	*	.			trans	-60.8	148.8	172.7	0	0	0	0	0	110.7	R96 Q97	A94-R96 PolarHBondContact O-N 3.4Å; A94-Q97 PolarHBondContact O-N 3.15Å
95	S	71	Confident	74.5	Confident	97 Å²	97	66.1 Å²	66.1	68%	0.678	36%	0.355	S	S	*	.	H	α-helix	trans	-48.8	-27.9	179.5	-55.7	0	0	0	0	114	Q97 L98 S99	S95-Q97 VanDerWaalsContact C-N 3.3Å; S95-Q97 PolarHBondContact O-N 3.39Å; S95-L98 PolarHBondContact O-N 3.47Å; S95-S99 PolarHBondContact O-N 2.99Å; S95-S99 VanDerWaalsContact O-N 3.14Å; S95-S99 PolarHBondContact O-OG 3.48Å
96	R	71.2	Confident	74.5	Confident	197 Å²	197	69 Å²	69	74%	0.743	37%	0.371	S	S	*	.	H	α-helix	trans	-56.6	-37	173.4	-171.8	178.4	-177.9	-165.9	1.3	113.7	A94 L98 S99 I100	A94-R96 PolarHBondContact O-N 3.4Å; R96-L98 VanDerWaalsContact C-N 3.33Å; R96-S99 PolarHBondContact O-N 2.86Å; R96-I100 HydrophobicContact CG-CD1 4.04Å; R96-I100 VanDerWaalsContact O-CG1 3.27Å; R96-I100 WeakPolarHBondContact O-CG1 3.2Å; R96-I100 PolarHBondContact O-N 2.96Å
97	Q	69	Low	74.6	Confident	60 Å²	60	74.6 Å²	74.6	28%	0.28	40%	0.397	S	S	.	.	H	α-helix	trans	-69	-34.6	179.8	-66	-175.4	-2	0	0	111.9	H89 F90 A94 S95 I100 L101	H89-Q97 PolarHBondContact O-OE1 2.87Å; F90-Q97 HydrophobicContact CD1-CB 4.12Å; A94-Q97 PolarHBondContact O-N 3.15Å; S95-Q97 VanDerWaalsContact C-N 3.3Å; S95-Q97 PolarHBondContact O-N 3.39Å; Q97-I100 PolarHBondContact O-N 2.9Å; Q97-L101 WeakPolarHBondContact O-CB 3.32Å; Q97-L101 PolarHBondContact O-N 3.08Å
98	L	75	Confident	74.5	Confident	64 Å²	64	73.1 Å²	73.1	34%	0.335	39%	0.391	S	S	.	.	H	α-helix	trans	-68.6	-40	174.2	-67.7	172.3	0	0	0	111.5	F90 S95 R96 L101 G102 I112	F90-L98 HydrophobicContact CB-CD2 4.15Å; F90-L98 WeakPolarHBondContact O-CD2 3.2Å; S95-L98 PolarHBondContact O-N 3.47Å; R96-L98 VanDerWaalsContact C-N 3.33Å; L98-L101 PolarHBondContact O-N 3.19Å; L98-G102 PolarHBondContact O-N 3.47Å; L98-I112 HydrophobicContact CD2-CD1 3.25Å
99	S	73.7	Confident	74.5	Confident	67 Å²	67	69.7 Å²	69.7	47%	0.469	38%	0.382	S	S	.	.	H	α-helix	trans	-60.3	-46.8	173.6	-56.6	0	0	0	0	111.5	S95 R96 L101 G102 E103	S95-S99 PolarHBondContact O-N 2.99Å; S95-S99 VanDerWaalsContact O-N 3.14Å; S95-S99 PolarHBondContact O-OG 3.48Å; R96-S99 PolarHBondContact O-N 2.86Å; S99-L101 VanDerWaalsContact C-N 3.32Å; S99-L101 PolarHBondContact O-N 3.37Å; S99-G102 PolarHBondContact O-N 3.41Å; S99-G102 VanDerWaalsContact O-N 3.17Å; S99-E103 WeakPolarHBondContact O-CG 3.42Å; S99-E103 PolarHBondContact O-N 2.88Å
100	I	72.6	Confident	74.8	Confident	54 Å²	54	70.2 Å²	70.2	28%	0.277	40%	0.398	S	S	.	.	H	α-helix	trans	-63	-39.3	177	-66.2	166.5	0	0	0	111.3	R96 Q97 E103 R104	R96-I100 HydrophobicContact CG-CD1 4.04Å; R96-I100 VanDerWaalsContact O-CG1 3.27Å; R96-I100 WeakPolarHBondContact O-CG1 3.2Å; R96-I100 PolarHBondContact O-N 2.96Å; Q97-I100 PolarHBondContact O-N 2.9Å; I100-E103 PolarHBondContact O-N 3.11Å; I100-R104 HydrophobicContact CG2-CG 4.3Å; I100-R104 WeakPolarHBondContact O-CB 3.36Å; I100-R104 WeakPolarHBondContact O-CG 3.3Å; I100-R104 PolarHBondContact O-N 3.4Å
101	L	72.2	Confident	75.2	Confident	1 Å²	1	71.2 Å²	71.2	1%	0.005	41%	0.405	C	S	.	.	H	α-helix	trans	-63.3	-43.3	174.9	-179.3	65.7	0	0	0	111.1	L67 F90 Q97 L98 S99 R104 N105 L108 A109 I112	L67-L101 HydrophobicContact CD1-CD1 3.18Å; L67-L101 HydrophobicContact CD1-CG 4.4Å; F90-L101 HydrophobicContact CB-CD2 4.31Å; F90-L101 HydrophobicContact CD1-CB 4.05Å; F90-L101 HydrophobicContact CD1-CD2 4Å; F90-L101 HydrophobicContact CD1-CG 4.48Å; F90-L101 HydrophobicContact CD2-CD2 4.21Å; F90-L101 HydrophobicContact CE1-CB 3.95Å; F90-L101 HydrophobicContact CE1-CD1 4.3Å; F90-L101 HydrophobicContact CE1-CD2 4.38Å; F90-L101 HydrophobicContact CE1-CG 4.44Å; F90-L101 HydrophobicContact CE2-CD1 4.39Å; F90-L101 HydrophobicContact CG-CD2 3.92Å; F90-L101 HydrophobicContact CZ-CD1 4.14Å; Q97-L101 WeakPolarHBondContact O-CB 3.32Å; Q97-L101 PolarHBondContact O-N 3.08Å; L98-L101 PolarHBondContact O-N 3.19Å; S99-L101 VanDerWaalsContact C-N 3.32Å; S99-L101 PolarHBondContact O-N 3.37Å; L101-R104 PolarHBondContact O-N 3.5Å; L101-N105 HydrophobicContact CD1-CB 4.23Å; L101-N105 CarbonylContact O-C 3.54Å; L101-N105 WeakPolarHBondContact O-CA 3.27Å; L101-N105 PolarHBondContact O-N 3.36Å; L101-N105 VanDerWaalsContact O-O 3.07Å; L101-L108 HydrophobicContact CD1-CB 4.07Å; L101-A109 HydrophobicContact CD2-CB 4.5Å; L101-A109 HydrophobicContact CG-CB 4.12Å; L101-I112 HydrophobicContact CD2-CD1 3.61Å
102	G	74.3	Confident	75.4	Confident	33 Å²	33	68.6 Å²	68.6	34%	0.34	39%	0.391	S	S	.	.	H	α-helix	trans	-61.2	-43.3	175.9	0	0	0	0	0	113.1	L98 S99	L98-G102 PolarHBondContact O-N 3.47Å; S99-G102 PolarHBondContact O-N 3.41Å; S99-G102 VanDerWaalsContact O-N 3.17Å
103	E	69.8	Low	75.8	Confident	155 Å²	155	69.4 Å²	69.4	72%	0.724	39%	0.391	S	S	*	.	H	α-helix	trans	-69.8	-38.3	179.2	-73.6	169.2	-170.5	0	0	112.7	S99 I100	S99-E103 WeakPolarHBondContact O-CG 3.42Å; S99-E103 PolarHBondContact O-N 2.88Å; I100-E103 PolarHBondContact O-N 3.11Å
104	R	63.5	Low	76.5	Confident	134 Å²	134	71.9 Å²	71.9	51%	0.506	40%	0.399	S	S	.	.	H	α-helix	trans	-96.5	-31.6	-171.8	-61.3	179.2	97.3	148.3	10.7	113.8	L67 I100 L101	L67-R104 HydrophobicContact CD1-CB 4.45Å; L67-R104 HydrophobicContact CD2-CB 4.48Å; L67-R104 HydrophobicContact CG-CB 4.04Å; I100-R104 HydrophobicContact CG2-CG 4.3Å; I100-R104 WeakPolarHBondContact O-CB 3.36Å; I100-R104 WeakPolarHBondContact O-CG 3.3Å; I100-R104 PolarHBondContact O-N 3.4Å; L101-R104 PolarHBondContact O-N 3.5Å
105	N	72.5	Confident	77.3	Confident	5 Å²	5	71.6 Å²	71.6	3%	0.027	39%	0.392	C	S	.	.			trans	-144.4	78.9	-178.2	-164.4	-37.6	0	0	0	110.6	L67 L101 E107 L108 A109 Q125	L67-N105 HydrophobicContact CD1-CB 3.91Å; L101-N105 HydrophobicContact CD1-CB 4.23Å; L101-N105 CarbonylContact O-C 3.54Å; L101-N105 WeakPolarHBondContact O-CA 3.27Å; L101-N105 PolarHBondContact O-N 3.36Å; L101-N105 VanDerWaalsContact O-O 3.07Å; N105-E107 PolarHBondContact O-N 2.91Å; N105-L108 HydrophobicContact CB-CB 4.41Å; N105-L108 WeakPolarHBondContact ND2-CD1 3.15Å; N105-L108 PolarHBondContact O-N 2.97Å; N105-L108 PolarHBondContact OD1-N 3.48Å; N105-L108 VanDerWaalsContact OD1-N 3.12Å; N105-A109 PolarHBondContact O-N 3.21Å; N105-Q125 PolarHBondContact ND2-NE2 3.46Å; N105-Q125 PolarHBondContact ND2-OE1 2.93Å; N105-Q125 PolarHBondContact OD1-NE2 3.26Å
106	P	79.8	Confident	78.1	Confident	87 Å²	87	71 Å²	71	57%	0.565	38%	0.383	S	S	*	.	H	α-helix	trans	-61.7	-31.6	-176.3	24	-33.9	0	0	0	112.4	A109 A110	P106-A109 PolarHBondContact O-N 2.95Å; P106-A110 WeakPolarHBondContact O-CB 3.41Å; P106-A110 PolarHBondContact O-N 3.26Å
107	E	80.5	Confident	78.8	Confident	121 Å²	121	62.6 Å²	62.6	57%	0.565	36%	0.357	S	S	*	.	H	α-helix	trans	-60.3	-48.9	176.6	-66	-171.1	158.1	0	0	112	N105 A110 V111 V121 Q125	N105-E107 PolarHBondContact O-N 2.91Å; E107-A110 PolarHBondContact O-N 3.32Å; E107-V111 WeakPolarHBondContact O-CG2 3.39Å; E107-V111 PolarHBondContact O-N 3.1Å; E107-V121 HydrophobicContact CB-CG1 4.05Å; E107-Q125 PolarHBondContact OE2-NE2 3.14Å
108	L	81.7	Confident	79.7	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-69.9	-34.8	176.8	-76.5	179	0	0	0	112.3	F69 L101 N105 A110 V111 I112 F118 V121 F122	F69-L108 HydrophobicContact CE1-CD1 4.39Å; F69-L108 HydrophobicContact CE2-CD1 3.91Å; F69-L108 HydrophobicContact CZ-CD1 3.38Å; L101-L108 HydrophobicContact CD1-CB 4.07Å; N105-L108 HydrophobicContact CB-CB 4.41Å; N105-L108 WeakPolarHBondContact ND2-CD1 3.15Å; N105-L108 PolarHBondContact O-N 2.97Å; N105-L108 PolarHBondContact OD1-N 3.48Å; N105-L108 VanDerWaalsContact OD1-N 3.12Å; L108-A110 VanDerWaalsContact C-N 3.33Å; L108-V111 PolarHBondContact O-N 3.32Å; L108-I112 PolarHBondContact O-N 3.2Å; L108-F118 HydrophobicContact CB-CE2 4.13Å; L108-F118 HydrophobicContact CD2-CD2 4.02Å; L108-F118 HydrophobicContact CD2-CE2 3.83Å; L108-F118 HydrophobicContact CD2-CG 4.47Å; L108-F118 HydrophobicContact CD2-CZ 4.1Å; L108-F118 HydrophobicContact CG-CE2 4.44Å; L108-V121 HydrophobicContact CD2-CB 3.87Å; L108-V121 HydrophobicContact CD2-CG1 3.54Å; L108-V121 HydrophobicContact CG-CG1 4Å; L108-F122 HydrophobicContact CD1-CD2 4.34Å; L108-F122 HydrophobicContact CD2-CB 4.11Å
109	A	82	Confident	80.3	Confident	28 Å²	28	60.3 Å²	60.3	23%	0.231	34%	0.341	C	S	.	.	H	α-helix	trans	-62.3	-41.1	176.3	0	0	0	0	0	111.7	L101 N105 P106 V111 I112	L101-A109 HydrophobicContact CD2-CB 4.5Å; L101-A109 HydrophobicContact CG-CB 4.12Å; N105-A109 PolarHBondContact O-N 3.21Å; P106-A109 PolarHBondContact O-N 2.95Å; A109-V111 VanDerWaalsContact C-N 3.31Å; A109-V111 PolarHBondContact O-N 3.14Å; A109-I112 VanDerWaalsContact O-CG2 3.27Å; A109-I112 WeakPolarHBondContact O-CG2 3.43Å; A109-I112 PolarHBondContact O-N 3.5Å
110	A	85.6	Confident	80.9	Confident	83 Å²	83	65.6 Å²	65.6	69%	0.686	35%	0.351	S	S	*	.	H	α-helix	trans	-63.9	-34.5	179.7	0	0	0	0	0	112.9	P106 E107 L108	P106-A110 WeakPolarHBondContact O-CB 3.41Å; P106-A110 PolarHBondContact O-N 3.26Å; E107-A110 PolarHBondContact O-N 3.32Å; L108-A110 VanDerWaalsContact C-N 3.33Å
111	V	86.6	Confident	81.6	Confident	32 Å²	32	64.6 Å²	64.6	19%	0.194	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	8.9	-176.7	-58.9	0	0	0	0	114	E107 L108 A109 N113 D114 A117 F118 V121	E107-V111 WeakPolarHBondContact O-CG2 3.39Å; E107-V111 PolarHBondContact O-N 3.1Å; L108-V111 PolarHBondContact O-N 3.32Å; A109-V111 VanDerWaalsContact C-N 3.31Å; A109-V111 PolarHBondContact O-N 3.14Å; V111-N113 PolarHBondContact O-N 3.03Å; V111-N113 VanDerWaalsContact O-N 3.09Å; V111-D114 PolarHBondContact O-N 3.38Å; V111-D114 VanDerWaalsContact O-O 3.09Å; V111-A117 HydrophobicContact CB-CB 3.87Å; V111-A117 HydrophobicContact CG1-CB 3.92Å; V111-F118 HydrophobicContact CG2-CB 4.16Å; V111-F118 HydrophobicContact CG2-CD2 4.18Å; V111-V121 HydrophobicContact CG1-CG2 4.35Å; V111-V121 HydrophobicContact CG2-CB 4.21Å; V111-V121 HydrophobicContact CG2-CG2 3.99Å
112	I	84.4	Confident	82.2	Confident	13 Å²	13	65.1 Å²	65.1	7%	0.067	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-30.4	-173.5	-166.9	157.1	0	0	0	114.4	R87 F90 L91 L98 L101 L108 A109	R87-I112 WeakPolarHBondContact CD-O 3.15Å; R87-I112 HydrophobicContact CG-CG1 4.25Å; R87-I112 WeakPolarHBondContact CG-O 3.42Å; R87-I112 PolarHBondContact NH1-O 3.42Å; F90-I112 HydrophobicContact CB-CD1 3.61Å; L91-I112 HydrophobicContact CD2-CD1 4.25Å; L91-I112 HydrophobicContact CD2-CG1 3.95Å; L91-I112 HydrophobicContact CG-CD1 4.32Å; L91-I112 HydrophobicContact CG-CG1 4.01Å; L98-I112 HydrophobicContact CD2-CD1 3.25Å; L101-I112 HydrophobicContact CD2-CD1 3.61Å; L108-I112 PolarHBondContact O-N 3.2Å; A109-I112 VanDerWaalsContact O-CG2 3.27Å; A109-I112 WeakPolarHBondContact O-CG2 3.43Å; A109-I112 PolarHBondContact O-N 3.5Å
113	N	85.4	Confident	82.7	Confident	133 Å²	133	67.8 Å²	67.8	71%	0.711	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-17.3	-179.6	-68.5	-40.2	0	0	0	113.5	V111	V111-N113 PolarHBondContact O-N 3.03Å; V111-N113 VanDerWaalsContact O-N 3.09Å
114	D	86.6	Confident	83.5	Confident	76 Å²	76	63.2 Å²	63.2	41%	0.406	34%	0.338	S	S	.	.			trans	-105.6	108.8	178.5	-179.9	-11.3	0	0	0	110.2	V111 V116 A117 F118	V111-D114 PolarHBondContact O-N 3.38Å; V111-D114 VanDerWaalsContact O-O 3.09Å; D114-V116 VanDerWaalsContact C-N 3.26Å; D114-V116 PolarHBondContact O-N 2.98Å; D114-V116 PolarHBondContact OD1-N 2.94Å; D114-A117 HydrophobicContact CB-CB 3.83Å; D114-A117 PolarHBondContact O-N 2.87Å; D114-A117 PolarHBondContact OD1-N 3.41Å; D114-A117 VanDerWaalsContact OD1-N 3.16Å; D114-A117 WeakPolarHBondContact OD2-CB 3.29Å; D114-F118 WeakPolarHBondContact O-CB 3.41Å; D114-F118 PolarHBondContact O-N 3.29Å
115	P	85.8	Confident	84.4	Confident	64 Å²	64	57.6 Å²	57.6	42%	0.416	32%	0.317	S	S	.	.	H	α-helix	trans	-59.6	-33.2	180	-20	30.3	0	0	0	114.2	R119	P115-R119 WeakPolarHBondContact O-CB 3.27Å; P115-R119 PolarHBondContact O-N 3.07Å; P115-R119 VanDerWaalsContact O-N 3.15Å
116	V	87.6	Confident	84.8	Confident	83 Å²	83	63.2 Å²	63.2	50%	0.503	34%	0.343	S	S	.	.	H	α-helix	trans	-79.7	-45.8	-176.4	179.9	0	0	0	0	109.7	D114 R119 R120	D114-V116 VanDerWaalsContact C-N 3.26Å; D114-V116 PolarHBondContact O-N 2.98Å; D114-V116 PolarHBondContact OD1-N 2.94Å; V116-R119 PolarHBondContact O-N 3.45Å; V116-R120 WeakPolarHBondContact O-CG 3.44Å; V116-R120 PolarHBondContact O-N 3.47Å; V116-R120 VanDerWaalsContact O-N 3.08Å
117	A	85.3	Confident	85	Confident	22 Å²	22	61.6 Å²	61.6	18%	0.182	33%	0.334	C	S	.	.	H	α-helix	trans	-64	-43.6	175.1	0	0	0	0	0	111.4	V111 D114 R119 R120 V121	V111-A117 HydrophobicContact CB-CB 3.87Å; V111-A117 HydrophobicContact CG1-CB 3.92Å; D114-A117 HydrophobicContact CB-CB 3.83Å; D114-A117 PolarHBondContact O-N 2.87Å; D114-A117 PolarHBondContact OD1-N 3.41Å; D114-A117 VanDerWaalsContact OD1-N 3.16Å; D114-A117 WeakPolarHBondContact OD2-CB 3.29Å; A117-R119 VanDerWaalsContact C-N 3.34Å; A117-R119 PolarHBondContact O-N 2.99Å; A117-R120 PolarHBondContact O-N 2.93Å; A117-V121 WeakPolarHBondContact O-CG2 3.36Å; A117-V121 PolarHBondContact O-N 3.25Å
118	F	88.4	Confident	85	Confident	1 Å²	1	60.5 Å²	60.5	0%	0.004	33%	0.331	C	S	.	.	H	α-helix	trans	-57.5	-45.7	175.4	-171.2	-85	0	0	0	112.2	P83 I86 R87 L108 V111 D114 R120 V121 F122	P83-F118 VanDerWaalsContact O-CE1 3.31Å; P83-F118 WeakPolarHBondContact O-CE1 3.43Å; I86-F118 HydrophobicContact CG2-CZ 4.28Å; R87-F118 HydrophobicContact CB-CD1 3.73Å; R87-F118 HydrophobicContact CB-CD2 4.41Å; R87-F118 HydrophobicContact CB-CE1 3.7Å; R87-F118 HydrophobicContact CB-CE2 4.36Å; R87-F118 HydrophobicContact CB-CG 4.1Å; R87-F118 HydrophobicContact CB-CZ 4.02Å; R87-F118 HydrophobicContact CG-CB 4.35Å; R87-F118 HydrophobicContact CG-CD1 3.98Å; R87-F118 HydrophobicContact CG-CD2 3.92Å; R87-F118 HydrophobicContact CG-CE1 4.26Å; R87-F118 HydrophobicContact CG-CE2 4.18Å; R87-F118 HydrophobicContact CG-CG 3.8Å; R87-F118 HydrophobicContact CG-CZ 4.35Å; L108-F118 HydrophobicContact CB-CE2 4.13Å; L108-F118 HydrophobicContact CD2-CD2 4.02Å; L108-F118 HydrophobicContact CD2-CE2 3.83Å; L108-F118 HydrophobicContact CD2-CG 4.47Å; L108-F118 HydrophobicContact CD2-CZ 4.1Å; L108-F118 HydrophobicContact CG-CE2 4.44Å; V111-F118 HydrophobicContact CG2-CB 4.16Å; V111-F118 HydrophobicContact CG2-CD2 4.18Å; D114-F118 WeakPolarHBondContact O-CB 3.41Å; D114-F118 PolarHBondContact O-N 3.29Å; F118-R120 PolarHBondContact O-N 3.34Å; F118-V121 PolarHBondContact O-N 3.48Å; F118-F122 HydrophobicContact CD1-CB 4.42Å; F118-F122 HydrophobicContact CE1-CB 4.29Å; F118-F122 HydrophobicContact CE1-CD2 4.29Å; F118-F122 HydrophobicContact CE1-CG 4.48Å; F118-F122 WeakPolarHBondContact O-CB 3.43Å; F118-F122 PolarHBondContact O-N 3.03Å
119	R	87.6	Confident	84.8	Confident	75 Å²	75	62.7 Å²	62.7	28%	0.283	35%	0.349	S	S	.	.	H	α-helix	trans	-59	-46.8	176.6	178.6	-178.6	-66.2	-90.4	2.8	111.6	S80 P83 P115 V116 A117 F122 E123	S80-R119 PolarHBondContact O-NH1 2.89Å; S80-R119 PolarHBondContact O-NH2 3.35Å; S80-R119 VanDerWaalsContact O-NH2 3.09Å; P83-R119 HydrophobicContact CB-CB 4.32Å; P83-R119 HydrophobicContact CB-CG 4.29Å; P83-R119 HydrophobicContact CG-CG 4.27Å; P115-R119 WeakPolarHBondContact O-CB 3.27Å; P115-R119 PolarHBondContact O-N 3.07Å; P115-R119 VanDerWaalsContact O-N 3.15Å; V116-R119 PolarHBondContact O-N 3.45Å; A117-R119 VanDerWaalsContact C-N 3.34Å; A117-R119 PolarHBondContact O-N 2.99Å; R119-F122 PolarHBondContact O-N 3.47Å; R119-E123 WeakPolarHBondContact CD-OE1 3.33Å; R119-E123 HydrophobicContact CG-CG 4.27Å; R119-E123 WeakPolarHBondContact CG-OE1 3.33Å; R119-E123 IonicContact NH1-OE1 2.73Å; R119-E123 WeakPolarHBondContact O-CB 3.48Å; R119-E123 VanDerWaalsContact O-CG 3.3Å; R119-E123 WeakPolarHBondContact O-CG 3.21Å; R119-E123 PolarHBondContact O-N 3.46Å
120	R	87.8	Confident	84.8	Confident	178 Å²	178	68.8 Å²	68.8	67%	0.672	37%	0.366	S	S	*	.	H	α-helix	trans	-61.5	-47.9	179.7	-72.3	176.1	-176.4	171.7	2	112	V116 A117 F118 S124	V116-R120 WeakPolarHBondContact O-CG 3.44Å; V116-R120 PolarHBondContact O-N 3.47Å; V116-R120 VanDerWaalsContact O-N 3.08Å; A117-R120 PolarHBondContact O-N 2.93Å; F118-R120 PolarHBondContact O-N 3.34Å; R120-S124 VanDerWaalsContact O-CB 3.23Å; R120-S124 WeakPolarHBondContact O-CB 3.34Å; R120-S124 PolarHBondContact O-N 3.19Å
121	V	85.4	Confident	84.6	Confident	32 Å²	32	70.9 Å²	70.9	19%	0.194	36%	0.362	C	S	.	.	H	α-helix	trans	-64.2	-44.2	178.8	177.3	0	0	0	0	110.3	E107 L108 V111 A117 F118 S124 Q125	E107-V121 HydrophobicContact CB-CG1 4.05Å; L108-V121 HydrophobicContact CD2-CB 3.87Å; L108-V121 HydrophobicContact CD2-CG1 3.54Å; L108-V121 HydrophobicContact CG-CG1 4Å; V111-V121 HydrophobicContact CG1-CG2 4.35Å; V111-V121 HydrophobicContact CG2-CB 4.21Å; V111-V121 HydrophobicContact CG2-CG2 3.99Å; A117-V121 WeakPolarHBondContact O-CG2 3.36Å; A117-V121 PolarHBondContact O-N 3.25Å; F118-V121 PolarHBondContact O-N 3.48Å; V121-S124 PolarHBondContact O-N 3.15Å; V121-Q125 HydrophobicContact CG1-CG 4.44Å; V121-Q125 WeakPolarHBondContact O-CB 3.4Å; V121-Q125 WeakPolarHBondContact O-CG 3.37Å; V121-Q125 PolarHBondContact O-N 3.26Å
122	F	85.1	Confident	84.1	Confident	12 Å²	12	72.8 Å²	72.8	5%	0.053	37%	0.368	C	S	.	.	H	α-helix	trans	-62.6	-46.5	178.5	-175.2	-89.9	0	0	0	112.7	F69 P83 I86 L108 F118 R119 Q125 Q126	F69-F122 AromaticContact CD1-CE2 3.97Å; F69-F122 HydrophobicContact CD1-CE2 3.97Å; F69-F122 AromaticContact CD2-CE2 3.81Å; F69-F122 HydrophobicContact CD2-CE2 3.81Å; F69-F122 HydrophobicContact CE1-CE2 4.15Å; F69-F122 HydrophobicContact CE2-CD2 4.35Å; F69-F122 AromaticContact CE2-CE2 3.97Å; F69-F122 HydrophobicContact CE2-CE2 3.97Å; F69-F122 AromaticContact CG-CE2 3.83Å; F69-F122 HydrophobicContact CG-CE2 3.83Å; F69-F122 HydrophobicContact CG-CZ 4.44Å; F69-F122 HydrophobicContact CZ-CD2 4.4Å; F69-F122 HydrophobicContact CZ-CE2 4.16Å; P83-F122 HydrophobicContact CB-CB 4.48Å; P83-F122 HydrophobicContact CB-CD1 3.95Å; P83-F122 HydrophobicContact CB-CG 4.31Å; P83-F122 HydrophobicContact CG-CD1 3.81Å; P83-F122 HydrophobicContact CG-CE1 4.23Å; I86-F122 HydrophobicContact CD1-CE1 4.35Å; I86-F122 HydrophobicContact CD1-CE2 3.58Å; I86-F122 HydrophobicContact CD1-CZ 3.4Å; I86-F122 VanDerWaalsContact CD1-CZ 3.4Å; L108-F122 HydrophobicContact CD1-CD2 4.34Å; L108-F122 HydrophobicContact CD2-CB 4.11Å; F118-F122 HydrophobicContact CD1-CB 4.42Å; F118-F122 HydrophobicContact CE1-CB 4.29Å; F118-F122 HydrophobicContact CE1-CD2 4.29Å; F118-F122 HydrophobicContact CE1-CG 4.48Å; F118-F122 WeakPolarHBondContact O-CB 3.43Å; F118-F122 PolarHBondContact O-N 3.03Å; R119-F122 PolarHBondContact O-N 3.47Å; F122-Q125 PolarHBondContact O-N 3.23Å; F122-Q126 WeakPolarHBondContact O-CB 3.3Å; F122-Q126 PolarHBondContact O-N 3.32Å
123	E	85.8	Confident	83.8	Confident	90 Å²	90	78.7 Å²	78.7	42%	0.421	39%	0.39	S	S	.	.	H	α-helix	trans	-65.7	-39.5	177.1	-73.5	170.7	-176.4	0	0	111.4	R119 Q126 S127	R119-E123 WeakPolarHBondContact CD-OE1 3.33Å; R119-E123 HydrophobicContact CG-CG 4.27Å; R119-E123 WeakPolarHBondContact CG-OE1 3.33Å; R119-E123 IonicContact NH1-OE1 2.73Å; R119-E123 WeakPolarHBondContact O-CB 3.48Å; R119-E123 VanDerWaalsContact O-CG 3.3Å; R119-E123 WeakPolarHBondContact O-CG 3.21Å; R119-E123 PolarHBondContact O-N 3.46Å; E123-Q126 PolarHBondContact O-N 3.48Å; E123-S127 WeakPolarHBondContact O-CB 3.41Å; E123-S127 PolarHBondContact O-N 3.46Å; E123-S127 PolarHBondContact O-OG 3Å
124	S	85.3	Confident	83.8	Confident	58 Å²	58	76.1 Å²	76.1	41%	0.406	37%	0.373	S	S	.	.	H	α-helix	trans	-59.2	-53	173.8	-175.5	0	0	0	0	111.3	R120 V121 Q126 S127 I128	R120-S124 VanDerWaalsContact O-CB 3.23Å; R120-S124 WeakPolarHBondContact O-CB 3.34Å; R120-S124 PolarHBondContact O-N 3.19Å; V121-S124 PolarHBondContact O-N 3.15Å; S124-Q126 VanDerWaalsContact C-N 3.32Å; S124-Q126 PolarHBondContact O-N 3.47Å; S124-S127 PolarHBondContact O-N 2.9Å; S124-S127 VanDerWaalsContact O-N 3.11Å; S124-S127 PolarHBondContact O-OG 3.44Å; S124-I128 WeakPolarHBondContact O-CG1 3.44Å; S124-I128 PolarHBondContact O-N 3.46Å
125	Q	82.5	Confident	83.5	Confident	16 Å²	16	75.6 Å²	75.6	8%	0.075	37%	0.369	C	S	.	.	H	α-helix	trans	-61.2	-39.5	178.6	-72.3	-178.1	3.9	0	0	112.1	N105 E107 V121 F122 I128 A129	N105-Q125 PolarHBondContact ND2-NE2 3.46Å; N105-Q125 PolarHBondContact ND2-OE1 2.93Å; N105-Q125 PolarHBondContact OD1-NE2 3.26Å; E107-Q125 PolarHBondContact OE2-NE2 3.14Å; V121-Q125 HydrophobicContact CG1-CG 4.44Å; V121-Q125 WeakPolarHBondContact O-CB 3.4Å; V121-Q125 WeakPolarHBondContact O-CG 3.37Å; V121-Q125 PolarHBondContact O-N 3.26Å; F122-Q125 PolarHBondContact O-N 3.23Å; Q125-I128 PolarHBondContact O-N 3.21Å; Q125-A129 VanDerWaalsContact O-CB 3.29Å; Q125-A129 WeakPolarHBondContact O-CB 3.37Å; Q125-A129 PolarHBondContact O-N 3.21Å
126	Q	80.7	Confident	83.2	Confident	123 Å²	123	75.5 Å²	75.5	58%	0.575	36%	0.364	S	S	*	.	H	α-helix	trans	-64.5	-39.6	174.9	-174.5	176.3	71.6	0	0	112.1	F122 E123 S124 R130	F122-Q126 WeakPolarHBondContact O-CB 3.3Å; F122-Q126 PolarHBondContact O-N 3.32Å; E123-Q126 PolarHBondContact O-N 3.48Å; S124-Q126 VanDerWaalsContact C-N 3.32Å; S124-Q126 PolarHBondContact O-N 3.47Å; Q126-R130 WeakPolarHBondContact O-CB 3.4Å; Q126-R130 PolarHBondContact O-N 2.95Å
127	S	84.1	Confident	82.9	Confident	54 Å²	54	76.2 Å²	76.2	38%	0.378	36%	0.362	S	S	.	.	H	α-helix	trans	-66.1	-43.3	177.6	76.5	0	0	0	0	111.9	E123 S124 R130 Q131	E123-S127 WeakPolarHBondContact O-CB 3.41Å; E123-S127 PolarHBondContact O-N 3.46Å; E123-S127 PolarHBondContact O-OG 3Å; S124-S127 PolarHBondContact O-N 2.9Å; S124-S127 VanDerWaalsContact O-N 3.11Å; S124-S127 PolarHBondContact O-OG 3.44Å; S127-R130 PolarHBondContact O-N 3.39Å; S127-Q131 WeakPolarHBondContact O-CG 3.37Å; S127-Q131 PolarHBondContact O-N 2.7Å
128	I	81.9	Confident	82.8	Confident	98 Å²	98	80.5 Å²	80.5	50%	0.503	38%	0.382	S	S	.	.	H	α-helix	trans	-63	-47.8	176.2	-68	165.2	0	0	0	110	S124 Q125 R130 Q131 H132	S124-I128 WeakPolarHBondContact O-CG1 3.44Å; S124-I128 PolarHBondContact O-N 3.46Å; Q125-I128 PolarHBondContact O-N 3.21Å; I128-R130 VanDerWaalsContact C-N 3.26Å; I128-R130 PolarHBondContact O-N 3.4Å; I128-Q131 PolarHBondContact O-N 2.93Å; I128-H132 WeakPolarHBondContact O-CB 3.23Å; I128-H132 PolarHBondContact O-N 3.26Å
129	A	77.7	Confident	82.6	Confident	45 Å²	45	81.6 Å²	81.6	37%	0.372	39%	0.388	S	S	.	.	H	α-helix	trans	-61	-36.1	177.7	0	0	0	0	0	112.3	Q125 R133	Q125-A129 VanDerWaalsContact O-CB 3.29Å; Q125-A129 WeakPolarHBondContact O-CB 3.37Å; Q125-A129 PolarHBondContact O-N 3.21Å; A129-R133 WeakPolarHBondContact O-CB 3.38Å; A129-R133 PolarHBondContact O-N 3.12Å
130	R	80.9	Confident	82.2	Confident	157 Å²	157	84.8 Å²	84.8	59%	0.592	41%	0.41	S	S	*	.	H	α-helix	trans	-68.1	-47.5	175.9	-173.1	-179.2	-168.2	152.4	8.3	111.8	Q126 S127 I128 H132 R133 E134	Q126-R130 WeakPolarHBondContact O-CB 3.4Å; Q126-R130 PolarHBondContact O-N 2.95Å; S127-R130 PolarHBondContact O-N 3.39Å; I128-R130 VanDerWaalsContact C-N 3.26Å; I128-R130 PolarHBondContact O-N 3.4Å; R130-H132 VanDerWaalsContact C-N 3.33Å; R130-H132 PolarHBondContact O-N 3.5Å; R130-R133 PolarHBondContact O-N 2.9Å; R130-E134 WeakPolarHBondContact CG-OE1 3.42Å; R130-E134 IonicContact NE-OE1 3.54Å; R130-E134 PolarHBondContact NE-OE1 2.9Å; R130-E134 WeakPolarHBondContact O-CG 3.48Å; R130-E134 PolarHBondContact O-N 3.48Å
131	Q	81.1	Confident	81.9	Confident	126 Å²	126	80.5 Å²	80.5	59%	0.589	41%	0.412	S	S	*	.	H	α-helix	trans	-59.3	-45.3	176.9	-74.5	176	-16.6	0	0	111.2	S127 I128 R133 E134 E135	S127-Q131 WeakPolarHBondContact O-CG 3.37Å; S127-Q131 PolarHBondContact O-N 2.7Å; I128-Q131 PolarHBondContact O-N 2.93Å; Q131-R133 VanDerWaalsContact C-N 3.31Å; Q131-R133 PolarHBondContact O-N 3.31Å; Q131-E134 PolarHBondContact O-N 3.03Å; Q131-E135 WeakPolarHBondContact O-CB 3.33Å; Q131-E135 PolarHBondContact O-N 3.24Å
132	H	76.8	Confident	81.7	Confident	73 Å²	73	80.9 Å²	80.9	34%	0.338	42%	0.419	S	S	.	.	H	α-helix	trans	-61.4	-39	176.9	-172.5	-94.4	0	0	0	112.3	I128 R130 E135 L136	I128-H132 WeakPolarHBondContact O-CB 3.23Å; I128-H132 PolarHBondContact O-N 3.26Å; R130-H132 VanDerWaalsContact C-N 3.33Å; R130-H132 PolarHBondContact O-N 3.5Å; H132-E135 PolarHBondContact O-N 3.39Å; H132-L136 PolarHBondContact O-N 2.83Å
133	R	79.1	Confident	81.5	Confident	136 Å²	136	85.3 Å²	85.3	51%	0.513	44%	0.443	S	S	.	.	H	α-helix	trans	-66.5	-45	175.8	-170.1	177.8	73.3	118.7	5.2	112.2	A129 R130 Q131 E135 L136 E137	A129-R133 WeakPolarHBondContact O-CB 3.38Å; A129-R133 PolarHBondContact O-N 3.12Å; R130-R133 PolarHBondContact O-N 2.9Å; Q131-R133 VanDerWaalsContact C-N 3.31Å; Q131-R133 PolarHBondContact O-N 3.31Å; R133-E135 VanDerWaalsContact C-N 3.3Å; R133-L136 PolarHBondContact O-N 3.05Å; R133-E137 IonicContact CZ-OE1 3.17Å; R133-E137 IonicContact NH1-OE1 3.8Å; R133-E137 WeakPolarHBondContact O-CG 3.4Å; R133-E137 PolarHBondContact O-N 2.91Å
134	E	83.5	Confident	81	Confident	79 Å²	79	84.3 Å²	84.3	37%	0.369	45%	0.45	S	S	.	.	H	α-helix	trans	-63.6	-38.4	176.6	-72	170.7	-169.8	0	0	110.9	R130 Q131 E137 N138	R130-E134 WeakPolarHBondContact CG-OE1 3.42Å; R130-E134 IonicContact NE-OE1 3.54Å; R130-E134 PolarHBondContact NE-OE1 2.9Å; R130-E134 WeakPolarHBondContact O-CG 3.48Å; R130-E134 PolarHBondContact O-N 3.48Å; Q131-E134 PolarHBondContact O-N 3.03Å; E134-E137 PolarHBondContact O-N 3.17Å; E134-N138 WeakPolarHBondContact O-CB 3.35Å; E134-N138 PolarHBondContact O-N 2.75Å; E134-N138 PolarHBondContact O-ND2 2.87Å; E134-N138 VanDerWaalsContact O-ND2 3.1Å
135	E	81.6	Confident	80.7	Confident	66 Å²	66	88.2 Å²	88.2	31%	0.308	47%	0.466	S	S	.	.	H	α-helix	trans	-61.2	-47.9	173.4	-173.9	-176.6	-178.5	0	0	112	Q131 H132 R133 E137 N138 L139 R152	Q131-E135 WeakPolarHBondContact O-CB 3.33Å; Q131-E135 PolarHBondContact O-N 3.24Å; H132-E135 PolarHBondContact O-N 3.39Å; R133-E135 VanDerWaalsContact C-N 3.3Å; E135-E137 PolarHBondContact O-N 3.48Å; E135-N138 WeakPolarHBondContact O-CB 3.42Å; E135-N138 PolarHBondContact O-N 2.81Å; E135-L139 HydrophobicContact CG-CD1 4.15Å; E135-L139 WeakPolarHBondContact O-CG 3.35Å; E135-L139 PolarHBondContact O-N 2.94Å; E135-R152 VanDerWaalsContact CD-NH2 3.33Å; E135-R152 IonicContact OE1-CZ 3.95Å; E135-R152 IonicContact OE1-NE 3.79Å; E135-R152 PolarHBondContact OE1-NE 3.47Å; E135-R152 IonicContact OE1-NH2 2.76Å; E135-R152 PolarHBondContact OE1-NH2 3.13Å; E135-R152 IonicContact OE2-NH2 3.64Å; E135-R152 PolarHBondContact OE2-NH2 2.89Å
136	L	80.2	Confident	80.9	Confident	62 Å²	62	90.7 Å²	90.7	33%	0.325	48%	0.48	S	S	.	.	H	α-helix	trans	-62.3	-42.2	177.9	-171.5	68.5	0	0	0	111.8	H132 R133 N138 L139 L140 L156	H132-L136 PolarHBondContact O-N 2.83Å; R133-L136 PolarHBondContact O-N 3.05Å; L136-N138 VanDerWaalsContact C-N 3.32Å; L136-N138 PolarHBondContact O-N 2.72Å; L136-L139 PolarHBondContact O-N 3.28Å; L136-L140 HydrophobicContact CG-CD1 4.43Å; L136-L140 VanDerWaalsContact O-CG 3.3Å; L136-L140 WeakPolarHBondContact O-CG 3.47Å; L136-L140 PolarHBondContact O-N 3.4Å; L136-L156 HydrophobicContact CD1-CD1 4.01Å
137	E	80.9	Confident	81.1	Confident	98 Å²	98	89.3 Å²	89.3	46%	0.458	48%	0.481	S	S	.	.	H	α-helix	trans	-60.5	-41.9	174.2	-74.3	173.9	-170.4	0	0	111.2	R133 E134 E135 L140 A141	R133-E137 IonicContact CZ-OE1 3.17Å; R133-E137 IonicContact NH1-OE1 3.8Å; R133-E137 WeakPolarHBondContact O-CG 3.4Å; R133-E137 PolarHBondContact O-N 2.91Å; E134-E137 PolarHBondContact O-N 3.17Å; E135-E137 PolarHBondContact O-N 3.48Å; E137-L140 PolarHBondContact O-N 3.04Å; E137-A141 PolarHBondContact O-N 3.42Å; E137-A141 VanDerWaalsContact O-N 3.15Å
138	N	83.6	Confident	81.2	Confident	112 Å²	112	89.6 Å²	89.6	60%	0.599	49%	0.487	S	S	*	.	H	α-helix	trans	-66.1	-40.1	176.3	-71.3	-29.3	0	0	0	112.5	E134 E135 L136 A141 A142	E134-N138 WeakPolarHBondContact O-CB 3.35Å; E134-N138 PolarHBondContact O-N 2.75Å; E134-N138 PolarHBondContact O-ND2 2.87Å; E134-N138 VanDerWaalsContact O-ND2 3.1Å; E135-N138 WeakPolarHBondContact O-CB 3.42Å; E135-N138 PolarHBondContact O-N 2.81Å; L136-N138 VanDerWaalsContact C-N 3.32Å; L136-N138 PolarHBondContact O-N 2.72Å; N138-A141 PolarHBondContact O-N 2.97Å; N138-A142 WeakPolarHBondContact O-CB 3.37Å; N138-A142 PolarHBondContact O-N 3.24Å
139	L	82.9	Confident	81.2	Confident	24 Å²	24	85.7 Å²	85.7	13%	0.126	47%	0.468	C	S	.	.	H	α-helix	trans	-66.8	-37.4	177.6	-72.3	168.9	0	0	0	112.2	E135 L136 A141 A142 V149 R152 L156	E135-L139 HydrophobicContact CG-CD1 4.15Å; E135-L139 WeakPolarHBondContact O-CG 3.35Å; E135-L139 PolarHBondContact O-N 2.94Å; L136-L139 PolarHBondContact O-N 3.28Å; L139-A141 VanDerWaalsContact C-N 3.31Å; L139-A142 PolarHBondContact O-N 3.31Å; L139-V149 HydrophobicContact CD2-CG1 4.28Å; L139-R152 HydrophobicContact CD1-CB 4.46Å; L139-R152 HydrophobicContact CD1-CG 3.53Å; L139-R152 HydrophobicContact CD2-CB 3.88Å; L139-R152 HydrophobicContact CD2-CG 3.69Å; L139-R152 HydrophobicContact CG-CG 4.25Å; L139-L156 HydrophobicContact CD1-CD1 3.52Å
140	L	79	Confident	81.5	Confident	142 Å²	142	88.3 Å²	88.3	74%	0.743	47%	0.472	S	S	*	.	H	α-helix	trans	-67.5	-31	174.9	-72.5	170.5	0	0	0	112.8	L136 E137	L136-L140 HydrophobicContact CG-CD1 4.43Å; L136-L140 VanDerWaalsContact O-CG 3.3Å; L136-L140 WeakPolarHBondContact O-CG 3.47Å; L136-L140 PolarHBondContact O-N 3.4Å; E137-L140 PolarHBondContact O-N 3.04Å
141	A	82.3	Confident	81.8	Confident	87 Å²	87	87.8 Å²	87.8	72%	0.719	48%	0.476	S	S	*	.	H	α-helix	trans	-87	-12.8	178.6	0	0	0	0	0	113.8	E137 N138 L139	E137-A141 PolarHBondContact O-N 3.42Å; E137-A141 VanDerWaalsContact O-N 3.15Å; N138-A141 PolarHBondContact O-N 2.97Å; L139-A141 VanDerWaalsContact C-N 3.31Å
142	A	80.8	Confident	82	Confident	40 Å²	40	85.2 Å²	85.2	33%	0.331	46%	0.461	S	S	.	.	S	Bend	trans	-76.4	160.8	-177	0	0	0	0	0	112.5	N138 L139 A144 V149	N138-A142 WeakPolarHBondContact O-CB 3.37Å; N138-A142 PolarHBondContact O-N 3.24Å; L139-A142 PolarHBondContact O-N 3.31Å; A142-A144 PolarHBondContact O-N 3.01Å; A142-V149 HydrophobicContact CB-CB 4.41Å; A142-V149 HydrophobicContact CB-CG1 3.86Å; A142-V149 HydrophobicContact CB-CG2 3.62Å
143	D	81.4	Confident	82.2	Confident	105 Å²	105	84.9 Å²	84.9	56%	0.561	46%	0.461	S	S	*	.			trans	-65	118.2	178.5	-175.3	-0.5	0	0	0	110.7	L145 N146	D143-L145 PolarHBondContact O-N 3.09Å; D143-L145 VanDerWaalsContact O-N 3.09Å; D143-L145 PolarHBondContact OD1-N 3.04Å; D143-N146 HydrophobicContact CB-CB 4.46Å; D143-N146 WeakPolarHBondContact O-CB 3.4Å; D143-N146 PolarHBondContact O-N 3.21Å
144	A	74.3	Confident	82.6	Confident	70 Å²	70	81.1 Å²	81.1	58%	0.579	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-18.1	179.8	0	0	0	0	0	113.4	A142 Q150	A142-A144 PolarHBondContact O-N 3.01Å; A144-Q150 WeakPolarHBondContact O-CG 3.49Å; A144-Q150 PolarHBondContact O-NE2 3.41Å
145	L	79.8	Confident	82.8	Confident	139 Å²	139	82.3 Å²	82.3	73%	0.728	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-3	177.4	-62.8	177.7	0	0	0	113.8	D143	D143-L145 PolarHBondContact O-N 3.09Å; D143-L145 VanDerWaalsContact O-N 3.09Å; D143-L145 PolarHBondContact OD1-N 3.04Å
146	N	85.6	Confident	82.9	Confident	69 Å²	69	81.1 Å²	81.1	37%	0.369	46%	0.461	S	S	.	.			trans	-77.6	121.5	177.4	-175.2	-21.4	0	0	0	110.6	D143 A148 V149 Q150	D143-N146 HydrophobicContact CB-CB 4.46Å; D143-N146 WeakPolarHBondContact O-CB 3.4Å; D143-N146 PolarHBondContact O-N 3.21Å; N146-A148 VanDerWaalsContact C-N 3.29Å; N146-A148 PolarHBondContact O-N 2.73Å; N146-A148 PolarHBondContact OD1-N 2.73Å; N146-A148 VanDerWaalsContact OD1-N 3.09Å; N146-V149 HydrophobicContact CB-CB 4.16Å; N146-V149 HydrophobicContact CB-CG2 3.84Å; N146-V149 PolarHBondContact O-N 2.87Å; N146-V149 VanDerWaalsContact O-N 3.13Å; N146-Q150 PolarHBondContact O-N 3.37Å
147	P	85.5	Confident	82.9	Confident	93 Å²	93	82.5 Å²	82.5	60%	0.604	47%	0.467	S	S	*	.	H	α-helix	trans	-58.6	-35.4	-177.9	22.4	-33.9	0	0	0	113.7	Q150 E151	P147-Q150 PolarHBondContact O-N 2.88Å; P147-E151 WeakPolarHBondContact O-CB 3.39Å; P147-E151 PolarHBondContact O-N 3.5Å
148	A	85.2	Confident	83.2	Confident	61 Å²	61	84.5 Å²	84.5	50%	0.504	47%	0.474	S	S	.	.	H	α-helix	trans	-69.4	-34.4	179.4	0	0	0	0	0	112.5	N146 R152	N146-A148 VanDerWaalsContact C-N 3.29Å; N146-A148 PolarHBondContact O-N 2.73Å; N146-A148 PolarHBondContact OD1-N 2.73Å; N146-A148 VanDerWaalsContact OD1-N 3.09Å; A148-R152 PolarHBondContact O-N 2.74Å; A148-R152 VanDerWaalsContact O-N 3.17Å
149	V	83.4	Confident	83.2	Confident	16 Å²	16	83.6 Å²	83.6	10%	0.097	47%	0.467	C	S	.	.	H	α-helix	trans	-70.4	-42.9	175.2	176.7	0	0	0	0	109.8	L139 A142 N146 E151 R152 I153	L139-V149 HydrophobicContact CD2-CG1 4.28Å; A142-V149 HydrophobicContact CB-CB 4.41Å; A142-V149 HydrophobicContact CB-CG1 3.86Å; A142-V149 HydrophobicContact CB-CG2 3.62Å; N146-V149 HydrophobicContact CB-CB 4.16Å; N146-V149 HydrophobicContact CB-CG2 3.84Å; N146-V149 PolarHBondContact O-N 2.87Å; N146-V149 VanDerWaalsContact O-N 3.13Å; V149-E151 VanDerWaalsContact C-N 3.35Å; V149-E151 PolarHBondContact O-N 3.01Å; V149-R152 PolarHBondContact O-N 3.28Å; V149-I153 HydrophobicContact CG1-CD1 3.75Å; V149-I153 HydrophobicContact CG1-CG1 4.36Å; V149-I153 WeakPolarHBondContact O-CB 3.42Å; V149-I153 VanDerWaalsContact O-CG1 3.27Å; V149-I153 WeakPolarHBondContact O-CG1 3.27Å; V149-I153 PolarHBondContact O-N 3.09Å
150	Q	83.1	Confident	83	Confident	99 Å²	99	85.7 Å²	85.7	46%	0.463	48%	0.478	S	S	.	.	H	α-helix	trans	-61.3	-41.9	176.3	-70.6	-176.9	2.1	0	0	112.3	A144 N146 P147 I153 A154	A144-Q150 WeakPolarHBondContact O-CG 3.49Å; A144-Q150 PolarHBondContact O-NE2 3.41Å; N146-Q150 PolarHBondContact O-N 3.37Å; P147-Q150 PolarHBondContact O-N 2.88Å; Q150-I153 PolarHBondContact O-N 3.25Å; Q150-A154 VanDerWaalsContact O-CB 3.31Å; Q150-A154 WeakPolarHBondContact O-CB 3.28Å; Q150-A154 PolarHBondContact O-N 2.89Å
151	E	88.1	Confident	83.2	Confident	146 Å²	146	82.5 Å²	82.5	68%	0.682	46%	0.462	S	S	*	.	H	α-helix	trans	-60.7	-46.4	175.3	-175.8	172.4	-160.7	0	0	111.2	P147 V149 I153 A154 E155	P147-E151 WeakPolarHBondContact O-CB 3.39Å; P147-E151 PolarHBondContact O-N 3.5Å; V149-E151 VanDerWaalsContact C-N 3.35Å; V149-E151 PolarHBondContact O-N 3.01Å; E151-I153 PolarHBondContact O-N 2.88Å; E151-A154 WeakPolarHBondContact O-CB 3.49Å; E151-A154 PolarHBondContact O-N 3.38Å; E151-E155 PolarHBondContact O-N 3.03Å
152	R	84.8	Confident	83.1	Confident	72 Å²	72	82 Å²	82	27%	0.272	45%	0.446	S	S	.	.	H	α-helix	trans	-65.6	-39.9	177.9	-171.4	58.5	173.1	155.7	3.1	112.9	E135 L139 A148 V149 A154 E155 L156	E135-R152 VanDerWaalsContact CD-NH2 3.33Å; E135-R152 IonicContact OE1-CZ 3.95Å; E135-R152 IonicContact OE1-NE 3.79Å; E135-R152 PolarHBondContact OE1-NE 3.47Å; E135-R152 IonicContact OE1-NH2 2.76Å; E135-R152 PolarHBondContact OE1-NH2 3.13Å; E135-R152 IonicContact OE2-NH2 3.64Å; E135-R152 PolarHBondContact OE2-NH2 2.89Å; L139-R152 HydrophobicContact CD1-CB 4.46Å; L139-R152 HydrophobicContact CD1-CG 3.53Å; L139-R152 HydrophobicContact CD2-CB 3.88Å; L139-R152 HydrophobicContact CD2-CG 3.69Å; L139-R152 HydrophobicContact CG-CG 4.25Å; A148-R152 PolarHBondContact O-N 2.74Å; A148-R152 VanDerWaalsContact O-N 3.17Å; V149-R152 PolarHBondContact O-N 3.28Å; R152-A154 VanDerWaalsContact C-N 3.35Å; R152-E155 IonicContact CZ-OE2 3.76Å; R152-E155 IonicContact NH1-OE1 3.15Å; R152-E155 IonicContact NH1-OE2 3.24Å; R152-E155 PolarHBondContact NH1-OE2 3.17Å; R152-E155 PolarHBondContact O-N 3.28Å; R152-L156 WeakPolarHBondContact O-CG 3.45Å; R152-L156 PolarHBondContact O-N 3.29Å
153	I	81.7	Confident	83	Confident	66 Å²	66	80.9 Å²	80.9	34%	0.338	43%	0.434	S	S	.	.	H	α-helix	trans	-62.6	-43.2	173.2	-69.8	169.3	0	0	0	110.5	V149 Q150 E151 E155 L156 I157	V149-I153 HydrophobicContact CG1-CD1 3.75Å; V149-I153 HydrophobicContact CG1-CG1 4.36Å; V149-I153 WeakPolarHBondContact O-CB 3.42Å; V149-I153 VanDerWaalsContact O-CG1 3.27Å; V149-I153 WeakPolarHBondContact O-CG1 3.27Å; V149-I153 PolarHBondContact O-N 3.09Å; Q150-I153 PolarHBondContact O-N 3.25Å; E151-I153 PolarHBondContact O-N 2.88Å; I153-E155 VanDerWaalsContact C-N 3.33Å; I153-E155 PolarHBondContact O-N 3.22Å; I153-L156 PolarHBondContact O-N 3.36Å; I153-I157 HydrophobicContact CG2-CD1 3.77Å; I153-I157 HydrophobicContact CG2-CG1 4.38Å; I153-I157 VanDerWaalsContact O-CG1 3.3Å; I153-I157 WeakPolarHBondContact O-CG1 3.41Å; I153-I157 PolarHBondContact O-N 3.37Å
154	A	86.5	Confident	82.9	Confident	57 Å²	57	80.1 Å²	80.1	47%	0.471	43%	0.429	S	S	.	.	H	α-helix	trans	-63.2	-39.4	177.8	0	0	0	0	0	111.9	Q150 E151 R152 I157 K158	Q150-A154 VanDerWaalsContact O-CB 3.31Å; Q150-A154 WeakPolarHBondContact O-CB 3.28Å; Q150-A154 PolarHBondContact O-N 2.89Å; E151-A154 WeakPolarHBondContact O-CB 3.49Å; E151-A154 PolarHBondContact O-N 3.38Å; R152-A154 VanDerWaalsContact C-N 3.35Å; A154-I157 PolarHBondContact O-N 3.29Å; A154-K158 WeakPolarHBondContact O-CB 3.3Å; A154-K158 PolarHBondContact O-N 3.11Å
155	E	88.1	Confident	83.3	Confident	104 Å²	104	83.6 Å²	83.6	49%	0.486	43%	0.433	S	S	.	.	H	α-helix	trans	-62.9	-44.8	173.8	-169.8	-179.3	-162.9	0	0	111.7	E151 R152 I153 I157 K158 Q159	E151-E155 PolarHBondContact O-N 3.03Å; R152-E155 IonicContact CZ-OE2 3.76Å; R152-E155 IonicContact NH1-OE1 3.15Å; R152-E155 IonicContact NH1-OE2 3.24Å; R152-E155 PolarHBondContact NH1-OE2 3.17Å; R152-E155 PolarHBondContact O-N 3.28Å; I153-E155 VanDerWaalsContact C-N 3.33Å; I153-E155 PolarHBondContact O-N 3.22Å; E155-I157 PolarHBondContact O-N 3.49Å; E155-K158 WeakPolarHBondContact O-CB 3.41Å; E155-K158 PolarHBondContact O-N 3.45Å; E155-Q159 PolarHBondContact O-N 2.88Å
156	L	82.8	Confident	83.1	Confident	42 Å²	42	80.6 Å²	80.6	22%	0.22	42%	0.416	C	S	.	.	H	α-helix	trans	-63.1	-40.9	175.6	-72.3	174.4	0	0	0	112.4	L136 L139 R152 I153 Q159 N160	L136-L156 HydrophobicContact CD1-CD1 4.01Å; L139-L156 HydrophobicContact CD1-CD1 3.52Å; R152-L156 WeakPolarHBondContact O-CG 3.45Å; R152-L156 PolarHBondContact O-N 3.29Å; I153-L156 PolarHBondContact O-N 3.36Å; L156-Q159 PolarHBondContact O-N 2.84Å; L156-N160 VanDerWaalsContact O-CB 3.31Å; L156-N160 WeakPolarHBondContact O-CB 3.29Å; L156-N160 PolarHBondContact O-N 2.88Å
157	I	81.9	Confident	82.5	Confident	91 Å²	91	83.8 Å²	83.8	47%	0.467	43%	0.429	S	S	.	.	H	α-helix	trans	-63.9	-44	174.8	-69.2	167.3	0	0	0	110.3	I153 A154 E155 Q159 N160 N161	I153-I157 HydrophobicContact CG2-CD1 3.77Å; I153-I157 HydrophobicContact CG2-CG1 4.38Å; I153-I157 VanDerWaalsContact O-CG1 3.3Å; I153-I157 WeakPolarHBondContact O-CG1 3.41Å; I153-I157 PolarHBondContact O-N 3.37Å; A154-I157 PolarHBondContact O-N 3.29Å; E155-I157 PolarHBondContact O-N 3.49Å; I157-Q159 VanDerWaalsContact C-N 3.34Å; I157-Q159 PolarHBondContact O-N 2.85Å; I157-N160 PolarHBondContact O-N 3.49Å; I157-N161 WeakPolarHBondContact O-CB 3.31Å; I157-N161 PolarHBondContact O-N 3.42Å; I157-N161 PolarHBondContact O-ND2 3.5Å
158	K	87.1	Confident	82.3	Confident	139 Å²	139	81.8 Å²	81.8	60%	0.604	42%	0.417	S	S	*	.	H	α-helix	trans	-59.3	-47.1	176.5	-178.6	-175.3	176.1	-172.1	0	110.7	A154 E155 N161 I162	A154-K158 WeakPolarHBondContact O-CB 3.3Å; A154-K158 PolarHBondContact O-N 3.11Å; E155-K158 WeakPolarHBondContact O-CB 3.41Å; E155-K158 PolarHBondContact O-N 3.45Å; K158-N161 PolarHBondContact O-N 2.89Å; K158-I162 HydrophobicContact CG-CD1 4.15Å; K158-I162 WeakPolarHBondContact O-CG1 3.23Å; K158-I162 PolarHBondContact O-N 2.86Å
159	Q	82.5	Confident	81.9	Confident	94 Å²	94	79.8 Å²	79.8	44%	0.439	40%	0.401	S	S	.	.	H	α-helix	trans	-62.9	-45.3	178.1	-171.1	58.8	42.9	0	0	111.3	E155 L156 I157 N161 I162 D163	E155-Q159 PolarHBondContact O-N 2.88Å; L156-Q159 PolarHBondContact O-N 2.84Å; I157-Q159 VanDerWaalsContact C-N 3.34Å; I157-Q159 PolarHBondContact O-N 2.85Å; Q159-N161 VanDerWaalsContact C-N 3.3Å; Q159-N161 PolarHBondContact O-N 3.4Å; Q159-I162 WeakPolarHBondContact O-CB 3.41Å; Q159-I162 PolarHBondContact O-N 3.34Å; Q159-I162 VanDerWaalsContact O-N 3.11Å; Q159-D163 PolarHBondContact NE2-OD1 3.42Å; Q159-D163 VanDerWaalsContact O-CG 3.27Å; Q159-D163 PolarHBondContact O-N 2.79Å
160	N	79.6	Confident	81.6	Confident	67 Å²	67	83.5 Å²	83.5	36%	0.358	42%	0.419	S	S	.	.	H	α-helix	trans	-61.7	-38.5	176.9	-167.6	23.9	0	0	0	112	L156 I157 I162 D163 M164	L156-N160 VanDerWaalsContact O-CB 3.31Å; L156-N160 WeakPolarHBondContact O-CB 3.29Å; L156-N160 PolarHBondContact O-N 2.88Å; I157-N160 PolarHBondContact O-N 3.49Å; N160-I162 VanDerWaalsContact C-N 3.35Å; N160-I162 PolarHBondContact O-N 3.41Å; N160-D163 PolarHBondContact O-N 3.3Å; N160-M164 WeakPolarHBondContact O-CB 3.47Å; N160-M164 VanDerWaalsContact O-CG 3.28Å; N160-M164 WeakPolarHBondContact O-CG 3.29Å; N160-M164 PolarHBondContact O-N 3.17Å
161	N	82.6	Confident	81.1	Confident	75 Å²	75	85.2 Å²	85.2	40%	0.401	43%	0.427	S	S	.	.	H	α-helix	trans	-63.9	-39.1	174.1	-71.4	-18.2	0	0	0	112.3	I157 K158 Q159 M164 Q165	I157-N161 WeakPolarHBondContact O-CB 3.31Å; I157-N161 PolarHBondContact O-N 3.42Å; I157-N161 PolarHBondContact O-ND2 3.5Å; K158-N161 PolarHBondContact O-N 2.89Å; Q159-N161 VanDerWaalsContact C-N 3.3Å; Q159-N161 PolarHBondContact O-N 3.4Å; N161-M164 VanDerWaalsContact OD1-CE 3.23Å; N161-M164 WeakPolarHBondContact OD1-CE 3.47Å; N161-Q165 WeakPolarHBondContact O-CB 3.49Å; N161-Q165 WeakPolarHBondContact O-CG 3.48Å; N161-Q165 PolarHBondContact O-N 2.84Å
162	I	80.4	Confident	80.8	Confident	76 Å²	76	85.2 Å²	85.2	39%	0.39	42%	0.422	S	S	.	.	H	α-helix	trans	-65.4	-46.9	174.6	-67.7	164.9	0	0	0	110	K158 Q159 N160 M164 Q165 M166	K158-I162 HydrophobicContact CG-CD1 4.15Å; K158-I162 WeakPolarHBondContact O-CG1 3.23Å; K158-I162 PolarHBondContact O-N 2.86Å; Q159-I162 WeakPolarHBondContact O-CB 3.41Å; Q159-I162 PolarHBondContact O-N 3.34Å; Q159-I162 VanDerWaalsContact O-N 3.11Å; N160-I162 VanDerWaalsContact C-N 3.35Å; N160-I162 PolarHBondContact O-N 3.41Å; I162-M164 PolarHBondContact O-N 3.46Å; I162-Q165 PolarHBondContact O-N 3.47Å; I162-M166 WeakPolarHBondContact O-CB 3.33Å; I162-M166 PolarHBondContact O-N 2.86Å
163	D	79	Confident	80.6	Confident	17 Å²	17	88 Å²	88	9%	0.091	43%	0.434	C	S	.	.	H	α-helix	trans	-61.2	-43.8	179.9	-67.5	-7.8	0	0	0	111.1	Q159 N160 M166 E167	Q159-D163 PolarHBondContact NE2-OD1 3.42Å; Q159-D163 VanDerWaalsContact O-CG 3.27Å; Q159-D163 PolarHBondContact O-N 2.79Å; N160-D163 PolarHBondContact O-N 3.3Å; D163-M166 PolarHBondContact O-N 2.93Å; D163-E167 PolarHBondContact O-N 2.86Å
164	M	78.2	Confident	80.3	Confident	89 Å²	89	88.6 Å²	88.6	44%	0.438	44%	0.442	S	S	.	.	H	α-helix	trans	-64.1	-39.2	174.5	-73.2	-172.9	-61.1	0	0	112.6	N160 N161 I162 M166 E167 S168	N160-M164 WeakPolarHBondContact O-CB 3.47Å; N160-M164 VanDerWaalsContact O-CG 3.28Å; N160-M164 WeakPolarHBondContact O-CG 3.29Å; N160-M164 PolarHBondContact O-N 3.17Å; N161-M164 VanDerWaalsContact OD1-CE 3.23Å; N161-M164 WeakPolarHBondContact OD1-CE 3.47Å; I162-M164 PolarHBondContact O-N 3.46Å; M164-M166 VanDerWaalsContact C-N 3.34Å; M164-E167 PolarHBondContact O-N 3.26Å; M164-S168 VanDerWaalsContact O-CB 3.29Å; M164-S168 WeakPolarHBondContact O-CB 3.34Å; M164-S168 PolarHBondContact O-N 3.49Å
165	Q	82.8	Confident	79.8	Confident	144 Å²	144	91.7 Å²	91.7	67%	0.673	45%	0.447	S	S	*	.	H	α-helix	trans	-65.3	-39.7	174.8	-79.4	-176.9	12.8	0	0	111.6	N161 I162 A169	N161-Q165 WeakPolarHBondContact O-CB 3.49Å; N161-Q165 WeakPolarHBondContact O-CG 3.48Å; N161-Q165 PolarHBondContact O-N 2.84Å; I162-Q165 PolarHBondContact O-N 3.47Å; Q165-A169 WeakPolarHBondContact O-CB 3.33Å; Q165-A169 PolarHBondContact O-N 3.22Å
166	M	75.5	Confident	79.1	Confident	76 Å²	76	91.1 Å²	91.1	37%	0.374	45%	0.451	S	S	.	.	H	α-helix	trans	-64.9	-45.4	175.8	-177	-176.2	69.2	0	0	111.4	I162 D163 M164 A169 L170 F177	I162-M166 WeakPolarHBondContact O-CB 3.33Å; I162-M166 PolarHBondContact O-N 2.86Å; D163-M166 PolarHBondContact O-N 2.93Å; M164-M166 VanDerWaalsContact C-N 3.34Å; M166-A169 PolarHBondContact O-N 2.94Å; M166-L170 HydrophobicContact CG-CD1 4.28Å; M166-L170 WeakPolarHBondContact O-CG 3.2Å; M166-L170 PolarHBondContact O-N 3.01Å; M166-F177 HydrophobicContact CG-CE1 4.44Å; M166-F177 HydrophobicContact CG-CZ 4.17Å
167	E	74.9	Confident	78.4	Confident	135 Å²	135	94.2 Å²	94.2	63%	0.631	46%	0.462	S	S	*	.	H	α-helix	trans	-61.5	-44.8	176.6	-174.4	172.1	-155.7	0	0	111.3	D163 M164 A169 L170 E171	D163-E167 PolarHBondContact O-N 2.86Å; M164-E167 PolarHBondContact O-N 3.26Å; E167-A169 VanDerWaalsContact C-N 3.35Å; E167-A169 PolarHBondContact O-N 2.95Å; E167-L170 PolarHBondContact O-N 3.14Å; E167-E171 PolarHBondContact O-N 3.11Å
168	S	81	Confident	77.6	Confident	51 Å²	51	91.9 Å²	91.9	36%	0.357	46%	0.461	S	S	.	.	H	α-helix	trans	-60.2	-43.2	173.3	-178.8	0	0	0	0	111.9	M164 L170 E171 Y172	M164-S168 VanDerWaalsContact O-CB 3.29Å; M164-S168 WeakPolarHBondContact O-CB 3.34Å; M164-S168 PolarHBondContact O-N 3.49Å; S168-L170 VanDerWaalsContact C-N 3.32Å; S168-L170 PolarHBondContact O-N 3.48Å; S168-E171 PolarHBondContact O-N 3.25Å; S168-Y172 WeakPolarHBondContact O-CB 3.31Å; S168-Y172 VanDerWaalsContact O-CD2 3.29Å; S168-Y172 WeakPolarHBondContact O-CD2 3.27Å; S168-Y172 PolarHBondContact O-N 2.91Å
169	A	77	Confident	76.8	Confident	20 Å²	20	91.6 Å²	91.6	17%	0.165	46%	0.462	C	S	.	.	H	α-helix	trans	-62.6	-39.1	175.3	0	0	0	0	0	111.8	Q165 M166 E167 Y173 F177	Q165-A169 WeakPolarHBondContact O-CB 3.33Å; Q165-A169 PolarHBondContact O-N 3.22Å; M166-A169 PolarHBondContact O-N 2.94Å; E167-A169 VanDerWaalsContact C-N 3.35Å; E167-A169 PolarHBondContact O-N 2.95Å; A169-Y173 CarbonylContact O-C 3.5Å; A169-Y173 WeakPolarHBondContact O-CA 3.48Å; A169-Y173 WeakPolarHBondContact O-CB 3.18Å; A169-Y173 PolarHBondContact O-N 3.23Å; A169-F177 HydrophobicContact CB-CE2 3.71Å; A169-F177 HydrophobicContact CB-CZ 3.88Å
170	L	75.6	Confident	76.6	Confident	93 Å²	93	92.7 Å²	92.7	49%	0.487	48%	0.475	S	S	.	.	H	α-helix	trans	-67.7	-37.8	177.5	-74.9	165.8	0	0	0	112	M166 E167 S168 F177	M166-L170 HydrophobicContact CG-CD1 4.28Å; M166-L170 WeakPolarHBondContact O-CG 3.2Å; M166-L170 PolarHBondContact O-N 3.01Å; E167-L170 PolarHBondContact O-N 3.14Å; S168-L170 VanDerWaalsContact C-N 3.32Å; S168-L170 PolarHBondContact O-N 3.48Å; L170-F177 HydrophobicContact CB-CE2 4.25Å; L170-F177 HydrophobicContact CD2-CD1 4.27Å; L170-F177 HydrophobicContact CD2-CD2 3.46Å; L170-F177 VanDerWaalsContact CD2-CD2 3.46Å; L170-F177 HydrophobicContact CD2-CE1 4.26Å; L170-F177 HydrophobicContact CD2-CE2 3.46Å; L170-F177 VanDerWaalsContact CD2-CE2 3.46Å; L170-F177 HydrophobicContact CD2-CG 3.88Å; L170-F177 HydrophobicContact CD2-CZ 3.87Å; L170-F177 HydrophobicContact CG-CD2 4.09Å; L170-F177 HydrophobicContact CG-CE1 4.48Å; L170-F177 HydrophobicContact CG-CE2 3.54Å; L170-F177 HydrophobicContact CG-CZ 3.75Å
171	E	74.2	Confident	76.8	Confident	135 Å²	135	91.8 Å²	91.8	63%	0.631	47%	0.473	S	S	*	.	H	α-helix	trans	-74.5	-48.1	-179.7	-176.3	174.3	-155.3	0	0	112.4	E167 S168	E167-E171 PolarHBondContact O-N 3.11Å; S168-E171 PolarHBondContact O-N 3.25Å
172	Y	80.9	Confident	77.2	Confident	146 Å²	146	91 Å²	91	57%	0.573	47%	0.468	S	S	*	.	H	α-helix	trans	-98.7	-25.2	-171.2	-63.3	-74.8	0	0	0	114.1	S168	S168-Y172 WeakPolarHBondContact O-CB 3.31Å; S168-Y172 VanDerWaalsContact O-CD2 3.29Å; S168-Y172 WeakPolarHBondContact O-CD2 3.27Å; S168-Y172 PolarHBondContact O-N 2.91Å
173	Y	80.9	Confident	77.9	Confident	130 Å²	130	89.3 Å²	89.3	51%	0.51	46%	0.46	S	S	.	.			trans	-135.8	56.2	-172.8	-50.8	-65.9	0	0	0	112.7	A169 E175 T176	A169-Y173 CarbonylContact O-C 3.5Å; A169-Y173 WeakPolarHBondContact O-CA 3.48Å; A169-Y173 WeakPolarHBondContact O-CB 3.18Å; A169-Y173 PolarHBondContact O-N 3.23Å; Y173-E175 VanDerWaalsContact CA-OE2 3.27Å; Y173-E175 WeakPolarHBondContact CA-OE2 3.33Å; Y173-E175 PolarHBondContact O-N 3.17Å; Y173-T176 WeakPolarHBondContact CB-OG1 3.47Å; Y173-T176 WeakPolarHBondContact O-CB 3.33Å; Y173-T176 PolarHBondContact O-N 3.01Å; Y173-T176 PolarHBondContact O-OG1 2.87Å
174	P	75.5	Confident	78.6	Confident	80 Å²	80	88.7 Å²	88.7	52%	0.519	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-57.5	-25.3	-177.5	26.3	-36.2	0	0	0	112.9	T176 F177 G178	P174-T176 PolarHBondContact O-N 2.86Å; P174-F177 PolarHBondContact O-N 3.05Å; P174-F177 VanDerWaalsContact O-N 3.11Å; P174-G178 PolarHBondContact O-N 2.89Å
175	E	74.5	Confident	79.5	Confident	122 Å²	122	84.4 Å²	84.4	57%	0.57	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-60.2	-23.9	173.9	71.3	-80.4	-170.1	0	0	113.5	Y173 F177 G178	Y173-E175 VanDerWaalsContact CA-OE2 3.27Å; Y173-E175 WeakPolarHBondContact CA-OE2 3.33Å; Y173-E175 PolarHBondContact O-N 3.17Å; E175-F177 PolarHBondContact O-N 2.87Å; E175-G178 PolarHBondContact O-N 2.85Å; E175-G178 VanDerWaalsContact O-N 3.14Å
176	T	73.8	Confident	80.1	Confident	92 Å²	92	81.4 Å²	81.4	56%	0.564	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-60.8	-29.5	175.4	-51.6	0	0	0	0	111.7	Y173 P174	Y173-T176 WeakPolarHBondContact CB-OG1 3.47Å; Y173-T176 WeakPolarHBondContact O-CB 3.33Å; Y173-T176 PolarHBondContact O-N 3.01Å; Y173-T176 PolarHBondContact O-OG1 2.87Å; P174-T176 PolarHBondContact O-N 2.86Å
177	F	69.1	Low	81.1	Confident	106 Å²	106	78.1 Å²	78.1	47%	0.465	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-99.8	-6	-179.4	-56.9	-83.7	0	0	0	112.7	M166 A169 L170 P174 E175	M166-F177 HydrophobicContact CG-CE1 4.44Å; M166-F177 HydrophobicContact CG-CZ 4.17Å; A169-F177 HydrophobicContact CB-CE2 3.71Å; A169-F177 HydrophobicContact CB-CZ 3.88Å; L170-F177 HydrophobicContact CB-CE2 4.25Å; L170-F177 HydrophobicContact CD2-CD1 4.27Å; L170-F177 HydrophobicContact CD2-CD2 3.46Å; L170-F177 VanDerWaalsContact CD2-CD2 3.46Å; L170-F177 HydrophobicContact CD2-CE1 4.26Å; L170-F177 HydrophobicContact CD2-CE2 3.46Å; L170-F177 VanDerWaalsContact CD2-CE2 3.46Å; L170-F177 HydrophobicContact CD2-CG 3.88Å; L170-F177 HydrophobicContact CD2-CZ 3.87Å; L170-F177 HydrophobicContact CG-CD2 4.09Å; L170-F177 HydrophobicContact CG-CE1 4.48Å; L170-F177 HydrophobicContact CG-CE2 3.54Å; L170-F177 HydrophobicContact CG-CZ 3.75Å; P174-F177 PolarHBondContact O-N 3.05Å; P174-F177 VanDerWaalsContact O-N 3.11Å; E175-F177 PolarHBondContact O-N 2.87Å
178	G	64.8	Low	82.1	Confident	42 Å²	42	74.4 Å²	74.4	43%	0.433	39%	0.39	S	S	.	.	S	Bend	trans	-81.2	141.3	176.9	0	0	0	0	0	111.7	P174 E175	P174-G178 PolarHBondContact O-N 2.89Å; E175-G178 PolarHBondContact O-N 2.85Å; E175-G178 VanDerWaalsContact O-N 3.14Å
179	Q	69.6	Low	82.7	Confident	134 Å²	134	72.1 Å²	72.1	63%	0.626	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-72	130.5	165.8	-67.8	-174.4	-34.5	0	0	109.1	N310	Q179-N310 PolarHBondContact NE2-OD1 3.45Å
180	V	78	Confident	83.4	Confident	117 Å²	117	75.7 Å²	75.7	71%	0.709	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-92.6	131.7	177.2	-179.7	0	0	0	0	109.2	M182	V180-M182 PolarHBondContact O-N 2.84Å
181	S	84.4	Confident	84	Confident	48 Å²	48	77.5 Å²	77.5	34%	0.336	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-65.4	128	172.9	-70.7	0	0	0	0	111.1	E301	S181-E301 VanDerWaalsContact OG-CB 3.29Å; S181-E301 WeakPolarHBondContact OG-CB 3.36Å; S181-E301 WeakPolarHBondContact OG-CG 3.22Å
182	M	91.1	Very high	85	Confident	59 Å²	59	74.7 Å²	74.7	29%	0.291	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-69.5	155.1	177.3	-66.4	-53	-70.6	0	0	112.1	V180 F184 F197 I304 L314	V180-M182 PolarHBondContact O-N 2.84Å; M182-F184 HydrophobicContact CB-CD2 4.27Å; M182-F184 HydrophobicContact CB-CE2 3.87Å; M182-F184 PolarHBondContact O-N 3.49Å; M182-F197 HydrophobicContact CB-CD2 4.5Å; M182-F197 HydrophobicContact CB-CE2 3.93Å; M182-F197 HydrophobicContact CE-CE2 3.52Å; M182-F197 HydrophobicContact CE-CZ 3.45Å; M182-F197 VanDerWaalsContact CE-CZ 3.45Å; M182-F197 HydrophobicContact CG-CE2 4.45Å; M182-I304 VanDerWaalsContact O-CD1 3.23Å; M182-I304 WeakPolarHBondContact O-CD1 3.36Å; M182-L314 HydrophobicContact CE-CD1 3.88Å
183	L	94.7	Very high	85.6	Confident	40 Å²	40	73.7 Å²	73.7	21%	0.209	39%	0.387	C	S	.	.			trans	-81	109.4	-175.1	-56.4	-178.3	0	0	0	111.3	F197 V198 I281 L283 F298	L183-F197 WeakPolarHBondContact O-CD2 3.4Å; L183-V198 HydrophobicContact CB-CB 4.08Å; L183-V198 PolarHBondContact O-N 3.19Å; L183-I281 HydrophobicContact CD1-CG2 3.77Å; L183-L283 HydrophobicContact CD1-CD2 4.03Å; L183-L283 HydrophobicContact CD2-CD2 3.88Å; L183-F298 HydrophobicContact CB-CD1 3.9Å; L183-F298 HydrophobicContact CB-CE1 3.83Å; L183-F298 HydrophobicContact CB-CZ 4.44Å; L183-F298 HydrophobicContact CD1-CE1 4.32Å; L183-F298 HydrophobicContact CD1-CZ 4.12Å; L183-F298 HydrophobicContact CD2-CD1 4.23Å; L183-F298 HydrophobicContact CD2-CD2 4.02Å; L183-F298 HydrophobicContact CD2-CE1 4.38Å; L183-F298 HydrophobicContact CD2-CE2 4.2Å; L183-F298 HydrophobicContact CD2-CG 4.07Å; L183-F298 HydrophobicContact CD2-CZ 4.38Å; L183-F298 HydrophobicContact CG-CE1 4.4Å
184	F	95.3	Very high	86.3	Confident	3 Å²	3	67.6 Å²	67.6	1%	0.013	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	148.4	172.1	-76.9	-97.3	0	0	0	111.1	M182 K195 A196 F197 F298 L299 I304 L308	M182-F184 HydrophobicContact CB-CD2 4.27Å; M182-F184 HydrophobicContact CB-CE2 3.87Å; M182-F184 PolarHBondContact O-N 3.49Å; F184-K195 HydrophobicContact CD1-CB 4.22Å; F184-A196 CarbonylContact C-O 3.45Å; F184-A196 VanDerWaalsContact CA-O 3.27Å; F184-A196 WeakPolarHBondContact CA-O 3.29Å; F184-F197 HydrophobicContact CD1-CB 4.15Å; F184-F197 HydrophobicContact CD2-CD2 4.19Å; F184-F197 HydrophobicContact CE1-CB 3.57Å; F184-F197 HydrophobicContact CE1-CD2 4.21Å; F184-F197 HydrophobicContact CE1-CG 4.28Å; F184-F197 AromaticContact CE2-CD2 3.63Å; F184-F197 HydrophobicContact CE2-CD2 3.63Å; F184-F197 HydrophobicContact CE2-CE2 4.35Å; F184-F197 HydrophobicContact CE2-CG 4.43Å; F184-F197 HydrophobicContact CZ-CB 3.78Å; F184-F197 AromaticContact CZ-CD2 3.62Å; F184-F197 HydrophobicContact CZ-CD2 3.62Å; F184-F197 AromaticContact CZ-CG 3.98Å; F184-F197 HydrophobicContact CZ-CG 3.98Å; F184-F298 CarbonylContact O-C 3.57Å; F184-F298 WeakPolarHBondContact O-CA 2.99Å; F184-L299 HydrophobicContact CB-CB 4.13Å; F184-L299 HydrophobicContact CB-CD1 3.79Å; F184-L299 HydrophobicContact CB-CG 3.95Å; F184-L299 WeakPolarHBondContact O-CG 3.41Å; F184-L299 PolarHBondContact O-N 3.13Å; F184-I304 HydrophobicContact CD2-CB 4.42Å; F184-I304 HydrophobicContact CD2-CD1 4.06Å; F184-I304 HydrophobicContact CD2-CG1 3.94Å; F184-I304 HydrophobicContact CD2-CG2 3.72Å; F184-I304 HydrophobicContact CE2-CG2 3.58Å; F184-I304 HydrophobicContact CG-CG1 4.45Å; F184-I304 HydrophobicContact CZ-CG2 4.26Å; F184-L308 HydrophobicContact CE1-CD1 3.9Å; F184-L308 HydrophobicContact CE2-CB 4.46Å; F184-L308 HydrophobicContact CZ-CB 3.98Å; F184-L308 HydrophobicContact CZ-CD1 3.64Å; F184-L308 HydrophobicContact CZ-CG 4.39Å
185	I	95.7	Very high	87.2	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	150.4	170	63.2	175.8	0	0	0	110.7	K195 A196 V198 I248 I269 L288 A296 F298	I185-K195 WeakPolarHBondContact O-CA 3.31Å; I185-A196 HydrophobicContact CG1-CB 4.06Å; I185-A196 PolarHBondContact N-O 3.23Å; I185-A196 PolarHBondContact O-N 2.96Å; I185-V198 HydrophobicContact CD1-CG2 4.25Å; I185-V198 HydrophobicContact CG1-CG2 4.12Å; I185-V198 HydrophobicContact CG2-CG2 4.21Å; I185-I248 HydrophobicContact CD1-CD1 3.98Å; I185-I248 HydrophobicContact CD1-CG2 4.45Å; I185-I269 HydrophobicContact CD1-CD1 3.83Å; I185-I269 HydrophobicContact CG1-CD1 4.4Å; I185-L288 HydrophobicContact CD1-CD2 3.66Å; I185-L288 HydrophobicContact CG2-CB 4.16Å; I185-A296 HydrophobicContact CB-CB 4.41Å; I185-A296 HydrophobicContact CG2-CB 4.26Å; I185-F298 HydrophobicContact CG2-CD1 3.61Å; I185-F298 HydrophobicContact CG2-CE1 3.82Å
186	N	95.6	Very high	88.2	Confident	81 Å²	81	61.7 Å²	61.7	43%	0.433	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	129.2	167.1	-77	-38.2	0	0	0	109.7	L299	N186-L299 HydrophobicContact CB-CD2 4.41Å; N186-L299 VanDerWaalsContact ND2-CD2 3.28Å; N186-L299 WeakPolarHBondContact ND2-CD2 3.45Å
187	C	95.7	Very high	89.2	Confident	7 Å²	7	57.5 Å²	57.5	5%	0.047	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	169.6	170.4	69.8	0	0	0	0	109.7	I194 I246 E247 I248	C187-I194 PolarHBondContact N-O 3.25Å; C187-I194 PolarHBondContact O-N 3.1Å; C187-I194 VanDerWaalsContact O-O 3.04Å; C187-I194 PolarHBondContact SG-O 2.82Å; C187-I194 VanDerWaalsContact SG-O 3.32Å; C187-I246 HydrophobicContact CB-CG2 3.73Å; C187-E247 CarbonylContact C-O 3.55Å; C187-E247 WeakPolarHBondContact CA-O 3.3Å; C187-I248 HydrophobicContact CB-CD1 4.42Å; C187-I248 HydrophobicContact CB-CG1 3.83Å
188	K	96.1	Very high	90.4	Very high	56 Å²	56	52.7 Å²	52.7	24%	0.243	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	137.2	179.6	-176.5	179.4	-178.5	-128.8	0	110	K190 D191 Q192 E247	K188-K190 WeakPolarHBondContact CE-O 3.43Å; K188-K190 WeakPolarHBondContact CG-O 3.26Å; K188-K190 PolarHBondContact NZ-O 3.39Å; K188-D191 IonicContact NZ-OD1 3.72Å; K188-Q192 WeakPolarHBondContact CA-O 3.39Å; K188-Q192 WeakPolarHBondContact CG-O 3.23Å; K188-E247 HydrophobicContact CB-CB 4.12Å; K188-E247 PolarHBondContact N-O 3.06Å; K188-E247 IonicContact NZ-OE2 3.74Å; K188-E247 WeakPolarHBondContact O-CB 3.31Å; K188-E247 PolarHBondContact O-N 3.49Å
189	I	95.3	Very high	91.8	Very high	4 Å²	4	53 Å²	53	2%	0.021	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	115.8	172.4	-60.7	-179.2	0	0	0	107.1	D191 Q192 I194 M207 C215 L217 I246 L267	I189-D191 PolarHBondContact O-N 3.03Å; I189-D191 VanDerWaalsContact O-N 3.08Å; I189-Q192 PolarHBondContact N-O 2.79Å; I189-Q192 PolarHBondContact O-N 3.35Å; I189-I194 HydrophobicContact CB-CD1 3.84Å; I189-I194 HydrophobicContact CD1-CD1 3.61Å; I189-I194 HydrophobicContact CG1-CD1 3.68Å; I189-M207 HydrophobicContact CD1-CE 3.31Å; I189-C215 HydrophobicContact CB-CB 4.46Å; I189-C215 HydrophobicContact CG2-CB 4.01Å; I189-L217 HydrophobicContact CG2-CD1 4.2Å; I189-L217 HydrophobicContact CG2-CD2 4.35Å; I189-I246 HydrophobicContact CD1-CD1 4.18Å; I189-I246 HydrophobicContact CD1-CG1 3.87Å; I189-I246 HydrophobicContact CG1-CB 4.39Å; I189-I246 HydrophobicContact CG1-CG1 4.02Å; I189-I246 HydrophobicContact CG1-CG2 4.22Å; I189-L267 HydrophobicContact CD1-CD2 4.3Å
190	K	90.6	Very high	93	Very high	94 Å²	94	50 Å²	50	41%	0.409	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	54	-109.7	-167.1	-55.5	-176.9	-170.9	163.5	0	110.7	K188 C215 N216	K188-K190 WeakPolarHBondContact CE-O 3.43Å; K188-K190 WeakPolarHBondContact CG-O 3.26Å; K188-K190 PolarHBondContact NZ-O 3.39Å; K190-C215 VanDerWaalsContact CD-O 3.29Å; K190-C215 WeakPolarHBondContact CD-O 3.26Å; K190-C215 VanDerWaalsContact CE-O 3.32Å; K190-C215 WeakPolarHBondContact CE-O 3.38Å; K190-C215 PolarHBondContact NZ-O 3.16Å; K190-N216 VanDerWaalsContact NZ-C 3.33Å; K190-N216 PolarHBondContact NZ-O 3.5Å
191	D	89	Confident	93.8	Very high	131 Å²	131	47.8 Å²	47.8	70%	0.701	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.7	3.5	-178.8	-64.4	-43.2	0	0	0	113.6	K188 I189	K188-D191 IonicContact NZ-OD1 3.72Å; I189-D191 PolarHBondContact O-N 3.03Å; I189-D191 VanDerWaalsContact O-N 3.08Å
192	Q	94.4	Very high	94	Very high	76 Å²	76	46.3 Å²	46.3	36%	0.355	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	124.8	-178	-61.9	-59.7	-38.4	0	0	111.3	K188 I189 R214	K188-Q192 WeakPolarHBondContact CA-O 3.39Å; K188-Q192 WeakPolarHBondContact CG-O 3.23Å; I189-Q192 PolarHBondContact N-O 2.79Å; I189-Q192 PolarHBondContact O-N 3.35Å; Q192-R214 WeakPolarHBondContact CG-O 3.47Å
193	N	94.7	Very high	94.1	Very high	125 Å²	125	51.5 Å²	51.5	67%	0.668	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79	131.5	171	-64.4	-39.2	0	0	0	109.6
194	I	94.5	Very high	94	Very high	2 Å²	2	51.4 Å²	51.4	1%	0.01	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	136.9	-176.2	-63	157.3	0	0	0	108.9	C187 I189 D266 L267	C187-I194 PolarHBondContact N-O 3.25Å; C187-I194 PolarHBondContact O-N 3.1Å; C187-I194 VanDerWaalsContact O-O 3.04Å; C187-I194 PolarHBondContact SG-O 2.82Å; C187-I194 VanDerWaalsContact SG-O 3.32Å; I189-I194 HydrophobicContact CB-CD1 3.84Å; I189-I194 HydrophobicContact CD1-CD1 3.61Å; I189-I194 HydrophobicContact CG1-CD1 3.68Å; I194-D266 HydrophobicContact CG2-CB 3.97Å; I194-L267 HydrophobicContact CG2-CB 3.78Å; I194-L267 HydrophobicContact CG2-CD2 4.29Å
195	K	94.3	Very high	94	Very high	78 Å²	78	51.2 Å²	51.2	34%	0.339	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	107.8	169.4	-61.7	-178.9	-179.8	-179.3	0	107.8	F184 I185 L299 E303 P305	F184-K195 HydrophobicContact CD1-CB 4.22Å; I185-K195 WeakPolarHBondContact O-CA 3.31Å; K195-L299 HydrophobicContact CB-CD1 4.18Å; K195-L299 HydrophobicContact CD-CD1 3.8Å; K195-L299 HydrophobicContact CG-CD1 3.82Å; K195-E303 WeakPolarHBondContact CD-O 3.11Å; K195-E303 WeakPolarHBondContact CE-O 3.34Å; K195-E303 PolarHBondContact NZ-O 2.72Å; K195-P305 HydrophobicContact CD-CG 4.39Å
196	A	95.1	Very high	93.9	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	127.3	-177.9	0	0	0	0	0	110.2	F184 I185 L267 I269	F184-A196 CarbonylContact C-O 3.45Å; F184-A196 VanDerWaalsContact CA-O 3.27Å; F184-A196 WeakPolarHBondContact CA-O 3.29Å; I185-A196 HydrophobicContact CG1-CB 4.06Å; I185-A196 PolarHBondContact N-O 3.23Å; I185-A196 PolarHBondContact O-N 2.96Å; A196-L267 CarbonylContact C-O 3.47Å; A196-L267 WeakPolarHBondContact CA-O 3.13Å; A196-L267 HydrophobicContact CB-CB 4.3Å; A196-L267 HydrophobicContact CB-CD2 3.82Å; A196-L267 HydrophobicContact CB-CG 4.03Å; A196-I269 HydrophobicContact CB-CD1 3.69Å; A196-I269 HydrophobicContact CB-CG1 4.02Å
197	F	95	Very high	93.9	Very high	4 Å²	4	49 Å²	49	2%	0.018	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	131.2	172	179.9	-128.6	0	0	0	109.6	M182 L183 F184 D199 M265 L267 L268 I269 L314	M182-F197 HydrophobicContact CB-CD2 4.5Å; M182-F197 HydrophobicContact CB-CE2 3.93Å; M182-F197 HydrophobicContact CE-CE2 3.52Å; M182-F197 HydrophobicContact CE-CZ 3.45Å; M182-F197 VanDerWaalsContact CE-CZ 3.45Å; M182-F197 HydrophobicContact CG-CE2 4.45Å; L183-F197 WeakPolarHBondContact O-CD2 3.4Å; F184-F197 HydrophobicContact CD1-CB 4.15Å; F184-F197 HydrophobicContact CD2-CD2 4.19Å; F184-F197 HydrophobicContact CE1-CB 3.57Å; F184-F197 HydrophobicContact CE1-CD2 4.21Å; F184-F197 HydrophobicContact CE1-CG 4.28Å; F184-F197 AromaticContact CE2-CD2 3.63Å; F184-F197 HydrophobicContact CE2-CD2 3.63Å; F184-F197 HydrophobicContact CE2-CE2 4.35Å; F184-F197 HydrophobicContact CE2-CG 4.43Å; F184-F197 HydrophobicContact CZ-CB 3.78Å; F184-F197 AromaticContact CZ-CD2 3.62Å; F184-F197 HydrophobicContact CZ-CD2 3.62Å; F184-F197 AromaticContact CZ-CG 3.98Å; F184-F197 HydrophobicContact CZ-CG 3.98Å; F197-D199 HydrophobicContact CD1-CB 4.05Å; F197-D199 HydrophobicContact CE1-CB 3.56Å; F197-D199 HydrophobicContact CZ-CB 4.02Å; F197-M265 HydrophobicContact CB-SD 3.81Å; F197-M265 HydrophobicContact CD1-CE 3.84Å; F197-M265 HydrophobicContact CD1-SD 3.51Å; F197-M265 VanDerWaalsContact CD1-SD 3.51Å; F197-M265 HydrophobicContact CE1-CE 4.33Å; F197-M265 HydrophobicContact CE1-SD 4.29Å; F197-M265 HydrophobicContact CG-SD 3.77Å; F197-L267 PolarHBondContact N-O 3.34Å; F197-L268 HydrophobicContact CD1-CB 4.5Å; F197-L268 HydrophobicContact CD1-CD1 3.89Å; F197-L268 HydrophobicContact CD1-CG 3.81Å; F197-L268 HydrophobicContact CE1-CD1 4.28Å; F197-L268 CarbonylContact O-C 3.21Å; F197-L268 WeakPolarHBondContact O-CA 3.47Å; F197-I269 PolarHBondContact O-N 3.11Å; F197-L314 HydrophobicContact CE1-CD1 4.45Å; F197-L314 HydrophobicContact CE1-CD2 4.4Å; F197-L314 HydrophobicContact CZ-CD1 4.09Å
198	V	95.6	Very high	93.8	Very high	6 Å²	6	48.8 Å²	48.8	4%	0.036	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	112.4	-178.5	-179.8	0	0	0	0	109.2	L183 I185 L274 I281 L288 F298	L183-V198 HydrophobicContact CB-CB 4.08Å; L183-V198 PolarHBondContact O-N 3.19Å; I185-V198 HydrophobicContact CD1-CG2 4.25Å; I185-V198 HydrophobicContact CG1-CG2 4.12Å; I185-V198 HydrophobicContact CG2-CG2 4.21Å; V198-L274 HydrophobicContact CG1-CD1 4.25Å; V198-L274 HydrophobicContact CG1-CD2 4.06Å; V198-I281 HydrophobicContact CG1-CD1 4.07Å; V198-I281 HydrophobicContact CG1-CG1 4.4Å; V198-L288 HydrophobicContact CG1-CD1 4.43Å; V198-L288 HydrophobicContact CG2-CD2 4.4Å; V198-F298 HydrophobicContact CB-CE1 4.34Å; V198-F298 HydrophobicContact CG2-CE1 4.18Å
199	D	94.3	Very high	93.7	Very high	48 Å²	48	49.2 Å²	49.2	26%	0.257	27%	0.272	S	S	.	.			trans	-133.5	107.2	-174.2	-174.2	1	0	0	0	111.5	F197 G201 A202 L268 I269 G270	F197-D199 HydrophobicContact CD1-CB 4.05Å; F197-D199 HydrophobicContact CE1-CB 3.56Å; F197-D199 HydrophobicContact CZ-CB 4.02Å; D199-G201 VanDerWaalsContact C-N 3.26Å; D199-G201 PolarHBondContact O-N 3.05Å; D199-G201 VanDerWaalsContact OD1-CA 3.31Å; D199-G201 WeakPolarHBondContact OD1-CA 3.49Å; D199-G201 PolarHBondContact OD1-N 3.09Å; D199-A202 HydrophobicContact CB-CB 4.14Å; D199-A202 PolarHBondContact O-N 3.47Å; D199-A202 PolarHBondContact OD1-N 3.09Å; D199-L268 HydrophobicContact CB-CD2 4.14Å; D199-L268 HydrophobicContact CB-CG 4.29Å; D199-I269 PolarHBondContact N-O 2.89Å; D199-G270 WeakPolarHBondContact O-CA 3.49Å
200	S	94.8	Very high	93.7	Very high	71 Å²	71	53.1 Å²	53.1	50%	0.497	29%	0.293	S	S	.	.	S	Bend	trans	-74.2	-15.6	174.1	56.1	0	0	0	0	113.7
201	G	92.9	Very high	93.9	Very high	70 Å²	70	48.7 Å²	48.7	72%	0.722	27%	0.274	S	S	*	.	S	Bend	trans	-78	-23.7	174.6	0	0	0	0	0	113.1	D199	D199-G201 VanDerWaalsContact C-N 3.26Å; D199-G201 PolarHBondContact O-N 3.05Å; D199-G201 VanDerWaalsContact OD1-CA 3.31Å; D199-G201 WeakPolarHBondContact OD1-CA 3.49Å; D199-G201 PolarHBondContact OD1-N 3.09Å
202	A	90.7	Very high	94.2	Very high	17 Å²	17	42.4 Å²	42.4	14%	0.14	24%	0.241	C	C	.	.			trans	-78.3	127.7	175.4	0	0	0	0	0	112.1	D199 S204 L268 L271	D199-A202 HydrophobicContact CB-CB 4.14Å; D199-A202 PolarHBondContact O-N 3.47Å; D199-A202 PolarHBondContact OD1-N 3.09Å; A202-S204 VanDerWaalsContact C-N 3.34Å; A202-S204 PolarHBondContact O-N 3.41Å; A202-L268 HydrophobicContact CB-CD1 4.35Å; A202-L268 HydrophobicContact CB-CD2 3.51Å; A202-L271 WeakPolarHBondContact O-CB 3.45Å; A202-L271 PolarHBondContact O-N 3.1Å
203	Q	91.6	Very high	94.2	Very high	168 Å²	168	44.9 Å²	44.9	79%	0.785	25%	0.246	S	C	*	.	S	Bend	trans	-69.4	-30.9	178.3	-175	179.4	-4.7	0	0	113.1	D272	Q203-D272 WeakPolarHBondContact O-CB 3.31Å
204	S	92.5	Very high	94.2	Very high	38 Å²	38	43.3 Å²	43.3	27%	0.266	23%	0.231	S	C	.	.	S	Bend	trans	-131.3	145.2	-172.8	-65.7	0	0	0	0	111.7	A202 D272	A202-S204 VanDerWaalsContact C-N 3.34Å; A202-S204 PolarHBondContact O-N 3.41Å; S204-D272 WeakPolarHBondContact CA-OD2 3.39Å
205	T	95.2	Very high	94.2	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.231	C	C	.	.			trans	-75.5	133.2	171.5	-64.9	0	0	0	0	110	T255 F257 I258 L267 L268 G270 D272 M273	T205-T255 HydrophobicContact CG2-CG2 4.17Å; T205-F257 HydrophobicContact CG2-CB 3.71Å; T205-F257 VanDerWaalsContact O-CA 3.28Å; T205-F257 WeakPolarHBondContact O-CA 3.25Å; T205-F257 WeakPolarHBondContact O-CB 3.47Å; T205-I258 PolarHBondContact O-N 3Å; T205-L267 HydrophobicContact CG2-CD1 4.22Å; T205-L268 CarbonylContact C-O 3.49Å; T205-L268 VanDerWaalsContact CA-O 3.22Å; T205-L268 WeakPolarHBondContact CA-O 3.46Å; T205-L268 WeakPolarHBondContact CG2-O 3.22Å; T205-G270 PolarHBondContact OG1-N 3.23Å; T205-D272 VanDerWaalsContact N-CG 3.34Å; T205-D272 PolarHBondContact N-OD1 2.88Å; T205-D272 PolarHBondContact N-OD2 2.89Å; T205-D272 VanDerWaalsContact N-OD2 3.09Å; T205-D272 PolarHBondContact OG1-OD1 3.07Å; T205-M273 HydrophobicContact CG2-CG 4.08Å; T205-M273 WeakPolarHBondContact OG1-CB 3.28Å; T205-M273 WeakPolarHBondContact OG1-CG 3.15Å
206	I	94.4	Very high	94.2	Very high	33 Å²	33	44.9 Å²	44.9	17%	0.169	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	142.2	-170.5	-69.5	161.3	0	0	0	109.6	I258 L260 Q263 L267 L268	I206-I258 CarbonylContact C-O 3.55Å; I206-I258 WeakPolarHBondContact CA-O 3.26Å; I206-L260 HydrophobicContact CB-CD1 4.46Å; I206-L260 HydrophobicContact CD1-CD1 3.94Å; I206-L260 HydrophobicContact CG1-CD1 4.13Å; I206-L260 HydrophobicContact CG2-CB 4.24Å; I206-L260 HydrophobicContact CG2-CD1 3.48Å; I206-L260 VanDerWaalsContact CG2-CD1 3.48Å; I206-L260 HydrophobicContact CG2-CG 3.72Å; I206-Q263 HydrophobicContact CG2-CG 4.44Å; I206-L267 WeakPolarHBondContact O-CA 3.43Å; I206-L267 WeakPolarHBondContact O-CD1 3.33Å; I206-L268 HydrophobicContact CB-CB 4.35Å; I206-L268 PolarHBondContact N-O 3.44Å; I206-L268 PolarHBondContact O-N 2.57Å
207	M	95.3	Very high	94.2	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	143	171.4	-176.4	179.1	-74.1	0	0	110	I189 C211 A212 L217 F257 I258 V259 L260 D266 L267	I189-M207 HydrophobicContact CD1-CE 3.31Å; M207-C211 HydrophobicContact CG-CB 3.8Å; M207-C211 HydrophobicContact SD-CB 4.39Å; M207-A212 HydrophobicContact CG-CB 4.46Å; M207-A212 HydrophobicContact SD-CB 3.89Å; M207-L217 HydrophobicContact CE-CD1 4.08Å; M207-L217 HydrophobicContact SD-CD1 3.7Å; M207-F257 HydrophobicContact CB-CD2 3.62Å; M207-F257 HydrophobicContact CB-CE2 4.1Å; M207-F257 HydrophobicContact CB-CG 4.31Å; M207-F257 HydrophobicContact CE-CD1 4.46Å; M207-F257 HydrophobicContact CE-CD2 3.93Å; M207-F257 HydrophobicContact CE-CE1 4.04Å; M207-F257 HydrophobicContact CE-CE2 3.44Å; M207-F257 VanDerWaalsContact CE-CE2 3.44Å; M207-F257 HydrophobicContact CE-CG 4.41Å; M207-F257 HydrophobicContact CE-CZ 3.51Å; M207-F257 HydrophobicContact CG-CD2 4.41Å; M207-F257 HydrophobicContact CG-CE2 4.41Å; M207-F257 HydrophobicContact SD-CD2 4Å; M207-F257 HydrophobicContact SD-CE2 3.44Å; M207-F257 WeakPolarHBondContact SD-CE2 3.37Å; M207-F257 HydrophobicContact SD-CZ 4.04Å; M207-I258 PolarHBondContact N-O 2.71Å; M207-V259 CarbonylContact O-C 3.57Å; M207-V259 VanDerWaalsContact O-CA 3.3Å; M207-V259 WeakPolarHBondContact O-CA 3.37Å; M207-L260 PolarHBondContact O-N 2.92Å; M207-D266 VanDerWaalsContact CA-O 3.32Å; M207-D266 WeakPolarHBondContact CA-O 3.45Å; M207-D266 WeakPolarHBondContact CG-O 3.42Å; M207-L267 HydrophobicContact CB-CD1 4.26Å; M207-L267 HydrophobicContact CE-CD1 3.92Å
208	S	93.9	Very high	94	Very high	3 Å²	3	48.9 Å²	48.9	2%	0.021	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	151.7	172.3	69.5	0	0	0	0	111.9	D210 C211 A212 Q263 M265 D266	S208-D210 PolarHBondContact O-N 3.07Å; S208-C211 PolarHBondContact O-N 3.13Å; S208-C211 WeakPolarHBondContact OG-CB 3.45Å; S208-C211 PolarHBondContact OG-N 2.95Å; S208-A212 PolarHBondContact O-N 3.04Å; S208-Q263 WeakPolarHBondContact CB-O 3.3Å; S208-M265 WeakPolarHBondContact CB-O 3.39Å; S208-D266 PolarHBondContact N-O 2.86Å
209	E	94.5	Very high	94	Very high	66 Å²	66	53.9 Å²	53.9	31%	0.308	30%	0.3	S	S	.	.	H	α-helix	trans	-53	-43.1	170.8	-171.3	174.2	-157.2	0	0	111.9	A212 R213 I238 L260 K261	E209-A212 PolarHBondContact O-N 3.44Å; E209-R213 WeakPolarHBondContact O-CB 3.3Å; E209-R213 PolarHBondContact O-N 3.44Å; E209-I238 HydrophobicContact CB-CD1 3.45Å; E209-I238 VanDerWaalsContact CB-CD1 3.45Å; E209-I238 HydrophobicContact CG-CD1 3.39Å; E209-I238 WeakPolarHBondContact OE1-CD1 3.43Å; E209-I238 WeakPolarHBondContact OE2-CD1 2.96Å; E209-L260 PolarHBondContact N-O 2.78Å; E209-K261 WeakPolarHBondContact OE2-CG 3.35Å
210	D	93.6	Very high	94	Very high	86 Å²	86	55.7 Å²	55.7	46%	0.46	31%	0.309	S	S	.	.	H	α-helix	trans	-64.3	-42.3	-178.8	-74	2.2	0	0	0	112	S208 R213 R214	S208-D210 PolarHBondContact O-N 3.07Å; D210-R213 IonicContact OD1-CZ 2.75Å; D210-R213 IonicContact OD1-NH2 3.17Å; D210-R213 PolarHBondContact OD1-NH2 3.43Å; D210-R213 IonicContact OD2-NH2 3.85Å; D210-R214 WeakPolarHBondContact O-CB 3.29Å; D210-R214 VanDerWaalsContact O-CG 3.27Å; D210-R214 WeakPolarHBondContact O-CG 3.37Å; D210-R214 PolarHBondContact O-N 2.9Å
211	C	95	Very high	94.1	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-63.9	-46	173.4	-175.3	0	0	0	0	111.3	M207 S208 R213 R214 C215 D266	M207-C211 HydrophobicContact CG-CB 3.8Å; M207-C211 HydrophobicContact SD-CB 4.39Å; S208-C211 PolarHBondContact O-N 3.13Å; S208-C211 WeakPolarHBondContact OG-CB 3.45Å; S208-C211 PolarHBondContact OG-N 2.95Å; C211-R213 VanDerWaalsContact C-N 3.32Å; C211-R213 PolarHBondContact O-N 3.02Å; C211-R214 PolarHBondContact O-N 3.46Å; C211-C215 WeakPolarHBondContact O-CB 3.33Å; C211-C215 PolarHBondContact O-N 3.19Å; C211-C215 PolarHBondContact O-SG 3.48Å; C211-D266 HydrophobicContact CB-CB 3.94Å; C211-D266 WeakPolarHBondContact CB-O 3.32Å
212	A	95.3	Very high	94.3	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-58.9	-44.1	178.9	0	0	0	0	0	111.9	M207 S208 E209 C215 N216 L217 I221 V259	M207-A212 HydrophobicContact CG-CB 4.46Å; M207-A212 HydrophobicContact SD-CB 3.89Å; S208-A212 PolarHBondContact O-N 3.04Å; E209-A212 PolarHBondContact O-N 3.44Å; A212-C215 CarbonylContact O-C 3.6Å; A212-C215 PolarHBondContact O-N 2.94Å; A212-N216 PolarHBondContact O-N 3.36Å; A212-N216 VanDerWaalsContact O-N 3.17Å; A212-L217 HydrophobicContact CB-CB 4.35Å; A212-L217 WeakPolarHBondContact O-CB 3.19Å; A212-L217 PolarHBondContact O-N 2.92Å; A212-I221 HydrophobicContact CB-CD1 4.19Å; A212-V259 HydrophobicContact CB-CG1 4.09Å; A212-V259 HydrophobicContact CB-CG2 4.48Å
213	R	94.5	Very high	94.5	Very high	127 Å²	127	57.7 Å²	57.7	48%	0.479	29%	0.288	S	S	.	.	H	α-helix	trans	-65.1	-46	176.4	177.7	168.4	45.9	94.2	-1.6	112.5	E209 D210 C211 C215 N216	E209-R213 WeakPolarHBondContact O-CB 3.3Å; E209-R213 PolarHBondContact O-N 3.44Å; D210-R213 IonicContact OD1-CZ 2.75Å; D210-R213 IonicContact OD1-NH2 3.17Å; D210-R213 PolarHBondContact OD1-NH2 3.43Å; D210-R213 IonicContact OD2-NH2 3.85Å; C211-R213 VanDerWaalsContact C-N 3.32Å; C211-R213 PolarHBondContact O-N 3.02Å; R213-C215 PolarHBondContact O-N 3.34Å; R213-N216 PolarHBondContact O-N 2.91Å
214	R	95.1	Very high	94.6	Very high	92 Å²	92	59.7 Å²	59.7	35%	0.347	29%	0.288	S	S	.	.	H	α-helix	trans	-59.4	-34.3	174.5	-73.5	-176.3	-54.6	121.3	-1.9	112.1	Q192 D210 C211 N216 D266	Q192-R214 WeakPolarHBondContact CG-O 3.47Å; D210-R214 WeakPolarHBondContact O-CB 3.29Å; D210-R214 VanDerWaalsContact O-CG 3.27Å; D210-R214 WeakPolarHBondContact O-CG 3.37Å; D210-R214 PolarHBondContact O-N 2.9Å; C211-R214 PolarHBondContact O-N 3.46Å; R214-N216 VanDerWaalsContact C-N 3.27Å; R214-N216 PolarHBondContact O-N 2.87Å; R214-D266 IonicContact CZ-OD1 3.75Å; R214-D266 IonicContact CZ-OD2 2.73Å; R214-D266 IonicContact NH2-OD1 2.62Å; R214-D266 PolarHBondContact NH2-OD1 2.86Å; R214-D266 IonicContact NH2-OD2 3.91Å; R214-D266 PolarHBondContact NH2-OD2 3.46Å
215	C	95.2	Very high	94.6	Very high	1 Å²	1	64.1 Å²	64.1	1%	0.007	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	5.8	176.8	-60.8	0	0	0	0	113.7	I189 K190 C211 A212 R213 L217	I189-C215 HydrophobicContact CB-CB 4.46Å; I189-C215 HydrophobicContact CG2-CB 4.01Å; K190-C215 VanDerWaalsContact CD-O 3.29Å; K190-C215 WeakPolarHBondContact CD-O 3.26Å; K190-C215 VanDerWaalsContact CE-O 3.32Å; K190-C215 WeakPolarHBondContact CE-O 3.38Å; K190-C215 PolarHBondContact NZ-O 3.16Å; C211-C215 WeakPolarHBondContact O-CB 3.33Å; C211-C215 PolarHBondContact O-N 3.19Å; C211-C215 PolarHBondContact O-SG 3.48Å; A212-C215 CarbonylContact O-C 3.6Å; A212-C215 PolarHBondContact O-N 2.94Å; R213-C215 PolarHBondContact O-N 3.34Å; C215-L217 HydrophobicContact CB-CD1 3.93Å; C215-L217 HydrophobicContact CB-CG 3.77Å; C215-L217 PolarHBondContact O-N 3Å
216	N	94	Very high	94.4	Very high	113 Å²	113	66.8 Å²	66.8	60%	0.604	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	39.3	-177.1	-61.5	-45.7	0	0	0	112.8	K190 A212 R213 R214	K190-N216 VanDerWaalsContact NZ-C 3.33Å; K190-N216 PolarHBondContact NZ-O 3.5Å; A212-N216 PolarHBondContact O-N 3.36Å; A212-N216 VanDerWaalsContact O-N 3.17Å; R213-N216 PolarHBondContact O-N 2.91Å; R214-N216 VanDerWaalsContact C-N 3.27Å; R214-N216 PolarHBondContact O-N 2.87Å
217	L	94	Very high	94.1	Very high	4 Å²	4	67 Å²	67	2%	0.021	33%	0.332	C	S	.	.			trans	-92	-0.3	-178	-62.5	176.5	0	0	0	113.2	I189 M207 A212 C215 S219 L220 I221 F257	I189-L217 HydrophobicContact CG2-CD1 4.2Å; I189-L217 HydrophobicContact CG2-CD2 4.35Å; M207-L217 HydrophobicContact CE-CD1 4.08Å; M207-L217 HydrophobicContact SD-CD1 3.7Å; A212-L217 HydrophobicContact CB-CB 4.35Å; A212-L217 WeakPolarHBondContact O-CB 3.19Å; A212-L217 PolarHBondContact O-N 2.92Å; C215-L217 HydrophobicContact CB-CD1 3.93Å; C215-L217 HydrophobicContact CB-CG 3.77Å; C215-L217 PolarHBondContact O-N 3Å; L217-S219 PolarHBondContact O-N 3.24Å; L217-S219 VanDerWaalsContact O-N 3.09Å; L217-L220 HydrophobicContact CD2-CD1 3.91Å; L217-L220 WeakPolarHBondContact O-CA 3.5Å; L217-L220 WeakPolarHBondContact O-CB 3.47Å; L217-L220 PolarHBondContact O-N 3.43Å; L217-I221 PolarHBondContact O-N 2.81Å; L217-F257 HydrophobicContact CD1-CE2 3.99Å; L217-F257 HydrophobicContact CD1-CZ 3.76Å
218	D	92.7	Very high	93.6	Very high	83 Å²	83	73.8 Å²	73.8	44%	0.444	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-50.8	-39.1	-174.8	-58.8	-88.5	0	0	0	113.7	L220 I221	D218-L220 PolarHBondContact O-N 3.4Å; D218-I221 PolarHBondContact O-N 2.94Å
219	S	94.4	Very high	92.6	Very high	111 Å²	111	75 Å²	75	78%	0.776	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-70.4	-16.3	179.1	58.8	0	0	0	0	114.3	L217	L217-S219 PolarHBondContact O-N 3.24Å; L217-S219 VanDerWaalsContact O-N 3.09Å
220	L	95	Very high	91.4	Very high	86 Å²	86	80.7 Å²	80.7	45%	0.45	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-98	-5.6	-179.9	-57.7	-179.8	0	0	0	112.9	L217 D218 D222 V241	L217-L220 HydrophobicContact CD2-CD1 3.91Å; L217-L220 WeakPolarHBondContact O-CA 3.5Å; L217-L220 WeakPolarHBondContact O-CB 3.47Å; L217-L220 PolarHBondContact O-N 3.43Å; D218-L220 PolarHBondContact O-N 3.4Å; L220-D222 PolarHBondContact O-N 2.9Å; L220-V241 HydrophobicContact CB-CG1 4.24Å; L220-V241 HydrophobicContact CB-CG2 4.43Å
221	I	96	Very high	90.2	Very high	21 Å²	21	79.8 Å²	79.8	11%	0.108	40%	0.402	C	S	.	.			trans	-79	108.2	-179	-55.7	177.5	0	0	0	109.5	A212 L217 D218 K223 I238 V241 V259	A212-I221 HydrophobicContact CB-CD1 4.19Å; L217-I221 PolarHBondContact O-N 2.81Å; D218-I221 PolarHBondContact O-N 2.94Å; I221-K223 PolarHBondContact O-N 2.65Å; I221-K223 VanDerWaalsContact O-N 3.16Å; I221-I238 HydrophobicContact CG2-CG2 4.31Å; I221-V241 HydrophobicContact CG1-CG2 4.08Å; I221-V259 HydrophobicContact CD1-CG1 4.24Å; I221-V259 HydrophobicContact CD1-CG2 4.2Å; I221-V259 HydrophobicContact CG1-CG2 4.2Å
222	D	97	Very high	88.5	Confident	26 Å²	26	85.1 Å²	85.1	14%	0.139	44%	0.435	C	S	.	.	B	Isolated β-bridge	trans	-77.7	99.7	173.5	-174.3	-2.4	0	0	0	110.6	L220 R224 W225 G239 R240 H242	L220-D222 PolarHBondContact O-N 2.9Å; D222-R224 PolarHBondContact O-N 2.96Å; D222-R224 VanDerWaalsContact OD1-CB 3.28Å; D222-R224 WeakPolarHBondContact OD1-CB 3.47Å; D222-R224 WeakPolarHBondContact OD1-CG 3.39Å; D222-R224 IonicContact OD1-CZ 3.78Å; D222-R224 PolarHBondContact OD1-N 2.97Å; D222-R224 VanDerWaalsContact OD1-N 3.09Å; D222-R224 IonicContact OD1-NE 2.9Å; D222-R224 PolarHBondContact OD1-NE 3.06Å; D222-R224 IonicContact OD1-NH2 3.78Å; D222-R224 IonicContact OD2-CZ 3.39Å; D222-R224 IonicContact OD2-NE 3.23Å; D222-R224 PolarHBondContact OD2-NE 3.22Å; D222-R224 IonicContact OD2-NH2 2.71Å; D222-R224 PolarHBondContact OD2-NH2 3.17Å; D222-W225 PolarHBondContact O-N 3.46Å; D222-G239 VanDerWaalsContact O-CA 3.32Å; D222-G239 WeakPolarHBondContact O-CA 3.27Å; D222-R240 WeakPolarHBondContact CB-O 3.45Å; D222-R240 PolarHBondContact N-O 3.04Å; D222-R240 PolarHBondContact O-N 3.04Å; D222-H242 WeakPolarHBondContact CB-NE2 3.34Å; D222-H242 IonicContact OD2-CD2 3.79Å; D222-H242 IonicContact OD2-CE1 3.79Å; D222-H242 IonicContact OD2-NE2 2.83Å; D222-H242 PolarHBondContact OD2-NE2 3.42Å
223	K	95.5	Very high	87.2	Confident	153 Å²	153	86.8 Å²	86.8	67%	0.665	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-68.8	-9	-179.2	-62	-173.6	179.8	-175.7	0	114.2	I221 W225 A226	I221-K223 PolarHBondContact O-N 2.65Å; I221-K223 VanDerWaalsContact O-N 3.16Å; K223-W225 PolarHBondContact O-N 3Å; K223-A226 WeakPolarHBondContact O-CB 3.41Å; K223-A226 PolarHBondContact O-N 3.3Å
224	R	94.5	Very high	86.2	Confident	210 Å²	210	86 Å²	86	79%	0.792	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-65.3	-19.3	172.3	-60.8	175.8	-63.8	171.6	3.4	112.2	D222 A226	D222-R224 PolarHBondContact O-N 2.96Å; D222-R224 VanDerWaalsContact OD1-CB 3.28Å; D222-R224 WeakPolarHBondContact OD1-CB 3.47Å; D222-R224 WeakPolarHBondContact OD1-CG 3.39Å; D222-R224 IonicContact OD1-CZ 3.78Å; D222-R224 PolarHBondContact OD1-N 2.97Å; D222-R224 VanDerWaalsContact OD1-N 3.09Å; D222-R224 IonicContact OD1-NE 2.9Å; D222-R224 PolarHBondContact OD1-NE 3.06Å; D222-R224 IonicContact OD1-NH2 3.78Å; D222-R224 IonicContact OD2-CZ 3.39Å; D222-R224 IonicContact OD2-NE 3.23Å; D222-R224 PolarHBondContact OD2-NE 3.22Å; D222-R224 IonicContact OD2-NH2 2.71Å; D222-R224 PolarHBondContact OD2-NH2 3.17Å; R224-A226 VanDerWaalsContact C-N 3.34Å
225	W	91.9	Very high	85.6	Confident	132 Å²	132	83.5 Å²	83.5	50%	0.5	45%	0.454	S	S	.	.	G	3₁₀ helix	trans	-92.5	7.9	175.2	-69.3	73.8	0	0	0	113	D222 K223 I237 R240 H242	D222-W225 PolarHBondContact O-N 3.46Å; K223-W225 PolarHBondContact O-N 3Å; W225-I237 VanDerWaalsContact O-CG2 3.25Å; W225-I237 WeakPolarHBondContact O-CG2 3.3Å; W225-R240 HydrophobicContact CB-CB 3.77Å; W225-R240 HydrophobicContact CD2-CB 4.31Å; W225-R240 HydrophobicContact CG-CB 3.89Å; W225-H242 AromaticContact CD1-CE1 3.78Å; W225-H242 AromaticContact CD1-NE2 3.98Å; W225-H242 AromaticContact CE2-CE1 3.76Å; W225-H242 AromaticContact NE1-CE1 3.34Å; W225-H242 PolarHBondContact NE1-CE1 2.87Å; W225-H242 VanDerWaalsContact NE1-CE1 3.34Å; W225-H242 AromaticContact NE1-NE2 3.78Å
226	A	90.7	Very high	85.4	Confident	55 Å²	55	87 Å²	87	46%	0.455	48%	0.475	S	S	.	.			trans	-62.4	146.7	173.1	0	0	0	0	0	110.9	K223 R224 I237 I238	K223-A226 WeakPolarHBondContact O-CB 3.41Å; K223-A226 PolarHBondContact O-N 3.3Å; R224-A226 VanDerWaalsContact C-N 3.34Å; A226-I237 VanDerWaalsContact CA-O 3.28Å; A226-I237 WeakPolarHBondContact CA-O 3.43Å; A226-I238 WeakPolarHBondContact CB-O 3.47Å
227	G	89	Confident	85.4	Confident	38 Å²	38	82.9 Å²	82.9	39%	0.392	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	171.5	-157.6	-174.8	0	0	0	0	0	112.5	I237	G227-I237 PolarHBondContact N-O 3.09Å; G227-I237 PolarHBondContact O-N 2.8Å
228	K	83.4	Confident	85.4	Confident	142 Å²	142	84.1 Å²	84.1	62%	0.617	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.9	130.7	172.3	-67.6	-174.3	176.8	-174.7	0	109.3	Y230 Q235	K228-Y230 HydrophobicContact CB-CE2 4.21Å; K228-Q235 CarbonylContact C-O 3.42Å; K228-Q235 WeakPolarHBondContact CA-O 3.48Å
229	A	73.6	Confident	85.6	Confident	29 Å²	29	80.2 Å²	80.2	24%	0.24	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	132.1	169	0	0	0	0	0	108.8	T234 Q235 I237 L260	A229-T234 WeakPolarHBondContact O-CA 3.38Å; A229-Q235 HydrophobicContact CB-CB 4.43Å; A229-Q235 PolarHBondContact N-O 3.25Å; A229-Q235 PolarHBondContact O-N 3.2Å; A229-I237 HydrophobicContact CB-CD1 3.87Å; A229-I237 HydrophobicContact CB-CG1 3.77Å; A229-L260 HydrophobicContact CB-CD2 4.21Å
230	Y	69.5	Low	85.7	Confident	186 Å²	186	77.5 Å²	77.5	73%	0.729	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.6	127.4	173.5	-60.6	-85.8	0	0	0	108.4	K228 T234	K228-Y230 HydrophobicContact CB-CE2 4.21Å; Y230-T234 HydrophobicContact CD1-CG2 4.01Å; Y230-T234 HydrophobicContact CE1-CG2 4.07Å
231	G	67.3	Low	85.7	Confident	66 Å²	66	73.4 Å²	73.4	68%	0.68	39%	0.39	S	S	*	.	S	Bend	trans	-162.1	-133.7	177	0	0	0	0	0	109.4	G233	G231-G233 PolarHBondContact N-O 3.09Å; G231-G233 VanDerWaalsContact N-O 3.08Å; G231-G233 PolarHBondContact O-N 3.39Å
232	V	59.2	Low	85.7	Confident	112 Å²	112	76.4 Å²	76.4	68%	0.679	40%	0.403	S	S	*	.	S	Bend	trans	-67.9	35.1	168.3	-70	0	0	0	0	113.1
233	G	68.2	Low	85.5	Confident	36 Å²	36	80.3 Å²	80.3	37%	0.371	42%	0.424	S	S	.	.	S	Bend	trans	149.3	167.6	-171.1	0	0	0	0	0	112	G231	G231-G233 PolarHBondContact N-O 3.09Å; G231-G233 VanDerWaalsContact N-O 3.08Å; G231-G233 PolarHBondContact O-N 3.39Å
234	T	73.9	Confident	85.4	Confident	109 Å²	109	73.2 Å²	73.2	67%	0.669	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.2	115	171	53.2	0	0	0	0	109.8	A229 Y230	A229-T234 WeakPolarHBondContact O-CA 3.38Å; Y230-T234 HydrophobicContact CD1-CG2 4.01Å; Y230-T234 HydrophobicContact CE1-CG2 4.07Å
235	Q	83.3	Confident	85.4	Confident	41 Å²	41	67.8 Å²	67.8	19%	0.192	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	150.8	175.8	-62.2	-167.2	27.1	0	0	111.4	K228 A229 L260 Q263	K228-Q235 CarbonylContact C-O 3.42Å; K228-Q235 WeakPolarHBondContact CA-O 3.48Å; A229-Q235 HydrophobicContact CB-CB 4.43Å; A229-Q235 PolarHBondContact N-O 3.25Å; A229-Q235 PolarHBondContact O-N 3.2Å; Q235-L260 HydrophobicContact CB-CD1 4.2Å; Q235-Q263 VanDerWaalsContact NE2-OE1 3.14Å
236	T	90.8	Very high	85.6	Confident	74 Å²	74	61.6 Å²	61.6	45%	0.454	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	119.2	178.1	-58.7	0	0	0	0	109.6	K261	T236-K261 PolarHBondContact O-N 3.45Å
237	I	93.4	Very high	85.8	Confident	26 Å²	26	61.1 Å²	61.1	13%	0.133	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	122.1	172.6	-58	164.1	0	0	0	108.3	W225 A226 G227 A229 I258 L260	W225-I237 VanDerWaalsContact O-CG2 3.25Å; W225-I237 WeakPolarHBondContact O-CG2 3.3Å; A226-I237 VanDerWaalsContact CA-O 3.28Å; A226-I237 WeakPolarHBondContact CA-O 3.43Å; G227-I237 PolarHBondContact N-O 3.09Å; G227-I237 PolarHBondContact O-N 2.8Å; A229-I237 HydrophobicContact CB-CD1 3.87Å; A229-I237 HydrophobicContact CB-CG1 3.77Å; I237-I258 HydrophobicContact CB-CG2 4.37Å; I237-I258 HydrophobicContact CD1-CG2 4.42Å; I237-I258 HydrophobicContact CG1-CG2 4Å; I237-I258 HydrophobicContact CG2-CG2 3.56Å; I237-L260 HydrophobicContact CB-CD2 4.06Å; I237-L260 HydrophobicContact CG1-CD2 3.44Å; I237-L260 VanDerWaalsContact CG1-CD2 3.44Å
238	I	94.6	Very high	86.1	Confident	31 Å²	31	59.8 Å²	59.8	16%	0.159	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	-38	174.9	-58.9	178.4	0	0	0	110.3	E209 I221 A226 V259 K261	E209-I238 HydrophobicContact CB-CD1 3.45Å; E209-I238 VanDerWaalsContact CB-CD1 3.45Å; E209-I238 HydrophobicContact CG-CD1 3.39Å; E209-I238 WeakPolarHBondContact OE1-CD1 3.43Å; E209-I238 WeakPolarHBondContact OE2-CD1 2.96Å; I221-I238 HydrophobicContact CG2-CG2 4.31Å; A226-I238 WeakPolarHBondContact CB-O 3.47Å; I238-V259 HydrophobicContact CB-CG1 4.41Å; I238-V259 HydrophobicContact CD1-CG1 4.31Å; I238-V259 PolarHBondContact N-O 2.91Å; I238-K261 HydrophobicContact CD1-CB 3.94Å; I238-K261 HydrophobicContact CD1-CG 4.21Å; I238-K261 HydrophobicContact CG1-CB 3.98Å
239	G	95.9	Very high	86.3	Confident	0 Å²	0	56 Å²	56	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.1	-160.2	178.7	0	0	0	0	0	111.5	D222 V259	D222-G239 VanDerWaalsContact O-CA 3.32Å; D222-G239 WeakPolarHBondContact O-CA 3.27Å; G239-V259 PolarHBondContact O-N 3.13Å
240	R	96.1	Very high	86.9	Confident	54 Å²	54	57 Å²	57	20%	0.204	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	137.3	-178.4	-174.6	176.5	-177.8	146.3	9.6	111	D222 W225 S256	D222-R240 WeakPolarHBondContact CB-O 3.45Å; D222-R240 PolarHBondContact N-O 3.04Å; D222-R240 PolarHBondContact O-N 3.04Å; W225-R240 HydrophobicContact CB-CB 3.77Å; W225-R240 HydrophobicContact CD2-CB 4.31Å; W225-R240 HydrophobicContact CG-CB 3.89Å; R240-S256 PolarHBondContact NE-OG 3.25Å; R240-S256 PolarHBondContact NH2-OG 3.36Å
241	V	96.7	Very high	88	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.006	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	115.4	163.5	179.9	0	0	0	0	107.3	L220 I221 S256 F257 V259	L220-V241 HydrophobicContact CB-CG1 4.24Å; L220-V241 HydrophobicContact CB-CG2 4.43Å; I221-V241 HydrophobicContact CG1-CG2 4.08Å; V241-S256 WeakPolarHBondContact O-CA 3.4Å; V241-S256 PolarHBondContact O-OG 3.35Å; V241-F257 HydrophobicContact CB-CD2 3.91Å; V241-F257 HydrophobicContact CB-CE1 4.41Å; V241-F257 HydrophobicContact CB-CE2 3.51Å; V241-F257 HydrophobicContact CB-CZ 3.78Å; V241-F257 HydrophobicContact CG1-CE1 4.31Å; V241-F257 HydrophobicContact CG1-CE2 4.06Å; V241-F257 HydrophobicContact CG1-CZ 3.79Å; V241-F257 HydrophobicContact CG2-CD2 4.15Å; V241-F257 HydrophobicContact CG2-CE2 3.52Å; V241-F257 HydrophobicContact CG2-CZ 4.09Å; V241-F257 PolarHBondContact N-O 3.1Å; V241-F257 PolarHBondContact O-N 3.11Å; V241-V259 HydrophobicContact CG2-CG2 4.1Å
242	H	95.5	Very high	89.3	Confident	83 Å²	83	54.6 Å²	54.6	38%	0.384	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	-34.8	-174.6	-65.1	-62.4	0	0	0	113.1	D222 W225 S256	D222-H242 WeakPolarHBondContact CB-NE2 3.34Å; D222-H242 IonicContact OD2-CD2 3.79Å; D222-H242 IonicContact OD2-CE1 3.79Å; D222-H242 IonicContact OD2-NE2 2.83Å; D222-H242 PolarHBondContact OD2-NE2 3.42Å; W225-H242 AromaticContact CD1-CE1 3.78Å; W225-H242 AromaticContact CD1-NE2 3.98Å; W225-H242 AromaticContact CE2-CE1 3.76Å; W225-H242 AromaticContact NE1-CE1 3.34Å; W225-H242 PolarHBondContact NE1-CE1 2.87Å; W225-H242 VanDerWaalsContact NE1-CE1 3.34Å; W225-H242 AromaticContact NE1-NE2 3.78Å; H242-S256 WeakPolarHBondContact O-CB 3.09Å
243	N	92.8	Very high	90.9	Very high	108 Å²	108	49.9 Å²	49.9	58%	0.578	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-150.3	82.9	-177.2	-169.1	12.4	0	0	0	110.5	P254	N243-P254 VanDerWaalsContact OD1-CB 3.3Å; N243-P254 WeakPolarHBondContact OD1-CB 3.28Å
244	G	93.4	Very high	92.1	Very high	4 Å²	4	51 Å²	51	4%	0.041	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	145.1	168.3	0	0	0	0	0	110.3	T255	G244-T255 PolarHBondContact N-O 2.66Å; G244-T255 PolarHBondContact O-N 2.73Å
245	L	94.7	Very high	93.1	Very high	97 Å²	97	46.1 Å²	46.1	51%	0.508	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	119.7	175.4	-64.9	175.3	0	0	0	109.6	F252 I253 P254	L245-F252 HydrophobicContact CB-CD1 4.24Å; L245-I253 WeakPolarHBondContact CA-O 3.27Å; L245-P254 HydrophobicContact CD2-CB 4.22Å
246	I	95.5	Very high	93.7	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.01	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	123.7	173.6	-53.1	-174.1	0	0	0	108.1	C187 I189 I248 I253 T255 L267	C187-I246 HydrophobicContact CB-CG2 3.73Å; I189-I246 HydrophobicContact CD1-CD1 4.18Å; I189-I246 HydrophobicContact CD1-CG1 3.87Å; I189-I246 HydrophobicContact CG1-CB 4.39Å; I189-I246 HydrophobicContact CG1-CG1 4.02Å; I189-I246 HydrophobicContact CG1-CG2 4.22Å; I246-I248 HydrophobicContact CG2-CD1 4.19Å; I246-I248 HydrophobicContact CG2-CG1 3.9Å; I246-I253 PolarHBondContact N-O 2.99Å; I246-I253 PolarHBondContact O-N 2.95Å; I246-T255 HydrophobicContact CD1-CG2 3.68Å; I246-T255 HydrophobicContact CG1-CG2 4.45Å; I246-L267 HydrophobicContact CD1-CD2 3.9Å
247	E	95.6	Very high	93.9	Very high	45 Å²	45	40.9 Å²	40.9	21%	0.21	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	120.3	174.3	-174.3	-173	162.2	0	0	109.6	C187 K188 I251 F252	C187-E247 CarbonylContact C-O 3.55Å; C187-E247 WeakPolarHBondContact CA-O 3.3Å; K188-E247 HydrophobicContact CB-CB 4.12Å; K188-E247 PolarHBondContact N-O 3.06Å; K188-E247 IonicContact NZ-OE2 3.74Å; K188-E247 WeakPolarHBondContact O-CB 3.31Å; K188-E247 PolarHBondContact O-N 3.49Å; E247-I251 WeakPolarHBondContact CA-O 3.49Å; E247-F252 HydrophobicContact CB-CD1 3.95Å; E247-F252 HydrophobicContact CB-CE1 3.81Å; E247-F252 HydrophobicContact CB-CZ 4.41Å; E247-F252 HydrophobicContact CG-CD1 4.49Å; E247-F252 HydrophobicContact CG-CE1 4.19Å; E247-F252 HydrophobicContact CG-CZ 4.3Å
248	I	94.5	Very high	94	Very high	9 Å²	9	41.1 Å²	41.1	5%	0.046	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	125.2	175.1	-52.9	-178.5	0	0	0	107.7	I185 C187 I246 G250 I251 I253 I290 A296	I185-I248 HydrophobicContact CD1-CD1 3.98Å; I185-I248 HydrophobicContact CD1-CG2 4.45Å; C187-I248 HydrophobicContact CB-CD1 4.42Å; C187-I248 HydrophobicContact CB-CG1 3.83Å; I246-I248 HydrophobicContact CG2-CD1 4.19Å; I246-I248 HydrophobicContact CG2-CG1 3.9Å; I248-G250 PolarHBondContact O-N 2.95Å; I248-G250 VanDerWaalsContact O-N 3.17Å; I248-I251 PolarHBondContact N-O 3.3Å; I248-I251 PolarHBondContact O-N 2.77Å; I248-I253 HydrophobicContact CB-CD1 3.97Å; I248-I253 HydrophobicContact CD1-CD1 3.93Å; I248-I253 HydrophobicContact CG1-CD1 4.08Å; I248-I290 HydrophobicContact CB-CD1 4.04Å; I248-I290 HydrophobicContact CD1-CD1 3.78Å; I248-I290 HydrophobicContact CG1-CD1 4.49Å; I248-I290 HydrophobicContact CG2-CD1 3.73Å; I248-A296 HydrophobicContact CG2-CB 3.63Å
249	G	87.4	Confident	94	Very high	62 Å²	62	39.7 Å²	39.7	64%	0.639	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.2	30.4	-178.2	0	0	0	0	0	113.8	I251	G249-I251 VanDerWaalsContact C-N 3.33Å; G249-I251 PolarHBondContact O-N 2.82Å
250	G	87.7	Confident	93.9	Very high	52 Å²	52	39.9 Å²	39.9	54%	0.536	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.3	4.7	-178.3	0	0	0	0	0	115.4	I248	I248-G250 PolarHBondContact O-N 2.95Å; I248-G250 VanDerWaalsContact O-N 3.17Å
251	I	91.4	Very high	93.7	Very high	84 Å²	84	41.6 Å²	41.6	43%	0.431	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	133.3	177.5	-54.3	-159.9	0	0	0	110.1	E247 I248 G249 I294	E247-I251 WeakPolarHBondContact CA-O 3.49Å; I248-I251 PolarHBondContact N-O 3.3Å; I248-I251 PolarHBondContact O-N 2.77Å; G249-I251 VanDerWaalsContact C-N 3.33Å; G249-I251 PolarHBondContact O-N 2.82Å; I251-I294 HydrophobicContact CB-CD1 3.65Å; I251-I294 HydrophobicContact CB-CG1 4.29Å; I251-I294 HydrophobicContact CD1-CD1 3.74Å; I251-I294 HydrophobicContact CD1-CG1 3.58Å; I251-I294 HydrophobicContact CG1-CD1 3.96Å; I251-I294 HydrophobicContact CG1-CG1 4.04Å; I251-I294 HydrophobicContact CG2-CD1 3.92Å
252	F	94	Very high	93	Very high	116 Å²	116	47.9 Å²	47.9	51%	0.509	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	121	176.1	-65.3	-83.2	0	0	0	111.1	L245 E247	L245-F252 HydrophobicContact CB-CD1 4.24Å; E247-F252 HydrophobicContact CB-CD1 3.95Å; E247-F252 HydrophobicContact CB-CE1 3.81Å; E247-F252 HydrophobicContact CB-CZ 4.41Å; E247-F252 HydrophobicContact CG-CD1 4.49Å; E247-F252 HydrophobicContact CG-CE1 4.19Å; E247-F252 HydrophobicContact CG-CZ 4.3Å
253	I	93.5	Very high	92.4	Very high	14 Å²	14	45.3 Å²	45.3	7%	0.072	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	124.9	-177.1	-61.5	167.9	0	0	0	108.6	L245 I246 I248 T255 H277 I290 I294	L245-I253 WeakPolarHBondContact CA-O 3.27Å; I246-I253 PolarHBondContact N-O 2.99Å; I246-I253 PolarHBondContact O-N 2.95Å; I248-I253 HydrophobicContact CB-CD1 3.97Å; I248-I253 HydrophobicContact CD1-CD1 3.93Å; I248-I253 HydrophobicContact CG1-CD1 4.08Å; I253-T255 PolarHBondContact O-N 3.48Å; I253-T255 PolarHBondContact O-OG1 2.76Å; I253-H277 WeakPolarHBondContact CG2-CE1 3.4Å; I253-H277 WeakPolarHBondContact CG2-ND1 3.21Å; I253-H277 VanDerWaalsContact CG2-NE2 3.28Å; I253-H277 WeakPolarHBondContact CG2-NE2 3.43Å; I253-I290 HydrophobicContact CD1-CD1 3.62Å; I253-I290 HydrophobicContact CD1-CG2 3.95Å; I253-I294 HydrophobicContact CD1-CD1 4.38Å
254	P	94.8	Very high	91.9	Very high	60 Å²	60	43.6 Å²	43.6	39%	0.39	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	112.9	177.3	28.9	-32.5	0	0	0	111.4	N243 L245 H277	N243-P254 VanDerWaalsContact OD1-CB 3.3Å; N243-P254 WeakPolarHBondContact OD1-CB 3.28Å; L245-P254 HydrophobicContact CD2-CB 4.22Å; P254-H277 PolarHBondContact O-CE1 3.48Å; P254-H277 PolarHBondContact O-NE2 2.75Å; P254-H277 VanDerWaalsContact O-NE2 3.11Å
255	T	94.5	Very high	91.6	Very high	6 Å²	6	44 Å²	44	4%	0.037	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	138.3	-171.2	-51.2	0	0	0	0	110.6	T205 G244 I246 I253 F257 M273	T205-T255 HydrophobicContact CG2-CG2 4.17Å; G244-T255 PolarHBondContact N-O 2.66Å; G244-T255 PolarHBondContact O-N 2.73Å; I246-T255 HydrophobicContact CD1-CG2 3.68Å; I246-T255 HydrophobicContact CG1-CG2 4.45Å; I253-T255 PolarHBondContact O-N 3.48Å; I253-T255 PolarHBondContact O-OG1 2.76Å; T255-F257 HydrophobicContact CG2-CD1 4.11Å; T255-M273 HydrophobicContact CG2-CB 4.31Å; T255-M273 HydrophobicContact CG2-CG 3.47Å; T255-M273 VanDerWaalsContact CG2-CG 3.47Å; T255-M273 HydrophobicContact CG2-SD 3.43Å; T255-M273 WeakPolarHBondContact CG2-SD 3.42Å
256	S	95.1	Very high	91.5	Very high	3 Å²	3	42 Å²	42	2%	0.021	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	140.1	167.6	172.2	0	0	0	0	108.7	R240 V241 H242 M273	R240-S256 PolarHBondContact NE-OG 3.25Å; R240-S256 PolarHBondContact NH2-OG 3.36Å; V241-S256 WeakPolarHBondContact O-CA 3.4Å; V241-S256 PolarHBondContact O-OG 3.35Å; H242-S256 WeakPolarHBondContact O-CB 3.09Å; S256-M273 PolarHBondContact N-SD 3.44Å; S256-M273 VanDerWaalsContact N-SD 3.44Å
257	F	95.2	Very high	91.5	Very high	1 Å²	1	42 Å²	42	0%	0.004	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	149.1	175	44.5	-93	0	0	0	112.6	T205 M207 L217 V241 T255 V259	T205-F257 HydrophobicContact CG2-CB 3.71Å; T205-F257 VanDerWaalsContact O-CA 3.28Å; T205-F257 WeakPolarHBondContact O-CA 3.25Å; T205-F257 WeakPolarHBondContact O-CB 3.47Å; M207-F257 HydrophobicContact CB-CD2 3.62Å; M207-F257 HydrophobicContact CB-CE2 4.1Å; M207-F257 HydrophobicContact CB-CG 4.31Å; M207-F257 HydrophobicContact CE-CD1 4.46Å; M207-F257 HydrophobicContact CE-CD2 3.93Å; M207-F257 HydrophobicContact CE-CE1 4.04Å; M207-F257 HydrophobicContact CE-CE2 3.44Å; M207-F257 VanDerWaalsContact CE-CE2 3.44Å; M207-F257 HydrophobicContact CE-CG 4.41Å; M207-F257 HydrophobicContact CE-CZ 3.51Å; M207-F257 HydrophobicContact CG-CD2 4.41Å; M207-F257 HydrophobicContact CG-CE2 4.41Å; M207-F257 HydrophobicContact SD-CD2 4Å; M207-F257 HydrophobicContact SD-CE2 3.44Å; M207-F257 WeakPolarHBondContact SD-CE2 3.37Å; M207-F257 HydrophobicContact SD-CZ 4.04Å; L217-F257 HydrophobicContact CD1-CE2 3.99Å; L217-F257 HydrophobicContact CD1-CZ 3.76Å; V241-F257 HydrophobicContact CB-CD2 3.91Å; V241-F257 HydrophobicContact CB-CE1 4.41Å; V241-F257 HydrophobicContact CB-CE2 3.51Å; V241-F257 HydrophobicContact CB-CZ 3.78Å; V241-F257 HydrophobicContact CG1-CE1 4.31Å; V241-F257 HydrophobicContact CG1-CE2 4.06Å; V241-F257 HydrophobicContact CG1-CZ 3.79Å; V241-F257 HydrophobicContact CG2-CD2 4.15Å; V241-F257 HydrophobicContact CG2-CE2 3.52Å; V241-F257 HydrophobicContact CG2-CZ 4.09Å; V241-F257 PolarHBondContact N-O 3.1Å; V241-F257 PolarHBondContact O-N 3.11Å; T255-F257 HydrophobicContact CG2-CD1 4.11Å; F257-V259 HydrophobicContact CD2-CG2 4.34Å
258	I	95.2	Very high	91.5	Very high	32 Å²	32	40.3 Å²	40.3	16%	0.164	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	133.1	174.9	-60.1	175.2	0	0	0	107.7	T205 I206 M207 I237 L260	T205-I258 PolarHBondContact O-N 3Å; I206-I258 CarbonylContact C-O 3.55Å; I206-I258 WeakPolarHBondContact CA-O 3.26Å; M207-I258 PolarHBondContact N-O 2.71Å; I237-I258 HydrophobicContact CB-CG2 4.37Å; I237-I258 HydrophobicContact CD1-CG2 4.42Å; I237-I258 HydrophobicContact CG1-CG2 4Å; I237-I258 HydrophobicContact CG2-CG2 3.56Å; I258-L260 HydrophobicContact CG2-CD2 3.84Å; I258-L260 HydrophobicContact CG2-CG 4.39Å
259	V	95.8	Very high	91.5	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	118.6	177	-173.8	0	0	0	0	109	M207 A212 I221 I238 G239 V241 F257	M207-V259 CarbonylContact O-C 3.57Å; M207-V259 VanDerWaalsContact O-CA 3.3Å; M207-V259 WeakPolarHBondContact O-CA 3.37Å; A212-V259 HydrophobicContact CB-CG1 4.09Å; A212-V259 HydrophobicContact CB-CG2 4.48Å; I221-V259 HydrophobicContact CD1-CG1 4.24Å; I221-V259 HydrophobicContact CD1-CG2 4.2Å; I221-V259 HydrophobicContact CG1-CG2 4.2Å; I238-V259 HydrophobicContact CB-CG1 4.41Å; I238-V259 HydrophobicContact CD1-CG1 4.31Å; I238-V259 PolarHBondContact N-O 2.91Å; G239-V259 PolarHBondContact O-N 3.13Å; V241-V259 HydrophobicContact CG2-CG2 4.1Å; F257-V259 HydrophobicContact CD2-CG2 4.34Å
260	L	93.5	Very high	91.9	Very high	4 Å²	4	37.4 Å²	37.4	2%	0.021	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	144.2	-179.9	-62.3	-175.1	0	0	0	111.3	I206 M207 E209 A229 Q235 I237 I258 Q263	I206-L260 HydrophobicContact CB-CD1 4.46Å; I206-L260 HydrophobicContact CD1-CD1 3.94Å; I206-L260 HydrophobicContact CG1-CD1 4.13Å; I206-L260 HydrophobicContact CG2-CB 4.24Å; I206-L260 HydrophobicContact CG2-CD1 3.48Å; I206-L260 VanDerWaalsContact CG2-CD1 3.48Å; I206-L260 HydrophobicContact CG2-CG 3.72Å; M207-L260 PolarHBondContact O-N 2.92Å; E209-L260 PolarHBondContact N-O 2.78Å; A229-L260 HydrophobicContact CB-CD2 4.21Å; Q235-L260 HydrophobicContact CB-CD1 4.2Å; I237-L260 HydrophobicContact CB-CD2 4.06Å; I237-L260 HydrophobicContact CG1-CD2 3.44Å; I237-L260 VanDerWaalsContact CG1-CD2 3.44Å; I258-L260 HydrophobicContact CG2-CD2 3.84Å; I258-L260 HydrophobicContact CG2-CG 4.39Å; L260-Q263 HydrophobicContact CB-CB 4.23Å
261	K	91	Very high	92.3	Very high	91 Å²	91	37.8 Å²	37.8	40%	0.396	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	144	171.6	-157.5	-165.2	170.1	-160.7	0	110.1	E209 T236 I238 Q263	E209-K261 WeakPolarHBondContact OE2-CG 3.35Å; T236-K261 PolarHBondContact O-N 3.45Å; I238-K261 HydrophobicContact CD1-CB 3.94Å; I238-K261 HydrophobicContact CD1-CG 4.21Å; I238-K261 HydrophobicContact CG1-CB 3.98Å; K261-Q263 PolarHBondContact O-N 3.17Å
262	D	82.4	Confident	92.5	Very high	132 Å²	132	35.7 Å²	35.7	71%	0.706	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.4	32.4	171	-50.8	-43.1	0	0	0	113.8
263	Q	81.8	Confident	92.6	Very high	29 Å²	29	30.4 Å²	30.4	14%	0.136	17%	0.165	C	C	.	.			trans	-89.2	128.6	177.6	176.4	70.4	-24.6	0	0	110.8	I206 S208 Q235 L260 K261 M265	I206-Q263 HydrophobicContact CG2-CG 4.44Å; S208-Q263 WeakPolarHBondContact CB-O 3.3Å; Q235-Q263 VanDerWaalsContact NE2-OE1 3.14Å; L260-Q263 HydrophobicContact CB-CB 4.23Å; K261-Q263 PolarHBondContact O-N 3.17Å; Q263-M265 VanDerWaalsContact C-N 3.33Å; Q263-M265 WeakPolarHBondContact CG-O 3.18Å; Q263-M265 PolarHBondContact O-N 2.79Å
264	S	83.3	Confident	92.7	Very high	72 Å²	72	30.2 Å²	30.2	50%	0.503	16%	0.164	S	C	.	.	S	Bend	trans	-68.9	-29.6	-178	59.1	0	0	0	0	113.7
265	M	87.2	Confident	92.8	Very high	14 Å²	14	34.5 Å²	34.5	7%	0.069	18%	0.177	C	C	.	.	S	Bend	trans	-92.6	133.5	178.4	-66.1	-169.8	-75.3	0	0	111.9	F197 S208 Q263 L268 L308 L314	F197-M265 HydrophobicContact CB-SD 3.81Å; F197-M265 HydrophobicContact CD1-CE 3.84Å; F197-M265 HydrophobicContact CD1-SD 3.51Å; F197-M265 VanDerWaalsContact CD1-SD 3.51Å; F197-M265 HydrophobicContact CE1-CE 4.33Å; F197-M265 HydrophobicContact CE1-SD 4.29Å; F197-M265 HydrophobicContact CG-SD 3.77Å; S208-M265 WeakPolarHBondContact CB-O 3.39Å; Q263-M265 VanDerWaalsContact C-N 3.33Å; Q263-M265 WeakPolarHBondContact CG-O 3.18Å; Q263-M265 PolarHBondContact O-N 2.79Å; M265-L268 HydrophobicContact CE-CD1 3.81Å; M265-L308 HydrophobicContact CG-CD1 3.68Å; M265-L308 HydrophobicContact CG-CD2 3.33Å; M265-L308 HydrophobicContact CG-CG 4.15Å; M265-L308 HydrophobicContact SD-CD1 4.29Å; M265-L308 HydrophobicContact SD-CD2 3.83Å; M265-L314 HydrophobicContact CE-CD2 3.85Å; M265-L314 HydrophobicContact SD-CD2 4.24Å
266	D	93.2	Very high	92.8	Very high	54 Å²	54	40.9 Å²	40.9	29%	0.289	20%	0.2	S	C	.	.	S	Bend	trans	-62.4	-49.9	177.3	-84.6	-27.1	0	0	0	113	I194 M207 S208 C211 R214	I194-D266 HydrophobicContact CG2-CB 3.97Å; M207-D266 VanDerWaalsContact CA-O 3.32Å; M207-D266 WeakPolarHBondContact CA-O 3.45Å; M207-D266 WeakPolarHBondContact CG-O 3.42Å; S208-D266 PolarHBondContact N-O 2.86Å; C211-D266 HydrophobicContact CB-CB 3.94Å; C211-D266 WeakPolarHBondContact CB-O 3.32Å; R214-D266 IonicContact CZ-OD1 3.75Å; R214-D266 IonicContact CZ-OD2 2.73Å; R214-D266 IonicContact NH2-OD1 2.62Å; R214-D266 PolarHBondContact NH2-OD1 2.86Å; R214-D266 IonicContact NH2-OD2 3.91Å; R214-D266 PolarHBondContact NH2-OD2 3.46Å
267	L	94.8	Very high	92.8	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	127.5	-176.3	179.5	63.1	0	0	0	109.9	I189 I194 A196 F197 T205 I206 M207 I246	I189-L267 HydrophobicContact CD1-CD2 4.3Å; I194-L267 HydrophobicContact CG2-CB 3.78Å; I194-L267 HydrophobicContact CG2-CD2 4.29Å; A196-L267 CarbonylContact C-O 3.47Å; A196-L267 WeakPolarHBondContact CA-O 3.13Å; A196-L267 HydrophobicContact CB-CB 4.3Å; A196-L267 HydrophobicContact CB-CD2 3.82Å; A196-L267 HydrophobicContact CB-CG 4.03Å; F197-L267 PolarHBondContact N-O 3.34Å; T205-L267 HydrophobicContact CG2-CD1 4.22Å; I206-L267 WeakPolarHBondContact O-CA 3.43Å; I206-L267 WeakPolarHBondContact O-CD1 3.33Å; M207-L267 HydrophobicContact CB-CD1 4.26Å; M207-L267 HydrophobicContact CE-CD1 3.92Å; I246-L267 HydrophobicContact CD1-CD2 3.9Å
268	L	94.8	Very high	92.8	Very high	11 Å²	11	49.2 Å²	49.2	6%	0.058	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	119.3	172.6	-177.3	166.6	0	0	0	108.1	F197 D199 A202 T205 I206 M265	F197-L268 HydrophobicContact CD1-CB 4.5Å; F197-L268 HydrophobicContact CD1-CD1 3.89Å; F197-L268 HydrophobicContact CD1-CG 3.81Å; F197-L268 HydrophobicContact CE1-CD1 4.28Å; F197-L268 CarbonylContact O-C 3.21Å; F197-L268 WeakPolarHBondContact O-CA 3.47Å; D199-L268 HydrophobicContact CB-CD2 4.14Å; D199-L268 HydrophobicContact CB-CG 4.29Å; A202-L268 HydrophobicContact CB-CD1 4.35Å; A202-L268 HydrophobicContact CB-CD2 3.51Å; T205-L268 CarbonylContact C-O 3.49Å; T205-L268 VanDerWaalsContact CA-O 3.22Å; T205-L268 WeakPolarHBondContact CA-O 3.46Å; T205-L268 WeakPolarHBondContact CG2-O 3.22Å; I206-L268 HydrophobicContact CB-CB 4.35Å; I206-L268 PolarHBondContact N-O 3.44Å; I206-L268 PolarHBondContact O-N 2.57Å; M265-L268 HydrophobicContact CE-CD1 3.81Å
269	I	96	Very high	92.9	Very high	10 Å²	10	49.2 Å²	49.2	5%	0.051	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	104.6	173.7	-60.1	174.8	0	0	0	108.5	I185 A196 F197 D199 M273 L274	I185-I269 HydrophobicContact CD1-CD1 3.83Å; I185-I269 HydrophobicContact CG1-CD1 4.4Å; A196-I269 HydrophobicContact CB-CD1 3.69Å; A196-I269 HydrophobicContact CB-CG1 4.02Å; F197-I269 PolarHBondContact O-N 3.11Å; D199-I269 PolarHBondContact N-O 2.89Å; I269-M273 HydrophobicContact CG2-CB 4.15Å; I269-L274 HydrophobicContact CG2-CD2 3.97Å; I269-L274 HydrophobicContact CG2-CG 4.07Å
270	G	95.2	Very high	92.9	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.264	C	S	.	.			trans	-85.2	176.3	-179.5	0	0	0	0	0	113.1	D199 T205 D272 M273 L274	D199-G270 WeakPolarHBondContact O-CA 3.49Å; T205-G270 PolarHBondContact OG1-N 3.23Å; G270-D272 PolarHBondContact O-N 3.22Å; G270-M273 PolarHBondContact O-N 3.23Å; G270-L274 WeakPolarHBondContact O-CG 3.37Å; G270-L274 PolarHBondContact O-N 3.41Å; G270-L274 VanDerWaalsContact O-N 3.12Å
271	L	96.5	Very high	93.1	Very high	59 Å²	59	54.9 Å²	54.9	31%	0.309	28%	0.276	S	S	.	.	H	α-helix	trans	-59.8	-28.1	179.9	-169.1	63.9	0	0	0	113.4	A202 K275	A202-L271 WeakPolarHBondContact O-CB 3.45Å; A202-L271 PolarHBondContact O-N 3.1Å; L271-K275 HydrophobicContact CD1-CD 4.42Å; L271-K275 HydrophobicContact CD1-CG 4.16Å; L271-K275 HydrophobicContact CG-CD 4.1Å; L271-K275 HydrophobicContact CG-CG 4.22Å; L271-K275 VanDerWaalsContact O-CB 3.31Å; L271-K275 WeakPolarHBondContact O-CB 3.35Å; L271-K275 WeakPolarHBondContact O-CG 3.4Å; L271-K275 PolarHBondContact O-N 3.44Å
272	D	95.3	Very high	93.4	Very high	41 Å²	41	52.4 Å²	52.4	22%	0.219	27%	0.267	C	S	.	.	H	α-helix	trans	-58.8	-46.6	176.3	59.8	-18.3	0	0	0	112.5	Q203 S204 T205 G270 R276	Q203-D272 WeakPolarHBondContact O-CB 3.31Å; S204-D272 WeakPolarHBondContact CA-OD2 3.39Å; T205-D272 VanDerWaalsContact N-CG 3.34Å; T205-D272 PolarHBondContact N-OD1 2.88Å; T205-D272 PolarHBondContact N-OD2 2.89Å; T205-D272 VanDerWaalsContact N-OD2 3.09Å; T205-D272 PolarHBondContact OG1-OD1 3.07Å; G270-D272 PolarHBondContact O-N 3.22Å; D272-R276 VanDerWaalsContact O-CB 3.23Å; D272-R276 WeakPolarHBondContact O-CB 3.27Å; D272-R276 PolarHBondContact O-N 3.07Å
273	M	94.6	Very high	94	Very high	5 Å²	5	51.5 Å²	51.5	3%	0.025	26%	0.262	C	S	.	.	H	α-helix	trans	-81.1	-36.7	180	-63.7	-60.3	107.9	0	0	111.5	T205 T255 S256 I269 G270 K275 R276 H277	T205-M273 HydrophobicContact CG2-CG 4.08Å; T205-M273 WeakPolarHBondContact OG1-CB 3.28Å; T205-M273 WeakPolarHBondContact OG1-CG 3.15Å; T255-M273 HydrophobicContact CG2-CB 4.31Å; T255-M273 HydrophobicContact CG2-CG 3.47Å; T255-M273 VanDerWaalsContact CG2-CG 3.47Å; T255-M273 HydrophobicContact CG2-SD 3.43Å; T255-M273 WeakPolarHBondContact CG2-SD 3.42Å; S256-M273 PolarHBondContact N-SD 3.44Å; S256-M273 VanDerWaalsContact N-SD 3.44Å; I269-M273 HydrophobicContact CG2-CB 4.15Å; G270-M273 PolarHBondContact O-N 3.23Å; M273-K275 VanDerWaalsContact C-N 3.33Å; M273-K275 PolarHBondContact O-N 2.99Å; M273-R276 PolarHBondContact O-N 3.46Å; M273-H277 PolarHBondContact O-CD2 3.13Å; M273-H277 VanDerWaalsContact O-CD2 3.22Å; M273-H277 PolarHBondContact O-N 3.49Å
274	L	96.6	Very high	94.6	Very high	10 Å²	10	59.8 Å²	59.8	5%	0.052	30%	0.297	C	S	.	.	H	α-helix	trans	-57.2	-46.6	172.9	-66.2	172.6	0	0	0	111.3	V198 I269 G270 Q278 C279 I281 L288	V198-L274 HydrophobicContact CG1-CD1 4.25Å; V198-L274 HydrophobicContact CG1-CD2 4.06Å; I269-L274 HydrophobicContact CG2-CD2 3.97Å; I269-L274 HydrophobicContact CG2-CG 4.07Å; G270-L274 WeakPolarHBondContact O-CG 3.37Å; G270-L274 PolarHBondContact O-N 3.41Å; G270-L274 VanDerWaalsContact O-N 3.12Å; L274-Q278 PolarHBondContact O-N 2.93Å; L274-C279 HydrophobicContact CB-CB 4.28Å; L274-C279 HydrophobicContact CD2-CB 3.73Å; L274-C279 PolarHBondContact O-N 3.36Å; L274-I281 HydrophobicContact CD1-CD1 4.19Å; L274-L288 HydrophobicContact CD2-CD1 4.02Å; L274-L288 HydrophobicContact CD2-CD2 4.42Å
275	K	96.5	Very high	95.2	Very high	150 Å²	150	62.6 Å²	62.6	65%	0.652	30%	0.296	S	S	*	.	H	α-helix	trans	-68.9	-42.8	176.2	-76.2	-175.3	174	179.8	0	112.5	L271 M273 H277 Q278	L271-K275 HydrophobicContact CD1-CD 4.42Å; L271-K275 HydrophobicContact CD1-CG 4.16Å; L271-K275 HydrophobicContact CG-CD 4.1Å; L271-K275 HydrophobicContact CG-CG 4.22Å; L271-K275 VanDerWaalsContact O-CB 3.31Å; L271-K275 WeakPolarHBondContact O-CB 3.35Å; L271-K275 WeakPolarHBondContact O-CG 3.4Å; L271-K275 PolarHBondContact O-N 3.44Å; M273-K275 VanDerWaalsContact C-N 3.33Å; M273-K275 PolarHBondContact O-N 2.99Å; K275-H277 VanDerWaalsContact C-N 3.27Å; K275-H277 PolarHBondContact O-N 3.33Å; K275-Q278 PolarHBondContact O-N 3.36Å
276	R	95.6	Very high	95.6	Very high	139 Å²	139	65.5 Å²	65.5	53%	0.525	31%	0.313	S	S	.	.	H	α-helix	trans	-58	-39.5	-178.9	176.8	178.3	-71.1	-175.8	-2.8	112.5	D272 M273	D272-R276 VanDerWaalsContact O-CB 3.23Å; D272-R276 WeakPolarHBondContact O-CB 3.27Å; D272-R276 PolarHBondContact O-N 3.07Å; M273-R276 PolarHBondContact O-N 3.46Å
277	H	94.7	Very high	95.7	Very high	34 Å²	34	63.7 Å²	63.7	16%	0.157	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	15.9	-177.9	-57.9	-64.4	0	0	0	113.3	I253 P254 M273 K275 C279 I290 D291	I253-H277 WeakPolarHBondContact CG2-CE1 3.4Å; I253-H277 WeakPolarHBondContact CG2-ND1 3.21Å; I253-H277 VanDerWaalsContact CG2-NE2 3.28Å; I253-H277 WeakPolarHBondContact CG2-NE2 3.43Å; P254-H277 PolarHBondContact O-CE1 3.48Å; P254-H277 PolarHBondContact O-NE2 2.75Å; P254-H277 VanDerWaalsContact O-NE2 3.11Å; M273-H277 PolarHBondContact O-CD2 3.13Å; M273-H277 VanDerWaalsContact O-CD2 3.22Å; M273-H277 PolarHBondContact O-N 3.49Å; K275-H277 VanDerWaalsContact C-N 3.27Å; K275-H277 PolarHBondContact O-N 3.33Å; H277-C279 PolarHBondContact O-N 2.85Å; H277-I290 HydrophobicContact CB-CG2 3.83Å; H277-D291 PolarHBondContact O-N 2.85Å; H277-D291 VanDerWaalsContact O-N 3.13Å
278	Q	95.4	Very high	95.8	Very high	146 Å²	146	63.7 Å²	63.7	68%	0.682	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.1	44.8	178.8	-56.5	-170.5	-87.7	0	0	112.5	L274 K275	L274-Q278 PolarHBondContact O-N 2.93Å; K275-Q278 PolarHBondContact O-N 3.36Å
279	C	96.4	Very high	95.9	Very high	32 Å²	32	64 Å²	64	22%	0.216	31%	0.305	C	S	.	.			trans	-68.3	145.2	-178.4	-60.4	0	0	0	0	111.2	L274 H277 L288 V289	L274-C279 HydrophobicContact CB-CB 4.28Å; L274-C279 HydrophobicContact CD2-CB 3.73Å; L274-C279 PolarHBondContact O-N 3.36Å; H277-C279 PolarHBondContact O-N 2.85Å; C279-L288 HydrophobicContact CB-CD1 4Å; C279-V289 CarbonylContact C-O 3.58Å; C279-V289 WeakPolarHBondContact CA-O 3.47Å
280	C	96.9	Very high	95.9	Very high	69 Å²	69	63.7 Å²	63.7	47%	0.466	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	118.6	168.9	-177.4	0	0	0	0	108.7	D282 V289	C280-D282 PolarHBondContact O-N 2.91Å; C280-V289 HydrophobicContact CB-CB 4.17Å; C280-V289 PolarHBondContact N-O 3.32Å; C280-V289 PolarHBondContact O-N 2.89Å
281	I	97	Very high	95.6	Very high	54 Å²	54	67.2 Å²	67.2	28%	0.277	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	96.9	171.7	-63.3	172.2	0	0	0	106.6	L183 V198 L274 L283 L288 F298	L183-I281 HydrophobicContact CD1-CG2 3.77Å; V198-I281 HydrophobicContact CG1-CD1 4.07Å; V198-I281 HydrophobicContact CG1-CG1 4.4Å; L274-I281 HydrophobicContact CD1-CD1 4.19Å; I281-L283 HydrophobicContact CG2-CD2 3.68Å; I281-L283 HydrophobicContact CG2-CG 4.07Å; I281-L283 PolarHBondContact O-N 3.11Å; I281-L288 HydrophobicContact CG1-CD1 3.69Å; I281-F298 HydrophobicContact CG2-CE2 4.12Å; I281-F298 HydrophobicContact CG2-CZ 3.9Å
282	D	96.6	Very high	95.3	Very high	38 Å²	38	67.6 Å²	67.6	20%	0.203	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	93.2	-179.9	-170.6	-26.7	0	0	0	110	C280 K284 R285 N286 V287	C280-D282 PolarHBondContact O-N 2.91Å; D282-K284 VanDerWaalsContact C-N 3.29Å; D282-K284 PolarHBondContact O-N 2.99Å; D282-K284 WeakPolarHBondContact OD1-CA 3.42Å; D282-K284 WeakPolarHBondContact OD1-CB 3.36Å; D282-K284 PolarHBondContact OD1-N 2.86Å; D282-R285 HydrophobicContact CB-CB 4.44Å; D282-R285 PolarHBondContact OD1-N 2.7Å; D282-R285 WeakPolarHBondContact OD2-CD 3.5Å; D282-R285 WeakPolarHBondContact OD2-CG 3.17Å; D282-N286 VanDerWaalsContact O-CA 3.31Å; D282-N286 WeakPolarHBondContact O-CA 3.34Å; D282-N286 PolarHBondContact O-N 3.15Å; D282-V287 HydrophobicContact CB-CG2 4.15Å; D282-V287 PolarHBondContact N-O 2.88Å; D282-V287 PolarHBondContact O-N 3.43Å
283	L	95.7	Very high	95	Very high	114 Å²	114	75.4 Å²	75.4	60%	0.597	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-20.9	178.7	-57.7	179.1	0	0	0	112.9	L183 I281 F298	L183-L283 HydrophobicContact CD1-CD2 4.03Å; L183-L283 HydrophobicContact CD2-CD2 3.88Å; I281-L283 HydrophobicContact CG2-CD2 3.68Å; I281-L283 HydrophobicContact CG2-CG 4.07Å; I281-L283 PolarHBondContact O-N 3.11Å; L283-F298 HydrophobicContact CD2-CE2 4.34Å
284	K	95	Very high	94.9	Very high	203 Å²	203	76 Å²	76	88%	0.883	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-40.1	177.1	-178.9	179.3	-179.7	178.6	0	110.8	D282	D282-K284 VanDerWaalsContact C-N 3.29Å; D282-K284 PolarHBondContact O-N 2.99Å; D282-K284 WeakPolarHBondContact OD1-CA 3.42Å; D282-K284 WeakPolarHBondContact OD1-CB 3.36Å; D282-K284 PolarHBondContact OD1-N 2.86Å
285	R	95.4	Very high	94.8	Very high	130 Å²	130	80 Å²	80	49%	0.491	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-9.6	176.8	-63.3	176.3	65.2	-154.6	-2.9	112.9	D282 V287 E295	D282-R285 HydrophobicContact CB-CB 4.44Å; D282-R285 PolarHBondContact OD1-N 2.7Å; D282-R285 WeakPolarHBondContact OD2-CD 3.5Å; D282-R285 WeakPolarHBondContact OD2-CG 3.17Å; R285-V287 HydrophobicContact CB-CG2 3.96Å; R285-E295 IonicContact CZ-OE1 3.46Å; R285-E295 IonicContact CZ-OE2 3.19Å; R285-E295 IonicContact NH1-OE1 3.82Å; R285-E295 PolarHBondContact NH1-OE1 3.02Å; R285-E295 IonicContact NH2-OE1 2.72Å; R285-E295 PolarHBondContact NH2-OE1 2.87Å; R285-E295 IonicContact NH2-OE2 2.87Å; R285-E295 PolarHBondContact NH2-OE2 2.86Å
286	N	94.9	Very high	94.8	Very high	76 Å²	76	73.2 Å²	73.2	41%	0.406	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.7	45.8	-174.2	-159.4	43.5	0	0	0	113.2	D282 F298	D282-N286 VanDerWaalsContact O-CA 3.31Å; D282-N286 WeakPolarHBondContact O-CA 3.34Å; D282-N286 PolarHBondContact O-N 3.15Å; N286-F298 VanDerWaalsContact C-CD2 3.44Å; N286-F298 PolarHBondContact O-N 3.33Å
287	V	96.7	Very high	94.8	Very high	15 Å²	15	70.9 Å²	70.9	9%	0.091	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	148.9	179.5	-54.6	0	0	0	0	111.6	D282 R285 V289 A296 P297 F298	D282-V287 HydrophobicContact CB-CG2 4.15Å; D282-V287 PolarHBondContact N-O 2.88Å; D282-V287 PolarHBondContact O-N 3.43Å; R285-V287 HydrophobicContact CB-CG2 3.96Å; V287-V289 HydrophobicContact CG2-CG2 3.86Å; V287-A296 CarbonylContact C-O 3.56Å; V287-A296 WeakPolarHBondContact CA-O 3.32Å; V287-P297 HydrophobicContact CG1-CB 4.37Å; V287-F298 VanDerWaalsContact C-CE2 3.42Å; V287-F298 WeakPolarHBondContact O-CE2 3.47Å
288	L	97	Very high	94.9	Very high	2 Å²	2	69.7 Å²	69.7	1%	0.01	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	114.5	161.3	-174	71.7	0	0	0	108.8	I185 V198 L274 C279 I281 I290 A296 F298	I185-L288 HydrophobicContact CD1-CD2 3.66Å; I185-L288 HydrophobicContact CG2-CB 4.16Å; V198-L288 HydrophobicContact CG1-CD1 4.43Å; V198-L288 HydrophobicContact CG2-CD2 4.4Å; L274-L288 HydrophobicContact CD2-CD1 4.02Å; L274-L288 HydrophobicContact CD2-CD2 4.42Å; C279-L288 HydrophobicContact CB-CD1 4Å; I281-L288 HydrophobicContact CG1-CD1 3.69Å; L288-I290 HydrophobicContact CD2-CD1 4.35Å; L288-I290 HydrophobicContact CD2-CG1 4.27Å; L288-I290 HydrophobicContact CG-CG1 4.29Å; L288-A296 HydrophobicContact CB-CB 4.44Å; L288-A296 PolarHBondContact N-O 2.8Å; L288-A296 PolarHBondContact O-N 2.83Å; L288-F298 HydrophobicContact CB-CE1 3.94Å; L288-F298 HydrophobicContact CB-CZ 3.85Å; L288-F298 HydrophobicContact CD1-CZ 4.35Å
289	V	96.5	Very high	94.8	Very high	16 Å²	16	63.3 Å²	63.3	10%	0.097	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	130.9	172.9	-173.7	0	0	0	0	108.9	C279 C280 V287 I294 E295	C279-V289 CarbonylContact C-O 3.58Å; C279-V289 WeakPolarHBondContact CA-O 3.47Å; C280-V289 HydrophobicContact CB-CB 4.17Å; C280-V289 PolarHBondContact N-O 3.32Å; C280-V289 PolarHBondContact O-N 2.89Å; V287-V289 HydrophobicContact CG2-CG2 3.86Å; V289-I294 CarbonylContact C-O 2.92Å; V289-I294 VanDerWaalsContact CA-O 3.28Å; V289-I294 WeakPolarHBondContact CA-O 3.33Å; V289-E295 HydrophobicContact CG2-CG 4.41Å
290	I	94.7	Very high	94.6	Very high	4 Å²	4	64.9 Å²	64.9	2%	0.021	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	126	179.3	-48.3	175.8	0	0	0	108.8	I248 I253 H277 L288 G292 R293 I294	I248-I290 HydrophobicContact CB-CD1 4.04Å; I248-I290 HydrophobicContact CD1-CD1 3.78Å; I248-I290 HydrophobicContact CG1-CD1 4.49Å; I248-I290 HydrophobicContact CG2-CD1 3.73Å; I253-I290 HydrophobicContact CD1-CD1 3.62Å; I253-I290 HydrophobicContact CD1-CG2 3.95Å; H277-I290 HydrophobicContact CB-CG2 3.83Å; L288-I290 HydrophobicContact CD2-CD1 4.35Å; L288-I290 HydrophobicContact CD2-CG1 4.27Å; L288-I290 HydrophobicContact CG-CG1 4.29Å; I290-G292 PolarHBondContact O-N 2.96Å; I290-R293 PolarHBondContact O-N 2.84Å; I290-I294 HydrophobicContact CB-CB 4.17Å; I290-I294 HydrophobicContact CB-CD1 4.29Å; I290-I294 HydrophobicContact CG2-CD1 4.45Å; I290-I294 PolarHBondContact N-O 2.75Å; I290-I294 PolarHBondContact O-N 3.4Å; I290-I294 VanDerWaalsContact O-N 3.1Å
291	D	90.4	Very high	94.1	Very high	75 Å²	75	67.4 Å²	67.4	40%	0.401	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	52	23.4	-177.4	-167.4	40.2	0	0	0	114.3	H277 R293	H277-D291 PolarHBondContact O-N 2.85Å; H277-D291 VanDerWaalsContact O-N 3.13Å; D291-R293 WeakPolarHBondContact O-CG 3.45Å; D291-R293 PolarHBondContact O-N 2.76Å; D291-R293 VanDerWaalsContact O-N 3.14Å; D291-R293 IonicContact OD2-CZ 3.77Å; D291-R293 IonicContact OD2-NE 3.73Å; D291-R293 IonicContact OD2-NH1 3.91Å
292	G	89	Confident	93.7	Very high	66 Å²	66	70.2 Å²	70.2	68%	0.68	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.6	8.1	-176.1	0	0	0	0	0	115.5	I290	I290-G292 PolarHBondContact O-N 2.96Å
293	R	89.5	Confident	93.3	Very high	206 Å²	206	72.3 Å²	72.3	78%	0.777	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122	-38.3	-171.4	-67	171.7	-171.6	-178.3	5.2	113.5	I290 D291	I290-R293 PolarHBondContact O-N 2.84Å; D291-R293 WeakPolarHBondContact O-CG 3.45Å; D291-R293 PolarHBondContact O-N 2.76Å; D291-R293 VanDerWaalsContact O-N 3.14Å; D291-R293 IonicContact OD2-CZ 3.77Å; D291-R293 IonicContact OD2-NE 3.73Å; D291-R293 IonicContact OD2-NH1 3.91Å
294	I	92.4	Very high	92.7	Very high	18 Å²	18	67.2 Å²	67.2	9%	0.092	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	134.9	-177.2	-53.6	156.5	0	0	0	107.3	I251 I253 V289 I290	I251-I294 HydrophobicContact CB-CD1 3.65Å; I251-I294 HydrophobicContact CB-CG1 4.29Å; I251-I294 HydrophobicContact CD1-CD1 3.74Å; I251-I294 HydrophobicContact CD1-CG1 3.58Å; I251-I294 HydrophobicContact CG1-CD1 3.96Å; I251-I294 HydrophobicContact CG1-CG1 4.04Å; I251-I294 HydrophobicContact CG2-CD1 3.92Å; I253-I294 HydrophobicContact CD1-CD1 4.38Å; V289-I294 CarbonylContact C-O 2.92Å; V289-I294 VanDerWaalsContact CA-O 3.28Å; V289-I294 WeakPolarHBondContact CA-O 3.33Å; I290-I294 HydrophobicContact CB-CB 4.17Å; I290-I294 HydrophobicContact CB-CD1 4.29Å; I290-I294 HydrophobicContact CG2-CD1 4.45Å; I290-I294 PolarHBondContact N-O 2.75Å; I290-I294 PolarHBondContact O-N 3.4Å; I290-I294 VanDerWaalsContact O-N 3.1Å
295	E	94.6	Very high	91.6	Very high	94 Å²	94	59.7 Å²	59.7	44%	0.439	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	123.4	173.4	-57.8	-171.8	160.9	0	0	108.6	R285 V289	R285-E295 IonicContact CZ-OE1 3.46Å; R285-E295 IonicContact CZ-OE2 3.19Å; R285-E295 IonicContact NH1-OE1 3.82Å; R285-E295 PolarHBondContact NH1-OE1 3.02Å; R285-E295 IonicContact NH2-OE1 2.72Å; R285-E295 PolarHBondContact NH2-OE1 2.87Å; R285-E295 IonicContact NH2-OE2 2.87Å; R285-E295 PolarHBondContact NH2-OE2 2.86Å; V289-E295 HydrophobicContact CG2-CG 4.41Å
296	A	95.5	Very high	90.2	Very high	6 Å²	6	60.9 Å²	60.9	5%	0.05	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	110.7	174.3	0	0	0	0	0	108.6	I185 I248 V287 L288	I185-A296 HydrophobicContact CB-CB 4.41Å; I185-A296 HydrophobicContact CG2-CB 4.26Å; I248-A296 HydrophobicContact CG2-CB 3.63Å; V287-A296 CarbonylContact C-O 3.56Å; V287-A296 WeakPolarHBondContact CA-O 3.32Å; L288-A296 HydrophobicContact CB-CB 4.44Å; L288-A296 PolarHBondContact N-O 2.8Å; L288-A296 PolarHBondContact O-N 2.83Å
297	P	96.4	Very high	88.6	Confident	90 Å²	90	60.4 Å²	60.4	58%	0.584	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64	140.2	178.9	26.7	-33.4	0	0	0	111.2	V287	V287-P297 HydrophobicContact CG1-CB 4.37Å
298	F	96.8	Very high	86.8	Confident	9 Å²	9	60.2 Å²	60.2	4%	0.039	34%	0.337	C	S	.	.	B	Isolated β-bridge	trans	-69.1	142	170.4	-66.9	-59.6	0	0	0	109.9	L183 F184 I185 V198 I281 L283 N286 V287 L288	L183-F298 HydrophobicContact CB-CD1 3.9Å; L183-F298 HydrophobicContact CB-CE1 3.83Å; L183-F298 HydrophobicContact CB-CZ 4.44Å; L183-F298 HydrophobicContact CD1-CE1 4.32Å; L183-F298 HydrophobicContact CD1-CZ 4.12Å; L183-F298 HydrophobicContact CD2-CD1 4.23Å; L183-F298 HydrophobicContact CD2-CD2 4.02Å; L183-F298 HydrophobicContact CD2-CE1 4.38Å; L183-F298 HydrophobicContact CD2-CE2 4.2Å; L183-F298 HydrophobicContact CD2-CG 4.07Å; L183-F298 HydrophobicContact CD2-CZ 4.38Å; L183-F298 HydrophobicContact CG-CE1 4.4Å; F184-F298 CarbonylContact O-C 3.57Å; F184-F298 WeakPolarHBondContact O-CA 2.99Å; I185-F298 HydrophobicContact CG2-CD1 3.61Å; I185-F298 HydrophobicContact CG2-CE1 3.82Å; V198-F298 HydrophobicContact CB-CE1 4.34Å; V198-F298 HydrophobicContact CG2-CE1 4.18Å; I281-F298 HydrophobicContact CG2-CE2 4.12Å; I281-F298 HydrophobicContact CG2-CZ 3.9Å; L283-F298 HydrophobicContact CD2-CE2 4.34Å; N286-F298 VanDerWaalsContact C-CD2 3.44Å; N286-F298 PolarHBondContact O-N 3.33Å; V287-F298 VanDerWaalsContact C-CE2 3.42Å; V287-F298 WeakPolarHBondContact O-CE2 3.47Å; L288-F298 HydrophobicContact CB-CE1 3.94Å; L288-F298 HydrophobicContact CB-CZ 3.85Å; L288-F298 HydrophobicContact CD1-CZ 4.35Å
299	L	94.2	Very high	84.7	Confident	12 Å²	12	61.6 Å²	61.6	6%	0.063	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-68.7	141.8	-177.9	-57.8	-172.9	0	0	0	111.1	F184 N186 K195 E303 I304	F184-L299 HydrophobicContact CB-CB 4.13Å; F184-L299 HydrophobicContact CB-CD1 3.79Å; F184-L299 HydrophobicContact CB-CG 3.95Å; F184-L299 WeakPolarHBondContact O-CG 3.41Å; F184-L299 PolarHBondContact O-N 3.13Å; N186-L299 HydrophobicContact CB-CD2 4.41Å; N186-L299 VanDerWaalsContact ND2-CD2 3.28Å; N186-L299 WeakPolarHBondContact ND2-CD2 3.45Å; K195-L299 HydrophobicContact CB-CD1 4.18Å; K195-L299 HydrophobicContact CD-CD1 3.8Å; K195-L299 HydrophobicContact CG-CD1 3.82Å; L299-E303 HydrophobicContact CB-CB 4.21Å; L299-E303 HydrophobicContact CD1-CB 4.42Å; L299-I304 HydrophobicContact CB-CG1 4.44Å
300	P	91.9	Very high	82.5	Confident	66 Å²	66	64 Å²	64	43%	0.429	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-68	157.7	169.2	31.2	-35.2	0	0	0	110.4	S302 E303 I304	P300-S302 PolarHBondContact O-N 3.24Å; P300-S302 VanDerWaalsContact O-N 3.09Å; P300-E303 HydrophobicContact CG-CB 4.23Å; P300-E303 HydrophobicContact CG-CG 3.99Å; P300-E303 PolarHBondContact O-N 2.7Å; P300-I304 PolarHBondContact O-N 3.48Å
301	E	86.8	Confident	80.2	Confident	121 Å²	121	67.1 Å²	67.1	57%	0.565	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-49	-40.8	179.9	-164.9	-179.7	163.9	0	0	113.3	S181 E303 I304	S181-E301 VanDerWaalsContact OG-CB 3.29Å; S181-E301 WeakPolarHBondContact OG-CB 3.36Å; S181-E301 WeakPolarHBondContact OG-CG 3.22Å; E301-E303 PolarHBondContact O-N 2.87Å; E301-E303 VanDerWaalsContact O-N 3.09Å; E301-I304 PolarHBondContact O-N 2.82Å
302	S	87.8	Confident	77.9	Confident	113 Å²	113	66.8 Å²	66.8	79%	0.79	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-60.8	-20.1	179.4	57.8	0	0	0	0	114.6	P300	P300-S302 PolarHBondContact O-N 3.24Å; P300-S302 VanDerWaalsContact O-N 3.09Å
303	E	87.4	Confident	75.8	Confident	82 Å²	82	66.5 Å²	66.5	38%	0.383	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-102.9	-7.7	178.9	-70.1	-174.4	-146.8	0	0	113	K195 L299 P300 E301	K195-E303 WeakPolarHBondContact CD-O 3.11Å; K195-E303 WeakPolarHBondContact CE-O 3.34Å; K195-E303 PolarHBondContact NZ-O 2.72Å; L299-E303 HydrophobicContact CB-CB 4.21Å; L299-E303 HydrophobicContact CD1-CB 4.42Å; P300-E303 HydrophobicContact CG-CB 4.23Å; P300-E303 HydrophobicContact CG-CG 3.99Å; P300-E303 PolarHBondContact O-N 2.7Å; E301-E303 PolarHBondContact O-N 2.87Å; E301-E303 VanDerWaalsContact O-N 3.09Å
304	I	83.6	Confident	73.7	Confident	8 Å²	8	59.1 Å²	59.1	4%	0.041	34%	0.342	C	S	.	.	S	Bend	trans	-76.1	135.6	177.7	-61	175	0	0	0	108.6	M182 F184 L299 P300 E301 L306 L308	M182-I304 VanDerWaalsContact O-CD1 3.23Å; M182-I304 WeakPolarHBondContact O-CD1 3.36Å; F184-I304 HydrophobicContact CD2-CB 4.42Å; F184-I304 HydrophobicContact CD2-CD1 4.06Å; F184-I304 HydrophobicContact CD2-CG1 3.94Å; F184-I304 HydrophobicContact CD2-CG2 3.72Å; F184-I304 HydrophobicContact CE2-CG2 3.58Å; F184-I304 HydrophobicContact CG-CG1 4.45Å; F184-I304 HydrophobicContact CZ-CG2 4.26Å; L299-I304 HydrophobicContact CB-CG1 4.44Å; P300-I304 PolarHBondContact O-N 3.48Å; E301-I304 PolarHBondContact O-N 2.82Å; I304-L306 PolarHBondContact O-N 3.21Å; I304-L308 HydrophobicContact CG2-CB 4.5Å
305	P	73	Confident	71.3	Confident	44 Å²	44	63 Å²	63	29%	0.286	36%	0.363	S	S	.	.			trans	-54.3	126.2	174.1	-24.3	34.4	0	0	0	110.8	K195 S307 L308 S309	K195-P305 HydrophobicContact CD-CG 4.39Å; P305-S307 PolarHBondContact O-N 2.73Å; P305-S307 VanDerWaalsContact O-N 3.09Å; P305-L308 HydrophobicContact CB-CD1 4.01Å; P305-L308 HydrophobicContact CB-CG 4.38Å; P305-L308 HydrophobicContact CG-CD1 4.04Å; P305-L308 WeakPolarHBondContact O-CA 3.44Å; P305-L308 WeakPolarHBondContact O-CB 3.33Å; P305-L308 PolarHBondContact O-N 3.15Å; P305-S309 PolarHBondContact O-N 3.05Å
306	L	65.3	Low	68.8	Low	155 Å²	155	62.1 Å²	62.1	81%	0.812	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-25.7	-177.2	-70.3	166.7	0	0	0	113.3	I304 L308 S309	I304-L306 PolarHBondContact O-N 3.21Å; L306-L308 PolarHBondContact O-N 2.67Å; L306-S309 PolarHBondContact O-OG 3.05Å
307	S	60.9	Low	66.3	Low	66 Å²	66	66.6 Å²	66.6	46%	0.462	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	1.8	172.6	62.1	0	0	0	0	113.6	P305 I313	P305-S307 PolarHBondContact O-N 2.73Å; P305-S307 VanDerWaalsContact O-N 3.09Å; S307-I313 WeakPolarHBondContact O-CD1 3.36Å; S307-I313 VanDerWaalsContact O-CG2 3.27Å; S307-I313 WeakPolarHBondContact O-CG2 3.47Å
308	L	60	Low	63.9	Low	11 Å²	11	66.5 Å²	66.5	6%	0.058	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132	-5.4	-179.9	-61.1	169.2	0	0	0	111.9	F184 M265 I304 P305 L306 N310	F184-L308 HydrophobicContact CE1-CD1 3.9Å; F184-L308 HydrophobicContact CE2-CB 4.46Å; F184-L308 HydrophobicContact CZ-CB 3.98Å; F184-L308 HydrophobicContact CZ-CD1 3.64Å; F184-L308 HydrophobicContact CZ-CG 4.39Å; M265-L308 HydrophobicContact CG-CD1 3.68Å; M265-L308 HydrophobicContact CG-CD2 3.33Å; M265-L308 HydrophobicContact CG-CG 4.15Å; M265-L308 HydrophobicContact SD-CD1 4.29Å; M265-L308 HydrophobicContact SD-CD2 3.83Å; I304-L308 HydrophobicContact CG2-CB 4.5Å; P305-L308 HydrophobicContact CB-CD1 4.01Å; P305-L308 HydrophobicContact CB-CG 4.38Å; P305-L308 HydrophobicContact CG-CD1 4.04Å; P305-L308 WeakPolarHBondContact O-CA 3.44Å; P305-L308 WeakPolarHBondContact O-CB 3.33Å; P305-L308 PolarHBondContact O-N 3.15Å; L306-L308 PolarHBondContact O-N 2.67Å; L308-N310 VanDerWaalsContact C-N 3.28Å
309	S	52.4	Low	61.6	Low	32 Å²	32	71.5 Å²	71.5	22%	0.224	41%	0.407	C	S	.	.	S	Bend	trans	-74.9	-19.6	176.5	58.5	0	0	0	0	112.5	P305 L306	P305-S309 PolarHBondContact O-N 3.05Å; L306-S309 PolarHBondContact O-OG 3.05Å
310	N	49.6	Very low	59.5	Low	66 Å²	66	72.9 Å²	72.9	35%	0.353	41%	0.414	S	S	.	.	S	Bend	trans	-93.1	119.6	172.3	-91.4	-15.8	0	0	0	110.5	Q179 L308 S312 I313	Q179-N310 PolarHBondContact NE2-OD1 3.45Å; L308-N310 VanDerWaalsContact C-N 3.28Å; N310-S312 PolarHBondContact O-N 2.8Å; N310-S312 VanDerWaalsContact O-N 3.1Å; N310-I313 HydrophobicContact CB-CD1 4.03Å; N310-I313 HydrophobicContact CB-CG1 4.23Å; N310-I313 PolarHBondContact O-N 3.06Å
311	P	47.2	Very low	57.7	Low	69 Å²	69	79 Å²	79	45%	0.448	44%	0.437	S	S	.	.	G	3₁₀ helix	trans	-60.2	-22	177.5	21.3	-30.2	0	0	0	112.8	I313 L314	P311-I313 PolarHBondContact O-N 2.82Å; P311-L314 PolarHBondContact O-N 2.98Å; P311-L314 VanDerWaalsContact O-N 3.09Å
312	S	42.7	Very low	56.7	Low	69 Å²	69	82 Å²	82	48%	0.483	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-64.2	-5.4	173.6	63.6	0	0	0	0	114.6	N310	N310-S312 PolarHBondContact O-N 2.8Å; N310-S312 VanDerWaalsContact O-N 3.1Å
313	I	43.5	Very low	56	Low	60 Å²	60	77.8 Å²	77.8	31%	0.308	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-95.1	-17.7	176.5	-56.2	171.5	0	0	0	111.3	S307 N310 P311	S307-I313 WeakPolarHBondContact O-CD1 3.36Å; S307-I313 VanDerWaalsContact O-CG2 3.27Å; S307-I313 WeakPolarHBondContact O-CG2 3.47Å; N310-I313 HydrophobicContact CB-CD1 4.03Å; N310-I313 HydrophobicContact CB-CG1 4.23Å; N310-I313 PolarHBondContact O-N 3.06Å; P311-I313 PolarHBondContact O-N 2.82Å
314	L	45.6	Very low	55.7	Low	51 Å²	51	77.6 Å²	77.6	27%	0.267	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-29.8	171	-64.2	177.4	0	0	0	111.4	M182 F197 M265 P311 N316	M182-L314 HydrophobicContact CE-CD1 3.88Å; F197-L314 HydrophobicContact CE1-CD1 4.45Å; F197-L314 HydrophobicContact CE1-CD2 4.4Å; F197-L314 HydrophobicContact CZ-CD1 4.09Å; M265-L314 HydrophobicContact CE-CD2 3.85Å; M265-L314 HydrophobicContact SD-CD2 4.24Å; P311-L314 PolarHBondContact O-N 2.98Å; P311-L314 VanDerWaalsContact O-N 3.09Å; L314-N316 PolarHBondContact O-N 3.05Å; L314-N316 VanDerWaalsContact O-N 3.15Å
315	D	41.6	Very low	55.3	Low	100 Å²	100	83.2 Å²	83.2	54%	0.535	44%	0.438	S	S	.	.	S	Bend	trans	-76.2	93.7	160.7	-64	-29	0	0	0	107.4	E317	D315-E317 HydrophobicContact CB-CG 4.45Å; D315-E317 PolarHBondContact O-N 2.76Å
316	N	43.6	Very low	55.8	Low	74 Å²	74	85 Å²	85	40%	0.396	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	40.4	167.6	-76.3	-56.7	0	0	0	111.6	L314	L314-N316 PolarHBondContact O-N 3.05Å; L314-N316 VanDerWaalsContact O-N 3.15Å
317	E	42.7	Very low	56.7	Low	100 Å²	100	79.4 Å²	79.4	47%	0.467	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-26.1	177	-66	-144.5	150.2	0	0	111.6	D315 R341	D315-E317 HydrophobicContact CB-CG 4.45Å; D315-E317 PolarHBondContact O-N 2.76Å; E317-R341 PolarHBondContact O-NE 2.86Å; E317-R341 PolarHBondContact O-NH1 3.08Å; E317-R341 PolarHBondContact O-NH2 2.82Å; E317-R341 IonicContact OE2-NH1 3.86Å
318	D	46.1	Very low	57.6	Low	89 Å²	89	78.9 Å²	78.9	48%	0.476	41%	0.408	S	S	.	.	S	Bend	trans	-113.6	12.1	-168.8	-78.1	-21.4	0	0	0	118.6	R341	D318-R341 IonicContact OD1-CZ 3.53Å; D318-R341 IonicContact OD1-NH1 2.73Å; D318-R341 PolarHBondContact OD1-NH1 2.85Å; D318-R341 IonicContact OD1-NH2 2.73Å; D318-R341 PolarHBondContact OD1-NH2 2.95Å
319	T	47	Very low	58.8	Low	113 Å²	113	83.9 Å²	83.9	69%	0.693	43%	0.434	S	S	*	.			trans	-107	33.1	172.5	60.6	0	0	0	0	114.1	E321	T319-E321 VanDerWaalsContact C-N 3.34Å; T319-E321 PolarHBondContact O-N 2.95Å
320	D	50.4	Low	60.4	Low	42 Å²	42	85.2 Å²	85.2	23%	0.225	44%	0.436	C	S	.	.			trans	-78	88.4	165.5	-116.2	-17.8	0	0	0	109.3	R322 F323	D320-R322 PolarHBondContact O-N 3.21Å; D320-R322 IonicContact OD1-CZ 3.74Å; D320-R322 IonicContact OD1-NE 2.81Å; D320-R322 PolarHBondContact OD1-NE 3.18Å; D320-R322 IonicContact OD1-NH2 2.67Å; D320-R322 PolarHBondContact OD1-NH2 2.92Å; D320-R322 IonicContact OD2-CZ 3.85Å; D320-R322 IonicContact OD2-NE 2.96Å; D320-R322 IonicContact OD2-NH2 3.33Å; D320-R322 PolarHBondContact OD2-NH2 3.12Å; D320-F323 HydrophobicContact CB-CD2 3.81Å; D320-F323 HydrophobicContact CB-CE2 4.08Å; D320-F323 PolarHBondContact O-N 2.93Å; D320-F323 WeakPolarHBondContact OD2-CE2 3.46Å
321	E	55.2	Low	62.1	Low	193 Å²	193	82.1 Å²	82.1	90%	0.902	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-7.3	168.4	-69.1	-166.1	164.2	0	0	112.8	T319 F323	T319-E321 VanDerWaalsContact C-N 3.34Å; T319-E321 PolarHBondContact O-N 2.95Å; E321-F323 VanDerWaalsContact C-N 3.27Å; E321-F323 PolarHBondContact O-N 2.81Å
322	R	65.7	Low	63.7	Low	186 Å²	186	82.2 Å²	82.2	70%	0.702	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-21.8	175.4	-67	-173.8	-74	170.1	0.5	113.5	D320	D320-R322 PolarHBondContact O-N 3.21Å; D320-R322 IonicContact OD1-CZ 3.74Å; D320-R322 IonicContact OD1-NE 2.81Å; D320-R322 PolarHBondContact OD1-NE 3.18Å; D320-R322 IonicContact OD1-NH2 2.67Å; D320-R322 PolarHBondContact OD1-NH2 2.92Å; D320-R322 IonicContact OD2-CZ 3.85Å; D320-R322 IonicContact OD2-NE 2.96Å; D320-R322 IonicContact OD2-NH2 3.33Å; D320-R322 PolarHBondContact OD2-NH2 3.12Å
323	F	72.5	Confident	65.7	Low	23 Å²	23	81.3 Å²	81.3	10%	0.101	41%	0.405	C	S	.	.	S	Bend	trans	-116.1	134.8	-175.4	-55.7	-57.1	0	0	0	112.2	D320 E321 Q327 K328 I331 I345 H349 W353	D320-F323 HydrophobicContact CB-CD2 3.81Å; D320-F323 HydrophobicContact CB-CE2 4.08Å; D320-F323 PolarHBondContact O-N 2.93Å; D320-F323 WeakPolarHBondContact OD2-CE2 3.46Å; E321-F323 VanDerWaalsContact C-N 3.27Å; E321-F323 PolarHBondContact O-N 2.81Å; F323-Q327 VanDerWaalsContact CA-OE1 3.23Å; F323-Q327 HydrophobicContact CB-CB 3.9Å; F323-K328 HydrophobicContact CB-CG 4.19Å; F323-K328 WeakPolarHBondContact O-CE 3.38Å; F323-I331 HydrophobicContact CD2-CD1 3.91Å; F323-I331 HydrophobicContact CE2-CD1 4.2Å; F323-I331 HydrophobicContact CG-CD1 4.16Å; F323-I345 HydrophobicContact CE2-CD1 4.03Å; F323-I345 HydrophobicContact CE2-CG1 4.43Å; F323-I345 HydrophobicContact CZ-CD1 4.31Å; F323-I345 HydrophobicContact CZ-CG1 4.42Å; F323-I345 HydrophobicContact CZ-CG2 3.95Å; F323-H349 AromaticContact CE1-NE2 3.86Å; F323-W353 AromaticContact CD1-CH2 3.31Å; F323-W353 HydrophobicContact CD1-CH2 3.31Å; F323-W353 AromaticContact CD1-CZ2 3.49Å; F323-W353 HydrophobicContact CD1-CZ2 3.49Å; F323-W353 VanDerWaalsContact CD1-CZ2 3.49Å; F323-W353 AromaticContact CE1-CH2 3.52Å; F323-W353 HydrophobicContact CE1-CH2 3.52Å; F323-W353 AromaticContact CE1-CZ2 3.5Å; F323-W353 HydrophobicContact CE1-CZ2 3.5Å; F323-W353 VanDerWaalsContact CE1-CZ2 3.5Å; F323-W353 HydrophobicContact CG-CH2 4.03Å; F323-W353 HydrophobicContact CZ-CH2 4.38Å
324	D	81.2	Confident	67.5	Low	79 Å²	79	78.5 Å²	78.5	42%	0.422	39%	0.39	S	S	.	.			trans	-70.2	165.2	172.8	70.8	49.8	0	0	0	111.6	T326 Q327 K328	D324-T326 PolarHBondContact O-N 3.5Å; D324-T326 VanDerWaalsContact OD1-CA 3.3Å; D324-T326 WeakPolarHBondContact OD1-CA 3.48Å; D324-T326 VanDerWaalsContact OD1-CB 3.31Å; D324-T326 WeakPolarHBondContact OD1-CB 3.44Å; D324-T326 PolarHBondContact OD1-N 3.05Å; D324-T326 PolarHBondContact OD1-OG1 2.86Å; D324-Q327 WeakPolarHBondContact O-CB 3.3Å; D324-Q327 PolarHBondContact O-N 3.1Å; D324-Q327 WeakPolarHBondContact OD1-CG 3.38Å; D324-Q327 PolarHBondContact OD1-N 3.06Å; D324-K328 WeakPolarHBondContact O-CG 3.38Å; D324-K328 PolarHBondContact O-N 3.14Å
325	E	75.8	Confident	69.2	Low	125 Å²	125	77.8 Å²	77.8	58%	0.584	39%	0.388	S	S	*	.	H	α-helix	trans	-57.5	-33.2	-179.4	-73.7	-59.3	128.7	0	0	113	K328 L329	E325-K328 PolarHBondContact O-N 3.48Å; E325-K328 IonicContact OE1-NZ 2.7Å; E325-K328 PolarHBondContact OE1-NZ 3.17Å; E325-L329 WeakPolarHBondContact O-CD1 3.28Å; E325-L329 PolarHBondContact O-N 3.47Å
326	T	83.1	Confident	71.1	Confident	83 Å²	83	78.7 Å²	78.7	51%	0.509	39%	0.393	S	S	.	.	H	α-helix	trans	-71.2	-35.5	178.1	75.6	0	0	0	0	111.9	D324 K330	D324-T326 PolarHBondContact O-N 3.5Å; D324-T326 VanDerWaalsContact OD1-CA 3.3Å; D324-T326 WeakPolarHBondContact OD1-CA 3.48Å; D324-T326 VanDerWaalsContact OD1-CB 3.31Å; D324-T326 WeakPolarHBondContact OD1-CB 3.44Å; D324-T326 PolarHBondContact OD1-N 3.05Å; D324-T326 PolarHBondContact OD1-OG1 2.86Å; T326-K330 WeakPolarHBondContact O-CG 3.5Å; T326-K330 PolarHBondContact O-N 3.24Å; T326-K330 VanDerWaalsContact O-N 3.13Å
327	Q	84.8	Confident	72.7	Confident	36 Å²	36	82.9 Å²	82.9	17%	0.168	40%	0.403	C	S	.	.	H	α-helix	trans	-68.8	-43.1	175.9	-73.8	-179.9	-20.4	0	0	110.9	F323 D324 L329 K330 I331 W353	F323-Q327 VanDerWaalsContact CA-OE1 3.23Å; F323-Q327 HydrophobicContact CB-CB 3.9Å; D324-Q327 WeakPolarHBondContact O-CB 3.3Å; D324-Q327 PolarHBondContact O-N 3.1Å; D324-Q327 WeakPolarHBondContact OD1-CG 3.38Å; D324-Q327 PolarHBondContact OD1-N 3.06Å; Q327-L329 PolarHBondContact O-N 3.01Å; Q327-K330 PolarHBondContact O-N 2.62Å; Q327-K330 VanDerWaalsContact O-N 3.16Å; Q327-I331 WeakPolarHBondContact O-CG1 3.48Å; Q327-I331 PolarHBondContact O-N 3.47Å; Q327-W353 HydrophobicContact CB-CD2 4.37Å; Q327-W353 HydrophobicContact CB-CE3 3.7Å; Q327-W353 HydrophobicContact CB-CH2 3.63Å; Q327-W353 HydrophobicContact CB-CZ2 4.32Å; Q327-W353 HydrophobicContact CB-CZ3 3.28Å; Q327-W353 HydrophobicContact CG-CD2 3.69Å; Q327-W353 HydrophobicContact CG-CE3 3.48Å; Q327-W353 VanDerWaalsContact CG-CE3 3.48Å; Q327-W353 HydrophobicContact CG-CG 4.4Å; Q327-W353 HydrophobicContact CG-CH2 3.86Å; Q327-W353 HydrophobicContact CG-CZ2 4.07Å; Q327-W353 HydrophobicContact CG-CZ3 3.56Å
328	K	79.7	Confident	74.3	Confident	56 Å²	56	81.5 Å²	81.5	24%	0.243	42%	0.416	C	S	.	.	H	α-helix	trans	-59.3	-46.6	174.1	-67.2	178.9	-169.3	172.5	0	111.8	F323 D324 E325 K330 I331 Q332	F323-K328 HydrophobicContact CB-CG 4.19Å; F323-K328 WeakPolarHBondContact O-CE 3.38Å; D324-K328 WeakPolarHBondContact O-CG 3.38Å; D324-K328 PolarHBondContact O-N 3.14Å; E325-K328 PolarHBondContact O-N 3.48Å; E325-K328 IonicContact OE1-NZ 2.7Å; E325-K328 PolarHBondContact OE1-NZ 3.17Å; K328-K330 VanDerWaalsContact C-N 3.29Å; K328-K330 PolarHBondContact O-N 3.25Å; K328-I331 PolarHBondContact O-N 3.28Å; K328-Q332 WeakPolarHBondContact O-CB 3.34Å; K328-Q332 PolarHBondContact O-N 3.37Å
329	L	83.6	Confident	75.9	Confident	115 Å²	115	77.5 Å²	77.5	60%	0.602	40%	0.395	S	S	*	.	H	α-helix	trans	-55.2	-43.6	173.9	-90.5	149.8	0	0	0	111.9	E325 Q327 Q332 V333	E325-L329 WeakPolarHBondContact O-CD1 3.28Å; E325-L329 PolarHBondContact O-N 3.47Å; Q327-L329 PolarHBondContact O-N 3.01Å; L329-Q332 PolarHBondContact O-N 3.13Å; L329-V333 VanDerWaalsContact O-CG2 3.26Å; L329-V333 WeakPolarHBondContact O-CG2 3.49Å; L329-V333 PolarHBondContact O-N 3.18Å
330	K	87.1	Confident	77.4	Confident	61 Å²	61	74.8 Å²	74.8	27%	0.265	38%	0.384	S	S	.	.	H	α-helix	trans	-66.6	-40.5	178	-71	171.4	-177.9	179	0	112.9	T326 Q327 K328 V333 L334 L348 W353 L355	T326-K330 WeakPolarHBondContact O-CG 3.5Å; T326-K330 PolarHBondContact O-N 3.24Å; T326-K330 VanDerWaalsContact O-N 3.13Å; Q327-K330 PolarHBondContact O-N 2.62Å; Q327-K330 VanDerWaalsContact O-N 3.16Å; K328-K330 VanDerWaalsContact C-N 3.29Å; K328-K330 PolarHBondContact O-N 3.25Å; K330-V333 PolarHBondContact O-N 3.28Å; K330-L334 PolarHBondContact O-N 3.31Å; K330-L348 HydrophobicContact CB-CD1 3.96Å; K330-L348 HydrophobicContact CB-CD2 4.1Å; K330-W353 HydrophobicContact CD-CB 4.44Å; K330-W353 HydrophobicContact CD-CE3 4.42Å; K330-W353 VanDerWaalsContact CD-O 3.32Å; K330-W353 WeakPolarHBondContact CD-O 3.5Å; K330-W353 WeakPolarHBondContact CE-O 3.43Å; K330-W353 PolarHBondContact NZ-O 2.93Å; K330-L355 HydrophobicContact CB-CD1 4.38Å; K330-L355 HydrophobicContact CG-CB 4.39Å
331	I	84.7	Confident	78.7	Confident	1 Å²	1	74.5 Å²	74.5	1%	0.005	38%	0.38	C	S	.	.	H	α-helix	trans	-61.5	-48.5	174.8	-66.7	161.2	0	0	0	109.3	F323 Q327 K328 V333 L334 V335 R341 A344 I345 L348 W353	F323-I331 HydrophobicContact CD2-CD1 3.91Å; F323-I331 HydrophobicContact CE2-CD1 4.2Å; F323-I331 HydrophobicContact CG-CD1 4.16Å; Q327-I331 WeakPolarHBondContact O-CG1 3.48Å; Q327-I331 PolarHBondContact O-N 3.47Å; K328-I331 PolarHBondContact O-N 3.28Å; I331-V333 VanDerWaalsContact C-N 3.32Å; I331-V333 PolarHBondContact O-N 3.27Å; I331-L334 PolarHBondContact O-N 2.97Å; I331-V335 HydrophobicContact CG2-CG2 4.14Å; I331-V335 WeakPolarHBondContact O-CG2 3.46Å; I331-V335 PolarHBondContact O-N 2.98Å; I331-R341 HydrophobicContact CG2-CG 3.89Å; I331-A344 HydrophobicContact CG2-CB 4.43Å; I331-I345 HydrophobicContact CD1-CD1 4.4Å; I331-I345 HydrophobicContact CD1-CG1 3.79Å; I331-I345 HydrophobicContact CG1-CG1 4Å; I331-I345 HydrophobicContact CG2-CG1 4.34Å; I331-L348 HydrophobicContact CB-CD1 4.36Å; I331-L348 HydrophobicContact CG1-CD1 3.66Å; I331-W353 HydrophobicContact CD1-CH2 3.91Å; I331-W353 HydrophobicContact CD1-CZ3 3.95Å; I331-W353 HydrophobicContact CG1-CH2 4.3Å; I331-W353 HydrophobicContact CG1-CZ3 3.92Å
332	Q	81.4	Confident	79.8	Confident	71 Å²	71	69.3 Å²	69.3	33%	0.332	36%	0.364	S	S	.	.	H	α-helix	trans	-59	-42.7	-178.9	-167.5	61.3	38	0	0	111.9	K328 L329 L334 V335 D336	K328-Q332 WeakPolarHBondContact O-CB 3.34Å; K328-Q332 PolarHBondContact O-N 3.37Å; L329-Q332 PolarHBondContact O-N 3.13Å; Q332-L334 VanDerWaalsContact C-N 3.25Å; Q332-L334 PolarHBondContact O-N 2.9Å; Q332-V335 PolarHBondContact O-N 3.26Å; Q332-V335 VanDerWaalsContact O-N 3.1Å; Q332-D336 PolarHBondContact NE2-OD1 3.17Å; Q332-D336 WeakPolarHBondContact O-CB 2.98Å; Q332-D336 PolarHBondContact O-N 2.96Å
333	V	84.2	Confident	80.5	Confident	50 Å²	50	64.2 Å²	64.2	30%	0.303	35%	0.348	S	S	.	.	H	α-helix	trans	-60	-34.5	177.1	172.6	0	0	0	0	112.7	L329 K330 I331 R337 L355	L329-V333 VanDerWaalsContact O-CG2 3.26Å; L329-V333 WeakPolarHBondContact O-CG2 3.49Å; L329-V333 PolarHBondContact O-N 3.18Å; K330-V333 PolarHBondContact O-N 3.28Å; I331-V333 VanDerWaalsContact C-N 3.32Å; I331-V333 PolarHBondContact O-N 3.27Å; V333-R337 WeakPolarHBondContact O-CG 3.46Å; V333-L355 HydrophobicContact CB-CD1 4.23Å; V333-L355 HydrophobicContact CB-CD2 4.44Å; V333-L355 HydrophobicContact CG1-CD1 4.06Å; V333-L355 HydrophobicContact CG1-CD2 4.04Å
334	L	81.3	Confident	81	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-75.3	-39.3	175.2	-67.8	-177.2	0	0	0	111.7	K330 I331 Q332 R337 I339 A344 L348 L355 A358 L359	K330-L334 PolarHBondContact O-N 3.31Å; I331-L334 PolarHBondContact O-N 2.97Å; Q332-L334 VanDerWaalsContact C-N 3.25Å; Q332-L334 PolarHBondContact O-N 2.9Å; L334-R337 PolarHBondContact O-N 3.33Å; L334-R337 VanDerWaalsContact O-N 3.17Å; L334-I339 HydrophobicContact CB-CB 4.44Å; L334-I339 HydrophobicContact CB-CD1 4.11Å; L334-I339 HydrophobicContact CD2-CD1 3.93Å; L334-I339 HydrophobicContact CG-CD1 4.47Å; L334-I339 WeakPolarHBondContact O-CB 3.46Å; L334-I339 WeakPolarHBondContact O-CG1 3.28Å; L334-I339 PolarHBondContact O-N 2.92Å; L334-A344 HydrophobicContact CB-CB 3.65Å; L334-A344 HydrophobicContact CD1-CB 3.89Å; L334-A344 HydrophobicContact CG-CB 4.43Å; L334-L348 HydrophobicContact CD1-CD1 3.74Å; L334-L348 HydrophobicContact CD1-CD2 4.02Å; L334-L348 HydrophobicContact CD1-CG 3.56Å; L334-L355 HydrophobicContact CD2-CD1 4.08Å; L334-L355 HydrophobicContact CG-CD1 4.13Å; L334-A358 HydrophobicContact CD1-CB 4.36Å; L334-L359 HydrophobicContact CD2-CD2 3.44Å; L334-L359 VanDerWaalsContact CD2-CD2 3.44Å; L334-L359 HydrophobicContact CD2-CG 3.84Å
335	V	82.5	Confident	81.2	Confident	37 Å²	37	60.8 Å²	60.8	22%	0.224	33%	0.331	C	S	.	.	H	α-helix	trans	-63.9	-43.7	177.2	173.6	0	0	0	0	111.3	I331 Q332 R337 G338 I339 R341 A344	I331-V335 HydrophobicContact CG2-CG2 4.14Å; I331-V335 WeakPolarHBondContact O-CG2 3.46Å; I331-V335 PolarHBondContact O-N 2.98Å; Q332-V335 PolarHBondContact O-N 3.26Å; Q332-V335 VanDerWaalsContact O-N 3.1Å; V335-R337 PolarHBondContact O-N 2.99Å; V335-R337 VanDerWaalsContact O-N 3.11Å; V335-G338 PolarHBondContact O-N 2.91Å; V335-I339 WeakPolarHBondContact CA-O 3.22Å; V335-R341 HydrophobicContact CG2-CB 4Å; V335-R341 HydrophobicContact CG2-CG 4.24Å; V335-A344 HydrophobicContact CG2-CB 4.38Å
336	D	80.2	Confident	81.6	Confident	118 Å²	118	59.5 Å²	59.5	63%	0.631	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-20.8	176.2	-67.3	-14.2	0	0	0	112.4	Q332	Q332-D336 PolarHBondContact NE2-OD1 3.17Å; Q332-D336 WeakPolarHBondContact O-CB 2.98Å; Q332-D336 PolarHBondContact O-N 2.96Å
337	R	77.3	Confident	81.7	Confident	162 Å²	162	55.8 Å²	55.8	61%	0.611	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	7.9	174.1	-70.2	-177.8	179.6	-140.2	2.8	113.9	V333 L334 V335	V333-R337 WeakPolarHBondContact O-CG 3.46Å; L334-R337 PolarHBondContact O-N 3.33Å; L334-R337 VanDerWaalsContact O-N 3.17Å; V335-R337 PolarHBondContact O-N 2.99Å; V335-R337 VanDerWaalsContact O-N 3.11Å
338	G	77.2	Confident	81.9	Confident	72 Å²	72	54 Å²	54	74%	0.742	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.7	11.8	174.7	0	0	0	0	0	115.2	V335	V335-G338 PolarHBondContact O-N 2.91Å
339	I	78.6	Confident	82.3	Confident	5 Å²	5	56.3 Å²	56.3	3%	0.026	31%	0.309	C	S	.	.			trans	-85.8	130	176.1	-52.4	179.7	0	0	0	108.8	L334 V335 R341 E343 A344 H362	L334-I339 HydrophobicContact CB-CB 4.44Å; L334-I339 HydrophobicContact CB-CD1 4.11Å; L334-I339 HydrophobicContact CD2-CD1 3.93Å; L334-I339 HydrophobicContact CG-CD1 4.47Å; L334-I339 WeakPolarHBondContact O-CB 3.46Å; L334-I339 WeakPolarHBondContact O-CG1 3.28Å; L334-I339 PolarHBondContact O-N 2.92Å; V335-I339 WeakPolarHBondContact CA-O 3.22Å; I339-R341 PolarHBondContact O-N 3.02Å; I339-E343 HydrophobicContact CG2-CB 3.87Å; I339-E343 HydrophobicContact CG2-CG 3.87Å; I339-A344 HydrophobicContact CG2-CB 4.16Å; I339-H362 HydrophobicContact CD1-CB 4.11Å; I339-H362 VanDerWaalsContact CD1-CD2 3.43Å; I339-H362 WeakPolarHBondContact CD1-CD2 3.3Å; I339-H362 VanDerWaalsContact CD1-CG 3.46Å
340	A	78.5	Confident	82.4	Confident	56 Å²	56	58.2 Å²	58.2	46%	0.463	31%	0.308	S	S	.	.			trans	-57.8	138.3	176	0	0	0	0	0	110.6	S342 E343 A344	A340-S342 VanDerWaalsContact C-N 3.26Å; A340-S342 PolarHBondContact O-N 3.09Å; A340-S342 VanDerWaalsContact O-N 3.13Å; A340-E343 HydrophobicContact CB-CB 4.42Å; A340-E343 CarbonylContact O-C 3.53Å; A340-E343 WeakPolarHBondContact O-CA 3.23Å; A340-E343 WeakPolarHBondContact O-CB 3.31Å; A340-E343 PolarHBondContact O-N 2.94Å; A340-A344 PolarHBondContact O-N 2.94Å
341	R	78.1	Confident	82.4	Confident	36 Å²	36	57.9 Å²	57.9	14%	0.136	31%	0.307	C	S	.	.	H	α-helix	trans	-52.4	-40.5	-174.6	-169.6	178.1	-174.7	116	1.6	113.4	E317 D318 I331 V335 I339 A344 I345	E317-R341 PolarHBondContact O-NE 2.86Å; E317-R341 PolarHBondContact O-NH1 3.08Å; E317-R341 PolarHBondContact O-NH2 2.82Å; E317-R341 IonicContact OE2-NH1 3.86Å; D318-R341 IonicContact OD1-CZ 3.53Å; D318-R341 IonicContact OD1-NH1 2.73Å; D318-R341 PolarHBondContact OD1-NH1 2.85Å; D318-R341 IonicContact OD1-NH2 2.73Å; D318-R341 PolarHBondContact OD1-NH2 2.95Å; I331-R341 HydrophobicContact CG2-CG 3.89Å; V335-R341 HydrophobicContact CG2-CB 4Å; V335-R341 HydrophobicContact CG2-CG 4.24Å; I339-R341 PolarHBondContact O-N 3.02Å; R341-A344 PolarHBondContact O-N 3.08Å; R341-I345 HydrophobicContact CG-CD1 4.19Å; R341-I345 VanDerWaalsContact O-CG1 3.26Å; R341-I345 WeakPolarHBondContact O-CG1 3.4Å; R341-I345 PolarHBondContact O-N 2.77Å
342	S	79.2	Confident	82.5	Confident	83 Å²	83	66.4 Å²	66.4	58%	0.58	35%	0.347	S	S	*	.	H	α-helix	trans	-61.9	-44.3	175.3	52.2	0	0	0	0	112.6	A340 I345 D346	A340-S342 VanDerWaalsContact C-N 3.26Å; A340-S342 PolarHBondContact O-N 3.09Å; A340-S342 VanDerWaalsContact O-N 3.13Å; S342-I345 PolarHBondContact O-N 3.3Å; S342-D346 PolarHBondContact O-N 3.34Å
343	E	80.2	Confident	82.7	Confident	79 Å²	79	64.5 Å²	64.5	37%	0.369	34%	0.337	S	S	.	.	H	α-helix	trans	-67.6	-40.2	176.3	-174.1	-177.9	172.6	0	0	111.2	I339 A340 I345 D346 V347 H362	I339-E343 HydrophobicContact CG2-CB 3.87Å; I339-E343 HydrophobicContact CG2-CG 3.87Å; A340-E343 HydrophobicContact CB-CB 4.42Å; A340-E343 CarbonylContact O-C 3.53Å; A340-E343 WeakPolarHBondContact O-CA 3.23Å; A340-E343 WeakPolarHBondContact O-CB 3.31Å; A340-E343 PolarHBondContact O-N 2.94Å; E343-I345 VanDerWaalsContact C-N 3.34Å; E343-I345 PolarHBondContact O-N 2.94Å; E343-D346 PolarHBondContact O-N 3.44Å; E343-V347 HydrophobicContact CG-CG2 4.17Å; E343-V347 WeakPolarHBondContact O-CB 3.42Å; E343-V347 WeakPolarHBondContact O-CG2 3.48Å; E343-V347 PolarHBondContact O-N 3.22Å; E343-H362 IonicContact OE1-CE1 2.74Å; E343-H362 IonicContact OE1-ND1 2.86Å
344	A	82.7	Confident	82.9	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-58.2	-45.8	175.5	0	0	0	0	0	111.7	I331 L334 V335 I339 A340 R341 V347 L348	I331-A344 HydrophobicContact CG2-CB 4.43Å; L334-A344 HydrophobicContact CB-CB 3.65Å; L334-A344 HydrophobicContact CD1-CB 3.89Å; L334-A344 HydrophobicContact CG-CB 4.43Å; V335-A344 HydrophobicContact CG2-CB 4.38Å; I339-A344 HydrophobicContact CG2-CB 4.16Å; A340-A344 PolarHBondContact O-N 2.94Å; R341-A344 PolarHBondContact O-N 3.08Å; A344-V347 PolarHBondContact O-N 3.46Å; A344-L348 WeakPolarHBondContact O-CB 3.5Å; A344-L348 VanDerWaalsContact O-CG 3.3Å; A344-L348 WeakPolarHBondContact O-CG 3.46Å; A344-L348 PolarHBondContact O-N 3.32Å
345	I	85.4	Confident	83.1	Confident	30 Å²	30	67.8 Å²	67.8	15%	0.154	35%	0.352	C	S	.	.	H	α-helix	trans	-60.9	-46.8	175.3	-69	165.7	0	0	0	110.4	F323 I331 R341 S342 E343 V347 L348 H349	F323-I345 HydrophobicContact CE2-CD1 4.03Å; F323-I345 HydrophobicContact CE2-CG1 4.43Å; F323-I345 HydrophobicContact CZ-CD1 4.31Å; F323-I345 HydrophobicContact CZ-CG1 4.42Å; F323-I345 HydrophobicContact CZ-CG2 3.95Å; I331-I345 HydrophobicContact CD1-CD1 4.4Å; I331-I345 HydrophobicContact CD1-CG1 3.79Å; I331-I345 HydrophobicContact CG1-CG1 4Å; I331-I345 HydrophobicContact CG2-CG1 4.34Å; R341-I345 HydrophobicContact CG-CD1 4.19Å; R341-I345 VanDerWaalsContact O-CG1 3.26Å; R341-I345 WeakPolarHBondContact O-CG1 3.4Å; R341-I345 PolarHBondContact O-N 2.77Å; S342-I345 PolarHBondContact O-N 3.3Å; E343-I345 VanDerWaalsContact C-N 3.34Å; E343-I345 PolarHBondContact O-N 2.94Å; I345-V347 PolarHBondContact O-N 3.03Å; I345-L348 PolarHBondContact O-N 3.28Å; I345-H349 WeakPolarHBondContact O-CB 3.4Å; I345-H349 PolarHBondContact O-CD2 3.27Å; I345-H349 PolarHBondContact O-N 2.9Å
346	D	84.1	Confident	83.1	Confident	99 Å²	99	71.8 Å²	71.8	53%	0.529	37%	0.372	S	S	.	.	H	α-helix	trans	-65.8	-37.4	-180	-76.8	-15.6	0	0	0	113.2	S342 E343 R350	S342-D346 PolarHBondContact O-N 3.34Å; E343-D346 PolarHBondContact O-N 3.44Å; D346-R350 WeakPolarHBondContact O-CG 3.32Å; D346-R350 PolarHBondContact O-N 2.85Å; D346-R350 VanDerWaalsContact O-N 3.13Å; D346-R350 PolarHBondContact O-NE 2.71Å; D346-R350 VanDerWaalsContact O-NE 3.15Å
347	V	85.3	Confident	83.4	Confident	4 Å²	4	67.5 Å²	67.5	2%	0.024	35%	0.353	C	S	.	.	H	α-helix	trans	-67.3	-47.3	175.3	176.9	0	0	0	0	109.7	E343 A344 I345 H349 R350 H351 A358	E343-V347 HydrophobicContact CG-CG2 4.17Å; E343-V347 WeakPolarHBondContact O-CB 3.42Å; E343-V347 WeakPolarHBondContact O-CG2 3.48Å; E343-V347 PolarHBondContact O-N 3.22Å; A344-V347 PolarHBondContact O-N 3.46Å; I345-V347 PolarHBondContact O-N 3.03Å; V347-H349 VanDerWaalsContact C-N 3.35Å; V347-H349 PolarHBondContact O-N 3.2Å; V347-R350 PolarHBondContact O-N 2.68Å; V347-H351 PolarHBondContact O-CD2 2.9Å; V347-H351 VanDerWaalsContact O-CD2 3.23Å; V347-H351 PolarHBondContact O-N 3.17Å; V347-H351 VanDerWaalsContact O-N 3.1Å; V347-A358 HydrophobicContact CG1-CB 3.55Å
348	L	88.5	Confident	83.7	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-62.4	-41.5	178	-74.2	166.3	0	0	0	111.6	K330 I331 L334 A344 I345 R350 H351 Q352 W353 A358	K330-L348 HydrophobicContact CB-CD1 3.96Å; K330-L348 HydrophobicContact CB-CD2 4.1Å; I331-L348 HydrophobicContact CB-CD1 4.36Å; I331-L348 HydrophobicContact CG1-CD1 3.66Å; L334-L348 HydrophobicContact CD1-CD1 3.74Å; L334-L348 HydrophobicContact CD1-CD2 4.02Å; L334-L348 HydrophobicContact CD1-CG 3.56Å; A344-L348 WeakPolarHBondContact O-CB 3.5Å; A344-L348 VanDerWaalsContact O-CG 3.3Å; A344-L348 WeakPolarHBondContact O-CG 3.46Å; A344-L348 PolarHBondContact O-N 3.32Å; I345-L348 PolarHBondContact O-N 3.28Å; L348-R350 VanDerWaalsContact C-N 3.34Å; L348-R350 PolarHBondContact O-N 3.43Å; L348-H351 CarbonylContact O-C 3.54Å; L348-H351 PolarHBondContact O-N 3.07Å; L348-Q352 PolarHBondContact O-N 2.81Å; L348-Q352 VanDerWaalsContact O-N 3.11Å; L348-W353 HydrophobicContact CB-CD2 4.26Å; L348-W353 HydrophobicContact CB-CE3 3.94Å; L348-W353 HydrophobicContact CB-CZ3 4.24Å; L348-W353 HydrophobicContact CD1-CE3 4.05Å; L348-W353 HydrophobicContact CD1-CZ3 3.93Å; L348-W353 HydrophobicContact CG-CE3 4.39Å; L348-W353 PolarHBondContact O-N 2.94Å; L348-A358 HydrophobicContact CD2-CB 3.96Å
349	H	87.3	Confident	84	Confident	104 Å²	104	57.4 Å²	57.4	48%	0.481	29%	0.294	S	S	.	.	H	α-helix	trans	-60.9	-42	175.4	-94.3	-73	0	0	0	112.6	F323 I345 V347 H351 Q352 W353	F323-H349 AromaticContact CE1-NE2 3.86Å; I345-H349 WeakPolarHBondContact O-CB 3.4Å; I345-H349 PolarHBondContact O-CD2 3.27Å; I345-H349 PolarHBondContact O-N 2.9Å; V347-H349 VanDerWaalsContact C-N 3.35Å; V347-H349 PolarHBondContact O-N 3.2Å; H349-H351 VanDerWaalsContact C-N 3.28Å; H349-H351 PolarHBondContact O-N 2.88Å; H349-Q352 PolarHBondContact O-N 3.03Å; H349-W353 AromaticContact NE2-CZ2 3.81Å
350	R	87.5	Confident	84.2	Confident	155 Å²	155	59.8 Å²	59.8	59%	0.585	32%	0.315	S	S	*	.	H	α-helix	trans	-62.8	-35.5	176.9	-80.1	-179.2	-76.3	149.2	-13.4	112.8	D346 V347 L348	D346-R350 WeakPolarHBondContact O-CG 3.32Å; D346-R350 PolarHBondContact O-N 2.85Å; D346-R350 VanDerWaalsContact O-N 3.13Å; D346-R350 PolarHBondContact O-NE 2.71Å; D346-R350 VanDerWaalsContact O-NE 3.15Å; V347-R350 PolarHBondContact O-N 2.68Å; L348-R350 VanDerWaalsContact C-N 3.34Å; L348-R350 PolarHBondContact O-N 3.43Å
351	H	87.3	Confident	84.3	Confident	54 Å²	54	58.9 Å²	58.9	25%	0.25	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	21.7	-178.7	-66.7	-69.1	0	0	0	113.4	V347 L348 H349 W353 D354 A357 A358 S361	V347-H351 PolarHBondContact O-CD2 2.9Å; V347-H351 VanDerWaalsContact O-CD2 3.23Å; V347-H351 PolarHBondContact O-N 3.17Å; V347-H351 VanDerWaalsContact O-N 3.1Å; L348-H351 CarbonylContact O-C 3.54Å; L348-H351 PolarHBondContact O-N 3.07Å; H349-H351 VanDerWaalsContact C-N 3.28Å; H349-H351 PolarHBondContact O-N 2.88Å; H351-W353 PolarHBondContact O-N 2.81Å; H351-W353 VanDerWaalsContact O-N 3.13Å; H351-D354 VanDerWaalsContact O-CB 3.25Å; H351-D354 WeakPolarHBondContact O-CB 3.25Å; H351-D354 PolarHBondContact O-N 2.82Å; H351-A357 HydrophobicContact CB-CB 4.03Å; H351-A358 HydrophobicContact CB-CB 4.47Å; H351-S361 WeakPolarHBondContact NE2-CB 3.29Å; H351-S361 PolarHBondContact NE2-OG 2.88Å
352	Q	86	Confident	84.1	Confident	179 Å²	179	58.7 Å²	58.7	84%	0.836	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	36.7	177.4	-58.2	-177.8	-11.6	0	0	113.7	L348 H349 D354	L348-Q352 PolarHBondContact O-N 2.81Å; L348-Q352 VanDerWaalsContact O-N 3.11Å; H349-Q352 PolarHBondContact O-N 3.03Å; Q352-D354 PolarHBondContact O-N 3.32Å
353	W	85.5	Confident	83.9	Confident	32 Å²	32	58.7 Å²	58.7	12%	0.121	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.6	22.3	-176.3	-59.9	86.6	0	0	0	114.7	F323 Q327 K330 I331 L348 H349 H351 L355	F323-W353 AromaticContact CD1-CH2 3.31Å; F323-W353 HydrophobicContact CD1-CH2 3.31Å; F323-W353 AromaticContact CD1-CZ2 3.49Å; F323-W353 HydrophobicContact CD1-CZ2 3.49Å; F323-W353 VanDerWaalsContact CD1-CZ2 3.49Å; F323-W353 AromaticContact CE1-CH2 3.52Å; F323-W353 HydrophobicContact CE1-CH2 3.52Å; F323-W353 AromaticContact CE1-CZ2 3.5Å; F323-W353 HydrophobicContact CE1-CZ2 3.5Å; F323-W353 VanDerWaalsContact CE1-CZ2 3.5Å; F323-W353 HydrophobicContact CG-CH2 4.03Å; F323-W353 HydrophobicContact CZ-CH2 4.38Å; Q327-W353 HydrophobicContact CB-CD2 4.37Å; Q327-W353 HydrophobicContact CB-CE3 3.7Å; Q327-W353 HydrophobicContact CB-CH2 3.63Å; Q327-W353 HydrophobicContact CB-CZ2 4.32Å; Q327-W353 HydrophobicContact CB-CZ3 3.28Å; Q327-W353 HydrophobicContact CG-CD2 3.69Å; Q327-W353 HydrophobicContact CG-CE3 3.48Å; Q327-W353 VanDerWaalsContact CG-CE3 3.48Å; Q327-W353 HydrophobicContact CG-CG 4.4Å; Q327-W353 HydrophobicContact CG-CH2 3.86Å; Q327-W353 HydrophobicContact CG-CZ2 4.07Å; Q327-W353 HydrophobicContact CG-CZ3 3.56Å; K330-W353 HydrophobicContact CD-CB 4.44Å; K330-W353 HydrophobicContact CD-CE3 4.42Å; K330-W353 VanDerWaalsContact CD-O 3.32Å; K330-W353 WeakPolarHBondContact CD-O 3.5Å; K330-W353 WeakPolarHBondContact CE-O 3.43Å; K330-W353 PolarHBondContact NZ-O 2.93Å; I331-W353 HydrophobicContact CD1-CH2 3.91Å; I331-W353 HydrophobicContact CD1-CZ3 3.95Å; I331-W353 HydrophobicContact CG1-CH2 4.3Å; I331-W353 HydrophobicContact CG1-CZ3 3.92Å; L348-W353 HydrophobicContact CB-CD2 4.26Å; L348-W353 HydrophobicContact CB-CE3 3.94Å; L348-W353 HydrophobicContact CB-CZ3 4.24Å; L348-W353 HydrophobicContact CD1-CE3 4.05Å; L348-W353 HydrophobicContact CD1-CZ3 3.93Å; L348-W353 HydrophobicContact CG-CE3 4.39Å; L348-W353 PolarHBondContact O-N 2.94Å; H349-W353 AromaticContact NE2-CZ2 3.81Å; H351-W353 PolarHBondContact O-N 2.81Å; H351-W353 VanDerWaalsContact O-N 3.13Å; W353-L355 PolarHBondContact O-N 2.88Å
354	D	87.3	Confident	83.6	Confident	79 Å²	79	62.2 Å²	62.2	42%	0.422	32%	0.315	S	S	.	.			trans	-79.9	113.5	166.2	-173.9	-9.5	0	0	0	109.9	H351 Q352 D356 A357 A358	H351-D354 VanDerWaalsContact O-CB 3.25Å; H351-D354 WeakPolarHBondContact O-CB 3.25Å; H351-D354 PolarHBondContact O-N 2.82Å; Q352-D354 PolarHBondContact O-N 3.32Å; D354-D356 PolarHBondContact OD1-N 2.77Å; D354-A357 HydrophobicContact CB-CB 3.96Å; D354-A357 PolarHBondContact OD1-N 3.09Å; D354-A358 WeakPolarHBondContact O-CB 3.35Å; D354-A358 PolarHBondContact O-N 3.16Å
355	L	85.6	Confident	82.9	Confident	39 Å²	39	65.8 Å²	65.8	20%	0.204	34%	0.34	C	S	.	.	H	α-helix	trans	-68.3	-37.9	-178	-177.5	67.4	0	0	0	111.6	K330 V333 L334 W353 A358 L359	K330-L355 HydrophobicContact CB-CD1 4.38Å; K330-L355 HydrophobicContact CG-CB 4.39Å; V333-L355 HydrophobicContact CB-CD1 4.23Å; V333-L355 HydrophobicContact CB-CD2 4.44Å; V333-L355 HydrophobicContact CG1-CD1 4.06Å; V333-L355 HydrophobicContact CG1-CD2 4.04Å; L334-L355 HydrophobicContact CD2-CD1 4.08Å; L334-L355 HydrophobicContact CG-CD1 4.13Å; W353-L355 PolarHBondContact O-N 2.88Å; L355-A358 PolarHBondContact O-N 3.07Å; L355-L359 HydrophobicContact CD1-CD1 4.38Å; L355-L359 HydrophobicContact CD1-CG 4.48Å; L355-L359 HydrophobicContact CG-CD1 4.05Å; L355-L359 WeakPolarHBondContact O-CB 3.16Å; L355-L359 VanDerWaalsContact O-CG 3.26Å; L355-L359 WeakPolarHBondContact O-CG 3.44Å; L355-L359 PolarHBondContact O-N 3.29Å
356	D	84	Confident	81.8	Confident	121 Å²	121	69.7 Å²	69.7	65%	0.647	36%	0.359	S	S	*	.	H	α-helix	trans	-72	-42.2	-176.3	-70.9	-25.6	0	0	0	110.4	D354 L359 A360	D354-D356 PolarHBondContact OD1-N 2.77Å; D356-L359 PolarHBondContact O-N 3.11Å; D356-A360 VanDerWaalsContact O-CB 3.29Å; D356-A360 WeakPolarHBondContact O-CB 3.41Å; D356-A360 PolarHBondContact O-N 3.21Å
357	A	85.4	Confident	80.5	Confident	29 Å²	29	72.4 Å²	72.4	24%	0.24	37%	0.366	C	S	.	.	H	α-helix	trans	-65.4	-40.5	174.1	0	0	0	0	0	112.1	H351 D354 A360 S361	H351-A357 HydrophobicContact CB-CB 4.03Å; D354-A357 HydrophobicContact CB-CB 3.96Å; D354-A357 PolarHBondContact OD1-N 3.09Å; A357-A360 PolarHBondContact O-N 3.37Å; A357-S361 VanDerWaalsContact O-CB 3.3Å; A357-S361 WeakPolarHBondContact O-CB 3.4Å; A357-S361 PolarHBondContact O-N 3.33Å
358	A	84.7	Confident	78.9	Confident	0 Å²	0	74.7 Å²	74.7	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-59.2	-49.3	174.3	0	0	0	0	0	112.1	L334 V347 L348 H351 D354 L355 S361 H362	L334-A358 HydrophobicContact CD1-CB 4.36Å; V347-A358 HydrophobicContact CG1-CB 3.55Å; L348-A358 HydrophobicContact CD2-CB 3.96Å; H351-A358 HydrophobicContact CB-CB 4.47Å; D354-A358 WeakPolarHBondContact O-CB 3.35Å; D354-A358 PolarHBondContact O-N 3.16Å; L355-A358 PolarHBondContact O-N 3.07Å; A358-S361 PolarHBondContact O-N 3.04Å; A358-H362 WeakPolarHBondContact O-CB 3.28Å; A358-H362 PolarHBondContact O-N 3.5Å
359	L	82.3	Confident	76.8	Confident	21 Å²	21	83 Å²	83	11%	0.11	43%	0.43	C	S	.	.	H	α-helix	trans	-62.4	-45.7	176.8	-75.7	170.6	0	0	0	111.9	L334 L355 D356 S361 H362 L363	L334-L359 HydrophobicContact CD2-CD2 3.44Å; L334-L359 VanDerWaalsContact CD2-CD2 3.44Å; L334-L359 HydrophobicContact CD2-CG 3.84Å; L355-L359 HydrophobicContact CD1-CD1 4.38Å; L355-L359 HydrophobicContact CD1-CG 4.48Å; L355-L359 HydrophobicContact CG-CD1 4.05Å; L355-L359 WeakPolarHBondContact O-CB 3.16Å; L355-L359 VanDerWaalsContact O-CG 3.26Å; L355-L359 WeakPolarHBondContact O-CG 3.44Å; L355-L359 PolarHBondContact O-N 3.29Å; D356-L359 PolarHBondContact O-N 3.11Å; L359-S361 VanDerWaalsContact C-N 3.33Å; L359-S361 PolarHBondContact O-N 2.83Å; L359-H362 PolarHBondContact O-N 2.91Å; L359-L363 WeakPolarHBondContact O-CB 3.42Å; L359-L363 WeakPolarHBondContact O-CG 3.47Å; L359-L363 PolarHBondContact O-N 2.88Å
360	A	83.8	Confident	74.5	Confident	55 Å²	55	83 Å²	83	46%	0.455	44%	0.442	S	S	.	.	H	α-helix	trans	-61.2	-42.2	178.7	0	0	0	0	0	111.8	D356 A357 H364	D356-A360 VanDerWaalsContact O-CB 3.29Å; D356-A360 WeakPolarHBondContact O-CB 3.41Å; D356-A360 PolarHBondContact O-N 3.21Å; A357-A360 PolarHBondContact O-N 3.37Å; A360-H364 WeakPolarHBondContact O-CB 3.32Å; A360-H364 PolarHBondContact O-N 3.22Å
361	S	80.4	Confident	72.1	Confident	38 Å²	38	90.6 Å²	90.6	27%	0.266	47%	0.47	S	S	.	.	H	α-helix	trans	-65.2	-38.7	176.7	-176.7	0	0	0	0	112.4	H351 A357 A358 L359 H364 S365	H351-S361 WeakPolarHBondContact NE2-CB 3.29Å; H351-S361 PolarHBondContact NE2-OG 2.88Å; A357-S361 VanDerWaalsContact O-CB 3.3Å; A357-S361 WeakPolarHBondContact O-CB 3.4Å; A357-S361 PolarHBondContact O-N 3.33Å; A358-S361 PolarHBondContact O-N 3.04Å; L359-S361 VanDerWaalsContact C-N 3.33Å; L359-S361 PolarHBondContact O-N 2.83Å; S361-H364 PolarHBondContact O-N 3.26Å; S361-S365 PolarHBondContact O-N 3.21Å; S361-S365 VanDerWaalsContact O-N 3.07Å
362	H	72.9	Confident	71.4	Confident	31 Å²	31	92.4 Å²	92.4	14%	0.144	48%	0.481	C	S	.	.	H	α-helix	trans	-70.8	-42.3	178.4	-174	76.8	0	0	0	111.5	I339 E343 A358 L359 H364 S365 M366	I339-H362 HydrophobicContact CD1-CB 4.11Å; I339-H362 VanDerWaalsContact CD1-CD2 3.43Å; I339-H362 WeakPolarHBondContact CD1-CD2 3.3Å; I339-H362 VanDerWaalsContact CD1-CG 3.46Å; E343-H362 IonicContact OE1-CE1 2.74Å; E343-H362 IonicContact OE1-ND1 2.86Å; A358-H362 WeakPolarHBondContact O-CB 3.28Å; A358-H362 PolarHBondContact O-N 3.5Å; L359-H362 PolarHBondContact O-N 2.91Å; H362-H364 VanDerWaalsContact C-N 3.32Å; H362-H364 PolarHBondContact O-N 2.83Å; H362-S365 WeakPolarHBondContact O-CB 3.33Å; H362-S365 PolarHBondContact O-N 3.23Å; H362-S365 VanDerWaalsContact O-N 3.11Å; H362-M366 PolarHBondContact O-N 2.9Å
363	L	74.9	Confident	70.6	Confident	83 Å²	83	87.8 Å²	87.8	44%	0.435	46%	0.462	S	S	.	.	H	α-helix	trans	-59	-43	172	-72.2	170.4	0	0	0	111.5	L359 S365 M366 F367	L359-L363 WeakPolarHBondContact O-CB 3.42Å; L359-L363 WeakPolarHBondContact O-CG 3.47Å; L359-L363 PolarHBondContact O-N 2.88Å; L363-S365 VanDerWaalsContact C-N 3.29Å; L363-S365 PolarHBondContact O-N 3.34Å; L363-M366 HydrophobicContact CD2-CE 4.45Å; L363-M366 PolarHBondContact O-N 3.23Å; L363-F367 HydrophobicContact CD2-CD2 4.5Å; L363-F367 HydrophobicContact CD2-CE2 4.05Å; L363-F367 VanDerWaalsContact O-CD2 3.3Å; L363-F367 WeakPolarHBondContact O-CD2 3.28Å; L363-F367 PolarHBondContact O-N 2.71Å
364	H	74.4	Confident	69.8	Low	153 Å²	153	90.9 Å²	90.9	71%	0.708	48%	0.481	S	S	*	.	H	α-helix	trans	-62.7	-35.6	175.6	-123.5	83.6	0	0	0	112.6	A360 S361 H362 G368	A360-H364 WeakPolarHBondContact O-CB 3.32Å; A360-H364 PolarHBondContact O-N 3.22Å; S361-H364 PolarHBondContact O-N 3.26Å; H362-H364 VanDerWaalsContact C-N 3.32Å; H362-H364 PolarHBondContact O-N 2.83Å; H364-G368 VanDerWaalsContact O-CA 3.22Å; H364-G368 WeakPolarHBondContact O-CA 3.36Å; H364-G368 PolarHBondContact O-N 3.09Å
365	S	68.6	Low	68.7	Low	76 Å²	76	91.6 Å²	91.6	53%	0.531	49%	0.485	S	S	.	.	H	α-helix	trans	-69.3	-39.1	176.8	-170.1	0	0	0	0	112.3	S361 H362 L363	S361-S365 PolarHBondContact O-N 3.21Å; S361-S365 VanDerWaalsContact O-N 3.07Å; H362-S365 WeakPolarHBondContact O-CB 3.33Å; H362-S365 PolarHBondContact O-N 3.23Å; H362-S365 VanDerWaalsContact O-N 3.11Å; L363-S365 VanDerWaalsContact C-N 3.29Å; L363-S365 PolarHBondContact O-N 3.34Å
366	M	61	Low	67.7	Low	111 Å²	111	94.9 Å²	94.9	55%	0.547	50%	0.502	S	S	.	.	H	α-helix	trans	-69.1	-43.7	177	-86.5	-153.5	-76.4	0	0	112.9	H362 L363	H362-M366 PolarHBondContact O-N 2.9Å; L363-M366 HydrophobicContact CD2-CE 4.45Å; L363-M366 PolarHBondContact O-N 3.23Å
367	F	57.6	Low	66.6	Low	156 Å²	156	93.2 Å²	93.2	68%	0.684	49%	0.493	S	S	*	.	H	α-helix	trans	-93.8	-10.1	-175.3	-67.8	-73.5	0	0	0	114.1	L363	L363-F367 HydrophobicContact CD2-CD2 4.5Å; L363-F367 HydrophobicContact CD2-CE2 4.05Å; L363-F367 VanDerWaalsContact O-CD2 3.3Å; L363-F367 WeakPolarHBondContact O-CD2 3.28Å; L363-F367 PolarHBondContact O-N 2.71Å
368	G	51.6	Low	65.3	Low	53 Å²	53	97.8 Å²	97.8	55%	0.546	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-9.5	-175.1	0	0	0	0	0	115.8	H364	H364-G368 VanDerWaalsContact O-CA 3.22Å; H364-G368 WeakPolarHBondContact O-CA 3.36Å; H364-G368 PolarHBondContact O-N 3.09Å
369	Q	45.5	Very low	63.8	Low	174 Å²	174	105.3 Å²	105.3	81%	0.813	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	3.8	177	-67.4	-161.4	3.5	0	0	114.3
370	S	38.4	Very low	62.2	Low	104 Å²	104	112.3 Å²	112.3	73%	0.727	59%	0.587	S	S	*	*			trans	-104.7	36	-176.9	-56.4	0	0	0	0	114.6
371	R	37.6	Very low	60.3	Low	314 Å²	314	117.5 Å²	117.5	100%	1.185	60%	0.599	S	S	*	*			trans	-119.7	0	169.2	-81	-166.6	-178.8	-168.2	2.1	113

Retrieved 371 of 371 residues in 291.3 ms (Link to these results)

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