A0A087Y636_POEFO Loading...

Rac/Cdc42 guanine nucleotide exchange factor 6

AlphaFold DB , UniProt , Accession A0A087Y636, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 772 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	56	Low	74.8	Confident	170 Å²	170	57 Å²	57	84%	0.837	29%	0.293	S	S	*	.				0	113.1	0	-79.4	178.2	162.6	0	0	108.1	E5 Q6	M1-E5 VanDerWaalsContact C-OE2 3.3Å; M1-E5 WeakPolarHBondContact CA-OE2 3.44Å; M1-Q6 HydrophobicContact CB-CG 3.86Å; M1-Q6 PolarHBondContact O-NE2 2.93Å
2	N	71.8	Confident	75.3	Confident	96 Å²	96	56 Å²	56	51%	0.513	29%	0.288	S	S	.	.			trans	-67.8	152.8	174.1	-59.4	-8.5	0	0	0	109.1	E4 E5 Q6	N2-E4 VanDerWaalsContact CB-OE2 3.23Å; N2-E4 WeakPolarHBondContact CB-OE2 3.07Å; N2-E4 PolarHBondContact O-N 3.11Å; N2-E4 VanDerWaalsContact O-N 3.17Å; N2-E5 HydrophobicContact CB-CG 4.24Å; N2-E5 PolarHBondContact N-OE2 3.32Å; N2-E5 WeakPolarHBondContact O-CB 3.49Å; N2-E5 PolarHBondContact O-N 2.9Å; N2-Q6 WeakPolarHBondContact O-CG 3.49Å; N2-Q6 PolarHBondContact O-N 3.27Å; N2-Q6 VanDerWaalsContact O-N 3.11Å
3	P	68.1	Low	75.4	Confident	50 Å²	50	58.4 Å²	58.4	33%	0.325	31%	0.313	S	S	.	.	H	α-helix	trans	-60.7	-26	-176.4	23.1	-32	0	0	0	113.3	Q6 T7 L100 L104	P3-Q6 PolarHBondContact O-N 2.75Å; P3-T7 WeakPolarHBondContact O-CB 3.28Å; P3-T7 PolarHBondContact O-N 3.21Å; P3-T7 PolarHBondContact O-OG1 2.84Å; P3-L100 HydrophobicContact CB-CD2 3.77Å; P3-L100 HydrophobicContact CB-CG 4.46Å; P3-L100 HydrophobicContact CG-CD2 3.81Å; P3-L104 HydrophobicContact CB-CD1 3.92Å
4	E	76.1	Confident	75.2	Confident	36 Å²	36	57.8 Å²	57.8	17%	0.168	31%	0.309	C	S	.	.	H	α-helix	trans	-65.1	-48.5	172.7	-56.3	71.6	-156.6	0	0	110.8	N2 Q6 T7 V8 P27 E28 L31 L100	N2-E4 VanDerWaalsContact CB-OE2 3.23Å; N2-E4 WeakPolarHBondContact CB-OE2 3.07Å; N2-E4 PolarHBondContact O-N 3.11Å; N2-E4 VanDerWaalsContact O-N 3.17Å; E4-Q6 VanDerWaalsContact C-N 3.29Å; E4-Q6 PolarHBondContact O-N 3.29Å; E4-T7 PolarHBondContact O-N 2.97Å; E4-V8 WeakPolarHBondContact O-CG2 3.48Å; E4-V8 PolarHBondContact O-N 2.91Å; E4-P27 HydrophobicContact CB-CB 3.82Å; E4-P27 HydrophobicContact CB-CG 3.77Å; E4-E28 HydrophobicContact CG-CB 4.23Å; E4-E28 HydrophobicContact CG-CG 4.34Å; E4-L31 HydrophobicContact CB-CD1 4.17Å; E4-L100 HydrophobicContact CG-CD1 4.46Å; E4-L100 HydrophobicContact CG-CD2 3.79Å; E4-L100 WeakPolarHBondContact OE1-CD2 3.4Å
5	E	77.3	Confident	75	Confident	75 Å²	75	57.9 Å²	57.9	35%	0.35	33%	0.329	S	S	.	.	H	α-helix	trans	-61.2	-38.9	176.4	-59.3	176.1	135.1	0	0	111.7	M1 N2 T9 P27	M1-E5 VanDerWaalsContact C-OE2 3.3Å; M1-E5 WeakPolarHBondContact CA-OE2 3.44Å; N2-E5 HydrophobicContact CB-CG 4.24Å; N2-E5 PolarHBondContact N-OE2 3.32Å; N2-E5 WeakPolarHBondContact O-CB 3.49Å; N2-E5 PolarHBondContact O-N 2.9Å; E5-T9 WeakPolarHBondContact O-CB 3.32Å; E5-T9 PolarHBondContact O-N 2.86Å; E5-T9 PolarHBondContact O-OG1 3.39Å; E5-P27 HydrophobicContact CG-CB 4.38Å; E5-P27 HydrophobicContact CG-CG 4.14Å
6	Q	76.8	Confident	75.1	Confident	93 Å²	93	55.3 Å²	55.3	44%	0.435	32%	0.315	S	S	.	.	H	α-helix	trans	-65.4	-43.4	176.5	-63.4	179.5	43.4	0	0	110.9	M1 N2 P3 E4 T9 W10	M1-Q6 HydrophobicContact CB-CG 3.86Å; M1-Q6 PolarHBondContact O-NE2 2.93Å; N2-Q6 WeakPolarHBondContact O-CG 3.49Å; N2-Q6 PolarHBondContact O-N 3.27Å; N2-Q6 VanDerWaalsContact O-N 3.11Å; P3-Q6 PolarHBondContact O-N 2.75Å; E4-Q6 VanDerWaalsContact C-N 3.29Å; E4-Q6 PolarHBondContact O-N 3.29Å; Q6-T9 PolarHBondContact O-N 2.68Å; Q6-W10 VanDerWaalsContact O-CB 3.29Å; Q6-W10 WeakPolarHBondContact O-CB 3.41Å; Q6-W10 PolarHBondContact O-N 3.1Å
7	T	78.4	Confident	75.1	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-66.7	-42.6	177.5	-59.8	0	0	0	0	111.7	P3 E4 W10 L11 L31 L100 L103	P3-T7 WeakPolarHBondContact O-CB 3.28Å; P3-T7 PolarHBondContact O-N 3.21Å; P3-T7 PolarHBondContact O-OG1 2.84Å; E4-T7 PolarHBondContact O-N 2.97Å; T7-W10 HydrophobicContact CG2-CE3 4.46Å; T7-W10 PolarHBondContact O-N 2.9Å; T7-L11 HydrophobicContact CG2-CD1 4Å; T7-L11 HydrophobicContact CG2-CG 4.35Å; T7-L11 WeakPolarHBondContact O-CB 3.41Å; T7-L11 VanDerWaalsContact O-CG 3.25Å; T7-L11 WeakPolarHBondContact O-CG 3.44Å; T7-L11 PolarHBondContact O-N 2.95Å; T7-L31 HydrophobicContact CG2-CD1 4.19Å; T7-L31 HydrophobicContact CG2-CD2 4.43Å; T7-L100 HydrophobicContact CG2-CD1 4.02Å; T7-L100 VanDerWaalsContact OG1-CD1 3.27Å; T7-L100 WeakPolarHBondContact OG1-CD1 3.44Å; T7-L103 HydrophobicContact CG2-CB 4.26Å; T7-L103 HydrophobicContact CG2-CD1 4.04Å
8	V	78.9	Confident	74.6	Confident	4 Å²	4	55.4 Å²	55.4	2%	0.024	32%	0.322	C	S	.	.	H	α-helix	trans	-57.8	-51.2	172.4	172.9	0	0	0	0	110.7	E4 W10 L11 I12 L17 I24 F30 L31	E4-V8 WeakPolarHBondContact O-CG2 3.48Å; E4-V8 PolarHBondContact O-N 2.91Å; V8-W10 VanDerWaalsContact C-N 3.29Å; V8-W10 PolarHBondContact O-N 2.84Å; V8-L11 PolarHBondContact O-N 3.45Å; V8-I12 HydrophobicContact CG1-CD1 3.54Å; V8-I12 HydrophobicContact CG1-CG1 4.41Å; V8-I12 WeakPolarHBondContact O-CD1 3.46Å; V8-I12 VanDerWaalsContact O-CG1 3.25Å; V8-I12 WeakPolarHBondContact O-CG1 3.24Å; V8-I12 PolarHBondContact O-N 2.8Å; V8-L17 HydrophobicContact CG1-CD2 4.45Å; V8-I24 HydrophobicContact CB-CD1 4.47Å; V8-I24 HydrophobicContact CG1-CD1 3.78Å; V8-I24 HydrophobicContact CG2-CD1 4.3Å; V8-F30 HydrophobicContact CG1-CD1 4.39Å; V8-F30 HydrophobicContact CG1-CE1 4.1Å; V8-F30 HydrophobicContact CG2-CD1 4.04Å; V8-F30 HydrophobicContact CG2-CE1 4.45Å; V8-L31 HydrophobicContact CG2-CD1 3.94Å; V8-L31 HydrophobicContact CG2-CD2 3.53Å; V8-L31 HydrophobicContact CG2-CG 3.54Å
9	T	79	Confident	73.8	Confident	77 Å²	77	56.8 Å²	56.8	47%	0.472	34%	0.336	S	S	.	.	H	α-helix	trans	-59.4	-40.9	-179.2	-54.9	0	0	0	0	111.5	E5 Q6 S13	E5-T9 WeakPolarHBondContact O-CB 3.32Å; E5-T9 PolarHBondContact O-N 2.86Å; E5-T9 PolarHBondContact O-OG1 3.39Å; Q6-T9 PolarHBondContact O-N 2.68Å; T9-S13 WeakPolarHBondContact O-CB 3.41Å; T9-S13 PolarHBondContact O-N 2.85Å
10	W	81.3	Confident	73.2	Confident	26 Å²	26	55.9 Å²	55.9	10%	0.098	33%	0.331	C	S	.	.	H	α-helix	trans	-65.5	-48.6	177.2	173.7	60.9	0	0	0	112.8	Q6 T7 V8 I12 S13 L14 L44 L48 L103 F106 N107	Q6-W10 VanDerWaalsContact O-CB 3.29Å; Q6-W10 WeakPolarHBondContact O-CB 3.41Å; Q6-W10 PolarHBondContact O-N 3.1Å; T7-W10 HydrophobicContact CG2-CE3 4.46Å; T7-W10 PolarHBondContact O-N 2.9Å; V8-W10 VanDerWaalsContact C-N 3.29Å; V8-W10 PolarHBondContact O-N 2.84Å; W10-I12 VanDerWaalsContact C-N 3.26Å; W10-I12 PolarHBondContact O-N 3.31Å; W10-S13 WeakPolarHBondContact CA-OG 3.48Å; W10-S13 PolarHBondContact O-N 3.36Å; W10-S13 PolarHBondContact O-OG 2.96Å; W10-L14 HydrophobicContact CD2-CD1 4.28Å; W10-L14 HydrophobicContact CZ2-CD1 3.86Å; W10-L14 PolarHBondContact O-N 2.57Å; W10-L14 VanDerWaalsContact O-N 3.13Å; W10-L44 HydrophobicContact CH2-CD1 4.08Å; W10-L44 HydrophobicContact CH2-CD2 3.87Å; W10-L44 HydrophobicContact CH2-CG 4.4Å; W10-L44 HydrophobicContact CZ2-CD1 4.26Å; W10-L44 HydrophobicContact CZ3-CD2 4.04Å; W10-L48 HydrophobicContact CH2-CD1 4.26Å; W10-L48 HydrophobicContact CZ2-CD1 3.69Å; W10-L103 HydrophobicContact CZ3-CB 4.39Å; W10-L103 HydrophobicContact CZ3-CD2 4.4Å; W10-F106 HydrophobicContact CH2-CD1 4.23Å; W10-N107 HydrophobicContact CD2-CB 4.13Å; W10-N107 HydrophobicContact CE3-CB 4.36Å; W10-N107 HydrophobicContact CH2-CB 3.69Å; W10-N107 HydrophobicContact CZ2-CB 3.41Å; W10-N107 VanDerWaalsContact CZ2-CB 3.41Å; W10-N107 HydrophobicContact CZ3-CB 4.16Å; W10-N107 VanDerWaalsContact NE1-CG 3.27Å; W10-N107 PolarHBondContact NE1-ND2 3.36Å; W10-N107 PolarHBondContact NE1-OD1 2.88Å
11	L	79.1	Confident	72	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-61.9	-33.3	177.9	-67.6	172.3	0	0	0	112.7	T7 V8 V16 L17 L31 L35 L44	T7-L11 HydrophobicContact CG2-CD1 4Å; T7-L11 HydrophobicContact CG2-CG 4.35Å; T7-L11 WeakPolarHBondContact O-CB 3.41Å; T7-L11 VanDerWaalsContact O-CG 3.25Å; T7-L11 WeakPolarHBondContact O-CG 3.44Å; T7-L11 PolarHBondContact O-N 2.95Å; V8-L11 PolarHBondContact O-N 3.45Å; L11-V16 PolarHBondContact O-N 3.21Å; L11-V16 VanDerWaalsContact O-N 3.13Å; L11-L17 HydrophobicContact CB-CB 3.71Å; L11-L17 HydrophobicContact CB-CD2 4Å; L11-L17 HydrophobicContact CD1-CD2 4.17Å; L11-L17 PolarHBondContact O-N 2.91Å; L11-L17 VanDerWaalsContact O-N 3.11Å; L11-L31 HydrophobicContact CD1-CD2 3.86Å; L11-L35 HydrophobicContact CD1-CD2 4.18Å; L11-L44 HydrophobicContact CD2-CD1 3.84Å; L11-L44 HydrophobicContact CD2-CD2 3.68Å; L11-L44 HydrophobicContact CD2-CG 4.32Å
12	I	80.6	Confident	71.8	Confident	45 Å²	45	58 Å²	58	23%	0.231	33%	0.332	C	S	.	.	H	α-helix	trans	-69.2	-44.6	171.6	-64.4	161.1	0	0	0	110.8	V8 W10 L14 G15 L17	V8-I12 HydrophobicContact CG1-CD1 3.54Å; V8-I12 HydrophobicContact CG1-CG1 4.41Å; V8-I12 WeakPolarHBondContact O-CD1 3.46Å; V8-I12 VanDerWaalsContact O-CG1 3.25Å; V8-I12 WeakPolarHBondContact O-CG1 3.24Å; V8-I12 PolarHBondContact O-N 2.8Å; W10-I12 VanDerWaalsContact C-N 3.26Å; W10-I12 PolarHBondContact O-N 3.31Å; I12-L14 PolarHBondContact O-N 2.85Å; I12-G15 PolarHBondContact O-N 2.87Å; I12-L17 WeakPolarHBondContact CA-O 3.41Å; I12-L17 HydrophobicContact CG1-CB 4.37Å; I12-L17 HydrophobicContact CG1-CD2 4.49Å; I12-L17 HydrophobicContact CG1-CG 4.42Å
13	S	76.8	Confident	71	Confident	87 Å²	87	61.2 Å²	61.2	61%	0.608	35%	0.349	S	S	*	.	H	α-helix	trans	-61.9	-26.1	-179.1	74.4	0	0	0	0	114	T9 W10 G15	T9-S13 WeakPolarHBondContact O-CB 3.41Å; T9-S13 PolarHBondContact O-N 2.85Å; W10-S13 WeakPolarHBondContact CA-OG 3.48Å; W10-S13 PolarHBondContact O-N 3.36Å; W10-S13 PolarHBondContact O-OG 2.96Å; S13-G15 VanDerWaalsContact C-N 3.34Å
14	L	72.3	Confident	70.8	Confident	50 Å²	50	61.1 Å²	61.1	26%	0.262	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-1.3	174.8	-65.7	175.7	0	0	0	113.7	W10 I12 V16 L44 L48	W10-L14 HydrophobicContact CD2-CD1 4.28Å; W10-L14 HydrophobicContact CZ2-CD1 3.86Å; W10-L14 PolarHBondContact O-N 2.57Å; W10-L14 VanDerWaalsContact O-N 3.13Å; I12-L14 PolarHBondContact O-N 2.85Å; L14-V16 VanDerWaalsContact C-N 3.26Å; L14-V16 HydrophobicContact CB-CG2 3.72Å; L14-V16 PolarHBondContact O-N 2.89Å; L14-L44 HydrophobicContact CD1-CD1 3.52Å; L14-L48 HydrophobicContact CD1-CD1 3.76Å; L14-L48 HydrophobicContact CD1-CD2 4.13Å; L14-L48 HydrophobicContact CD1-CG 4.21Å; L14-L48 HydrophobicContact CD2-CD2 4.13Å
15	G	72.2	Confident	70	Confident	59 Å²	59	64.7 Å²	64.7	61%	0.608	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.3	23.6	-177.2	0	0	0	0	0	114	I12 S13	I12-G15 PolarHBondContact O-N 2.87Å; S13-G15 VanDerWaalsContact C-N 3.34Å
16	V	77.3	Confident	69.7	Low	17 Å²	17	64.8 Å²	64.8	10%	0.103	38%	0.383	C	S	.	.	S	Bend	trans	-98.1	-31.6	-176.5	-164.6	0	0	0	0	111.5	L11 L14 V40 K43 L44	L11-V16 PolarHBondContact O-N 3.21Å; L11-V16 VanDerWaalsContact O-N 3.13Å; L14-V16 VanDerWaalsContact C-N 3.26Å; L14-V16 HydrophobicContact CB-CG2 3.72Å; L14-V16 PolarHBondContact O-N 2.89Å; V16-V40 HydrophobicContact CG1-CG1 3.98Å; V16-V40 WeakPolarHBondContact CG1-O 3.46Å; V16-K43 HydrophobicContact CG1-CB 3.65Å; V16-L44 HydrophobicContact CG1-CB 4.18Å; V16-L44 HydrophobicContact CG2-CD1 4.18Å
17	L	75.5	Confident	69.5	Low	14 Å²	14	61.3 Å²	61.3	7%	0.073	37%	0.369	C	S	.	.	S	Bend	trans	-115.3	137.1	174.4	-176.6	63.9	0	0	0	110	V8 L11 I12 F30 L31	V8-L17 HydrophobicContact CG1-CD2 4.45Å; L11-L17 HydrophobicContact CB-CB 3.71Å; L11-L17 HydrophobicContact CB-CD2 4Å; L11-L17 HydrophobicContact CD1-CD2 4.17Å; L11-L17 PolarHBondContact O-N 2.91Å; L11-L17 VanDerWaalsContact O-N 3.11Å; I12-L17 WeakPolarHBondContact CA-O 3.41Å; I12-L17 HydrophobicContact CG1-CB 4.37Å; I12-L17 HydrophobicContact CG1-CD2 4.49Å; I12-L17 HydrophobicContact CG1-CG 4.42Å; L17-F30 HydrophobicContact CD2-CE1 4.02Å; L17-L31 HydrophobicContact CD2-CD2 4.44Å
18	S	65.9	Low	69.4	Low	98 Å²	98	64.5 Å²	64.5	69%	0.685	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-73.8	137.1	177.1	49.4	0	0	0	0	111.4
19	S	59.8	Low	69.3	Low	83 Å²	83	70.4 Å²	70.4	58%	0.58	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-66.1	124.8	-177.9	-169.8	0	0	0	0	111.7	K21	S19-K21 PolarHBondContact O-N 3.1Å
20	P	61.6	Low	69.3	Low	38 Å²	38	69 Å²	69	25%	0.247	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-69.2	126.2	-177.6	24.8	-30.1	0	0	0	111.1	K22 I24 F30	P20-K22 PolarHBondContact O-N 2.68Å; P20-I24 HydrophobicContact CB-CG1 4.29Å; P20-I24 HydrophobicContact CG-CD1 3.66Å; P20-I24 HydrophobicContact CG-CG1 3.76Å; P20-F30 HydrophobicContact CB-CE1 4.37Å; P20-F30 HydrophobicContact CB-CE2 4.39Å; P20-F30 HydrophobicContact CB-CZ 3.99Å; P20-F30 HydrophobicContact CG-CE1 4.11Å; P20-F30 HydrophobicContact CG-CZ 4.19Å
21	K	46.7	Very low	69.2	Low	111 Å²	111	67.7 Å²	67.7	48%	0.483	39%	0.394	S	S	.	.	S	Bend	trans	-65.8	-6.1	-172.6	-53.1	179.2	-172.1	169.7	0	114.9	S19 E702 E712	S19-K21 PolarHBondContact O-N 3.1Å; K21-E702 IonicContact NZ-OE2 2.81Å; K21-E702 PolarHBondContact NZ-OE2 3.46Å; K21-E712 WeakPolarHBondContact CD-OE2 3.13Å; K21-E712 WeakPolarHBondContact CE-OE2 3.46Å; K21-E712 IonicContact NZ-OE2 2.9Å; K21-E712 PolarHBondContact NZ-OE2 2.89Å
22	K	53.2	Low	69.2	Low	160 Å²	160	70.6 Å²	70.6	70%	0.696	41%	0.406	S	S	*	.	S	Bend	trans	-141.6	153.4	-178.9	-66.4	-178.2	-177.7	174	0	109.5	P20 I24	P20-K22 PolarHBondContact O-N 2.68Å; K22-I24 PolarHBondContact O-N 2.82Å
23	N	54.1	Low	69	Low	163 Å²	163	73 Å²	73	87%	0.872	42%	0.423	S	S	*	.			trans	-58	130.7	176.7	-165.2	20.2	0	0	0	110.1	A25	N23-A25 PolarHBondContact O-N 3.31Å
24	I	63.8	Low	69.1	Low	47 Å²	47	70 Å²	70	24%	0.241	40%	0.402	C	S	.	.			trans	-79.9	119.3	-166.9	-38.7	173.8	0	0	0	108.8	V8 P20 K22 D26 F30	V8-I24 HydrophobicContact CB-CD1 4.47Å; V8-I24 HydrophobicContact CG1-CD1 3.78Å; V8-I24 HydrophobicContact CG2-CD1 4.3Å; P20-I24 HydrophobicContact CB-CG1 4.29Å; P20-I24 HydrophobicContact CG-CD1 3.66Å; P20-I24 HydrophobicContact CG-CG1 3.76Å; K22-I24 PolarHBondContact O-N 2.82Å; I24-D26 WeakPolarHBondContact CG2-O 3.26Å; I24-F30 HydrophobicContact CD1-CD1 3.97Å; I24-F30 HydrophobicContact CD1-CE1 4.35Å; I24-F30 HydrophobicContact CG2-CB 3.78Å; I24-F30 HydrophobicContact CG2-CD1 4.49Å; I24-F30 HydrophobicContact CG2-CG 4.16Å
25	A	59.2	Low	69.4	Low	111 Å²	111	67.6 Å²	67.6	92%	0.917	39%	0.39	S	S	*	.	S	Bend	trans	-71.7	-35.8	-179	0	0	0	0	0	112.5	N23	N23-A25 PolarHBondContact O-N 3.31Å
26	D	72.4	Confident	69.7	Low	77 Å²	77	68.5 Å²	68.5	41%	0.412	38%	0.377	S	S	.	.			trans	-136.8	108.8	170.7	-171.3	-42.8	0	0	0	109.1	I24 E28 E29 F30	I24-D26 WeakPolarHBondContact CG2-O 3.26Å; D26-E28 VanDerWaalsContact C-N 3.33Å; D26-E28 WeakPolarHBondContact OD1-CA 3.43Å; D26-E28 WeakPolarHBondContact OD1-CB 3.4Å; D26-E28 PolarHBondContact OD1-N 3.22Å; D26-E29 HydrophobicContact CB-CB 4.2Å; D26-E29 PolarHBondContact OD1-N 2.87Å; D26-F30 PolarHBondContact O-N 2.89Å
27	P	72.1	Confident	69.7	Low	21 Å²	21	70.3 Å²	70.3	14%	0.136	39%	0.386	C	S	.	.	H	α-helix	trans	-75.7	-18.4	178.9	31.8	-35.5	0	0	0	113.4	E4 E5 L31	E4-P27 HydrophobicContact CB-CB 3.82Å; E4-P27 HydrophobicContact CB-CG 3.77Å; E5-P27 HydrophobicContact CG-CB 4.38Å; E5-P27 HydrophobicContact CG-CG 4.14Å; P27-L31 WeakPolarHBondContact O-CG 3.41Å; P27-L31 PolarHBondContact O-N 3.47Å; P27-L31 VanDerWaalsContact O-N 3.11Å
28	E	76.1	Confident	69.7	Low	66 Å²	66	69.7 Å²	69.7	31%	0.308	38%	0.382	S	S	.	.	H	α-helix	trans	-75.5	-46	177.1	-155.7	-165	148.4	0	0	110.4	E4 D26 F30 L31 K32 F96	E4-E28 HydrophobicContact CG-CB 4.23Å; E4-E28 HydrophobicContact CG-CG 4.34Å; D26-E28 VanDerWaalsContact C-N 3.33Å; D26-E28 WeakPolarHBondContact OD1-CA 3.43Å; D26-E28 WeakPolarHBondContact OD1-CB 3.4Å; D26-E28 PolarHBondContact OD1-N 3.22Å; E28-F30 VanDerWaalsContact C-N 3.35Å; E28-L31 PolarHBondContact O-N 3.41Å; E28-K32 VanDerWaalsContact CD-NZ 3.31Å; E28-K32 WeakPolarHBondContact O-CB 3.5Å; E28-K32 VanDerWaalsContact O-CG 3.28Å; E28-K32 WeakPolarHBondContact O-CG 3.4Å; E28-K32 PolarHBondContact O-N 3.08Å; E28-K32 WeakPolarHBondContact OE1-CE 3.49Å; E28-K32 IonicContact OE1-NZ 3.47Å; E28-K32 PolarHBondContact OE1-NZ 2.82Å; E28-K32 IonicContact OE2-NZ 2.68Å; E28-F96 HydrophobicContact CG-CD1 3.42Å; E28-F96 VanDerWaalsContact CG-CD1 3.42Å; E28-F96 HydrophobicContact CG-CE1 3.78Å; E28-F96 HydrophobicContact CG-CG 4.37Å
29	E	76.1	Confident	70.5	Confident	129 Å²	129	65.3 Å²	65.3	60%	0.603	35%	0.352	S	S	*	.	H	α-helix	trans	-63.7	-39.7	174.8	-171.1	176.9	-143.2	0	0	111.9	D26 K32 T33	D26-E29 HydrophobicContact CB-CB 4.2Å; D26-E29 PolarHBondContact OD1-N 2.87Å; E29-K32 PolarHBondContact O-N 2.84Å; E29-T33 PolarHBondContact O-N 2.78Å; E29-T33 PolarHBondContact O-OG1 2.85Å
30	F	79.9	Confident	71.7	Confident	46 Å²	46	62.2 Å²	62.2	20%	0.202	33%	0.329	C	S	.	.	H	α-helix	trans	-62.9	-43.6	175.2	-179.7	-111.3	0	0	0	112.4	V8 L17 P20 I24 D26 E28 T33 S34	V8-F30 HydrophobicContact CG1-CD1 4.39Å; V8-F30 HydrophobicContact CG1-CE1 4.1Å; V8-F30 HydrophobicContact CG2-CD1 4.04Å; V8-F30 HydrophobicContact CG2-CE1 4.45Å; L17-F30 HydrophobicContact CD2-CE1 4.02Å; P20-F30 HydrophobicContact CB-CE1 4.37Å; P20-F30 HydrophobicContact CB-CE2 4.39Å; P20-F30 HydrophobicContact CB-CZ 3.99Å; P20-F30 HydrophobicContact CG-CE1 4.11Å; P20-F30 HydrophobicContact CG-CZ 4.19Å; I24-F30 HydrophobicContact CD1-CD1 3.97Å; I24-F30 HydrophobicContact CD1-CE1 4.35Å; I24-F30 HydrophobicContact CG2-CB 3.78Å; I24-F30 HydrophobicContact CG2-CD1 4.49Å; I24-F30 HydrophobicContact CG2-CG 4.16Å; D26-F30 PolarHBondContact O-N 2.89Å; E28-F30 VanDerWaalsContact C-N 3.35Å; F30-T33 PolarHBondContact O-OG1 3.35Å; F30-T33 VanDerWaalsContact O-OG1 3.04Å; F30-S34 VanDerWaalsContact O-CB 3.24Å; F30-S34 WeakPolarHBondContact O-CB 3.48Å; F30-S34 PolarHBondContact O-N 3.29Å; F30-S34 PolarHBondContact O-OG 3.45Å
31	L	78.4	Confident	72.6	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-67.9	-41.9	174.8	-74.2	173	0	0	0	112.3	E4 T7 V8 L11 L17 P27 E28 T33 S34 L35 F96 L100	E4-L31 HydrophobicContact CB-CD1 4.17Å; T7-L31 HydrophobicContact CG2-CD1 4.19Å; T7-L31 HydrophobicContact CG2-CD2 4.43Å; V8-L31 HydrophobicContact CG2-CD1 3.94Å; V8-L31 HydrophobicContact CG2-CD2 3.53Å; V8-L31 HydrophobicContact CG2-CG 3.54Å; L11-L31 HydrophobicContact CD1-CD2 3.86Å; L17-L31 HydrophobicContact CD2-CD2 4.44Å; P27-L31 WeakPolarHBondContact O-CG 3.41Å; P27-L31 PolarHBondContact O-N 3.47Å; P27-L31 VanDerWaalsContact O-N 3.11Å; E28-L31 PolarHBondContact O-N 3.41Å; L31-T33 PolarHBondContact O-N 2.99Å; L31-S34 PolarHBondContact O-N 2.79Å; L31-L35 HydrophobicContact CB-CD1 4.36Å; L31-L35 HydrophobicContact CD2-CD1 4.26Å; L31-L35 VanDerWaalsContact O-CB 3.31Å; L31-L35 WeakPolarHBondContact O-CB 3.34Å; L31-L35 VanDerWaalsContact O-CG 3.26Å; L31-L35 WeakPolarHBondContact O-CG 3.27Å; L31-L35 PolarHBondContact O-N 2.93Å; L31-F96 HydrophobicContact CB-CE1 4.16Å; L31-F96 HydrophobicContact CB-CZ 3.62Å; L31-F96 HydrophobicContact CD1-CE1 4.42Å; L31-F96 HydrophobicContact CD1-CZ 4.38Å; L31-L100 HydrophobicContact CD1-CD1 4.02Å
32	K	78.5	Confident	74.2	Confident	61 Å²	61	55.1 Å²	55.1	27%	0.265	29%	0.294	S	S	.	.	H	α-helix	trans	-55.2	-50.2	176.1	-78.6	167.9	-179.2	166.6	0	111.5	E28 E29 K36 F96	E28-K32 VanDerWaalsContact CD-NZ 3.31Å; E28-K32 WeakPolarHBondContact O-CB 3.5Å; E28-K32 VanDerWaalsContact O-CG 3.28Å; E28-K32 WeakPolarHBondContact O-CG 3.4Å; E28-K32 PolarHBondContact O-N 3.08Å; E28-K32 WeakPolarHBondContact OE1-CE 3.49Å; E28-K32 IonicContact OE1-NZ 3.47Å; E28-K32 PolarHBondContact OE1-NZ 2.82Å; E28-K32 IonicContact OE2-NZ 2.68Å; E29-K32 PolarHBondContact O-N 2.84Å; K32-K36 WeakPolarHBondContact O-CB 3.38Å; K32-K36 PolarHBondContact O-N 2.82Å; K32-F96 HydrophobicContact CD-CD2 4.45Å; K32-F96 HydrophobicContact CD-CG 4.32Å; K32-F96 HydrophobicContact CG-CB 4.45Å; K32-F96 HydrophobicContact CG-CD1 4.28Å; K32-F96 HydrophobicContact CG-CD2 3.51Å; K32-F96 HydrophobicContact CG-CE1 4.49Å; K32-F96 HydrophobicContact CG-CE2 3.76Å; K32-F96 HydrophobicContact CG-CG 3.81Å; K32-F96 HydrophobicContact CG-CZ 4.27Å
33	T	76.9	Confident	75.5	Confident	95 Å²	95	51.6 Å²	51.6	58%	0.583	28%	0.279	S	S	*	.	H	α-helix	trans	-66	-40.1	178.2	49.2	0	0	0	0	112.6	E29 F30 L31	E29-T33 PolarHBondContact O-N 2.78Å; E29-T33 PolarHBondContact O-OG1 2.85Å; F30-T33 PolarHBondContact O-OG1 3.35Å; F30-T33 VanDerWaalsContact O-OG1 3.04Å; L31-T33 PolarHBondContact O-N 2.99Å
34	S	78.7	Confident	76.8	Confident	24 Å²	24	43.8 Å²	43.8	17%	0.168	24%	0.238	C	C	.	.	H	α-helix	trans	-79.9	-12.5	-176.1	-52.9	0	0	0	0	115.5	F30 L31 V40	F30-S34 VanDerWaalsContact O-CB 3.24Å; F30-S34 WeakPolarHBondContact O-CB 3.48Å; F30-S34 PolarHBondContact O-N 3.29Å; F30-S34 PolarHBondContact O-OG 3.45Å; L31-S34 PolarHBondContact O-N 2.79Å; S34-V40 VanDerWaalsContact O-CG2 3.31Å; S34-V40 WeakPolarHBondContact O-CG2 3.44Å
35	L	79.3	Confident	77.5	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-111.5	-9.1	-178.6	-61.9	178.7	0	0	0	113.7	L11 L31 D37 G38 V40 L41 L90 L103	L11-L35 HydrophobicContact CD1-CD2 4.18Å; L31-L35 HydrophobicContact CB-CD1 4.36Å; L31-L35 HydrophobicContact CD2-CD1 4.26Å; L31-L35 VanDerWaalsContact O-CB 3.31Å; L31-L35 WeakPolarHBondContact O-CB 3.34Å; L31-L35 VanDerWaalsContact O-CG 3.26Å; L31-L35 WeakPolarHBondContact O-CG 3.27Å; L31-L35 PolarHBondContact O-N 2.93Å; L35-D37 VanDerWaalsContact C-N 3.27Å; L35-D37 PolarHBondContact O-N 3.16Å; L35-G38 PolarHBondContact O-N 3.19Å; L35-G38 VanDerWaalsContact O-N 3.12Å; L35-V40 HydrophobicContact CD2-CB 3.93Å; L35-V40 HydrophobicContact CD2-CG1 3.62Å; L35-L41 HydrophobicContact CD1-CD2 4.46Å; L35-L41 HydrophobicContact CD2-CD2 3.89Å; L35-L41 HydrophobicContact CD2-CG 4.17Å; L35-L90 HydrophobicContact CB-CD1 4.13Å; L35-L90 HydrophobicContact CB-CD2 4.4Å; L35-L103 HydrophobicContact CD1-CD1 3.78Å
36	K	77.9	Confident	78.5	Confident	77 Å²	77	40.6 Å²	40.6	34%	0.335	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-22.5	-173.5	176.3	162.5	175.3	157.1	0	114.8	K32 G38 Y91	K32-K36 WeakPolarHBondContact O-CB 3.38Å; K32-K36 PolarHBondContact O-N 2.82Å; K36-G38 VanDerWaalsContact C-N 3.31Å; K36-Y91 HydrophobicContact CD-CD2 4.46Å; K36-Y91 VanDerWaalsContact CE-O 3.3Å; K36-Y91 WeakPolarHBondContact CE-O 3.42Å; K36-Y91 HydrophobicContact CG-CD2 4.1Å; K36-Y91 HydrophobicContact CG-CE2 4.39Å; K36-Y91 PolarHBondContact NZ-O 3.49Å
37	D	77.9	Confident	78.7	Confident	56 Å²	56	45.1 Å²	45.1	30%	0.299	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-14.3	176	65	11.8	0	0	0	113.8	L35 V39 P60 N69	L35-D37 VanDerWaalsContact C-N 3.27Å; L35-D37 PolarHBondContact O-N 3.16Å; D37-V39 HydrophobicContact CB-CB 4.45Å; D37-V39 HydrophobicContact CB-CG2 4.08Å; D37-V39 PolarHBondContact O-N 3.4Å; D37-V39 VanDerWaalsContact O-N 3.1Å; D37-V39 PolarHBondContact OD1-N 2.89Å; D37-P60 HydrophobicContact CB-CG 4.04Å; D37-N69 WeakPolarHBondContact O-CB 3.24Å; D37-N69 PolarHBondContact O-ND2 3.11Å
38	G	76.3	Confident	78.8	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.217	C	C	.	.	S	Bend	trans	66	-5.4	-170.6	0	0	0	0	0	115.2	L35 K36 L41 C42	L35-G38 PolarHBondContact O-N 3.19Å; L35-G38 VanDerWaalsContact O-N 3.12Å; K36-G38 VanDerWaalsContact C-N 3.31Å; G38-L41 WeakPolarHBondContact O-CB 3.47Å; G38-L41 PolarHBondContact O-N 3.42Å; G38-C42 PolarHBondContact O-N 3.08Å; G38-C42 PolarHBondContact O-SG 2.82Å
39	V	82.3	Confident	78.7	Confident	7 Å²	7	43.9 Å²	43.9	4%	0.042	21%	0.208	C	C	.	.	H	α-helix	trans	-71.1	-44.3	-175.3	176.1	0	0	0	0	110.6	D37 L41 C42 K43 Y56 P60	D37-V39 HydrophobicContact CB-CB 4.45Å; D37-V39 HydrophobicContact CB-CG2 4.08Å; D37-V39 PolarHBondContact O-N 3.4Å; D37-V39 VanDerWaalsContact O-N 3.1Å; D37-V39 PolarHBondContact OD1-N 2.89Å; V39-L41 PolarHBondContact O-N 2.95Å; V39-C42 PolarHBondContact O-N 3.43Å; V39-K43 HydrophobicContact CG1-CD 4.15Å; V39-K43 WeakPolarHBondContact O-CG 3.44Å; V39-K43 PolarHBondContact O-N 3.03Å; V39-K43 VanDerWaalsContact O-N 3.08Å; V39-Y56 HydrophobicContact CG1-CD2 4.44Å; V39-Y56 HydrophobicContact CG1-CE2 4.07Å; V39-P60 HydrophobicContact CG2-CG 4.04Å
40	V	83.6	Confident	78	Confident	17 Å²	17	43.8 Å²	43.8	10%	0.103	22%	0.218	C	C	.	.	H	α-helix	trans	-60.4	-38.6	173.2	177.9	0	0	0	0	110.3	V16 S34 L35 L44	V16-V40 HydrophobicContact CG1-CG1 3.98Å; V16-V40 WeakPolarHBondContact CG1-O 3.46Å; S34-V40 VanDerWaalsContact O-CG2 3.31Å; S34-V40 WeakPolarHBondContact O-CG2 3.44Å; L35-V40 HydrophobicContact CD2-CB 3.93Å; L35-V40 HydrophobicContact CD2-CG1 3.62Å; V40-L44 WeakPolarHBondContact O-CB 3.22Å; V40-L44 PolarHBondContact O-N 3.09Å
41	L	82	Confident	77	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-68.7	-44.1	178	-67.3	-177.7	0	0	0	112.8	L35 G38 V39 K43 L44 T45 F73 F85 L90 L103	L35-L41 HydrophobicContact CD1-CD2 4.46Å; L35-L41 HydrophobicContact CD2-CD2 3.89Å; L35-L41 HydrophobicContact CD2-CG 4.17Å; G38-L41 WeakPolarHBondContact O-CB 3.47Å; G38-L41 PolarHBondContact O-N 3.42Å; V39-L41 PolarHBondContact O-N 2.95Å; L41-K43 PolarHBondContact O-N 2.84Å; L41-L44 VanDerWaalsContact O-CB 3.32Å; L41-L44 WeakPolarHBondContact O-CB 3.44Å; L41-L44 PolarHBondContact O-N 2.84Å; L41-T45 PolarHBondContact O-N 3.01Å; L41-T45 VanDerWaalsContact O-N 3.15Å; L41-T45 PolarHBondContact O-OG1 2.79Å; L41-F73 HydrophobicContact CB-CB 3.87Å; L41-F73 HydrophobicContact CB-CD1 4.26Å; L41-F73 HydrophobicContact CB-CD2 3.67Å; L41-F73 HydrophobicContact CB-CE2 4.28Å; L41-F73 HydrophobicContact CB-CG 3.67Å; L41-F73 HydrophobicContact CD1-CD1 3.97Å; L41-F73 HydrophobicContact CD1-CE1 4.3Å; L41-F73 HydrophobicContact CD1-CG 4.22Å; L41-F73 HydrophobicContact CD2-CD2 4.33Å; L41-F73 HydrophobicContact CD2-CE1 4.31Å; L41-F73 HydrophobicContact CD2-CE2 4.1Å; L41-F73 HydrophobicContact CD2-CZ 4.09Å; L41-F73 HydrophobicContact CG-CD2 4.47Å; L41-F73 HydrophobicContact CG-CG 4.38Å; L41-F73 VanDerWaalsContact O-CD2 3.31Å; L41-F73 WeakPolarHBondContact O-CD2 3.38Å; L41-F85 HydrophobicContact CD1-CZ 4.42Å; L41-L90 HydrophobicContact CD1-CD2 3.46Å; L41-L90 VanDerWaalsContact CD1-CD2 3.46Å; L41-L103 HydrophobicContact CD2-CD2 3.78Å
42	C	80.6	Confident	76.6	Confident	0 Å²	0	47 Å²	47	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-63.8	-41.2	176.6	-65.4	0	0	0	0	112.4	G38 V39 L44 T45 E46 P54 Y56 N69	G38-C42 PolarHBondContact O-N 3.08Å; G38-C42 PolarHBondContact O-SG 2.82Å; V39-C42 PolarHBondContact O-N 3.43Å; C42-L44 VanDerWaalsContact C-N 3.28Å; C42-L44 PolarHBondContact O-N 3.03Å; C42-T45 PolarHBondContact O-N 3.48Å; C42-E46 WeakPolarHBondContact O-CB 3.4Å; C42-E46 PolarHBondContact O-N 3.26Å; C42-P54 HydrophobicContact CB-CB 4.22Å; C42-P54 HydrophobicContact CB-CG 4.05Å; C42-Y56 HydrophobicContact CB-CD1 3.44Å; C42-Y56 VanDerWaalsContact CB-CD1 3.44Å; C42-Y56 HydrophobicContact CB-CD2 3.93Å; C42-Y56 HydrophobicContact CB-CE1 3.85Å; C42-Y56 HydrophobicContact CB-CE2 4.31Å; C42-Y56 HydrophobicContact CB-CG 3.46Å; C42-Y56 VanDerWaalsContact CB-CG 3.46Å; C42-Y56 VanDerWaalsContact SG-CB 3.52Å; C42-N69 PolarHBondContact SG-O 3.12Å
43	K	80	Confident	75.9	Confident	86 Å²	86	49.3 Å²	49.3	37%	0.374	27%	0.274	S	S	.	.	H	α-helix	trans	-61.6	-35	173.9	-70.8	169.3	180	171.6	0	112.3	V16 V39 L41 E46 R47 Y56	V16-K43 HydrophobicContact CG1-CB 3.65Å; V39-K43 HydrophobicContact CG1-CD 4.15Å; V39-K43 WeakPolarHBondContact O-CG 3.44Å; V39-K43 PolarHBondContact O-N 3.03Å; V39-K43 VanDerWaalsContact O-N 3.08Å; L41-K43 PolarHBondContact O-N 2.84Å; K43-E46 PolarHBondContact O-N 2.84Å; K43-R47 WeakPolarHBondContact O-CG 3.31Å; K43-R47 PolarHBondContact O-N 3.08Å; K43-R47 VanDerWaalsContact O-N 3.12Å; K43-Y56 HydrophobicContact CG-CE2 4.37Å; K43-Y56 VanDerWaalsContact CG-OH 3.29Å; K43-Y56 WeakPolarHBondContact CG-OH 3.38Å
44	L	81.1	Confident	75.5	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-62.8	-45.1	174.3	-176.1	66.2	0	0	0	111.6	W10 L11 L14 V16 V40 L41 C42 R47 L48 F73 L103 F106	W10-L44 HydrophobicContact CH2-CD1 4.08Å; W10-L44 HydrophobicContact CH2-CD2 3.87Å; W10-L44 HydrophobicContact CH2-CG 4.4Å; W10-L44 HydrophobicContact CZ2-CD1 4.26Å; W10-L44 HydrophobicContact CZ3-CD2 4.04Å; L11-L44 HydrophobicContact CD2-CD1 3.84Å; L11-L44 HydrophobicContact CD2-CD2 3.68Å; L11-L44 HydrophobicContact CD2-CG 4.32Å; L14-L44 HydrophobicContact CD1-CD1 3.52Å; V16-L44 HydrophobicContact CG1-CB 4.18Å; V16-L44 HydrophobicContact CG2-CD1 4.18Å; V40-L44 WeakPolarHBondContact O-CB 3.22Å; V40-L44 PolarHBondContact O-N 3.09Å; L41-L44 VanDerWaalsContact O-CB 3.32Å; L41-L44 WeakPolarHBondContact O-CB 3.44Å; L41-L44 PolarHBondContact O-N 2.84Å; C42-L44 VanDerWaalsContact C-N 3.28Å; C42-L44 PolarHBondContact O-N 3.03Å; L44-R47 PolarHBondContact O-N 2.87Å; L44-L48 HydrophobicContact CD1-CD1 3.59Å; L44-L48 HydrophobicContact CD1-CG 4.4Å; L44-L48 HydrophobicContact CG-CD1 4.02Å; L44-L48 WeakPolarHBondContact O-CB 3.44Å; L44-L48 PolarHBondContact O-N 2.9Å; L44-L48 VanDerWaalsContact O-N 3.08Å; L44-F73 HydrophobicContact CD2-CE2 4.24Å; L44-L103 HydrophobicContact CD2-CD2 3.88Å; L44-F106 HydrophobicContact CG-CE1 4.46Å
45	T	78.8	Confident	75.1	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-65.7	-43.1	176.4	-43.5	0	0	0	0	112.3	L41 C42 R47 L48 I49 F52 F73 F106	L41-T45 PolarHBondContact O-N 3.01Å; L41-T45 VanDerWaalsContact O-N 3.15Å; L41-T45 PolarHBondContact O-OG1 2.79Å; C42-T45 PolarHBondContact O-N 3.48Å; T45-R47 PolarHBondContact O-N 2.94Å; T45-L48 PolarHBondContact O-N 2.88Å; T45-I49 HydrophobicContact CG2-CB 4.39Å; T45-I49 HydrophobicContact CG2-CD1 3.58Å; T45-I49 HydrophobicContact CG2-CG1 3.98Å; T45-I49 PolarHBondContact O-N 2.82Å; T45-F52 HydrophobicContact CG2-CD1 3.39Å; T45-F52 HydrophobicContact CG2-CE1 3.56Å; T45-F52 HydrophobicContact CG2-CG 4.23Å; T45-F52 HydrophobicContact CG2-CZ 4.5Å; T45-F73 VanDerWaalsContact OG1-CD2 3.26Å; T45-F73 WeakPolarHBondContact OG1-CD2 3.4Å; T45-F106 HydrophobicContact CG2-CZ 4.29Å
46	E	80.6	Confident	74.9	Confident	90 Å²	90	54.9 Å²	54.9	42%	0.421	29%	0.288	S	S	.	.	H	α-helix	trans	-59.2	-33.6	178.1	-177.4	174.4	-164.3	0	0	112.4	C42 K43 P54 Y56	C42-E46 WeakPolarHBondContact O-CB 3.4Å; C42-E46 PolarHBondContact O-N 3.26Å; K43-E46 PolarHBondContact O-N 2.84Å; E46-P54 HydrophobicContact CB-CG 4.27Å; E46-Y56 PolarHBondContact OE2-OH 3.4Å
47	R	75.2	Confident	74.5	Confident	173 Å²	173	53.6 Å²	53.6	65%	0.653	29%	0.288	S	S	*	.	H	α-helix	trans	-82.7	-31.8	176.6	-69.1	-65.1	-176.6	85.3	-4	114.4	K43 L44 T45	K43-R47 WeakPolarHBondContact O-CG 3.31Å; K43-R47 PolarHBondContact O-N 3.08Å; K43-R47 VanDerWaalsContact O-N 3.12Å; L44-R47 PolarHBondContact O-N 2.87Å; T45-R47 PolarHBondContact O-N 2.94Å
48	L	74	Confident	73.9	Confident	37 Å²	37	57.8 Å²	57.8	19%	0.194	31%	0.306	C	S	.	.	H	α-helix	trans	-102.1	-13.1	-172.5	-67.8	175.6	0	0	0	115.2	W10 L14 L44 T45 F106 T110	W10-L48 HydrophobicContact CH2-CD1 4.26Å; W10-L48 HydrophobicContact CZ2-CD1 3.69Å; L14-L48 HydrophobicContact CD1-CD1 3.76Å; L14-L48 HydrophobicContact CD1-CD2 4.13Å; L14-L48 HydrophobicContact CD1-CG 4.21Å; L14-L48 HydrophobicContact CD2-CD2 4.13Å; L44-L48 HydrophobicContact CD1-CD1 3.59Å; L44-L48 HydrophobicContact CD1-CG 4.4Å; L44-L48 HydrophobicContact CG-CD1 4.02Å; L44-L48 WeakPolarHBondContact O-CB 3.44Å; L44-L48 PolarHBondContact O-N 2.9Å; L44-L48 VanDerWaalsContact O-N 3.08Å; T45-L48 PolarHBondContact O-N 2.88Å; L48-F106 HydrophobicContact CB-CE1 4.11Å; L48-F106 HydrophobicContact CD1-CD1 4.17Å; L48-F106 HydrophobicContact CD1-CE1 3.78Å; L48-T110 HydrophobicContact CB-CG2 3.8Å; L48-T110 HydrophobicContact CD1-CG2 4.19Å; L48-T110 HydrophobicContact CG-CG2 4.49Å
49	I	73.8	Confident	73.5	Confident	24 Å²	24	64.3 Å²	64.3	12%	0.123	34%	0.341	C	S	.	.	S	Bend	trans	-118.8	94.8	176	-52	-172.6	0	0	0	109.9	T45 G51 F52 G76 L80 F106	T45-I49 HydrophobicContact CG2-CB 4.39Å; T45-I49 HydrophobicContact CG2-CD1 3.58Å; T45-I49 HydrophobicContact CG2-CG1 3.98Å; T45-I49 PolarHBondContact O-N 2.82Å; I49-G51 PolarHBondContact O-N 2.86Å; I49-G51 VanDerWaalsContact O-N 3.11Å; I49-F52 HydrophobicContact CB-CB 3.86Å; I49-F52 HydrophobicContact CG2-CB 3.63Å; I49-F52 PolarHBondContact O-N 2.96Å; I49-G76 WeakPolarHBondContact CD1-O 3.03Å; I49-L80 HydrophobicContact CD1-CD1 3.78Å; I49-L80 HydrophobicContact CD1-CD2 4.34Å; I49-L80 HydrophobicContact CD1-CG 3.8Å; I49-L80 HydrophobicContact CG1-CD1 4.06Å; I49-L80 HydrophobicContact CG1-CG 4.39Å; I49-F106 HydrophobicContact CD1-CE2 4.26Å; I49-F106 HydrophobicContact CD1-CZ 4.03Å; I49-F106 HydrophobicContact CG1-CZ 4.22Å
50	P	61.5	Low	72.9	Confident	127 Å²	127	65.3 Å²	65.3	83%	0.825	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	117.2	-179.1	-27.4	35.8	0	0	0	112.9
51	G	60.2	Low	72	Confident	79 Å²	79	75.4 Å²	75.4	81%	0.814	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.1	-2.5	179.6	0	0	0	0	0	115.7	I49	I49-G51 PolarHBondContact O-N 2.86Å; I49-G51 VanDerWaalsContact O-N 3.11Å
52	F	70.1	Confident	71.5	Confident	34 Å²	34	79 Å²	79	15%	0.149	41%	0.406	C	S	.	.			trans	-86.5	108.3	169	-174.5	-91.4	0	0	0	110.1	T45 I49 P54 R75	T45-F52 HydrophobicContact CG2-CD1 3.39Å; T45-F52 HydrophobicContact CG2-CE1 3.56Å; T45-F52 HydrophobicContact CG2-CG 4.23Å; T45-F52 HydrophobicContact CG2-CZ 4.5Å; I49-F52 HydrophobicContact CB-CB 3.86Å; I49-F52 HydrophobicContact CG2-CB 3.63Å; I49-F52 PolarHBondContact O-N 2.96Å; F52-P54 HydrophobicContact CD1-CB 4.46Å; F52-P54 HydrophobicContact CD1-CG 4.42Å; F52-P54 HydrophobicContact CE1-CB 3.92Å; F52-P54 HydrophobicContact CE1-CG 4.32Å; F52-P54 VanDerWaalsContact O-CD 3.25Å; F52-P54 WeakPolarHBondContact O-CD 3.37Å; F52-R75 HydrophobicContact CZ-CB 4.45Å
53	T	64	Low	71.1	Confident	110 Å²	110	83.3 Å²	83.3	68%	0.675	43%	0.429	S	S	*	.			trans	-100.9	99	174.6	41.7	0	0	0	0	110.3
54	P	68.6	Low	70.8	Confident	13 Å²	13	82.6 Å²	82.6	8%	0.084	44%	0.439	C	S	.	.			trans	-66.6	142.5	174.8	24.4	-27.6	0	0	0	110.5	C42 E46 F52 Y56 E72	C42-P54 HydrophobicContact CB-CB 4.22Å; C42-P54 HydrophobicContact CB-CG 4.05Å; E46-P54 HydrophobicContact CB-CG 4.27Å; F52-P54 HydrophobicContact CD1-CB 4.46Å; F52-P54 HydrophobicContact CD1-CG 4.42Å; F52-P54 HydrophobicContact CE1-CB 3.92Å; F52-P54 HydrophobicContact CE1-CG 4.32Å; F52-P54 VanDerWaalsContact O-CD 3.25Å; F52-P54 WeakPolarHBondContact O-CD 3.37Å; P54-Y56 HydrophobicContact CB-CD1 3.94Å; P54-Y56 HydrophobicContact CG-CD1 3.77Å; P54-Y56 HydrophobicContact CG-CE1 3.93Å; P54-Y56 WeakPolarHBondContact O-CD1 3.28Å; P54-Y56 PolarHBondContact O-N 3.36Å; P54-E72 HydrophobicContact CB-CB 4.26Å
55	K	69.6	Low	70.6	Confident	181 Å²	181	84.9 Å²	84.9	79%	0.787	45%	0.451	S	S	*	.			trans	-99	77.6	174.7	-73.7	-174.2	172.7	-177.3	0	109.3	E72	K55-E72 PolarHBondContact N-OE2 3.16Å
56	Y	75.9	Confident	70.6	Confident	41 Å²	41	85.6 Å²	85.6	16%	0.161	46%	0.456	C	S	.	.			trans	-106.4	149.7	-177.1	67.5	-83.3	0	0	0	112.4	V39 C42 K43 E46 P54 Q58 N69	V39-Y56 HydrophobicContact CG1-CD2 4.44Å; V39-Y56 HydrophobicContact CG1-CE2 4.07Å; C42-Y56 HydrophobicContact CB-CD1 3.44Å; C42-Y56 VanDerWaalsContact CB-CD1 3.44Å; C42-Y56 HydrophobicContact CB-CD2 3.93Å; C42-Y56 HydrophobicContact CB-CE1 3.85Å; C42-Y56 HydrophobicContact CB-CE2 4.31Å; C42-Y56 HydrophobicContact CB-CG 3.46Å; C42-Y56 VanDerWaalsContact CB-CG 3.46Å; C42-Y56 VanDerWaalsContact SG-CB 3.52Å; K43-Y56 HydrophobicContact CG-CE2 4.37Å; K43-Y56 VanDerWaalsContact CG-OH 3.29Å; K43-Y56 WeakPolarHBondContact CG-OH 3.38Å; E46-Y56 PolarHBondContact OE2-OH 3.4Å; P54-Y56 HydrophobicContact CB-CD1 3.94Å; P54-Y56 HydrophobicContact CG-CD1 3.77Å; P54-Y56 HydrophobicContact CG-CE1 3.93Å; P54-Y56 WeakPolarHBondContact O-CD1 3.28Å; P54-Y56 PolarHBondContact O-N 3.36Å; Y56-Q58 HydrophobicContact CD2-CG 4.49Å; Y56-Q58 HydrophobicContact CE2-CG 4.05Å; Y56-N69 WeakPolarHBondContact CA-OD1 3.45Å; Y56-N69 WeakPolarHBondContact CB-OD1 3.42Å
57	S	68.9	Low	70.6	Confident	50 Å²	50	82.8 Å²	82.8	35%	0.35	44%	0.444	S	S	.	.			trans	-79.3	122.4	172	-69.3	0	0	0	0	109	N69	S57-N69 PolarHBondContact N-OD1 2.88Å; S57-N69 PolarHBondContact O-ND2 3.38Å
58	Q	65.9	Low	70.9	Confident	145 Å²	145	77.3 Å²	77.3	68%	0.678	43%	0.432	S	S	*	.	S	Bend	trans	-70.8	-36.5	-178.8	-69.9	-176.5	-15.4	0	0	113	Y56 P60	Y56-Q58 HydrophobicContact CD2-CG 4.49Å; Y56-Q58 HydrophobicContact CE2-CG 4.05Å; Q58-P60 WeakPolarHBondContact O-CD 3.21Å
59	D	66.8	Low	71.4	Confident	137 Å²	137	75.5 Å²	75.5	73%	0.733	42%	0.422	S	S	*	.	S	Bend	trans	-115.1	82.5	169.7	-73.3	-50.3	0	0	0	109.7	R61	D59-R61 PolarHBondContact O-N 2.74Å
60	P	69.3	Low	71.8	Confident	28 Å²	28	74.4 Å²	74.4	18%	0.182	42%	0.417	C	S	.	.			trans	-69.4	114.8	176.3	29.4	-33.1	0	0	0	109.7	D37 V39 Q58 D65	D37-P60 HydrophobicContact CB-CG 4.04Å; V39-P60 HydrophobicContact CG2-CG 4.04Å; Q58-P60 WeakPolarHBondContact O-CD 3.21Å; P60-D65 HydrophobicContact CB-CB 3.48Å; P60-D65 VanDerWaalsContact CB-CB 3.48Å
61	R	64.4	Low	72.8	Confident	229 Å²	229	73.8 Å²	73.8	86%	0.864	40%	0.401	S	S	*	.			trans	-107.4	0.1	-176.7	-76.2	-171.7	-75.3	177.5	-6.2	114	D59 D65	D59-R61 PolarHBondContact O-N 2.74Å; R61-D65 PolarHBondContact N-OD2 2.89Å
62	T	72.3	Confident	73.8	Confident	74 Å²	74	71.2 Å²	71.2	45%	0.454	37%	0.368	S	S	.	.	S	Bend	trans	-132.9	155.2	171.5	73.1	0	0	0	0	110.7	A64 D65 C66	T62-A64 PolarHBondContact O-N 2.86Å; T62-A64 VanDerWaalsContact O-N 3.17Å; T62-D65 WeakPolarHBondContact CB-OD2 3.5Å; T62-D65 PolarHBondContact N-OD2 2.84Å; T62-D65 WeakPolarHBondContact O-CB 3.42Å; T62-D65 PolarHBondContact O-N 2.92Å; T62-D65 VanDerWaalsContact OG1-CG 3.27Å; T62-D65 PolarHBondContact OG1-N 3.3Å; T62-D65 PolarHBondContact OG1-OD2 2.56Å; T62-C66 PolarHBondContact O-N 2.91Å
63	D	71.8	Confident	74.5	Confident	91 Å²	91	69.6 Å²	69.6	49%	0.487	36%	0.361	S	S	.	.	H	α-helix	trans	-60.5	-28.7	179	-55	-36.9	0	0	0	112.4	D65 C66 I67 Y91	D63-D65 VanDerWaalsContact C-N 3.34Å; D63-C66 PolarHBondContact O-N 2.74Å; D63-I67 WeakPolarHBondContact O-CB 3.48Å; D63-I67 VanDerWaalsContact O-CG1 3.3Å; D63-I67 WeakPolarHBondContact O-CG1 3.32Å; D63-I67 PolarHBondContact O-N 3.34Å; D63-Y91 HydrophobicContact CB-CE2 4.25Å; D63-Y91 VanDerWaalsContact CG-OH 3.25Å; D63-Y91 PolarHBondContact OD1-OH 2.65Å
64	A	73.9	Confident	75.3	Confident	71 Å²	71	65.2 Å²	65.2	59%	0.587	33%	0.333	S	S	*	.	H	α-helix	trans	-64.7	-35.5	173.3	0	0	0	0	0	112.5	T62 S68	T62-A64 PolarHBondContact O-N 2.86Å; T62-A64 VanDerWaalsContact O-N 3.17Å; A64-S68 VanDerWaalsContact O-CB 3.24Å; A64-S68 WeakPolarHBondContact O-CB 3.46Å; A64-S68 PolarHBondContact O-N 3.42Å
65	D	77.6	Confident	75.8	Confident	48 Å²	48	70 Å²	70	26%	0.257	35%	0.35	S	S	.	.	H	α-helix	trans	-68.3	-46.9	175.5	-58.2	-59.7	0	0	0	110.9	P60 R61 T62 D63 I67 S68 N69	P60-D65 HydrophobicContact CB-CB 3.48Å; P60-D65 VanDerWaalsContact CB-CB 3.48Å; R61-D65 PolarHBondContact N-OD2 2.89Å; T62-D65 WeakPolarHBondContact CB-OD2 3.5Å; T62-D65 PolarHBondContact N-OD2 2.84Å; T62-D65 WeakPolarHBondContact O-CB 3.42Å; T62-D65 PolarHBondContact O-N 2.92Å; T62-D65 VanDerWaalsContact OG1-CG 3.27Å; T62-D65 PolarHBondContact OG1-N 3.3Å; T62-D65 PolarHBondContact OG1-OD2 2.56Å; D63-D65 VanDerWaalsContact C-N 3.34Å; D65-I67 PolarHBondContact O-N 2.89Å; D65-S68 WeakPolarHBondContact O-CB 3.41Å; D65-S68 PolarHBondContact O-N 3.47Å; D65-S68 VanDerWaalsContact O-N 3.12Å; D65-N69 PolarHBondContact O-N 2.89Å; D65-N69 PolarHBondContact O-OD1 2.79Å
66	C	79.3	Confident	76.1	Confident	15 Å²	15	61.4 Å²	61.4	10%	0.101	31%	0.312	C	S	.	.	H	α-helix	trans	-58.4	-47.9	176.6	-61	0	0	0	0	111.3	T62 D63 S68 N69 I70 Y91	T62-C66 PolarHBondContact O-N 2.91Å; D63-C66 PolarHBondContact O-N 2.74Å; C66-S68 VanDerWaalsContact C-N 3.28Å; C66-S68 PolarHBondContact O-N 2.93Å; C66-N69 PolarHBondContact O-N 3.13Å; C66-I70 VanDerWaalsContact O-CG1 3.3Å; C66-I70 WeakPolarHBondContact O-CG1 3.49Å; C66-I70 PolarHBondContact O-N 3.47Å; C66-Y91 HydrophobicContact CB-CD2 4.16Å; C66-Y91 HydrophobicContact CB-CE2 4.27Å
67	I	80.4	Confident	76.2	Confident	32 Å²	32	59.5 Å²	59.5	16%	0.164	31%	0.305	C	S	.	.	H	α-helix	trans	-65.5	-32	177.3	-70	169.1	0	0	0	111.3	D63 D65 K71 P87	D63-I67 WeakPolarHBondContact O-CB 3.48Å; D63-I67 VanDerWaalsContact O-CG1 3.3Å; D63-I67 WeakPolarHBondContact O-CG1 3.32Å; D63-I67 PolarHBondContact O-N 3.34Å; D65-I67 PolarHBondContact O-N 2.89Å; I67-K71 HydrophobicContact CG2-CD 4.05Å; I67-K71 WeakPolarHBondContact O-CB 3.45Å; I67-K71 WeakPolarHBondContact O-CD 3.01Å; I67-K71 VanDerWaalsContact O-CG 3.24Å; I67-K71 WeakPolarHBondContact O-CG 3.29Å; I67-K71 PolarHBondContact O-N 3.46Å; I67-P87 HydrophobicContact CG2-CB 4.15Å
68	S	80.6	Confident	76.5	Confident	57 Å²	57	61 Å²	61	40%	0.399	32%	0.316	S	S	.	.	H	α-helix	trans	-67.2	-46.2	173.3	-169.4	0	0	0	0	111.8	A64 D65 C66 I70 K71 E72	A64-S68 VanDerWaalsContact O-CB 3.24Å; A64-S68 WeakPolarHBondContact O-CB 3.46Å; A64-S68 PolarHBondContact O-N 3.42Å; D65-S68 WeakPolarHBondContact O-CB 3.41Å; D65-S68 PolarHBondContact O-N 3.47Å; D65-S68 VanDerWaalsContact O-N 3.12Å; C66-S68 VanDerWaalsContact C-N 3.28Å; C66-S68 PolarHBondContact O-N 2.93Å; S68-I70 VanDerWaalsContact C-N 3.35Å; S68-I70 PolarHBondContact O-N 3.08Å; S68-K71 WeakPolarHBondContact O-CB 3.39Å; S68-K71 PolarHBondContact O-N 3.48Å; S68-K71 VanDerWaalsContact O-N 3.14Å; S68-E72 PolarHBondContact O-N 2.89Å
69	N	84.3	Confident	76.9	Confident	0 Å²	0	58 Å²	58	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-58.1	-45.8	175.2	-69.4	-7.4	0	0	0	111.3	D37 C42 Y56 S57 D65 C66 K71 E72 F73	D37-N69 WeakPolarHBondContact O-CB 3.24Å; D37-N69 PolarHBondContact O-ND2 3.11Å; C42-N69 PolarHBondContact SG-O 3.12Å; Y56-N69 WeakPolarHBondContact CA-OD1 3.45Å; Y56-N69 WeakPolarHBondContact CB-OD1 3.42Å; S57-N69 PolarHBondContact N-OD1 2.88Å; S57-N69 PolarHBondContact O-ND2 3.38Å; D65-N69 PolarHBondContact O-N 2.89Å; D65-N69 PolarHBondContact O-OD1 2.79Å; C66-N69 PolarHBondContact O-N 3.13Å; N69-K71 VanDerWaalsContact C-N 3.3Å; N69-K71 PolarHBondContact O-N 3.42Å; N69-E72 WeakPolarHBondContact O-CB 3.41Å; N69-E72 PolarHBondContact O-N 3.49Å; N69-E72 VanDerWaalsContact O-N 3.15Å; N69-F73 PolarHBondContact O-N 2.89Å; N69-F73 VanDerWaalsContact O-N 3.09Å
70	I	83.1	Confident	77.1	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-62.7	-36.3	177.2	-63.8	164.2	0	0	0	111.3	C66 S68 F73 L74 F85 P87 L90	C66-I70 VanDerWaalsContact O-CG1 3.3Å; C66-I70 WeakPolarHBondContact O-CG1 3.49Å; C66-I70 PolarHBondContact O-N 3.47Å; S68-I70 VanDerWaalsContact C-N 3.35Å; S68-I70 PolarHBondContact O-N 3.08Å; I70-F73 PolarHBondContact O-N 2.99Å; I70-L74 HydrophobicContact CG2-CD1 4.01Å; I70-L74 WeakPolarHBondContact O-CD1 3.41Å; I70-L74 WeakPolarHBondContact O-CG 3.47Å; I70-L74 PolarHBondContact O-N 2.81Å; I70-F85 HydrophobicContact CG2-CE2 3.76Å; I70-F85 HydrophobicContact CG2-CZ 4.2Å; I70-P87 HydrophobicContact CB-CB 4.4Å; I70-P87 HydrophobicContact CG2-CB 3.88Å; I70-L90 HydrophobicContact CD1-CB 4.32Å; I70-L90 HydrophobicContact CD1-CD2 3.98Å; I70-L90 HydrophobicContact CD1-CG 4.15Å; I70-L90 HydrophobicContact CG1-CD2 4.1Å; I70-L90 HydrophobicContact CG2-CD2 4.38Å
71	K	81.3	Confident	77.2	Confident	115 Å²	115	61.5 Å²	61.5	50%	0.5	32%	0.318	S	S	.	.	H	α-helix	trans	-68.3	-35.4	173.9	-74.5	167.4	-178.3	172.4	0	113.1	I67 S68 N69 L74 R75 P87	I67-K71 HydrophobicContact CG2-CD 4.05Å; I67-K71 WeakPolarHBondContact O-CB 3.45Å; I67-K71 WeakPolarHBondContact O-CD 3.01Å; I67-K71 VanDerWaalsContact O-CG 3.24Å; I67-K71 WeakPolarHBondContact O-CG 3.29Å; I67-K71 PolarHBondContact O-N 3.46Å; S68-K71 WeakPolarHBondContact O-CB 3.39Å; S68-K71 PolarHBondContact O-N 3.48Å; S68-K71 VanDerWaalsContact O-N 3.14Å; N69-K71 VanDerWaalsContact C-N 3.3Å; N69-K71 PolarHBondContact O-N 3.42Å; K71-L74 PolarHBondContact O-N 3.41Å; K71-R75 PolarHBondContact O-N 2.6Å; K71-R75 VanDerWaalsContact O-N 3.09Å; K71-P87 HydrophobicContact CD-CG 4.27Å; K71-P87 HydrophobicContact CG-CB 4.2Å; K71-P87 HydrophobicContact CG-CG 3.56Å
72	E	81.5	Confident	77.8	Confident	24 Å²	24	51.5 Å²	51.5	11%	0.112	28%	0.282	C	S	.	.	H	α-helix	trans	-62.3	-43	172.3	-70.5	-75	119.3	0	0	111.6	P54 K55 S68 N69 R75 G76	P54-E72 HydrophobicContact CB-CB 4.26Å; K55-E72 PolarHBondContact N-OE2 3.16Å; S68-E72 PolarHBondContact O-N 2.89Å; N69-E72 WeakPolarHBondContact O-CB 3.41Å; N69-E72 PolarHBondContact O-N 3.49Å; N69-E72 VanDerWaalsContact O-N 3.15Å; E72-R75 VanDerWaalsContact CD-NH2 3.31Å; E72-R75 PolarHBondContact O-N 2.98Å; E72-R75 IonicContact OE1-CZ 2.76Å; E72-R75 IonicContact OE1-NH1 2.8Å; E72-R75 PolarHBondContact OE1-NH1 3.18Å; E72-R75 IonicContact OE1-NH2 2.76Å; E72-R75 PolarHBondContact OE1-NH2 2.54Å; E72-R75 IonicContact OE2-CZ 2.68Å; E72-R75 IonicContact OE2-NH1 3.83Å; E72-R75 IonicContact OE2-NH2 3.56Å; E72-R75 PolarHBondContact OE2-NH2 3.31Å; E72-G76 PolarHBondContact O-N 3.42Å
73	F	84.1	Confident	77.6	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-60.6	-48.6	173.9	168.7	-103.1	0	0	0	112.5	L41 L44 T45 N69 I70 R75 G76 C77 F85 L103 F106	L41-F73 HydrophobicContact CB-CB 3.87Å; L41-F73 HydrophobicContact CB-CD1 4.26Å; L41-F73 HydrophobicContact CB-CD2 3.67Å; L41-F73 HydrophobicContact CB-CE2 4.28Å; L41-F73 HydrophobicContact CB-CG 3.67Å; L41-F73 HydrophobicContact CD1-CD1 3.97Å; L41-F73 HydrophobicContact CD1-CE1 4.3Å; L41-F73 HydrophobicContact CD1-CG 4.22Å; L41-F73 HydrophobicContact CD2-CD2 4.33Å; L41-F73 HydrophobicContact CD2-CE1 4.31Å; L41-F73 HydrophobicContact CD2-CE2 4.1Å; L41-F73 HydrophobicContact CD2-CZ 4.09Å; L41-F73 HydrophobicContact CG-CD2 4.47Å; L41-F73 HydrophobicContact CG-CG 4.38Å; L41-F73 VanDerWaalsContact O-CD2 3.31Å; L41-F73 WeakPolarHBondContact O-CD2 3.38Å; L44-F73 HydrophobicContact CD2-CE2 4.24Å; T45-F73 VanDerWaalsContact OG1-CD2 3.26Å; T45-F73 WeakPolarHBondContact OG1-CD2 3.4Å; N69-F73 PolarHBondContact O-N 2.89Å; N69-F73 VanDerWaalsContact O-N 3.09Å; I70-F73 PolarHBondContact O-N 2.99Å; F73-R75 PolarHBondContact O-N 2.9Å; F73-G76 WeakPolarHBondContact O-CA 3.27Å; F73-G76 PolarHBondContact O-N 2.79Å; F73-C77 WeakPolarHBondContact CE1-SG 3.33Å; F73-C77 WeakPolarHBondContact CZ-SG 3.4Å; F73-C77 PolarHBondContact O-N 2.85Å; F73-C77 PolarHBondContact O-SG 2.79Å; F73-C77 VanDerWaalsContact O-SG 3.38Å; F73-F85 HydrophobicContact CD1-CE1 4.45Å; F73-F85 HydrophobicContact CD1-CZ 4.33Å; F73-F85 AromaticContact CE1-CE1 3.94Å; F73-F85 HydrophobicContact CE1-CE1 3.94Å; F73-F85 HydrophobicContact CE1-CZ 4.22Å; F73-L103 HydrophobicContact CE2-CD2 4.5Å; F73-L103 HydrophobicContact CZ-CD2 3.86Å; F73-F106 HydrophobicContact CE2-CE2 4.44Å
74	L	81.9	Confident	77.5	Confident	19 Å²	19	54.2 Å²	54.2	10%	0.099	30%	0.3	C	S	.	.	H	α-helix	trans	-64.3	-28.5	-179.4	-70.2	163	0	0	0	112.6	I70 K71 G76 C77 S78 F85 P87	I70-L74 HydrophobicContact CG2-CD1 4.01Å; I70-L74 WeakPolarHBondContact O-CD1 3.41Å; I70-L74 WeakPolarHBondContact O-CG 3.47Å; I70-L74 PolarHBondContact O-N 2.81Å; K71-L74 PolarHBondContact O-N 3.41Å; L74-G76 VanDerWaalsContact C-N 3.34Å; L74-C77 WeakPolarHBondContact O-CB 3.25Å; L74-C77 PolarHBondContact O-N 2.87Å; L74-S78 PolarHBondContact O-N 2.92Å; L74-S78 PolarHBondContact O-OG 2.64Å; L74-F85 HydrophobicContact CD1-CE2 4.37Å; L74-F85 WeakPolarHBondContact CD1-O 3.44Å; L74-F85 HydrophobicContact CD2-CD1 3.98Å; L74-F85 HydrophobicContact CD2-CD2 4.47Å; L74-F85 HydrophobicContact CD2-CE1 3.95Å; L74-F85 HydrophobicContact CD2-CE2 4.43Å; L74-F85 HydrophobicContact CD2-CG 4.25Å; L74-F85 HydrophobicContact CD2-CZ 4.18Å; L74-P87 HydrophobicContact CD1-CG 3.75Å
75	R	79.8	Confident	77.8	Confident	114 Å²	114	51.3 Å²	51.3	43%	0.43	27%	0.274	S	S	.	.	H	α-helix	trans	-65.1	-37.2	169.6	-168.2	177.5	68.7	-127.9	-8.1	112	F52 K71 E72 F73 S78 S79	F52-R75 HydrophobicContact CZ-CB 4.45Å; K71-R75 PolarHBondContact O-N 2.6Å; K71-R75 VanDerWaalsContact O-N 3.09Å; E72-R75 VanDerWaalsContact CD-NH2 3.31Å; E72-R75 PolarHBondContact O-N 2.98Å; E72-R75 IonicContact OE1-CZ 2.76Å; E72-R75 IonicContact OE1-NH1 2.8Å; E72-R75 PolarHBondContact OE1-NH1 3.18Å; E72-R75 IonicContact OE1-NH2 2.76Å; E72-R75 PolarHBondContact OE1-NH2 2.54Å; E72-R75 IonicContact OE2-CZ 2.68Å; E72-R75 IonicContact OE2-NH1 3.83Å; E72-R75 IonicContact OE2-NH2 3.56Å; E72-R75 PolarHBondContact OE2-NH2 3.31Å; F73-R75 PolarHBondContact O-N 2.9Å; R75-S78 WeakPolarHBondContact O-CB 3.4Å; R75-S78 PolarHBondContact O-N 2.93Å; R75-S79 PolarHBondContact O-N 3.17Å; R75-S79 PolarHBondContact O-OG 3.26Å
76	G	75.8	Confident	77.8	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-64.5	-44.5	171.2	0	0	0	0	0	112.8	I49 E72 F73 L74 S78 S79 L80	I49-G76 WeakPolarHBondContact CD1-O 3.03Å; E72-G76 PolarHBondContact O-N 3.42Å; F73-G76 WeakPolarHBondContact O-CA 3.27Å; F73-G76 PolarHBondContact O-N 2.79Å; L74-G76 VanDerWaalsContact C-N 3.34Å; G76-S78 PolarHBondContact O-N 3.22Å; G76-S79 WeakPolarHBondContact O-CB 3.43Å; G76-S79 PolarHBondContact O-N 2.93Å; G76-S79 VanDerWaalsContact O-N 3.07Å; G76-L80 PolarHBondContact O-N 2.99Å
77	C	77.3	Confident	77.5	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-57	-40.3	173.7	-58.9	0	0	0	0	112	F73 L74 S79 L80 K81 V82 F106	F73-C77 WeakPolarHBondContact CE1-SG 3.33Å; F73-C77 WeakPolarHBondContact CZ-SG 3.4Å; F73-C77 PolarHBondContact O-N 2.85Å; F73-C77 PolarHBondContact O-SG 2.79Å; F73-C77 VanDerWaalsContact O-SG 3.38Å; L74-C77 WeakPolarHBondContact O-CB 3.25Å; L74-C77 PolarHBondContact O-N 2.87Å; C77-S79 VanDerWaalsContact C-N 3.31Å; C77-S79 PolarHBondContact O-N 3Å; C77-L80 CarbonylContact O-C 3.59Å; C77-L80 PolarHBondContact O-N 2.69Å; C77-L80 VanDerWaalsContact O-N 3.08Å; C77-K81 PolarHBondContact O-N 3.2Å; C77-V82 HydrophobicContact CB-CB 4.33Å; C77-V82 PolarHBondContact O-N 2.9Å; C77-V82 VanDerWaalsContact O-N 3.08Å; C77-F106 HydrophobicContact CB-CD2 4.21Å; C77-F106 HydrophobicContact CB-CE2 4.41Å; C77-F106 VanDerWaalsContact SG-CD2 3.52Å
78	S	75.4	Confident	76.8	Confident	83 Å²	83	58.8 Å²	58.8	58%	0.58	31%	0.306	S	S	*	.	H	α-helix	trans	-62.9	-34.5	177.1	-56.6	0	0	0	0	112.5	L74 R75 G76 L80 K81	L74-S78 PolarHBondContact O-N 2.92Å; L74-S78 PolarHBondContact O-OG 2.64Å; R75-S78 WeakPolarHBondContact O-CB 3.4Å; R75-S78 PolarHBondContact O-N 2.93Å; G76-S78 PolarHBondContact O-N 3.22Å; S78-L80 VanDerWaalsContact C-N 3.27Å; S78-L80 PolarHBondContact O-N 3.42Å; S78-K81 PolarHBondContact O-N 3.29Å
79	S	73.7	Confident	76.5	Confident	80 Å²	80	59.3 Å²	59.3	56%	0.559	30%	0.299	S	S	*	.	H	α-helix	trans	-66	-27.6	173.6	-60	0	0	0	0	113.2	R75 G76 C77	R75-S79 PolarHBondContact O-N 3.17Å; R75-S79 PolarHBondContact O-OG 3.26Å; G76-S79 WeakPolarHBondContact O-CB 3.43Å; G76-S79 PolarHBondContact O-N 2.93Å; G76-S79 VanDerWaalsContact O-N 3.07Å; C77-S79 VanDerWaalsContact C-N 3.31Å; C77-S79 PolarHBondContact O-N 3Å
80	L	71.6	Confident	75.7	Confident	40 Å²	40	59.4 Å²	59.4	21%	0.209	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	5	174.8	-61.5	-179.5	0	0	0	113.7	I49 G76 C77 S78 V82 F106 A109 T110	I49-L80 HydrophobicContact CD1-CD1 3.78Å; I49-L80 HydrophobicContact CD1-CD2 4.34Å; I49-L80 HydrophobicContact CD1-CG 3.8Å; I49-L80 HydrophobicContact CG1-CD1 4.06Å; I49-L80 HydrophobicContact CG1-CG 4.39Å; G76-L80 PolarHBondContact O-N 2.99Å; C77-L80 CarbonylContact O-C 3.59Å; C77-L80 PolarHBondContact O-N 2.69Å; C77-L80 VanDerWaalsContact O-N 3.08Å; S78-L80 VanDerWaalsContact C-N 3.27Å; S78-L80 PolarHBondContact O-N 3.42Å; L80-V82 HydrophobicContact CB-CG2 3.97Å; L80-V82 PolarHBondContact O-N 2.96Å; L80-F106 HydrophobicContact CD1-CD2 4.03Å; L80-F106 HydrophobicContact CD1-CE1 4.45Å; L80-F106 HydrophobicContact CD1-CE2 3.68Å; L80-F106 HydrophobicContact CD1-CZ 3.91Å; L80-A109 HydrophobicContact CB-CB 4.34Å; L80-T110 HydrophobicContact CD1-CG2 3.49Å; L80-T110 VanDerWaalsContact CD1-CG2 3.49Å
81	K	71.8	Confident	74.7	Confident	200 Å²	200	62.1 Å²	62.1	87%	0.87	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	26.7	-175.7	-52.6	177.9	-177.3	171.9	0	114.7	C77 S78	C77-K81 PolarHBondContact O-N 3.2Å; S78-K81 PolarHBondContact O-N 3.29Å
82	V	77.3	Confident	73.9	Confident	18 Å²	18	60.8 Å²	60.8	11%	0.109	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-81.7	139.3	176.8	179	0	0	0	0	109.7	C77 L80 G84 T102 A105 A109	C77-V82 HydrophobicContact CB-CB 4.33Å; C77-V82 PolarHBondContact O-N 2.9Å; C77-V82 VanDerWaalsContact O-N 3.08Å; L80-V82 HydrophobicContact CB-CG2 3.97Å; L80-V82 PolarHBondContact O-N 2.96Å; V82-G84 PolarHBondContact O-N 2.76Å; V82-T102 HydrophobicContact CG1-CG2 4.17Å; V82-A105 HydrophobicContact CG1-CB 3.74Å; V82-A109 HydrophobicContact CG2-CB 3.78Å
83	E	67.6	Low	73	Confident	173 Å²	173	60.8 Å²	60.8	81%	0.808	32%	0.319	S	S	*	.	P	Polyproline II helix	trans	-64	116.8	173.5	-69.8	-164.4	149.3	0	0	110.8	T102	E83-T102 WeakPolarHBondContact O-CB 3.25Å; E83-T102 VanDerWaalsContact O-CG2 3.31Å; E83-T102 WeakPolarHBondContact O-CG2 3.28Å; E83-T102 PolarHBondContact O-OG1 3.45Å
84	G	70	Confident	72.1	Confident	50 Å²	50	66.6 Å²	66.6	52%	0.515	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-81.7	165.4	176	0	0	0	0	0	113.5	V82	V82-G84 PolarHBondContact O-N 2.76Å
85	F	80.1	Confident	71.4	Confident	9 Å²	9	70.5 Å²	70.5	4%	0.039	37%	0.367	C	S	.	.			trans	-108.9	161.4	172	57	-94.7	0	0	0	110.8	L41 I70 F73 L74 W89 L90 V99 T102	L41-F85 HydrophobicContact CD1-CZ 4.42Å; I70-F85 HydrophobicContact CG2-CE2 3.76Å; I70-F85 HydrophobicContact CG2-CZ 4.2Å; F73-F85 HydrophobicContact CD1-CE1 4.45Å; F73-F85 HydrophobicContact CD1-CZ 4.33Å; F73-F85 AromaticContact CE1-CE1 3.94Å; F73-F85 HydrophobicContact CE1-CE1 3.94Å; F73-F85 HydrophobicContact CE1-CZ 4.22Å; L74-F85 HydrophobicContact CD1-CE2 4.37Å; L74-F85 WeakPolarHBondContact CD1-O 3.44Å; L74-F85 HydrophobicContact CD2-CD1 3.98Å; L74-F85 HydrophobicContact CD2-CD2 4.47Å; L74-F85 HydrophobicContact CD2-CE1 3.95Å; L74-F85 HydrophobicContact CD2-CE2 4.43Å; L74-F85 HydrophobicContact CD2-CG 4.25Å; L74-F85 HydrophobicContact CD2-CZ 4.18Å; F85-W89 HydrophobicContact CB-CE3 4Å; F85-W89 HydrophobicContact CB-CZ3 4.31Å; F85-L90 HydrophobicContact CD2-CB 4.39Å; F85-L90 HydrophobicContact CE2-CB 3.74Å; F85-L90 HydrophobicContact CE2-CD2 3.93Å; F85-L90 HydrophobicContact CZ-CB 4.44Å; F85-L90 HydrophobicContact CZ-CD2 3.87Å; F85-V99 HydrophobicContact CB-CG2 4.47Å; F85-V99 HydrophobicContact CD1-CB 4.23Å; F85-V99 HydrophobicContact CD1-CG1 4.23Å; F85-V99 HydrophobicContact CD1-CG2 4.05Å; F85-V99 HydrophobicContact CD2-CG2 3.91Å; F85-V99 HydrophobicContact CE1-CB 4.26Å; F85-V99 HydrophobicContact CE1-CG1 3.75Å; F85-V99 HydrophobicContact CE1-CG2 4.25Å; F85-V99 HydrophobicContact CE2-CG2 4.13Å; F85-V99 HydrophobicContact CG-CG2 3.89Å; F85-V99 HydrophobicContact CZ-CG1 3.93Å; F85-V99 HydrophobicContact CZ-CG2 4.29Å; F85-T102 HydrophobicContact CD1-CG2 3.87Å; F85-T102 HydrophobicContact CE1-CG2 4.07Å
86	E	76.1	Confident	71.2	Confident	117 Å²	117	65.2 Å²	65.2	55%	0.547	35%	0.347	S	S	.	.			trans	-70.7	129.7	173.8	-74.8	-62.7	164.8	0	0	110.8	E88 W89	E86-E88 PolarHBondContact O-N 2.98Å; E86-W89 HydrophobicContact CB-CD2 3.87Å; E86-W89 HydrophobicContact CB-CE3 4.23Å; E86-W89 HydrophobicContact CB-CG 4.19Å; E86-W89 HydrophobicContact CB-CH2 4.44Å; E86-W89 HydrophobicContact CB-CZ2 4.14Å; E86-W89 HydrophobicContact CB-CZ3 4.49Å; E86-W89 HydrophobicContact CG-CH2 4.21Å; E86-W89 HydrophobicContact CG-CZ2 3.99Å; E86-W89 WeakPolarHBondContact O-CB 2.99Å; E86-W89 PolarHBondContact O-N 2.91Å
87	P	73.1	Confident	71.2	Confident	9 Å²	9	67.1 Å²	67.1	6%	0.058	37%	0.366	C	S	.	.	H	α-helix	trans	-53.4	-31.5	-174.7	-27.6	33.1	0	0	0	114.7	I67 I70 K71 L74 W89	I67-P87 HydrophobicContact CG2-CB 4.15Å; I70-P87 HydrophobicContact CB-CB 4.4Å; I70-P87 HydrophobicContact CG2-CB 3.88Å; K71-P87 HydrophobicContact CD-CG 4.27Å; K71-P87 HydrophobicContact CG-CB 4.2Å; K71-P87 HydrophobicContact CG-CG 3.56Å; L74-P87 HydrophobicContact CD1-CG 3.75Å; P87-W89 VanDerWaalsContact C-N 3.35Å
88	E	67.1	Low	71.1	Confident	127 Å²	127	72.6 Å²	72.6	59%	0.593	39%	0.39	S	S	*	.	H	α-helix	trans	-68.1	-32.1	-178.8	-64	179.9	-172.5	0	0	112.1	E86 L90 Y91 T92	E86-E88 PolarHBondContact O-N 2.98Å; E88-L90 PolarHBondContact O-N 3.46Å; E88-Y91 PolarHBondContact O-N 3.46Å; E88-Y91 VanDerWaalsContact O-N 3.08Å; E88-T92 WeakPolarHBondContact O-CG2 3.35Å; E88-T92 PolarHBondContact O-N 3.26Å; E88-T92 PolarHBondContact O-OG1 2.9Å; E88-T92 VanDerWaalsContact O-OG1 3.12Å
89	W	73.3	Confident	71.2	Confident	68 Å²	68	68.6 Å²	68.6	26%	0.258	36%	0.362	S	S	.	.	H	α-helix	trans	-62.4	-38.8	179.7	-65.7	-12.4	0	0	0	112.7	F85 E86 P87 G93 E94 N95 K98	F85-W89 HydrophobicContact CB-CE3 4Å; F85-W89 HydrophobicContact CB-CZ3 4.31Å; E86-W89 HydrophobicContact CB-CD2 3.87Å; E86-W89 HydrophobicContact CB-CE3 4.23Å; E86-W89 HydrophobicContact CB-CG 4.19Å; E86-W89 HydrophobicContact CB-CH2 4.44Å; E86-W89 HydrophobicContact CB-CZ2 4.14Å; E86-W89 HydrophobicContact CB-CZ3 4.49Å; E86-W89 HydrophobicContact CG-CH2 4.21Å; E86-W89 HydrophobicContact CG-CZ2 3.99Å; E86-W89 WeakPolarHBondContact O-CB 2.99Å; E86-W89 PolarHBondContact O-N 2.91Å; P87-W89 VanDerWaalsContact C-N 3.35Å; W89-G93 CarbonylContact O-C 3.59Å; W89-G93 WeakPolarHBondContact O-CA 3.3Å; W89-G93 PolarHBondContact O-N 3.12Å; W89-E94 WeakPolarHBondContact CB-O 3.3Å; W89-E94 PolarHBondContact O-N 2.82Å; W89-N95 HydrophobicContact CD2-CB 4.3Å; W89-N95 HydrophobicContact CE3-CB 4.38Å; W89-N95 HydrophobicContact CG-CB 4.47Å; W89-K98 HydrophobicContact CE3-CD 4.21Å; W89-K98 HydrophobicContact CH2-CD 4.23Å; W89-K98 HydrophobicContact CZ3-CD 3.55Å
90	L	68.6	Low	71.5	Confident	2 Å²	2	65 Å²	65	1%	0.01	34%	0.337	C	S	.	.	H	α-helix	trans	-72.2	-30.6	175.1	179	55.6	0	0	0	112.1	L35 L41 I70 F85 E88 F96 V99	L35-L90 HydrophobicContact CB-CD1 4.13Å; L35-L90 HydrophobicContact CB-CD2 4.4Å; L41-L90 HydrophobicContact CD1-CD2 3.46Å; L41-L90 VanDerWaalsContact CD1-CD2 3.46Å; I70-L90 HydrophobicContact CD1-CB 4.32Å; I70-L90 HydrophobicContact CD1-CD2 3.98Å; I70-L90 HydrophobicContact CD1-CG 4.15Å; I70-L90 HydrophobicContact CG1-CD2 4.1Å; I70-L90 HydrophobicContact CG2-CD2 4.38Å; F85-L90 HydrophobicContact CD2-CB 4.39Å; F85-L90 HydrophobicContact CE2-CB 3.74Å; F85-L90 HydrophobicContact CE2-CD2 3.93Å; F85-L90 HydrophobicContact CZ-CB 4.44Å; F85-L90 HydrophobicContact CZ-CD2 3.87Å; E88-L90 PolarHBondContact O-N 3.46Å; L90-F96 HydrophobicContact CD1-CD2 4.22Å; L90-F96 HydrophobicContact CD1-CE2 3.93Å; L90-V99 HydrophobicContact CB-CG2 4.21Å; L90-V99 HydrophobicContact CD1-CG1 4.22Å; L90-V99 HydrophobicContact CD1-CG2 4.47Å; L90-V99 HydrophobicContact CD2-CG1 4.44Å
91	Y	62.3	Low	71.9	Confident	57 Å²	57	68.1 Å²	68.1	22%	0.224	35%	0.354	C	S	.	.	H	α-helix	trans	-78.7	-39.5	178.4	-173	-83	0	0	0	112.6	K36 D63 C66 E88	K36-Y91 HydrophobicContact CD-CD2 4.46Å; K36-Y91 VanDerWaalsContact CE-O 3.3Å; K36-Y91 WeakPolarHBondContact CE-O 3.42Å; K36-Y91 HydrophobicContact CG-CD2 4.1Å; K36-Y91 HydrophobicContact CG-CE2 4.39Å; K36-Y91 PolarHBondContact NZ-O 3.49Å; D63-Y91 HydrophobicContact CB-CE2 4.25Å; D63-Y91 VanDerWaalsContact CG-OH 3.25Å; D63-Y91 PolarHBondContact OD1-OH 2.65Å; C66-Y91 HydrophobicContact CB-CD2 4.16Å; C66-Y91 HydrophobicContact CB-CE2 4.27Å; E88-Y91 PolarHBondContact O-N 3.46Å; E88-Y91 VanDerWaalsContact O-N 3.08Å
92	T	63.8	Low	72.4	Confident	86 Å²	86	59.1 Å²	59.1	53%	0.528	32%	0.315	S	S	.	.	H	α-helix	trans	-79.9	-24.5	175.9	62.5	0	0	0	0	113	E88 E94	E88-T92 WeakPolarHBondContact O-CG2 3.35Å; E88-T92 PolarHBondContact O-N 3.26Å; E88-T92 PolarHBondContact O-OG1 2.9Å; E88-T92 VanDerWaalsContact O-OG1 3.12Å; T92-E94 PolarHBondContact OG1-N 3.08Å
93	G	63.1	Low	72.5	Confident	25 Å²	25	58.2 Å²	58.2	26%	0.258	31%	0.31	S	S	.	.			trans	87.4	2.7	-177	0	0	0	0	0	114.4	W89	W89-G93 CarbonylContact O-C 3.59Å; W89-G93 WeakPolarHBondContact O-CA 3.3Å; W89-G93 PolarHBondContact O-N 3.12Å
94	E	64.9	Low	73.1	Confident	122 Å²	122	51.4 Å²	51.4	57%	0.57	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	150.6	176.5	-63	-174.1	147.4	0	0	111.8	W89 T92 F96	W89-E94 WeakPolarHBondContact CB-O 3.3Å; W89-E94 PolarHBondContact O-N 2.82Å; T92-E94 PolarHBondContact OG1-N 3.08Å; E94-F96 PolarHBondContact O-N 2.99Å
95	N	67.1	Low	73.6	Confident	100 Å²	100	51.1 Å²	51.1	54%	0.535	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	27	176.8	-66.7	-65.3	0	0	0	115.7	W89 G97 K98	W89-N95 HydrophobicContact CD2-CB 4.3Å; W89-N95 HydrophobicContact CE3-CB 4.38Å; W89-N95 HydrophobicContact CG-CB 4.47Å; N95-G97 PolarHBondContact O-N 3.39Å; N95-K98 WeakPolarHBondContact O-CB 3.39Å; N95-K98 PolarHBondContact O-N 3.02Å
96	F	76.4	Confident	73.6	Confident	4 Å²	4	50.7 Å²	50.7	2%	0.018	27%	0.27	C	S	.	.	H	α-helix	trans	-54.8	-29.3	-173.7	-175.2	-97.2	0	0	0	114.8	E28 L31 K32 L90 E94 K98 V99 L100	E28-F96 HydrophobicContact CG-CD1 3.42Å; E28-F96 VanDerWaalsContact CG-CD1 3.42Å; E28-F96 HydrophobicContact CG-CE1 3.78Å; E28-F96 HydrophobicContact CG-CG 4.37Å; L31-F96 HydrophobicContact CB-CE1 4.16Å; L31-F96 HydrophobicContact CB-CZ 3.62Å; L31-F96 HydrophobicContact CD1-CE1 4.42Å; L31-F96 HydrophobicContact CD1-CZ 4.38Å; K32-F96 HydrophobicContact CD-CD2 4.45Å; K32-F96 HydrophobicContact CD-CG 4.32Å; K32-F96 HydrophobicContact CG-CB 4.45Å; K32-F96 HydrophobicContact CG-CD1 4.28Å; K32-F96 HydrophobicContact CG-CD2 3.51Å; K32-F96 HydrophobicContact CG-CE1 4.49Å; K32-F96 HydrophobicContact CG-CE2 3.76Å; K32-F96 HydrophobicContact CG-CG 3.81Å; K32-F96 HydrophobicContact CG-CZ 4.27Å; L90-F96 HydrophobicContact CD1-CD2 4.22Å; L90-F96 HydrophobicContact CD1-CE2 3.93Å; E94-F96 PolarHBondContact O-N 2.99Å; F96-K98 PolarHBondContact O-N 3.35Å; F96-K98 VanDerWaalsContact O-N 3.09Å; F96-V99 HydrophobicContact CD2-CB 4.1Å; F96-V99 HydrophobicContact CD2-CG2 4.22Å; F96-V99 HydrophobicContact CE2-CB 4.15Å; F96-V99 HydrophobicContact CE2-CG1 4.11Å; F96-V99 WeakPolarHBondContact O-CA 3.24Å; F96-V99 VanDerWaalsContact O-CB 3.3Å; F96-V99 WeakPolarHBondContact O-CB 3.48Å; F96-V99 PolarHBondContact O-N 3.45Å; F96-L100 PolarHBondContact O-N 2.7Å
97	G	74.9	Confident	73.8	Confident	39 Å²	39	46.1 Å²	46.1	40%	0.402	25%	0.249	S	C	.	.	H	α-helix	trans	-55.7	-25	171.7	0	0	0	0	0	114.6	N95 N101	N95-G97 PolarHBondContact O-N 3.39Å; G97-N101 WeakPolarHBondContact O-CB 3.35Å; G97-N101 VanDerWaalsContact O-CG 3.24Å; G97-N101 PolarHBondContact O-N 3.23Å; G97-N101 PolarHBondContact O-ND2 3.21Å
98	K	74.8	Confident	74.1	Confident	115 Å²	115	52.1 Å²	52.1	50%	0.5	27%	0.274	S	S	.	.	H	α-helix	trans	-72.3	-40.7	169.5	-75.4	-169	172.7	-172.4	0	112.7	W89 N95 F96 L100 N101 T102	W89-K98 HydrophobicContact CE3-CD 4.21Å; W89-K98 HydrophobicContact CH2-CD 4.23Å; W89-K98 HydrophobicContact CZ3-CD 3.55Å; N95-K98 WeakPolarHBondContact O-CB 3.39Å; N95-K98 PolarHBondContact O-N 3.02Å; F96-K98 PolarHBondContact O-N 3.35Å; F96-K98 VanDerWaalsContact O-N 3.09Å; K98-L100 VanDerWaalsContact C-N 3.27Å; K98-L100 PolarHBondContact O-N 3.01Å; K98-N101 PolarHBondContact O-N 2.66Å; K98-T102 PolarHBondContact O-N 2.83Å; K98-T102 PolarHBondContact O-OG1 3.23Å
99	V	78.3	Confident	74.4	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-58.3	-44.8	173.9	-178.1	0	0	0	0	109.9	F85 L90 F96 T102 L103	F85-V99 HydrophobicContact CB-CG2 4.47Å; F85-V99 HydrophobicContact CD1-CB 4.23Å; F85-V99 HydrophobicContact CD1-CG1 4.23Å; F85-V99 HydrophobicContact CD1-CG2 4.05Å; F85-V99 HydrophobicContact CD2-CG2 3.91Å; F85-V99 HydrophobicContact CE1-CB 4.26Å; F85-V99 HydrophobicContact CE1-CG1 3.75Å; F85-V99 HydrophobicContact CE1-CG2 4.25Å; F85-V99 HydrophobicContact CE2-CG2 4.13Å; F85-V99 HydrophobicContact CG-CG2 3.89Å; F85-V99 HydrophobicContact CZ-CG1 3.93Å; F85-V99 HydrophobicContact CZ-CG2 4.29Å; L90-V99 HydrophobicContact CB-CG2 4.21Å; L90-V99 HydrophobicContact CD1-CG1 4.22Å; L90-V99 HydrophobicContact CD1-CG2 4.47Å; L90-V99 HydrophobicContact CD2-CG1 4.44Å; F96-V99 HydrophobicContact CD2-CB 4.1Å; F96-V99 HydrophobicContact CD2-CG2 4.22Å; F96-V99 HydrophobicContact CE2-CB 4.15Å; F96-V99 HydrophobicContact CE2-CG1 4.11Å; F96-V99 WeakPolarHBondContact O-CA 3.24Å; F96-V99 VanDerWaalsContact O-CB 3.3Å; F96-V99 WeakPolarHBondContact O-CB 3.48Å; F96-V99 PolarHBondContact O-N 3.45Å; V99-T102 PolarHBondContact O-N 2.69Å; V99-L103 HydrophobicContact CG1-CD1 4.08Å; V99-L103 WeakPolarHBondContact O-CG 3.35Å; V99-L103 PolarHBondContact O-N 3.07Å
100	L	79.3	Confident	74.2	Confident	4 Å²	4	44.8 Å²	44.8	2%	0.021	25%	0.249	C	C	.	.	H	α-helix	trans	-61.6	-45.5	177.2	-166.3	70.9	0	0	0	112.1	P3 E4 T7 L31 F96 K98 L103 L104	P3-L100 HydrophobicContact CB-CD2 3.77Å; P3-L100 HydrophobicContact CB-CG 4.46Å; P3-L100 HydrophobicContact CG-CD2 3.81Å; E4-L100 HydrophobicContact CG-CD1 4.46Å; E4-L100 HydrophobicContact CG-CD2 3.79Å; E4-L100 WeakPolarHBondContact OE1-CD2 3.4Å; T7-L100 HydrophobicContact CG2-CD1 4.02Å; T7-L100 VanDerWaalsContact OG1-CD1 3.27Å; T7-L100 WeakPolarHBondContact OG1-CD1 3.44Å; L31-L100 HydrophobicContact CD1-CD1 4.02Å; F96-L100 PolarHBondContact O-N 2.7Å; K98-L100 VanDerWaalsContact C-N 3.27Å; K98-L100 PolarHBondContact O-N 3.01Å; L100-L103 PolarHBondContact O-N 3.31Å; L100-L104 HydrophobicContact CG-CD1 4.44Å; L100-L104 WeakPolarHBondContact O-CG 3.31Å; L100-L104 PolarHBondContact O-N 3.24Å
101	N	80.8	Confident	74.1	Confident	106 Å²	106	49.4 Å²	49.4	57%	0.567	27%	0.27	S	S	*	.	H	α-helix	trans	-63	-41	175.1	-73.3	-23.1	0	0	0	112.5	G97 K98 L103 L104 A105	G97-N101 WeakPolarHBondContact O-CB 3.35Å; G97-N101 VanDerWaalsContact O-CG 3.24Å; G97-N101 PolarHBondContact O-N 3.23Å; G97-N101 PolarHBondContact O-ND2 3.21Å; K98-N101 PolarHBondContact O-N 2.66Å; N101-L103 VanDerWaalsContact C-N 3.35Å; N101-L103 PolarHBondContact O-N 3.48Å; N101-L104 PolarHBondContact O-N 2.92Å; N101-A105 VanDerWaalsContact O-CB 3.29Å; N101-A105 WeakPolarHBondContact O-CB 3.34Å; N101-A105 PolarHBondContact O-N 2.98Å
102	T	81.6	Confident	73.4	Confident	10 Å²	10	52.9 Å²	52.9	6%	0.061	29%	0.293	C	S	.	.	H	α-helix	trans	-60.7	-42.3	172.9	-64.5	0	0	0	0	111.3	V82 E83 F85 K98 V99 A105 F106	V82-T102 HydrophobicContact CG1-CG2 4.17Å; E83-T102 WeakPolarHBondContact O-CB 3.25Å; E83-T102 VanDerWaalsContact O-CG2 3.31Å; E83-T102 WeakPolarHBondContact O-CG2 3.28Å; E83-T102 PolarHBondContact O-OG1 3.45Å; F85-T102 HydrophobicContact CD1-CG2 3.87Å; F85-T102 HydrophobicContact CE1-CG2 4.07Å; K98-T102 PolarHBondContact O-N 2.83Å; K98-T102 PolarHBondContact O-OG1 3.23Å; V99-T102 PolarHBondContact O-N 2.69Å; T102-A105 PolarHBondContact O-N 3.45Å; T102-F106 VanDerWaalsContact O-CB 3.27Å; T102-F106 WeakPolarHBondContact O-CB 3.49Å; T102-F106 PolarHBondContact O-N 3.03Å
103	L	80.2	Confident	72.4	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-66.6	-41	178	-75.3	167.7	0	0	0	112.7	T7 W10 L35 L41 L44 F73 V99 L100 N101 F106 N107	T7-L103 HydrophobicContact CG2-CB 4.26Å; T7-L103 HydrophobicContact CG2-CD1 4.04Å; W10-L103 HydrophobicContact CZ3-CB 4.39Å; W10-L103 HydrophobicContact CZ3-CD2 4.4Å; L35-L103 HydrophobicContact CD1-CD1 3.78Å; L41-L103 HydrophobicContact CD2-CD2 3.78Å; L44-L103 HydrophobicContact CD2-CD2 3.88Å; F73-L103 HydrophobicContact CE2-CD2 4.5Å; F73-L103 HydrophobicContact CZ-CD2 3.86Å; V99-L103 HydrophobicContact CG1-CD1 4.08Å; V99-L103 WeakPolarHBondContact O-CG 3.35Å; V99-L103 PolarHBondContact O-N 3.07Å; L100-L103 PolarHBondContact O-N 3.31Å; N101-L103 VanDerWaalsContact C-N 3.35Å; N101-L103 PolarHBondContact O-N 3.48Å; L103-F106 PolarHBondContact O-N 3.15Å; L103-N107 PolarHBondContact O-N 3.48Å
104	L	80.5	Confident	71.3	Confident	30 Å²	30	55.9 Å²	55.9	16%	0.157	32%	0.318	C	S	.	.	H	α-helix	trans	-66.6	-43	174.7	-68.9	171	0	0	0	111.5	P3 L100 N101 F106 N107 F108	P3-L104 HydrophobicContact CB-CD1 3.92Å; L100-L104 HydrophobicContact CG-CD1 4.44Å; L100-L104 WeakPolarHBondContact O-CG 3.31Å; L100-L104 PolarHBondContact O-N 3.24Å; N101-L104 PolarHBondContact O-N 2.92Å; L104-F106 VanDerWaalsContact C-N 3.32Å; L104-F106 PolarHBondContact O-N 2.76Å; L104-N107 WeakPolarHBondContact O-CB 3.26Å; L104-N107 PolarHBondContact O-N 3.26Å; L104-F108 WeakPolarHBondContact O-CD2 3.17Å; L104-F108 PolarHBondContact O-N 3.25Å
105	A	79.1	Confident	69.9	Low	44 Å²	44	55.2 Å²	55.2	36%	0.364	32%	0.322	S	S	.	.	H	α-helix	trans	-64.3	-36.1	174.6	0	0	0	0	0	112.4	V82 N101 T102 A109	V82-A105 HydrophobicContact CG1-CB 3.74Å; N101-A105 VanDerWaalsContact O-CB 3.29Å; N101-A105 WeakPolarHBondContact O-CB 3.34Å; N101-A105 PolarHBondContact O-N 2.98Å; T102-A105 PolarHBondContact O-N 3.45Å; A105-A109 VanDerWaalsContact O-CB 3.32Å; A105-A109 WeakPolarHBondContact O-CB 3.49Å; A105-A109 PolarHBondContact O-N 2.87Å
106	F	81.1	Confident	68.3	Low	0 Å²	0	59.7 Å²	59.7	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-64.2	-44.6	172.2	-167.5	-85.5	0	0	0	111.4	W10 L44 T45 L48 I49 F73 C77 L80 T102 L103 L104 F108 A109 T110	W10-F106 HydrophobicContact CH2-CD1 4.23Å; L44-F106 HydrophobicContact CG-CE1 4.46Å; T45-F106 HydrophobicContact CG2-CZ 4.29Å; L48-F106 HydrophobicContact CB-CE1 4.11Å; L48-F106 HydrophobicContact CD1-CD1 4.17Å; L48-F106 HydrophobicContact CD1-CE1 3.78Å; I49-F106 HydrophobicContact CD1-CE2 4.26Å; I49-F106 HydrophobicContact CD1-CZ 4.03Å; I49-F106 HydrophobicContact CG1-CZ 4.22Å; F73-F106 HydrophobicContact CE2-CE2 4.44Å; C77-F106 HydrophobicContact CB-CD2 4.21Å; C77-F106 HydrophobicContact CB-CE2 4.41Å; C77-F106 VanDerWaalsContact SG-CD2 3.52Å; L80-F106 HydrophobicContact CD1-CD2 4.03Å; L80-F106 HydrophobicContact CD1-CE1 4.45Å; L80-F106 HydrophobicContact CD1-CE2 3.68Å; L80-F106 HydrophobicContact CD1-CZ 3.91Å; T102-F106 VanDerWaalsContact O-CB 3.27Å; T102-F106 WeakPolarHBondContact O-CB 3.49Å; T102-F106 PolarHBondContact O-N 3.03Å; L103-F106 PolarHBondContact O-N 3.15Å; L104-F106 VanDerWaalsContact C-N 3.32Å; L104-F106 PolarHBondContact O-N 2.76Å; F106-F108 PolarHBondContact O-N 3.04Å; F106-A109 PolarHBondContact O-N 2.99Å; F106-T110 HydrophobicContact CD1-CG2 3.9Å; F106-T110 HydrophobicContact CE1-CG2 3.72Å; F106-T110 HydrophobicContact CZ-CG2 4.29Å; F106-T110 VanDerWaalsContact O-CG2 3.29Å; F106-T110 WeakPolarHBondContact O-CG2 3.47Å; F106-T110 PolarHBondContact O-N 3.43Å; F106-T110 PolarHBondContact O-OG1 3.4Å; F106-T110 VanDerWaalsContact O-OG1 3.13Å
107	N	79.5	Confident	66	Low	20 Å²	20	70.6 Å²	70.6	11%	0.107	38%	0.38	C	S	.	.	H	α-helix	trans	-53.7	-56.1	173.8	-171.8	4.7	0	0	0	111.1	W10 L103 L104 A109 T110 Q111	W10-N107 HydrophobicContact CD2-CB 4.13Å; W10-N107 HydrophobicContact CE3-CB 4.36Å; W10-N107 HydrophobicContact CH2-CB 3.69Å; W10-N107 HydrophobicContact CZ2-CB 3.41Å; W10-N107 VanDerWaalsContact CZ2-CB 3.41Å; W10-N107 HydrophobicContact CZ3-CB 4.16Å; W10-N107 VanDerWaalsContact NE1-CG 3.27Å; W10-N107 PolarHBondContact NE1-ND2 3.36Å; W10-N107 PolarHBondContact NE1-OD1 2.88Å; L103-N107 PolarHBondContact O-N 3.48Å; L104-N107 WeakPolarHBondContact O-CB 3.26Å; L104-N107 PolarHBondContact O-N 3.26Å; N107-A109 PolarHBondContact O-N 2.99Å; N107-T110 PolarHBondContact O-N 2.98Å; N107-T110 VanDerWaalsContact O-N 3.13Å; N107-T110 PolarHBondContact O-OG1 3.49Å; N107-Q111 WeakPolarHBondContact O-CG 3.31Å; N107-Q111 PolarHBondContact O-N 3.37Å; N107-Q111 VanDerWaalsContact O-N 3.08Å; N107-Q111 PolarHBondContact OD1-NE2 3.28Å
108	F	80	Confident	63.6	Low	135 Å²	135	74.3 Å²	74.3	59%	0.592	40%	0.399	S	S	*	.	H	α-helix	trans	-58.4	-46.1	178.3	-69.2	-60.9	0	0	0	112.7	L104 F106 T110 Q111	L104-F108 WeakPolarHBondContact O-CD2 3.17Å; L104-F108 PolarHBondContact O-N 3.25Å; F106-F108 PolarHBondContact O-N 3.04Å; F108-T110 PolarHBondContact O-N 3.1Å; F108-Q111 PolarHBondContact O-N 3.12Å; F108-Q111 VanDerWaalsContact O-N 3.13Å
109	A	72.4	Confident	61.6	Low	29 Å²	29	74.7 Å²	74.7	24%	0.24	41%	0.413	C	S	.	.	H	α-helix	trans	-61.4	-30.2	177.9	0	0	0	0	0	113.4	L80 V82 A105 F106 N107	L80-A109 HydrophobicContact CB-CB 4.34Å; V82-A109 HydrophobicContact CG2-CB 3.78Å; A105-A109 VanDerWaalsContact O-CB 3.32Å; A105-A109 WeakPolarHBondContact O-CB 3.49Å; A105-A109 PolarHBondContact O-N 2.87Å; F106-A109 PolarHBondContact O-N 2.99Å; N107-A109 PolarHBondContact O-N 2.99Å
110	T	69.5	Low	59.2	Low	13 Å²	13	84.1 Å²	84.1	8%	0.08	46%	0.457	C	S	.	.	H	α-helix	trans	-82.1	-22.8	176.3	59.4	0	0	0	0	113.9	L48 L80 F106 N107 F108 C113	L48-T110 HydrophobicContact CB-CG2 3.8Å; L48-T110 HydrophobicContact CD1-CG2 4.19Å; L48-T110 HydrophobicContact CG-CG2 4.49Å; L80-T110 HydrophobicContact CD1-CG2 3.49Å; L80-T110 VanDerWaalsContact CD1-CG2 3.49Å; F106-T110 HydrophobicContact CD1-CG2 3.9Å; F106-T110 HydrophobicContact CE1-CG2 3.72Å; F106-T110 HydrophobicContact CZ-CG2 4.29Å; F106-T110 VanDerWaalsContact O-CG2 3.29Å; F106-T110 WeakPolarHBondContact O-CG2 3.47Å; F106-T110 PolarHBondContact O-N 3.43Å; F106-T110 PolarHBondContact O-OG1 3.4Å; F106-T110 VanDerWaalsContact O-OG1 3.13Å; N107-T110 PolarHBondContact O-N 2.98Å; N107-T110 VanDerWaalsContact O-N 3.13Å; N107-T110 PolarHBondContact O-OG1 3.49Å; F108-T110 PolarHBondContact O-N 3.1Å; T110-C113 PolarHBondContact O-N 2.89Å
111	Q	65.9	Low	56.7	Low	98 Å²	98	89.8 Å²	89.8	46%	0.458	50%	0.497	S	S	.	.	H	α-helix	trans	-69.6	-40.8	177.4	-73.6	175.9	26.2	0	0	112.1	N107 F108 C113 A114	N107-Q111 WeakPolarHBondContact O-CG 3.31Å; N107-Q111 PolarHBondContact O-N 3.37Å; N107-Q111 VanDerWaalsContact O-N 3.08Å; N107-Q111 PolarHBondContact OD1-NE2 3.28Å; F108-Q111 PolarHBondContact O-N 3.12Å; F108-Q111 VanDerWaalsContact O-N 3.13Å; Q111-C113 PolarHBondContact O-N 3Å; Q111-A114 WeakPolarHBondContact O-CB 3.33Å; Q111-A114 PolarHBondContact O-N 3.44Å; Q111-A114 VanDerWaalsContact O-N 3.07Å
112	D	47.6	Very low	54.2	Low	131 Å²	131	88 Å²	88	70%	0.701	50%	0.503	S	S	*	.	H	α-helix	trans	-62.4	-31.2	176.3	-79.5	-38.1	0	0	0	112.5	A114 V115	D112-A114 PolarHBondContact O-N 2.87Å; D112-V115 PolarHBondContact O-N 3.39Å
113	C	44.2	Very low	51.6	Low	91 Å²	91	92.9 Å²	92.9	62%	0.615	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-13.4	175.4	-70.6	0	0	0	0	114.4	T110 Q111	T110-C113 PolarHBondContact O-N 2.89Å; Q111-C113 PolarHBondContact O-N 3Å
114	A	39.4	Very low	49.1	Very low	83 Å²	83	98.5 Å²	98.5	69%	0.686	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85	-8.5	-179.4	0	0	0	0	0	114.1	Q111 D112	Q111-A114 WeakPolarHBondContact O-CB 3.33Å; Q111-A114 PolarHBondContact O-N 3.44Å; Q111-A114 VanDerWaalsContact O-N 3.07Å; D112-A114 PolarHBondContact O-N 2.87Å
115	V	35.5	Very low	46.4	Very low	108 Å²	108	102.6 Å²	102.6	66%	0.655	61%	0.609	S	S	*	*			trans	-86.6	-19	-165.4	-175.4	0	0	0	0	114	D112 R117	D112-V115 PolarHBondContact O-N 3.39Å; V115-R117 PolarHBondContact O-N 3.12Å
116	E	32.8	Very low	44.8	Very low	194 Å²	194	106.1 Å²	106.1	91%	0.907	63%	0.627	S	S	*	*			trans	-79.9	55.6	-178.4	-69.2	-149.1	139.7	0	0	115
117	R	28.1	Very low	42.1	Very low	233 Å²	233	113.9 Å²	113.9	88%	0.879	67%	0.669	S	S	*	*	S	Bend	trans	-167.7	112	158.9	-97.5	170.8	-148.1	-169.6	7.3	106.6	V115	V115-R117 PolarHBondContact O-N 3.12Å
118	C	24.2	Very low	39.5	Very low	117 Å²	117	121.1 Å²	121.1	79%	0.791	70%	0.702	S	S	*	*			cis	-141.2	169.7	16.8	-109.4	0	0	0	0	110.8
119	P	34.1	Very low	36.8	Very low	123 Å²	123	120.9 Å²	120.9	80%	0.799	71%	0.712	S	S	*	*			trans	-76.4	134.8	-172.6	30.7	-35.2	0	0	0	113.3
120	Q	28.6	Very low	34.4	Very low	198 Å²	198	125.1 Å²	125.1	93%	0.925	74%	0.735	S	S	*	*			trans	-131.2	141.5	154.9	-75	-162.2	-17.8	0	0	111
121	S	26.8	Very low	32.2	Very low	123 Å²	123	130 Å²	130	86%	0.86	77%	0.77	S	S	*	*			trans	-98.2	141.5	-170.9	54.3	0	0	0	0	112.9
122	G	27.9	Very low	30.3	Very low	67 Å²	67	130.1 Å²	130.1	69%	0.691	78%	0.781	S	S	*	*			trans	102	92.1	147.2	0	0	0	0	0	117
123	S	27.2	Very low	29.2	Very low	114 Å²	114	132.5 Å²	132.5	80%	0.797	79%	0.788	S	S	*	*			trans	29.1	127.7	137.3	58.6	0	0	0	0	118.7
124	S	26.3	Very low	28.3	Very low	118 Å²	118	131.9 Å²	131.9	83%	0.825	79%	0.79	S	S	*	*				-171	160.2	69.1	36.9	0	0	0	0	113.5
125	S	23.9	Very low	27.6	Very low	116 Å²	116	135.8 Å²	135.8	81%	0.811	80%	0.798	S	S	*	*			trans	-117.6	180	176.2	-49.5	0	0	0	0	109.6
126	P	45	Very low	27	Very low	117 Å²	117	135.5 Å²	135.5	76%	0.76	80%	0.801	S	S	*	*				-127.6	177.3	-63.9	38.3	-25.2	0	0	0	110.9
127	N	24.4	Very low	26.5	Very low	164 Å²	164	131.1 Å²	131.1	88%	0.877	79%	0.792	S	S	*	*			trans	-159	165.8	146.7	-127.1	-27.6	0	0	0	115.9
128	Q	25.9	Very low	26.2	Very low	171 Å²	171	125.7 Å²	125.7	80%	0.799	79%	0.785	S	S	*	*			trans	-107.6	148.6	-175.6	-52.1	168.5	4.8	0	0	112.1
129	T	23.1	Very low	26.2	Very low	131 Å²	131	130.9 Å²	130.9	80%	0.804	79%	0.787	S	S	*	*			trans	167.8	111.8	141.9	29.2	0	0	0	0	108.8
130	T	22	Very low	25.7	Very low	117 Å²	117	129 Å²	129	72%	0.718	78%	0.777	S	S	*	*				68.6	129.4	82.1	62.2	0	0	0	0	117.5
131	S	23.8	Very low	25.4	Very low	116 Å²	116	129.7 Å²	129.7	81%	0.811	78%	0.777	S	S	*	*			trans	70.7	154.2	159	78.8	0	0	0	0	117.4
132	S	24.7	Very low	25.2	Very low	100 Å²	100	127.6 Å²	127.6	70%	0.699	78%	0.775	S	S	*	*			cis	-165.1	-175.4	-13.1	39.6	0	0	0	0	111.8
133	H	25.6	Very low	24.9	Very low	181 Å²	181	129.6 Å²	129.6	84%	0.838	78%	0.779	S	S	*	*			trans	-37.3	170.1	162	-37.9	-88.1	0	0	0	115.8
134	A	24.7	Very low	24.7	Very low	79 Å²	79	131.9 Å²	131.9	65%	0.653	78%	0.781	S	S	*	*			cis	-165.6	154.4	20.2	0	0	0	0	0	115.6
135	L	24.1	Very low	24.5	Very low	164 Å²	164	136.2 Å²	136.2	86%	0.859	78%	0.779	S	S	*	*				49.6	156.2	124.8	-66.8	171.2	0	0	0	125.3
136	S	23.2	Very low	24.5	Very low	103 Å²	103	142.5 Å²	142.5	72%	0.72	79%	0.785	S	S	*	*			trans	88.7	118.1	150.8	88.5	0	0	0	0	115.8
137	S	22.5	Very low	23.4	Very low	101 Å²	101	144.4 Å²	144.4	71%	0.706	78%	0.784	S	S	*	*				86.3	143.5	74.1	85.9	0	0	0	0	111.6
138	T	23.2	Very low	23.3	Very low	120 Å²	120	142.9 Å²	142.9	74%	0.736	79%	0.786	S	S	*	*			cis	-153.9	149.7	34.1	25.8	0	0	0	0	108.8
139	R	23.5	Very low	23.1	Very low	225 Å²	225	144 Å²	144	85%	0.849	79%	0.788	S	S	*	*			cis	110.7	130.8	46.2	-166.6	-160.9	-175.7	-175.8	2.1	111
140	S	23.8	Very low	23.2	Very low	84 Å²	84	142.6 Å²	142.6	59%	0.587	78%	0.784	S	S	*	*			trans	77.2	115.2	150.8	44	0	0	0	0	124.4
141	K	22.6	Very low	23.3	Very low	213 Å²	213	143.3 Å²	143.3	93%	0.926	79%	0.788	S	S	*	*				74.8	134.1	126.2	-64.1	174.6	178.5	-175.2	0	121
142	G	22	Very low	23.3	Very low	78 Å²	78	146.7 Å²	146.7	80%	0.804	79%	0.791	S	S	*	*			trans	167.3	60.2	153.5	0	0	0	0	0	119.6
143	S	21.4	Very low	23.4	Very low	110 Å²	110	150.2 Å²	150.2	77%	0.769	80%	0.798	S	S	*	*			trans	-47.2	137.2	171	175.6	0	0	0	0	115.1
144	L	22.5	Very low	23.4	Very low	161 Å²	161	146.7 Å²	146.7	84%	0.843	79%	0.794	S	S	*	*				-174.5	113.4	121.6	-101.7	156	0	0	0	116.9
145	R	23.2	Very low	23.5	Very low	209 Å²	209	151.3 Å²	151.3	79%	0.789	80%	0.802	S	S	*	*			trans	-18.4	132.8	152.5	177.4	-168.1	-171.7	-169.5	4.6	117.6
146	R	22.7	Very low	23.6	Very low	248 Å²	248	150.9 Å²	150.9	94%	0.936	80%	0.801	S	S	*	*			trans	-144.7	147.1	147.8	-147.6	172.4	-170	-177.4	2.3	112.4
147	Q	22.6	Very low	23.7	Very low	157 Å²	157	149.2 Å²	149.2	73%	0.734	80%	0.799	S	S	*	*			trans	-95.3	152.7	176.4	-63	164.7	-70.1	0	0	110.8
148	S	22.7	Very low	24.2	Very low	132 Å²	132	148.9 Å²	148.9	92%	0.923	81%	0.812	S	S	*	*			trans	-158.5	164	149.6	-103.7	0	0	0	0	109.7
149	K	20.6	Very low	24.7	Very low	194 Å²	194	146.2 Å²	146.2	84%	0.843	81%	0.808	S	S	*	*			trans	-129.6	141.9	-169.1	-143.6	-172.9	-173.5	-169.7	0	111.3
150	S	25.2	Very low	25.9	Very low	102 Å²	102	139 Å²	139	71%	0.713	81%	0.805	S	S	*	*			trans	41.9	117.5	150.7	58.3	0	0	0	0	120.3
151	V	24.7	Very low	27.7	Very low	132 Å²	132	142 Å²	142	80%	0.8	81%	0.809	S	S	*	*			trans	-135.7	126.9	143.4	178.7	0	0	0	0	107.6	M153	V151-M153 HydrophobicContact CG1-CG 4.29Å
152	E	24.3	Very low	30.4	Very low	188 Å²	188	134.2 Å²	134.2	88%	0.879	78%	0.779	S	S	*	*			trans	-90.6	141.8	162.5	-68.9	177.8	124.1	0	0	108.9
153	M	26	Very low	33.4	Very low	174 Å²	174	134 Å²	134	86%	0.857	76%	0.759	S	S	*	*			trans	-142.2	145	165.1	-86.8	-64.2	159.6	0	0	109.6	V151	V151-M153 HydrophobicContact CG1-CG 4.29Å
154	S	26.3	Very low	36.5	Very low	107 Å²	107	128.8 Å²	128.8	75%	0.748	72%	0.722	S	S	*	*			trans	-88.8	157	-161.4	-49.1	0	0	0	0	115
155	E	27	Very low	39.6	Very low	175 Å²	175	126.3 Å²	126.3	82%	0.818	70%	0.704	S	S	*	*			trans	44.5	108.8	141.1	-90.9	-172.7	101.1	0	0	120.1
156	N	24.9	Very low	42.7	Very low	156 Å²	156	116.6 Å²	116.6	83%	0.834	67%	0.669	S	S	*	*				141.9	137.8	93.4	-155.1	-11.3	0	0	0	111.5
157	G	25.1	Very low	45.5	Very low	67 Å²	67	110.5 Å²	110.5	69%	0.691	65%	0.646	S	S	*	*			trans	150.2	104.1	-175.9	0	0	0	0	0	111.2	G159	G157-G159 PolarHBondContact O-N 2.94Å
158	G	34.2	Very low	48.2	Very low	94 Å²	94	108.2 Å²	108.2	97%	0.969	63%	0.634	S	S	*	*			trans	-71.7	91	-174.5	0	0	0	0	0	113.6
159	G	33.4	Very low	51.1	Low	64 Å²	64	107.3 Å²	107.3	66%	0.66	62%	0.618	S	S	*	*			trans	-116.1	118.8	165.9	0	0	0	0	0	110.5	G157 Q161	G157-G159 PolarHBondContact O-N 2.94Å; G159-Q161 PolarHBondContact O-N 3.14Å
160	G	49.3	Very low	54.2	Low	75 Å²	75	99.4 Å²	99.4	77%	0.773	58%	0.584	S	S	*	*			trans	-67.5	120.7	175.6	0	0	0	0	0	110.7	V162	G160-V162 PolarHBondContact O-N 3.06Å; G160-V162 VanDerWaalsContact O-N 3.07Å
161	Q	61.9	Low	57	Low	145 Å²	145	103.4 Å²	103.4	68%	0.678	59%	0.588	S	S	*	*			trans	-60.6	112.7	179.2	-72.5	-176.4	-40.3	0	0	110.6	G159 M163 I187	G159-Q161 PolarHBondContact O-N 3.14Å; Q161-M163 PolarHBondContact O-N 2.64Å; Q161-I187 HydrophobicContact CB-CG2 4.25Å; Q161-I187 HydrophobicContact CG-CG2 4.49Å
162	V	78.1	Confident	59.8	Low	50 Å²	50	100.8 Å²	100.8	30%	0.303	57%	0.568	S	S	.	*			trans	-74.8	107.9	178.9	-178.9	0	0	0	0	108.5	G160 V164 V188 E215	G160-V162 PolarHBondContact O-N 3.06Å; G160-V162 VanDerWaalsContact O-N 3.07Å; V162-V164 HydrophobicContact CG1-CG1 4.23Å; V162-V188 HydrophobicContact CB-CB 4.26Å; V162-V188 HydrophobicContact CG1-CG2 4.39Å; V162-V188 VanDerWaalsContact O-CB 3.28Å; V162-V188 WeakPolarHBondContact O-CB 3.45Å; V162-V188 WeakPolarHBondContact O-CG2 3.45Å; V162-V188 PolarHBondContact O-N 3.05Å; V162-E215 HydrophobicContact CG1-CG 4.12Å
163	M	85.4	Confident	62.1	Low	75 Å²	75	98.5 Å²	98.5	37%	0.369	56%	0.561	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-87.1	140.2	171.7	-68.1	-178.1	-74.5	0	0	110	Q161 V185 I187 I216	Q161-M163 PolarHBondContact O-N 2.64Å; M163-V185 HydrophobicContact CB-CG1 4.27Å; M163-I187 HydrophobicContact CG-CG1 4.43Å; M163-I216 HydrophobicContact CB-CB 4.32Å; M163-I216 HydrophobicContact CB-CD1 4.16Å; M163-I216 PolarHBondContact O-N 3.29Å
164	V	85.4	Confident	64.5	Low	0 Å²	0	94.2 Å²	94.2	0%	0	54%	0.542	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	144.4	178.2	-59.6	0	0	0	0	110.8	V162 V185 I186 V188 W197 F208 V213 R214 E215	V162-V164 HydrophobicContact CG1-CG1 4.23Å; V164-V185 CarbonylContact O-C 3.53Å; V164-V185 WeakPolarHBondContact O-CA 3.43Å; V164-I186 HydrophobicContact CG2-CB 3.83Å; V164-I186 HydrophobicContact CG2-CD1 4.44Å; V164-I186 PolarHBondContact N-O 2.99Å; V164-I186 PolarHBondContact O-N 3.46Å; V164-V188 HydrophobicContact CB-CG2 4.3Å; V164-V188 HydrophobicContact CG1-CG2 3.49Å; V164-V188 VanDerWaalsContact CG1-CG2 3.49Å; V164-V188 HydrophobicContact CG2-CG2 3.81Å; V164-W197 HydrophobicContact CG1-CE3 4.26Å; V164-W197 HydrophobicContact CG1-CZ3 3.85Å; V164-F208 HydrophobicContact CG2-CE2 4.25Å; V164-F208 HydrophobicContact CG2-CZ 3.92Å; V164-V213 HydrophobicContact CB-CB 3.92Å; V164-V213 HydrophobicContact CB-CG2 3.84Å; V164-V213 HydrophobicContact CG1-CG2 4.15Å; V164-V213 HydrophobicContact CG2-CB 3.94Å; V164-V213 HydrophobicContact CG2-CG1 4.03Å; V164-V213 HydrophobicContact CG2-CG2 3.91Å; V164-R214 CarbonylContact C-O 3.57Å; V164-R214 VanDerWaalsContact CA-O 3.26Å; V164-R214 WeakPolarHBondContact CA-O 3.34Å; V164-E215 HydrophobicContact CG1-CG 4.22Å
165	K	88.9	Confident	66.9	Low	108 Å²	108	98 Å²	98	47%	0.47	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	129.8	175.4	-163.5	167.5	-174.4	171.1	0	110.9	R167 G183 E184 V185 V213 R214 I216	K165-R167 PolarHBondContact O-N 3.17Å; K165-G183 WeakPolarHBondContact CE-O 3.46Å; K165-E184 WeakPolarHBondContact CA-O 3.01Å; K165-V185 HydrophobicContact CG-CG2 4.29Å; K165-V213 CarbonylContact O-C 3.5Å; K165-V213 VanDerWaalsContact O-CA 3.28Å; K165-V213 WeakPolarHBondContact O-CA 3.41Å; K165-R214 PolarHBondContact N-O 2.88Å; K165-R214 PolarHBondContact O-N 3.04Å; K165-I216 HydrophobicContact CB-CD1 4.07Å; K165-I216 HydrophobicContact CB-CG1 4.19Å
166	A	88.1	Confident	69.4	Low	5 Å²	5	95.6 Å²	95.6	4%	0.041	54%	0.541	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	121.7	175	0	0	0	0	0	111.7	F180 S181 G183 E184	A166-F180 HydrophobicContact CB-CD2 3.39Å; A166-F180 HydrophobicContact CB-CE2 3.55Å; A166-F180 HydrophobicContact CB-CG 4.44Å; A166-S181 VanDerWaalsContact CB-O 3.24Å; A166-S181 WeakPolarHBondContact CB-O 3.03Å; A166-G183 PolarHBondContact O-N 3.31Å; A166-E184 PolarHBondContact N-O 2.94Å
167	R	82.3	Confident	72.4	Confident	120 Å²	120	89.6 Å²	89.6	45%	0.453	51%	0.507	S	S	.	.	S	Bend	trans	-85.8	-29	174.5	-58.4	-175.3	75.6	174.9	-3.6	112.1	K165 K182 Y212 V213 R214	K165-R167 PolarHBondContact O-N 3.17Å; R167-K182 WeakPolarHBondContact O-CD 3.24Å; R167-K182 WeakPolarHBondContact O-CE 3.47Å; R167-K182 VanDerWaalsContact O-CG 3.32Å; R167-K182 WeakPolarHBondContact O-CG 3.46Å; R167-Y212 PolarHBondContact N-O 3.17Å; R167-V213 VanDerWaalsContact CD-O 3.27Å; R167-V213 WeakPolarHBondContact CD-O 3.47Å; R167-R214 HydrophobicContact CG-CB 4.07Å
168	F	78.6	Confident	75.3	Confident	110 Å²	110	86.6 Å²	86.6	48%	0.482	48%	0.476	S	S	.	.	S	Bend	trans	-135	157.6	178.8	-53.1	-75.1	0	0	0	109.3	F180 Y212	F168-F180 WeakPolarHBondContact O-CE2 3.39Å; F168-Y212 HydrophobicContact CB-CD1 3.69Å; F168-Y212 HydrophobicContact CB-CE1 3.97Å; F168-Y212 HydrophobicContact CB-CG 4.46Å; F168-Y212 PolarHBondContact N-O 3.15Å
169	N	83.8	Confident	77.8	Confident	112 Å²	112	84.3 Å²	84.3	60%	0.599	45%	0.445	S	S	*	.			trans	-80.6	125.2	174.4	35.4	-88.4	0	0	0	110.6	F180	N169-F180 CarbonylContact C-O 3.49Å; N169-F180 WeakPolarHBondContact CA-O 3.35Å
170	F	85.5	Confident	80.4	Confident	29 Å²	29	81.6 Å²	81.6	13%	0.127	42%	0.415	C	S	.	.	B	Isolated β-bridge	trans	-116.5	128.5	-179.4	-178.6	-108.6	0	0	0	109.6	E177 L178 S179 F180 W196 F208 P209 Y212	F170-E177 HydrophobicContact CE1-CB 4.49Å; F170-L178 WeakPolarHBondContact CD1-O 3.43Å; F170-S179 WeakPolarHBondContact O-CA 3.36Å; F170-F180 HydrophobicContact CB-CD1 4.42Å; F170-F180 HydrophobicContact CB-CD2 4.17Å; F170-F180 HydrophobicContact CB-CE1 3.96Å; F170-F180 HydrophobicContact CB-CE2 3.67Å; F170-F180 HydrophobicContact CB-CZ 3.57Å; F170-F180 AromaticContact CD1-CE1 3.95Å; F170-F180 HydrophobicContact CD1-CE1 3.95Å; F170-F180 HydrophobicContact CD1-CZ 4.27Å; F170-F180 HydrophobicContact CG-CE1 4.35Å; F170-F180 HydrophobicContact CG-CZ 4.22Å; F170-F180 PolarHBondContact N-O 2.93Å; F170-F180 PolarHBondContact O-N 3.49Å; F170-W196 AromaticContact CZ-CH2 4Å; F170-W196 HydrophobicContact CZ-CH2 4Å; F170-W196 HydrophobicContact CZ-CZ3 4.02Å; F170-F208 HydrophobicContact CD1-CB 4.25Å; F170-F208 HydrophobicContact CE1-CB 4.28Å; F170-P209 HydrophobicContact CD2-CG 4.15Å; F170-P209 HydrophobicContact CE2-CG 3.94Å; F170-P209 HydrophobicContact CZ-CG 4.37Å; F170-Y212 HydrophobicContact CB-CD1 3.98Å; F170-Y212 HydrophobicContact CD2-CD1 4.23Å; F170-Y212 HydrophobicContact CD2-CE1 4.3Å
171	K	84.5	Confident	82.2	Confident	185 Å²	185	81.3 Å²	81.3	80%	0.804	40%	0.401	S	S	*	.			trans	-107.4	128.1	175.5	-70.7	-175	178.4	-178.7	0	108.3	N173	K171-N173 PolarHBondContact O-N 2.94Å
172	Q	83.8	Confident	83.2	Confident	78 Å²	78	81.4 Å²	81.4	36%	0.364	40%	0.399	S	S	.	.			trans	-57.3	133.1	174	68.5	-174.4	104.7	0	0	110.9	N174 E177 S179	Q172-N174 PolarHBondContact NE2-O 2.67Å; Q172-N174 VanDerWaalsContact NE2-O 3.16Å; Q172-E177 HydrophobicContact CB-CB 3.65Å; Q172-E177 VanDerWaalsContact CB-O 3.25Å; Q172-E177 WeakPolarHBondContact CB-O 3.28Å; Q172-E177 PolarHBondContact NE2-O 2.84Å; Q172-S179 PolarHBondContact OE1-OG 3.31Å
173	N	71.9	Confident	83.2	Confident	139 Å²	139	80.6 Å²	80.6	74%	0.743	40%	0.401	S	S	*	.	S	Bend	trans	-99	-30.9	170.5	-173	91.6	0	0	0	111	K171 E177	K171-N173 PolarHBondContact O-N 2.94Å; N173-E177 PolarHBondContact N-OE2 3.37Å
174	N	76.9	Confident	83.3	Confident	84 Å²	84	79.8 Å²	79.8	45%	0.449	40%	0.396	S	S	.	.	S	Bend	trans	-110.4	167.2	176.7	-63.4	-63.2	0	0	0	111.9	Q172 D176 E177	Q172-N174 PolarHBondContact NE2-O 2.67Å; Q172-N174 VanDerWaalsContact NE2-O 3.16Å; N174-D176 VanDerWaalsContact C-N 3.32Å; N174-E177 HydrophobicContact CB-CG 4.21Å; N174-E177 PolarHBondContact N-OE2 2.9Å; N174-E177 PolarHBondContact ND2-OE1 2.68Å; N174-E177 PolarHBondContact O-N 3.04Å
175	E	75.7	Confident	83.5	Confident	188 Å²	188	82.8 Å²	82.8	88%	0.879	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-28.1	177.5	-64.5	-166.9	165.5	0	0	112.2	E177	E175-E177 VanDerWaalsContact C-N 3.27Å; E175-E177 PolarHBondContact O-N 3.11Å
176	D	80.7	Confident	83.4	Confident	124 Å²	124	77.6 Å²	77.6	66%	0.663	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-2.1	177.2	-50.6	-69.2	0	0	0	114	N174 G206 W207	N174-D176 VanDerWaalsContact C-N 3.32Å; D176-G206 CarbonylContact O-C 3.54Å; D176-G206 VanDerWaalsContact O-CA 3.3Å; D176-G206 WeakPolarHBondContact O-CA 3.35Å; D176-W207 PolarHBondContact O-N 2.93Å
177	E	87.2	Confident	83.5	Confident	29 Å²	29	80.4 Å²	80.4	14%	0.136	41%	0.405	C	S	.	.	B	Isolated β-bridge	trans	-99.5	142.9	-174.9	-77.8	170.5	-152.6	0	0	113.4	F170 Q172 N173 N174 E175 W196 W207	F170-E177 HydrophobicContact CE1-CB 4.49Å; Q172-E177 HydrophobicContact CB-CB 3.65Å; Q172-E177 VanDerWaalsContact CB-O 3.25Å; Q172-E177 WeakPolarHBondContact CB-O 3.28Å; Q172-E177 PolarHBondContact NE2-O 2.84Å; N173-E177 PolarHBondContact N-OE2 3.37Å; N174-E177 HydrophobicContact CB-CG 4.21Å; N174-E177 PolarHBondContact N-OE2 2.9Å; N174-E177 PolarHBondContact ND2-OE1 2.68Å; N174-E177 PolarHBondContact O-N 3.04Å; E175-E177 VanDerWaalsContact C-N 3.27Å; E175-E177 PolarHBondContact O-N 3.11Å; E177-W196 HydrophobicContact CG-CZ3 4.23Å; E177-W207 CarbonylContact C-O 3.57Å; E177-W207 WeakPolarHBondContact CA-O 3.37Å
178	L	86.4	Confident	83.7	Confident	5 Å²	5	75.3 Å²	75.3	3%	0.026	39%	0.388	C	S	.	.			trans	-92.1	109.7	-177.7	-172.9	74.2	0	0	0	111.5	F170 F180 I186 L201 K204 W207 F208	F170-L178 WeakPolarHBondContact CD1-O 3.43Å; L178-F180 HydrophobicContact CD2-CD1 4.3Å; L178-F180 HydrophobicContact CG-CD1 4.36Å; L178-F180 VanDerWaalsContact O-CD1 3.26Å; L178-F180 WeakPolarHBondContact O-CD1 3.3Å; L178-I186 HydrophobicContact CD2-CD1 4.17Å; L178-I186 HydrophobicContact CD2-CG1 4.3Å; L178-I186 HydrophobicContact CD2-CG2 3.6Å; L178-L201 HydrophobicContact CD1-CB 4.26Å; L178-L201 HydrophobicContact CD2-CB 3.99Å; L178-L201 HydrophobicContact CG-CB 4.48Å; L178-K204 HydrophobicContact CD1-CB 4Å; L178-K204 WeakPolarHBondContact CD1-O 3.31Å; L178-W207 PolarHBondContact N-O 2.95Å; L178-F208 HydrophobicContact CB-CD1 4.46Å; L178-F208 HydrophobicContact CD2-CD1 4.03Å; L178-F208 HydrophobicContact CD2-CE1 4.4Å
179	S	86.4	Confident	84	Confident	45 Å²	45	73.7 Å²	73.7	32%	0.315	39%	0.387	S	S	.	.			trans	-76.5	133.9	171.9	48.4	0	0	0	0	112.7	F170 Q172	F170-S179 WeakPolarHBondContact O-CA 3.36Å; Q172-S179 PolarHBondContact OE1-OG 3.31Å
180	F	87.8	Confident	83.9	Confident	8 Å²	8	74.4 Å²	74.4	4%	0.035	38%	0.381	C	S	.	.	B	Isolated β-bridge	trans	-155.2	159.5	177.3	57.2	-100.5	0	0	0	114.1	A166 F168 N169 F170 L178 E184 I186 L201 F208 V213	A166-F180 HydrophobicContact CB-CD2 3.39Å; A166-F180 HydrophobicContact CB-CE2 3.55Å; A166-F180 HydrophobicContact CB-CG 4.44Å; F168-F180 WeakPolarHBondContact O-CE2 3.39Å; N169-F180 CarbonylContact C-O 3.49Å; N169-F180 WeakPolarHBondContact CA-O 3.35Å; F170-F180 HydrophobicContact CB-CD1 4.42Å; F170-F180 HydrophobicContact CB-CD2 4.17Å; F170-F180 HydrophobicContact CB-CE1 3.96Å; F170-F180 HydrophobicContact CB-CE2 3.67Å; F170-F180 HydrophobicContact CB-CZ 3.57Å; F170-F180 AromaticContact CD1-CE1 3.95Å; F170-F180 HydrophobicContact CD1-CE1 3.95Å; F170-F180 HydrophobicContact CD1-CZ 4.27Å; F170-F180 HydrophobicContact CG-CE1 4.35Å; F170-F180 HydrophobicContact CG-CZ 4.22Å; F170-F180 PolarHBondContact N-O 2.93Å; F170-F180 PolarHBondContact O-N 3.49Å; L178-F180 HydrophobicContact CD2-CD1 4.3Å; L178-F180 HydrophobicContact CG-CD1 4.36Å; L178-F180 VanDerWaalsContact O-CD1 3.26Å; L178-F180 WeakPolarHBondContact O-CD1 3.3Å; F180-E184 WeakPolarHBondContact CA-OE2 3.41Å; F180-I186 HydrophobicContact CD1-CD1 3.47Å; F180-I186 VanDerWaalsContact CD1-CD1 3.47Å; F180-I186 HydrophobicContact CD2-CD1 4.27Å; F180-I186 HydrophobicContact CE1-CD1 3.52Å; F180-I186 HydrophobicContact CE2-CD1 4.33Å; F180-I186 HydrophobicContact CG-CD1 3.86Å; F180-I186 HydrophobicContact CZ-CD1 3.97Å; F180-L201 HydrophobicContact CB-CD2 3.52Å; F180-F208 HydrophobicContact CE1-CB 3.51Å; F180-F208 HydrophobicContact CE1-CD1 4.35Å; F180-F208 HydrophobicContact CE1-CD2 4.24Å; F180-F208 AromaticContact CE1-CG 3.79Å; F180-F208 HydrophobicContact CE1-CG 3.79Å; F180-F208 HydrophobicContact CZ-CB 4.09Å; F180-F208 HydrophobicContact CZ-CD2 4.34Å; F180-F208 HydrophobicContact CZ-CG 4.32Å; F180-V213 HydrophobicContact CE2-CG1 4.41Å; F180-V213 HydrophobicContact CZ-CG1 4.07Å
181	S	87.2	Confident	83.8	Confident	69 Å²	69	77.5 Å²	77.5	48%	0.483	40%	0.396	S	S	.	.			trans	-98.1	153.5	178	-56.1	0	0	0	0	112.1	A166 G183 E184	A166-S181 VanDerWaalsContact CB-O 3.24Å; A166-S181 WeakPolarHBondContact CB-O 3.03Å; S181-G183 PolarHBondContact O-N 3.36Å; S181-E184 WeakPolarHBondContact CB-OE2 3.48Å; S181-E184 PolarHBondContact N-OE2 3.48Å; S181-E184 PolarHBondContact O-N 2.99Å; S181-E184 VanDerWaalsContact O-N 3.14Å
182	K	82.9	Confident	83.4	Confident	146 Å²	146	72.6 Å²	72.6	64%	0.635	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	122.9	172.2	174	175.4	-179.1	-171.4	0	109.9	R167	R167-K182 WeakPolarHBondContact O-CD 3.24Å; R167-K182 WeakPolarHBondContact O-CE 3.47Å; R167-K182 VanDerWaalsContact O-CG 3.32Å; R167-K182 WeakPolarHBondContact O-CG 3.46Å
183	G	78.6	Confident	82.3	Confident	33 Å²	33	77.4 Å²	77.4	34%	0.34	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	101.9	-13.3	179.7	0	0	0	0	0	115.8	K165 A166 S181	K165-G183 WeakPolarHBondContact CE-O 3.46Å; A166-G183 PolarHBondContact O-N 3.31Å; S181-G183 PolarHBondContact O-N 3.36Å
184	E	87.8	Confident	82.1	Confident	58 Å²	58	74 Å²	74	27%	0.271	40%	0.402	S	S	.	.			trans	-68.8	154.1	174.4	-66.8	-170.6	98.9	0	0	111.9	K165 A166 F180 S181 L201 N202	K165-E184 WeakPolarHBondContact CA-O 3.01Å; A166-E184 PolarHBondContact N-O 2.94Å; F180-E184 WeakPolarHBondContact CA-OE2 3.41Å; S181-E184 WeakPolarHBondContact CB-OE2 3.48Å; S181-E184 PolarHBondContact N-OE2 3.48Å; S181-E184 PolarHBondContact O-N 2.99Å; S181-E184 VanDerWaalsContact O-N 3.14Å; E184-L201 HydrophobicContact CB-CD1 4.2Å; E184-L201 HydrophobicContact CB-CD2 4.17Å; E184-N202 PolarHBondContact OE1-ND2 2.77Å
185	V	87.7	Confident	82.1	Confident	63 Å²	63	71.2 Å²	71.2	38%	0.382	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	122.3	-178.1	178.8	0	0	0	0	109.5	M163 V164 K165 L201 I216	M163-V185 HydrophobicContact CB-CG1 4.27Å; V164-V185 CarbonylContact O-C 3.53Å; V164-V185 WeakPolarHBondContact O-CA 3.43Å; K165-V185 HydrophobicContact CG-CG2 4.29Å; V185-L201 WeakPolarHBondContact O-CD1 3.22Å; V185-I216 HydrophobicContact CG1-CD1 3.73Å; V185-I216 HydrophobicContact CG2-CD1 4.01Å
186	I	88.4	Confident	82.7	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	136.9	-175.9	-48	163.7	0	0	0	107.8	V164 L178 F180 L201 F208 V213	V164-I186 HydrophobicContact CG2-CB 3.83Å; V164-I186 HydrophobicContact CG2-CD1 4.44Å; V164-I186 PolarHBondContact N-O 2.99Å; V164-I186 PolarHBondContact O-N 3.46Å; L178-I186 HydrophobicContact CD2-CD1 4.17Å; L178-I186 HydrophobicContact CD2-CG1 4.3Å; L178-I186 HydrophobicContact CD2-CG2 3.6Å; F180-I186 HydrophobicContact CD1-CD1 3.47Å; F180-I186 VanDerWaalsContact CD1-CD1 3.47Å; F180-I186 HydrophobicContact CD2-CD1 4.27Å; F180-I186 HydrophobicContact CE1-CD1 3.52Å; F180-I186 HydrophobicContact CE2-CD1 4.33Å; F180-I186 HydrophobicContact CG-CD1 3.86Å; F180-I186 HydrophobicContact CZ-CD1 3.97Å; I186-L201 HydrophobicContact CG1-CB 4.34Å; I186-L201 HydrophobicContact CG2-CB 4.48Å; I186-F208 HydrophobicContact CD1-CD1 4.34Å; I186-F208 HydrophobicContact CD1-CE1 4.19Å; I186-F208 HydrophobicContact CD1-CZ 4.29Å; I186-F208 HydrophobicContact CG2-CD1 4.49Å; I186-F208 HydrophobicContact CG2-CE1 3.73Å; I186-F208 HydrophobicContact CG2-CZ 4.23Å; I186-V213 HydrophobicContact CD1-CG1 4.14Å
187	I	88.7	Confident	83.1	Confident	63 Å²	63	63.4 Å²	63.4	32%	0.323	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	113.3	173.2	-57.6	172.7	0	0	0	107.4	Q161 M163 T189 G199 T200	Q161-I187 HydrophobicContact CB-CG2 4.25Å; Q161-I187 HydrophobicContact CG-CG2 4.49Å; M163-I187 HydrophobicContact CG-CG1 4.43Å; I187-T189 PolarHBondContact O-N 2.93Å; I187-G199 CarbonylContact O-C 3.42Å; I187-G199 WeakPolarHBondContact O-CA 3.32Å; I187-T200 PolarHBondContact N-O 3.43Å; I187-T200 PolarHBondContact O-N 3.27Å
188	V	88.4	Confident	83.1	Confident	14 Å²	14	64.5 Å²	64.5	9%	0.085	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	125.2	179	-177	0	0	0	0	109.3	V162 V164 Q191 W197 E198 F208	V162-V188 HydrophobicContact CB-CB 4.26Å; V162-V188 HydrophobicContact CG1-CG2 4.39Å; V162-V188 VanDerWaalsContact O-CB 3.28Å; V162-V188 WeakPolarHBondContact O-CB 3.45Å; V162-V188 WeakPolarHBondContact O-CG2 3.45Å; V162-V188 PolarHBondContact O-N 3.05Å; V164-V188 HydrophobicContact CB-CG2 4.3Å; V164-V188 HydrophobicContact CG1-CG2 3.49Å; V164-V188 VanDerWaalsContact CG1-CG2 3.49Å; V164-V188 HydrophobicContact CG2-CG2 3.81Å; V188-Q191 HydrophobicContact CG1-CG 3.69Å; V188-W197 HydrophobicContact CG1-CB 4.42Å; V188-W197 HydrophobicContact CG2-CE3 4.22Å; V188-E198 WeakPolarHBondContact CA-O 3.41Å; V188-E198 WeakPolarHBondContact CG1-O 3.45Å; V188-F208 HydrophobicContact CG2-CZ 4.29Å
189	T	83.7	Confident	83.2	Confident	75 Å²	75	64.2 Å²	64.2	46%	0.46	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	-31.9	176.7	43.8	0	0	0	0	111.6	I187 E198	I187-T189 PolarHBondContact O-N 2.93Å; T189-E198 WeakPolarHBondContact CB-OE2 3.44Å; T189-E198 PolarHBondContact N-O 2.75Å; T189-E198 WeakPolarHBondContact OG1-CG 3.34Å; T189-E198 PolarHBondContact OG1-O 3.33Å; T189-E198 PolarHBondContact OG1-OE2 3.39Å
190	R	81.3	Confident	83.3	Confident	128 Å²	128	63.8 Å²	63.8	48%	0.483	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	128.4	176.2	178.8	176.9	172.4	170.2	-6.1	111	E192 W197 E198 W207	R190-E192 IonicContact CZ-OE1 2.69Å; R190-E192 VanDerWaalsContact CZ-OE1 3.23Å; R190-E192 IonicContact NE-OE1 2.77Å; R190-E192 PolarHBondContact NE-OE1 3.05Å; R190-E192 IonicContact NH2-OE1 2.65Å; R190-E192 PolarHBondContact NH2-OE1 3.12Å; R190-W197 CarbonylContact O-C 3.6Å; R190-W197 WeakPolarHBondContact O-CA 3.15Å; R190-E198 HydrophobicContact CB-CB 3.93Å; R190-E198 PolarHBondContact N-O 2.72Å; R190-E198 PolarHBondContact O-N 3.34Å; R190-W207 HydrophobicContact CG-CH2 4.37Å
191	Q	83.3	Confident	83.1	Confident	93 Å²	93	64.1 Å²	64.1	44%	0.435	35%	0.348	S	S	.	.			trans	-95.5	143.9	164.7	-66.5	-176.3	-29.6	0	0	108.9	V188 W197 E215	V188-Q191 HydrophobicContact CG1-CG 3.69Å; Q191-W197 HydrophobicContact CG-CD2 4.05Å; Q191-W197 HydrophobicContact CG-CG 4.2Å; Q191-W197 HydrophobicContact CG-CZ2 4.34Å; Q191-E215 PolarHBondContact NE2-OE1 2.9Å
192	E	76.8	Confident	82.7	Confident	83 Å²	83	67.5 Å²	67.5	39%	0.388	36%	0.36	S	S	.	.			trans	-141.5	138.6	177.8	-165.7	155.2	-80	0	0	109.9	R190 G194 G195 W207	R190-E192 IonicContact CZ-OE1 2.69Å; R190-E192 VanDerWaalsContact CZ-OE1 3.23Å; R190-E192 IonicContact NE-OE1 2.77Å; R190-E192 PolarHBondContact NE-OE1 3.05Å; R190-E192 IonicContact NH2-OE1 2.65Å; R190-E192 PolarHBondContact NH2-OE1 3.12Å; E192-G194 PolarHBondContact O-N 2.91Å; E192-G195 PolarHBondContact O-N 3.39Å; E192-W207 HydrophobicContact CB-CZ3 4.04Å
193	D	60.4	Low	82.4	Confident	178 Å²	178	64 Å²	64	95%	0.952	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-13.2	-168.2	-60.7	-55.5	0	0	0	113.8	G195	D193-G195 PolarHBondContact O-N 3.31Å
194	G	69	Low	82.4	Confident	68 Å²	68	68.9 Å²	68.9	70%	0.701	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	2.9	172.5	0	0	0	0	0	115.1	E192 W196	E192-G194 PolarHBondContact O-N 2.91Å; G194-W196 VanDerWaalsContact C-N 3.31Å; G194-W196 PolarHBondContact O-N 3.42Å
195	G	77	Confident	82.3	Confident	26 Å²	26	70 Å²	70	27%	0.268	39%	0.389	S	S	.	.	S	Bend	trans	81.1	5.5	176.4	0	0	0	0	0	115.1	E192 D193 S210	E192-G195 PolarHBondContact O-N 3.39Å; D193-G195 PolarHBondContact O-N 3.31Å; G195-S210 PolarHBondContact O-N 3.18Å; G195-S210 PolarHBondContact O-OG 3.09Å
196	W	86.6	Confident	82.4	Confident	107 Å²	107	67.1 Å²	67.1	41%	0.405	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	131.2	168.6	-74.2	80.7	0	0	0	109.5	F170 E177 G194 W207 F208 P209	F170-W196 AromaticContact CZ-CH2 4Å; F170-W196 HydrophobicContact CZ-CH2 4Å; F170-W196 HydrophobicContact CZ-CZ3 4.02Å; E177-W196 HydrophobicContact CG-CZ3 4.23Å; G194-W196 VanDerWaalsContact C-N 3.31Å; G194-W196 PolarHBondContact O-N 3.42Å; W196-W207 HydrophobicContact CB-CE3 4.3Å; W196-W207 HydrophobicContact CE3-CB 4.35Å; W196-F208 WeakPolarHBondContact CA-O 3.24Å; W196-P209 HydrophobicContact CD2-CB 4.36Å; W196-P209 HydrophobicContact CE3-CB 4.47Å; W196-P209 HydrophobicContact CZ2-CB 4.4Å
197	W	89.6	Confident	82.4	Confident	40 Å²	40	69.9 Å²	69.9	15%	0.152	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	135.7	-179.8	-67	-8.2	0	0	0	109.2	V164 V188 R190 Q191 W207 F208 S210 V213 E215	V164-W197 HydrophobicContact CG1-CE3 4.26Å; V164-W197 HydrophobicContact CG1-CZ3 3.85Å; V188-W197 HydrophobicContact CG1-CB 4.42Å; V188-W197 HydrophobicContact CG2-CE3 4.22Å; R190-W197 CarbonylContact O-C 3.6Å; R190-W197 WeakPolarHBondContact O-CA 3.15Å; Q191-W197 HydrophobicContact CG-CD2 4.05Å; Q191-W197 HydrophobicContact CG-CG 4.2Å; Q191-W197 HydrophobicContact CG-CZ2 4.34Å; W197-W207 WeakPolarHBondContact O-CB 3.44Å; W197-F208 HydrophobicContact CB-CE1 4.48Å; W197-F208 HydrophobicContact CB-CE2 3.97Å; W197-F208 HydrophobicContact CB-CZ 3.92Å; W197-F208 HydrophobicContact CE3-CE2 4.32Å; W197-F208 PolarHBondContact N-O 2.9Å; W197-F208 WeakPolarHBondContact O-CD1 3.31Å; W197-F208 WeakPolarHBondContact O-CE1 3.32Å; W197-F208 PolarHBondContact O-N 2.8Å; W197-F208 VanDerWaalsContact O-N 3.07Å; W197-S210 VanDerWaalsContact CD2-CB 3.49Å; W197-S210 VanDerWaalsContact CE2-CB 3.48Å; W197-V213 HydrophobicContact CE3-CG2 4.11Å; W197-V213 HydrophobicContact CZ3-CG2 4.05Å; W197-E215 HydrophobicContact CH2-CG 4.24Å; W197-E215 HydrophobicContact CZ3-CG 4.33Å
198	E	87.1	Confident	82.4	Confident	52 Å²	52	66.9 Å²	66.9	24%	0.243	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	138.2	170.3	-164.1	-162.9	-113.5	0	0	108.8	V188 T189 R190 T205 W207	V188-E198 WeakPolarHBondContact CA-O 3.41Å; V188-E198 WeakPolarHBondContact CG1-O 3.45Å; T189-E198 WeakPolarHBondContact CB-OE2 3.44Å; T189-E198 PolarHBondContact N-O 2.75Å; T189-E198 WeakPolarHBondContact OG1-CG 3.34Å; T189-E198 PolarHBondContact OG1-O 3.33Å; T189-E198 PolarHBondContact OG1-OE2 3.39Å; R190-E198 HydrophobicContact CB-CB 3.93Å; R190-E198 PolarHBondContact N-O 2.72Å; R190-E198 PolarHBondContact O-N 3.34Å; E198-T205 HydrophobicContact CG-CG2 3.88Å; E198-W207 HydrophobicContact CB-CD2 3.76Å; E198-W207 HydrophobicContact CB-CE3 3.89Å; E198-W207 HydrophobicContact CB-CG 4.13Å; E198-W207 HydrophobicContact CB-CZ2 4.49Å; E198-W207 HydrophobicContact CB-CZ3 4.33Å; E198-W207 HydrophobicContact CG-CD2 4.27Å; E198-W207 HydrophobicContact CG-CG 4.29Å
199	G	89.4	Confident	82.4	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	173.3	170.6	0	0	0	0	0	113.3	I187 T205 G206	I187-G199 CarbonylContact O-C 3.42Å; I187-G199 WeakPolarHBondContact O-CA 3.32Å; G199-T205 CarbonylContact O-C 3.59Å; G199-T205 VanDerWaalsContact O-CA 3.28Å; G199-T205 WeakPolarHBondContact O-CA 3.44Å; G199-G206 PolarHBondContact N-O 3.01Å; G199-G206 PolarHBondContact O-N 2.98Å
200	T	88.3	Confident	82.4	Confident	36 Å²	36	64.9 Å²	64.9	22%	0.221	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	130	-174	-57	0	0	0	0	111.3	I187 K204 T205	I187-T200 PolarHBondContact N-O 3.43Å; I187-T200 PolarHBondContact O-N 3.27Å; T200-K204 CarbonylContact C-O 3.5Å; T200-K204 VanDerWaalsContact CA-O 3.23Å; T200-K204 WeakPolarHBondContact CA-O 3.45Å; T200-K204 WeakPolarHBondContact CG2-O 3.39Å; T200-T205 WeakPolarHBondContact OG1-CG2 3.29Å; T200-T205 PolarHBondContact OG1-OG1 3.46Å
201	L	83.6	Confident	82.6	Confident	15 Å²	15	64 Å²	64	8%	0.079	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	129.5	174.7	172.9	66.5	0	0	0	108.8	L178 F180 E184 V185 I186 G203 K204	L178-L201 HydrophobicContact CD1-CB 4.26Å; L178-L201 HydrophobicContact CD2-CB 3.99Å; L178-L201 HydrophobicContact CG-CB 4.48Å; F180-L201 HydrophobicContact CB-CD2 3.52Å; E184-L201 HydrophobicContact CB-CD1 4.2Å; E184-L201 HydrophobicContact CB-CD2 4.17Å; V185-L201 WeakPolarHBondContact O-CD1 3.22Å; I186-L201 HydrophobicContact CG1-CB 4.34Å; I186-L201 HydrophobicContact CG2-CB 4.48Å; L201-G203 PolarHBondContact O-N 3.08Å; L201-K204 PolarHBondContact N-O 3.41Å; L201-K204 PolarHBondContact O-N 3.4Å
202	N	77.8	Confident	82.5	Confident	139 Å²	139	63.7 Å²	63.7	74%	0.743	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	33	175.9	-59	-32.7	0	0	0	114.4	E184	E184-N202 PolarHBondContact OE1-ND2 2.77Å
203	G	76	Confident	82.9	Confident	74 Å²	74	60.1 Å²	60.1	76%	0.763	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.4	5.9	-179.1	0	0	0	0	0	115.8	L201	L201-G203 PolarHBondContact O-N 3.08Å
204	K	79.9	Confident	84	Confident	134 Å²	134	59.2 Å²	59.2	58%	0.583	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.1	139.8	167.8	-64.4	-179	177.8	-176.5	0	109.7	L178 T200 L201	L178-K204 HydrophobicContact CD1-CB 4Å; L178-K204 WeakPolarHBondContact CD1-O 3.31Å; T200-K204 CarbonylContact C-O 3.5Å; T200-K204 VanDerWaalsContact CA-O 3.23Å; T200-K204 WeakPolarHBondContact CA-O 3.45Å; T200-K204 WeakPolarHBondContact CG2-O 3.39Å; L201-K204 PolarHBondContact N-O 3.41Å; L201-K204 PolarHBondContact O-N 3.4Å
205	T	86.2	Confident	84.7	Confident	81 Å²	81	60 Å²	60	50%	0.497	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	142.6	177	-52.1	0	0	0	0	109.3	E198 G199 T200	E198-T205 HydrophobicContact CG-CG2 3.88Å; G199-T205 CarbonylContact O-C 3.59Å; G199-T205 VanDerWaalsContact O-CA 3.28Å; G199-T205 WeakPolarHBondContact O-CA 3.44Å; T200-T205 WeakPolarHBondContact OG1-CG2 3.29Å; T200-T205 PolarHBondContact OG1-OG1 3.46Å
206	G	89	Confident	84.8	Confident	3 Å²	3	62 Å²	62	3%	0.031	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.4	178.6	175.3	0	0	0	0	0	116.7	D176 G199	D176-G206 CarbonylContact O-C 3.54Å; D176-G206 VanDerWaalsContact O-CA 3.3Å; D176-G206 WeakPolarHBondContact O-CA 3.35Å; G199-G206 PolarHBondContact N-O 3.01Å; G199-G206 PolarHBondContact O-N 2.98Å
207	W	88.8	Confident	83.9	Confident	59 Å²	59	65.1 Å²	65.1	22%	0.223	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	122	179.9	50.2	-0.9	0	0	0	114.4	D176 E177 L178 R190 E192 W196 W197 E198	D176-W207 PolarHBondContact O-N 2.93Å; E177-W207 CarbonylContact C-O 3.57Å; E177-W207 WeakPolarHBondContact CA-O 3.37Å; L178-W207 PolarHBondContact N-O 2.95Å; R190-W207 HydrophobicContact CG-CH2 4.37Å; E192-W207 HydrophobicContact CB-CZ3 4.04Å; W196-W207 HydrophobicContact CB-CE3 4.3Å; W196-W207 HydrophobicContact CE3-CB 4.35Å; W197-W207 WeakPolarHBondContact O-CB 3.44Å; E198-W207 HydrophobicContact CB-CD2 3.76Å; E198-W207 HydrophobicContact CB-CE3 3.89Å; E198-W207 HydrophobicContact CB-CG 4.13Å; E198-W207 HydrophobicContact CB-CZ2 4.49Å; E198-W207 HydrophobicContact CB-CZ3 4.33Å; E198-W207 HydrophobicContact CG-CD2 4.27Å; E198-W207 HydrophobicContact CG-CG 4.29Å
208	F	88.5	Confident	81.8	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	153.9	162.8	67.4	-93.7	0	0	0	113.7	V164 F170 L178 F180 I186 V188 W196 W197 V213	V164-F208 HydrophobicContact CG2-CE2 4.25Å; V164-F208 HydrophobicContact CG2-CZ 3.92Å; F170-F208 HydrophobicContact CD1-CB 4.25Å; F170-F208 HydrophobicContact CE1-CB 4.28Å; L178-F208 HydrophobicContact CB-CD1 4.46Å; L178-F208 HydrophobicContact CD2-CD1 4.03Å; L178-F208 HydrophobicContact CD2-CE1 4.4Å; F180-F208 HydrophobicContact CE1-CB 3.51Å; F180-F208 HydrophobicContact CE1-CD1 4.35Å; F180-F208 HydrophobicContact CE1-CD2 4.24Å; F180-F208 AromaticContact CE1-CG 3.79Å; F180-F208 HydrophobicContact CE1-CG 3.79Å; F180-F208 HydrophobicContact CZ-CB 4.09Å; F180-F208 HydrophobicContact CZ-CD2 4.34Å; F180-F208 HydrophobicContact CZ-CG 4.32Å; I186-F208 HydrophobicContact CD1-CD1 4.34Å; I186-F208 HydrophobicContact CD1-CE1 4.19Å; I186-F208 HydrophobicContact CD1-CZ 4.29Å; I186-F208 HydrophobicContact CG2-CD1 4.49Å; I186-F208 HydrophobicContact CG2-CE1 3.73Å; I186-F208 HydrophobicContact CG2-CZ 4.23Å; V188-F208 HydrophobicContact CG2-CZ 4.29Å; W196-F208 WeakPolarHBondContact CA-O 3.24Å; W197-F208 HydrophobicContact CB-CE1 4.48Å; W197-F208 HydrophobicContact CB-CE2 3.97Å; W197-F208 HydrophobicContact CB-CZ 3.92Å; W197-F208 HydrophobicContact CE3-CE2 4.32Å; W197-F208 PolarHBondContact N-O 2.9Å; W197-F208 WeakPolarHBondContact O-CD1 3.31Å; W197-F208 WeakPolarHBondContact O-CE1 3.32Å; W197-F208 PolarHBondContact O-N 2.8Å; W197-F208 VanDerWaalsContact O-N 3.07Å; F208-V213 HydrophobicContact CD2-CG1 3.86Å; F208-V213 HydrophobicContact CE2-CB 4.36Å; F208-V213 HydrophobicContact CE2-CG1 3.61Å; F208-V213 HydrophobicContact CE2-CG2 3.79Å; F208-V213 HydrophobicContact CZ-CG1 4.5Å
209	P	87.3	Confident	79.1	Confident	13 Å²	13	72.5 Å²	72.5	8%	0.084	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	132.4	-179.6	33.7	-35.8	0	0	0	111.5	F170 W196 N211 Y212	F170-P209 HydrophobicContact CD2-CG 4.15Å; F170-P209 HydrophobicContact CE2-CG 3.94Å; F170-P209 HydrophobicContact CZ-CG 4.37Å; W196-P209 HydrophobicContact CD2-CB 4.36Å; W196-P209 HydrophobicContact CE3-CB 4.47Å; W196-P209 HydrophobicContact CZ2-CB 4.4Å; P209-N211 VanDerWaalsContact C-N 3.28Å; P209-N211 WeakPolarHBondContact CB-OD1 3.47Å; P209-N211 PolarHBondContact O-N 3.37Å; P209-Y212 HydrophobicContact CB-CD2 4.49Å; P209-Y212 HydrophobicContact CG-CD2 3.72Å; P209-Y212 HydrophobicContact CG-CE2 4.32Å; P209-Y212 HydrophobicContact CG-CG 4.1Å; P209-Y212 PolarHBondContact O-N 3.11Å
210	S	84.5	Confident	76.3	Confident	33 Å²	33	79.8 Å²	79.8	23%	0.231	42%	0.423	C	S	.	.	G	3₁₀ helix	trans	-65.6	-26.6	-169.6	68	0	0	0	0	114	G195 W197 Y212 V213	G195-S210 PolarHBondContact O-N 3.18Å; G195-S210 PolarHBondContact O-OG 3.09Å; W197-S210 VanDerWaalsContact CD2-CB 3.49Å; W197-S210 VanDerWaalsContact CE2-CB 3.48Å; S210-Y212 PolarHBondContact O-N 3.36Å; S210-V213 WeakPolarHBondContact O-CG2 3.36Å; S210-V213 PolarHBondContact O-N 3.29Å
211	N	85.1	Confident	73.6	Confident	111 Å²	111	86.5 Å²	86.5	59%	0.594	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-68.7	-14.4	175.4	63.8	-21.9	0	0	0	113.9	P209 V213	P209-N211 VanDerWaalsContact C-N 3.28Å; P209-N211 WeakPolarHBondContact CB-OD1 3.47Å; P209-N211 PolarHBondContact O-N 3.37Å; N211-V213 VanDerWaalsContact C-N 3.32Å
212	Y	81.5	Confident	71.4	Confident	85 Å²	85	91.4 Å²	91.4	33%	0.333	48%	0.482	S	S	.	.	G	3₁₀ helix	trans	-82.7	-7.5	174	-84.2	-118.9	0	0	0	113.2	R167 F168 F170 P209 S210	R167-Y212 PolarHBondContact N-O 3.17Å; F168-Y212 HydrophobicContact CB-CD1 3.69Å; F168-Y212 HydrophobicContact CB-CE1 3.97Å; F168-Y212 HydrophobicContact CB-CG 4.46Å; F168-Y212 PolarHBondContact N-O 3.15Å; F170-Y212 HydrophobicContact CB-CD1 3.98Å; F170-Y212 HydrophobicContact CD2-CD1 4.23Å; F170-Y212 HydrophobicContact CD2-CE1 4.3Å; P209-Y212 HydrophobicContact CB-CD2 4.49Å; P209-Y212 HydrophobicContact CG-CD2 3.72Å; P209-Y212 HydrophobicContact CG-CE2 4.32Å; P209-Y212 HydrophobicContact CG-CG 4.1Å; P209-Y212 PolarHBondContact O-N 3.11Å; S210-Y212 PolarHBondContact O-N 3.36Å
213	V	84.7	Confident	69	Low	9 Å²	9	93.1 Å²	93.1	6%	0.055	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	-179.6	-176.7	-55.5	0	0	0	0	113.1	V164 K165 R167 F180 I186 W197 F208 S210 N211	V164-V213 HydrophobicContact CB-CB 3.92Å; V164-V213 HydrophobicContact CB-CG2 3.84Å; V164-V213 HydrophobicContact CG1-CG2 4.15Å; V164-V213 HydrophobicContact CG2-CB 3.94Å; V164-V213 HydrophobicContact CG2-CG1 4.03Å; V164-V213 HydrophobicContact CG2-CG2 3.91Å; K165-V213 CarbonylContact O-C 3.5Å; K165-V213 VanDerWaalsContact O-CA 3.28Å; K165-V213 WeakPolarHBondContact O-CA 3.41Å; R167-V213 VanDerWaalsContact CD-O 3.27Å; R167-V213 WeakPolarHBondContact CD-O 3.47Å; F180-V213 HydrophobicContact CE2-CG1 4.41Å; F180-V213 HydrophobicContact CZ-CG1 4.07Å; I186-V213 HydrophobicContact CD1-CG1 4.14Å; W197-V213 HydrophobicContact CE3-CG2 4.11Å; W197-V213 HydrophobicContact CZ3-CG2 4.05Å; F208-V213 HydrophobicContact CD2-CG1 3.86Å; F208-V213 HydrophobicContact CE2-CB 4.36Å; F208-V213 HydrophobicContact CE2-CG1 3.61Å; F208-V213 HydrophobicContact CE2-CG2 3.79Å; F208-V213 HydrophobicContact CZ-CG1 4.5Å; S210-V213 WeakPolarHBondContact O-CG2 3.36Å; S210-V213 PolarHBondContact O-N 3.29Å; N211-V213 VanDerWaalsContact C-N 3.32Å
214	R	84.9	Confident	66.8	Low	159 Å²	159	95.1 Å²	95.1	60%	0.6	49%	0.492	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.4	131.8	170.1	179.1	-171.5	-78.8	-179.6	-7.5	109.1	V164 K165 R167	V164-R214 CarbonylContact C-O 3.57Å; V164-R214 VanDerWaalsContact CA-O 3.26Å; V164-R214 WeakPolarHBondContact CA-O 3.34Å; K165-R214 PolarHBondContact N-O 2.88Å; K165-R214 PolarHBondContact O-N 3.04Å; R167-R214 HydrophobicContact CG-CB 4.07Å
215	E	83.6	Confident	65.2	Low	85 Å²	85	94.3 Å²	94.3	40%	0.397	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	138.4	173	-63.7	-178.1	164	0	0	112.9	V162 V164 Q191 W197	V162-E215 HydrophobicContact CG1-CG 4.12Å; V164-E215 HydrophobicContact CG1-CG 4.22Å; Q191-E215 PolarHBondContact NE2-OE1 2.9Å; W197-E215 HydrophobicContact CH2-CG 4.24Å; W197-E215 HydrophobicContact CZ3-CG 4.33Å
216	I	77.6	Confident	62.6	Low	66 Å²	66	100.4 Å²	100.4	34%	0.338	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	97.9	170.7	-53.5	165.1	0	0	0	106.5	M163 K165 V185 P218	M163-I216 HydrophobicContact CB-CB 4.32Å; M163-I216 HydrophobicContact CB-CD1 4.16Å; M163-I216 PolarHBondContact O-N 3.29Å; K165-I216 HydrophobicContact CB-CD1 4.07Å; K165-I216 HydrophobicContact CB-CG1 4.19Å; V185-I216 HydrophobicContact CG1-CD1 3.73Å; V185-I216 HydrophobicContact CG2-CD1 4.01Å; I216-P218 WeakPolarHBondContact O-CD 3.32Å
217	K	69.3	Low	59.9	Low	173 Å²	173	103.8 Å²	103.8	75%	0.752	56%	0.555	S	S	*	*			trans	-70.8	124.7	175.9	-66.5	-171.2	176.6	-173.3	0	109.7	C219	K217-C219 PolarHBondContact O-N 2.78Å
218	P	44.7	Very low	57.4	Low	118 Å²	118	108 Å²	108	77%	0.766	58%	0.58	S	S	*	*			trans	-70.9	123.9	174.8	28.6	-32.5	0	0	0	109.8	I216	I216-P218 WeakPolarHBondContact O-CD 3.32Å
219	C	30.5	Very low	55	Low	130 Å²	130	112 Å²	112	88%	0.878	61%	0.607	S	S	*	*			trans	-108.4	151.7	161.9	-162.3	0	0	0	0	108.2	K217	K217-C219 PolarHBondContact O-N 2.78Å
220	E	31.1	Very low	53	Low	153 Å²	153	117.2 Å²	117.2	72%	0.715	63%	0.633	S	S	*	*	S	Bend	trans	-75.7	150	-163.5	-77.3	-155.6	159.7	0	0	116.1
221	K	30.3	Very low	51.3	Low	177 Å²	177	118.2 Å²	118.2	77%	0.77	64%	0.638	S	S	*	*			trans	79.7	149	158.5	-74.6	149.1	-176.8	148.4	0	117.3
222	P	37.2	Very low	49.7	Very low	117 Å²	117	118.2 Å²	118.2	76%	0.76	63%	0.632	S	S	*	*			trans	-115.5	144.2	-137.5	37.9	-28	0	0	0	114.3
223	L	28.5	Very low	48.6	Very low	176 Å²	176	120 Å²	120	92%	0.921	65%	0.648	S	S	*	*			trans	-128.2	124.6	162	-67.2	174.6	0	0	0	108.7
224	S	29.2	Very low	47.8	Very low	115 Å²	115	123.6 Å²	123.6	80%	0.804	66%	0.661	S	S	*	*			trans	-88.6	162.3	171.9	78.8	0	0	0	0	110.3
225	P	47.2	Very low	47.2	Very low	118 Å²	118	116.8 Å²	116.8	77%	0.766	64%	0.636	S	S	*	*	S	Bend	trans	-91.3	128.1	-148.6	32.5	-35.5	0	0	0	115.3
226	K	30.6	Very low	46.7	Very low	209 Å²	209	115 Å²	115	91%	0.909	63%	0.633	S	S	*	*	S	Bend	trans	-175.9	138.1	139.1	-101.3	151.5	-175.3	179.2	0	111.1
227	G	33.1	Very low	46.8	Very low	73 Å²	73	116.3 Å²	116.3	75%	0.753	64%	0.644	S	S	*	*			trans	82.2	145.9	-179.2	0	0	0	0	0	113.6
228	I	35.4	Very low	47.2	Very low	148 Å²	148	109.1 Å²	109.1	76%	0.759	61%	0.614	S	S	*	*			trans	-106	114.2	176.9	-62.3	168.7	0	0	0	107.9	L230	I228-L230 HydrophobicContact CG2-CB 4.37Å; I228-L230 HydrophobicContact CG2-CD1 3.75Å; I228-L230 HydrophobicContact CG2-CG 3.76Å
229	P	39.7	Very low	48.9	Very low	85 Å²	85	103.8 Å²	103.8	55%	0.552	58%	0.579	S	S	*	*			trans	-108.5	73.4	177.1	37	-27.3	0	0	0	110.8
230	L	44.1	Very low	51.4	Low	121 Å²	121	101.8 Å²	101.8	63%	0.634	56%	0.557	S	S	*	*			trans	-88.2	-22	177.8	-77.2	170.3	0	0	0	113.6	I228 Y234	I228-L230 HydrophobicContact CG2-CB 4.37Å; I228-L230 HydrophobicContact CG2-CD1 3.75Å; I228-L230 HydrophobicContact CG2-CG 3.76Å; L230-Y234 WeakPolarHBondContact O-CD2 3.34Å
231	T	49	Very low	53.9	Low	55 Å²	55	98 Å²	98	34%	0.337	54%	0.542	S	S	.	.	S	Bend	trans	-69.3	-39.6	-179.1	41.5	0	0	0	0	113.8	N233 Y234 F235	T231-N233 VanDerWaalsContact C-N 3.29Å; T231-N233 PolarHBondContact O-N 2.68Å; T231-N233 VanDerWaalsContact O-N 3.14Å; T231-Y234 PolarHBondContact O-N 3.31Å; T231-F235 PolarHBondContact O-N 3.43Å
232	K	50.9	Low	56.5	Low	110 Å²	110	89.8 Å²	89.8	48%	0.478	51%	0.506	S	S	.	.	H	α-helix	trans	-59.5	-34.8	-165.1	-58.9	-164.4	174.7	-165.4	0	114.4	E388	K232-E388 VanDerWaalsContact CE-OE1 3.31Å; K232-E388 WeakPolarHBondContact CE-OE1 3.15Å
233	N	58.3	Low	58.8	Low	123 Å²	123	84.4 Å²	84.4	66%	0.658	47%	0.471	S	S	*	.	H	α-helix	trans	-74.1	-26.7	176.3	-66.2	-16.2	0	0	0	113.2	T231 V237	T231-N233 VanDerWaalsContact C-N 3.29Å; T231-N233 PolarHBondContact O-N 2.68Å; T231-N233 VanDerWaalsContact O-N 3.14Å; N233-V237 WeakPolarHBondContact O-CG2 3.26Å; N233-V237 PolarHBondContact O-N 3.09Å
234	Y	69.2	Low	61.5	Low	84 Å²	84	79.4 Å²	79.4	33%	0.329	45%	0.445	S	S	.	.	H	α-helix	trans	-76.1	-38.6	-178.3	-82.3	-89.4	0	0	0	112.4	L230 T231 S236 V237 V238 Q689	L230-Y234 WeakPolarHBondContact O-CD2 3.34Å; T231-Y234 PolarHBondContact O-N 3.31Å; Y234-S236 PolarHBondContact O-N 3.41Å; Y234-V237 PolarHBondContact O-N 3.29Å; Y234-V237 VanDerWaalsContact O-N 3.16Å; Y234-V238 WeakPolarHBondContact O-CG2 3.48Å; Y234-V238 PolarHBondContact O-N 3.35Å; Y234-Q689 PolarHBondContact OH-O 2.65Å
235	F	72.7	Confident	64.2	Low	17 Å²	17	77.7 Å²	77.7	8%	0.075	42%	0.424	C	S	.	.	H	α-helix	trans	-53.9	-51.3	175.2	175.8	-103.9	0	0	0	111.9	T231 V237 V238 V239 Q307 L383 V387	T231-F235 PolarHBondContact O-N 3.43Å; F235-V237 VanDerWaalsContact C-N 3.31Å; F235-V237 PolarHBondContact O-N 3.02Å; F235-V238 PolarHBondContact O-N 3.07Å; F235-V239 HydrophobicContact CD1-CG2 4.5Å; F235-V239 HydrophobicContact CD2-CG2 4.27Å; F235-V239 HydrophobicContact CE1-CG2 4.19Å; F235-V239 HydrophobicContact CE2-CG2 3.95Å; F235-V239 HydrophobicContact CZ-CG2 3.91Å; F235-V239 WeakPolarHBondContact O-CB 3.43Å; F235-V239 VanDerWaalsContact O-CG2 3.31Å; F235-V239 WeakPolarHBondContact O-CG2 3.3Å; F235-V239 PolarHBondContact O-N 3.46Å; F235-Q307 HydrophobicContact CE1-CB 4.42Å; F235-L383 HydrophobicContact CD2-CD1 3.71Å; F235-L383 HydrophobicContact CE2-CD1 3.56Å; F235-L383 HydrophobicContact CE2-CG 4.22Å; F235-V387 HydrophobicContact CD2-CG2 3.43Å; F235-V387 VanDerWaalsContact CD2-CG2 3.43Å; F235-V387 HydrophobicContact CE2-CG2 3.38Å
236	S	72	Confident	66.1	Low	48 Å²	48	72 Å²	72	34%	0.336	39%	0.388	S	S	.	.	H	α-helix	trans	-60.9	-37.1	178.3	-171.9	0	0	0	0	112.8	Y234 Q240	Y234-S236 PolarHBondContact O-N 3.41Å; S236-Q240 WeakPolarHBondContact O-CB 3.31Å; S236-Q240 PolarHBondContact O-N 3.4Å
237	V	79.6	Confident	68.9	Low	93 Å²	93	64.6 Å²	64.6	56%	0.564	35%	0.354	S	S	*	.	H	α-helix	trans	-69.3	-43.2	176.1	170.8	0	0	0	0	112.1	N233 Y234 F235 Q240 D241	N233-V237 WeakPolarHBondContact O-CG2 3.26Å; N233-V237 PolarHBondContact O-N 3.09Å; Y234-V237 PolarHBondContact O-N 3.29Å; Y234-V237 VanDerWaalsContact O-N 3.16Å; F235-V237 VanDerWaalsContact C-N 3.31Å; F235-V237 PolarHBondContact O-N 3.02Å; V237-Q240 PolarHBondContact O-N 3.07Å; V237-D241 WeakPolarHBondContact O-CB 3.49Å; V237-D241 PolarHBondContact O-N 3.2Å
238	V	78.6	Confident	71.5	Confident	22 Å²	22	66.9 Å²	66.9	13%	0.133	35%	0.345	C	S	.	.	H	α-helix	trans	-65.7	-41.6	177.6	172.3	0	0	0	0	111	Y234 F235 Q240 D241 I242 E382 L383	Y234-V238 WeakPolarHBondContact O-CG2 3.48Å; Y234-V238 PolarHBondContact O-N 3.35Å; F235-V238 PolarHBondContact O-N 3.07Å; V238-Q240 PolarHBondContact O-N 2.89Å; V238-D241 PolarHBondContact O-N 3.2Å; V238-I242 HydrophobicContact CG1-CD1 4.06Å; V238-I242 VanDerWaalsContact O-CG1 3.3Å; V238-I242 WeakPolarHBondContact O-CG1 3.5Å; V238-I242 PolarHBondContact O-N 3.42Å; V238-E382 HydrophobicContact CG2-CG 4.47Å; V238-L383 HydrophobicContact CG1-CB 4.47Å; V238-L383 HydrophobicContact CG1-CD1 4.06Å
239	V	80.1	Confident	74	Confident	6 Å²	6	60.4 Å²	60.4	4%	0.036	31%	0.311	C	S	.	.	H	α-helix	trans	-63.8	-39.9	175.7	171	0	0	0	0	111.7	F235 L243 T300 V309 L383	F235-V239 HydrophobicContact CD1-CG2 4.5Å; F235-V239 HydrophobicContact CD2-CG2 4.27Å; F235-V239 HydrophobicContact CE1-CG2 4.19Å; F235-V239 HydrophobicContact CE2-CG2 3.95Å; F235-V239 HydrophobicContact CZ-CG2 3.91Å; F235-V239 WeakPolarHBondContact O-CB 3.43Å; F235-V239 VanDerWaalsContact O-CG2 3.31Å; F235-V239 WeakPolarHBondContact O-CG2 3.3Å; F235-V239 PolarHBondContact O-N 3.46Å; V239-L243 PolarHBondContact O-N 3.26Å; V239-L243 VanDerWaalsContact O-N 3.14Å; V239-T300 HydrophobicContact CG1-CG2 3.34Å; V239-V309 HydrophobicContact CG1-CG2 4.11Å; V239-V309 HydrophobicContact CG2-CG2 4.22Å; V239-L383 HydrophobicContact CG2-CD1 3.55Å
240	Q	82.5	Confident	76.3	Confident	88 Å²	88	57 Å²	57	41%	0.411	29%	0.289	S	S	.	.	H	α-helix	trans	-67.9	-40.4	174.8	178.9	61.8	29.3	0	0	112.4	S236 V237 V238 L243 D244	S236-Q240 WeakPolarHBondContact O-CB 3.31Å; S236-Q240 PolarHBondContact O-N 3.4Å; V237-Q240 PolarHBondContact O-N 3.07Å; V238-Q240 PolarHBondContact O-N 2.89Å; Q240-L243 WeakPolarHBondContact O-CB 3.34Å; Q240-L243 PolarHBondContact O-N 3.09Å; Q240-D244 PolarHBondContact NE2-OD2 3.27Å; Q240-D244 PolarHBondContact O-N 2.88Å
241	D	84.8	Confident	78.4	Confident	74 Å²	74	56.8 Å²	56.8	40%	0.396	28%	0.283	S	S	.	.	H	α-helix	trans	-63.2	-41.3	176.1	179.9	91.9	0	0	0	112	V237 V238 L243 D244 H245	V237-D241 WeakPolarHBondContact O-CB 3.49Å; V237-D241 PolarHBondContact O-N 3.2Å; V238-D241 PolarHBondContact O-N 3.2Å; D241-L243 VanDerWaalsContact C-N 3.34Å; D241-L243 PolarHBondContact O-N 3.48Å; D241-D244 PolarHBondContact O-N 2.99Å; D241-H245 WeakPolarHBondContact O-CB 3.28Å; D241-H245 PolarHBondContact O-N 3.19Å; D241-H245 PolarHBondContact O-ND1 2.69Å; D241-H245 IonicContact OD1-CE1 3.52Å; D241-H245 PolarHBondContact OD1-CE1 3.11Å; D241-H245 IonicContact OD1-ND1 2.75Å; D241-H245 IonicContact OD2-CE1 2.71Å; D241-H245 PolarHBondContact OD2-CE1 3.2Å; D241-H245 IonicContact OD2-ND1 2.68Å; D241-H245 PolarHBondContact OD2-ND1 3.5Å
242	I	84.8	Confident	80.2	Confident	4 Å²	4	58.2 Å²	58.2	2%	0.021	29%	0.286	C	S	.	.	H	α-helix	trans	-57.5	-48.9	171.9	-70.5	165.3	0	0	0	110	V238 H245 E246 L379	V238-I242 HydrophobicContact CG1-CD1 4.06Å; V238-I242 VanDerWaalsContact O-CG1 3.3Å; V238-I242 WeakPolarHBondContact O-CG1 3.5Å; V238-I242 PolarHBondContact O-N 3.42Å; I242-H245 PolarHBondContact O-N 3.35Å; I242-E246 WeakPolarHBondContact O-CG 3.31Å; I242-E246 PolarHBondContact O-N 2.89Å; I242-L379 HydrophobicContact CD1-CB 4.34Å; I242-L379 HydrophobicContact CG1-CB 4.26Å; I242-L379 HydrophobicContact CG1-CD2 4.18Å
243	L	84.6	Confident	81.8	Confident	4 Å²	4	53.2 Å²	53.2	2%	0.021	26%	0.264	C	S	.	.	H	α-helix	trans	-62.8	-40.1	178.8	-85.2	179.3	0	0	0	113.6	V239 Q240 D241 E246 R247 L296 E297 T300	V239-L243 PolarHBondContact O-N 3.26Å; V239-L243 VanDerWaalsContact O-N 3.14Å; Q240-L243 WeakPolarHBondContact O-CB 3.34Å; Q240-L243 PolarHBondContact O-N 3.09Å; D241-L243 VanDerWaalsContact C-N 3.34Å; D241-L243 PolarHBondContact O-N 3.48Å; L243-E246 PolarHBondContact O-N 3.01Å; L243-R247 WeakPolarHBondContact O-CG 3.43Å; L243-R247 PolarHBondContact O-N 3.4Å; L243-L296 HydrophobicContact CD2-CB 3.5Å; L243-L296 HydrophobicContact CD2-CD1 4.5Å; L243-E297 HydrophobicContact CD1-CG 4.38Å; L243-E297 HydrophobicContact CD2-CG 3.98Å; L243-T300 HydrophobicContact CD1-CG2 3.66Å
244	D	85.9	Confident	83.3	Confident	70 Å²	70	51.7 Å²	51.7	37%	0.374	25%	0.253	S	S	.	.	H	α-helix	trans	-69.9	-41	178.3	-80.4	-37	0	0	0	111.9	Q240 D241 E246 R247 E248	Q240-D244 PolarHBondContact NE2-OD2 3.27Å; Q240-D244 PolarHBondContact O-N 2.88Å; D241-D244 PolarHBondContact O-N 2.99Å; D244-E246 VanDerWaalsContact C-N 3.31Å; D244-E246 PolarHBondContact O-N 3.34Å; D244-R247 VanDerWaalsContact CG-NH2 3.34Å; D244-R247 PolarHBondContact O-N 2.99Å; D244-R247 IonicContact OD1-CZ 2.68Å; D244-R247 VanDerWaalsContact OD1-CZ 3.29Å; D244-R247 IonicContact OD1-NE 3.31Å; D244-R247 PolarHBondContact OD1-NE 3.37Å; D244-R247 IonicContact OD1-NH2 3.59Å; D244-R247 PolarHBondContact OD1-NH2 3.48Å; D244-R247 IonicContact OD2-NH2 3.38Å; D244-E248 WeakPolarHBondContact O-CG 2.97Å; D244-E248 PolarHBondContact O-N 3.01Å
245	H	85.5	Confident	84.1	Confident	79 Å²	79	51.1 Å²	51.1	37%	0.366	26%	0.259	S	S	.	.	H	α-helix	trans	-61.3	-36	170.7	-77.2	106.4	0	0	0	113	D241 I242 E248 F249	D241-H245 WeakPolarHBondContact O-CB 3.28Å; D241-H245 PolarHBondContact O-N 3.19Å; D241-H245 PolarHBondContact O-ND1 2.69Å; D241-H245 IonicContact OD1-CE1 3.52Å; D241-H245 PolarHBondContact OD1-CE1 3.11Å; D241-H245 IonicContact OD1-ND1 2.75Å; D241-H245 IonicContact OD2-CE1 2.71Å; D241-H245 PolarHBondContact OD2-CE1 3.2Å; D241-H245 IonicContact OD2-ND1 2.68Å; D241-H245 PolarHBondContact OD2-ND1 3.5Å; I242-H245 PolarHBondContact O-N 3.35Å; H245-E248 PolarHBondContact O-N 3.47Å; H245-F249 WeakPolarHBondContact O-CB 3.48Å; H245-F249 PolarHBondContact O-N 3.17Å
246	E	87.5	Confident	84.6	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-68.1	-43.3	173.9	-72.9	-52.3	155.5	0	0	112.3	I242 L243 D244 E248 F249 V250 Q289 L296 R372 Y376	I242-E246 WeakPolarHBondContact O-CG 3.31Å; I242-E246 PolarHBondContact O-N 2.89Å; L243-E246 PolarHBondContact O-N 3.01Å; D244-E246 VanDerWaalsContact C-N 3.31Å; D244-E246 PolarHBondContact O-N 3.34Å; E246-E248 PolarHBondContact O-N 2.84Å; E246-F249 PolarHBondContact O-N 3.16Å; E246-V250 PolarHBondContact O-N 3.01Å; E246-Q289 PolarHBondContact OE2-NE2 3.27Å; E246-L296 HydrophobicContact CG-CD1 4.49Å; E246-R372 VanDerWaalsContact CD-NH2 3.29Å; E246-R372 IonicContact OE1-CZ 3.73Å; E246-R372 IonicContact OE1-NE 4Å; E246-R372 PolarHBondContact OE1-NE 3.13Å; E246-R372 IonicContact OE1-NH2 3.29Å; E246-R372 PolarHBondContact OE1-NH2 3.37Å; E246-R372 IonicContact OE2-NE 2.71Å; E246-Y376 WeakPolarHBondContact OE1-CE1 3.43Å
247	R	87.4	Confident	85.2	Confident	52 Å²	52	49 Å²	49	20%	0.196	25%	0.245	C	C	.	.	H	α-helix	trans	-61.2	-32.5	173.5	-76.9	-174.8	-76.4	-95.6	-1.6	112.3	L243 D244 K251 E297	L243-R247 WeakPolarHBondContact O-CG 3.43Å; L243-R247 PolarHBondContact O-N 3.4Å; D244-R247 VanDerWaalsContact CG-NH2 3.34Å; D244-R247 PolarHBondContact O-N 2.99Å; D244-R247 IonicContact OD1-CZ 2.68Å; D244-R247 VanDerWaalsContact OD1-CZ 3.29Å; D244-R247 IonicContact OD1-NE 3.31Å; D244-R247 PolarHBondContact OD1-NE 3.37Å; D244-R247 IonicContact OD1-NH2 3.59Å; D244-R247 PolarHBondContact OD1-NH2 3.48Å; D244-R247 IonicContact OD2-NH2 3.38Å; R247-K251 WeakPolarHBondContact O-CD 3.4Å; R247-K251 WeakPolarHBondContact O-CE 3.15Å; R247-K251 WeakPolarHBondContact O-CG 3.26Å; R247-K251 PolarHBondContact O-N 2.84Å; R247-E297 WeakPolarHBondContact CD-OE1 3.37Å; R247-E297 IonicContact CZ-OE1 2.98Å; R247-E297 IonicContact NE-OE1 3.16Å; R247-E297 IonicContact NH1-OE1 3.6Å; R247-E297 PolarHBondContact NH1-OE1 3.13Å
248	E	87.8	Confident	85.4	Confident	121 Å²	121	47.4 Å²	47.4	57%	0.565	24%	0.235	S	C	*	.	H	α-helix	trans	-71.2	-48.8	171.6	-71.5	-166	159	0	0	111.9	D244 H245 E246 V250 K251 E252	D244-E248 WeakPolarHBondContact O-CG 2.97Å; D244-E248 PolarHBondContact O-N 3.01Å; H245-E248 PolarHBondContact O-N 3.47Å; E246-E248 PolarHBondContact O-N 2.84Å; E248-V250 VanDerWaalsContact C-N 3.32Å; E248-V250 PolarHBondContact O-N 2.96Å; E248-K251 WeakPolarHBondContact O-CB 3.23Å; E248-K251 PolarHBondContact O-N 3.4Å; E248-E252 WeakPolarHBondContact O-CG 3.38Å; E248-E252 PolarHBondContact O-N 3.28Å
249	F	87.9	Confident	85.4	Confident	12 Å²	12	49.1 Å²	49.1	5%	0.053	25%	0.247	C	C	.	.	H	α-helix	trans	-57	-41.9	178.6	178.5	-124.8	0	0	0	112.6	H245 E246 E252 L253 Q289 K368 P369 R372	H245-F249 WeakPolarHBondContact O-CB 3.48Å; H245-F249 PolarHBondContact O-N 3.17Å; E246-F249 PolarHBondContact O-N 3.16Å; F249-E252 PolarHBondContact O-N 3.03Å; F249-L253 HydrophobicContact CD1-CD1 4.28Å; F249-L253 HydrophobicContact CD2-CG 4.28Å; F249-L253 HydrophobicContact CE1-CD1 3.76Å; F249-L253 HydrophobicContact CE2-CD1 4.01Å; F249-L253 HydrophobicContact CE2-CD2 4.04Å; F249-L253 HydrophobicContact CE2-CG 3.9Å; F249-L253 HydrophobicContact CZ-CD1 3.61Å; F249-L253 HydrophobicContact CZ-CD2 4.2Å; F249-L253 HydrophobicContact CZ-CG 4.02Å; F249-L253 WeakPolarHBondContact O-CG 3.3Å; F249-L253 PolarHBondContact O-N 2.84Å; F249-Q289 HydrophobicContact CD1-CG 3.79Å; F249-Q289 HydrophobicContact CE1-CG 3.89Å; F249-K368 HydrophobicContact CE2-CB 4.3Å; F249-P369 HydrophobicContact CZ-CB 4.32Å; F249-P369 HydrophobicContact CZ-CG 4.34Å; F249-R372 HydrophobicContact CD1-CB 4.35Å; F249-R372 HydrophobicContact CD1-CG 3.87Å; F249-R372 HydrophobicContact CD2-CB 4.3Å; F249-R372 HydrophobicContact CE1-CB 4.13Å; F249-R372 HydrophobicContact CE1-CG 3.97Å; F249-R372 HydrophobicContact CE2-CB 4.08Å; F249-R372 HydrophobicContact CG-CB 4.45Å; F249-R372 HydrophobicContact CG-CG 4.17Å; F249-R372 HydrophobicContact CZ-CB 4Å; F249-R372 HydrophobicContact CZ-CG 4.36Å
250	V	89.2	Confident	85.2	Confident	14 Å²	14	50.7 Å²	50.7	9%	0.085	25%	0.253	C	S	.	.	H	α-helix	trans	-60.5	-45	172.9	167.5	0	0	0	0	112.4	E246 E248 E252 L253 Q254 L286 Q289 Q290 C293	E246-V250 PolarHBondContact O-N 3.01Å; E248-V250 VanDerWaalsContact C-N 3.32Å; E248-V250 PolarHBondContact O-N 2.96Å; V250-E252 VanDerWaalsContact C-N 3.31Å; V250-E252 PolarHBondContact O-N 3.29Å; V250-L253 PolarHBondContact O-N 3.4Å; V250-Q254 VanDerWaalsContact O-CB 3.29Å; V250-Q254 WeakPolarHBondContact O-CB 3.47Å; V250-Q254 PolarHBondContact O-N 3.42Å; V250-L286 HydrophobicContact CG1-CD1 4.21Å; V250-Q289 HydrophobicContact CG2-CB 3.86Å; V250-Q289 HydrophobicContact CG2-CG 3.58Å; V250-Q290 HydrophobicContact CG1-CG 3.58Å; V250-C293 VanDerWaalsContact CG2-SG 3.52Å
251	K	88.3	Confident	85	Confident	117 Å²	117	46.6 Å²	46.6	51%	0.509	23%	0.234	S	C	.	.	H	α-helix	trans	-63.6	-37.6	177.8	-68.9	160.8	-162.6	158.9	0	111.6	R247 E248 T255	R247-K251 WeakPolarHBondContact O-CD 3.4Å; R247-K251 WeakPolarHBondContact O-CE 3.15Å; R247-K251 WeakPolarHBondContact O-CG 3.26Å; R247-K251 PolarHBondContact O-N 2.84Å; E248-K251 WeakPolarHBondContact O-CB 3.23Å; E248-K251 PolarHBondContact O-N 3.4Å; K251-T255 WeakPolarHBondContact O-CB 3.37Å; K251-T255 PolarHBondContact O-N 3.37Å; K251-T255 PolarHBondContact O-OG1 3.37Å
252	E	85.7	Confident	84.8	Confident	84 Å²	84	48.2 Å²	48.2	39%	0.393	23%	0.234	S	C	.	.	H	α-helix	trans	-66.8	-48.7	176.6	-66.5	-160.1	128.4	0	0	111.4	E248 F249 V250 Q254 T255 V256 K368	E248-E252 WeakPolarHBondContact O-CG 3.38Å; E248-E252 PolarHBondContact O-N 3.28Å; F249-E252 PolarHBondContact O-N 3.03Å; V250-E252 VanDerWaalsContact C-N 3.31Å; V250-E252 PolarHBondContact O-N 3.29Å; E252-Q254 VanDerWaalsContact C-N 3.34Å; E252-Q254 PolarHBondContact O-N 3.04Å; E252-T255 WeakPolarHBondContact O-CB 3.46Å; E252-T255 PolarHBondContact O-N 3.26Å; E252-V256 VanDerWaalsContact O-CG2 3.29Å; E252-V256 WeakPolarHBondContact O-CG2 3.35Å; E252-V256 PolarHBondContact O-N 3.3Å; E252-K368 IonicContact OE1-NZ 3.02Å; E252-K368 PolarHBondContact OE1-NZ 3.06Å; E252-K368 VanDerWaalsContact OE2-CD 3.28Å; E252-K368 WeakPolarHBondContact OE2-CD 3.46Å; E252-K368 WeakPolarHBondContact OE2-CE 3.43Å; E252-K368 IonicContact OE2-NZ 3.77Å; E252-K368 PolarHBondContact OE2-NZ 3.34Å
253	L	85.8	Confident	84.5	Confident	5 Å²	5	49.6 Å²	49.6	3%	0.026	24%	0.244	C	C	.	.	H	α-helix	trans	-57.5	-45.8	174.7	-71.7	179.4	0	0	0	112	F249 V250 T255 V256 L257 L282 I285 L286 P369	F249-L253 HydrophobicContact CD1-CD1 4.28Å; F249-L253 HydrophobicContact CD2-CG 4.28Å; F249-L253 HydrophobicContact CE1-CD1 3.76Å; F249-L253 HydrophobicContact CE2-CD1 4.01Å; F249-L253 HydrophobicContact CE2-CD2 4.04Å; F249-L253 HydrophobicContact CE2-CG 3.9Å; F249-L253 HydrophobicContact CZ-CD1 3.61Å; F249-L253 HydrophobicContact CZ-CD2 4.2Å; F249-L253 HydrophobicContact CZ-CG 4.02Å; F249-L253 WeakPolarHBondContact O-CG 3.3Å; F249-L253 PolarHBondContact O-N 2.84Å; V250-L253 PolarHBondContact O-N 3.4Å; L253-T255 VanDerWaalsContact C-N 3.31Å; L253-T255 PolarHBondContact O-N 2.8Å; L253-V256 PolarHBondContact O-N 3.24Å; L253-L257 WeakPolarHBondContact O-CB 3.41Å; L253-L257 PolarHBondContact O-N 2.94Å; L253-L282 HydrophobicContact CD2-CD1 3.95Å; L253-I285 HydrophobicContact CD1-CG2 4.16Å; L253-L286 HydrophobicContact CB-CD1 3.87Å; L253-P369 HydrophobicContact CD2-CG 4.14Å
254	Q	88.6	Confident	83.9	Confident	91 Å²	91	49.8 Å²	49.8	43%	0.425	25%	0.245	S	C	.	.	H	α-helix	trans	-62.4	-38.5	177.7	-173.6	175.2	-1.8	0	0	112.1	V250 E252 T258 L286	V250-Q254 VanDerWaalsContact O-CB 3.29Å; V250-Q254 WeakPolarHBondContact O-CB 3.47Å; V250-Q254 PolarHBondContact O-N 3.42Å; E252-Q254 VanDerWaalsContact C-N 3.34Å; E252-Q254 PolarHBondContact O-N 3.04Å; Q254-T258 WeakPolarHBondContact O-CB 3.48Å; Q254-T258 PolarHBondContact O-N 2.77Å; Q254-T258 PolarHBondContact O-OG1 3.4Å; Q254-L286 HydrophobicContact CB-CD1 4.07Å; Q254-L286 HydrophobicContact CB-CD2 4.24Å
255	T	86.5	Confident	83.3	Confident	73 Å²	73	51.2 Å²	51.2	45%	0.448	25%	0.249	S	C	.	.	H	α-helix	trans	-64.2	-49.1	174.5	-59.2	0	0	0	0	111.1	K251 E252 L253 L257 T258 C259	K251-T255 WeakPolarHBondContact O-CB 3.37Å; K251-T255 PolarHBondContact O-N 3.37Å; K251-T255 PolarHBondContact O-OG1 3.37Å; E252-T255 WeakPolarHBondContact O-CB 3.46Å; E252-T255 PolarHBondContact O-N 3.26Å; L253-T255 VanDerWaalsContact C-N 3.31Å; L253-T255 PolarHBondContact O-N 2.8Å; T255-L257 VanDerWaalsContact C-N 3.34Å; T255-L257 PolarHBondContact O-N 3.27Å; T255-T258 PolarHBondContact O-N 3.38Å; T255-C259 WeakPolarHBondContact O-CB 3.45Å; T255-C259 PolarHBondContact O-N 3.36Å
256	V	84.1	Confident	82.8	Confident	13 Å²	13	51.8 Å²	51.8	8%	0.079	27%	0.268	C	S	.	.	H	α-helix	trans	-58.7	-47.2	179.2	173.2	0	0	0	0	111.1	E252 L253 Y260 L261 L282 L362 S365	E252-V256 VanDerWaalsContact O-CG2 3.29Å; E252-V256 WeakPolarHBondContact O-CG2 3.35Å; E252-V256 PolarHBondContact O-N 3.3Å; L253-V256 PolarHBondContact O-N 3.24Å; V256-Y260 HydrophobicContact CG1-CD2 4.46Å; V256-Y260 WeakPolarHBondContact O-CB 3.37Å; V256-Y260 PolarHBondContact O-N 2.69Å; V256-L261 HydrophobicContact CG1-CD1 4.49Å; V256-L261 PolarHBondContact O-N 3.42Å; V256-L261 VanDerWaalsContact O-N 3.17Å; V256-L282 HydrophobicContact CG1-CD2 4.36Å; V256-L362 HydrophobicContact CG1-CD1 4.17Å; V256-S365 VanDerWaalsContact CG2-CB 3.47Å; V256-S365 WeakPolarHBondContact CG2-OG 3.36Å
257	L	83.1	Confident	82	Confident	8 Å²	8	53.2 Å²	53.2	4%	0.042	28%	0.277	C	S	.	.	I	π-helix	trans	-69.3	-38.8	-177.3	-168.1	148.5	0	0	0	111.9	L253 T255 R262 E283 L286	L253-L257 WeakPolarHBondContact O-CB 3.41Å; L253-L257 PolarHBondContact O-N 2.94Å; T255-L257 VanDerWaalsContact C-N 3.34Å; T255-L257 PolarHBondContact O-N 3.27Å; L257-R262 HydrophobicContact CD2-CG 4.07Å; L257-R262 VanDerWaalsContact CD2-NE 3.28Å; L257-R262 WeakPolarHBondContact O-CG 3.28Å; L257-R262 PolarHBondContact O-N 3.43Å; L257-E283 HydrophobicContact CD1-CB 3.74Å; L257-E283 HydrophobicContact CD1-CG 3.94Å; L257-L286 HydrophobicContact CB-CD2 4.49Å; L257-L286 HydrophobicContact CD1-CD2 4.19Å
258	T	84.1	Confident	81.2	Confident	58 Å²	58	58.9 Å²	58.9	36%	0.356	31%	0.312	S	S	.	.	I	π-helix	trans	-82.2	-35.9	-177.5	-51.9	0	0	0	0	113.5	Q254 T255 R262 P263	Q254-T258 WeakPolarHBondContact O-CB 3.48Å; Q254-T258 PolarHBondContact O-N 2.77Å; Q254-T258 PolarHBondContact O-OG1 3.4Å; T255-T258 PolarHBondContact O-N 3.38Å; T258-R262 PolarHBondContact OG1-NH1 3.2Å; T258-P263 WeakPolarHBondContact O-CD 3.29Å
259	C	80	Confident	80.2	Confident	58 Å²	58	58.5 Å²	58.5	39%	0.392	31%	0.308	S	S	.	.	I	π-helix	trans	-95.5	-23.7	-174.4	-60.3	0	0	0	0	114	T255	T255-C259 WeakPolarHBondContact O-CB 3.45Å; T255-C259 PolarHBondContact O-N 3.36Å
260	Y	75.6	Confident	79.3	Confident	39 Å²	39	59 Å²	59	15%	0.153	31%	0.311	C	S	.	.	I	π-helix	trans	-117.2	-54.1	-179.8	-51.6	-50.2	0	0	0	112.5	V256 L264 I349 A354 L362	V256-Y260 HydrophobicContact CG1-CD2 4.46Å; V256-Y260 WeakPolarHBondContact O-CB 3.37Å; V256-Y260 PolarHBondContact O-N 2.69Å; Y260-L264 WeakPolarHBondContact O-CB 3.47Å; Y260-L264 PolarHBondContact O-N 3Å; Y260-L264 VanDerWaalsContact O-N 3.11Å; Y260-I349 HydrophobicContact CD1-CG2 4.06Å; Y260-I349 HydrophobicContact CE1-CG2 3.94Å; Y260-A354 HydrophobicContact CE1-CB 4.29Å; Y260-L362 HydrophobicContact CD2-CD1 4.49Å
261	L	76.8	Confident	78.8	Confident	2 Å²	2	61.5 Å²	61.5	1%	0.01	33%	0.329	C	S	.	.	I	π-helix	trans	-72.6	-47.2	-171.6	-60.8	179.4	0	0	0	113.8	V256 L264 Q265 L278 L282 L362	V256-L261 HydrophobicContact CG1-CD1 4.49Å; V256-L261 PolarHBondContact O-N 3.42Å; V256-L261 VanDerWaalsContact O-N 3.17Å; L261-L264 WeakPolarHBondContact O-CB 3.38Å; L261-L264 PolarHBondContact O-N 3.11Å; L261-Q265 WeakPolarHBondContact O-CG 3.33Å; L261-Q265 PolarHBondContact O-N 3.04Å; L261-L278 HydrophobicContact CD2-CD2 4.46Å; L261-L278 HydrophobicContact CD2-CG 4.14Å; L261-L282 HydrophobicContact CD1-CD2 3.57Å; L261-L362 HydrophobicContact CD2-CD1 4.43Å
262	R	81.1	Confident	78.1	Confident	108 Å²	108	60.8 Å²	60.8	41%	0.408	34%	0.339	S	S	.	.	H	α-helix	trans	-62.6	-44.5	177.4	-75	178.7	-175.3	145.6	-1.4	113.1	L257 T258 L264 Q265 A266 E283	L257-R262 HydrophobicContact CD2-CG 4.07Å; L257-R262 VanDerWaalsContact CD2-NE 3.28Å; L257-R262 WeakPolarHBondContact O-CG 3.28Å; L257-R262 PolarHBondContact O-N 3.43Å; T258-R262 PolarHBondContact OG1-NH1 3.2Å; R262-L264 VanDerWaalsContact C-N 3.27Å; R262-L264 PolarHBondContact O-N 3.4Å; R262-Q265 PolarHBondContact O-N 3.07Å; R262-A266 WeakPolarHBondContact O-CB 3.46Å; R262-A266 PolarHBondContact O-N 3.2Å; R262-E283 IonicContact CZ-OE1 3.37Å; R262-E283 IonicContact NE-OE1 2.63Å; R262-E283 IonicContact NH2-OE1 2.63Å; R262-E283 PolarHBondContact NH2-OE1 3.08Å
263	P	78.2	Confident	77.6	Confident	33 Å²	33	58.5 Å²	58.5	21%	0.214	34%	0.338	C	S	.	.	H	α-helix	trans	-62.4	-32.6	172.8	-27	37.7	0	0	0	113.4	T258 A266 S267 F348	T258-P263 WeakPolarHBondContact O-CD 3.29Å; P263-A266 CarbonylContact O-C 3.58Å; P263-A266 PolarHBondContact O-N 3.38Å; P263-S267 WeakPolarHBondContact O-CB 3.28Å; P263-S267 PolarHBondContact O-N 3.26Å; P263-F348 HydrophobicContact CB-CE1 4.22Å; P263-F348 HydrophobicContact CB-CZ 3.88Å; P263-F348 WeakPolarHBondContact O-CZ 3.32Å
264	L	73.6	Confident	77.2	Confident	8 Å²	8	60.9 Å²	60.9	4%	0.042	35%	0.35	C	S	.	.	H	α-helix	trans	-70.4	-43.2	176.3	176.1	156.6	0	0	0	112.1	Y260 L261 R262 A266 S267 L270 L278 L345 F348	Y260-L264 WeakPolarHBondContact O-CB 3.47Å; Y260-L264 PolarHBondContact O-N 3Å; Y260-L264 VanDerWaalsContact O-N 3.11Å; L261-L264 WeakPolarHBondContact O-CB 3.38Å; L261-L264 PolarHBondContact O-N 3.11Å; R262-L264 VanDerWaalsContact C-N 3.27Å; R262-L264 PolarHBondContact O-N 3.4Å; L264-A266 PolarHBondContact O-N 3.47Å; L264-S267 PolarHBondContact O-N 3.15Å; L264-S267 VanDerWaalsContact O-O 3.12Å; L264-L270 HydrophobicContact CD1-CD1 3.91Å; L264-L270 HydrophobicContact CD2-CD1 3.79Å; L264-L270 HydrophobicContact CG-CD1 3.92Å; L264-L278 HydrophobicContact CD1-CD2 3.57Å; L264-L278 HydrophobicContact CD2-CD2 4.08Å; L264-L345 HydrophobicContact CD1-CD1 3.49Å; L264-L345 VanDerWaalsContact CD1-CD1 3.49Å; L264-L345 HydrophobicContact CD1-CD2 4.43Å; L264-F348 HydrophobicContact CB-CE1 4.04Å
265	Q	73.3	Confident	76.6	Confident	101 Å²	101	57.1 Å²	57.1	47%	0.472	33%	0.334	S	S	.	.	H	α-helix	trans	-61.4	-33.6	171.4	-72.7	176.6	-20.7	0	0	112.2	L261 R262 S267 C279	L261-Q265 WeakPolarHBondContact O-CG 3.33Å; L261-Q265 PolarHBondContact O-N 3.04Å; R262-Q265 PolarHBondContact O-N 3.07Å; Q265-S267 PolarHBondContact O-N 2.87Å; Q265-C279 PolarHBondContact NE2-SG 3.45Å
266	A	74	Confident	76.2	Confident	91 Å²	91	56.2 Å²	56.2	75%	0.752	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	0.5	174.9	0	0	0	0	0	113.7	R262 P263 L264	R262-A266 WeakPolarHBondContact O-CB 3.46Å; R262-A266 PolarHBondContact O-N 3.2Å; P263-A266 CarbonylContact O-C 3.58Å; P263-A266 PolarHBondContact O-N 3.38Å; L264-A266 PolarHBondContact O-N 3.47Å
267	S	71.3	Confident	76	Confident	29 Å²	29	58.1 Å²	58.1	20%	0.203	35%	0.346	C	S	.	.	S	Bend	trans	-111	123.7	179.7	-155.8	0	0	0	0	110.6	P263 L264 Q265 K269	P263-S267 WeakPolarHBondContact O-CB 3.28Å; P263-S267 PolarHBondContact O-N 3.26Å; L264-S267 PolarHBondContact O-N 3.15Å; L264-S267 VanDerWaalsContact O-O 3.12Å; Q265-S267 PolarHBondContact O-N 2.87Å; S267-K269 PolarHBondContact O-N 2.97Å
268	D	69.7	Low	75.8	Confident	172 Å²	172	57.9 Å²	57.9	92%	0.92	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	44.5	177.7	-160.3	35.8	0	0	0	112.1
269	K	67.8	Low	75.2	Confident	113 Å²	113	55.7 Å²	55.7	49%	0.491	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	-15.8	-176.7	-78.4	-173.5	161.7	-66	0	113.5	S267 F348	S267-K269 PolarHBondContact O-N 2.97Å; K269-F348 HydrophobicContact CD-CB 4.49Å; K269-F348 HydrophobicContact CD-CD2 4.08Å
270	L	69.6	Low	75.1	Confident	23 Å²	23	54.8 Å²	54.8	12%	0.12	33%	0.332	C	S	.	.	S	Bend	trans	-133.5	153	177.8	-74.1	168.7	0	0	0	108.3	L264 L278 H341	L264-L270 HydrophobicContact CD1-CD1 3.91Å; L264-L270 HydrophobicContact CD2-CD1 3.79Å; L264-L270 HydrophobicContact CG-CD1 3.92Å; L270-L278 HydrophobicContact CD1-CD2 4.43Å; L270-H341 HydrophobicContact CD2-CB 3.98Å
271	S	78.3	Confident	75.4	Confident	66 Å²	66	53.2 Å²	53.2	46%	0.462	33%	0.326	S	S	.	.			trans	-57.6	149.3	171.5	-170	0	0	0	0	110.3	G273 D274 S275	S271-G273 PolarHBondContact O-N 3.22Å; S271-D274 WeakPolarHBondContact CB-OD2 3.39Å; S271-D274 PolarHBondContact O-N 3.15Å; S271-S275 PolarHBondContact O-N 3.17Å; S271-S275 PolarHBondContact O-OG 3.5Å
272	S	73.8	Confident	75.6	Confident	102 Å²	102	53.2 Å²	53.2	71%	0.713	33%	0.326	S	S	*	.	H	α-helix	trans	-60.1	-26.8	172.6	53.8	0	0	0	0	112.4	S275 A276	S272-S275 WeakPolarHBondContact CA-OG 3.09Å; S272-S275 PolarHBondContact O-OG 3.23Å; S272-A276 WeakPolarHBondContact O-CB 3.44Å; S272-A276 PolarHBondContact O-N 3.31Å
273	G	74.9	Confident	75.8	Confident	35 Å²	35	52.4 Å²	52.4	36%	0.361	33%	0.327	S	S	.	.	H	α-helix	trans	-74.2	-37.2	171.4	0	0	0	0	0	114	S271 T277	S271-G273 PolarHBondContact O-N 3.22Å; G273-T277 WeakPolarHBondContact O-CB 3.32Å; G273-T277 PolarHBondContact O-N 3Å; G273-T277 PolarHBondContact O-OG1 2.94Å
274	D	77.6	Confident	76.1	Confident	55 Å²	55	55.7 Å²	55.7	29%	0.294	34%	0.34	S	S	.	.	H	α-helix	trans	-78.3	-40.4	-176.5	-58	-35.6	0	0	0	111	S271 T277 L278 I337	S271-D274 WeakPolarHBondContact CB-OD2 3.39Å; S271-D274 PolarHBondContact O-N 3.15Å; D274-T277 PolarHBondContact O-N 3.37Å; D274-L278 VanDerWaalsContact O-CB 3.3Å; D274-L278 WeakPolarHBondContact O-CB 3.37Å; D274-L278 PolarHBondContact O-N 2.88Å; D274-I337 HydrophobicContact CB-CD1 4.25Å; D274-I337 HydrophobicContact CB-CG2 4.19Å
275	S	74.4	Confident	76.8	Confident	13 Å²	13	55.4 Å²	55.4	9%	0.091	34%	0.338	C	S	.	.	H	α-helix	trans	-64.4	-38.5	171.3	54.5	0	0	0	0	112.3	S271 S272 C279	S271-S275 PolarHBondContact O-N 3.17Å; S271-S275 PolarHBondContact O-OG 3.5Å; S272-S275 WeakPolarHBondContact CA-OG 3.09Å; S272-S275 PolarHBondContact O-OG 3.23Å; S275-C279 WeakPolarHBondContact O-CB 2.93Å; S275-C279 PolarHBondContact O-N 2.73Å; S275-C279 PolarHBondContact O-SG 2.92Å
276	A	79.3	Confident	77.4	Confident	54 Å²	54	51 Å²	51	45%	0.446	32%	0.318	S	S	.	.	H	α-helix	trans	-63.6	-44	170.7	0	0	0	0	0	112.1	S272 L278 C279 G280	S272-A276 WeakPolarHBondContact O-CB 3.44Å; S272-A276 PolarHBondContact O-N 3.31Å; A276-L278 PolarHBondContact O-N 3.38Å; A276-C279 PolarHBondContact O-N 2.84Å; A276-G280 PolarHBondContact O-N 2.95Å
277	T	79.8	Confident	78.1	Confident	53 Å²	53	50.9 Å²	50.9	33%	0.325	31%	0.308	S	S	.	.	H	α-helix	trans	-65	-38.2	178.1	-57.9	0	0	0	0	112.2	G273 D274 G280 I337	G273-T277 WeakPolarHBondContact O-CB 3.32Å; G273-T277 PolarHBondContact O-N 3Å; G273-T277 PolarHBondContact O-OG1 2.94Å; D274-T277 PolarHBondContact O-N 3.37Å; T277-G280 PolarHBondContact O-N 3.32Å; T277-I337 HydrophobicContact CG2-CD1 3.68Å
278	L	77.7	Confident	78.9	Confident	2 Å²	2	50.4 Å²	50.4	1%	0.01	30%	0.302	C	S	.	.	H	α-helix	trans	-67.5	-36.6	175.8	177	58.4	0	0	0	112.7	L261 L264 L270 D274 A276 A334 L338 L345 L366	L261-L278 HydrophobicContact CD2-CD2 4.46Å; L261-L278 HydrophobicContact CD2-CG 4.14Å; L264-L278 HydrophobicContact CD1-CD2 3.57Å; L264-L278 HydrophobicContact CD2-CD2 4.08Å; L270-L278 HydrophobicContact CD1-CD2 4.43Å; D274-L278 VanDerWaalsContact O-CB 3.3Å; D274-L278 WeakPolarHBondContact O-CB 3.37Å; D274-L278 PolarHBondContact O-N 2.88Å; A276-L278 PolarHBondContact O-N 3.38Å; L278-A334 HydrophobicContact CD1-CB 4.11Å; L278-L338 HydrophobicContact CD1-CD1 4.11Å; L278-L338 HydrophobicContact CD1-CD2 3.64Å; L278-L338 HydrophobicContact CD1-CG 3.77Å; L278-L338 HydrophobicContact CD2-CD2 4.17Å; L278-L345 HydrophobicContact CD2-CD2 4.47Å; L278-L366 HydrophobicContact CD1-CD1 3.75Å
279	C	72.8	Confident	79.7	Confident	13 Å²	13	42.2 Å²	42.2	9%	0.088	26%	0.258	C	S	.	.	H	α-helix	trans	-75.5	-32	174.6	-62.1	0	0	0	0	112.1	Q265 S275 A276 N281 L282	Q265-C279 PolarHBondContact NE2-SG 3.45Å; S275-C279 WeakPolarHBondContact O-CB 2.93Å; S275-C279 PolarHBondContact O-N 2.73Å; S275-C279 PolarHBondContact O-SG 2.92Å; A276-C279 PolarHBondContact O-N 2.84Å; C279-N281 PolarHBondContact O-N 3.4Å; C279-L282 WeakPolarHBondContact O-CB 3.15Å; C279-L282 PolarHBondContact O-N 3.17Å
280	G	78.4	Confident	80.8	Confident	38 Å²	38	40.4 Å²	40.4	39%	0.392	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.7	-135.9	-179.3	0	0	0	0	0	111.6	A276 T277	A276-G280 PolarHBondContact O-N 2.95Å; T277-G280 PolarHBondContact O-N 3.32Å
281	N	81.4	Confident	81.7	Confident	7 Å²	7	41.3 Å²	41.3	4%	0.037	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	27.7	171	72.3	-38.6	0	0	0	113.7	C279 E283 E284 I285 L323 Y327	C279-N281 PolarHBondContact O-N 3.4Å; N281-E283 PolarHBondContact O-N 3.08Å; N281-E284 HydrophobicContact CB-CB 4.2Å; N281-E284 HydrophobicContact CB-CG 4.1Å; N281-E284 WeakPolarHBondContact CB-OE2 3.29Å; N281-E284 WeakPolarHBondContact O-CB 3.47Å; N281-E284 PolarHBondContact O-N 3.4Å; N281-E284 VanDerWaalsContact O-N 3.09Å; N281-I285 PolarHBondContact O-N 3.26Å; N281-L323 PolarHBondContact ND2-O 3.27Å; N281-Y327 WeakPolarHBondContact OD1-CA 3.5Å; N281-Y327 WeakPolarHBondContact OD1-CB 3.32Å; N281-Y327 WeakPolarHBondContact OD1-CD2 3.5Å; N281-Y327 PolarHBondContact OD1-N 3.49Å
282	L	81.1	Confident	82.1	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-63.9	-28.6	-177.8	-162	73	0	0	0	112.9	L253 V256 L261 C279 I285 L286 Y327 L366 P369	L253-L282 HydrophobicContact CD2-CD1 3.95Å; V256-L282 HydrophobicContact CG1-CD2 4.36Å; L261-L282 HydrophobicContact CD1-CD2 3.57Å; C279-L282 WeakPolarHBondContact O-CB 3.15Å; C279-L282 PolarHBondContact O-N 3.17Å; L282-I285 PolarHBondContact O-N 3.42Å; L282-L286 WeakPolarHBondContact O-CB 3.39Å; L282-L286 PolarHBondContact O-N 3.21Å; L282-Y327 HydrophobicContact CB-CE2 4.49Å; L282-Y327 HydrophobicContact CD1-CE2 3.83Å; L282-L366 HydrophobicContact CD2-CD2 4Å; L282-P369 HydrophobicContact CD1-CG 4.16Å
283	E	84.1	Confident	82.7	Confident	90 Å²	90	33.8 Å²	33.8	42%	0.421	21%	0.214	S	C	.	.	H	α-helix	trans	-73.1	-32.6	174.6	-157.4	155.2	-137.6	0	0	112.3	L257 R262 N281 T287	L257-E283 HydrophobicContact CD1-CB 3.74Å; L257-E283 HydrophobicContact CD1-CG 3.94Å; R262-E283 IonicContact CZ-OE1 3.37Å; R262-E283 IonicContact NE-OE1 2.63Å; R262-E283 IonicContact NH2-OE1 2.63Å; R262-E283 PolarHBondContact NH2-OE1 3.08Å; N281-E283 PolarHBondContact O-N 3.08Å; E283-T287 WeakPolarHBondContact O-CB 3.25Å; E283-T287 PolarHBondContact O-N 3.41Å; E283-T287 PolarHBondContact O-OG1 3.2Å
284	E	85.8	Confident	83.2	Confident	103 Å²	103	35.2 Å²	35.2	48%	0.481	22%	0.218	S	C	.	.	H	α-helix	trans	-66.4	-45.3	170.2	-56.5	179.6	174.5	0	0	110.5	N281 T287 F288 L323	N281-E284 HydrophobicContact CB-CB 4.2Å; N281-E284 HydrophobicContact CB-CG 4.1Å; N281-E284 WeakPolarHBondContact CB-OE2 3.29Å; N281-E284 WeakPolarHBondContact O-CB 3.47Å; N281-E284 PolarHBondContact O-N 3.4Å; N281-E284 VanDerWaalsContact O-N 3.09Å; E284-T287 PolarHBondContact O-N 2.8Å; E284-F288 VanDerWaalsContact O-CB 3.3Å; E284-F288 WeakPolarHBondContact O-CB 3.32Å; E284-F288 PolarHBondContact O-N 3.07Å; E284-L323 HydrophobicContact CB-CD2 3.84Å; E284-L323 WeakPolarHBondContact OE2-CD2 3.27Å
285	I	87	Confident	83.6	Confident	1 Å²	1	34.1 Å²	34.1	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-60.8	-46.4	176.3	-68	164.1	0	0	0	110.6	L253 N281 L282 T287 F288 Q289 L323 Y327	L253-I285 HydrophobicContact CD1-CG2 4.16Å; N281-I285 PolarHBondContact O-N 3.26Å; L282-I285 PolarHBondContact O-N 3.42Å; I285-T287 PolarHBondContact O-N 3.4Å; I285-F288 PolarHBondContact O-N 2.71Å; I285-Q289 VanDerWaalsContact O-CB 3.25Å; I285-Q289 WeakPolarHBondContact O-CB 3.31Å; I285-Q289 PolarHBondContact O-N 3.31Å; I285-L323 HydrophobicContact CG1-CB 4.46Å; I285-Y327 HydrophobicContact CD1-CD1 4.16Å; I285-Y327 HydrophobicContact CD1-CD2 3.7Å; I285-Y327 HydrophobicContact CD1-CE2 4.39Å; I285-Y327 HydrophobicContact CD1-CG 3.57Å
286	L	86.4	Confident	84	Confident	9 Å²	9	33.7 Å²	33.7	5%	0.047	21%	0.213	C	C	.	.	H	α-helix	trans	-59.5	-45.9	177.2	174.3	60.2	0	0	0	111.6	V250 L253 Q254 L257 L282 Q289 Q290	V250-L286 HydrophobicContact CG1-CD1 4.21Å; L253-L286 HydrophobicContact CB-CD1 3.87Å; Q254-L286 HydrophobicContact CB-CD1 4.07Å; Q254-L286 HydrophobicContact CB-CD2 4.24Å; L257-L286 HydrophobicContact CB-CD2 4.49Å; L257-L286 HydrophobicContact CD1-CD2 4.19Å; L282-L286 WeakPolarHBondContact O-CB 3.39Å; L282-L286 PolarHBondContact O-N 3.21Å; L286-Q289 PolarHBondContact O-N 2.84Å; L286-Q290 HydrophobicContact CD1-CG 4.33Å; L286-Q290 WeakPolarHBondContact O-CG 3.45Å; L286-Q290 PolarHBondContact O-N 2.85Å
287	T	89.1	Confident	84.2	Confident	88 Å²	88	33.8 Å²	33.8	54%	0.54	20%	0.204	S	C	.	.	H	α-helix	trans	-63.4	-44.7	178.7	-54.7	0	0	0	0	111.2	E283 E284 I285 Q290 G291	E283-T287 WeakPolarHBondContact O-CB 3.25Å; E283-T287 PolarHBondContact O-N 3.41Å; E283-T287 PolarHBondContact O-OG1 3.2Å; E284-T287 PolarHBondContact O-N 2.8Å; I285-T287 PolarHBondContact O-N 3.4Å; T287-Q290 PolarHBondContact O-N 2.65Å; T287-G291 PolarHBondContact O-N 3.39Å; T287-G291 VanDerWaalsContact O-N 3.1Å
288	F	88.7	Confident	84.4	Confident	19 Å²	19	36 Å²	36	8%	0.083	21%	0.214	C	C	.	.	H	α-helix	trans	-61.4	-45.1	174.6	171.7	-90.9	0	0	0	111.7	E284 I285 Q290 G291 L292 L316 Q319 I320 L323	E284-F288 VanDerWaalsContact O-CB 3.3Å; E284-F288 WeakPolarHBondContact O-CB 3.32Å; E284-F288 PolarHBondContact O-N 3.07Å; I285-F288 PolarHBondContact O-N 2.71Å; F288-Q290 VanDerWaalsContact C-N 3.33Å; F288-Q290 PolarHBondContact O-N 3.16Å; F288-G291 CarbonylContact O-C 3.42Å; F288-G291 WeakPolarHBondContact O-CA 3.23Å; F288-G291 PolarHBondContact O-N 3.02Å; F288-G291 VanDerWaalsContact O-N 3.11Å; F288-L292 HydrophobicContact CE1-CB 4.17Å; F288-L292 HydrophobicContact CE1-CD2 3.98Å; F288-L292 HydrophobicContact CZ-CB 4.34Å; F288-L292 HydrophobicContact CZ-CD2 4.44Å; F288-L292 WeakPolarHBondContact O-CB 3.26Å; F288-L292 PolarHBondContact O-N 2.88Å; F288-L316 HydrophobicContact CE2-CB 4.21Å; F288-L316 HydrophobicContact CE2-CD2 4.29Å; F288-L316 HydrophobicContact CZ-CB 4.08Å; F288-Q319 HydrophobicContact CD2-CB 4.21Å; F288-Q319 HydrophobicContact CE2-CB 3.83Å; F288-I320 HydrophobicContact CE1-CD1 4.4Å; F288-I320 HydrophobicContact CE1-CG1 3.64Å; F288-I320 HydrophobicContact CE2-CG1 4.27Å; F288-I320 HydrophobicContact CZ-CD1 4.07Å; F288-I320 HydrophobicContact CZ-CG1 3.32Å; F288-L323 HydrophobicContact CB-CD1 3.51Å; F288-L323 HydrophobicContact CD1-CD1 4.22Å; F288-L323 HydrophobicContact CD2-CD1 3.75Å; F288-L323 HydrophobicContact CG-CD1 3.52Å
289	Q	86.6	Confident	84.4	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-68	-34.4	-176.9	-155.1	71.7	13.4	0	0	111.9	E246 F249 V250 I285 L286 L292 C293 Y376	E246-Q289 PolarHBondContact OE2-NE2 3.27Å; F249-Q289 HydrophobicContact CD1-CG 3.79Å; F249-Q289 HydrophobicContact CE1-CG 3.89Å; V250-Q289 HydrophobicContact CG2-CB 3.86Å; V250-Q289 HydrophobicContact CG2-CG 3.58Å; I285-Q289 VanDerWaalsContact O-CB 3.25Å; I285-Q289 WeakPolarHBondContact O-CB 3.31Å; I285-Q289 PolarHBondContact O-N 3.31Å; L286-Q289 PolarHBondContact O-N 2.84Å; Q289-L292 PolarHBondContact O-N 2.93Å; Q289-C293 PolarHBondContact O-N 3.4Å; Q289-C293 PolarHBondContact O-SG 3.11Å; Q289-Y376 PolarHBondContact NE2-OH 3.01Å
290	Q	89	Confident	84.4	Confident	76 Å²	76	38.5 Å²	38.5	36%	0.355	23%	0.23	S	C	.	.	H	α-helix	trans	-61.9	-46.4	168.8	-74.8	173	-7.4	0	0	111.3	V250 L286 T287 F288 L292 C293 S294	V250-Q290 HydrophobicContact CG1-CG 3.58Å; L286-Q290 HydrophobicContact CD1-CG 4.33Å; L286-Q290 WeakPolarHBondContact O-CG 3.45Å; L286-Q290 PolarHBondContact O-N 2.85Å; T287-Q290 PolarHBondContact O-N 2.65Å; F288-Q290 VanDerWaalsContact C-N 3.33Å; F288-Q290 PolarHBondContact O-N 3.16Å; Q290-L292 PolarHBondContact O-N 3.43Å; Q290-C293 WeakPolarHBondContact O-CB 3.25Å; Q290-C293 PolarHBondContact O-N 3.5Å; Q290-S294 PolarHBondContact O-N 3.39Å; Q290-S294 PolarHBondContact O-OG 3.29Å
291	G	88.8	Confident	84.2	Confident	42 Å²	42	43.5 Å²	43.5	43%	0.433	24%	0.241	S	C	.	.	H	α-helix	trans	-61.1	-41.4	174.6	0	0	0	0	0	113.4	T287 F288 S294 A295	T287-G291 PolarHBondContact O-N 3.39Å; T287-G291 VanDerWaalsContact O-N 3.1Å; F288-G291 CarbonylContact O-C 3.42Å; F288-G291 WeakPolarHBondContact O-CA 3.23Å; F288-G291 PolarHBondContact O-N 3.02Å; F288-G291 VanDerWaalsContact O-N 3.11Å; G291-S294 PolarHBondContact O-N 3.39Å; G291-A295 WeakPolarHBondContact O-CB 3.38Å; G291-A295 PolarHBondContact O-N 2.87Å
292	L	86.8	Confident	83.9	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-62.4	-44.9	174.6	176.1	63.1	0	0	0	111.3	F288 Q289 Q290 S294 A295 L296 Y313 L316	F288-L292 HydrophobicContact CE1-CB 4.17Å; F288-L292 HydrophobicContact CE1-CD2 3.98Å; F288-L292 HydrophobicContact CZ-CB 4.34Å; F288-L292 HydrophobicContact CZ-CD2 4.44Å; F288-L292 WeakPolarHBondContact O-CB 3.26Å; F288-L292 PolarHBondContact O-N 2.88Å; Q289-L292 PolarHBondContact O-N 2.93Å; Q290-L292 PolarHBondContact O-N 3.43Å; L292-S294 PolarHBondContact O-N 3.37Å; L292-A295 PolarHBondContact O-N 2.84Å; L292-L296 HydrophobicContact CD1-CD1 3.82Å; L292-L296 HydrophobicContact CD1-CG 3.97Å; L292-L296 HydrophobicContact CG-CD1 3.86Å; L292-L296 HydrophobicContact CG-CG 4.41Å; L292-L296 WeakPolarHBondContact O-CB 3.16Å; L292-L296 VanDerWaalsContact O-CG 3.24Å; L292-L296 WeakPolarHBondContact O-CG 3.37Å; L292-L296 PolarHBondContact O-N 2.88Å; L292-Y313 HydrophobicContact CD1-CD1 4.21Å; L292-Y313 HydrophobicContact CD1-CE1 4.08Å; L292-Y313 HydrophobicContact CD2-CE1 4.15Å; L292-L316 HydrophobicContact CB-CD1 4.46Å; L292-L316 HydrophobicContact CD1-CD1 3.52Å
293	C	86.8	Confident	83.1	Confident	9 Å²	9	49.5 Å²	49.5	6%	0.061	29%	0.285	C	S	.	.	H	α-helix	trans	-56.9	-50.4	174.7	-71.4	0	0	0	0	111.6	V250 Q289 Q290 A295 L296 E297	V250-C293 VanDerWaalsContact CG2-SG 3.52Å; Q289-C293 PolarHBondContact O-N 3.4Å; Q289-C293 PolarHBondContact O-SG 3.11Å; Q290-C293 WeakPolarHBondContact O-CB 3.25Å; Q290-C293 PolarHBondContact O-N 3.5Å; C293-A295 PolarHBondContact O-N 3.24Å; C293-L296 PolarHBondContact O-N 2.9Å; C293-E297 WeakPolarHBondContact O-CB 3.27Å; C293-E297 WeakPolarHBondContact O-CG 3.39Å; C293-E297 PolarHBondContact O-N 3.19Å
294	S	86.7	Confident	81.9	Confident	64 Å²	64	50.1 Å²	50.1	45%	0.448	29%	0.288	S	S	.	.	H	α-helix	trans	-63.8	-39.8	178.8	-62.4	0	0	0	0	112.6	Q290 G291 L292 E297 D298	Q290-S294 PolarHBondContact O-N 3.39Å; Q290-S294 PolarHBondContact O-OG 3.29Å; G291-S294 PolarHBondContact O-N 3.39Å; L292-S294 PolarHBondContact O-N 3.37Å; S294-E297 PolarHBondContact O-N 3.35Å; S294-D298 PolarHBondContact O-N 3.43Å
295	A	85.5	Confident	80.7	Confident	32 Å²	32	47.7 Å²	47.7	26%	0.264	29%	0.291	S	S	.	.	H	α-helix	trans	-65.5	-38.5	177	0	0	0	0	0	112.6	G291 L292 C293 D298 C299 L316	G291-A295 WeakPolarHBondContact O-CB 3.38Å; G291-A295 PolarHBondContact O-N 2.87Å; L292-A295 PolarHBondContact O-N 2.84Å; C293-A295 PolarHBondContact O-N 3.24Å; A295-D298 PolarHBondContact O-N 3.31Å; A295-C299 PolarHBondContact O-N 3.28Å; A295-C299 PolarHBondContact O-SG 3.05Å; A295-L316 HydrophobicContact CB-CD1 4.47Å
296	L	82.4	Confident	79.5	Confident	4 Å²	4	54.3 Å²	54.3	2%	0.021	32%	0.322	C	S	.	.	H	α-helix	trans	-69.5	-40.6	173.6	-67.3	169.3	0	0	0	111.4	L243 E246 L292 C293 D298 C299 T300 V309 C312 Y313	L243-L296 HydrophobicContact CD2-CB 3.5Å; L243-L296 HydrophobicContact CD2-CD1 4.5Å; E246-L296 HydrophobicContact CG-CD1 4.49Å; L292-L296 HydrophobicContact CD1-CD1 3.82Å; L292-L296 HydrophobicContact CD1-CG 3.97Å; L292-L296 HydrophobicContact CG-CD1 3.86Å; L292-L296 HydrophobicContact CG-CG 4.41Å; L292-L296 WeakPolarHBondContact O-CB 3.16Å; L292-L296 VanDerWaalsContact O-CG 3.24Å; L292-L296 WeakPolarHBondContact O-CG 3.37Å; L292-L296 PolarHBondContact O-N 2.88Å; C293-L296 PolarHBondContact O-N 2.9Å; L296-D298 VanDerWaalsContact C-N 3.28Å; L296-D298 PolarHBondContact O-N 2.94Å; L296-C299 WeakPolarHBondContact O-CB 3.29Å; L296-C299 PolarHBondContact O-N 2.92Å; L296-C299 VanDerWaalsContact O-N 3.14Å; L296-T300 PolarHBondContact O-N 3.21Å; L296-T300 PolarHBondContact O-OG1 3.14Å; L296-V309 HydrophobicContact CD2-CG1 4.1Å; L296-C312 HydrophobicContact CD2-CB 4.2Å; L296-Y313 HydrophobicContact CD1-CE1 4.36Å; L296-Y313 HydrophobicContact CD1-CE2 4.41Å; L296-Y313 HydrophobicContact CD2-CD2 4.29Å; L296-Y313 HydrophobicContact CD2-CE2 3.89Å
297	E	84	Confident	78.9	Confident	57 Å²	57	54.4 Å²	54.4	27%	0.266	32%	0.322	S	S	.	.	H	α-helix	trans	-64.4	-28	172.9	-75.8	178.9	-179.2	0	0	113.1	L243 R247 C293 S294 T300 K301	L243-E297 HydrophobicContact CD1-CG 4.38Å; L243-E297 HydrophobicContact CD2-CG 3.98Å; R247-E297 WeakPolarHBondContact CD-OE1 3.37Å; R247-E297 IonicContact CZ-OE1 2.98Å; R247-E297 IonicContact NE-OE1 3.16Å; R247-E297 IonicContact NH1-OE1 3.6Å; R247-E297 PolarHBondContact NH1-OE1 3.13Å; C293-E297 WeakPolarHBondContact O-CB 3.27Å; C293-E297 WeakPolarHBondContact O-CG 3.39Å; C293-E297 PolarHBondContact O-N 3.19Å; S294-E297 PolarHBondContact O-N 3.35Å; E297-T300 PolarHBondContact O-OG1 3.05Å; E297-K301 VanDerWaalsContact C-NZ 3.31Å; E297-K301 WeakPolarHBondContact O-CD 3.48Å; E297-K301 VanDerWaalsContact O-CE 3.22Å; E297-K301 WeakPolarHBondContact O-CE 3.48Å; E297-K301 VanDerWaalsContact O-CG 3.3Å; E297-K301 WeakPolarHBondContact O-CG 3.31Å; E297-K301 PolarHBondContact O-NZ 2.93Å
298	D	82.8	Confident	78.2	Confident	98 Å²	98	55.4 Å²	55.4	52%	0.524	32%	0.316	S	S	.	.	H	α-helix	trans	-76	-34.6	170.7	-78.2	-24.9	0	0	0	111.8	S294 A295 L296 T300 K301	S294-D298 PolarHBondContact O-N 3.43Å; A295-D298 PolarHBondContact O-N 3.31Å; L296-D298 VanDerWaalsContact C-N 3.28Å; L296-D298 PolarHBondContact O-N 2.94Å; D298-T300 VanDerWaalsContact C-N 3.34Å; D298-T300 PolarHBondContact O-N 3.25Å; D298-K301 PolarHBondContact O-N 3.3Å; D298-K301 IonicContact OD1-NZ 3.62Å; D298-K301 PolarHBondContact OD1-NZ 2.74Å
299	C	77.3	Confident	77.6	Confident	28 Å²	28	54.8 Å²	54.8	19%	0.189	31%	0.313	C	S	.	.	H	α-helix	trans	-65.1	-34.2	174.4	-67.6	0	0	0	0	112.9	A295 L296 V302	A295-C299 PolarHBondContact O-N 3.28Å; A295-C299 PolarHBondContact O-SG 3.05Å; L296-C299 WeakPolarHBondContact O-CB 3.29Å; L296-C299 PolarHBondContact O-N 2.92Å; L296-C299 VanDerWaalsContact O-N 3.14Å; C299-V302 WeakPolarHBondContact O-CB 3.42Å; C299-V302 PolarHBondContact O-N 2.82Å
300	T	73.4	Confident	77.2	Confident	41 Å²	41	54.8 Å²	54.8	25%	0.252	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-12.2	179.6	57.5	0	0	0	0	114.8	V239 L243 L296 E297 D298 V302 Q307	V239-T300 HydrophobicContact CG1-CG2 3.34Å; L243-T300 HydrophobicContact CD1-CG2 3.66Å; L296-T300 PolarHBondContact O-N 3.21Å; L296-T300 PolarHBondContact O-OG1 3.14Å; E297-T300 PolarHBondContact O-OG1 3.05Å; D298-T300 VanDerWaalsContact C-N 3.34Å; D298-T300 PolarHBondContact O-N 3.25Å; T300-V302 PolarHBondContact O-N 2.87Å; T300-Q307 PolarHBondContact O-NE2 3.44Å
301	K	74.4	Confident	76.8	Confident	143 Å²	143	52.1 Å²	52.1	62%	0.622	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-15.3	169.4	-68.6	164.7	-165	121	0	112.5	E297 D298	E297-K301 VanDerWaalsContact C-NZ 3.31Å; E297-K301 WeakPolarHBondContact O-CD 3.48Å; E297-K301 VanDerWaalsContact O-CE 3.22Å; E297-K301 WeakPolarHBondContact O-CE 3.48Å; E297-K301 VanDerWaalsContact O-CG 3.3Å; E297-K301 WeakPolarHBondContact O-CG 3.31Å; E297-K301 PolarHBondContact O-NZ 2.93Å; D298-K301 PolarHBondContact O-N 3.3Å; D298-K301 IonicContact OD1-NZ 3.62Å; D298-K301 PolarHBondContact OD1-NZ 2.74Å
302	V	74.4	Confident	76.5	Confident	61 Å²	61	50.9 Å²	50.9	37%	0.37	29%	0.291	S	S	.	.	S	Bend	trans	-78.7	148.3	174.6	-172.8	0	0	0	0	109.8	C299 T300 Q306 Q307	C299-V302 WeakPolarHBondContact O-CB 3.42Å; C299-V302 PolarHBondContact O-N 2.82Å; T300-V302 PolarHBondContact O-N 2.87Å; V302-Q306 HydrophobicContact CG1-CB 3.72Å; V302-Q307 VanDerWaalsContact O-CG 3.24Å; V302-Q307 WeakPolarHBondContact O-CG 3.39Å; V302-Q307 PolarHBondContact O-NE2 2.92Å
303	A	65.7	Low	76.4	Confident	73 Å²	73	51 Å²	51	60%	0.603	29%	0.291	S	S	*	.			trans	-59.6	143.1	178.4	0	0	0	0	0	112.2	G305 Q306 Q307	A303-G305 VanDerWaalsContact C-N 3.31Å; A303-G305 PolarHBondContact O-N 2.98Å; A303-Q306 PolarHBondContact O-N 3.24Å; A303-Q307 PolarHBondContact O-N 3.27Å
304	E	58.9	Low	76.3	Confident	104 Å²	104	52.9 Å²	52.9	49%	0.486	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-46.1	-45.8	-167.5	-61.7	175	156.4	0	0	114.3	Q306 Q307 H391	E304-Q306 PolarHBondContact O-N 3.03Å; E304-Q307 PolarHBondContact O-N 3.2Å; E304-H391 PolarHBondContact O-NE2 3.1Å
305	G	59.8	Low	76.2	Confident	52 Å²	52	56 Å²	56	54%	0.536	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-71.9	6.8	179.2	0	0	0	0	0	116.4	A303	A303-G305 VanDerWaalsContact C-N 3.31Å; A303-G305 PolarHBondContact O-N 2.98Å
306	Q	62.8	Low	76.2	Confident	139 Å²	139	55.6 Å²	55.6	65%	0.65	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-134	4.5	176.8	-68.7	-174.6	-1.7	0	0	113.2	V302 A303 E304 R308	V302-Q306 HydrophobicContact CG1-CB 3.72Å; A303-Q306 PolarHBondContact O-N 3.24Å; E304-Q306 PolarHBondContact O-N 3.03Å; Q306-R308 PolarHBondContact O-N 3.36Å; Q306-R308 VanDerWaalsContact O-N 3.14Å
307	Q	72.4	Confident	76.3	Confident	12 Å²	12	56 Å²	56	6%	0.056	31%	0.307	C	S	.	.			trans	-69.1	109.5	179.9	-67.8	-176.2	-7.7	0	0	110.8	F235 T300 V302 A303 E304 V309 H391	F235-Q307 HydrophobicContact CE1-CB 4.42Å; T300-Q307 PolarHBondContact O-NE2 3.44Å; V302-Q307 VanDerWaalsContact O-CG 3.24Å; V302-Q307 WeakPolarHBondContact O-CG 3.39Å; V302-Q307 PolarHBondContact O-NE2 2.92Å; A303-Q307 PolarHBondContact O-N 3.27Å; E304-Q307 PolarHBondContact O-N 3.2Å; Q307-V309 PolarHBondContact O-N 2.92Å; Q307-H391 PolarHBondContact O-CE1 3.35Å
308	R	74	Confident	76.4	Confident	109 Å²	109	57.8 Å²	57.8	41%	0.411	33%	0.327	S	S	.	.			trans	-99.5	70.1	179.5	-74.3	-175.1	166.9	-81.1	3.8	112.5	Q306 C312 P392 D393 D396	Q306-R308 PolarHBondContact O-N 3.36Å; Q306-R308 VanDerWaalsContact O-N 3.14Å; R308-C312 PolarHBondContact O-N 3.16Å; R308-C312 VanDerWaalsContact O-N 3.12Å; R308-P392 VanDerWaalsContact CZ-O 3.26Å; R308-P392 PolarHBondContact NH1-O 3.38Å; R308-P392 PolarHBondContact NH2-O 2.86Å; R308-D393 VanDerWaalsContact CA-OD1 3.29Å; R308-D393 WeakPolarHBondContact CA-OD1 3.26Å; R308-D393 WeakPolarHBondContact CB-OD1 3.39Å; R308-D393 HydrophobicContact CG-CB 4.41Å; R308-D393 IonicContact NH1-OD1 3.19Å; R308-D396 IonicContact CZ-OD2 3.1Å; R308-D396 IonicContact NH1-OD2 3.61Å; R308-D396 PolarHBondContact NH1-OD2 3.36Å
309	V	77.8	Confident	76.5	Confident	5 Å²	5	58 Å²	58	3%	0.03	33%	0.325	C	S	.	.	H	α-helix	trans	-66.7	-47	-178.9	178.7	0	0	0	0	110.4	V239 L296 Q307 C312 Y313 L383 D393	V239-V309 HydrophobicContact CG1-CG2 4.11Å; V239-V309 HydrophobicContact CG2-CG2 4.22Å; L296-V309 HydrophobicContact CD2-CG1 4.1Å; Q307-V309 PolarHBondContact O-N 2.92Å; V309-C312 WeakPolarHBondContact O-CB 3.45Å; V309-C312 PolarHBondContact O-N 3.34Å; V309-Y313 HydrophobicContact CG1-CD2 4.21Å; V309-Y313 HydrophobicContact CG1-CE2 3.94Å; V309-Y313 VanDerWaalsContact O-CD2 3.28Å; V309-Y313 WeakPolarHBondContact O-CD2 3.38Å; V309-Y313 PolarHBondContact O-N 3.01Å; V309-L383 HydrophobicContact CB-CD2 4.42Å; V309-L383 HydrophobicContact CG1-CD2 4.27Å; V309-D393 PolarHBondContact N-OD2 3.01Å
310	A	78.6	Confident	76.9	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-72.3	-33.8	176.9	0	0	0	0	0	112.7	C312 Y313 L314 D393 D396 I397 A400	A310-C312 VanDerWaalsContact C-N 3.25Å; A310-C312 PolarHBondContact O-N 3.24Å; A310-Y313 PolarHBondContact O-N 3.44Å; A310-L314 WeakPolarHBondContact O-CG 3.45Å; A310-L314 PolarHBondContact O-N 2.68Å; A310-D393 WeakPolarHBondContact CB-OD2 3.22Å; A310-D393 PolarHBondContact N-OD2 3.13Å; A310-D396 HydrophobicContact CB-CB 4.25Å; A310-I397 VanDerWaalsContact CB-CA 3.44Å; A310-I397 HydrophobicContact CB-CB 4.09Å; A310-I397 HydrophobicContact CB-CG1 3.5Å; A310-I397 VanDerWaalsContact CB-CG1 3.5Å; A310-I397 VanDerWaalsContact CB-N 3.33Å; A310-A400 HydrophobicContact CB-CB 4.14Å
311	G	79.9	Confident	77.6	Confident	20 Å²	20	57.8 Å²	57.8	21%	0.206	32%	0.317	C	S	.	.	H	α-helix	trans	-54.8	-39.8	168.9	0	0	0	0	0	113.2	N315 D393	G311-N315 PolarHBondContact O-N 2.98Å; G311-N315 VanDerWaalsContact O-N 3.16Å; G311-D393 PolarHBondContact N-OD1 3.42Å
312	C	82.4	Confident	78.2	Confident	16 Å²	16	55 Å²	55	11%	0.108	32%	0.315	C	S	.	.	H	α-helix	trans	-63.8	-50.2	173.9	-171.6	0	0	0	0	111.8	L296 R308 V309 A310 L314 N315 L316	L296-C312 HydrophobicContact CD2-CB 4.2Å; R308-C312 PolarHBondContact O-N 3.16Å; R308-C312 VanDerWaalsContact O-N 3.12Å; V309-C312 WeakPolarHBondContact O-CB 3.45Å; V309-C312 PolarHBondContact O-N 3.34Å; A310-C312 VanDerWaalsContact C-N 3.25Å; A310-C312 PolarHBondContact O-N 3.24Å; C312-L314 PolarHBondContact O-N 3.24Å; C312-N315 PolarHBondContact O-N 2.91Å; C312-L316 PolarHBondContact O-N 3.45Å; C312-L316 VanDerWaalsContact O-N 3.12Å
313	Y	84.4	Confident	78.8	Confident	3 Å²	3	53.4 Å²	53.4	1%	0.012	30%	0.304	C	S	.	.	H	α-helix	trans	-58.3	-42.6	176.2	-79.5	-66.8	0	0	0	112.9	L292 L296 V309 A310 L316 M317 I320 Y376 L380 F404	L292-Y313 HydrophobicContact CD1-CD1 4.21Å; L292-Y313 HydrophobicContact CD1-CE1 4.08Å; L292-Y313 HydrophobicContact CD2-CE1 4.15Å; L296-Y313 HydrophobicContact CD1-CE1 4.36Å; L296-Y313 HydrophobicContact CD1-CE2 4.41Å; L296-Y313 HydrophobicContact CD2-CD2 4.29Å; L296-Y313 HydrophobicContact CD2-CE2 3.89Å; V309-Y313 HydrophobicContact CG1-CD2 4.21Å; V309-Y313 HydrophobicContact CG1-CE2 3.94Å; V309-Y313 VanDerWaalsContact O-CD2 3.28Å; V309-Y313 WeakPolarHBondContact O-CD2 3.38Å; V309-Y313 PolarHBondContact O-N 3.01Å; A310-Y313 PolarHBondContact O-N 3.44Å; Y313-L316 CarbonylContact O-C 3.58Å; Y313-L316 PolarHBondContact O-N 3.25Å; Y313-M317 WeakPolarHBondContact O-CA 3.48Å; Y313-M317 WeakPolarHBondContact O-CB 3.5Å; Y313-M317 PolarHBondContact O-N 2.77Å; Y313-I320 HydrophobicContact CD1-CD1 4.5Å; Y313-Y376 HydrophobicContact CE1-CD1 4.06Å; Y313-Y376 AromaticContact CE1-CE1 3.91Å; Y313-Y376 HydrophobicContact CE1-CE1 3.91Å; Y313-L380 HydrophobicContact CD2-CD2 4.15Å; Y313-L380 HydrophobicContact CE2-CD2 4.29Å; Y313-F404 AromaticContact CD1-CE2 3.89Å; Y313-F404 HydrophobicContact CD1-CE2 3.89Å; Y313-F404 AromaticContact CD1-CZ 3.76Å; Y313-F404 HydrophobicContact CD1-CZ 3.76Å; Y313-F404 HydrophobicContact CE1-CZ 4.28Å; Y313-F404 HydrophobicContact CG-CE2 4.11Å; Y313-F404 HydrophobicContact CG-CZ 4.44Å
314	L	83.8	Confident	79.8	Confident	50 Å²	50	50 Å²	50	26%	0.262	28%	0.276	S	S	.	.	H	α-helix	trans	-63	-42.7	178.2	-76.7	179.3	0	0	0	112.7	A310 C312 L316 M317 D396 K399 A400	A310-L314 WeakPolarHBondContact O-CG 3.45Å; A310-L314 PolarHBondContact O-N 2.68Å; C312-L314 PolarHBondContact O-N 3.24Å; L314-L316 VanDerWaalsContact C-N 3.34Å; L314-L316 PolarHBondContact O-N 3.29Å; L314-M317 VanDerWaalsContact O-CB 3.26Å; L314-M317 WeakPolarHBondContact O-CB 3.32Å; L314-M317 PolarHBondContact O-N 3.11Å; L314-D396 HydrophobicContact CD1-CB 3.77Å; L314-K399 HydrophobicContact CD1-CB 3.99Å; L314-K399 HydrophobicContact CD1-CD 4.19Å; L314-K399 HydrophobicContact CD2-CB 4.02Å; L314-A400 HydrophobicContact CD2-CB 4.09Å; L314-A400 HydrophobicContact CG-CB 4.18Å
315	N	85.6	Confident	81.1	Confident	130 Å²	130	47.3 Å²	47.3	70%	0.695	27%	0.265	S	S	*	.	H	α-helix	trans	-63.2	-41.2	177.7	-175.5	45	0	0	0	111.6	G311 C312 M317	G311-N315 PolarHBondContact O-N 2.98Å; G311-N315 VanDerWaalsContact O-N 3.16Å; C312-N315 PolarHBondContact O-N 2.91Å; N315-M317 VanDerWaalsContact C-N 3.34Å
316	L	85.3	Confident	82.3	Confident	23 Å²	23	48.5 Å²	48.5	12%	0.12	26%	0.259	C	S	.	.	H	α-helix	trans	-80.8	-13.2	178.1	-64	173.4	0	0	0	113.3	F288 L292 A295 C312 Y313 L314 S318 Q319 I320	F288-L316 HydrophobicContact CE2-CB 4.21Å; F288-L316 HydrophobicContact CE2-CD2 4.29Å; F288-L316 HydrophobicContact CZ-CB 4.08Å; L292-L316 HydrophobicContact CB-CD1 4.46Å; L292-L316 HydrophobicContact CD1-CD1 3.52Å; A295-L316 HydrophobicContact CB-CD1 4.47Å; C312-L316 PolarHBondContact O-N 3.45Å; C312-L316 VanDerWaalsContact O-N 3.12Å; Y313-L316 CarbonylContact O-C 3.58Å; Y313-L316 PolarHBondContact O-N 3.25Å; L314-L316 VanDerWaalsContact C-N 3.34Å; L314-L316 PolarHBondContact O-N 3.29Å; L316-S318 VanDerWaalsContact C-N 3.26Å; L316-S318 PolarHBondContact O-N 2.9Å; L316-S318 VanDerWaalsContact O-N 3.11Å; L316-Q319 WeakPolarHBondContact O-CA 3.37Å; L316-Q319 WeakPolarHBondContact O-CB 3.49Å; L316-Q319 PolarHBondContact O-N 3.29Å; L316-I320 HydrophobicContact CB-CD1 4.46Å; L316-I320 WeakPolarHBondContact O-CG1 3.3Å; L316-I320 PolarHBondContact O-N 3.39Å
317	M	84.3	Confident	83.4	Confident	11 Å²	11	42.1 Å²	42.1	5%	0.054	23%	0.229	C	C	.	.	H	α-helix	trans	-54.6	-37	-173	-167.5	65.4	-165.5	0	0	113.5	Y313 L314 N315 Q319 I320 K321 A403 F404 L407	Y313-M317 WeakPolarHBondContact O-CA 3.48Å; Y313-M317 WeakPolarHBondContact O-CB 3.5Å; Y313-M317 PolarHBondContact O-N 2.77Å; L314-M317 VanDerWaalsContact O-CB 3.26Å; L314-M317 WeakPolarHBondContact O-CB 3.32Å; L314-M317 PolarHBondContact O-N 3.11Å; N315-M317 VanDerWaalsContact C-N 3.34Å; M317-Q319 VanDerWaalsContact C-N 3.27Å; M317-Q319 PolarHBondContact O-N 3.07Å; M317-I320 PolarHBondContact O-N 3.27Å; M317-I320 HydrophobicContact SD-CD1 4.45Å; M317-K321 HydrophobicContact CE-CD 4.44Å; M317-K321 HydrophobicContact CE-CG 3.97Å; M317-K321 HydrophobicContact CG-CG 4.47Å; M317-K321 WeakPolarHBondContact O-CB 3.38Å; M317-K321 VanDerWaalsContact O-CG 3.3Å; M317-K321 WeakPolarHBondContact O-CG 3.46Å; M317-K321 PolarHBondContact O-N 3.48Å; M317-A403 HydrophobicContact CE-CB 4Å; M317-A403 VanDerWaalsContact CE-O 3.27Å; M317-A403 WeakPolarHBondContact CE-O 3.35Å; M317-A403 HydrophobicContact CG-CB 4.16Å; M317-A403 HydrophobicContact SD-CB 4.29Å; M317-F404 HydrophobicContact CE-CD1 4.14Å; M317-F404 HydrophobicContact CE-CE1 4.46Å; M317-F404 HydrophobicContact CE-CG 4.28Å; M317-F404 HydrophobicContact SD-CD1 4.31Å; M317-F404 HydrophobicContact SD-CD2 4.3Å; M317-F404 HydrophobicContact SD-CE1 4.15Å; M317-F404 HydrophobicContact SD-CE2 4.15Å; M317-F404 HydrophobicContact SD-CG 4.39Å; M317-F404 HydrophobicContact SD-CZ 4.08Å; M317-L407 HydrophobicContact CE-CB 3.7Å; M317-L407 HydrophobicContact CE-CD2 3.62Å; M317-L407 HydrophobicContact CE-CG 4.31Å
318	S	85.8	Confident	83.9	Confident	96 Å²	96	41.5 Å²	41.5	67%	0.671	23%	0.226	S	C	*	.	H	α-helix	trans	-65.9	-31.1	177.6	-165.9	0	0	0	0	112.8	L316 S322	L316-S318 VanDerWaalsContact C-N 3.26Å; L316-S318 PolarHBondContact O-N 2.9Å; L316-S318 VanDerWaalsContact O-N 3.11Å; S318-S322 PolarHBondContact O-N 3.48Å
319	Q	85.6	Confident	84.4	Confident	103 Å²	103	38.2 Å²	38.2	48%	0.481	22%	0.219	S	C	.	.	H	α-helix	trans	-77.5	-44.5	175.8	-55.8	-179.5	19.8	0	0	110.1	F288 L316 M317 K321 S322 L323	F288-Q319 HydrophobicContact CD2-CB 4.21Å; F288-Q319 HydrophobicContact CE2-CB 3.83Å; L316-Q319 WeakPolarHBondContact O-CA 3.37Å; L316-Q319 WeakPolarHBondContact O-CB 3.49Å; L316-Q319 PolarHBondContact O-N 3.29Å; M317-Q319 VanDerWaalsContact C-N 3.27Å; M317-Q319 PolarHBondContact O-N 3.07Å; Q319-K321 VanDerWaalsContact C-N 3.33Å; Q319-K321 PolarHBondContact O-N 2.98Å; Q319-S322 PolarHBondContact O-N 3.4Å; Q319-L323 WeakPolarHBondContact O-CB 3.4Å; Q319-L323 WeakPolarHBondContact O-CG 3.44Å; Q319-L323 PolarHBondContact O-N 2.88Å
320	I	86.3	Confident	84.6	Confident	0 Å²	0	39 Å²	39	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-52.7	-51.6	173.3	-60.1	174.7	0	0	0	110	F288 Y313 L316 M317 S322 L323 Y324 F404 L407	F288-I320 HydrophobicContact CE1-CD1 4.4Å; F288-I320 HydrophobicContact CE1-CG1 3.64Å; F288-I320 HydrophobicContact CE2-CG1 4.27Å; F288-I320 HydrophobicContact CZ-CD1 4.07Å; F288-I320 HydrophobicContact CZ-CG1 3.32Å; Y313-I320 HydrophobicContact CD1-CD1 4.5Å; L316-I320 HydrophobicContact CB-CD1 4.46Å; L316-I320 WeakPolarHBondContact O-CG1 3.3Å; L316-I320 PolarHBondContact O-N 3.39Å; M317-I320 PolarHBondContact O-N 3.27Å; M317-I320 HydrophobicContact SD-CD1 4.45Å; I320-S322 PolarHBondContact O-N 2.88Å; I320-L323 PolarHBondContact O-N 2.78Å; I320-Y324 HydrophobicContact CG2-CD2 3.66Å; I320-Y324 HydrophobicContact CG2-CE2 3.95Å; I320-Y324 WeakPolarHBondContact O-CB 3.37Å; I320-Y324 WeakPolarHBondContact O-CD2 3.36Å; I320-Y324 PolarHBondContact O-N 3.13Å; I320-F404 HydrophobicContact CD1-CE1 4.21Å; I320-F404 HydrophobicContact CD1-CZ 3.82Å; I320-F404 HydrophobicContact CG2-CE1 4.18Å; I320-L407 HydrophobicContact CG2-CD2 3.7Å
321	K	86.7	Confident	84.9	Confident	63 Å²	63	39.2 Å²	39.2	27%	0.274	23%	0.226	S	C	.	.	H	α-helix	trans	-54.6	-51.6	177.9	-73.5	-169.7	174	-158.8	0	111.9	M317 Q319 L325 L407	M317-K321 HydrophobicContact CE-CD 4.44Å; M317-K321 HydrophobicContact CE-CG 3.97Å; M317-K321 HydrophobicContact CG-CG 4.47Å; M317-K321 WeakPolarHBondContact O-CB 3.38Å; M317-K321 VanDerWaalsContact O-CG 3.3Å; M317-K321 WeakPolarHBondContact O-CG 3.46Å; M317-K321 PolarHBondContact O-N 3.48Å; Q319-K321 VanDerWaalsContact C-N 3.33Å; Q319-K321 PolarHBondContact O-N 2.98Å; K321-L325 VanDerWaalsContact O-CB 3.23Å; K321-L325 WeakPolarHBondContact O-CB 3.39Å; K321-L325 WeakPolarHBondContact O-CD1 3.38Å; K321-L325 WeakPolarHBondContact O-CG 3.32Å; K321-L325 PolarHBondContact O-N 3.35Å; K321-L407 HydrophobicContact CB-CD1 4.38Å; K321-L407 HydrophobicContact CG-CD1 4.02Å; K321-L407 HydrophobicContact CG-CD2 3.98Å; K321-L407 HydrophobicContact CG-CG 4.38Å
322	S	88	Confident	85.1	Confident	84 Å²	84	38.7 Å²	38.7	59%	0.587	22%	0.219	S	C	*	.	H	α-helix	trans	-61.9	-48.6	-178.1	-164.4	0	0	0	0	112.5	S318 Q319 I320 N326	S318-S322 PolarHBondContact O-N 3.48Å; Q319-S322 PolarHBondContact O-N 3.4Å; I320-S322 PolarHBondContact O-N 2.88Å; S322-N326 WeakPolarHBondContact O-CB 3.48Å; S322-N326 PolarHBondContact O-N 2.9Å; S322-N326 VanDerWaalsContact O-N 3.11Å
323	L	87.3	Confident	85.1	Confident	28 Å²	28	39.5 Å²	39.5	15%	0.147	23%	0.225	C	C	.	.	H	α-helix	trans	-68.4	-45.1	-176.5	-68.4	171.7	0	0	0	112.6	N281 E284 I285 F288 Q319 I320 N326 Y327	N281-L323 PolarHBondContact ND2-O 3.27Å; E284-L323 HydrophobicContact CB-CD2 3.84Å; E284-L323 WeakPolarHBondContact OE2-CD2 3.27Å; I285-L323 HydrophobicContact CG1-CB 4.46Å; F288-L323 HydrophobicContact CB-CD1 3.51Å; F288-L323 HydrophobicContact CD1-CD1 4.22Å; F288-L323 HydrophobicContact CD2-CD1 3.75Å; F288-L323 HydrophobicContact CG-CD1 3.52Å; Q319-L323 WeakPolarHBondContact O-CB 3.4Å; Q319-L323 WeakPolarHBondContact O-CG 3.44Å; Q319-L323 PolarHBondContact O-N 2.88Å; I320-L323 PolarHBondContact O-N 2.78Å; L323-N326 PolarHBondContact O-N 2.81Å; L323-Y327 PolarHBondContact O-N 2.83Å; L323-Y327 VanDerWaalsContact O-N 3.13Å
324	Y	85.6	Confident	85	Confident	1 Å²	1	39.6 Å²	39.6	0%	0.004	23%	0.226	C	C	.	.	H	α-helix	trans	-72.1	-36.8	179.9	-82.7	-95.9	0	0	0	112.2	I320 Y327 C328 P369 L373	I320-Y324 HydrophobicContact CG2-CD2 3.66Å; I320-Y324 HydrophobicContact CG2-CE2 3.95Å; I320-Y324 WeakPolarHBondContact O-CB 3.37Å; I320-Y324 WeakPolarHBondContact O-CD2 3.36Å; I320-Y324 PolarHBondContact O-N 3.13Å; Y324-Y327 PolarHBondContact O-N 3.31Å; Y324-C328 WeakPolarHBondContact O-CB 3.33Å; Y324-C328 PolarHBondContact O-N 3.35Å; Y324-C328 PolarHBondContact O-SG 3.42Å; Y324-P369 HydrophobicContact CE1-CB 4.06Å; Y324-P369 WeakPolarHBondContact CE1-O 3.44Å; Y324-L373 HydrophobicContact CD1-CB 4.19Å; Y324-L373 HydrophobicContact CD1-CD1 3.96Å; Y324-L373 HydrophobicContact CD1-CD2 3.96Å; Y324-L373 HydrophobicContact CD1-CG 4.26Å; Y324-L373 HydrophobicContact CE1-CB 4.01Å; Y324-L373 HydrophobicContact CE1-CD1 4.13Å; Y324-L373 HydrophobicContact CE1-CG 4.47Å; Y324-L373 HydrophobicContact CG-CD1 4.15Å; Y324-L373 HydrophobicContact CG-CD2 4.44Å
325	L	86.4	Confident	85	Confident	49 Å²	49	39.1 Å²	39.1	26%	0.257	23%	0.225	S	C	.	.	H	α-helix	trans	-65.2	-38.7	174.6	-71.1	170	0	0	0	111.8	K321 C328 S329 L407 Q410 L414	K321-L325 VanDerWaalsContact O-CB 3.23Å; K321-L325 WeakPolarHBondContact O-CB 3.39Å; K321-L325 WeakPolarHBondContact O-CD1 3.38Å; K321-L325 WeakPolarHBondContact O-CG 3.32Å; K321-L325 PolarHBondContact O-N 3.35Å; L325-C328 PolarHBondContact O-N 2.95Å; L325-S329 PolarHBondContact O-N 3.33Å; L325-S329 VanDerWaalsContact O-N 3.16Å; L325-L407 HydrophobicContact CD1-CD1 4.49Å; L325-L407 HydrophobicContact CD2-CD1 4.26Å; L325-L407 HydrophobicContact CG-CD1 4.09Å; L325-Q410 HydrophobicContact CD2-CB 4.16Å; L325-L414 HydrophobicContact CB-CD2 4.26Å; L325-L414 HydrophobicContact CD2-CD2 3.87Å; L325-L414 WeakPolarHBondContact O-CD2 3.43Å
326	N	85.8	Confident	84.8	Confident	76 Å²	76	35.1 Å²	35.1	41%	0.406	21%	0.207	S	C	.	.	H	α-helix	trans	-58.5	-48.9	172.6	-169.1	22.4	0	0	0	111	S322 L323 C328 S329 S330	S322-N326 WeakPolarHBondContact O-CB 3.48Å; S322-N326 PolarHBondContact O-N 2.9Å; S322-N326 VanDerWaalsContact O-N 3.11Å; L323-N326 PolarHBondContact O-N 2.81Å; N326-C328 PolarHBondContact O-N 3.26Å; N326-S329 WeakPolarHBondContact O-CA 3.01Å; N326-S329 WeakPolarHBondContact O-CB 3.41Å; N326-S329 PolarHBondContact O-N 3.22Å; N326-S329 PolarHBondContact O-OG 2.86Å; N326-S330 PolarHBondContact O-N 3.45Å
327	Y	85.8	Confident	84.6	Confident	5 Å²	5	35 Å²	35	2%	0.02	21%	0.207	C	C	.	.	H	α-helix	trans	-63.1	-37.2	177.6	-167.2	-113.1	0	0	0	113.8	N281 L282 I285 L323 Y324 S329 S330 H331 L366 P369 F370	N281-Y327 WeakPolarHBondContact OD1-CA 3.5Å; N281-Y327 WeakPolarHBondContact OD1-CB 3.32Å; N281-Y327 WeakPolarHBondContact OD1-CD2 3.5Å; N281-Y327 PolarHBondContact OD1-N 3.49Å; L282-Y327 HydrophobicContact CB-CE2 4.49Å; L282-Y327 HydrophobicContact CD1-CE2 3.83Å; I285-Y327 HydrophobicContact CD1-CD1 4.16Å; I285-Y327 HydrophobicContact CD1-CD2 3.7Å; I285-Y327 HydrophobicContact CD1-CE2 4.39Å; I285-Y327 HydrophobicContact CD1-CG 3.57Å; L323-Y327 PolarHBondContact O-N 2.83Å; L323-Y327 VanDerWaalsContact O-N 3.13Å; Y324-Y327 PolarHBondContact O-N 3.31Å; Y327-S329 PolarHBondContact O-N 3.3Å; Y327-S330 PolarHBondContact O-N 2.78Å; Y327-S330 PolarHBondContact O-OG 3.38Å; Y327-H331 VanDerWaalsContact O-CB 3.25Å; Y327-H331 WeakPolarHBondContact O-CB 3.33Å; Y327-H331 PolarHBondContact O-N 3.14Å; Y327-L366 PolarHBondContact OH-O 2.87Å; Y327-P369 HydrophobicContact CD1-CB 4.09Å; Y327-P369 HydrophobicContact CD1-CG 4.41Å; Y327-P369 HydrophobicContact CE1-CB 3.75Å; Y327-P369 HydrophobicContact CE1-CG 3.66Å; Y327-F370 HydrophobicContact CD1-CE1 4.48Å; Y327-F370 AromaticContact CD1-CE2 3.76Å; Y327-F370 HydrophobicContact CD1-CE2 3.76Å; Y327-F370 AromaticContact CD1-CZ 3.65Å; Y327-F370 HydrophobicContact CD1-CZ 3.65Å; Y327-F370 HydrophobicContact CE1-CD2 4.17Å; Y327-F370 AromaticContact CE1-CE2 3.37Å; Y327-F370 HydrophobicContact CE1-CE2 3.37Å; Y327-F370 AromaticContact CE1-CZ 3.77Å; Y327-F370 HydrophobicContact CE1-CZ 3.77Å
328	C	83.1	Confident	84.4	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-61.3	-28.7	172.9	-67.2	0	0	0	0	112.4	Y324 L325 N326 P332 F370 C411 L414	Y324-C328 WeakPolarHBondContact O-CB 3.33Å; Y324-C328 PolarHBondContact O-N 3.35Å; Y324-C328 PolarHBondContact O-SG 3.42Å; L325-C328 PolarHBondContact O-N 2.95Å; N326-C328 PolarHBondContact O-N 3.26Å; C328-P332 VanDerWaalsContact O-CD 3.28Å; C328-P332 WeakPolarHBondContact O-CD 3.4Å; C328-F370 HydrophobicContact CB-CE1 4.31Å; C328-F370 VanDerWaalsContact SG-CE1 3.51Å; C328-C411 WeakPolarHBondContact SG-CB 3.2Å; C328-C411 PolarHBondContact SG-SG 3.36Å; C328-L414 HydrophobicContact CB-CD2 3.91Å; C328-L414 HydrophobicContact CB-CG 4.22Å
329	S	83.9	Confident	84.2	Confident	39 Å²	39	34.4 Å²	34.4	27%	0.273	20%	0.199	S	C	.	.	H	α-helix	trans	-80	-33.9	177.9	85.2	0	0	0	0	113.4	L325 N326 Y327	L325-S329 PolarHBondContact O-N 3.33Å; L325-S329 VanDerWaalsContact O-N 3.16Å; N326-S329 WeakPolarHBondContact O-CA 3.01Å; N326-S329 WeakPolarHBondContact O-CB 3.41Å; N326-S329 PolarHBondContact O-N 3.22Å; N326-S329 PolarHBondContact O-OG 2.86Å; Y327-S329 PolarHBondContact O-N 3.3Å
330	S	82.6	Confident	84	Confident	22 Å²	22	34.9 Å²	34.9	15%	0.154	21%	0.205	C	C	.	.	H	α-helix	trans	-88.5	-31.5	-178.7	61.8	0	0	0	0	114	N326 Y327 S333 A334	N326-S330 PolarHBondContact O-N 3.45Å; Y327-S330 PolarHBondContact O-N 2.78Å; Y327-S330 PolarHBondContact O-OG 3.38Å; S330-S333 WeakPolarHBondContact O-CB 3.25Å; S330-S333 PolarHBondContact O-N 3.5Å; S330-A334 PolarHBondContact O-N 2.81Å
331	H	84.3	Confident	83.7	Confident	5 Å²	5	37.5 Å²	37.5	2%	0.023	22%	0.217	C	C	.	.	H	α-helix	trans	-57.7	-42.3	-174.7	176	81	0	0	0	114.7	Y327 S333 A334 V335 L366 S367 F370 R415	Y327-H331 VanDerWaalsContact O-CB 3.25Å; Y327-H331 WeakPolarHBondContact O-CB 3.33Å; Y327-H331 PolarHBondContact O-N 3.14Å; H331-S333 VanDerWaalsContact C-N 3.27Å; H331-S333 PolarHBondContact O-N 2.87Å; H331-A334 PolarHBondContact O-N 3.48Å; H331-V335 WeakPolarHBondContact O-CG2 3.28Å; H331-V335 PolarHBondContact O-N 2.82Å; H331-L366 PolarHBondContact CE1-O 3.44Å; H331-L366 VanDerWaalsContact CE1-O 3.29Å; H331-S367 PolarHBondContact CE1-N 3.4Å; H331-S367 PolarHBondContact CE1-OG 2.94Å; H331-S367 PolarHBondContact NE2-OG 2.81Å; H331-F370 HydrophobicContact CB-CE2 3.89Å; H331-F370 HydrophobicContact CB-CZ 3.53Å; H331-F370 AromaticContact CD2-CE2 3.57Å; H331-F370 AromaticContact CD2-CZ 3.68Å; H331-F370 AromaticContact CG-CE2 3.41Å; H331-F370 VanDerWaalsContact CG-CE2 3.41Å; H331-F370 AromaticContact CG-CZ 3.52Å; H331-F370 AromaticContact ND1-CE2 3.6Å; H331-R415 PolarHBondContact NE2-NH2 3.09Å
332	P	84.5	Confident	83.4	Confident	8 Å²	8	36.7 Å²	36.7	5%	0.052	22%	0.219	C	C	.	.	H	α-helix	trans	-58.2	-39	174	-27.3	38.5	0	0	0	112.9	C328 V335 C336 R415 K418 L422	C328-P332 VanDerWaalsContact O-CD 3.28Å; C328-P332 WeakPolarHBondContact O-CD 3.4Å; P332-V335 PolarHBondContact O-N 3.48Å; P332-C336 PolarHBondContact O-N 2.81Å; P332-R415 HydrophobicContact CG-CG 4.22Å; P332-K418 HydrophobicContact CB-CB 4.45Å; P332-K418 HydrophobicContact CG-CB 4.02Å; P332-L422 HydrophobicContact CB-CD1 3.51Å; P332-L422 WeakPolarHBondContact O-CD1 3.27Å
333	S	82.3	Confident	83	Confident	34 Å²	34	38 Å²	38	24%	0.238	22%	0.22	C	C	.	.	H	α-helix	trans	-68.9	-41.3	177.5	-52.7	0	0	0	0	111.5	S330 H331 V335 C336 I337	S330-S333 WeakPolarHBondContact O-CB 3.25Å; S330-S333 PolarHBondContact O-N 3.5Å; H331-S333 VanDerWaalsContact C-N 3.27Å; H331-S333 PolarHBondContact O-N 2.87Å; S333-V335 VanDerWaalsContact C-N 3.34Å; S333-V335 PolarHBondContact O-N 3.28Å; S333-C336 WeakPolarHBondContact O-CB 3.48Å; S333-C336 PolarHBondContact O-N 2.81Å; S333-I337 WeakPolarHBondContact O-CG1 3.4Å; S333-I337 PolarHBondContact O-N 3.15Å
334	A	83.3	Confident	82.4	Confident	4 Å²	4	41.5 Å²	41.5	3%	0.033	24%	0.236	C	C	.	.	H	α-helix	trans	-59.5	-43.5	172.9	0	0	0	0	0	111.6	L278 S330 H331 C336 I337 L338	L278-A334 HydrophobicContact CD1-CB 4.11Å; S330-A334 PolarHBondContact O-N 2.81Å; H331-A334 PolarHBondContact O-N 3.48Å; A334-C336 VanDerWaalsContact C-N 3.34Å; A334-C336 PolarHBondContact O-N 3.1Å; A334-I337 PolarHBondContact O-N 2.85Å; A334-L338 VanDerWaalsContact O-CG 3.25Å; A334-L338 WeakPolarHBondContact O-CG 3.4Å; A334-L338 PolarHBondContact O-N 2.94Å
335	V	82.6	Confident	81.9	Confident	40 Å²	40	41.9 Å²	41.9	24%	0.242	24%	0.238	C	C	.	.	H	α-helix	trans	-65.4	-33.6	176.7	173.3	0	0	0	0	112.5	H331 P332 S333 T339	H331-V335 WeakPolarHBondContact O-CG2 3.28Å; H331-V335 PolarHBondContact O-N 2.82Å; P332-V335 PolarHBondContact O-N 3.48Å; S333-V335 VanDerWaalsContact C-N 3.34Å; S333-V335 PolarHBondContact O-N 3.28Å; V335-T339 PolarHBondContact O-N 3.47Å; V335-T339 VanDerWaalsContact O-N 3.11Å; V335-T339 PolarHBondContact O-OG1 2.9Å
336	C	81.4	Confident	81.3	Confident	46 Å²	46	40 Å²	40	31%	0.311	23%	0.23	S	C	.	.	H	α-helix	trans	-60.8	-54.5	170.6	-163.7	0	0	0	0	110.7	P332 S333 A334 L338 T339 D340	P332-C336 PolarHBondContact O-N 2.81Å; S333-C336 WeakPolarHBondContact O-CB 3.48Å; S333-C336 PolarHBondContact O-N 2.81Å; A334-C336 VanDerWaalsContact C-N 3.34Å; A334-C336 PolarHBondContact O-N 3.1Å; C336-L338 VanDerWaalsContact C-N 3.29Å; C336-L338 PolarHBondContact O-N 3.06Å; C336-T339 WeakPolarHBondContact O-CA 3.39Å; C336-T339 WeakPolarHBondContact O-CB 3.49Å; C336-T339 PolarHBondContact O-N 2.83Å; C336-D340 VanDerWaalsContact O-CG 3.29Å; C336-D340 PolarHBondContact O-N 3.37Å; C336-D340 VanDerWaalsContact O-OD2 3.13Å; C336-D340 PolarHBondContact SG-OD2 3.41Å
337	I	81.6	Confident	80.8	Confident	22 Å²	22	42.1 Å²	42.1	11%	0.113	24%	0.235	C	C	.	.	H	α-helix	trans	-57.7	-40	179.1	-65.1	164	0	0	0	111.7	D274 T277 S333 A334 T339 D340 H341	D274-I337 HydrophobicContact CB-CD1 4.25Å; D274-I337 HydrophobicContact CB-CG2 4.19Å; T277-I337 HydrophobicContact CG2-CD1 3.68Å; S333-I337 WeakPolarHBondContact O-CG1 3.4Å; S333-I337 PolarHBondContact O-N 3.15Å; A334-I337 PolarHBondContact O-N 2.85Å; I337-T339 VanDerWaalsContact C-N 3.27Å; I337-T339 PolarHBondContact O-N 3.3Å; I337-D340 PolarHBondContact O-N 2.93Å; I337-H341 PolarHBondContact O-N 2.87Å
338	L	79.7	Confident	80.4	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.01	24%	0.238	C	C	.	.	H	α-helix	trans	-62.6	-31.7	173.9	-72.2	175.4	0	0	0	113.2	L278 A334 C336 S342 L345 I359 L362 L366	L278-L338 HydrophobicContact CD1-CD1 4.11Å; L278-L338 HydrophobicContact CD1-CD2 3.64Å; L278-L338 HydrophobicContact CD1-CG 3.77Å; L278-L338 HydrophobicContact CD2-CD2 4.17Å; A334-L338 VanDerWaalsContact O-CG 3.25Å; A334-L338 WeakPolarHBondContact O-CG 3.4Å; A334-L338 PolarHBondContact O-N 2.94Å; C336-L338 VanDerWaalsContact C-N 3.29Å; C336-L338 PolarHBondContact O-N 3.06Å; L338-S342 WeakPolarHBondContact O-CA 3.33Å; L338-S342 VanDerWaalsContact O-CB 3.29Å; L338-S342 WeakPolarHBondContact O-CB 3.4Å; L338-S342 PolarHBondContact O-N 3.35Å; L338-L345 HydrophobicContact CD2-CD2 3.31Å; L338-I359 HydrophobicContact CB-CD1 4.28Å; L338-I359 HydrophobicContact CD2-CD1 3.96Å; L338-L362 HydrophobicContact CD2-CD2 3.68Å; L338-L362 HydrophobicContact CD2-CG 4.19Å; L338-L366 HydrophobicContact CD1-CD1 3.77Å
339	T	82.2	Confident	80	Confident	91 Å²	91	42.9 Å²	42.9	56%	0.558	24%	0.239	S	C	*	.	H	α-helix	trans	-78.1	-48.5	178.1	-53	0	0	0	0	109.8	V335 C336 I337 H341 S342	V335-T339 PolarHBondContact O-N 3.47Å; V335-T339 VanDerWaalsContact O-N 3.11Å; V335-T339 PolarHBondContact O-OG1 2.9Å; C336-T339 WeakPolarHBondContact O-CA 3.39Å; C336-T339 WeakPolarHBondContact O-CB 3.49Å; C336-T339 PolarHBondContact O-N 2.83Å; I337-T339 VanDerWaalsContact C-N 3.27Å; I337-T339 PolarHBondContact O-N 3.3Å; T339-H341 VanDerWaalsContact C-N 3.35Å; T339-H341 PolarHBondContact O-N 3.42Å; T339-S342 VanDerWaalsContact O-CB 3.28Å; T339-S342 WeakPolarHBondContact O-CB 3.25Å; T339-S342 PolarHBondContact O-N 3.45Å; T339-S342 PolarHBondContact O-OG 3.27Å
340	D	81.8	Confident	79.7	Confident	113 Å²	113	45.3 Å²	45.3	60%	0.604	25%	0.246	S	C	*	.	H	α-helix	trans	-61.5	-38	-178.9	-62.6	-37.8	0	0	0	112.5	C336 I337	C336-D340 VanDerWaalsContact O-CG 3.29Å; C336-D340 PolarHBondContact O-N 3.37Å; C336-D340 VanDerWaalsContact O-OD2 3.13Å; C336-D340 PolarHBondContact SG-OD2 3.41Å; I337-D340 PolarHBondContact O-N 2.93Å
341	H	79.8	Confident	79.3	Confident	55 Å²	55	48.3 Å²	48.3	26%	0.255	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	14.3	178.5	-67.3	-89.5	0	0	0	114.3	L270 I337 T339 D343 E344 L345	L270-H341 HydrophobicContact CD2-CB 3.98Å; I337-H341 PolarHBondContact O-N 2.87Å; T339-H341 VanDerWaalsContact C-N 3.35Å; T339-H341 PolarHBondContact O-N 3.42Å; H341-D343 PolarHBondContact O-N 2.8Å; H341-E344 IonicContact ND1-OE2 2.72Å; H341-E344 PolarHBondContact O-N 3.08Å; H341-E344 VanDerWaalsContact O-N 3.11Å; H341-L345 VanDerWaalsContact O-CB 3.28Å; H341-L345 WeakPolarHBondContact O-CB 3.28Å; H341-L345 PolarHBondContact O-N 3.01Å
342	S	79.8	Confident	78.6	Confident	46 Å²	46	52.5 Å²	52.5	32%	0.322	29%	0.286	S	S	.	.	H	α-helix	trans	-47.9	-40.7	-174.1	49.2	0	0	0	0	113.9	L338 T339 G346	L338-S342 WeakPolarHBondContact O-CA 3.33Å; L338-S342 VanDerWaalsContact O-CB 3.29Å; L338-S342 WeakPolarHBondContact O-CB 3.4Å; L338-S342 PolarHBondContact O-N 3.35Å; T339-S342 VanDerWaalsContact O-CB 3.28Å; T339-S342 WeakPolarHBondContact O-CB 3.25Å; T339-S342 PolarHBondContact O-N 3.45Å; T339-S342 PolarHBondContact O-OG 3.27Å; S342-G346 PolarHBondContact O-N 2.93Å
343	D	78.9	Confident	77.6	Confident	113 Å²	113	55.4 Å²	55.4	60%	0.604	32%	0.318	S	S	*	.	H	α-helix	trans	-73.8	-33.9	-174.8	-129.3	53.5	0	0	0	113.9	H341 K347	H341-D343 PolarHBondContact O-N 2.8Å; D343-K347 VanDerWaalsContact O-CD 3.32Å; D343-K347 WeakPolarHBondContact O-CD 3.27Å; D343-K347 WeakPolarHBondContact O-CE 3.48Å; D343-K347 VanDerWaalsContact O-CG 3.3Å; D343-K347 WeakPolarHBondContact O-CG 3.06Å; D343-K347 PolarHBondContact O-NZ 3.31Å; D343-K347 IonicContact OD2-NZ 3.99Å; D343-K347 PolarHBondContact OD2-NZ 3.03Å
344	E	76.1	Confident	76.6	Confident	101 Å²	101	54.9 Å²	54.9	47%	0.472	32%	0.316	S	S	.	.	H	α-helix	trans	-84.4	-37.9	177.8	-59.4	-168.7	118.7	0	0	111.1	H341 F348	H341-E344 IonicContact ND1-OE2 2.72Å; H341-E344 PolarHBondContact O-N 3.08Å; H341-E344 VanDerWaalsContact O-N 3.11Å; E344-F348 PolarHBondContact O-N 3.3Å; E344-F348 VanDerWaalsContact O-N 3.13Å
345	L	74.6	Confident	75.4	Confident	9 Å²	9	57.8 Å²	57.8	5%	0.047	34%	0.336	C	S	.	.	H	α-helix	trans	-74	-37	-179.3	-178.4	51.7	0	0	0	112.2	L264 L278 L338 H341 F348 I349 I359 L362	L264-L345 HydrophobicContact CD1-CD1 3.49Å; L264-L345 VanDerWaalsContact CD1-CD1 3.49Å; L264-L345 HydrophobicContact CD1-CD2 4.43Å; L278-L345 HydrophobicContact CD2-CD2 4.47Å; L338-L345 HydrophobicContact CD2-CD2 3.31Å; H341-L345 VanDerWaalsContact O-CB 3.28Å; H341-L345 WeakPolarHBondContact O-CB 3.28Å; H341-L345 PolarHBondContact O-N 3.01Å; L345-F348 HydrophobicContact CD1-CD1 4.39Å; L345-F348 PolarHBondContact O-N 3.38Å; L345-I349 HydrophobicContact CD1-CD1 3.66Å; L345-I349 HydrophobicContact CD1-CG1 3.86Å; L345-I349 HydrophobicContact CG-CD1 3.69Å; L345-I349 HydrophobicContact CG-CG1 4.36Å; L345-I349 VanDerWaalsContact O-CG1 3.29Å; L345-I349 WeakPolarHBondContact O-CG1 3.19Å; L345-I349 PolarHBondContact O-N 2.92Å; L345-I359 HydrophobicContact CB-CD1 4.24Å; L345-I359 HydrophobicContact CD2-CD1 3.75Å; L345-I359 HydrophobicContact CG-CD1 3.92Å; L345-L362 HydrophobicContact CD2-CD2 4.12Å
346	G	73.4	Confident	74	Confident	8 Å²	8	61.6 Å²	61.6	8%	0.082	36%	0.362	C	S	.	.	H	α-helix	trans	-55.6	-52.4	171.5	0	0	0	0	0	111.6	S342 F348 I349 E350	S342-G346 PolarHBondContact O-N 2.93Å; G346-F348 VanDerWaalsContact C-N 3.28Å; G346-F348 PolarHBondContact O-N 3.2Å; G346-I349 PolarHBondContact O-N 2.68Å; G346-E350 WeakPolarHBondContact O-CB 3.26Å; G346-E350 VanDerWaalsContact O-CG 3.31Å; G346-E350 WeakPolarHBondContact O-CG 3.33Å; G346-E350 PolarHBondContact O-N 3.4Å
347	K	76.3	Confident	73.2	Confident	121 Å²	121	61.8 Å²	61.8	53%	0.526	36%	0.363	S	S	.	.	H	α-helix	trans	-60.2	-35	177.2	-62.3	173.2	-170.8	97.7	0	112.3	D343 S351	D343-K347 VanDerWaalsContact O-CD 3.32Å; D343-K347 WeakPolarHBondContact O-CD 3.27Å; D343-K347 WeakPolarHBondContact O-CE 3.48Å; D343-K347 VanDerWaalsContact O-CG 3.3Å; D343-K347 WeakPolarHBondContact O-CG 3.06Å; D343-K347 PolarHBondContact O-NZ 3.31Å; D343-K347 IonicContact OD2-NZ 3.99Å; D343-K347 PolarHBondContact OD2-NZ 3.03Å; K347-S351 PolarHBondContact O-N 3.34Å; K347-S351 VanDerWaalsContact O-N 3.13Å
348	F	76.3	Confident	72.5	Confident	20 Å²	20	60.8 Å²	60.8	9%	0.088	36%	0.359	C	S	.	.	H	α-helix	trans	-68.9	-48.2	174.2	-179.2	-102.3	0	0	0	112.2	P263 L264 K269 E344 L345 G346 E350 S351 Q352	P263-F348 HydrophobicContact CB-CE1 4.22Å; P263-F348 HydrophobicContact CB-CZ 3.88Å; P263-F348 WeakPolarHBondContact O-CZ 3.32Å; L264-F348 HydrophobicContact CB-CE1 4.04Å; K269-F348 HydrophobicContact CD-CB 4.49Å; K269-F348 HydrophobicContact CD-CD2 4.08Å; E344-F348 PolarHBondContact O-N 3.3Å; E344-F348 VanDerWaalsContact O-N 3.13Å; L345-F348 HydrophobicContact CD1-CD1 4.39Å; L345-F348 PolarHBondContact O-N 3.38Å; G346-F348 VanDerWaalsContact C-N 3.28Å; G346-F348 PolarHBondContact O-N 3.2Å; F348-E350 VanDerWaalsContact C-N 3.33Å; F348-E350 PolarHBondContact O-N 2.92Å; F348-S351 WeakPolarHBondContact O-CA 3.35Å; F348-S351 WeakPolarHBondContact O-CB 3.46Å; F348-S351 PolarHBondContact O-N 3.31Å; F348-S351 PolarHBondContact O-OG 3.13Å; F348-Q352 HydrophobicContact CD1-CG 4.45Å; F348-Q352 HydrophobicContact CE1-CG 4.04Å; F348-Q352 HydrophobicContact CZ-CG 4.12Å; F348-Q352 PolarHBondContact O-N 3.13Å; F348-Q352 VanDerWaalsContact O-N 3.09Å
349	I	75.3	Confident	72.2	Confident	2 Å²	2	62.8 Å²	62.8	1%	0.01	37%	0.369	C	S	.	.	H	α-helix	trans	-66.5	-35.2	-178.9	-65.5	164.4	0	0	0	111.3	Y260 L345 G346 Q352 G353 A354 G358 L362	Y260-I349 HydrophobicContact CD1-CG2 4.06Å; Y260-I349 HydrophobicContact CE1-CG2 3.94Å; L345-I349 HydrophobicContact CD1-CD1 3.66Å; L345-I349 HydrophobicContact CD1-CG1 3.86Å; L345-I349 HydrophobicContact CG-CD1 3.69Å; L345-I349 HydrophobicContact CG-CG1 4.36Å; L345-I349 VanDerWaalsContact O-CG1 3.29Å; L345-I349 WeakPolarHBondContact O-CG1 3.19Å; L345-I349 PolarHBondContact O-N 2.92Å; G346-I349 PolarHBondContact O-N 2.68Å; I349-Q352 PolarHBondContact O-N 3.12Å; I349-G353 PolarHBondContact O-N 3.31Å; I349-A354 HydrophobicContact CG2-CB 3.45Å; I349-A354 VanDerWaalsContact CG2-CB 3.45Å; I349-A354 WeakPolarHBondContact O-CB 3.36Å; I349-A354 PolarHBondContact O-N 3.06Å; I349-G358 VanDerWaalsContact CG2-CA 3.47Å; I349-L362 HydrophobicContact CD1-CB 3.99Å; I349-L362 HydrophobicContact CD1-CD2 3.7Å; I349-L362 HydrophobicContact CD1-CG 4.49Å
350	E	77.5	Confident	71.7	Confident	89 Å²	89	62.5 Å²	62.5	42%	0.416	36%	0.363	S	S	.	.	H	α-helix	trans	-61.9	-41.5	169.1	-73.6	169.2	-178.3	0	0	111.8	G346 F348 Q352 G353	G346-E350 WeakPolarHBondContact O-CB 3.26Å; G346-E350 VanDerWaalsContact O-CG 3.31Å; G346-E350 WeakPolarHBondContact O-CG 3.33Å; G346-E350 PolarHBondContact O-N 3.4Å; F348-E350 VanDerWaalsContact C-N 3.33Å; F348-E350 PolarHBondContact O-N 2.92Å; E350-Q352 PolarHBondContact O-N 3.43Å; E350-G353 PolarHBondContact O-N 3.49Å
351	S	73.2	Confident	71.5	Confident	85 Å²	85	59.5 Å²	59.5	59%	0.594	35%	0.349	S	S	*	.	H	α-helix	trans	-66.5	-21.2	175.1	79	0	0	0	0	114	K347 F348 G353	K347-S351 PolarHBondContact O-N 3.34Å; K347-S351 VanDerWaalsContact O-N 3.13Å; F348-S351 WeakPolarHBondContact O-CA 3.35Å; F348-S351 WeakPolarHBondContact O-CB 3.46Å; F348-S351 PolarHBondContact O-N 3.31Å; F348-S351 PolarHBondContact O-OG 3.13Å; S351-G353 VanDerWaalsContact C-N 3.31Å
352	Q	69.4	Low	71.3	Confident	93 Å²	93	56.9 Å²	56.9	44%	0.435	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	7.2	171.3	-60.4	-64.1	-16.2	0	0	113.2	F348 I349 E350	F348-Q352 HydrophobicContact CD1-CG 4.45Å; F348-Q352 HydrophobicContact CE1-CG 4.04Å; F348-Q352 HydrophobicContact CZ-CG 4.12Å; F348-Q352 PolarHBondContact O-N 3.13Å; F348-Q352 VanDerWaalsContact O-N 3.09Å; I349-Q352 PolarHBondContact O-N 3.12Å; E350-Q352 PolarHBondContact O-N 3.43Å
353	G	63.7	Low	71.3	Confident	70 Å²	70	56.6 Å²	56.6	72%	0.722	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.5	17.4	171.3	0	0	0	0	0	116	I349 E350 S351	I349-G353 PolarHBondContact O-N 3.31Å; E350-G353 PolarHBondContact O-N 3.49Å; S351-G353 VanDerWaalsContact C-N 3.31Å
354	A	62	Low	71.4	Confident	23 Å²	23	54.4 Å²	54.4	19%	0.19	32%	0.324	C	S	.	.			trans	-71.9	173.7	168.6	0	0	0	0	0	112.3	Y260 I349	Y260-A354 HydrophobicContact CE1-CB 4.29Å; I349-A354 HydrophobicContact CG2-CB 3.45Å; I349-A354 VanDerWaalsContact CG2-CB 3.45Å; I349-A354 WeakPolarHBondContact O-CB 3.36Å; I349-A354 PolarHBondContact O-N 3.06Å
355	S	58.6	Low	71.6	Confident	64 Å²	64	50.1 Å²	50.1	45%	0.448	31%	0.305	S	S	.	.			trans	-67.4	163.9	169.7	78.2	0	0	0	0	111.2	S357 G358	S355-S357 PolarHBondContact O-N 2.74Å; S355-G358 PolarHBondContact O-N 3.11Å; S355-G358 VanDerWaalsContact O-N 3.12Å
356	P	52.6	Low	71.9	Confident	121 Å²	121	49.8 Å²	49.8	79%	0.786	30%	0.304	S	S	*	.	S	Bend	trans	-70.9	34	174.6	32	-38	0	0	0	113.8
357	S	65.2	Low	72.4	Confident	50 Å²	50	50.5 Å²	50.5	35%	0.35	31%	0.307	S	S	.	.			trans	-140.7	49.1	162.9	-152.8	0	0	0	0	108.3	S355 I359 L360 T361	S355-S357 PolarHBondContact O-N 2.74Å; S357-I359 VanDerWaalsContact C-N 3.28Å; S357-I359 PolarHBondContact O-N 3.49Å; S357-L360 PolarHBondContact O-N 2.9Å; S357-L360 VanDerWaalsContact OG-CB 3.31Å; S357-L360 WeakPolarHBondContact OG-CB 3.43Å; S357-T361 PolarHBondContact O-N 3.36Å; S357-T361 PolarHBondContact O-OG1 2.96Å
358	G	66.7	Low	72.6	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.01	30%	0.295	C	S	.	.	H	α-helix	trans	-57.6	-40.1	-177	0	0	0	0	0	112.7	I349 S355 T361 L362	I349-G358 VanDerWaalsContact CG2-CA 3.47Å; S355-G358 PolarHBondContact O-N 3.11Å; S355-G358 VanDerWaalsContact O-N 3.12Å; G358-T361 WeakPolarHBondContact O-CB 3.48Å; G358-T361 PolarHBondContact O-N 2.72Å; G358-L362 PolarHBondContact O-N 2.97Å
359	I	73.1	Confident	72.9	Confident	43 Å²	43	46.7 Å²	46.7	22%	0.221	29%	0.291	C	S	.	.	H	α-helix	trans	-64.5	-43.7	177.3	-164.3	67.3	0	0	0	112.2	L338 L345 S357 T361 L362 T363	L338-I359 HydrophobicContact CB-CD1 4.28Å; L338-I359 HydrophobicContact CD2-CD1 3.96Å; L345-I359 HydrophobicContact CB-CD1 4.24Å; L345-I359 HydrophobicContact CD2-CD1 3.75Å; L345-I359 HydrophobicContact CG-CD1 3.92Å; S357-I359 VanDerWaalsContact C-N 3.28Å; S357-I359 PolarHBondContact O-N 3.49Å; I359-T361 VanDerWaalsContact C-N 3.31Å; I359-T361 PolarHBondContact O-N 3.4Å; I359-L362 PolarHBondContact O-N 2.95Å; I359-T363 PolarHBondContact O-N 3.11Å; I359-T363 PolarHBondContact O-OG1 3.03Å; I359-T363 VanDerWaalsContact O-OG1 3.09Å
360	L	72.4	Confident	73.1	Confident	85 Å²	85	47.3 Å²	47.3	45%	0.445	29%	0.293	S	S	.	.	H	α-helix	trans	-65.2	-36.8	175.9	-179.2	61.6	0	0	0	111.3	S357 L362 T364	S357-L360 PolarHBondContact O-N 2.9Å; S357-L360 VanDerWaalsContact OG-CB 3.31Å; S357-L360 WeakPolarHBondContact OG-CB 3.43Å; L360-L362 VanDerWaalsContact C-N 3.35Å; L360-T364 WeakPolarHBondContact O-CB 3.33Å; L360-T364 PolarHBondContact O-N 2.9Å; L360-T364 PolarHBondContact O-OG1 2.96Å
361	T	76	Confident	73.3	Confident	50 Å²	50	46.3 Å²	46.3	31%	0.307	29%	0.29	S	S	.	.	H	α-helix	trans	-61.2	-44.1	175	-54.2	0	0	0	0	110.7	S357 G358 I359 S365	S357-T361 PolarHBondContact O-N 3.36Å; S357-T361 PolarHBondContact O-OG1 2.96Å; G358-T361 WeakPolarHBondContact O-CB 3.48Å; G358-T361 PolarHBondContact O-N 2.72Å; I359-T361 VanDerWaalsContact C-N 3.31Å; I359-T361 PolarHBondContact O-N 3.4Å; T361-S365 VanDerWaalsContact O-CB 3.27Å; T361-S365 WeakPolarHBondContact O-CB 3.23Å; T361-S365 PolarHBondContact O-N 2.91Å; T361-S365 PolarHBondContact O-OG 3.42Å
362	L	76.8	Confident	73.8	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-67.9	-50.5	176.1	-173.5	55.8	0	0	0	112.3	V256 Y260 L261 L338 L345 I349 G358 I359 L360 T364 S365 L366	V256-L362 HydrophobicContact CG1-CD1 4.17Å; Y260-L362 HydrophobicContact CD2-CD1 4.49Å; L261-L362 HydrophobicContact CD2-CD1 4.43Å; L338-L362 HydrophobicContact CD2-CD2 3.68Å; L338-L362 HydrophobicContact CD2-CG 4.19Å; L345-L362 HydrophobicContact CD2-CD2 4.12Å; I349-L362 HydrophobicContact CD1-CB 3.99Å; I349-L362 HydrophobicContact CD1-CD2 3.7Å; I349-L362 HydrophobicContact CD1-CG 4.49Å; G358-L362 PolarHBondContact O-N 2.97Å; I359-L362 PolarHBondContact O-N 2.95Å; L360-L362 VanDerWaalsContact C-N 3.35Å; L362-T364 VanDerWaalsContact C-N 3.31Å; L362-T364 PolarHBondContact O-N 3.08Å; L362-S365 WeakPolarHBondContact CA-OG 3.38Å; L362-S365 PolarHBondContact O-N 3.26Å; L362-S365 VanDerWaalsContact O-N 3.12Å; L362-S365 PolarHBondContact O-OG 2.93Å; L362-L366 HydrophobicContact CD1-CD1 3.86Å; L362-L366 HydrophobicContact CD1-CG 4.09Å; L362-L366 HydrophobicContact CG-CD1 3.87Å; L362-L366 WeakPolarHBondContact O-CG 3.48Å; L362-L366 PolarHBondContact O-N 3.4Å
363	T	79.5	Confident	74.5	Confident	39 Å²	39	38.9 Å²	38.9	24%	0.239	25%	0.245	C	C	.	.	H	α-helix	trans	-59.5	-39.3	178	-56.7	0	0	0	0	112.7	I359 S367	I359-T363 PolarHBondContact O-N 3.11Å; I359-T363 PolarHBondContact O-OG1 3.03Å; I359-T363 VanDerWaalsContact O-OG1 3.09Å; T363-S367 WeakPolarHBondContact O-CB 3.17Å; T363-S367 PolarHBondContact O-N 2.92Å; T363-S367 VanDerWaalsContact O-N 3.15Å; T363-S367 PolarHBondContact O-OG 2.96Å
364	T	81.6	Confident	75.5	Confident	68 Å²	68	38.6 Å²	38.6	42%	0.417	23%	0.227	S	C	.	.	H	α-helix	trans	-66.4	-45.1	174.8	-57	0	0	0	0	110.8	L360 L362 S367 K368	L360-T364 WeakPolarHBondContact O-CB 3.33Å; L360-T364 PolarHBondContact O-N 2.9Å; L360-T364 PolarHBondContact O-OG1 2.96Å; L362-T364 VanDerWaalsContact C-N 3.31Å; L362-T364 PolarHBondContact O-N 3.08Å; T364-S367 CarbonylContact O-C 3.56Å; T364-S367 WeakPolarHBondContact O-CA 3.44Å; T364-S367 WeakPolarHBondContact O-CB 3.3Å; T364-S367 PolarHBondContact O-N 3.26Å; T364-K368 PolarHBondContact O-N 3.33Å
365	S	79.4	Confident	76.7	Confident	11 Å²	11	41.2 Å²	41.2	8%	0.077	23%	0.234	C	C	.	.	H	α-helix	trans	-69.6	-36.6	-177.6	67	0	0	0	0	113.5	V256 T361 L362 S367 K368	V256-S365 VanDerWaalsContact CG2-CB 3.47Å; V256-S365 WeakPolarHBondContact CG2-OG 3.36Å; T361-S365 VanDerWaalsContact O-CB 3.27Å; T361-S365 WeakPolarHBondContact O-CB 3.23Å; T361-S365 PolarHBondContact O-N 2.91Å; T361-S365 PolarHBondContact O-OG 3.42Å; L362-S365 WeakPolarHBondContact CA-OG 3.38Å; L362-S365 PolarHBondContact O-N 3.26Å; L362-S365 VanDerWaalsContact O-N 3.12Å; L362-S365 PolarHBondContact O-OG 2.93Å; S365-S367 PolarHBondContact O-N 3.13Å; S365-K368 VanDerWaalsContact O-CB 3.31Å; S365-K368 WeakPolarHBondContact O-CB 3.31Å; S365-K368 PolarHBondContact O-N 3.49Å; S365-K368 VanDerWaalsContact O-N 3.09Å
366	L	81.6	Confident	78	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.01	21%	0.213	C	C	.	.	H	α-helix	trans	-67.8	-20.6	169	-69.1	166.2	0	0	0	112.7	L278 L282 Y327 H331 L338 L362 P369	L278-L366 HydrophobicContact CD1-CD1 3.75Å; L282-L366 HydrophobicContact CD2-CD2 4Å; Y327-L366 PolarHBondContact OH-O 2.87Å; H331-L366 PolarHBondContact CE1-O 3.44Å; H331-L366 VanDerWaalsContact CE1-O 3.29Å; L338-L366 HydrophobicContact CD1-CD1 3.77Å; L362-L366 HydrophobicContact CD1-CD1 3.86Å; L362-L366 HydrophobicContact CD1-CG 4.09Å; L362-L366 HydrophobicContact CG-CD1 3.87Å; L362-L366 WeakPolarHBondContact O-CG 3.48Å; L362-L366 PolarHBondContact O-N 3.4Å; L366-P369 WeakPolarHBondContact O-CD 3.39Å
367	S	83.1	Confident	79.6	Confident	23 Å²	23	33 Å²	33	16%	0.161	18%	0.179	C	C	.	.	H	α-helix	trans	-81.6	-12.7	171.3	-59.2	0	0	0	0	113.6	H331 T363 T364 S365 F370 I371	H331-S367 PolarHBondContact CE1-N 3.4Å; H331-S367 PolarHBondContact CE1-OG 2.94Å; H331-S367 PolarHBondContact NE2-OG 2.81Å; T363-S367 WeakPolarHBondContact O-CB 3.17Å; T363-S367 PolarHBondContact O-N 2.92Å; T363-S367 VanDerWaalsContact O-N 3.15Å; T363-S367 PolarHBondContact O-OG 2.96Å; T364-S367 CarbonylContact O-C 3.56Å; T364-S367 WeakPolarHBondContact O-CA 3.44Å; T364-S367 WeakPolarHBondContact O-CB 3.3Å; T364-S367 PolarHBondContact O-N 3.26Å; S365-S367 PolarHBondContact O-N 3.13Å; S367-F370 PolarHBondContact O-N 3.05Å; S367-I371 PolarHBondContact O-N 2.99Å
368	K	81.6	Confident	80.6	Confident	61 Å²	61	34.5 Å²	34.5	27%	0.265	19%	0.186	S	C	.	.	H	α-helix	trans	-64	-36.3	-177.7	-72.2	-177.3	172.8	-170.2	0	115.7	F249 E252 T364 S365 F370 I371 R372	F249-K368 HydrophobicContact CE2-CB 4.3Å; E252-K368 IonicContact OE1-NZ 3.02Å; E252-K368 PolarHBondContact OE1-NZ 3.06Å; E252-K368 VanDerWaalsContact OE2-CD 3.28Å; E252-K368 WeakPolarHBondContact OE2-CD 3.46Å; E252-K368 WeakPolarHBondContact OE2-CE 3.43Å; E252-K368 IonicContact OE2-NZ 3.77Å; E252-K368 PolarHBondContact OE2-NZ 3.34Å; T364-K368 PolarHBondContact O-N 3.33Å; S365-K368 VanDerWaalsContact O-CB 3.31Å; S365-K368 WeakPolarHBondContact O-CB 3.31Å; S365-K368 PolarHBondContact O-N 3.49Å; S365-K368 VanDerWaalsContact O-N 3.09Å; K368-F370 VanDerWaalsContact C-N 3.26Å; K368-F370 PolarHBondContact O-N 3.47Å; K368-I371 CarbonylContact O-C 3.57Å; K368-I371 PolarHBondContact O-N 2.98Å; K368-I371 VanDerWaalsContact O-N 3.1Å; K368-R372 PolarHBondContact O-N 3.12Å
369	P	82.7	Confident	81.4	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-56	-39.7	175.5	-28.4	36.6	0	0	0	113.3	F249 L253 L282 Y324 Y327 L366 R372 L373	F249-P369 HydrophobicContact CZ-CB 4.32Å; F249-P369 HydrophobicContact CZ-CG 4.34Å; L253-P369 HydrophobicContact CD2-CG 4.14Å; L282-P369 HydrophobicContact CD1-CG 4.16Å; Y324-P369 HydrophobicContact CE1-CB 4.06Å; Y324-P369 WeakPolarHBondContact CE1-O 3.44Å; Y327-P369 HydrophobicContact CD1-CB 4.09Å; Y327-P369 HydrophobicContact CD1-CG 4.41Å; Y327-P369 HydrophobicContact CE1-CB 3.75Å; Y327-P369 HydrophobicContact CE1-CG 3.66Å; L366-P369 WeakPolarHBondContact O-CD 3.39Å; P369-R372 PolarHBondContact O-N 3.34Å; P369-L373 WeakPolarHBondContact O-CB 3.47Å; P369-L373 PolarHBondContact O-N 3.31Å
370	F	79.3	Confident	81.9	Confident	15 Å²	15	34 Å²	34	7%	0.066	18%	0.184	C	C	.	.	H	α-helix	trans	-64	-47.9	174	-54.3	-88.8	0	0	0	111.2	Y327 C328 H331 S367 K368 R372 L373 D374	Y327-F370 HydrophobicContact CD1-CE1 4.48Å; Y327-F370 AromaticContact CD1-CE2 3.76Å; Y327-F370 HydrophobicContact CD1-CE2 3.76Å; Y327-F370 AromaticContact CD1-CZ 3.65Å; Y327-F370 HydrophobicContact CD1-CZ 3.65Å; Y327-F370 HydrophobicContact CE1-CD2 4.17Å; Y327-F370 AromaticContact CE1-CE2 3.37Å; Y327-F370 HydrophobicContact CE1-CE2 3.37Å; Y327-F370 AromaticContact CE1-CZ 3.77Å; Y327-F370 HydrophobicContact CE1-CZ 3.77Å; C328-F370 HydrophobicContact CB-CE1 4.31Å; C328-F370 VanDerWaalsContact SG-CE1 3.51Å; H331-F370 HydrophobicContact CB-CE2 3.89Å; H331-F370 HydrophobicContact CB-CZ 3.53Å; H331-F370 AromaticContact CD2-CE2 3.57Å; H331-F370 AromaticContact CD2-CZ 3.68Å; H331-F370 AromaticContact CG-CE2 3.41Å; H331-F370 VanDerWaalsContact CG-CE2 3.41Å; H331-F370 AromaticContact CG-CZ 3.52Å; H331-F370 AromaticContact ND1-CE2 3.6Å; S367-F370 PolarHBondContact O-N 3.05Å; K368-F370 VanDerWaalsContact C-N 3.26Å; K368-F370 PolarHBondContact O-N 3.47Å; F370-R372 PolarHBondContact O-N 2.95Å; F370-L373 WeakPolarHBondContact O-CA 3.35Å; F370-L373 WeakPolarHBondContact O-CB 2.97Å; F370-L373 PolarHBondContact O-N 3.3Å; F370-D374 PolarHBondContact O-N 2.83Å
371	I	81.7	Confident	82.4	Confident	68 Å²	68	33.9 Å²	33.9	35%	0.349	18%	0.181	S	C	.	.	H	α-helix	trans	-63.4	-27.4	179.6	-60.2	166	0	0	0	111.9	S367 K368 K375	S367-I371 PolarHBondContact O-N 2.99Å; K368-I371 CarbonylContact O-C 3.57Å; K368-I371 PolarHBondContact O-N 2.98Å; K368-I371 VanDerWaalsContact O-N 3.1Å; I371-K375 VanDerWaalsContact O-CD 3.25Å; I371-K375 WeakPolarHBondContact O-CD 3.43Å; I371-K375 WeakPolarHBondContact O-CE 3.49Å; I371-K375 VanDerWaalsContact O-CG 3.24Å; I371-K375 WeakPolarHBondContact O-CG 3.25Å
372	R	82.9	Confident	82.6	Confident	20 Å²	20	34.6 Å²	34.6	8%	0.075	18%	0.181	C	C	.	.	H	α-helix	trans	-78.6	-40.8	169.7	-171.2	63.5	-178.7	173.8	2.1	111.7	E246 F249 K368 P369 F370 D374 K375 Y376	E246-R372 VanDerWaalsContact CD-NH2 3.29Å; E246-R372 IonicContact OE1-CZ 3.73Å; E246-R372 IonicContact OE1-NE 4Å; E246-R372 PolarHBondContact OE1-NE 3.13Å; E246-R372 IonicContact OE1-NH2 3.29Å; E246-R372 PolarHBondContact OE1-NH2 3.37Å; E246-R372 IonicContact OE2-NE 2.71Å; F249-R372 HydrophobicContact CD1-CB 4.35Å; F249-R372 HydrophobicContact CD1-CG 3.87Å; F249-R372 HydrophobicContact CD2-CB 4.3Å; F249-R372 HydrophobicContact CE1-CB 4.13Å; F249-R372 HydrophobicContact CE1-CG 3.97Å; F249-R372 HydrophobicContact CE2-CB 4.08Å; F249-R372 HydrophobicContact CG-CB 4.45Å; F249-R372 HydrophobicContact CG-CG 4.17Å; F249-R372 HydrophobicContact CZ-CB 4Å; F249-R372 HydrophobicContact CZ-CG 4.36Å; K368-R372 PolarHBondContact O-N 3.12Å; P369-R372 PolarHBondContact O-N 3.34Å; F370-R372 PolarHBondContact O-N 2.95Å; R372-D374 VanDerWaalsContact C-N 3.35Å; R372-D374 PolarHBondContact O-N 3.32Å; R372-K375 WeakPolarHBondContact O-CB 3.46Å; R372-K375 PolarHBondContact O-N 3.31Å; R372-Y376 HydrophobicContact CG-CE2 4.25Å; R372-Y376 WeakPolarHBondContact O-CD2 3.29Å; R372-Y376 PolarHBondContact O-N 3.06Å
373	L	84.5	Confident	82.7	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-57.7	-46.7	178.1	-171.5	69.7	0	0	0	112	Y324 P369 F370 K375 Y376 P377 F404 L407 V408 C411	Y324-L373 HydrophobicContact CD1-CB 4.19Å; Y324-L373 HydrophobicContact CD1-CD1 3.96Å; Y324-L373 HydrophobicContact CD1-CD2 3.96Å; Y324-L373 HydrophobicContact CD1-CG 4.26Å; Y324-L373 HydrophobicContact CE1-CB 4.01Å; Y324-L373 HydrophobicContact CE1-CD1 4.13Å; Y324-L373 HydrophobicContact CE1-CG 4.47Å; Y324-L373 HydrophobicContact CG-CD1 4.15Å; Y324-L373 HydrophobicContact CG-CD2 4.44Å; P369-L373 WeakPolarHBondContact O-CB 3.47Å; P369-L373 PolarHBondContact O-N 3.31Å; F370-L373 WeakPolarHBondContact O-CA 3.35Å; F370-L373 WeakPolarHBondContact O-CB 2.97Å; F370-L373 PolarHBondContact O-N 3.3Å; L373-K375 PolarHBondContact O-N 3.12Å; L373-K375 VanDerWaalsContact O-N 3.16Å; L373-Y376 HydrophobicContact CD1-CD2 4.14Å; L373-Y376 HydrophobicContact CD1-CE2 4.22Å; L373-Y376 PolarHBondContact O-N 3.37Å; L373-P377 WeakPolarHBondContact O-CD 3.48Å; L373-F404 HydrophobicContact CD1-CD1 4.43Å; L373-L407 HydrophobicContact CD1-CD2 3.86Å; L373-L407 HydrophobicContact CD1-CG 4.31Å; L373-L407 HydrophobicContact CD2-CG 4.41Å; L373-V408 HydrophobicContact CG-CG2 4.05Å; L373-C411 HydrophobicContact CD2-CB 3.81Å; L373-C411 VanDerWaalsContact CD2-SG 3.54Å
374	D	84.6	Confident	82.7	Confident	65 Å²	65	35.3 Å²	35.3	35%	0.348	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-16.1	177.7	-65.7	-27.9	0	0	0	113	F370 R372 V408 Q412	F370-D374 PolarHBondContact O-N 2.83Å; R372-D374 VanDerWaalsContact C-N 3.35Å; R372-D374 PolarHBondContact O-N 3.32Å; D374-V408 VanDerWaalsContact OD1-CG1 3.28Å; D374-V408 WeakPolarHBondContact OD1-CG1 3.5Å; D374-Q412 PolarHBondContact OD1-NE2 3.09Å
375	K	86	Confident	82.5	Confident	77 Å²	77	36.4 Å²	36.4	34%	0.335	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95	-18.5	179.7	-71.4	174.3	-172.4	-179.2	0	114.7	I371 R372 L373 T378 L379	I371-K375 VanDerWaalsContact O-CD 3.25Å; I371-K375 WeakPolarHBondContact O-CD 3.43Å; I371-K375 WeakPolarHBondContact O-CE 3.49Å; I371-K375 VanDerWaalsContact O-CG 3.24Å; I371-K375 WeakPolarHBondContact O-CG 3.25Å; R372-K375 WeakPolarHBondContact O-CB 3.46Å; R372-K375 PolarHBondContact O-N 3.31Å; L373-K375 PolarHBondContact O-N 3.12Å; L373-K375 VanDerWaalsContact O-N 3.16Å; K375-T378 PolarHBondContact O-N 3Å; K375-T378 PolarHBondContact O-OG1 2.84Å; K375-T378 VanDerWaalsContact O-OG1 3.05Å; K375-L379 HydrophobicContact CB-CD1 4.45Å; K375-L379 WeakPolarHBondContact O-CB 3.37Å; K375-L379 VanDerWaalsContact O-CG 3.32Å; K375-L379 WeakPolarHBondContact O-CG 3.36Å; K375-L379 PolarHBondContact O-N 3.07Å
376	Y	86	Confident	82	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.008	18%	0.18	C	C	.	.	H	α-helix	trans	-59.1	-41.7	174.7	-62.5	-71.9	0	0	0	113	E246 Q289 Y313 R372 L373 T378 L379 L380 F404	E246-Y376 WeakPolarHBondContact OE1-CE1 3.43Å; Q289-Y376 PolarHBondContact NE2-OH 3.01Å; Y313-Y376 HydrophobicContact CE1-CD1 4.06Å; Y313-Y376 AromaticContact CE1-CE1 3.91Å; Y313-Y376 HydrophobicContact CE1-CE1 3.91Å; R372-Y376 HydrophobicContact CG-CE2 4.25Å; R372-Y376 WeakPolarHBondContact O-CD2 3.29Å; R372-Y376 PolarHBondContact O-N 3.06Å; L373-Y376 HydrophobicContact CD1-CD2 4.14Å; L373-Y376 HydrophobicContact CD1-CE2 4.22Å; L373-Y376 PolarHBondContact O-N 3.37Å; Y376-T378 VanDerWaalsContact C-N 3.34Å; Y376-T378 PolarHBondContact O-N 2.81Å; Y376-L379 PolarHBondContact O-N 3.21Å; Y376-L380 WeakPolarHBondContact O-CB 3.36Å; Y376-L380 VanDerWaalsContact O-CG 3.28Å; Y376-L380 WeakPolarHBondContact O-CG 3.29Å; Y376-L380 PolarHBondContact O-N 3.23Å; Y376-F404 HydrophobicContact CD1-CE1 4.33Å; Y376-F404 HydrophobicContact CD1-CZ 4.23Å; Y376-F404 AromaticContact CD2-CD1 3.82Å; Y376-F404 HydrophobicContact CD2-CD1 3.82Å; Y376-F404 AromaticContact CD2-CE1 3.43Å; Y376-F404 HydrophobicContact CD2-CE1 3.43Å; Y376-F404 VanDerWaalsContact CD2-CE1 3.43Å; Y376-F404 HydrophobicContact CD2-CZ 4.13Å; Y376-F404 HydrophobicContact CE2-CE1 4.03Å; Y376-F404 AromaticContact CG-CD1 3.96Å; Y376-F404 HydrophobicContact CG-CD1 3.96Å; Y376-F404 AromaticContact CG-CE1 3.6Å; Y376-F404 HydrophobicContact CG-CE1 3.6Å; Y376-F404 AromaticContact CG-CZ 3.9Å; Y376-F404 HydrophobicContact CG-CZ 3.9Å
377	P	87.3	Confident	81.6	Confident	10 Å²	10	37.9 Å²	37.9	7%	0.065	19%	0.185	C	C	.	.	H	α-helix	trans	-54.9	-44.2	174.3	-28.4	36.2	0	0	0	114	L373 Q381 F404 K405 V408	L373-P377 WeakPolarHBondContact O-CD 3.48Å; P377-Q381 WeakPolarHBondContact O-CB 3.27Å; P377-Q381 VanDerWaalsContact O-CG 3.28Å; P377-Q381 WeakPolarHBondContact O-CG 3.47Å; P377-Q381 PolarHBondContact O-N 3.31Å; P377-F404 HydrophobicContact CG-CB 4.01Å; P377-K405 HydrophobicContact CB-CG 3.83Å; P377-K405 HydrophobicContact CG-CG 4.08Å; P377-V408 HydrophobicContact CG-CG2 4.15Å
378	T	86.5	Confident	80.9	Confident	82 Å²	82	41.6 Å²	41.6	50%	0.503	20%	0.199	S	C	.	.	H	α-helix	trans	-76.7	-36.9	-176.1	53.8	0	0	0	0	112.2	K375 Y376 Q381 E382	K375-T378 PolarHBondContact O-N 3Å; K375-T378 PolarHBondContact O-OG1 2.84Å; K375-T378 VanDerWaalsContact O-OG1 3.05Å; Y376-T378 VanDerWaalsContact C-N 3.34Å; Y376-T378 PolarHBondContact O-N 2.81Å; T378-Q381 PolarHBondContact O-N 2.97Å; T378-E382 PolarHBondContact O-N 3.48Å
379	L	82.9	Confident	80	Confident	33 Å²	33	46.2 Å²	46.2	17%	0.173	22%	0.222	C	C	.	.	H	α-helix	trans	-64.2	-40.4	173.3	-68.8	170.1	0	0	0	112.1	I242 K375 Y376 E382 L383	I242-L379 HydrophobicContact CD1-CB 4.34Å; I242-L379 HydrophobicContact CG1-CB 4.26Å; I242-L379 HydrophobicContact CG1-CD2 4.18Å; K375-L379 HydrophobicContact CB-CD1 4.45Å; K375-L379 WeakPolarHBondContact O-CB 3.37Å; K375-L379 VanDerWaalsContact O-CG 3.32Å; K375-L379 WeakPolarHBondContact O-CG 3.36Å; K375-L379 PolarHBondContact O-N 3.07Å; Y376-L379 PolarHBondContact O-N 3.21Å; L379-E382 PolarHBondContact O-N 3.26Å; L379-L383 WeakPolarHBondContact O-CB 3.06Å; L379-L383 PolarHBondContact O-N 3.39Å
380	L	83.1	Confident	79	Confident	2 Å²	2	50.9 Å²	50.9	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-71.9	-31.4	176.4	-68.8	170.5	0	0	0	112.6	Y313 Y376 L383 E384 I397 A400 T401 F404	Y313-L380 HydrophobicContact CD2-CD2 4.15Å; Y313-L380 HydrophobicContact CE2-CD2 4.29Å; Y376-L380 WeakPolarHBondContact O-CB 3.36Å; Y376-L380 VanDerWaalsContact O-CG 3.28Å; Y376-L380 WeakPolarHBondContact O-CG 3.29Å; Y376-L380 PolarHBondContact O-N 3.23Å; L380-L383 HydrophobicContact CD2-CD2 4.31Å; L380-L383 WeakPolarHBondContact O-CB 3.32Å; L380-L383 PolarHBondContact O-N 2.87Å; L380-E384 WeakPolarHBondContact O-CB 3.3Å; L380-E384 PolarHBondContact O-N 3.48Å; L380-I397 WeakPolarHBondContact O-CG2 3.47Å; L380-A400 HydrophobicContact CD1-CB 3.9Å; L380-T401 WeakPolarHBondContact CB-OG1 3.5Å; L380-F404 HydrophobicContact CD1-CD2 3.42Å; L380-F404 VanDerWaalsContact CD1-CD2 3.42Å; L380-F404 HydrophobicContact CD1-CE2 3.75Å; L380-F404 HydrophobicContact CD1-CG 4.42Å
381	Q	83	Confident	78.5	Confident	81 Å²	81	51.7 Å²	51.7	38%	0.379	26%	0.264	S	S	.	.	H	α-helix	trans	-70.5	-36.9	171.8	-76.3	-178	-102.3	0	0	113.1	P377 T378 L383 E384 R385 T401	P377-Q381 WeakPolarHBondContact O-CB 3.27Å; P377-Q381 VanDerWaalsContact O-CG 3.28Å; P377-Q381 WeakPolarHBondContact O-CG 3.47Å; P377-Q381 PolarHBondContact O-N 3.31Å; T378-Q381 PolarHBondContact O-N 2.97Å; Q381-L383 VanDerWaalsContact C-N 3.31Å; Q381-E384 WeakPolarHBondContact O-CB 3.41Å; Q381-E384 PolarHBondContact O-N 3.09Å; Q381-R385 PolarHBondContact O-N 2.91Å; Q381-R385 VanDerWaalsContact O-N 3.1Å; Q381-T401 HydrophobicContact CG-CG2 3.7Å
382	E	80.9	Confident	77.8	Confident	66 Å²	66	51.2 Å²	51.2	31%	0.308	27%	0.266	S	S	.	.	H	α-helix	trans	-67.3	-36.5	172.2	-174.1	62	-169.9	0	0	110.8	V238 T378 L379 R385 H386	V238-E382 HydrophobicContact CG2-CG 4.47Å; T378-E382 PolarHBondContact O-N 3.48Å; L379-E382 PolarHBondContact O-N 3.26Å; E382-R385 PolarHBondContact O-N 2.93Å; E382-R385 IonicContact OE1-CZ 3.5Å; E382-R385 IonicContact OE1-NE 3.62Å; E382-R385 IonicContact OE1-NH2 2.64Å; E382-R385 PolarHBondContact OE1-NH2 2.73Å; E382-R385 IonicContact OE2-CZ 2.68Å; E382-R385 IonicContact OE2-NE 2.82Å; E382-R385 PolarHBondContact OE2-NE 2.87Å; E382-R385 IonicContact OE2-NH2 2.65Å; E382-R385 PolarHBondContact OE2-NH2 3.46Å; E382-H386 PolarHBondContact O-CD2 3.04Å; E382-H386 IonicContact OE1-CD2 3.41Å; E382-H386 IonicContact OE1-CE1 3.68Å; E382-H386 IonicContact OE1-NE2 2.7Å; E382-H386 PolarHBondContact OE1-NE2 2.84Å
383	L	77.8	Confident	77.4	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-62.2	-46.2	171.7	-169	69.3	0	0	0	111.8	F235 V238 V239 V309 L379 L380 Q381 R385 H386 V387 I397	F235-L383 HydrophobicContact CD2-CD1 3.71Å; F235-L383 HydrophobicContact CE2-CD1 3.56Å; F235-L383 HydrophobicContact CE2-CG 4.22Å; V238-L383 HydrophobicContact CG1-CB 4.47Å; V238-L383 HydrophobicContact CG1-CD1 4.06Å; V239-L383 HydrophobicContact CG2-CD1 3.55Å; V309-L383 HydrophobicContact CB-CD2 4.42Å; V309-L383 HydrophobicContact CG1-CD2 4.27Å; L379-L383 WeakPolarHBondContact O-CB 3.06Å; L379-L383 PolarHBondContact O-N 3.39Å; L380-L383 HydrophobicContact CD2-CD2 4.31Å; L380-L383 WeakPolarHBondContact O-CB 3.32Å; L380-L383 PolarHBondContact O-N 2.87Å; Q381-L383 VanDerWaalsContact C-N 3.31Å; L383-R385 PolarHBondContact O-N 2.94Å; L383-H386 PolarHBondContact O-N 3.32Å; L383-V387 VanDerWaalsContact O-CG2 3.3Å; L383-V387 WeakPolarHBondContact O-CG2 3.44Å; L383-V387 PolarHBondContact O-N 3.04Å; L383-I397 HydrophobicContact CD2-CD1 4.06Å; L383-I397 HydrophobicContact CD2-CG1 4.26Å; L383-I397 HydrophobicContact CG-CD1 4.13Å
384	E	80.3	Confident	77.1	Confident	54 Å²	54	53 Å²	53	25%	0.252	27%	0.273	S	S	.	.	H	α-helix	trans	-52.8	-41.6	175.3	-163.8	177.6	151.1	0	0	111.7	L380 Q381 H386 V387 Y394 I397 I398	L380-E384 WeakPolarHBondContact O-CB 3.3Å; L380-E384 PolarHBondContact O-N 3.48Å; Q381-E384 WeakPolarHBondContact O-CB 3.41Å; Q381-E384 PolarHBondContact O-N 3.09Å; E384-H386 VanDerWaalsContact C-N 3.32Å; E384-H386 PolarHBondContact O-N 3.26Å; E384-V387 PolarHBondContact O-N 3.36Å; E384-Y394 HydrophobicContact CG-CE2 4.06Å; E384-I397 HydrophobicContact CB-CG2 3.73Å; E384-I397 HydrophobicContact CG-CG2 4.05Å; E384-I398 HydrophobicContact CG-CG1 4.47Å
385	R	77.6	Confident	76.9	Confident	91 Å²	91	51.7 Å²	51.7	34%	0.343	28%	0.275	S	S	.	.	H	α-helix	trans	-68.6	-21.7	-178	-166.5	170.7	69.8	147.3	3.4	114.9	Q381 E382 L383	Q381-R385 PolarHBondContact O-N 2.91Å; Q381-R385 VanDerWaalsContact O-N 3.1Å; E382-R385 PolarHBondContact O-N 2.93Å; E382-R385 IonicContact OE1-CZ 3.5Å; E382-R385 IonicContact OE1-NE 3.62Å; E382-R385 IonicContact OE1-NH2 2.64Å; E382-R385 PolarHBondContact OE1-NH2 2.73Å; E382-R385 IonicContact OE2-CZ 2.68Å; E382-R385 IonicContact OE2-NE 2.82Å; E382-R385 PolarHBondContact OE2-NE 2.87Å; E382-R385 IonicContact OE2-NH2 2.65Å; E382-R385 PolarHBondContact OE2-NH2 3.46Å; L383-R385 PolarHBondContact O-N 2.94Å
386	H	68.9	Low	76.8	Confident	29 Å²	29	49.4 Å²	49.4	13%	0.134	27%	0.266	C	S	.	.	H	α-helix	trans	-106.2	1.7	179.3	-63.2	-67.2	0	0	0	114.1	E382 L383 E384	E382-H386 PolarHBondContact O-CD2 3.04Å; E382-H386 IonicContact OE1-CD2 3.41Å; E382-H386 IonicContact OE1-CE1 3.68Å; E382-H386 IonicContact OE1-NE2 2.7Å; E382-H386 PolarHBondContact OE1-NE2 2.84Å; L383-H386 PolarHBondContact O-N 3.32Å; E384-H386 VanDerWaalsContact C-N 3.32Å; E384-H386 PolarHBondContact O-N 3.26Å
387	V	73.3	Confident	76.7	Confident	16 Å²	16	49.3 Å²	49.3	10%	0.097	27%	0.266	C	S	.	.	S	Bend	trans	-97	125.1	179.1	169.4	0	0	0	0	110.5	F235 L383 E384 H391 Y394 I397	F235-V387 HydrophobicContact CD2-CG2 3.43Å; F235-V387 VanDerWaalsContact CD2-CG2 3.43Å; F235-V387 HydrophobicContact CE2-CG2 3.38Å; L383-V387 VanDerWaalsContact O-CG2 3.3Å; L383-V387 WeakPolarHBondContact O-CG2 3.44Å; L383-V387 PolarHBondContact O-N 3.04Å; E384-V387 PolarHBondContact O-N 3.36Å; V387-H391 HydrophobicContact CG1-CB 3.52Å; V387-Y394 HydrophobicContact CB-CD2 4.46Å; V387-Y394 HydrophobicContact CG1-CD2 3.99Å; V387-Y394 HydrophobicContact CG1-CG 4.45Å; V387-I397 HydrophobicContact CB-CD1 4.3Å; V387-I397 HydrophobicContact CG1-CD1 4.32Å; V387-I397 HydrophobicContact CG2-CD1 3.83Å
388	E	67.3	Low	76.6	Confident	101 Å²	101	52.2 Å²	52.2	47%	0.472	28%	0.28	S	S	.	.			trans	-64.2	132.6	170.5	-66.8	171.5	-165	0	0	109.6	K232 A390 H391	K232-E388 VanDerWaalsContact CE-OE1 3.31Å; K232-E388 WeakPolarHBondContact CE-OE1 3.15Å; E388-A390 PolarHBondContact O-N 3.41Å; E388-H391 WeakPolarHBondContact O-CB 3.46Å; E388-H391 PolarHBondContact O-N 3.35Å
389	E	64.6	Low	76.6	Confident	157 Å²	157	53.8 Å²	53.8	73%	0.734	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-24.4	-176.2	-61.7	-178.4	160.9	0	0	114.4	H391 Y394	E389-H391 PolarHBondContact O-N 3.29Å; E389-Y394 HydrophobicContact CB-CD1 4.36Å; E389-Y394 HydrophobicContact CB-CE1 4.32Å; E389-Y394 HydrophobicContact CG-CE1 4.13Å
390	A	59.8	Low	76.9	Confident	99 Å²	99	52.2 Å²	52.2	82%	0.818	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-5.3	175.6	0	0	0	0	0	114.1	E388	E388-A390 PolarHBondContact O-N 3.41Å
391	H	68.8	Low	77.1	Confident	31 Å²	31	52.5 Å²	52.5	14%	0.144	27%	0.274	C	S	.	.	S	Bend	trans	-76.8	135.2	-177.2	-170	-100.4	0	0	0	112	E304 Q307 V387 E388 E389 D393 Y394	E304-H391 PolarHBondContact O-NE2 3.1Å; Q307-H391 PolarHBondContact O-CE1 3.35Å; V387-H391 HydrophobicContact CG1-CB 3.52Å; E388-H391 WeakPolarHBondContact O-CB 3.46Å; E388-H391 PolarHBondContact O-N 3.35Å; E389-H391 PolarHBondContact O-N 3.29Å; H391-D393 WeakPolarHBondContact ND1-CB 3.46Å; H391-D393 PolarHBondContact ND1-N 3.18Å; H391-D393 PolarHBondContact O-N 3.35Å; H391-Y394 WeakPolarHBondContact O-CB 3.43Å; H391-Y394 PolarHBondContact O-N 3.48Å
392	P	68.7	Low	77.4	Confident	58 Å²	58	51.3 Å²	51.3	38%	0.377	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-21.8	-176.1	19.3	-33.2	0	0	0	115.9	R308	R308-P392 VanDerWaalsContact CZ-O 3.26Å; R308-P392 PolarHBondContact NH1-O 3.38Å; R308-P392 PolarHBondContact NH2-O 2.86Å
393	D	73.8	Confident	77.8	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-12.1	-179.4	-151.1	47.6	0	0	0	113.5	R308 V309 A310 G311 H391 G395 D396 I397	R308-D393 VanDerWaalsContact CA-OD1 3.29Å; R308-D393 WeakPolarHBondContact CA-OD1 3.26Å; R308-D393 WeakPolarHBondContact CB-OD1 3.39Å; R308-D393 HydrophobicContact CG-CB 4.41Å; R308-D393 IonicContact NH1-OD1 3.19Å; V309-D393 PolarHBondContact N-OD2 3.01Å; A310-D393 WeakPolarHBondContact CB-OD2 3.22Å; A310-D393 PolarHBondContact N-OD2 3.13Å; G311-D393 PolarHBondContact N-OD1 3.42Å; H391-D393 WeakPolarHBondContact ND1-CB 3.46Å; H391-D393 PolarHBondContact ND1-N 3.18Å; H391-D393 PolarHBondContact O-N 3.35Å; D393-G395 PolarHBondContact O-N 3.37Å; D393-D396 CarbonylContact O-C 3.58Å; D393-D396 WeakPolarHBondContact O-CA 3.5Å; D393-D396 WeakPolarHBondContact O-CB 3.21Å; D393-D396 PolarHBondContact O-N 2.96Å; D393-I397 WeakPolarHBondContact O-CG1 3.28Å; D393-I397 PolarHBondContact O-N 3.05Å
394	Y	77.6	Confident	78.3	Confident	58 Å²	58	49.1 Å²	49.1	23%	0.227	27%	0.271	C	S	.	.	H	α-helix	trans	-57.1	-48.6	-174.7	179.3	-105.5	0	0	0	112.8	E384 V387 E389 H391 D396 I397 I398	E384-Y394 HydrophobicContact CG-CE2 4.06Å; V387-Y394 HydrophobicContact CB-CD2 4.46Å; V387-Y394 HydrophobicContact CG1-CD2 3.99Å; V387-Y394 HydrophobicContact CG1-CG 4.45Å; E389-Y394 HydrophobicContact CB-CD1 4.36Å; E389-Y394 HydrophobicContact CB-CE1 4.32Å; E389-Y394 HydrophobicContact CG-CE1 4.13Å; H391-Y394 WeakPolarHBondContact O-CB 3.43Å; H391-Y394 PolarHBondContact O-N 3.48Å; Y394-D396 PolarHBondContact O-N 3.46Å; Y394-I397 PolarHBondContact O-N 3.03Å; Y394-I398 HydrophobicContact CD1-CD1 4.24Å; Y394-I398 HydrophobicContact CE1-CD1 3.67Å; Y394-I398 HydrophobicContact CE2-CD1 4.43Å; Y394-I398 PolarHBondContact O-N 2.98Å
395	G	81.1	Confident	78.8	Confident	38 Å²	38	51 Å²	51	39%	0.392	28%	0.278	S	S	.	.	H	α-helix	trans	-68.6	-10.6	175.4	0	0	0	0	0	114.5	D393 K399	D393-G395 PolarHBondContact O-N 3.37Å; G395-K399 VanDerWaalsContact O-CD 3.28Å; G395-K399 WeakPolarHBondContact O-CD 3.18Å; G395-K399 WeakPolarHBondContact O-CE 3.49Å; G395-K399 VanDerWaalsContact O-CG 3.31Å; G395-K399 WeakPolarHBondContact O-CG 3.37Å; G395-K399 PolarHBondContact O-NZ 3.09Å
396	D	84	Confident	79.3	Confident	29 Å²	29	49.2 Å²	49.2	16%	0.155	28%	0.279	C	S	.	.	H	α-helix	trans	-97.2	-31	173.5	-67.1	-35.6	0	0	0	111.5	R308 A310 L314 D393 Y394 K399 A400	R308-D396 IonicContact CZ-OD2 3.1Å; R308-D396 IonicContact NH1-OD2 3.61Å; R308-D396 PolarHBondContact NH1-OD2 3.36Å; A310-D396 HydrophobicContact CB-CB 4.25Å; L314-D396 HydrophobicContact CD1-CB 3.77Å; D393-D396 CarbonylContact O-C 3.58Å; D393-D396 WeakPolarHBondContact O-CA 3.5Å; D393-D396 WeakPolarHBondContact O-CB 3.21Å; D393-D396 PolarHBondContact O-N 2.96Å; Y394-D396 PolarHBondContact O-N 3.46Å; D396-K399 PolarHBondContact O-N 3.1Å; D396-K399 IonicContact OD1-NZ 3.1Å; D396-K399 PolarHBondContact OD1-NZ 3.22Å; D396-A400 WeakPolarHBondContact O-CB 3.47Å; D396-A400 PolarHBondContact O-N 3.02Å
397	I	83.6	Confident	80.3	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-56.8	-52.1	169.1	-67.6	165.6	0	0	0	110.2	A310 L380 L383 E384 V387 D393 Y394 K399 A400 T401	A310-I397 VanDerWaalsContact CB-CA 3.44Å; A310-I397 HydrophobicContact CB-CB 4.09Å; A310-I397 HydrophobicContact CB-CG1 3.5Å; A310-I397 VanDerWaalsContact CB-CG1 3.5Å; A310-I397 VanDerWaalsContact CB-N 3.33Å; L380-I397 WeakPolarHBondContact O-CG2 3.47Å; L383-I397 HydrophobicContact CD2-CD1 4.06Å; L383-I397 HydrophobicContact CD2-CG1 4.26Å; L383-I397 HydrophobicContact CG-CD1 4.13Å; E384-I397 HydrophobicContact CB-CG2 3.73Å; E384-I397 HydrophobicContact CG-CG2 4.05Å; V387-I397 HydrophobicContact CB-CD1 4.3Å; V387-I397 HydrophobicContact CG1-CD1 4.32Å; V387-I397 HydrophobicContact CG2-CD1 3.83Å; D393-I397 WeakPolarHBondContact O-CG1 3.28Å; D393-I397 PolarHBondContact O-N 3.05Å; Y394-I397 PolarHBondContact O-N 3.03Å; I397-K399 VanDerWaalsContact C-N 3.3Å; I397-K399 PolarHBondContact O-N 3.38Å; I397-A400 WeakPolarHBondContact O-CB 3.48Å; I397-A400 PolarHBondContact O-N 3.35Å; I397-T401 WeakPolarHBondContact O-CB 3.49Å; I397-T401 PolarHBondContact O-N 2.9Å; I397-T401 PolarHBondContact O-OG1 3.39Å
398	I	85.6	Confident	81.1	Confident	72 Å²	72	48 Å²	48	37%	0.369	27%	0.274	S	S	.	.	H	α-helix	trans	-57.6	-43	-180	-64.9	170.4	0	0	0	111.4	E384 Y394 A402	E384-I398 HydrophobicContact CG-CG1 4.47Å; Y394-I398 HydrophobicContact CD1-CD1 4.24Å; Y394-I398 HydrophobicContact CE1-CD1 3.67Å; Y394-I398 HydrophobicContact CE2-CD1 4.43Å; Y394-I398 PolarHBondContact O-N 2.98Å; I398-A402 WeakPolarHBondContact O-CB 3.47Å; I398-A402 PolarHBondContact O-N 2.87Å
399	K	86.9	Confident	82.1	Confident	115 Å²	115	45.9 Å²	45.9	50%	0.5	27%	0.27	S	S	.	.	H	α-helix	trans	-65.1	-41.5	176.5	-65.4	168.9	-159	146.9	0	111.5	L314 G395 D396 I397 A402 A403	L314-K399 HydrophobicContact CD1-CB 3.99Å; L314-K399 HydrophobicContact CD1-CD 4.19Å; L314-K399 HydrophobicContact CD2-CB 4.02Å; G395-K399 VanDerWaalsContact O-CD 3.28Å; G395-K399 WeakPolarHBondContact O-CD 3.18Å; G395-K399 WeakPolarHBondContact O-CE 3.49Å; G395-K399 VanDerWaalsContact O-CG 3.31Å; G395-K399 WeakPolarHBondContact O-CG 3.37Å; G395-K399 PolarHBondContact O-NZ 3.09Å; D396-K399 PolarHBondContact O-N 3.1Å; D396-K399 IonicContact OD1-NZ 3.1Å; D396-K399 PolarHBondContact OD1-NZ 3.22Å; I397-K399 VanDerWaalsContact C-N 3.3Å; I397-K399 PolarHBondContact O-N 3.38Å; K399-A402 PolarHBondContact O-N 3.3Å; K399-A403 VanDerWaalsContact O-CB 3.26Å; K399-A403 WeakPolarHBondContact O-CB 3.28Å; K399-A403 PolarHBondContact O-N 3.36Å
400	A	87.6	Confident	83.2	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64.7	-48.9	178.1	0	0	0	0	0	110.7	A310 L314 L380 D396 I397 A402 A403 F404	A310-A400 HydrophobicContact CB-CB 4.14Å; L314-A400 HydrophobicContact CD2-CB 4.09Å; L314-A400 HydrophobicContact CG-CB 4.18Å; L380-A400 HydrophobicContact CD1-CB 3.9Å; D396-A400 WeakPolarHBondContact O-CB 3.47Å; D396-A400 PolarHBondContact O-N 3.02Å; I397-A400 WeakPolarHBondContact O-CB 3.48Å; I397-A400 PolarHBondContact O-N 3.35Å; A400-A402 VanDerWaalsContact C-N 3.33Å; A400-A402 PolarHBondContact O-N 3.15Å; A400-A403 PolarHBondContact O-N 2.89Å; A400-A403 VanDerWaalsContact O-N 3.13Å; A400-F404 WeakPolarHBondContact O-CD2 3.3Å; A400-F404 PolarHBondContact O-N 2.87Å
401	T	88.1	Confident	84.5	Confident	7 Å²	7	37.6 Å²	37.6	4%	0.043	22%	0.215	C	C	.	.	H	α-helix	trans	-53.2	-48.3	174.2	-63.1	0	0	0	0	111.4	L380 Q381 I397 K405	L380-T401 WeakPolarHBondContact CB-OG1 3.5Å; Q381-T401 HydrophobicContact CG-CG2 3.7Å; I397-T401 WeakPolarHBondContact O-CB 3.49Å; I397-T401 PolarHBondContact O-N 2.9Å; I397-T401 PolarHBondContact O-OG1 3.39Å; T401-K405 HydrophobicContact CG2-CD 4.16Å; T401-K405 WeakPolarHBondContact O-CB 3.4Å; T401-K405 VanDerWaalsContact O-CG 3.3Å; T401-K405 WeakPolarHBondContact O-CG 3.37Å; T401-K405 PolarHBondContact O-N 3.06Å
402	A	89.1	Confident	85.4	Confident	56 Å²	56	40 Å²	40	46%	0.463	23%	0.226	S	C	.	.	H	α-helix	trans	-64.5	-42.1	176.8	0	0	0	0	0	112.7	I398 K399 A400 K405 S406	I398-A402 WeakPolarHBondContact O-CB 3.47Å; I398-A402 PolarHBondContact O-N 2.87Å; K399-A402 PolarHBondContact O-N 3.3Å; A400-A402 VanDerWaalsContact C-N 3.33Å; A400-A402 PolarHBondContact O-N 3.15Å; A402-K405 PolarHBondContact O-N 2.88Å; A402-S406 WeakPolarHBondContact O-CB 3.43Å; A402-S406 PolarHBondContact O-N 3.17Å
403	A	88.9	Confident	86.2	Confident	20 Å²	20	39.9 Å²	39.9	17%	0.165	22%	0.222	C	C	.	.	H	α-helix	trans	-65.5	-40.7	178.7	0	0	0	0	0	112.4	M317 K399 A400 S406 L407	M317-A403 HydrophobicContact CE-CB 4Å; M317-A403 VanDerWaalsContact CE-O 3.27Å; M317-A403 WeakPolarHBondContact CE-O 3.35Å; M317-A403 HydrophobicContact CG-CB 4.16Å; M317-A403 HydrophobicContact SD-CB 4.29Å; K399-A403 VanDerWaalsContact O-CB 3.26Å; K399-A403 WeakPolarHBondContact O-CB 3.28Å; K399-A403 PolarHBondContact O-N 3.36Å; A400-A403 PolarHBondContact O-N 2.89Å; A400-A403 VanDerWaalsContact O-N 3.13Å; A403-S406 PolarHBondContact O-N 3.05Å; A403-L407 PolarHBondContact O-N 3Å
404	F	89.4	Confident	86.8	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-68.4	-43.1	175.1	-85.2	-71.9	0	0	0	112.2	Y313 M317 I320 L373 Y376 P377 L380 A400 S406 L407 V408	Y313-F404 AromaticContact CD1-CE2 3.89Å; Y313-F404 HydrophobicContact CD1-CE2 3.89Å; Y313-F404 AromaticContact CD1-CZ 3.76Å; Y313-F404 HydrophobicContact CD1-CZ 3.76Å; Y313-F404 HydrophobicContact CE1-CZ 4.28Å; Y313-F404 HydrophobicContact CG-CE2 4.11Å; Y313-F404 HydrophobicContact CG-CZ 4.44Å; M317-F404 HydrophobicContact CE-CD1 4.14Å; M317-F404 HydrophobicContact CE-CE1 4.46Å; M317-F404 HydrophobicContact CE-CG 4.28Å; M317-F404 HydrophobicContact SD-CD1 4.31Å; M317-F404 HydrophobicContact SD-CD2 4.3Å; M317-F404 HydrophobicContact SD-CE1 4.15Å; M317-F404 HydrophobicContact SD-CE2 4.15Å; M317-F404 HydrophobicContact SD-CG 4.39Å; M317-F404 HydrophobicContact SD-CZ 4.08Å; I320-F404 HydrophobicContact CD1-CE1 4.21Å; I320-F404 HydrophobicContact CD1-CZ 3.82Å; I320-F404 HydrophobicContact CG2-CE1 4.18Å; L373-F404 HydrophobicContact CD1-CD1 4.43Å; Y376-F404 HydrophobicContact CD1-CE1 4.33Å; Y376-F404 HydrophobicContact CD1-CZ 4.23Å; Y376-F404 AromaticContact CD2-CD1 3.82Å; Y376-F404 HydrophobicContact CD2-CD1 3.82Å; Y376-F404 AromaticContact CD2-CE1 3.43Å; Y376-F404 HydrophobicContact CD2-CE1 3.43Å; Y376-F404 VanDerWaalsContact CD2-CE1 3.43Å; Y376-F404 HydrophobicContact CD2-CZ 4.13Å; Y376-F404 HydrophobicContact CE2-CE1 4.03Å; Y376-F404 AromaticContact CG-CD1 3.96Å; Y376-F404 HydrophobicContact CG-CD1 3.96Å; Y376-F404 AromaticContact CG-CE1 3.6Å; Y376-F404 HydrophobicContact CG-CE1 3.6Å; Y376-F404 AromaticContact CG-CZ 3.9Å; Y376-F404 HydrophobicContact CG-CZ 3.9Å; P377-F404 HydrophobicContact CG-CB 4.01Å; L380-F404 HydrophobicContact CD1-CD2 3.42Å; L380-F404 VanDerWaalsContact CD1-CD2 3.42Å; L380-F404 HydrophobicContact CD1-CE2 3.75Å; L380-F404 HydrophobicContact CD1-CG 4.42Å; A400-F404 WeakPolarHBondContact O-CD2 3.3Å; A400-F404 PolarHBondContact O-N 2.87Å; F404-S406 VanDerWaalsContact C-N 3.28Å; F404-S406 PolarHBondContact O-N 3.11Å; F404-L407 PolarHBondContact O-N 2.78Å; F404-V408 WeakPolarHBondContact O-CB 3.32Å; F404-V408 WeakPolarHBondContact O-CG2 3.49Å; F404-V408 PolarHBondContact O-N 2.86Å
405	K	89.4	Confident	87.1	Confident	95 Å²	95	41.9 Å²	41.9	41%	0.413	23%	0.232	S	C	.	.	H	α-helix	trans	-57.8	-41.9	173.4	-73.6	175.4	179.4	179.7	0	111.8	P377 T401 A402 S409	P377-K405 HydrophobicContact CB-CG 3.83Å; P377-K405 HydrophobicContact CG-CG 4.08Å; T401-K405 HydrophobicContact CG2-CD 4.16Å; T401-K405 WeakPolarHBondContact O-CB 3.4Å; T401-K405 VanDerWaalsContact O-CG 3.3Å; T401-K405 WeakPolarHBondContact O-CG 3.37Å; T401-K405 PolarHBondContact O-N 3.06Å; A402-K405 PolarHBondContact O-N 2.88Å; K405-S409 PolarHBondContact O-N 3.09Å
406	S	89.4	Confident	87.3	Confident	52 Å²	52	46 Å²	46	36%	0.364	24%	0.239	S	C	.	.	H	α-helix	trans	-64.3	-43.2	174.4	171.9	0	0	0	0	112.8	A402 A403 F404 Q410	A402-S406 WeakPolarHBondContact O-CB 3.43Å; A402-S406 PolarHBondContact O-N 3.17Å; A403-S406 PolarHBondContact O-N 3.05Å; F404-S406 VanDerWaalsContact C-N 3.28Å; F404-S406 PolarHBondContact O-N 3.11Å; S406-Q410 WeakPolarHBondContact O-CG 3.29Å; S406-Q410 PolarHBondContact O-N 3.43Å; S406-Q410 VanDerWaalsContact O-N 3.17Å
407	L	89.6	Confident	87.3	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-65.7	-42.5	176.6	175	56.9	0	0	0	111.8	M317 I320 K321 L325 L373 A403 F404 S409 Q410 C411	M317-L407 HydrophobicContact CE-CB 3.7Å; M317-L407 HydrophobicContact CE-CD2 3.62Å; M317-L407 HydrophobicContact CE-CG 4.31Å; I320-L407 HydrophobicContact CG2-CD2 3.7Å; K321-L407 HydrophobicContact CB-CD1 4.38Å; K321-L407 HydrophobicContact CG-CD1 4.02Å; K321-L407 HydrophobicContact CG-CD2 3.98Å; K321-L407 HydrophobicContact CG-CG 4.38Å; L325-L407 HydrophobicContact CD1-CD1 4.49Å; L325-L407 HydrophobicContact CD2-CD1 4.26Å; L325-L407 HydrophobicContact CG-CD1 4.09Å; L373-L407 HydrophobicContact CD1-CD2 3.86Å; L373-L407 HydrophobicContact CD1-CG 4.31Å; L373-L407 HydrophobicContact CD2-CG 4.41Å; A403-L407 PolarHBondContact O-N 3Å; F404-L407 PolarHBondContact O-N 2.78Å; L407-S409 VanDerWaalsContact C-N 3.34Å; L407-S409 PolarHBondContact O-N 3.36Å; L407-Q410 PolarHBondContact O-N 2.65Å; L407-C411 WeakPolarHBondContact CD1-SG 3.24Å; L407-C411 WeakPolarHBondContact O-CB 3.25Å; L407-C411 PolarHBondContact O-N 3.26Å; L407-C411 PolarHBondContact O-SG 2.85Å
408	V	89.4	Confident	87.5	Confident	20 Å²	20	48.6 Å²	48.6	12%	0.121	25%	0.247	C	C	.	.	H	α-helix	trans	-54.8	-48.6	176.8	161.5	0	0	0	0	111	L373 D374 P377 F404 C411 Q412	L373-V408 HydrophobicContact CG-CG2 4.05Å; D374-V408 VanDerWaalsContact OD1-CG1 3.28Å; D374-V408 WeakPolarHBondContact OD1-CG1 3.5Å; P377-V408 HydrophobicContact CG-CG2 4.15Å; F404-V408 WeakPolarHBondContact O-CB 3.32Å; F404-V408 WeakPolarHBondContact O-CG2 3.49Å; F404-V408 PolarHBondContact O-N 2.86Å; V408-C411 PolarHBondContact O-N 2.78Å; V408-Q412 WeakPolarHBondContact O-CB 3.4Å; V408-Q412 VanDerWaalsContact O-CG 3.29Å; V408-Q412 WeakPolarHBondContact O-CG 3.43Å; V408-Q412 PolarHBondContact O-N 2.77Å
409	S	89	Confident	87.6	Confident	56 Å²	56	49.5 Å²	49.5	39%	0.392	25%	0.253	S	S	.	.	H	α-helix	trans	-59.8	-50.1	175.2	-160.4	0	0	0	0	111.6	K405 L407 C411 Q412 D413	K405-S409 PolarHBondContact O-N 3.09Å; L407-S409 VanDerWaalsContact C-N 3.34Å; L407-S409 PolarHBondContact O-N 3.36Å; S409-C411 VanDerWaalsContact C-N 3.3Å; S409-C411 PolarHBondContact O-N 2.84Å; S409-Q412 PolarHBondContact O-N 3.21Å; S409-Q412 VanDerWaalsContact O-N 3.11Å; S409-D413 WeakPolarHBondContact O-CB 3.35Å; S409-D413 VanDerWaalsContact O-CG 3.32Å; S409-D413 PolarHBondContact O-N 2.84Å; S409-D413 PolarHBondContact OG-OD2 3.45Å
410	Q	87.1	Confident	87.5	Confident	79 Å²	79	45.5 Å²	45.5	37%	0.369	24%	0.237	S	C	.	.	H	α-helix	trans	-57.1	-41.6	179.8	-71.4	173	-8.4	0	0	112.4	L325 S406 L407 L414	L325-Q410 HydrophobicContact CD2-CB 4.16Å; S406-Q410 WeakPolarHBondContact O-CG 3.29Å; S406-Q410 PolarHBondContact O-N 3.43Å; S406-Q410 VanDerWaalsContact O-N 3.17Å; L407-Q410 PolarHBondContact O-N 2.65Å; Q410-L414 WeakPolarHBondContact O-CB 3.42Å; Q410-L414 PolarHBondContact O-N 3.01Å
411	C	87.6	Confident	87.4	Confident	3 Å²	3	46.3 Å²	46.3	2%	0.02	24%	0.241	C	C	.	.	H	α-helix	trans	-66	-43.7	175.6	-77.1	0	0	0	0	112.6	C328 L373 L407 V408 S409 R415	C328-C411 WeakPolarHBondContact SG-CB 3.2Å; C328-C411 PolarHBondContact SG-SG 3.36Å; L373-C411 HydrophobicContact CD2-CB 3.81Å; L373-C411 VanDerWaalsContact CD2-SG 3.54Å; L407-C411 WeakPolarHBondContact CD1-SG 3.24Å; L407-C411 WeakPolarHBondContact O-CB 3.25Å; L407-C411 PolarHBondContact O-N 3.26Å; L407-C411 PolarHBondContact O-SG 2.85Å; V408-C411 PolarHBondContact O-N 2.78Å; S409-C411 VanDerWaalsContact C-N 3.3Å; S409-C411 PolarHBondContact O-N 2.84Å; C411-R415 WeakPolarHBondContact O-CB 3.47Å; C411-R415 PolarHBondContact O-N 3.46Å
412	Q	87.3	Confident	87.2	Confident	81 Å²	81	47.8 Å²	47.8	38%	0.379	25%	0.248	S	C	.	.	H	α-helix	trans	-66.3	-43.2	177.7	-71.3	178.1	11.5	0	0	111.7	D374 V408 S409 R415 K416	D374-Q412 PolarHBondContact OD1-NE2 3.09Å; V408-Q412 WeakPolarHBondContact O-CB 3.4Å; V408-Q412 VanDerWaalsContact O-CG 3.29Å; V408-Q412 WeakPolarHBondContact O-CG 3.43Å; V408-Q412 PolarHBondContact O-N 2.77Å; S409-Q412 PolarHBondContact O-N 3.21Å; S409-Q412 VanDerWaalsContact O-N 3.11Å; Q412-R415 PolarHBondContact O-N 3.1Å; Q412-K416 WeakPolarHBondContact O-CG 3.39Å; Q412-K416 PolarHBondContact O-N 3.49Å
413	D	85.4	Confident	87	Confident	56 Å²	56	48.9 Å²	48.9	30%	0.299	24%	0.244	S	C	.	.	H	α-helix	trans	-71.8	-38.8	-179.4	-63.6	-41.7	0	0	0	112	S409 R415 K416 R417	S409-D413 WeakPolarHBondContact O-CB 3.35Å; S409-D413 VanDerWaalsContact O-CG 3.32Å; S409-D413 PolarHBondContact O-N 2.84Å; S409-D413 PolarHBondContact OG-OD2 3.45Å; D413-R415 VanDerWaalsContact C-N 3.33Å; D413-R415 PolarHBondContact O-N 2.86Å; D413-K416 PolarHBondContact O-N 3.01Å; D413-K416 IonicContact OD1-NZ 3.15Å; D413-K416 PolarHBondContact OD1-NZ 3.4Å; D413-R417 VanDerWaalsContact O-CB 3.31Å; D413-R417 WeakPolarHBondContact O-CB 3.09Å; D413-R417 PolarHBondContact O-N 3.08Å
414	L	86.1	Confident	86.9	Confident	29 Å²	29	48 Å²	48	15%	0.152	24%	0.236	C	C	.	.	H	α-helix	trans	-60.8	-40.6	169.4	178.7	57.5	0	0	0	111.9	L325 C328 Q410 R417 K418	L325-L414 HydrophobicContact CB-CD2 4.26Å; L325-L414 HydrophobicContact CD2-CD2 3.87Å; L325-L414 WeakPolarHBondContact O-CD2 3.43Å; C328-L414 HydrophobicContact CB-CD2 3.91Å; C328-L414 HydrophobicContact CB-CG 4.22Å; Q410-L414 WeakPolarHBondContact O-CB 3.42Å; Q410-L414 PolarHBondContact O-N 3.01Å; L414-R417 PolarHBondContact O-N 3.06Å; L414-K418 HydrophobicContact CD1-CG 4.15Å; L414-K418 PolarHBondContact O-N 3.04Å
415	R	84	Confident	86.5	Confident	72 Å²	72	49.6 Å²	49.6	27%	0.272	24%	0.244	S	C	.	.	H	α-helix	trans	-65.6	-43.6	176.3	-176.2	175.9	173.8	175.1	-4.8	111.9	H331 P332 C411 Q412 D413 R417 K418 N419	H331-R415 PolarHBondContact NE2-NH2 3.09Å; P332-R415 HydrophobicContact CG-CG 4.22Å; C411-R415 WeakPolarHBondContact O-CB 3.47Å; C411-R415 PolarHBondContact O-N 3.46Å; Q412-R415 PolarHBondContact O-N 3.1Å; D413-R415 VanDerWaalsContact C-N 3.33Å; D413-R415 PolarHBondContact O-N 2.86Å; R415-R417 VanDerWaalsContact C-N 3.34Å; R415-R417 PolarHBondContact O-N 3.13Å; R415-K418 PolarHBondContact O-N 2.84Å; R415-N419 VanDerWaalsContact O-CB 3.31Å; R415-N419 WeakPolarHBondContact O-CB 3.49Å; R415-N419 PolarHBondContact O-N 2.72Å
416	K	85.8	Confident	85.9	Confident	125 Å²	125	49 Å²	49	54%	0.543	25%	0.253	S	S	.	.	H	α-helix	trans	-56.9	-48.8	172.7	-67.5	165.7	-158.6	163.5	0	110.5	Q412 D413 N419 L420	Q412-K416 WeakPolarHBondContact O-CG 3.39Å; Q412-K416 PolarHBondContact O-N 3.49Å; D413-K416 PolarHBondContact O-N 3.01Å; D413-K416 IonicContact OD1-NZ 3.15Å; D413-K416 PolarHBondContact OD1-NZ 3.4Å; K416-N419 PolarHBondContact O-N 3.45Å; K416-L420 PolarHBondContact O-N 2.8Å
417	R	85.1	Confident	85.5	Confident	51 Å²	51	49.3 Å²	49.3	19%	0.192	25%	0.248	C	C	.	.	H	α-helix	trans	-59.8	-46.9	-179.6	-167.3	-174.8	-63.6	140.8	-6	112.6	D413 L414 R415 L420 E421 Y445 T446 E532	D413-R417 VanDerWaalsContact O-CB 3.31Å; D413-R417 WeakPolarHBondContact O-CB 3.09Å; D413-R417 PolarHBondContact O-N 3.08Å; L414-R417 PolarHBondContact O-N 3.06Å; R415-R417 VanDerWaalsContact C-N 3.34Å; R415-R417 PolarHBondContact O-N 3.13Å; R417-L420 PolarHBondContact O-N 3.41Å; R417-E421 WeakPolarHBondContact O-CB 3.31Å; R417-E421 PolarHBondContact O-N 3.33Å; R417-Y445 PolarHBondContact NH2-OH 3.39Å; R417-Y445 VanDerWaalsContact NH2-OH 3.16Å; R417-T446 WeakPolarHBondContact CD-O 3.47Å; R417-T446 WeakPolarHBondContact CG-O 3.33Å; R417-E532 IonicContact CZ-OE2 3.55Å; R417-E532 IonicContact NH1-OE1 3.16Å; R417-E532 IonicContact NH1-OE2 2.68Å; R417-E532 IonicContact NH2-OE1 2.87Å; R417-E532 IonicContact NH2-OE2 2.72Å; R417-E532 PolarHBondContact NH2-OE2 2.93Å
418	K	87.1	Confident	85	Confident	31 Å²	31	55.1 Å²	55.1	14%	0.135	29%	0.286	C	S	.	.	H	α-helix	trans	-73.2	-28.5	178.2	-76.3	-67.4	-177.4	-160.2	0	113.5	P332 L414 R415 E421 L422 V443	P332-K418 HydrophobicContact CB-CB 4.45Å; P332-K418 HydrophobicContact CG-CB 4.02Å; L414-K418 HydrophobicContact CD1-CG 4.15Å; L414-K418 PolarHBondContact O-N 3.04Å; R415-K418 PolarHBondContact O-N 2.84Å; K418-E421 WeakPolarHBondContact CD-OE1 3.37Å; K418-E421 WeakPolarHBondContact CD-OE2 3.33Å; K418-E421 IonicContact NZ-OE1 3.79Å; K418-E421 PolarHBondContact NZ-OE1 3.13Å; K418-E421 IonicContact NZ-OE2 3.64Å; K418-E421 PolarHBondContact NZ-OE2 2.8Å; K418-L422 WeakPolarHBondContact O-CG 3.44Å; K418-L422 PolarHBondContact O-N 2.81Å; K418-V443 PolarHBondContact NZ-O 3.45Å
419	N	86.5	Confident	84.7	Confident	92 Å²	92	55 Å²	55	49%	0.492	29%	0.285	S	S	.	.	H	α-helix	trans	-66.9	-43.3	170.5	-165.6	83.7	0	0	0	111.8	R415 K416 L422 Q423	R415-N419 VanDerWaalsContact O-CB 3.31Å; R415-N419 WeakPolarHBondContact O-CB 3.49Å; R415-N419 PolarHBondContact O-N 2.72Å; K416-N419 PolarHBondContact O-N 3.45Å; N419-L422 PolarHBondContact O-N 3.13Å; N419-Q423 WeakPolarHBondContact O-CB 3.28Å; N419-Q423 PolarHBondContact O-N 3.25Å
420	L	85.2	Confident	84.2	Confident	31 Å²	31	57.3 Å²	57.3	16%	0.162	29%	0.285	C	S	.	.	H	α-helix	trans	-62.5	-43.8	174.3	175.7	62.2	0	0	0	112	K416 R417 L422 Q423 I424 T446 Y463 F483	K416-L420 PolarHBondContact O-N 2.8Å; R417-L420 PolarHBondContact O-N 3.41Å; L420-L422 PolarHBondContact O-N 3.45Å; L420-Q423 PolarHBondContact O-N 3.46Å; L420-I424 HydrophobicContact CD1-CD1 3.92Å; L420-I424 HydrophobicContact CD1-CG1 4.32Å; L420-I424 HydrophobicContact CG-CD1 4.03Å; L420-I424 WeakPolarHBondContact O-CG1 3.14Å; L420-I424 PolarHBondContact O-N 3.11Å; L420-T446 HydrophobicContact CD2-CG2 4.22Å; L420-T446 HydrophobicContact CG-CG2 4.32Å; L420-Y463 HydrophobicContact CD1-CD1 4.18Å; L420-Y463 HydrophobicContact CD1-CE1 3.96Å; L420-Y463 HydrophobicContact CD2-CD1 3.99Å; L420-Y463 HydrophobicContact CD2-CE1 4Å; L420-F483 HydrophobicContact CD1-CE1 4.44Å; L420-F483 HydrophobicContact CD1-CZ 4.11Å
421	E	86.8	Confident	83.8	Confident	17 Å²	17	56.1 Å²	56.1	8%	0.079	29%	0.294	C	S	.	.	H	α-helix	trans	-57.1	-46.8	174.4	-178.8	-179.9	121.3	0	0	112.1	R417 K418 I424 L425 V443 M465	R417-E421 WeakPolarHBondContact O-CB 3.31Å; R417-E421 PolarHBondContact O-N 3.33Å; K418-E421 WeakPolarHBondContact CD-OE1 3.37Å; K418-E421 WeakPolarHBondContact CD-OE2 3.33Å; K418-E421 IonicContact NZ-OE1 3.79Å; K418-E421 PolarHBondContact NZ-OE1 3.13Å; K418-E421 IonicContact NZ-OE2 3.64Å; K418-E421 PolarHBondContact NZ-OE2 2.8Å; E421-I424 PolarHBondContact O-N 3.1Å; E421-L425 HydrophobicContact CG-CD1 4.08Å; E421-L425 WeakPolarHBondContact O-CB 3.25Å; E421-L425 VanDerWaalsContact O-CG 3.26Å; E421-L425 WeakPolarHBondContact O-CG 3.3Å; E421-L425 PolarHBondContact O-N 3.14Å; E421-V443 HydrophobicContact CG-CB 4.03Å; E421-V443 HydrophobicContact CG-CG1 4.16Å; E421-V443 HydrophobicContact CG-CG2 4.04Å; E421-V443 WeakPolarHBondContact OE2-CG1 3.29Å; E421-M465 HydrophobicContact CG-CE 3.99Å
422	L	84.1	Confident	83.5	Confident	38 Å²	38	58.6 Å²	58.6	20%	0.199	30%	0.303	C	S	.	.	H	α-helix	trans	-66.9	-39.6	176.9	-73.3	171.8	0	0	0	112.8	P332 K418 N419 L420 I424 L425 S426	P332-L422 HydrophobicContact CB-CD1 3.51Å; P332-L422 WeakPolarHBondContact O-CD1 3.27Å; K418-L422 WeakPolarHBondContact O-CG 3.44Å; K418-L422 PolarHBondContact O-N 2.81Å; N419-L422 PolarHBondContact O-N 3.13Å; L420-L422 PolarHBondContact O-N 3.45Å; L422-I424 VanDerWaalsContact C-N 3.32Å; L422-I424 PolarHBondContact O-N 3.44Å; L422-L425 CarbonylContact O-C 3.56Å; L422-L425 PolarHBondContact O-N 3.36Å; L422-L425 VanDerWaalsContact O-N 3.15Å; L422-S426 WeakPolarHBondContact O-CB 3.45Å; L422-S426 PolarHBondContact O-N 3.49Å; L422-S426 PolarHBondContact O-OG 3.46Å; L422-S426 VanDerWaalsContact O-OG 3.12Å
423	Q	84.4	Confident	82.5	Confident	78 Å²	78	62.9 Å²	62.9	36%	0.364	32%	0.323	S	S	.	.	H	α-helix	trans	-59.9	-43	176.4	-171.9	-176	-6.6	0	0	111.3	N419 L420 L425 S426 E427 F483	N419-Q423 WeakPolarHBondContact O-CB 3.28Å; N419-Q423 PolarHBondContact O-N 3.25Å; L420-Q423 PolarHBondContact O-N 3.46Å; Q423-L425 VanDerWaalsContact C-N 3.32Å; Q423-L425 PolarHBondContact O-N 3.5Å; Q423-S426 PolarHBondContact O-N 2.7Å; Q423-S426 PolarHBondContact O-OG 3.41Å; Q423-E427 HydrophobicContact CG-CG 4.3Å; Q423-E427 VanDerWaalsContact CG-OE1 3.29Å; Q423-E427 WeakPolarHBondContact CG-OE1 3.43Å; Q423-E427 PolarHBondContact NE2-OE1 3.01Å; Q423-E427 WeakPolarHBondContact O-CB 3.43Å; Q423-E427 WeakPolarHBondContact O-CG 3.47Å; Q423-E427 PolarHBondContact O-N 2.91Å; Q423-F483 HydrophobicContact CG-CE2 4.2Å
424	I	85.3	Confident	81.6	Confident	1 Å²	1	63.1 Å²	63.1	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-69.1	-31.5	176.6	-62.3	162.6	0	0	0	111.8	L420 E421 L422 V429 M437 T446 M465 L474 F483	L420-I424 HydrophobicContact CD1-CD1 3.92Å; L420-I424 HydrophobicContact CD1-CG1 4.32Å; L420-I424 HydrophobicContact CG-CD1 4.03Å; L420-I424 WeakPolarHBondContact O-CG1 3.14Å; L420-I424 PolarHBondContact O-N 3.11Å; E421-I424 PolarHBondContact O-N 3.1Å; L422-I424 VanDerWaalsContact C-N 3.32Å; L422-I424 PolarHBondContact O-N 3.44Å; I424-V429 HydrophobicContact CG2-CG2 4.24Å; I424-M437 HydrophobicContact CG2-SD 4.23Å; I424-T446 HydrophobicContact CD1-CG2 4.49Å; I424-M465 HydrophobicContact CB-CE 4.31Å; I424-M465 HydrophobicContact CB-SD 3.95Å; I424-M465 HydrophobicContact CD1-CG 4.42Å; I424-M465 HydrophobicContact CD1-SD 3.91Å; I424-M465 HydrophobicContact CG2-CE 4.23Å; I424-M465 HydrophobicContact CG2-SD 3.4Å; I424-M465 WeakPolarHBondContact CG2-SD 3.44Å; I424-L474 HydrophobicContact CG2-CD1 3.35Å; I424-F483 HydrophobicContact CD1-CE1 4.15Å; I424-F483 HydrophobicContact CD1-CZ 4.27Å; I424-F483 HydrophobicContact CG1-CD1 4.1Å; I424-F483 HydrophobicContact CG1-CD2 3.92Å; I424-F483 HydrophobicContact CG1-CE1 3.79Å; I424-F483 HydrophobicContact CG1-CE2 3.62Å; I424-F483 HydrophobicContact CG1-CG 4.16Å; I424-F483 HydrophobicContact CG1-CZ 3.55Å
425	L	81.6	Confident	80.9	Confident	34 Å²	34	67.9 Å²	67.9	18%	0.178	37%	0.365	C	S	.	.	H	α-helix	trans	-83.1	-9.2	177.7	-69.6	173.2	0	0	0	114.6	E421 L422 Q423 M437 K438 V443 M465	E421-L425 HydrophobicContact CG-CD1 4.08Å; E421-L425 WeakPolarHBondContact O-CB 3.25Å; E421-L425 VanDerWaalsContact O-CG 3.26Å; E421-L425 WeakPolarHBondContact O-CG 3.3Å; E421-L425 PolarHBondContact O-N 3.14Å; L422-L425 CarbonylContact O-C 3.56Å; L422-L425 PolarHBondContact O-N 3.36Å; L422-L425 VanDerWaalsContact O-N 3.15Å; Q423-L425 VanDerWaalsContact C-N 3.32Å; Q423-L425 PolarHBondContact O-N 3.5Å; L425-M437 HydrophobicContact CD2-CB 3.96Å; L425-M437 HydrophobicContact CD2-CG 3.75Å; L425-M437 HydrophobicContact CD2-SD 3.93Å; L425-K438 HydrophobicContact CD2-CG 4.4Å; L425-K438 WeakPolarHBondContact O-CE 3.49Å; L425-V443 HydrophobicContact CD1-CG2 4.2Å; L425-M465 HydrophobicContact CD2-CE 4.48Å; L425-M465 HydrophobicContact CG-CE 4.23Å
426	S	77.6	Confident	80.3	Confident	84 Å²	84	68.4 Å²	68.4	59%	0.587	38%	0.379	S	S	*	.	H	α-helix	trans	-106.9	-34.7	175.1	66.1	0	0	0	0	112.9	L422 Q423	L422-S426 WeakPolarHBondContact O-CB 3.45Å; L422-S426 PolarHBondContact O-N 3.49Å; L422-S426 PolarHBondContact O-OG 3.46Å; L422-S426 VanDerWaalsContact O-OG 3.12Å; Q423-S426 PolarHBondContact O-N 2.7Å; Q423-S426 PolarHBondContact O-OG 3.41Å
427	E	81.3	Confident	79.9	Confident	58 Å²	58	63.1 Å²	63.1	27%	0.271	36%	0.357	S	S	.	.	S	Bend	trans	-74.5	142.5	176.2	-74.2	-173.6	-156.7	0	0	113.1	Q423 V429 G482	Q423-E427 HydrophobicContact CG-CG 4.3Å; Q423-E427 VanDerWaalsContact CG-OE1 3.29Å; Q423-E427 WeakPolarHBondContact CG-OE1 3.43Å; Q423-E427 PolarHBondContact NE2-OE1 3.01Å; Q423-E427 WeakPolarHBondContact O-CB 3.43Å; Q423-E427 WeakPolarHBondContact O-CG 3.47Å; Q423-E427 PolarHBondContact O-N 2.91Å; E427-V429 PolarHBondContact O-N 3.46Å; E427-G482 WeakPolarHBondContact OE2-CA 3.15Å
428	P	77.8	Confident	79.4	Confident	121 Å²	121	67.6 Å²	67.6	79%	0.786	38%	0.378	S	S	*	.			trans	-74.5	93.7	176.1	30.3	-34.4	0	0	0	111.7	R430	P428-R430 PolarHBondContact O-N 2.68Å
429	V	83.7	Confident	78.8	Confident	17 Å²	17	69.8 Å²	69.8	10%	0.103	40%	0.396	C	S	.	.			trans	-57.9	119.9	176.8	-177.2	0	0	0	0	111.4	I424 E427 W432 M437 L474 F483	I424-V429 HydrophobicContact CG2-CG2 4.24Å; E427-V429 PolarHBondContact O-N 3.46Å; V429-W432 HydrophobicContact CB-CB 4.34Å; V429-W432 WeakPolarHBondContact O-CB 3.33Å; V429-W432 PolarHBondContact O-N 3.46Å; V429-M437 HydrophobicContact CB-CE 4.35Å; V429-M437 HydrophobicContact CG2-CE 3.85Å; V429-L474 HydrophobicContact CG1-CD2 3.79Å; V429-F483 HydrophobicContact CG1-CB 4.37Å; V429-F483 HydrophobicContact CG2-CB 4.27Å
430	R	79.6	Confident	78.2	Confident	106 Å²	106	67.6 Å²	67.6	40%	0.4	39%	0.385	S	S	.	.	B	Isolated β-bridge	trans	-72.3	134.2	-178.6	-65	-159.8	-61.1	-94.1	-1.4	111.7	P428 W432 S477 S481 F483 I484 Y485	P428-R430 PolarHBondContact O-N 2.68Å; R430-W432 VanDerWaalsContact C-N 3.32Å; R430-S477 VanDerWaalsContact NH2-CB 3.28Å; R430-S477 PolarHBondContact NH2-OG 3.42Å; R430-S481 PolarHBondContact NH1-O 3.3Å; R430-S481 PolarHBondContact NH1-OG 3.33Å; R430-F483 PolarHBondContact N-O 3.31Å; R430-I484 WeakPolarHBondContact O-CA 3.3Å; R430-Y485 PolarHBondContact O-N 3.26Å
431	G	77.8	Confident	77.8	Confident	54 Å²	54	67.8 Å²	67.8	56%	0.557	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.3	8.1	-177.5	0	0	0	0	0	114.2	E433 Y485	G431-E433 PolarHBondContact O-N 3.18Å; G431-Y485 WeakPolarHBondContact O-CD1 3.28Å
432	W	81.9	Confident	77.3	Confident	55 Å²	55	74.9 Å²	74.9	21%	0.208	43%	0.427	C	S	.	.			trans	-72.5	116.6	171.4	-176.7	-106.7	0	0	0	111	V429 R430 D435 M437 L440 L472 Y485	V429-W432 HydrophobicContact CB-CB 4.34Å; V429-W432 WeakPolarHBondContact O-CB 3.33Å; V429-W432 PolarHBondContact O-N 3.46Å; R430-W432 VanDerWaalsContact C-N 3.32Å; W432-D435 PolarHBondContact NE1-O 2.92Å; W432-M437 HydrophobicContact CD2-CE 4.18Å; W432-M437 HydrophobicContact CE3-CE 4.12Å; W432-M437 HydrophobicContact CZ3-CE 4.45Å; W432-L440 HydrophobicContact CH2-CD1 3.82Å; W432-L440 HydrophobicContact CZ2-CD1 4.14Å; W432-L472 HydrophobicContact CE3-CD1 4.38Å; W432-L472 HydrophobicContact CH2-CD1 4.37Å; W432-L472 HydrophobicContact CZ3-CD1 3.61Å; W432-Y485 AromaticContact CE3-CD2 3.71Å; W432-Y485 HydrophobicContact CE3-CD2 3.71Å; W432-Y485 AromaticContact CE3-CE2 3.93Å; W432-Y485 HydrophobicContact CE3-CE2 3.93Å; W432-Y485 HydrophobicContact CE3-CG 4.19Å; W432-Y485 AromaticContact CZ3-CD2 3.9Å; W432-Y485 HydrophobicContact CZ3-CD2 3.9Å; W432-Y485 AromaticContact CZ3-CE2 3.69Å; W432-Y485 HydrophobicContact CZ3-CE2 3.69Å
433	E	66.4	Low	77.2	Confident	170 Å²	170	73.3 Å²	73.3	79%	0.794	42%	0.419	S	S	*	.			trans	-115.7	108.6	174.7	-67.1	-174.5	172.9	0	0	110	G431	G431-E433 PolarHBondContact O-N 3.18Å
434	G	66.6	Low	77.1	Confident	62 Å²	62	71.5 Å²	71.5	64%	0.639	42%	0.418	S	S	*	.	S	Bend	trans	151.9	-172.5	179.9	0	0	0	0	0	112.6
435	D	69.9	Low	77.1	Confident	129 Å²	129	71.7 Å²	71.7	69%	0.69	42%	0.418	S	S	*	.	S	Bend	trans	-60.4	165.6	171.8	-61.5	-67.5	0	0	0	112.2	W432 M437 S439	W432-D435 PolarHBondContact NE1-O 2.92Å; D435-M437 PolarHBondContact O-N 2.97Å; D435-S439 WeakPolarHBondContact CB-OG 3.32Å
436	S	71.9	Confident	77.4	Confident	82 Å²	82	70.1 Å²	70.1	57%	0.573	41%	0.41	S	S	*	.			trans	-50.6	137.7	176.7	-179.8	0	0	0	0	111.2	K438 S439	S436-K438 PolarHBondContact O-N 3.33Å; S436-S439 VanDerWaalsContact O-CB 3.25Å; S436-S439 WeakPolarHBondContact O-CB 3.47Å; S436-S439 PolarHBondContact O-N 2.8Å; S436-S439 PolarHBondContact O-OG 3.23Å
437	M	76.5	Confident	77.9	Confident	15 Å²	15	67 Å²	67	7%	0.074	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-56.7	-25.9	-176.6	-166.2	173.6	-66.5	0	0	113.2	I424 L425 V429 W432 D435 S439 L440 M465 F467 L472	I424-M437 HydrophobicContact CG2-SD 4.23Å; L425-M437 HydrophobicContact CD2-CB 3.96Å; L425-M437 HydrophobicContact CD2-CG 3.75Å; L425-M437 HydrophobicContact CD2-SD 3.93Å; V429-M437 HydrophobicContact CB-CE 4.35Å; V429-M437 HydrophobicContact CG2-CE 3.85Å; W432-M437 HydrophobicContact CD2-CE 4.18Å; W432-M437 HydrophobicContact CE3-CE 4.12Å; W432-M437 HydrophobicContact CZ3-CE 4.45Å; D435-M437 PolarHBondContact O-N 2.97Å; M437-S439 PolarHBondContact O-N 2.88Å; M437-L440 HydrophobicContact CG-CD1 3.91Å; M437-L440 WeakPolarHBondContact O-CB 3.44Å; M437-L440 WeakPolarHBondContact O-CG 3.49Å; M437-L440 PolarHBondContact O-N 3.2Å; M437-M465 HydrophobicContact SD-SD 4.35Å; M437-F467 HydrophobicContact CG-CE1 4.43Å; M437-F467 HydrophobicContact CG-CE2 4.47Å; M437-F467 HydrophobicContact CG-CZ 3.74Å; M437-F467 HydrophobicContact SD-CZ 4.2Å; M437-L472 HydrophobicContact CE-CD2 3.57Å; M437-L472 HydrophobicContact CG-CD2 4.33Å; M437-L472 HydrophobicContact SD-CD2 3.47Å; M437-L472 WeakPolarHBondContact SD-CD2 3.45Å
438	K	74.6	Confident	78.2	Confident	145 Å²	145	67.9 Å²	67.9	63%	0.63	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-63.1	-19.1	173.3	-58.8	-177	-178.9	-176.9	0	113.7	L425 S436 L440	L425-K438 HydrophobicContact CD2-CG 4.4Å; L425-K438 WeakPolarHBondContact O-CE 3.49Å; S436-K438 PolarHBondContact O-N 3.33Å; K438-L440 VanDerWaalsContact C-N 3.33Å
439	S	75.9	Confident	78.7	Confident	76 Å²	76	62.2 Å²	62.2	53%	0.531	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-75.4	-16.8	176.2	69	0	0	0	0	114.2	D435 S436 M437 G441	D435-S439 WeakPolarHBondContact CB-OG 3.32Å; S436-S439 VanDerWaalsContact O-CB 3.25Å; S436-S439 WeakPolarHBondContact O-CB 3.47Å; S436-S439 PolarHBondContact O-N 2.8Å; S436-S439 PolarHBondContact O-OG 3.23Å; M437-S439 PolarHBondContact O-N 2.88Å; S439-G441 PolarHBondContact O-N 2.86Å
440	L	73.8	Confident	78.9	Confident	47 Å²	47	65.1 Å²	65.1	25%	0.246	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-71.3	-8.6	178.1	-58.8	175.7	0	0	0	112.9	W432 M437 K438 F467	W432-L440 HydrophobicContact CH2-CD1 3.82Å; W432-L440 HydrophobicContact CZ2-CD1 4.14Å; M437-L440 HydrophobicContact CG-CD1 3.91Å; M437-L440 WeakPolarHBondContact O-CB 3.44Å; M437-L440 WeakPolarHBondContact O-CG 3.49Å; M437-L440 PolarHBondContact O-N 3.2Å; K438-L440 VanDerWaalsContact C-N 3.33Å; L440-F467 HydrophobicContact CB-CB 4.18Å; L440-F467 HydrophobicContact CB-CD1 3.38Å; L440-F467 HydrophobicContact CB-CD2 4.37Å; L440-F467 HydrophobicContact CB-CE1 3.73Å; L440-F467 HydrophobicContact CB-CG 3.73Å; L440-F467 HydrophobicContact CB-CZ 4.38Å; L440-F467 HydrophobicContact CD1-CD1 4.29Å; L440-F467 HydrophobicContact CD1-CD2 4.02Å; L440-F467 HydrophobicContact CD1-CE1 4.12Å; L440-F467 HydrophobicContact CD1-CE2 3.88Å; L440-F467 HydrophobicContact CD1-CG 4.22Å; L440-F467 HydrophobicContact CD1-CZ 3.93Å; L440-F467 HydrophobicContact CG-CD1 4.48Å
441	G	75.9	Confident	79.2	Confident	35 Å²	35	60.6 Å²	60.6	36%	0.361	35%	0.352	S	S	.	.			trans	104.5	-175.5	-177.1	0	0	0	0	0	112.9	S439 F467	S439-G441 PolarHBondContact O-N 2.86Å; G441-F467 WeakPolarHBondContact O-CD1 3.44Å
442	Q	77.1	Confident	79.6	Confident	166 Å²	166	62 Å²	62	78%	0.776	34%	0.34	S	S	*	.			trans	-70.2	134.9	175.2	-171.6	176.9	17.5	0	0	110.4	A444 P468	Q442-A444 PolarHBondContact O-N 3.39Å; Q442-P468 WeakPolarHBondContact O-CD 3.31Å
443	V	82.6	Confident	79.4	Confident	5 Å²	5	62.5 Å²	62.5	3%	0.03	35%	0.347	C	S	.	.			trans	-72.6	119.7	176.6	-175.7	0	0	0	0	109.4	K418 E421 L425 Y445 T446 M465 F467	K418-V443 PolarHBondContact NZ-O 3.45Å; E421-V443 HydrophobicContact CG-CB 4.03Å; E421-V443 HydrophobicContact CG-CG1 4.16Å; E421-V443 HydrophobicContact CG-CG2 4.04Å; E421-V443 WeakPolarHBondContact OE2-CG1 3.29Å; L425-V443 HydrophobicContact CD1-CG2 4.2Å; V443-Y445 WeakPolarHBondContact CG1-O 3.38Å; V443-T446 VanDerWaalsContact CG1-OG1 3.31Å; V443-T446 WeakPolarHBondContact CG1-OG1 3.5Å; V443-M465 HydrophobicContact CG1-CB 4.43Å; V443-M465 HydrophobicContact CG1-CE 4.28Å; V443-M465 HydrophobicContact CG2-CE 3.85Å; V443-F467 HydrophobicContact CG2-CD1 3.99Å; V443-F467 HydrophobicContact CG2-CE1 3.42Å; V443-F467 VanDerWaalsContact CG2-CE1 3.42Å; V443-F467 HydrophobicContact CG2-CE2 4.45Å; V443-F467 HydrophobicContact CG2-CZ 3.68Å
444	A	81.6	Confident	79.4	Confident	40 Å²	40	57.2 Å²	57.2	33%	0.331	34%	0.338	S	S	.	.			trans	-76.9	-40	178.8	0	0	0	0	0	111.7	Q442 L466	Q442-A444 PolarHBondContact O-N 3.39Å; A444-L466 HydrophobicContact CB-CD2 4.2Å; A444-L466 HydrophobicContact CB-CG 4.32Å; A444-L466 PolarHBondContact N-O 3.22Å
445	Y	84.3	Confident	79.1	Confident	5 Å²	5	58.5 Å²	58.5	2%	0.02	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	149.2	178.9	-161.9	-102.2	0	0	0	111.7	R417 V443 L466 E532 W533 H536	R417-Y445 PolarHBondContact NH2-OH 3.39Å; R417-Y445 VanDerWaalsContact NH2-OH 3.16Å; V443-Y445 WeakPolarHBondContact CG1-O 3.38Å; Y445-L466 PolarHBondContact O-N 3.29Å; Y445-E532 HydrophobicContact CE2-CB 3.76Å; Y445-E532 HydrophobicContact CE2-CG 4.36Å; Y445-E532 VanDerWaalsContact CE2-OE2 3.28Å; Y445-E532 WeakPolarHBondContact CE2-OE2 3.31Å; Y445-E532 VanDerWaalsContact CZ-OE2 3.29Å; Y445-E532 PolarHBondContact OH-OE2 3.04Å; Y445-W533 AromaticContact CD1-CD2 3.84Å; Y445-W533 HydrophobicContact CD1-CD2 3.84Å; Y445-W533 AromaticContact CD1-CE2 3.59Å; Y445-W533 HydrophobicContact CD1-CE3 4.14Å; Y445-W533 HydrophobicContact CD1-CG 4.42Å; Y445-W533 AromaticContact CD1-CH2 3.94Å; Y445-W533 HydrophobicContact CD1-CH2 3.94Å; Y445-W533 AromaticContact CD1-CZ2 3.64Å; Y445-W533 HydrophobicContact CD1-CZ2 3.64Å; Y445-W533 HydrophobicContact CD1-CZ3 4.19Å; Y445-W533 AromaticContact CE1-CD1 3.92Å; Y445-W533 HydrophobicContact CE1-CD2 4.02Å; Y445-W533 AromaticContact CE1-CE2 3.61Å; Y445-W533 HydrophobicContact CE1-CG 4.2Å; Y445-W533 AromaticContact CE1-CZ2 3.99Å; Y445-W533 HydrophobicContact CE1-CZ2 3.99Å; Y445-W533 AromaticContact CE1-NE1 3.58Å; Y445-H536 AromaticContact CD2-CD2 3.34Å; Y445-H536 WeakPolarHBondContact CD2-CD2 3.34Å; Y445-H536 AromaticContact CD2-NE2 3.44Å; Y445-H536 WeakPolarHBondContact CD2-NE2 3.29Å; Y445-H536 AromaticContact CG-CD2 3.75Å
446	T	87.9	Confident	78.9	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	137.8	175.4	-62.6	0	0	0	0	108.8	R417 L420 I424 V443 L464 M465	R417-T446 WeakPolarHBondContact CD-O 3.47Å; R417-T446 WeakPolarHBondContact CG-O 3.33Å; L420-T446 HydrophobicContact CD2-CG2 4.22Å; L420-T446 HydrophobicContact CG-CG2 4.32Å; I424-T446 HydrophobicContact CD1-CG2 4.49Å; V443-T446 VanDerWaalsContact CG1-OG1 3.31Å; V443-T446 WeakPolarHBondContact CG1-OG1 3.5Å; T446-L464 WeakPolarHBondContact CA-O 3.36Å; T446-M465 HydrophobicContact CG2-CG 3.94Å
447	S	88.4	Confident	78.8	Confident	18 Å²	18	59.2 Å²	59.2	13%	0.126	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	162.1	169.3	-164.4	0	0	0	0	113.6	L464 E529	S447-L464 PolarHBondContact N-O 2.77Å; S447-L464 PolarHBondContact O-N 3.43Å; S447-E529 VanDerWaalsContact CB-OE1 3.25Å; S447-E529 WeakPolarHBondContact CB-OE1 3.43Å; S447-E529 VanDerWaalsContact OG-CD 3.26Å; S447-E529 PolarHBondContact OG-OE1 3.43Å
448	Q	88.3	Confident	78.8	Confident	78 Å²	78	65.6 Å²	65.6	36%	0.364	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	112.2	172	-179.7	171.9	-20.7	0	0	108	E461 Y463	Q448-E461 HydrophobicContact CG-CG 4.2Å; Q448-E461 VanDerWaalsContact NE2-CD 3.32Å; Q448-E461 PolarHBondContact NE2-OE1 3.23Å; Q448-Y463 HydrophobicContact CB-CD1 3.91Å; Q448-Y463 HydrophobicContact CB-CE1 3.69Å; Q448-Y463 VanDerWaalsContact CD-OH 3.28Å; Q448-Y463 HydrophobicContact CG-CD1 4.23Å; Q448-Y463 HydrophobicContact CG-CE1 3.71Å; Q448-Y463 PolarHBondContact OE1-OH 2.68Å
449	V	88.5	Confident	79.3	Confident	1 Å²	1	63.1 Å²	63.1	1%	0.006	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	159.5	-171.4	-71.2	0	0	0	0	111.1	V451 R462 L464 V522 E529	V449-V451 HydrophobicContact CG2-CG2 3.95Å; V449-R462 PolarHBondContact N-O 2.81Å; V449-R462 PolarHBondContact O-N 2.68Å; V449-L464 HydrophobicContact CG2-CB 4.28Å; V449-L464 HydrophobicContact CG2-CD1 3.56Å; V449-L464 HydrophobicContact CG2-CG 3.54Å; V449-V522 HydrophobicContact CB-CG1 3.88Å; V449-V522 HydrophobicContact CG1-CG1 4.04Å; V449-V522 HydrophobicContact CG2-CG1 3.85Å; V449-E529 WeakPolarHBondContact CG1-OE1 3.37Å
450	H	87.4	Confident	79.7	Confident	79 Å²	79	63.6 Å²	63.6	37%	0.366	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	122.7	170	-72.5	69	0	0	0	108.8	K459 E460 F523	H450-K459 HydrophobicContact CB-CB 4.28Å; H450-K459 HydrophobicContact CB-CD 4.48Å; H450-E460 CarbonylContact C-O 3.58Å; H450-E460 WeakPolarHBondContact CA-O 3.24Å; H450-F523 HydrophobicContact CB-CB 4.15Å; H450-F523 PolarHBondContact N-O 3.37Å; H450-F523 VanDerWaalsContact N-O 3.08Å; H450-F523 WeakPolarHBondContact O-CB 3.45Å; H450-F523 WeakPolarHBondContact O-CD2 3.5Å; H450-F523 PolarHBondContact O-N 3.14Å
451	V	87	Confident	80.4	Confident	10 Å²	10	65.9 Å²	65.9	6%	0.061	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	136.6	179.3	-176.6	0	0	0	0	109.3	V449 E460 R462 F520 S521 V522	V449-V451 HydrophobicContact CG2-CG2 3.95Å; V451-E460 PolarHBondContact N-O 2.95Å; V451-E460 PolarHBondContact O-N 3.01Å; V451-R462 HydrophobicContact CB-CB 4.46Å; V451-R462 HydrophobicContact CB-CG 4.04Å; V451-R462 HydrophobicContact CG2-CB 3.93Å; V451-R462 HydrophobicContact CG2-CG 4.07Å; V451-F520 HydrophobicContact CG1-CB 4.42Å; V451-F520 HydrophobicContact CG1-CD2 4.38Å; V451-S521 WeakPolarHBondContact CA-O 3.24Å; V451-V522 HydrophobicContact CG2-CG2 4.46Å
452	R	85.1	Confident	81.1	Confident	83 Å²	83	65.9 Å²	65.9	31%	0.313	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	119	167.1	-179	-172.1	-75.5	157.2	-13.4	108.6	S456 E457 F520 S521 F523	R452-S456 WeakPolarHBondContact CD-O 3.25Å; R452-S456 WeakPolarHBondContact CG-O 3.42Å; R452-E457 VanDerWaalsContact CZ-O 3.31Å; R452-E457 PolarHBondContact NE-O 3.12Å; R452-E457 PolarHBondContact NH2-O 2.88Å; R452-F520 WeakPolarHBondContact O-CA 3.4Å; R452-S521 PolarHBondContact N-O 3.33Å; R452-S521 PolarHBondContact O-N 3.49Å; R452-F523 HydrophobicContact CB-CE2 3.83Å
453	N	78.2	Confident	81.7	Confident	67 Å²	67	59.3 Å²	59.3	36%	0.358	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	141.3	166.5	-173.4	12.2	0	0	0	109.3	A455 S456	N453-A455 PolarHBondContact O-N 3.22Å; N453-S456 PolarHBondContact O-N 2.98Å; N453-S456 VanDerWaalsContact O-O 3.04Å
454	G	66	Low	82	Confident	59 Å²	59	59.1 Å²	59.1	61%	0.608	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-10.6	-174.7	0	0	0	0	0	116.4	R519	G454-R519 WeakPolarHBondContact CA-O 3.37Å; G454-R519 PolarHBondContact N-O 2.88Å
455	A	61.1	Low	82.4	Confident	89 Å²	89	57.2 Å²	57.2	74%	0.736	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-0.5	173.9	0	0	0	0	0	114.8	N453	N453-A455 PolarHBondContact O-N 3.22Å
456	S	64.6	Low	82.5	Confident	53 Å²	53	57 Å²	57	37%	0.371	30%	0.3	S	S	.	.			trans	-134.9	145.4	178.2	-174	0	0	0	0	111.3	R452 N453 E458	R452-S456 WeakPolarHBondContact CD-O 3.25Å; R452-S456 WeakPolarHBondContact CG-O 3.42Å; N453-S456 PolarHBondContact O-N 2.98Å; N453-S456 VanDerWaalsContact O-O 3.04Å; S456-E458 PolarHBondContact OG-N 3.13Å
457	E	69.4	Low	82.4	Confident	173 Å²	173	57 Å²	57	81%	0.808	30%	0.3	S	S	*	.	S	Bend	trans	-85.6	-24.1	172.3	-62.7	-161.4	141.3	0	0	112.7	R452	R452-E457 VanDerWaalsContact CZ-O 3.31Å; R452-E457 PolarHBondContact NE-O 3.12Å; R452-E457 PolarHBondContact NH2-O 2.88Å
458	E	77.6	Confident	82.1	Confident	149 Å²	149	58.3 Å²	58.3	70%	0.696	31%	0.309	S	S	*	.	S	Bend	trans	-66.2	142.8	-178.9	-64.4	-170.4	155.2	0	0	111.4	S456	S456-E458 PolarHBondContact OG-N 3.13Å
459	K	83.8	Confident	81.8	Confident	93 Å²	93	59.7 Å²	59.7	40%	0.404	32%	0.318	S	S	.	.			trans	-95.7	110.9	173.9	-72.2	-173.7	179.1	-174.1	0	108.3	H450 F523	H450-K459 HydrophobicContact CB-CB 4.28Å; H450-K459 HydrophobicContact CB-CD 4.48Å; K459-F523 HydrophobicContact CD-CD2 4Å; K459-F523 HydrophobicContact CD-CE2 4.22Å; K459-F523 HydrophobicContact CD-CG 4.45Å; K459-F523 HydrophobicContact CG-CD2 4.24Å; K459-F523 HydrophobicContact CG-CE2 4.21Å
460	E	85.6	Confident	81.7	Confident	85 Å²	85	61.1 Å²	61.1	40%	0.397	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	134	176.9	-60.4	-177.4	118.1	0	0	110.4	H450 V451 R462	H450-E460 CarbonylContact C-O 3.58Å; H450-E460 WeakPolarHBondContact CA-O 3.24Å; V451-E460 PolarHBondContact N-O 2.95Å; V451-E460 PolarHBondContact O-N 3.01Å; E460-R462 HydrophobicContact CB-CG 4.22Å; E460-R462 VanDerWaalsContact CD-CZ 3.49Å; E460-R462 PolarHBondContact O-N 2.76Å; E460-R462 IonicContact OE1-CZ 3Å; E460-R462 IonicContact OE1-NH2 3.68Å; E460-R462 PolarHBondContact OE1-NH2 2.76Å; E460-R462 IonicContact OE2-CZ 3.18Å; E460-R462 IonicContact OE2-NE 3.54Å; E460-R462 PolarHBondContact OE2-NE 2.99Å; E460-R462 VanDerWaalsContact OE2-NE 3.1Å; E460-R462 IonicContact OE2-NH2 3.63Å; E460-R462 PolarHBondContact OE2-NH2 2.68Å
461	E	88.9	Confident	81.6	Confident	95 Å²	95	57.4 Å²	57.4	44%	0.444	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	118.9	170.9	-174.8	170.7	-125.4	0	0	110.2	Q448	Q448-E461 HydrophobicContact CG-CG 4.2Å; Q448-E461 VanDerWaalsContact NE2-CD 3.32Å; Q448-E461 PolarHBondContact NE2-OE1 3.23Å
462	R	89.7	Confident	81.7	Confident	36 Å²	36	57 Å²	57	14%	0.136	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	146	-175.8	-56.1	-61.4	-167.8	-178	14.6	110.4	V449 V451 E460 L474 S475 Q486	V449-R462 PolarHBondContact N-O 2.81Å; V449-R462 PolarHBondContact O-N 2.68Å; V451-R462 HydrophobicContact CB-CB 4.46Å; V451-R462 HydrophobicContact CB-CG 4.04Å; V451-R462 HydrophobicContact CG2-CB 3.93Å; V451-R462 HydrophobicContact CG2-CG 4.07Å; E460-R462 HydrophobicContact CB-CG 4.22Å; E460-R462 VanDerWaalsContact CD-CZ 3.49Å; E460-R462 PolarHBondContact O-N 2.76Å; E460-R462 IonicContact OE1-CZ 3Å; E460-R462 IonicContact OE1-NH2 3.68Å; E460-R462 PolarHBondContact OE1-NH2 2.76Å; E460-R462 IonicContact OE2-CZ 3.18Å; E460-R462 IonicContact OE2-NE 3.54Å; E460-R462 PolarHBondContact OE2-NE 2.99Å; E460-R462 VanDerWaalsContact OE2-NE 3.1Å; E460-R462 IonicContact OE2-NH2 3.63Å; E460-R462 PolarHBondContact OE2-NH2 2.68Å; R462-L474 CarbonylContact C-O 3.58Å; R462-L474 WeakPolarHBondContact CA-O 3.11Å; R462-S475 VanDerWaalsContact NH1-CB 3.32Å; R462-Q486 VanDerWaalsContact NH1-CD 3.28Å; R462-Q486 VanDerWaalsContact NH1-NE2 3.15Å
463	Y	90.1	Very high	81.9	Confident	27 Å²	27	55.1 Å²	55.1	11%	0.106	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	123	169.9	-65.6	-88.7	0	0	0	108.6	L420 Q448 L474 A476 F483	L420-Y463 HydrophobicContact CD1-CD1 4.18Å; L420-Y463 HydrophobicContact CD1-CE1 3.96Å; L420-Y463 HydrophobicContact CD2-CD1 3.99Å; L420-Y463 HydrophobicContact CD2-CE1 4Å; Q448-Y463 HydrophobicContact CB-CD1 3.91Å; Q448-Y463 HydrophobicContact CB-CE1 3.69Å; Q448-Y463 VanDerWaalsContact CD-OH 3.28Å; Q448-Y463 HydrophobicContact CG-CD1 4.23Å; Q448-Y463 HydrophobicContact CG-CE1 3.71Å; Q448-Y463 PolarHBondContact OE1-OH 2.68Å; Y463-L474 PolarHBondContact N-O 2.99Å; Y463-L474 PolarHBondContact O-N 2.98Å; Y463-A476 HydrophobicContact CE2-CB 4.15Å; Y463-F483 HydrophobicContact CD1-CE1 4.43Å; Y463-F483 HydrophobicContact CD2-CD1 4.11Å; Y463-F483 AromaticContact CD2-CE1 3.97Å; Y463-F483 HydrophobicContact CD2-CE1 3.97Å; Y463-F483 HydrophobicContact CE1-CE1 4.42Å; Y463-F483 HydrophobicContact CE2-CD1 4.39Å; Y463-F483 AromaticContact CE2-CE1 3.97Å; Y463-F483 HydrophobicContact CE2-CE1 3.97Å; Y463-F483 HydrophobicContact CG-CE1 4.21Å
464	L	89	Confident	82.4	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.005	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	132.9	175.2	-67.9	-172.3	0	0	0	110.2	T446 S447 V449 L471 L472 M473 V522 W533	T446-L464 WeakPolarHBondContact CA-O 3.36Å; S447-L464 PolarHBondContact N-O 2.77Å; S447-L464 PolarHBondContact O-N 3.43Å; V449-L464 HydrophobicContact CG2-CB 4.28Å; V449-L464 HydrophobicContact CG2-CD1 3.56Å; V449-L464 HydrophobicContact CG2-CG 3.54Å; L464-L471 HydrophobicContact CB-CD1 4.18Å; L464-L471 HydrophobicContact CD1-CD1 4.47Å; L464-L471 HydrophobicContact CD1-CD2 4.49Å; L464-L471 HydrophobicContact CD2-CD1 4.45Å; L464-L471 HydrophobicContact CD2-CG 4.47Å; L464-L472 WeakPolarHBondContact CA-O 3.33Å; L464-M473 HydrophobicContact CD2-CB 4.15Å; L464-M473 HydrophobicContact CD2-CG 3.59Å; L464-M473 HydrophobicContact CD2-SD 4.27Å; L464-V522 HydrophobicContact CD1-CG1 4.07Å; L464-V522 HydrophobicContact CD1-CG2 4.14Å; L464-W533 HydrophobicContact CB-CH2 3.54Å; L464-W533 HydrophobicContact CB-CZ2 3.62Å; L464-W533 HydrophobicContact CD1-CH2 4.15Å; L464-W533 HydrophobicContact CD1-CZ2 4.09Å; L464-W533 HydrophobicContact CG-CZ2 4.48Å
465	M	88.8	Confident	83.5	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	124.9	171.7	-58.5	177.4	78.9	0	0	110.1	E421 I424 L425 M437 V443 T446 F467 L472 L474	E421-M465 HydrophobicContact CG-CE 3.99Å; I424-M465 HydrophobicContact CB-CE 4.31Å; I424-M465 HydrophobicContact CB-SD 3.95Å; I424-M465 HydrophobicContact CD1-CG 4.42Å; I424-M465 HydrophobicContact CD1-SD 3.91Å; I424-M465 HydrophobicContact CG2-CE 4.23Å; I424-M465 HydrophobicContact CG2-SD 3.4Å; I424-M465 WeakPolarHBondContact CG2-SD 3.44Å; L425-M465 HydrophobicContact CD2-CE 4.48Å; L425-M465 HydrophobicContact CG-CE 4.23Å; M437-M465 HydrophobicContact SD-SD 4.35Å; V443-M465 HydrophobicContact CG1-CB 4.43Å; V443-M465 HydrophobicContact CG1-CE 4.28Å; V443-M465 HydrophobicContact CG2-CE 3.85Å; T446-M465 HydrophobicContact CG2-CG 3.94Å; M465-F467 HydrophobicContact CB-CD2 4.46Å; M465-F467 HydrophobicContact CB-CE2 3.84Å; M465-F467 HydrophobicContact CE-CZ 4.31Å; M465-L472 HydrophobicContact CB-CB 4.25Å; M465-L472 HydrophobicContact CB-CD2 4.5Å; M465-L472 PolarHBondContact N-O 3.05Å; M465-L472 PolarHBondContact O-N 2.8Å; M465-L472 HydrophobicContact SD-CD2 4.19Å; M465-L474 HydrophobicContact SD-CD1 4.19Å
466	L	86.6	Confident	84.8	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	109.3	-177.8	-173.6	67.8	0	0	0	110.2	A444 Y445 L471 L491 W533 H536 L537	A444-L466 HydrophobicContact CB-CD2 4.2Å; A444-L466 HydrophobicContact CB-CG 4.32Å; A444-L466 PolarHBondContact N-O 3.22Å; Y445-L466 PolarHBondContact O-N 3.29Å; L466-L471 HydrophobicContact CB-CD1 4.42Å; L466-L471 HydrophobicContact CD1-CB 4.43Å; L466-L471 HydrophobicContact CD1-CD1 4.12Å; L466-L491 HydrophobicContact CD1-CD1 3.66Å; L466-L491 HydrophobicContact CD1-CD2 3.84Å; L466-L491 HydrophobicContact CD1-CG 4.34Å; L466-W533 HydrophobicContact CB-CH2 4.46Å; L466-W533 HydrophobicContact CB-CZ3 4.06Å; L466-W533 HydrophobicContact CD2-CZ3 4.4Å; L466-H536 HydrophobicContact CD2-CB 3.74Å; L466-L537 HydrophobicContact CD1-CD2 3.7Å; L466-L537 HydrophobicContact CD2-CD2 4.22Å
467	F	87.4	Confident	85.7	Confident	1 Å²	1	44.8 Å²	44.8	0%	0.004	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	161	168.5	-61.9	-94.1	0	0	0	109.9	M437 L440 G441 V443 M465 N469 V470 L472 L491	M437-F467 HydrophobicContact CG-CE1 4.43Å; M437-F467 HydrophobicContact CG-CE2 4.47Å; M437-F467 HydrophobicContact CG-CZ 3.74Å; M437-F467 HydrophobicContact SD-CZ 4.2Å; L440-F467 HydrophobicContact CB-CB 4.18Å; L440-F467 HydrophobicContact CB-CD1 3.38Å; L440-F467 HydrophobicContact CB-CD2 4.37Å; L440-F467 HydrophobicContact CB-CE1 3.73Å; L440-F467 HydrophobicContact CB-CG 3.73Å; L440-F467 HydrophobicContact CB-CZ 4.38Å; L440-F467 HydrophobicContact CD1-CD1 4.29Å; L440-F467 HydrophobicContact CD1-CD2 4.02Å; L440-F467 HydrophobicContact CD1-CE1 4.12Å; L440-F467 HydrophobicContact CD1-CE2 3.88Å; L440-F467 HydrophobicContact CD1-CG 4.22Å; L440-F467 HydrophobicContact CD1-CZ 3.93Å; L440-F467 HydrophobicContact CG-CD1 4.48Å; G441-F467 WeakPolarHBondContact O-CD1 3.44Å; V443-F467 HydrophobicContact CG2-CD1 3.99Å; V443-F467 HydrophobicContact CG2-CE1 3.42Å; V443-F467 VanDerWaalsContact CG2-CE1 3.42Å; V443-F467 HydrophobicContact CG2-CE2 4.45Å; V443-F467 HydrophobicContact CG2-CZ 3.68Å; M465-F467 HydrophobicContact CB-CD2 4.46Å; M465-F467 HydrophobicContact CB-CE2 3.84Å; M465-F467 HydrophobicContact CE-CZ 4.31Å; F467-N469 PolarHBondContact O-N 3.34Å; F467-V470 WeakPolarHBondContact CA-O 3.3Å; F467-V470 HydrophobicContact CB-CB 4.44Å; F467-V470 WeakPolarHBondContact CB-O 3.41Å; F467-V470 PolarHBondContact N-O 2.72Å; F467-V470 PolarHBondContact O-N 2.85Å; F467-V470 VanDerWaalsContact O-N 3.09Å; F467-L472 HydrophobicContact CD2-CB 4.18Å; F467-L472 HydrophobicContact CE2-CB 3.92Å; F467-L472 HydrophobicContact CE2-CD2 3.81Å; F467-L472 HydrophobicContact CZ-CD2 4.46Å; F467-L491 WeakPolarHBondContact O-CD1 3.29Å
468	P	81.7	Confident	86.2	Confident	46 Å²	46	42.6 Å²	42.6	30%	0.299	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-13.2	-166.4	-26.3	36.8	0	0	0	116.6	Q442 Y540	Q442-P468 WeakPolarHBondContact O-CD 3.31Å; P468-Y540 WeakPolarHBondContact O-CE1 3.48Å
469	N	81.1	Confident	86.2	Confident	106 Å²	106	46.1 Å²	46.1	57%	0.567	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-132.7	-0.8	174.4	-65.8	-68.2	0	0	0	113.4	F467 S490 L491	F467-N469 PolarHBondContact O-N 3.34Å; N469-S490 PolarHBondContact O-OG 3.46Å; N469-L491 PolarHBondContact O-N 3.07Å
470	V	86	Confident	85.8	Confident	32 Å²	32	49.7 Å²	49.7	19%	0.194	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	124.8	-166.6	-177.9	0	0	0	0	110.9	F467 K488 L489	F467-V470 WeakPolarHBondContact CA-O 3.3Å; F467-V470 HydrophobicContact CB-CB 4.44Å; F467-V470 WeakPolarHBondContact CB-O 3.41Å; F467-V470 PolarHBondContact N-O 2.72Å; F467-V470 PolarHBondContact O-N 2.85Å; F467-V470 VanDerWaalsContact O-N 3.09Å; V470-K488 HydrophobicContact CG1-CB 3.82Å; V470-K488 HydrophobicContact CG1-CG 4.45Å; V470-L489 CarbonylContact C-O 3.58Å; V470-L489 WeakPolarHBondContact CA-O 3.27Å
471	L	86.4	Confident	85.4	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	119.8	163.2	-178.9	64.1	0	0	0	109	L464 L466 K488 L489 L491 I512 F520 W533	L464-L471 HydrophobicContact CB-CD1 4.18Å; L464-L471 HydrophobicContact CD1-CD1 4.47Å; L464-L471 HydrophobicContact CD1-CD2 4.49Å; L464-L471 HydrophobicContact CD2-CD1 4.45Å; L464-L471 HydrophobicContact CD2-CG 4.47Å; L466-L471 HydrophobicContact CB-CD1 4.42Å; L466-L471 HydrophobicContact CD1-CB 4.43Å; L466-L471 HydrophobicContact CD1-CD1 4.12Å; L471-K488 CarbonylContact O-C 3.51Å; L471-K488 WeakPolarHBondContact O-CA 3.47Å; L471-L489 HydrophobicContact CB-CB 4.44Å; L471-L489 PolarHBondContact N-O 3.44Å; L471-L489 PolarHBondContact O-N 3.44Å; L471-L491 HydrophobicContact CB-CD2 4.09Å; L471-I512 HydrophobicContact CD2-CD1 3.98Å; L471-F520 HydrophobicContact CD2-CE2 4.07Å; L471-F520 HydrophobicContact CD2-CZ 4.12Å; L471-W533 HydrophobicContact CD1-CH2 4.01Å; L471-W533 HydrophobicContact CD1-CZ3 3.94Å
472	L	88.1	Confident	85.1	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	138.1	177.7	-179.7	67.7	0	0	0	110.3	W432 M437 L464 M465 F467 L474 Y485 K488	W432-L472 HydrophobicContact CE3-CD1 4.38Å; W432-L472 HydrophobicContact CH2-CD1 4.37Å; W432-L472 HydrophobicContact CZ3-CD1 3.61Å; M437-L472 HydrophobicContact CE-CD2 3.57Å; M437-L472 HydrophobicContact CG-CD2 4.33Å; M437-L472 HydrophobicContact SD-CD2 3.47Å; M437-L472 WeakPolarHBondContact SD-CD2 3.45Å; L464-L472 WeakPolarHBondContact CA-O 3.33Å; M465-L472 HydrophobicContact CB-CB 4.25Å; M465-L472 HydrophobicContact CB-CD2 4.5Å; M465-L472 PolarHBondContact N-O 3.05Å; M465-L472 PolarHBondContact O-N 2.8Å; M465-L472 HydrophobicContact SD-CD2 4.19Å; F467-L472 HydrophobicContact CD2-CB 4.18Å; F467-L472 HydrophobicContact CE2-CB 3.92Å; F467-L472 HydrophobicContact CE2-CD2 3.81Å; F467-L472 HydrophobicContact CZ-CD2 4.46Å; L472-L474 HydrophobicContact CD1-CD2 4.16Å; L472-L474 HydrophobicContact CD2-CD1 4.11Å; L472-L474 HydrophobicContact CD2-CD2 4.08Å; L472-L474 HydrophobicContact CD2-CG 4.14Å; L472-L474 HydrophobicContact CG-CD2 3.98Å; L472-L474 HydrophobicContact CG-CG 4.08Å; L472-Y485 HydrophobicContact CD1-CD2 3.76Å; L472-Y485 HydrophobicContact CD1-CE2 3.62Å; L472-K488 HydrophobicContact CD1-CB 4.32Å
473	M	89	Confident	85	Confident	44 Å²	44	43.9 Å²	43.9	22%	0.217	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	120.8	179	-51.6	-165.7	-70.8	0	0	110.5	L464 Q486 G487	L464-M473 HydrophobicContact CD2-CB 4.15Å; L464-M473 HydrophobicContact CD2-CG 3.59Å; L464-M473 HydrophobicContact CD2-SD 4.27Å; M473-Q486 HydrophobicContact CB-CB 4.5Å; M473-Q486 PolarHBondContact O-N 3.37Å; M473-G487 PolarHBondContact N-O 3.07Å; M473-G487 PolarHBondContact O-N 3.06Å; M473-G487 VanDerWaalsContact O-N 3.16Å
474	L	89.8	Confident	84.9	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	168.4	-179.4	-52.8	178.7	0	0	0	110.9	I424 V429 R462 Y463 M465 L472 I484 Y485	I424-L474 HydrophobicContact CG2-CD1 3.35Å; V429-L474 HydrophobicContact CG1-CD2 3.79Å; R462-L474 CarbonylContact C-O 3.58Å; R462-L474 WeakPolarHBondContact CA-O 3.11Å; Y463-L474 PolarHBondContact N-O 2.99Å; Y463-L474 PolarHBondContact O-N 2.98Å; M465-L474 HydrophobicContact SD-CD1 4.19Å; L472-L474 HydrophobicContact CD1-CD2 4.16Å; L472-L474 HydrophobicContact CD2-CD1 4.11Å; L472-L474 HydrophobicContact CD2-CD2 4.08Å; L472-L474 HydrophobicContact CD2-CG 4.14Å; L472-L474 HydrophobicContact CG-CD2 3.98Å; L472-L474 HydrophobicContact CG-CG 4.08Å; L474-I484 CarbonylContact C-O 3.56Å; L474-I484 VanDerWaalsContact CA-O 3.28Å; L474-I484 WeakPolarHBondContact CA-O 3.41Å; L474-Y485 HydrophobicContact CD2-CD2 4.08Å
475	S	89.6	Confident	84.8	Confident	9 Å²	9	47.4 Å²	47.4	6%	0.063	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	152	171.8	63.7	0	0	0	0	111.8	R462 I484 Q486	R462-S475 VanDerWaalsContact NH1-CB 3.32Å; S475-I484 PolarHBondContact N-O 3.07Å; S475-I484 PolarHBondContact O-N 3.32Å; S475-Q486 PolarHBondContact OG-NE2 2.86Å
476	A	87.8	Confident	84.7	Confident	39 Å²	39	51.6 Å²	51.6	32%	0.322	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	147.5	170.3	0	0	0	0	0	111.7	Y463	Y463-A476 HydrophobicContact CE2-CB 4.15Å
477	S	82.6	Confident	84.5	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.021	28%	0.279	C	S	.	.			trans	-64.9	130.1	163.7	177.4	0	0	0	0	109.9	R430 R479 M480 S481 G482	R430-S477 VanDerWaalsContact NH2-CB 3.28Å; R430-S477 PolarHBondContact NH2-OG 3.42Å; S477-R479 PolarHBondContact O-N 3.06Å; S477-R479 PolarHBondContact OG-N 3.28Å; S477-M480 PolarHBondContact O-N 2.94Å; S477-S481 PolarHBondContact OG-OG 2.96Å; S477-G482 WeakPolarHBondContact CB-O 3.41Å; S477-G482 PolarHBondContact N-O 3.12Å
478	P	79.7	Confident	84.4	Confident	127 Å²	127	57.5 Å²	57.5	83%	0.825	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-0.9	170.7	-24.9	35.2	0	0	0	115
479	R	79.6	Confident	84.3	Confident	223 Å²	223	55.8 Å²	55.8	84%	0.842	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.5	16.4	172.8	-57.7	-176.6	-177	174.2	1.1	112.6	S477 S481	S477-R479 PolarHBondContact O-N 3.06Å; S477-R479 PolarHBondContact OG-N 3.28Å; R479-S481 PolarHBondContact O-N 3.34Å
480	M	75.2	Confident	84.3	Confident	169 Å²	169	53.7 Å²	53.7	83%	0.833	28%	0.284	S	S	*	.	S	Bend	trans	54.5	9.3	-173.6	-58.3	-59.9	-75	0	0	115.7	S477 G482	S477-M480 PolarHBondContact O-N 2.94Å; M480-G482 VanDerWaalsContact C-N 3.25Å; M480-G482 PolarHBondContact O-N 2.74Å
481	S	75.5	Confident	83.9	Confident	64 Å²	64	52.5 Å²	52.5	45%	0.448	28%	0.276	S	S	.	.	S	Bend	trans	-83.4	56.6	-178.2	55.6	0	0	0	0	113	R430 S477 R479	R430-S481 PolarHBondContact NH1-O 3.3Å; R430-S481 PolarHBondContact NH1-OG 3.33Å; S477-S481 PolarHBondContact OG-OG 2.96Å; R479-S481 PolarHBondContact O-N 3.34Å
482	G	82.4	Confident	83.2	Confident	17 Å²	17	57.6 Å²	57.6	18%	0.175	31%	0.308	C	S	.	.	S	Bend	trans	73.8	-169.3	177.8	0	0	0	0	0	115.9	E427 S477 M480	E427-G482 WeakPolarHBondContact OE2-CA 3.15Å; S477-G482 WeakPolarHBondContact CB-O 3.41Å; S477-G482 PolarHBondContact N-O 3.12Å; M480-G482 VanDerWaalsContact C-N 3.25Å; M480-G482 PolarHBondContact O-N 2.74Å
483	F	88.5	Confident	82.2	Confident	13 Å²	13	60.4 Å²	60.4	6%	0.057	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	154.8	-168.3	-57.2	-89.1	0	0	0	114.2	L420 Q423 I424 V429 R430 Y463	L420-F483 HydrophobicContact CD1-CE1 4.44Å; L420-F483 HydrophobicContact CD1-CZ 4.11Å; Q423-F483 HydrophobicContact CG-CE2 4.2Å; I424-F483 HydrophobicContact CD1-CE1 4.15Å; I424-F483 HydrophobicContact CD1-CZ 4.27Å; I424-F483 HydrophobicContact CG1-CD1 4.1Å; I424-F483 HydrophobicContact CG1-CD2 3.92Å; I424-F483 HydrophobicContact CG1-CE1 3.79Å; I424-F483 HydrophobicContact CG1-CE2 3.62Å; I424-F483 HydrophobicContact CG1-CG 4.16Å; I424-F483 HydrophobicContact CG1-CZ 3.55Å; V429-F483 HydrophobicContact CG1-CB 4.37Å; V429-F483 HydrophobicContact CG2-CB 4.27Å; R430-F483 PolarHBondContact N-O 3.31Å; Y463-F483 HydrophobicContact CD1-CE1 4.43Å; Y463-F483 HydrophobicContact CD2-CD1 4.11Å; Y463-F483 AromaticContact CD2-CE1 3.97Å; Y463-F483 HydrophobicContact CD2-CE1 3.97Å; Y463-F483 HydrophobicContact CE1-CE1 4.42Å; Y463-F483 HydrophobicContact CE2-CD1 4.39Å; Y463-F483 AromaticContact CE2-CE1 3.97Å; Y463-F483 HydrophobicContact CE2-CE1 3.97Å; Y463-F483 HydrophobicContact CG-CE1 4.21Å
484	I	87.3	Confident	81.6	Confident	41 Å²	41	58.8 Å²	58.8	21%	0.21	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	132.6	175.4	-52.5	176.3	0	0	0	108.9	R430 L474 S475	R430-I484 WeakPolarHBondContact O-CA 3.3Å; L474-I484 CarbonylContact C-O 3.56Å; L474-I484 VanDerWaalsContact CA-O 3.28Å; L474-I484 WeakPolarHBondContact CA-O 3.41Å; S475-I484 PolarHBondContact N-O 3.07Å; S475-I484 PolarHBondContact O-N 3.32Å
485	Y	88.7	Confident	81	Confident	60 Å²	60	62.7 Å²	62.7	24%	0.235	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	130	172.9	172.8	-108.7	0	0	0	111.4	R430 G431 W432 L472 L474 G487 K488	R430-Y485 PolarHBondContact O-N 3.26Å; G431-Y485 WeakPolarHBondContact O-CD1 3.28Å; W432-Y485 AromaticContact CE3-CD2 3.71Å; W432-Y485 HydrophobicContact CE3-CD2 3.71Å; W432-Y485 AromaticContact CE3-CE2 3.93Å; W432-Y485 HydrophobicContact CE3-CE2 3.93Å; W432-Y485 HydrophobicContact CE3-CG 4.19Å; W432-Y485 AromaticContact CZ3-CD2 3.9Å; W432-Y485 HydrophobicContact CZ3-CD2 3.9Å; W432-Y485 AromaticContact CZ3-CE2 3.69Å; W432-Y485 HydrophobicContact CZ3-CE2 3.69Å; L472-Y485 HydrophobicContact CD1-CD2 3.76Å; L472-Y485 HydrophobicContact CD1-CE2 3.62Å; L474-Y485 HydrophobicContact CD2-CD2 4.08Å; Y485-G487 VanDerWaalsContact CE2-O 3.31Å; Y485-G487 WeakPolarHBondContact CE2-O 3.49Å; Y485-K488 HydrophobicContact CE2-CB 4.23Å; Y485-K488 WeakPolarHBondContact OH-CG 3.31Å; Y485-K488 PolarHBondContact OH-N 2.87Å
486	Q	84.8	Confident	80.6	Confident	88 Å²	88	63.8 Å²	63.8	41%	0.411	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	-32.6	178.4	-64.7	-69	-14.7	0	0	112.1	R462 M473 S475	R462-Q486 VanDerWaalsContact NH1-CD 3.28Å; R462-Q486 VanDerWaalsContact NH1-NE2 3.15Å; M473-Q486 HydrophobicContact CB-CB 4.5Å; M473-Q486 PolarHBondContact O-N 3.37Å; S475-Q486 PolarHBondContact OG-NE2 2.86Å
487	G	83.9	Confident	80.3	Confident	12 Å²	12	65.5 Å²	65.5	12%	0.124	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.9	173	175.6	0	0	0	0	0	113.8	M473 Y485	M473-G487 PolarHBondContact N-O 3.07Å; M473-G487 PolarHBondContact O-N 3.06Å; M473-G487 VanDerWaalsContact O-N 3.16Å; Y485-G487 VanDerWaalsContact CE2-O 3.31Å; Y485-G487 WeakPolarHBondContact CE2-O 3.49Å
488	K	84.4	Confident	80.2	Confident	113 Å²	113	72.3 Å²	72.3	49%	0.491	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	140	171.4	71.3	-166.8	176.2	-169.1	0	109.9	V470 L471 L472 Y485	V470-K488 HydrophobicContact CG1-CB 3.82Å; V470-K488 HydrophobicContact CG1-CG 4.45Å; L471-K488 CarbonylContact O-C 3.51Å; L471-K488 WeakPolarHBondContact O-CA 3.47Å; L472-K488 HydrophobicContact CD1-CB 4.32Å; Y485-K488 HydrophobicContact CE2-CB 4.23Å; Y485-K488 WeakPolarHBondContact OH-CG 3.31Å; Y485-K488 PolarHBondContact OH-N 2.87Å
489	L	81.1	Confident	79.8	Confident	10 Å²	10	68.4 Å²	68.4	5%	0.052	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	127.9	-174.6	-161.4	129.9	0	0	0	109	V470 L471 T494 V517 F520	V470-L489 CarbonylContact C-O 3.58Å; V470-L489 WeakPolarHBondContact CA-O 3.27Å; L471-L489 HydrophobicContact CB-CB 4.44Å; L471-L489 PolarHBondContact N-O 3.44Å; L471-L489 PolarHBondContact O-N 3.44Å; L489-T494 HydrophobicContact CD2-CG2 4Å; L489-V517 HydrophobicContact CD1-CB 4.06Å; L489-V517 HydrophobicContact CD1-CG1 3.82Å; L489-V517 HydrophobicContact CD1-CG2 3.83Å; L489-V517 HydrophobicContact CG-CG2 4.42Å; L489-F520 HydrophobicContact CD1-CD1 4.24Å; L489-F520 HydrophobicContact CD1-CE1 3.35Å; L489-F520 HydrophobicContact CD1-CZ 3.69Å; L489-F520 HydrophobicContact CD2-CE1 4.05Å; L489-F520 HydrophobicContact CD2-CZ 4Å; L489-F520 HydrophobicContact CG-CE1 4.33Å; L489-F520 HydrophobicContact CG-CZ 4.38Å
490	S	81.1	Confident	78.7	Confident	62 Å²	62	64 Å²	64	43%	0.434	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	136.8	176.7	-170.4	0	0	0	0	110.3	N469 T492 T494	N469-S490 PolarHBondContact O-OG 3.46Å; S490-T492 PolarHBondContact O-N 3.06Å; S490-T492 PolarHBondContact OG-N 3.14Å; S490-T494 PolarHBondContact O-OG1 2.87Å
491	L	76.1	Confident	77.7	Confident	7 Å²	7	62.5 Å²	62.5	4%	0.037	35%	0.35	C	S	.	.	S	Bend	trans	-73.7	-18.3	176.2	-60.1	174.4	0	0	0	112	L466 F467 N469 L471 G493 T494 L537 Y540	L466-L491 HydrophobicContact CD1-CD1 3.66Å; L466-L491 HydrophobicContact CD1-CD2 3.84Å; L466-L491 HydrophobicContact CD1-CG 4.34Å; F467-L491 WeakPolarHBondContact O-CD1 3.29Å; N469-L491 PolarHBondContact O-N 3.07Å; L471-L491 HydrophobicContact CB-CD2 4.09Å; L491-G493 PolarHBondContact O-N 3.4Å; L491-T494 WeakPolarHBondContact O-CB 3.28Å; L491-T494 PolarHBondContact O-N 3.4Å; L491-L537 HydrophobicContact CD2-CD2 3.99Å; L491-Y540 HydrophobicContact CB-CD1 4.37Å; L491-Y540 HydrophobicContact CB-CG 4.15Å; L491-Y540 HydrophobicContact CD1-CD1 4.12Å; L491-Y540 HydrophobicContact CD1-CD2 3.84Å; L491-Y540 HydrophobicContact CD1-CE1 4.27Å; L491-Y540 HydrophobicContact CD1-CE2 3.99Å; L491-Y540 HydrophobicContact CD1-CG 3.9Å
492	T	72.4	Confident	76.4	Confident	109 Å²	109	68 Å²	68	67%	0.669	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	112.2	-179.5	-51.8	0	0	0	0	111.4	S490	S490-T492 PolarHBondContact O-N 3.06Å; S490-T492 PolarHBondContact OG-N 3.14Å
493	G	66.6	Low	74.6	Confident	59 Å²	59	69.5 Å²	69.5	61%	0.608	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	25.5	-179.5	0	0	0	0	0	113.9	L491 G515	L491-G493 PolarHBondContact O-N 3.4Å; G493-G515 PolarHBondContact O-N 3.43Å
494	T	77.7	Confident	72.6	Confident	10 Å²	10	79.1 Å²	79.1	6%	0.061	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	122.9	179.6	-71	0	0	0	0	110.7	L489 S490 L491 I512 T513 G514	L489-T494 HydrophobicContact CD2-CG2 4Å; S490-T494 PolarHBondContact O-OG1 2.87Å; L491-T494 WeakPolarHBondContact O-CB 3.28Å; L491-T494 PolarHBondContact O-N 3.4Å; T494-I512 HydrophobicContact CG2-CG2 3.18Å; T494-T513 CarbonylContact C-O 3.58Å; T494-T513 WeakPolarHBondContact CA-O 3.33Å; T494-G514 WeakPolarHBondContact OG1-CA 3.47Å
495	T	76.5	Confident	70.6	Confident	82 Å²	82	84.6 Å²	84.6	50%	0.503	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	131.7	178	31.3	0	0	0	0	111.4	T513	T495-T513 PolarHBondContact N-O 3.02Å; T495-T513 PolarHBondContact O-N 3.34Å; T495-T513 PolarHBondContact O-OG1 3.41Å; T495-T513 PolarHBondContact OG1-O 2.9Å; T495-T513 PolarHBondContact OG1-OG1 3.26Å
496	V	81.7	Confident	69	Low	32 Å²	32	84.2 Å²	84.2	19%	0.194	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	124.6	177.6	-178.9	0	0	0	0	109.3	F510 D511 I512 L534 L537 T541	V496-F510 HydrophobicContact CG1-CD2 3.79Å; V496-D511 WeakPolarHBondContact CA-O 3.18Å; V496-I512 HydrophobicContact CG2-CG1 4.26Å; V496-I512 HydrophobicContact CG2-CG2 4.23Å; V496-L534 HydrophobicContact CG1-CD2 3.81Å; V496-L537 HydrophobicContact CG2-CB 4.25Å; V496-L537 HydrophobicContact CG2-CD1 4.21Å; V496-T541 HydrophobicContact CB-CG2 3.88Å; V496-T541 HydrophobicContact CG2-CG2 3.71Å
497	T	80.8	Confident	68	Low	75 Å²	75	82.5 Å²	82.5	46%	0.46	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	110.3	-179.7	47.3	0	0	0	0	109.5	Q499 D511	T497-Q499 PolarHBondContact O-N 3.32Å; T497-D511 PolarHBondContact N-O 3.47Å; T497-D511 PolarHBondContact O-N 3.33Å; T497-D511 WeakPolarHBondContact OG1-CB 3.4Å
498	R	80.5	Confident	67.9	Low	145 Å²	145	87 Å²	87	55%	0.547	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	130.9	171.8	175.5	175.7	175	162.3	-0.4	109.6	V500 L534	R498-V500 HydrophobicContact CG-CG2 4.49Å; R498-L534 HydrophobicContact CB-CD1 4.28Å; R498-L534 HydrophobicContact CG-CD1 4.38Å
499	Q	70.3	Confident	67.9	Low	45 Å²	45	81.7 Å²	81.7	21%	0.21	46%	0.463	C	S	.	.			trans	-74.6	138.8	172.8	-71.7	-174.6	-18.2	0	0	109.7	T497 A509 D511 S521	T497-Q499 PolarHBondContact O-N 3.32Å; Q499-A509 HydrophobicContact CB-CB 4.17Å; Q499-A509 PolarHBondContact N-O 3.44Å; Q499-A509 VanDerWaalsContact N-O 3.08Å; Q499-D511 WeakPolarHBondContact CG-OD2 3.24Å; Q499-D511 PolarHBondContact NE2-OD1 2.74Å; Q499-D511 PolarHBondContact NE2-OD2 3.04Å; Q499-S521 PolarHBondContact NE2-OG 3.07Å
500	V	58.4	Low	68.1	Low	130 Å²	130	81.2 Å²	81.2	79%	0.788	46%	0.46	S	S	*	.			trans	-134.3	82	175.6	-175.5	0	0	0	0	106.5	R498	R498-V500 HydrophobicContact CG-CG2 4.49Å
501	E	54.2	Low	68.3	Low	138 Å²	138	78.6 Å²	78.6	65%	0.645	44%	0.441	S	S	*	.			trans	-91.9	130.3	167.9	-67.6	-168	139.3	0	0	108.7	G503	E501-G503 PolarHBondContact O-N 3.48Å
502	D	46.2	Very low	68.7	Low	180 Å²	180	78.3 Å²	78.3	96%	0.963	44%	0.44	S	S	*	.			trans	-92.7	90.3	-173.9	-159.9	13.7	0	0	0	109.3
503	G	45	Very low	68.9	Low	49 Å²	49	74.9 Å²	74.9	51%	0.505	42%	0.419	S	S	.	.	S	Bend	trans	-177.1	153.9	-176.9	0	0	0	0	0	112.9	E501 N505 A506	E501-G503 PolarHBondContact O-N 3.48Å; G503-N505 PolarHBondContact O-N 3.31Å; G503-A506 PolarHBondContact O-N 3.17Å
504	E	46.3	Very low	68.8	Low	215 Å²	215	72.5 Å²	72.5	100%	1.005	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	5.7	-166.7	-59.8	-175.8	121.9	0	0	116.1
505	N	45.8	Very low	67.8	Low	156 Å²	156	75.5 Å²	75.5	83%	0.834	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.3	31.8	-177.9	-150.9	3.5	0	0	0	112.6	G503 P507	G503-N505 PolarHBondContact O-N 3.31Å; N505-P507 VanDerWaalsContact O-CD 3.24Å; N505-P507 WeakPolarHBondContact O-CD 3.46Å
506	A	54.8	Low	66.7	Low	52 Å²	52	80.8 Å²	80.8	43%	0.43	45%	0.448	S	S	.	.			trans	-64	112.2	176.7	0	0	0	0	0	111	G503	G503-A506 PolarHBondContact O-N 3.17Å
507	P	64.9	Low	65.5	Low	51 Å²	51	82.9 Å²	82.9	33%	0.331	46%	0.461	S	S	.	.			trans	-72.5	154	176.3	33.2	-35.8	0	0	0	110.1	N505 A509 F523	N505-P507 VanDerWaalsContact O-CD 3.24Å; N505-P507 WeakPolarHBondContact O-CD 3.46Å; P507-A509 VanDerWaalsContact C-N 3.31Å; P507-A509 HydrophobicContact CG-CB 4.36Å; P507-A509 WeakPolarHBondContact O-CB 3.32Å; P507-A509 PolarHBondContact O-N 2.86Å; P507-F523 HydrophobicContact CB-CD1 3.82Å; P507-F523 HydrophobicContact CB-CE1 4.37Å; P507-F523 HydrophobicContact CG-CD1 3.56Å; P507-F523 HydrophobicContact CG-CE1 3.61Å
508	Y	80.9	Confident	64.8	Low	106 Å²	106	84.4 Å²	84.4	42%	0.416	47%	0.466	S	S	.	.	S	Bend	trans	-70	84.5	-178.8	-54.5	-62.5	0	0	0	111.2	C524 P527	Y508-C524 WeakPolarHBondContact O-CB 3.33Å; Y508-C524 PolarHBondContact O-N 3.49Å; Y508-P527 HydrophobicContact CD1-CB 3.74Å; Y508-P527 HydrophobicContact CD1-CG 4.47Å; Y508-P527 HydrophobicContact CE1-CB 3.62Å; Y508-P527 HydrophobicContact CE1-CG 3.99Å; Y508-P527 HydrophobicContact CG-CB 4.4Å
509	A	83.6	Confident	64.4	Low	3 Å²	3	83.9 Å²	83.9	3%	0.025	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	146.6	-161.8	0	0	0	0	0	114.9	Q499 P507 V522 F523	Q499-A509 HydrophobicContact CB-CB 4.17Å; Q499-A509 PolarHBondContact N-O 3.44Å; Q499-A509 VanDerWaalsContact N-O 3.08Å; P507-A509 VanDerWaalsContact C-N 3.31Å; P507-A509 HydrophobicContact CG-CB 4.36Å; P507-A509 WeakPolarHBondContact O-CB 3.32Å; P507-A509 PolarHBondContact O-N 2.86Å; A509-V522 VanDerWaalsContact CA-O 3.26Å; A509-V522 WeakPolarHBondContact CA-O 3.47Å; A509-F523 HydrophobicContact CB-CD1 3.6Å; A509-F523 HydrophobicContact CB-CE1 3.79Å
510	F	86.6	Confident	64.9	Low	0 Å²	0	82.2 Å²	82.2	0%	0	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	136.7	170.3	63.7	-73.9	0	0	0	110.7	V496 I512 V522 L530 W533 L534 L537	V496-F510 HydrophobicContact CG1-CD2 3.79Å; F510-I512 HydrophobicContact CD2-CD1 4.1Å; F510-I512 HydrophobicContact CD2-CG1 3.74Å; F510-I512 HydrophobicContact CE2-CD1 3.55Å; F510-I512 HydrophobicContact CE2-CG1 3.74Å; F510-V522 HydrophobicContact CD1-CB 3.97Å; F510-V522 HydrophobicContact CD1-CG1 4.3Å; F510-V522 HydrophobicContact CE1-CB 3.61Å; F510-V522 HydrophobicContact CE1-CG1 3.53Å; F510-V522 HydrophobicContact CE1-CG2 4.5Å; F510-V522 HydrophobicContact CE2-CB 4.21Å; F510-V522 HydrophobicContact CE2-CG2 4.3Å; F510-V522 HydrophobicContact CG-CB 4.42Å; F510-V522 HydrophobicContact CZ-CB 3.75Å; F510-V522 HydrophobicContact CZ-CG1 3.74Å; F510-V522 HydrophobicContact CZ-CG2 4.16Å; F510-V522 PolarHBondContact N-O 3.36Å; F510-V522 PolarHBondContact O-N 3.27Å; F510-L530 HydrophobicContact CB-CD1 4.03Å; F510-L530 HydrophobicContact CD1-CD1 3.47Å; F510-L530 VanDerWaalsContact CD1-CD1 3.47Å; F510-L530 HydrophobicContact CE1-CD1 4.28Å; F510-L530 HydrophobicContact CG-CD1 4.11Å; F510-W533 HydrophobicContact CE1-CB 3.84Å; F510-W533 AromaticContact CE1-CG 3.9Å; F510-W533 HydrophobicContact CE1-CG 3.9Å; F510-W533 HydrophobicContact CE2-CB 4.42Å; F510-W533 HydrophobicContact CZ-CB 3.65Å; F510-W533 AromaticContact CZ-CD2 3.91Å; F510-W533 HydrophobicContact CZ-CD2 3.91Å; F510-W533 HydrophobicContact CZ-CE3 4.27Å; F510-W533 AromaticContact CZ-CG 3.64Å; F510-W533 HydrophobicContact CZ-CG 3.64Å; F510-L534 HydrophobicContact CB-CD2 4.26Å; F510-L537 HydrophobicContact CD2-CD1 4.3Å; F510-L537 HydrophobicContact CE2-CD1 3.48Å; F510-L537 VanDerWaalsContact CE2-CD1 3.48Å; F510-L537 HydrophobicContact CZ-CD1 4.19Å
511	D	84.7	Confident	66.1	Low	6 Å²	6	76.3 Å²	76.3	3%	0.032	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	140.4	168.6	-73.6	-46.8	0	0	0	109.9	V496 T497 Q499 R519 F520 S521	V496-D511 WeakPolarHBondContact CA-O 3.18Å; T497-D511 PolarHBondContact N-O 3.47Å; T497-D511 PolarHBondContact O-N 3.33Å; T497-D511 WeakPolarHBondContact OG1-CB 3.4Å; Q499-D511 WeakPolarHBondContact CG-OD2 3.24Å; Q499-D511 PolarHBondContact NE2-OD1 2.74Å; Q499-D511 PolarHBondContact NE2-OD2 3.04Å; D511-R519 HydrophobicContact CB-CG 4.03Å; D511-R519 IonicContact OD1-CZ 3.85Å; D511-R519 IonicContact OD1-NE 3.71Å; D511-R519 IonicContact OD1-NH1 3.77Å; D511-R519 IonicContact OD2-CZ 2.71Å; D511-R519 IonicContact OD2-NE 3.82Å; D511-R519 IonicContact OD2-NH1 3.87Å; D511-R519 PolarHBondContact OD2-NH1 3.43Å; D511-F520 WeakPolarHBondContact CA-O 3.3Å; D511-S521 WeakPolarHBondContact OD1-CA 3.31Å; D511-S521 VanDerWaalsContact OD1-CB 3.32Å; D511-S521 WeakPolarHBondContact OD1-CB 3.4Å; D511-S521 PolarHBondContact OD1-OG 2.92Å
512	I	84.1	Confident	67.7	Low	2 Å²	2	69.7 Å²	69.7	1%	0.01	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	138.4	165.6	-48.7	-174.8	0	0	0	108.2	L471 T494 V496 F510 F520 V522 L537	L471-I512 HydrophobicContact CD2-CD1 3.98Å; T494-I512 HydrophobicContact CG2-CG2 3.18Å; V496-I512 HydrophobicContact CG2-CG1 4.26Å; V496-I512 HydrophobicContact CG2-CG2 4.23Å; F510-I512 HydrophobicContact CD2-CD1 4.1Å; F510-I512 HydrophobicContact CD2-CG1 3.74Å; F510-I512 HydrophobicContact CE2-CD1 3.55Å; F510-I512 HydrophobicContact CE2-CG1 3.74Å; I512-F520 HydrophobicContact CB-CD1 4.04Å; I512-F520 HydrophobicContact CB-CD2 4.2Å; I512-F520 HydrophobicContact CB-CE1 3.51Å; I512-F520 HydrophobicContact CB-CE2 3.73Å; I512-F520 HydrophobicContact CB-CG 4.37Å; I512-F520 HydrophobicContact CB-CZ 3.37Å; I512-F520 HydrophobicContact CD1-CE2 3.61Å; I512-F520 HydrophobicContact CD1-CZ 3.74Å; I512-F520 HydrophobicContact CG1-CE2 3.99Å; I512-F520 HydrophobicContact CG1-CZ 4.04Å; I512-F520 HydrophobicContact CG2-CD1 4.49Å; I512-F520 HydrophobicContact CG2-CE1 3.56Å; I512-F520 HydrophobicContact CG2-CE2 4.27Å; I512-F520 HydrophobicContact CG2-CZ 3.45Å; I512-F520 VanDerWaalsContact CG2-CZ 3.45Å; I512-F520 PolarHBondContact N-O 3.38Å; I512-F520 VanDerWaalsContact O-CD1 3.28Å; I512-F520 WeakPolarHBondContact O-CD1 3.24Å; I512-F520 PolarHBondContact O-N 3.22Å; I512-F520 VanDerWaalsContact O-N 3.1Å; I512-V522 HydrophobicContact CD1-CG2 4.33Å; I512-L537 HydrophobicContact CD1-CD1 4.09Å
513	T	76.9	Confident	69.5	Low	37 Å²	37	61.7 Å²	61.7	23%	0.227	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	105.1	-179.8	41.3	0	0	0	0	108.9	T494 T495 R519	T494-T513 CarbonylContact C-O 3.58Å; T494-T513 WeakPolarHBondContact CA-O 3.33Å; T495-T513 PolarHBondContact N-O 3.02Å; T495-T513 PolarHBondContact O-N 3.34Å; T495-T513 PolarHBondContact O-OG1 3.41Å; T495-T513 PolarHBondContact OG1-O 2.9Å; T495-T513 PolarHBondContact OG1-OG1 3.26Å; T513-R519 HydrophobicContact CG2-CB 3.9Å; T513-R519 HydrophobicContact CG2-CG 3.81Å
514	G	66	Low	71.4	Confident	8 Å²	8	60 Å²	60	8%	0.082	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	143.3	171.7	0	0	0	0	0	110.2	T494 M516 V517	T494-G514 WeakPolarHBondContact OG1-CA 3.47Å; G514-M516 PolarHBondContact O-N 3.35Å; G514-V517 PolarHBondContact O-N 2.94Å
515	G	55.9	Low	73.2	Confident	74 Å²	74	54.3 Å²	54.3	76%	0.763	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-0.5	-176	0	0	0	0	0	117.5	G493	G493-G515 PolarHBondContact O-N 3.43Å
516	M	53.2	Low	74.9	Confident	193 Å²	193	48.4 Å²	48.4	95%	0.951	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142.1	23	172.3	-65.2	-169.9	173.5	0	0	113	G514	G514-M516 PolarHBondContact O-N 3.35Å
517	V	57.2	Low	76.2	Confident	76 Å²	76	49.1 Å²	49.1	46%	0.461	28%	0.282	S	S	.	.	S	Bend	trans	-133.6	143.1	-177.2	-170.1	0	0	0	0	110.2	L489 G514	L489-V517 HydrophobicContact CD1-CB 4.06Å; L489-V517 HydrophobicContact CD1-CG1 3.82Å; L489-V517 HydrophobicContact CD1-CG2 3.83Å; L489-V517 HydrophobicContact CG-CG2 4.42Å; G514-V517 PolarHBondContact O-N 2.94Å
518	D	64.9	Low	76.9	Confident	106 Å²	106	53.4 Å²	53.4	57%	0.567	30%	0.298	S	S	*	.			trans	-53.6	151.3	171.9	-69.5	-50.3	0	0	0	112	F520	D518-F520 PolarHBondContact O-N 3.23Å
519	R	71.9	Confident	77	Confident	135 Å²	135	48.6 Å²	48.6	51%	0.509	28%	0.279	S	S	.	.			trans	-60.7	123.2	175.2	-177.2	177.2	79.3	148.6	-5.8	109.2	G454 D511 T513	G454-R519 WeakPolarHBondContact CA-O 3.37Å; G454-R519 PolarHBondContact N-O 2.88Å; D511-R519 HydrophobicContact CB-CG 4.03Å; D511-R519 IonicContact OD1-CZ 3.85Å; D511-R519 IonicContact OD1-NE 3.71Å; D511-R519 IonicContact OD1-NH1 3.77Å; D511-R519 IonicContact OD2-CZ 2.71Å; D511-R519 IonicContact OD2-NE 3.82Å; D511-R519 IonicContact OD2-NH1 3.87Å; D511-R519 PolarHBondContact OD2-NH1 3.43Å; T513-R519 HydrophobicContact CG2-CB 3.9Å; T513-R519 HydrophobicContact CG2-CG 3.81Å
520	F	80.7	Confident	77.1	Confident	9 Å²	9	48.8 Å²	48.8	4%	0.039	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	125.7	173.3	64.6	-77.7	0	0	0	110.7	V451 R452 L471 L489 D511 I512 D518 V522	V451-F520 HydrophobicContact CG1-CB 4.42Å; V451-F520 HydrophobicContact CG1-CD2 4.38Å; R452-F520 WeakPolarHBondContact O-CA 3.4Å; L471-F520 HydrophobicContact CD2-CE2 4.07Å; L471-F520 HydrophobicContact CD2-CZ 4.12Å; L489-F520 HydrophobicContact CD1-CD1 4.24Å; L489-F520 HydrophobicContact CD1-CE1 3.35Å; L489-F520 HydrophobicContact CD1-CZ 3.69Å; L489-F520 HydrophobicContact CD2-CE1 4.05Å; L489-F520 HydrophobicContact CD2-CZ 4Å; L489-F520 HydrophobicContact CG-CE1 4.33Å; L489-F520 HydrophobicContact CG-CZ 4.38Å; D511-F520 WeakPolarHBondContact CA-O 3.3Å; I512-F520 HydrophobicContact CB-CD1 4.04Å; I512-F520 HydrophobicContact CB-CD2 4.2Å; I512-F520 HydrophobicContact CB-CE1 3.51Å; I512-F520 HydrophobicContact CB-CE2 3.73Å; I512-F520 HydrophobicContact CB-CG 4.37Å; I512-F520 HydrophobicContact CB-CZ 3.37Å; I512-F520 HydrophobicContact CD1-CE2 3.61Å; I512-F520 HydrophobicContact CD1-CZ 3.74Å; I512-F520 HydrophobicContact CG1-CE2 3.99Å; I512-F520 HydrophobicContact CG1-CZ 4.04Å; I512-F520 HydrophobicContact CG2-CD1 4.49Å; I512-F520 HydrophobicContact CG2-CE1 3.56Å; I512-F520 HydrophobicContact CG2-CE2 4.27Å; I512-F520 HydrophobicContact CG2-CZ 3.45Å; I512-F520 VanDerWaalsContact CG2-CZ 3.45Å; I512-F520 PolarHBondContact N-O 3.38Å; I512-F520 VanDerWaalsContact O-CD1 3.28Å; I512-F520 WeakPolarHBondContact O-CD1 3.24Å; I512-F520 PolarHBondContact O-N 3.22Å; I512-F520 VanDerWaalsContact O-N 3.1Å; D518-F520 PolarHBondContact O-N 3.23Å; F520-V522 HydrophobicContact CD2-CG2 3.97Å; F520-V522 HydrophobicContact CE2-CG2 4.18Å
521	S	84.9	Confident	76.9	Confident	6 Å²	6	52.8 Å²	52.8	4%	0.042	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	121	176.9	-50.9	0	0	0	0	109.1	V451 R452 Q499 D511	V451-S521 WeakPolarHBondContact CA-O 3.24Å; R452-S521 PolarHBondContact N-O 3.33Å; R452-S521 PolarHBondContact O-N 3.49Å; Q499-S521 PolarHBondContact NE2-OG 3.07Å; D511-S521 WeakPolarHBondContact OD1-CA 3.31Å; D511-S521 VanDerWaalsContact OD1-CB 3.32Å; D511-S521 WeakPolarHBondContact OD1-CB 3.4Å; D511-S521 PolarHBondContact OD1-OG 2.92Å
522	V	86.3	Confident	76.9	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	127.1	173.8	-176.6	0	0	0	0	108.6	V449 V451 L464 A509 F510 I512 F520	V449-V522 HydrophobicContact CB-CG1 3.88Å; V449-V522 HydrophobicContact CG1-CG1 4.04Å; V449-V522 HydrophobicContact CG2-CG1 3.85Å; V451-V522 HydrophobicContact CG2-CG2 4.46Å; L464-V522 HydrophobicContact CD1-CG1 4.07Å; L464-V522 HydrophobicContact CD1-CG2 4.14Å; A509-V522 VanDerWaalsContact CA-O 3.26Å; A509-V522 WeakPolarHBondContact CA-O 3.47Å; F510-V522 HydrophobicContact CD1-CB 3.97Å; F510-V522 HydrophobicContact CD1-CG1 4.3Å; F510-V522 HydrophobicContact CE1-CB 3.61Å; F510-V522 HydrophobicContact CE1-CG1 3.53Å; F510-V522 HydrophobicContact CE1-CG2 4.5Å; F510-V522 HydrophobicContact CE2-CB 4.21Å; F510-V522 HydrophobicContact CE2-CG2 4.3Å; F510-V522 HydrophobicContact CG-CB 4.42Å; F510-V522 HydrophobicContact CZ-CB 3.75Å; F510-V522 HydrophobicContact CZ-CG1 3.74Å; F510-V522 HydrophobicContact CZ-CG2 4.16Å; F510-V522 PolarHBondContact N-O 3.36Å; F510-V522 PolarHBondContact O-N 3.27Å; I512-V522 HydrophobicContact CD1-CG2 4.33Å; F520-V522 HydrophobicContact CD2-CG2 3.97Å; F520-V522 HydrophobicContact CE2-CG2 4.18Å
523	F	85.6	Confident	77.1	Confident	11 Å²	11	55.4 Å²	55.4	5%	0.048	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	113	176.4	-57.3	-82.7	0	0	0	109.4	H450 R452 K459 P507 A509	H450-F523 HydrophobicContact CB-CB 4.15Å; H450-F523 PolarHBondContact N-O 3.37Å; H450-F523 VanDerWaalsContact N-O 3.08Å; H450-F523 WeakPolarHBondContact O-CB 3.45Å; H450-F523 WeakPolarHBondContact O-CD2 3.5Å; H450-F523 PolarHBondContact O-N 3.14Å; R452-F523 HydrophobicContact CB-CE2 3.83Å; K459-F523 HydrophobicContact CD-CD2 4Å; K459-F523 HydrophobicContact CD-CE2 4.22Å; K459-F523 HydrophobicContact CD-CG 4.45Å; K459-F523 HydrophobicContact CG-CD2 4.24Å; K459-F523 HydrophobicContact CG-CE2 4.21Å; P507-F523 HydrophobicContact CB-CD1 3.82Å; P507-F523 HydrophobicContact CB-CE1 4.37Å; P507-F523 HydrophobicContact CG-CD1 3.56Å; P507-F523 HydrophobicContact CG-CE1 3.61Å; A509-F523 HydrophobicContact CB-CD1 3.6Å; A509-F523 HydrophobicContact CB-CE1 3.79Å
524	C	85.3	Confident	77.4	Confident	13 Å²	13	55.3 Å²	55.3	9%	0.088	31%	0.308	C	S	.	.			trans	-80.7	157.8	175.8	-70.3	0	0	0	0	112.4	Y508 E529 L530	Y508-C524 WeakPolarHBondContact O-CB 3.33Å; Y508-C524 PolarHBondContact O-N 3.49Å; C524-E529 HydrophobicContact CB-CB 4.18Å; C524-E529 HydrophobicContact CB-CG 4.28Å; C524-E529 WeakPolarHBondContact CB-OE2 3.41Å; C524-L530 HydrophobicContact CB-CB 4.26Å
525	S	82.4	Confident	78.4	Confident	96 Å²	96	60.5 Å²	60.5	67%	0.671	33%	0.33	S	S	*	.	S	Bend	trans	-72.6	-28.7	174.7	64.9	0	0	0	0	113.1	E529	S525-E529 WeakPolarHBondContact CB-OE2 3.36Å; S525-E529 PolarHBondContact N-OE2 2.93Å; S525-E529 PolarHBondContact OG-OE2 2.9Å
526	S	82.3	Confident	79.6	Confident	32 Å²	32	60.3 Å²	60.3	22%	0.224	31%	0.31	C	S	.	.	S	Bend	trans	-145	159.6	-172.6	77.1	0	0	0	0	112.6	Q528 E529 L530	S526-Q528 VanDerWaalsContact C-N 3.25Å; S526-Q528 PolarHBondContact O-N 3.47Å; S526-E529 PolarHBondContact O-N 2.97Å; S526-E529 VanDerWaalsContact OG-CB 3.27Å; S526-E529 WeakPolarHBondContact OG-CB 3.29Å; S526-E529 PolarHBondContact OG-N 3.33Å; S526-E529 VanDerWaalsContact OG-N 3.08Å; S526-L530 PolarHBondContact O-N 3.36Å
527	P	81.6	Confident	81	Confident	68 Å²	68	51.4 Å²	51.4	44%	0.442	27%	0.266	S	S	.	.	H	α-helix	trans	-70.7	-23.8	176.1	27.7	-32	0	0	0	112.5	Y508 Q531	Y508-P527 HydrophobicContact CD1-CB 3.74Å; Y508-P527 HydrophobicContact CD1-CG 4.47Å; Y508-P527 HydrophobicContact CE1-CB 3.62Å; Y508-P527 HydrophobicContact CE1-CG 3.99Å; Y508-P527 HydrophobicContact CG-CB 4.4Å; P527-Q531 PolarHBondContact O-N 3.26Å; P527-Q531 VanDerWaalsContact O-N 3.12Å
528	Q	80.9	Confident	81.9	Confident	140 Å²	140	52.7 Å²	52.7	65%	0.654	27%	0.267	S	S	*	.	H	α-helix	trans	-71.5	-45.5	176.8	-65.8	172.8	0.1	0	0	110.2	S526 L530 Q531 E532	S526-Q528 VanDerWaalsContact C-N 3.25Å; S526-Q528 PolarHBondContact O-N 3.47Å; Q528-L530 VanDerWaalsContact C-N 3.35Å; Q528-L530 PolarHBondContact O-N 3.45Å; Q528-Q531 PolarHBondContact O-N 2.93Å; Q528-Q531 VanDerWaalsContact O-N 3.13Å; Q528-E532 PolarHBondContact O-N 3.4Å
529	E	82.8	Confident	82.3	Confident	6 Å²	6	51.5 Å²	51.5	3%	0.028	27%	0.265	C	S	.	.	H	α-helix	trans	-60.9	-42	174.6	-166.5	-154.7	159.2	0	0	111.8	S447 V449 C524 S525 S526 Q531 E532 W533	S447-E529 VanDerWaalsContact CB-OE1 3.25Å; S447-E529 WeakPolarHBondContact CB-OE1 3.43Å; S447-E529 VanDerWaalsContact OG-CD 3.26Å; S447-E529 PolarHBondContact OG-OE1 3.43Å; V449-E529 WeakPolarHBondContact CG1-OE1 3.37Å; C524-E529 HydrophobicContact CB-CB 4.18Å; C524-E529 HydrophobicContact CB-CG 4.28Å; C524-E529 WeakPolarHBondContact CB-OE2 3.41Å; S525-E529 WeakPolarHBondContact CB-OE2 3.36Å; S525-E529 PolarHBondContact N-OE2 2.93Å; S525-E529 PolarHBondContact OG-OE2 2.9Å; S526-E529 PolarHBondContact O-N 2.97Å; S526-E529 VanDerWaalsContact OG-CB 3.27Å; S526-E529 WeakPolarHBondContact OG-CB 3.29Å; S526-E529 PolarHBondContact OG-N 3.33Å; S526-E529 VanDerWaalsContact OG-N 3.08Å; E529-Q531 VanDerWaalsContact C-N 3.31Å; E529-Q531 PolarHBondContact O-N 3.22Å; E529-E532 PolarHBondContact O-N 3.44Å; E529-W533 WeakPolarHBondContact O-CB 3.47Å; E529-W533 VanDerWaalsContact O-CD1 3.26Å; E529-W533 PolarHBondContact O-N 3.04Å; E529-W533 PolarHBondContact OE1-NE1 2.9Å
530	L	84.1	Confident	82.1	Confident	6 Å²	6	48.7 Å²	48.7	3%	0.031	26%	0.255	C	S	.	.	H	α-helix	trans	-58.9	-41.9	173	174.4	66.3	0	0	0	111.9	F510 C524 S526 Q528 L534	F510-L530 HydrophobicContact CB-CD1 4.03Å; F510-L530 HydrophobicContact CD1-CD1 3.47Å; F510-L530 VanDerWaalsContact CD1-CD1 3.47Å; F510-L530 HydrophobicContact CE1-CD1 4.28Å; F510-L530 HydrophobicContact CG-CD1 4.11Å; C524-L530 HydrophobicContact CB-CB 4.26Å; S526-L530 PolarHBondContact O-N 3.36Å; Q528-L530 VanDerWaalsContact C-N 3.35Å; Q528-L530 PolarHBondContact O-N 3.45Å; L530-L534 HydrophobicContact CD1-CD1 4.07Å; L530-L534 HydrophobicContact CD1-CG 4.32Å; L530-L534 HydrophobicContact CG-CD1 4.09Å; L530-L534 WeakPolarHBondContact O-CB 3.33Å; L530-L534 VanDerWaalsContact O-CG 3.24Å; L530-L534 WeakPolarHBondContact O-CG 3.46Å; L530-L534 PolarHBondContact O-N 3.41Å
531	Q	84.1	Confident	81.3	Confident	84 Å²	84	50.2 Å²	50.2	39%	0.393	26%	0.264	S	S	.	.	H	α-helix	trans	-68.6	-44.7	178.6	-174.6	64.4	24.9	0	0	111.4	P527 Q528 E529 W533 L534 E535	P527-Q531 PolarHBondContact O-N 3.26Å; P527-Q531 VanDerWaalsContact O-N 3.12Å; Q528-Q531 PolarHBondContact O-N 2.93Å; Q528-Q531 VanDerWaalsContact O-N 3.13Å; E529-Q531 VanDerWaalsContact C-N 3.31Å; E529-Q531 PolarHBondContact O-N 3.22Å; Q531-W533 PolarHBondContact O-N 3.38Å; Q531-L534 PolarHBondContact O-N 3.31Å; Q531-E535 WeakPolarHBondContact CG-OE1 3.45Å; Q531-E535 PolarHBondContact NE2-OE1 2.93Å; Q531-E535 WeakPolarHBondContact O-CB 3.43Å; Q531-E535 WeakPolarHBondContact O-CG 3.47Å; Q531-E535 PolarHBondContact O-N 3.43Å
532	E	84.4	Confident	79.8	Confident	64 Å²	64	56.6 Å²	56.6	30%	0.299	29%	0.292	S	S	.	.	H	α-helix	trans	-58.9	-45.6	174.4	-71.9	-179	149.2	0	0	111.3	R417 Y445 Q528 E529 L534 E535 H536	R417-E532 IonicContact CZ-OE2 3.55Å; R417-E532 IonicContact NH1-OE1 3.16Å; R417-E532 IonicContact NH1-OE2 2.68Å; R417-E532 IonicContact NH2-OE1 2.87Å; R417-E532 IonicContact NH2-OE2 2.72Å; R417-E532 PolarHBondContact NH2-OE2 2.93Å; Y445-E532 HydrophobicContact CE2-CB 3.76Å; Y445-E532 HydrophobicContact CE2-CG 4.36Å; Y445-E532 VanDerWaalsContact CE2-OE2 3.28Å; Y445-E532 WeakPolarHBondContact CE2-OE2 3.31Å; Y445-E532 VanDerWaalsContact CZ-OE2 3.29Å; Y445-E532 PolarHBondContact OH-OE2 3.04Å; Q528-E532 PolarHBondContact O-N 3.4Å; E529-E532 PolarHBondContact O-N 3.44Å; E532-L534 PolarHBondContact O-N 2.97Å; E532-E535 PolarHBondContact O-N 3.19Å; E532-H536 WeakPolarHBondContact O-CB 3.45Å; E532-H536 PolarHBondContact O-CD2 3.31Å; E532-H536 PolarHBondContact O-N 3.43Å
533	W	87.2	Confident	77.4	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-58.4	-47.1	174.1	-89.1	114.9	0	0	0	112.5	Y445 L464 L466 L471 F510 E529 Q531 H536 L537	Y445-W533 AromaticContact CD1-CD2 3.84Å; Y445-W533 HydrophobicContact CD1-CD2 3.84Å; Y445-W533 AromaticContact CD1-CE2 3.59Å; Y445-W533 HydrophobicContact CD1-CE3 4.14Å; Y445-W533 HydrophobicContact CD1-CG 4.42Å; Y445-W533 AromaticContact CD1-CH2 3.94Å; Y445-W533 HydrophobicContact CD1-CH2 3.94Å; Y445-W533 AromaticContact CD1-CZ2 3.64Å; Y445-W533 HydrophobicContact CD1-CZ2 3.64Å; Y445-W533 HydrophobicContact CD1-CZ3 4.19Å; Y445-W533 AromaticContact CE1-CD1 3.92Å; Y445-W533 HydrophobicContact CE1-CD2 4.02Å; Y445-W533 AromaticContact CE1-CE2 3.61Å; Y445-W533 HydrophobicContact CE1-CG 4.2Å; Y445-W533 AromaticContact CE1-CZ2 3.99Å; Y445-W533 HydrophobicContact CE1-CZ2 3.99Å; Y445-W533 AromaticContact CE1-NE1 3.58Å; L464-W533 HydrophobicContact CB-CH2 3.54Å; L464-W533 HydrophobicContact CB-CZ2 3.62Å; L464-W533 HydrophobicContact CD1-CH2 4.15Å; L464-W533 HydrophobicContact CD1-CZ2 4.09Å; L464-W533 HydrophobicContact CG-CZ2 4.48Å; L466-W533 HydrophobicContact CB-CH2 4.46Å; L466-W533 HydrophobicContact CB-CZ3 4.06Å; L466-W533 HydrophobicContact CD2-CZ3 4.4Å; L471-W533 HydrophobicContact CD1-CH2 4.01Å; L471-W533 HydrophobicContact CD1-CZ3 3.94Å; F510-W533 HydrophobicContact CE1-CB 3.84Å; F510-W533 AromaticContact CE1-CG 3.9Å; F510-W533 HydrophobicContact CE1-CG 3.9Å; F510-W533 HydrophobicContact CE2-CB 4.42Å; F510-W533 HydrophobicContact CZ-CB 3.65Å; F510-W533 AromaticContact CZ-CD2 3.91Å; F510-W533 HydrophobicContact CZ-CD2 3.91Å; F510-W533 HydrophobicContact CZ-CE3 4.27Å; F510-W533 AromaticContact CZ-CG 3.64Å; F510-W533 HydrophobicContact CZ-CG 3.64Å; E529-W533 WeakPolarHBondContact O-CB 3.47Å; E529-W533 VanDerWaalsContact O-CD1 3.26Å; E529-W533 PolarHBondContact O-N 3.04Å; E529-W533 PolarHBondContact OE1-NE1 2.9Å; Q531-W533 PolarHBondContact O-N 3.38Å; W533-H536 PolarHBondContact O-N 2.97Å; W533-L537 HydrophobicContact CE3-CD1 4.02Å; W533-L537 HydrophobicContact CE3-CG 4.34Å; W533-L537 VanDerWaalsContact O-CB 3.27Å; W533-L537 WeakPolarHBondContact O-CB 3.43Å; W533-L537 WeakPolarHBondContact O-CD1 3.33Å; W533-L537 VanDerWaalsContact O-CG 3.22Å; W533-L537 WeakPolarHBondContact O-CG 3.21Å; W533-L537 PolarHBondContact O-N 3.31Å
534	L	84.2	Confident	75	Confident	34 Å²	34	64.7 Å²	64.7	18%	0.178	36%	0.358	C	S	.	.	H	α-helix	trans	-65.1	-38.5	179.7	-72.8	171.6	0	0	0	111.9	V496 R498 F510 L530 Q531 E532 Q538	V496-L534 HydrophobicContact CG1-CD2 3.81Å; R498-L534 HydrophobicContact CB-CD1 4.28Å; R498-L534 HydrophobicContact CG-CD1 4.38Å; F510-L534 HydrophobicContact CB-CD2 4.26Å; L530-L534 HydrophobicContact CD1-CD1 4.07Å; L530-L534 HydrophobicContact CD1-CG 4.32Å; L530-L534 HydrophobicContact CG-CD1 4.09Å; L530-L534 WeakPolarHBondContact O-CB 3.33Å; L530-L534 VanDerWaalsContact O-CG 3.24Å; L530-L534 WeakPolarHBondContact O-CG 3.46Å; L530-L534 PolarHBondContact O-N 3.41Å; Q531-L534 PolarHBondContact O-N 3.31Å; E532-L534 PolarHBondContact O-N 2.97Å; L534-Q538 WeakPolarHBondContact O-CB 3.42Å; L534-Q538 PolarHBondContact O-N 2.94Å
535	E	86	Confident	72.2	Confident	117 Å²	117	69 Å²	69	55%	0.547	39%	0.388	S	S	.	.	H	α-helix	trans	-68.4	-44	176.4	-75.6	178.5	-163.5	0	0	112.2	Q531 E532 L537 Q538 P539	Q531-E535 WeakPolarHBondContact CG-OE1 3.45Å; Q531-E535 PolarHBondContact NE2-OE1 2.93Å; Q531-E535 WeakPolarHBondContact O-CB 3.43Å; Q531-E535 WeakPolarHBondContact O-CG 3.47Å; Q531-E535 PolarHBondContact O-N 3.43Å; E532-E535 PolarHBondContact O-N 3.19Å; E535-L537 VanDerWaalsContact C-N 3.33Å; E535-L537 PolarHBondContact O-N 2.92Å; E535-Q538 PolarHBondContact O-N 2.71Å; E535-P539 WeakPolarHBondContact O-CD 3.47Å
536	H	82.6	Confident	69.9	Low	71 Å²	71	70.3 Å²	70.3	33%	0.329	40%	0.395	S	S	.	.	H	α-helix	trans	-69	-28.1	176.2	-75.3	-63	0	0	0	113.4	Y445 L466 E532 W533 P539 Y540	Y445-H536 AromaticContact CD2-CD2 3.34Å; Y445-H536 WeakPolarHBondContact CD2-CD2 3.34Å; Y445-H536 AromaticContact CD2-NE2 3.44Å; Y445-H536 WeakPolarHBondContact CD2-NE2 3.29Å; Y445-H536 AromaticContact CG-CD2 3.75Å; L466-H536 HydrophobicContact CD2-CB 3.74Å; E532-H536 WeakPolarHBondContact O-CB 3.45Å; E532-H536 PolarHBondContact O-CD2 3.31Å; E532-H536 PolarHBondContact O-N 3.43Å; W533-H536 PolarHBondContact O-N 2.97Å; H536-P539 WeakPolarHBondContact O-CD 3.4Å; H536-Y540 VanDerWaalsContact O-CE2 3.29Å; H536-Y540 WeakPolarHBondContact O-CE2 3.45Å
537	L	81.6	Confident	67.3	Low	5 Å²	5	74.8 Å²	74.8	3%	0.026	42%	0.421	C	S	.	.	H	α-helix	trans	-86	-22.9	176.1	-69.6	168.4	0	0	0	113.4	L466 L491 V496 F510 I512 W533 E535 Y540	L466-L537 HydrophobicContact CD1-CD2 3.7Å; L466-L537 HydrophobicContact CD2-CD2 4.22Å; L491-L537 HydrophobicContact CD2-CD2 3.99Å; V496-L537 HydrophobicContact CG2-CB 4.25Å; V496-L537 HydrophobicContact CG2-CD1 4.21Å; F510-L537 HydrophobicContact CD2-CD1 4.3Å; F510-L537 HydrophobicContact CE2-CD1 3.48Å; F510-L537 VanDerWaalsContact CE2-CD1 3.48Å; F510-L537 HydrophobicContact CZ-CD1 4.19Å; I512-L537 HydrophobicContact CD1-CD1 4.09Å; W533-L537 HydrophobicContact CE3-CD1 4.02Å; W533-L537 HydrophobicContact CE3-CG 4.34Å; W533-L537 VanDerWaalsContact O-CB 3.27Å; W533-L537 WeakPolarHBondContact O-CB 3.43Å; W533-L537 WeakPolarHBondContact O-CD1 3.33Å; W533-L537 VanDerWaalsContact O-CG 3.22Å; W533-L537 WeakPolarHBondContact O-CG 3.21Å; W533-L537 PolarHBondContact O-N 3.31Å; E535-L537 VanDerWaalsContact C-N 3.33Å; E535-L537 PolarHBondContact O-N 2.92Å; L537-Y540 PolarHBondContact O-N 3.36Å; L537-Y540 VanDerWaalsContact O-N 3.08Å
538	Q	77.3	Confident	64.9	Low	103 Å²	103	75.3 Å²	75.3	48%	0.481	44%	0.438	S	S	.	.	H	α-helix	trans	-56.6	-33.2	-176.5	-140.8	-162	46.4	0	0	116.2	L534 E535 Y540 T541 K542	L534-Q538 WeakPolarHBondContact O-CB 3.42Å; L534-Q538 PolarHBondContact O-N 2.94Å; E535-Q538 PolarHBondContact O-N 2.71Å; Q538-Y540 VanDerWaalsContact C-N 3.26Å; Q538-Y540 PolarHBondContact O-N 2.83Å; Q538-T541 PolarHBondContact O-OG1 2.95Å; Q538-K542 WeakPolarHBondContact O-CD 3.48Å; Q538-K542 WeakPolarHBondContact O-CG 3.49Å
539	P	72.1	Confident	62.4	Low	81 Å²	81	75.6 Å²	75.6	53%	0.526	44%	0.443	S	S	.	.	H	α-helix	trans	-62.2	-33.9	175.7	-26	36.1	0	0	0	112.9	E535 H536	E535-P539 WeakPolarHBondContact O-CD 3.47Å; H536-P539 WeakPolarHBondContact O-CD 3.4Å
540	Y	68.1	Low	59.9	Low	77 Å²	77	82.9 Å²	82.9	30%	0.302	48%	0.48	S	S	.	.	H	α-helix	trans	-85.9	-21.1	-171.4	-53.7	-69.7	0	0	0	113.5	P468 L491 H536 L537 Q538	P468-Y540 WeakPolarHBondContact O-CE1 3.48Å; L491-Y540 HydrophobicContact CB-CD1 4.37Å; L491-Y540 HydrophobicContact CB-CG 4.15Å; L491-Y540 HydrophobicContact CD1-CD1 4.12Å; L491-Y540 HydrophobicContact CD1-CD2 3.84Å; L491-Y540 HydrophobicContact CD1-CE1 4.27Å; L491-Y540 HydrophobicContact CD1-CE2 3.99Å; L491-Y540 HydrophobicContact CD1-CG 3.9Å; H536-Y540 VanDerWaalsContact O-CE2 3.29Å; H536-Y540 WeakPolarHBondContact O-CE2 3.45Å; L537-Y540 PolarHBondContact O-N 3.36Å; L537-Y540 VanDerWaalsContact O-N 3.08Å; Q538-Y540 VanDerWaalsContact C-N 3.26Å; Q538-Y540 PolarHBondContact O-N 2.83Å
541	T	64.6	Low	57	Low	40 Å²	40	87.3 Å²	87.3	25%	0.245	51%	0.512	C	S	.	.	H	α-helix	trans	-82.1	-18.6	178.7	58.4	0	0	0	0	113.9	V496 Q538 S543 G544	V496-T541 HydrophobicContact CB-CG2 3.88Å; V496-T541 HydrophobicContact CG2-CG2 3.71Å; Q538-T541 PolarHBondContact O-OG1 2.95Å; T541-S543 PolarHBondContact O-N 3.41Å; T541-G544 PolarHBondContact O-N 3.17Å
542	K	52	Low	54.4	Low	141 Å²	141	92.2 Å²	92.2	61%	0.613	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	27	-170.4	-76.6	172.6	-178.9	166.7	0	115.9	Q538	Q538-K542 WeakPolarHBondContact O-CD 3.48Å; Q538-K542 WeakPolarHBondContact O-CG 3.49Å
543	S	36.1	Very low	51.4	Low	127 Å²	127	95.5 Å²	95.5	89%	0.888	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	-6.7	162.7	-149.9	0	0	0	0	112.4	T541	T541-S543 PolarHBondContact O-N 3.41Å
544	G	34.8	Very low	48.6	Very low	53 Å²	53	102.1 Å²	102.1	55%	0.546	60%	0.596	S	S	.	*	S	Bend	trans	-101.4	144.1	169.3	0	0	0	0	0	112.7	T541	T541-G544 PolarHBondContact O-N 3.17Å
545	S	26.4	Very low	45.8	Very low	105 Å²	105	108.4 Å²	108.4	73%	0.734	63%	0.63	S	S	*	*			trans	-66.9	141.9	-177.4	-172.3	0	0	0	0	113.3	T547	S545-T547 PolarHBondContact O-N 3.04Å
546	P	34.4	Very low	42.9	Very low	123 Å²	123	106.4 Å²	106.4	80%	0.799	64%	0.641	S	S	*	*			trans	-79.8	104.1	176.9	32.1	-34.2	0	0	0	112.3
547	T	29.1	Very low	40.3	Very low	126 Å²	126	113 Å²	113	77%	0.773	67%	0.669	S	S	*	*			trans	-126.9	89	160.6	41.2	0	0	0	0	110.2	S545	S545-T547 PolarHBondContact O-N 3.04Å
548	G	30.1	Very low	37.8	Very low	79 Å²	79	118.2 Å²	118.2	81%	0.814	70%	0.703	S	S	*	*			trans	-80.4	130.4	166.3	0	0	0	0	0	110.4
549	I	27.8	Very low	35.3	Very low	146 Å²	146	121.3 Å²	121.3	75%	0.749	72%	0.722	S	S	*	*			trans	-121.9	111.1	165.6	-64	-178.4	0	0	0	107.7	S551	I549-S551 PolarHBondContact O-N 3.11Å
550	I	31.1	Very low	33	Very low	158 Å²	158	122.6 Å²	122.6	81%	0.81	73%	0.733	S	S	*	*			trans	-80.6	99.5	168.9	-62.3	171.8	0	0	0	106.9	K552	I550-K552 HydrophobicContact CG2-CG 4.47Å; I550-K552 PolarHBondContact O-N 3.41Å; I550-K552 VanDerWaalsContact O-N 3.11Å
551	S	24.2	Very low	31	Very low	99 Å²	99	123.4 Å²	123.4	69%	0.692	75%	0.749	S	S	*	*			trans	-78.4	90.6	175.8	-66	0	0	0	0	111	I549	I549-S551 PolarHBondContact O-N 3.11Å
552	K	27.7	Very low	29	Very low	188 Å²	188	128.7 Å²	128.7	82%	0.817	78%	0.782	S	S	*	*			trans	-83.9	106.7	158.6	-76.2	-166	174.6	-170.4	0	109.1	I550	I550-K552 HydrophobicContact CG2-CG 4.47Å; I550-K552 PolarHBondContact O-N 3.41Å; I550-K552 VanDerWaalsContact O-N 3.11Å
553	T	23	Very low	27.7	Very low	133 Å²	133	125.6 Å²	125.6	82%	0.816	79%	0.789	S	S	*	*			trans	-75.7	131.3	170.5	40.9	0	0	0	0	110.9
554	V	27.9	Very low	27	Very low	138 Å²	138	126.1 Å²	126.1	84%	0.836	79%	0.788	S	S	*	*			trans	-135.2	131.2	164.4	177.4	0	0	0	0	106.8
555	D	25.8	Very low	27.3	Very low	167 Å²	167	128.8 Å²	128.8	89%	0.893	80%	0.795	S	S	*	*			trans	-64.7	140.1	-176.8	-68.9	-89.4	0	0	0	113.8
556	G	25.1	Very low	27.1	Very low	75 Å²	75	129 Å²	129	77%	0.773	79%	0.792	S	S	*	*			trans	-171.2	117.8	175.9	0	0	0	0	0	112.3
557	K	27.7	Very low	26.8	Very low	210 Å²	210	130.5 Å²	130.5	91%	0.913	79%	0.788	S	S	*	*			trans	-86.2	141.2	-175.1	-156.1	164.4	-175.8	171.9	0	111
558	P	28.7	Very low	26.6	Very low	114 Å²	114	130.3 Å²	130.3	74%	0.74	78%	0.782	S	S	*	*			trans	-90.3	160.2	-164.5	35.2	-38	0	0	0	115.1
559	L	24.1	Very low	27	Very low	168 Å²	168	132 Å²	132	88%	0.88	78%	0.779	S	S	*	*			trans	-153.7	150.5	163.2	-143.7	77.3	0	0	0	111.9
560	S	25.1	Very low	27.4	Very low	107 Å²	107	132.3 Å²	132.3	75%	0.748	78%	0.776	S	S	*	*			trans	12.6	148.5	155	-86.1	0	0	0	0	122.6
561	S	24.4	Very low	27.3	Very low	94 Å²	94	133.4 Å²	133.4	66%	0.657	78%	0.783	S	S	*	*			cis	175.9	150.2	-6.8	47.4	0	0	0	0	111.8
562	V	23.8	Very low	27.2	Very low	152 Å²	152	132 Å²	132	92%	0.921	78%	0.784	S	S	*	*			trans	62.1	135.6	149.2	172.7	0	0	0	0	119.9
563	G	23.9	Very low	26.9	Very low	75 Å²	75	126.8 Å²	126.8	77%	0.773	78%	0.784	S	S	*	*			trans	152.1	77	156.3	0	0	0	0	0	119.5
564	T	21.5	Very low	27.8	Very low	139 Å²	139	126 Å²	126	85%	0.853	78%	0.781	S	S	*	*			trans	-108.1	172.9	158.7	35.2	0	0	0	0	110
565	P	40.8	Very low	27.8	Very low	109 Å²	109	125 Å²	125	71%	0.708	78%	0.78	S	S	*	*			cis	-116.9	-134.8	-0	26.6	-1.5	0	0	0	112.1
566	T	23.7	Very low	28	Very low	110 Å²	110	121.2 Å²	121.2	68%	0.675	77%	0.772	S	S	*	*			cis	-164.6	133.9	11.7	-14.8	0	0	0	0	113.6
567	H	27.7	Very low	28.1	Very low	154 Å²	154	123.8 Å²	123.8	71%	0.713	77%	0.772	S	S	*	*			trans	41.8	121.4	134.9	-69.2	-110.3	0	0	0	122.1
568	L	23.6	Very low	28	Very low	121 Å²	121	118.6 Å²	118.6	63%	0.634	76%	0.763	S	S	*	*				81.4	157	82.4	-89.4	159.2	0	0	0	114
569	P	39.7	Very low	27.9	Very low	115 Å²	115	125.2 Å²	125.2	75%	0.747	77%	0.773	S	S	*	*			cis	-137.7	142.2	44.5	41.4	-22	0	0	0	117.5
570	H	35	Very low	28.1	Very low	152 Å²	152	120.5 Å²	120.5	70%	0.704	76%	0.764	S	S	*	*				76.8	127.8	93.8	-73.4	-72.5	0	0	0	121.1
571	L	28.9	Very low	28.3	Very low	181 Å²	181	121.9 Å²	121.9	95%	0.948	77%	0.771	S	S	*	*				175.9	142.3	121.7	-93.8	161.9	0	0	0	109
572	G	23.1	Very low	28.2	Very low	70 Å²	70	125.1 Å²	125.1	72%	0.722	78%	0.78	S	S	*	*			cis	-162.5	170.4	-5.1	0	0	0	0	0	111.5
573	G	21.9	Very low	28.2	Very low	78 Å²	78	126.7 Å²	126.7	80%	0.804	78%	0.777	S	S	*	*			trans	-102.5	-146.9	-176.1	0	0	0	0	0	114.7
574	P	41.8	Very low	29.1	Very low	117 Å²	117	127.9 Å²	127.9	76%	0.76	77%	0.771	S	S	*	*			cis	-145.3	165.3	11.2	42.9	-24.2	0	0	0	119.2
575	S	28.4	Very low	29.9	Very low	118 Å²	118	126.1 Å²	126.1	83%	0.825	76%	0.762	S	S	*	*			trans	65.4	149.3	143.3	-68.5	0	0	0	0	121.9
576	A	28.3	Very low	29.1	Very low	86 Å²	86	129.9 Å²	129.9	71%	0.711	77%	0.768	S	S	*	*			cis	-168.2	160.6	0.1	0	0	0	0	0	115.5
577	V	28.5	Very low	29.2	Very low	130 Å²	130	130.9 Å²	130.9	79%	0.788	77%	0.774	S	S	*	*			trans	81.9	99.9	144	168.8	0	0	0	0	123.3
578	S	25.6	Very low	29.2	Very low	101 Å²	101	128.9 Å²	128.9	71%	0.706	78%	0.777	S	S	*	*				70.8	142.1	120.2	-55.7	0	0	0	0	127.6
579	R	25.6	Very low	29.4	Very low	253 Å²	253	132.2 Å²	132.2	96%	0.955	79%	0.786	S	S	*	*			trans	74.9	150.6	147.6	-77.7	177.6	-174.5	174.4	2.6	120.4
580	G	28.2	Very low	29.1	Very low	68 Å²	68	132.3 Å²	132.3	70%	0.701	79%	0.787	S	S	*	*			trans	-133.6	162.5	156.9	0	0	0	0	0	110.9
581	P	29.4	Very low	28.7	Very low	136 Å²	136	135.6 Å²	135.6	88%	0.883	79%	0.793	S	S	*	*			trans	-142.7	-160.8	153.3	40.8	-24	0	0	0	113.3
582	L	23.9	Very low	28.8	Very low	163 Å²	163	132.1 Å²	132.1	85%	0.853	78%	0.78	S	S	*	*			trans	-101.9	156.9	-169.2	-66	152.6	0	0	0	114.9
583	E	22.6	Very low	29	Very low	184 Å²	184	136 Å²	136	86%	0.86	78%	0.783	S	S	*	*			trans	77.6	160.5	146.1	-84.8	-143.1	91.1	0	0	123.7
584	P	42.7	Very low	29.4	Very low	100 Å²	100	137.2 Å²	137.2	65%	0.649	78%	0.78	S	S	*	*			trans	-110.1	-144.8	-159.2	46.5	-36.7	0	0	0	112.3
585	P	39.3	Very low	28.8	Very low	102 Å²	102	137.3 Å²	137.3	66%	0.662	78%	0.781	S	S	*	*			cis	-138.6	-161.4	-7	35.7	-11.3	0	0	0	116.4
586	K	23.9	Very low	28.8	Very low	189 Å²	189	140 Å²	140	82%	0.822	79%	0.786	S	S	*	*			trans	93.3	145.3	169	-55.4	168.5	-172.8	172.9	0	114.9
587	T	26	Very low	29.3	Very low	131 Å²	131	147.3 Å²	147.3	80%	0.804	80%	0.795	S	S	*	*			cis	-158.8	155	-11.2	15.8	0	0	0	0	106.8
588	S	27.4	Very low	29.3	Very low	112 Å²	112	147.3 Å²	147.3	78%	0.783	80%	0.797	S	S	*	*				-166.9	171.8	63.6	57	0	0	0	0	113.1
589	K	27.8	Very low	29.4	Very low	190 Å²	190	146.8 Å²	146.8	83%	0.826	80%	0.799	S	S	*	*			trans	-123.9	160.7	169.2	-72	-174.3	176.9	-178.6	0	109.7
590	P	32.4	Very low	30	Very low	117 Å²	117	140.3 Å²	140.3	76%	0.76	79%	0.79	S	S	*	*				-111.2	126.8	111.9	-12.9	30.9	0	0	0	112.2
591	W	27.7	Very low	30.3	Very low	221 Å²	221	142.4 Å²	142.4	84%	0.837	79%	0.791	S	S	*	*				80.5	97.5	101.7	-79.3	43.3	0	0	0	113.2
592	T	30	Very low	30.2	Very low	108 Å²	108	144.4 Å²	144.4	66%	0.663	79%	0.793	S	S	*	*				77.1	143.5	76.9	54.6	0	0	0	0	113.5
593	L	28.2	Very low	30.5	Very low	152 Å²	152	145.7 Å²	145.7	80%	0.796	79%	0.792	S	S	*	*			cis	-152.6	165.4	7.9	-110.5	151.4	0	0	0	105.9
594	S	30.1	Very low	31.1	Very low	104 Å²	104	143 Å²	143	73%	0.727	79%	0.791	S	S	*	*			cis	-145.1	161.9	24.6	-61.5	0	0	0	0	112.3
595	C	29.7	Very low	30.4	Very low	118 Å²	118	144 Å²	144	80%	0.797	80%	0.8	S	S	*	*			trans	-122.3	174.1	171.9	-63.4	0	0	0	0	112
596	L	26.8	Very low	29.8	Very low	175 Å²	175	143.7 Å²	143.7	92%	0.916	81%	0.806	S	S	*	*			trans	103	132.1	160.2	-53.9	179.2	0	0	0	117.8
597	R	39.3	Very low	29.9	Very low	240 Å²	240	138.7 Å²	138.7	91%	0.906	80%	0.8	S	S	*	*			trans	-78.6	167.9	163.4	-53.6	176.1	-176.5	162.8	-1.3	109.3
598	P	28.7	Very low	30	Very low	129 Å²	129	141 Å²	141	84%	0.838	81%	0.806	S	S	*	*				-139.9	-171.6	97.3	36.9	-22.5	0	0	0	113.9
599	A	26.9	Very low	30	Very low	90 Å²	90	138.8 Å²	138.8	74%	0.744	80%	0.801	S	S	*	*			trans	-103.2	-170.8	-175.9	0	0	0	0	0	111.9
600	P	39.8	Very low	30	Very low	117 Å²	117	139.6 Å²	139.6	76%	0.76	80%	0.801	S	S	*	*			trans	-84.3	173.1	-142.5	38.4	-42.7	0	0	0	116.1
601	P	34	Very low	29.7	Very low	112 Å²	112	141.6 Å²	141.6	73%	0.727	80%	0.797	S	S	*	*				-151.1	147.4	111.2	37	-19.9	0	0	0	119
602	L	26.3	Very low	29.7	Very low	178 Å²	178	137.5 Å²	137.5	93%	0.932	79%	0.787	S	S	*	*			trans	65.6	165.5	138.5	-62.9	172	0	0	0	123.4
603	K	31.4	Very low	29.6	Very low	190 Å²	190	141.5 Å²	141.5	83%	0.826	79%	0.79	S	S	*	*			trans	-109.3	178.2	-170.6	-56.8	178.3	176.5	178	0	112.6
604	P	33.8	Very low	29.4	Very low	129 Å²	129	141.5 Å²	141.5	84%	0.838	79%	0.788	S	S	*	*				-135.5	-177.1	93	17.9	4.6	0	0	0	116.5
605	S	27.7	Very low	29.2	Very low	121 Å²	121	140.9 Å²	140.9	85%	0.846	78%	0.784	S	S	*	*			trans	-61.6	174.4	-172.9	-46.3	0	0	0	0	116.2
606	A	26.9	Very low	29	Very low	95 Å²	95	145.3 Å²	145.3	79%	0.785	79%	0.785	S	S	*	*			cis	-153.1	-176	18.7	0	0	0	0	0	111.4
607	A	26.3	Very low	29	Very low	83 Å²	83	143.1 Å²	143.1	69%	0.686	77%	0.773	S	S	*	*			cis	-157	156.8	7.2	0	0	0	0	0	112.2
608	L	28.8	Very low	28.5	Very low	180 Å²	180	138.4 Å²	138.4	94%	0.942	76%	0.763	S	S	*	*			trans	49.3	138.5	152.7	-57.9	169.1	0	0	0	121.1
609	G	26.4	Very low	28.4	Very low	65 Å²	65	140.4 Å²	140.4	67%	0.67	76%	0.758	S	S	*	*			cis	174.2	135.3	-7.9	0	0	0	0	0	115.9
610	Y	28.1	Very low	28.4	Very low	208 Å²	208	142.2 Å²	142.2	82%	0.816	76%	0.756	S	S	*	*			trans	64.2	122.5	148.2	-96.9	-108.1	0	0	0	124.2
611	K	27.1	Very low	27.7	Very low	159 Å²	159	141 Å²	141	69%	0.691	75%	0.75	S	S	*	*			trans	37.6	129.3	143.9	-63.1	-173.3	-179.7	-177.4	0	120.6
612	E	27.7	Very low	27.4	Very low	134 Å²	134	140 Å²	140	63%	0.626	75%	0.746	S	S	*	*			cis	79.1	119.5	40.9	-161.8	-140.3	142.3	0	0	115.4
613	R	27.9	Very low	27.4	Very low	193 Å²	193	141.3 Å²	141.3	73%	0.728	74%	0.744	S	S	*	*			trans	115.5	134.2	143	-158.8	173.6	-73.9	-136.8	-3.1	118.8
614	M	23.6	Very low	27	Very low	152 Å²	152	137.5 Å²	137.5	75%	0.749	74%	0.741	S	S	*	*			trans	63.1	103.2	156.4	-93.9	47.1	179.1	0	0	122.8
615	S	25.1	Very low	27.4	Very low	91 Å²	91	135.8 Å²	135.8	64%	0.636	73%	0.73	S	S	*	*				80.2	139.1	106.4	76	0	0	0	0	124.1
616	Y	25.2	Very low	27.5	Very low	210 Å²	210	141.6 Å²	141.6	82%	0.824	73%	0.733	S	S	*	*			trans	82.8	123.8	142.6	-76.1	-52.7	0	0	0	122.7
617	I	28.8	Very low	28	Very low	129 Å²	129	142.4 Å²	142.4	66%	0.662	73%	0.731	S	S	*	*			trans	92	108.2	130.4	-78.8	167	0	0	0	121.2
618	M	27.8	Very low	28.2	Very low	142 Å²	142	146.5 Å²	146.5	70%	0.7	74%	0.74	S	S	*	*			trans	69.3	128.2	139.5	-74.6	-160.9	-70.1	0	0	123.8
619	K	27.6	Very low	28.1	Very low	170 Å²	170	147.3 Å²	147.3	74%	0.739	74%	0.735	S	S	*	*			trans	74.8	152	130.8	-72.5	-178.8	167.1	-168.9	0	119
620	D	25.3	Very low	28.3	Very low	129 Å²	129	152.7 Å²	152.7	69%	0.69	74%	0.74	S	S	*	*			cis	-154.6	168.3	-3.9	-130.5	-39.9	0	0	0	114.2
621	S	25.6	Very low	28.3	Very low	90 Å²	90	151.3 Å²	151.3	63%	0.629	74%	0.739	S	S	*	*			trans	58.2	106.3	143	-159.7	0	0	0	0	123.7
622	S	27.2	Very low	28.4	Very low	92 Å²	92	151.3 Å²	151.3	64%	0.643	75%	0.746	S	S	*	*				46.3	136.4	126.2	78.8	0	0	0	0	124.4
623	K	27.1	Very low	29	Very low	205 Å²	205	151 Å²	151	89%	0.891	76%	0.755	S	S	*	*				178.6	170.6	118.5	-94.7	153.6	-170.4	169.7	0	114.9
624	S	22.1	Very low	28.8	Very low	110 Å²	110	145.4 Å²	145.4	77%	0.769	76%	0.758	S	S	*	*			trans	-155.2	-178	-178.2	-146	0	0	0	0	107.9
625	P	43.8	Very low	29.1	Very low	94 Å²	94	146.1 Å²	146.1	61%	0.61	77%	0.765	S	S	*	*			cis	-137.7	150.9	-15.3	29.2	-7.4	0	0	0	117
626	R	29.7	Very low	29.3	Very low	242 Å²	242	153.8 Å²	153.8	91%	0.913	78%	0.779	S	S	*	*			trans	60.1	-169.6	150.4	-59.8	175.5	-174.7	-103.1	4.2	116.1
627	P	38	Very low	29.9	Very low	113 Å²	113	153.9 Å²	153.9	73%	0.734	78%	0.784	S	S	*	*			cis	-130.6	175.1	-14.9	42.3	-27.8	0	0	0	115.7
628	I	28.5	Very low	30	Very low	169 Å²	169	157.1 Å²	157.1	87%	0.867	79%	0.794	S	S	*	*			trans	-168.1	167.5	138.1	-108.8	165.6	0	0	0	112.8
629	K	28.6	Very low	30.1	Very low	196 Å²	196	158 Å²	158	85%	0.852	80%	0.801	S	S	*	*			trans	-140.1	165.5	-176.1	-65.9	170	177.8	171.9	0	108.7
630	K	30.5	Very low	30.3	Very low	178 Å²	178	161.7 Å²	161.7	77%	0.774	81%	0.81	S	S	*	*			cis	-109.7	-136.3	8.7	-109.9	172.2	174	174.1	0	109.5
631	F	27.2	Very low	30.9	Very low	180 Å²	180	164.6 Å²	164.6	79%	0.789	82%	0.817	S	S	*	*			cis	-150.9	175.1	6.1	-98.3	-74.6	0	0	0	111.3
632	L	29.3	Very low	31.4	Very low	159 Å²	159	165 Å²	165	83%	0.832	82%	0.817	S	S	*	*			trans	-147	172.2	175.8	-78.3	176.3	0	0	0	107.9
633	P	39.6	Very low	32.1	Very low	127 Å²	127	163.4 Å²	163.4	83%	0.825	81%	0.806	S	S	*	*			cis	-131.9	178.5	8.6	42.2	-26.1	0	0	0	115.8
634	G	24.9	Very low	32.8	Very low	76 Å²	76	159 Å²	159	78%	0.784	79%	0.793	S	S	*	*			trans	178.6	117.5	167.8	0	0	0	0	0	114.2
635	N	29.3	Very low	33.7	Very low	167 Å²	167	158.8 Å²	158.8	89%	0.893	78%	0.783	S	S	*	*			trans	-70	134	-174.8	-79.6	-29.4	0	0	0	114.4
636	R	30.4	Very low	33.6	Very low	251 Å²	251	158.2 Å²	158.2	95%	0.947	77%	0.772	S	S	*	*			trans	-163.2	134.1	137.9	-106.9	156.9	-168.6	-167.7	2.1	111.1
637	K	36.6	Very low	34.2	Very low	212 Å²	212	152.7 Å²	152.7	92%	0.922	76%	0.755	S	S	*	*			trans	-72.5	139.8	175.3	-67.5	-178.3	177.3	-178.2	0	110.4
638	K	31	Very low	34.5	Very low	198 Å²	198	153.1 Å²	153.1	86%	0.861	75%	0.747	S	S	*	*			trans	-157.8	156.6	149.4	-113.3	178.6	-177.8	-174.4	0	109.6
639	D	30.6	Very low	35.4	Very low	160 Å²	160	150.2 Å²	150.2	86%	0.856	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-75.4	144.3	-157.4	-51.9	-86.8	0	0	0	113.7
640	R	31.3	Very low	36.4	Very low	247 Å²	247	147.9 Å²	147.9	93%	0.932	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-87.6	118.5	175.6	-115.8	179.5	173.4	136.7	-3.2	109.4
641	K	37.9	Very low	37.3	Very low	190 Å²	190	146.1 Å²	146.1	83%	0.826	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-63.6	151	156.8	-69.4	-175.4	173.6	-173.2	0	109.3
642	P	35.7	Very low	38.4	Very low	98 Å²	98	140.8 Å²	140.8	64%	0.636	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-56.1	156.7	165.3	-22.6	34.2	0	0	0	111.7
643	S	43.1	Very low	39.8	Very low	60 Å²	60	137 Å²	137	42%	0.42	68%	0.679	S	S	.	*	P	Polyproline II helix	trans	-73.2	149	176.8	-158.7	0	0	0	0	110.9	D645 E646 F647	S643-D645 PolarHBondContact O-N 3.14Å; S643-D645 PolarHBondContact OG-OD2 2.89Å; S643-E646 VanDerWaalsContact O-CB 3.31Å; S643-E646 WeakPolarHBondContact O-CB 3.48Å; S643-E646 PolarHBondContact O-N 2.88Å; S643-F647 PolarHBondContact O-N 3.4Å
644	D	40.3	Very low	40.8	Very low	113 Å²	113	132.9 Å²	132.9	60%	0.604	66%	0.655	S	S	*	*	H	α-helix	trans	-62.6	-34.1	173.2	-154.9	17	0	0	0	110.5	E646 F647 Q648	D644-E646 VanDerWaalsContact C-N 3.26Å; D644-E646 PolarHBondContact O-N 3.16Å; D644-F647 WeakPolarHBondContact O-CB 3.46Å; D644-F647 PolarHBondContact O-N 2.96Å; D644-F647 VanDerWaalsContact O-N 3.08Å; D644-Q648 WeakPolarHBondContact O-CG 3.42Å; D644-Q648 PolarHBondContact O-N 2.89Å
645	D	41.3	Very low	42.5	Very low	105 Å²	105	131.3 Å²	131.3	56%	0.561	64%	0.635	S	S	*	*	H	α-helix	trans	-57	-38	170.5	-49.3	-66.8	0	0	0	112.4	S643 F647 Q648 I649	S643-D645 PolarHBondContact O-N 3.14Å; S643-D645 PolarHBondContact OG-OD2 2.89Å; D645-F647 VanDerWaalsContact C-N 3.26Å; D645-F647 PolarHBondContact O-N 3.34Å; D645-Q648 PolarHBondContact O-N 2.9Å; D645-I649 VanDerWaalsContact O-CB 3.3Å; D645-I649 WeakPolarHBondContact O-CB 3.31Å; D645-I649 WeakPolarHBondContact O-CD1 3.44Å; D645-I649 WeakPolarHBondContact O-CG1 3.44Å; D645-I649 PolarHBondContact O-N 2.92Å
646	E	40.8	Very low	43.8	Very low	81 Å²	81	128.7 Å²	128.7	38%	0.379	62%	0.621	S	S	.	*	H	α-helix	trans	-72.2	-24.9	-179	-153.2	-166.8	137.5	0	0	111.3	S643 D644 R650	S643-E646 VanDerWaalsContact O-CB 3.31Å; S643-E646 WeakPolarHBondContact O-CB 3.48Å; S643-E646 PolarHBondContact O-N 2.88Å; D644-E646 VanDerWaalsContact C-N 3.26Å; D644-E646 PolarHBondContact O-N 3.16Å; E646-R650 VanDerWaalsContact CD-NH1 3.35Å; E646-R650 WeakPolarHBondContact O-CB 3.46Å; E646-R650 VanDerWaalsContact O-CG 3.32Å; E646-R650 WeakPolarHBondContact O-CG 3.23Å; E646-R650 PolarHBondContact O-N 3.1Å; E646-R650 IonicContact OE1-CZ 3.65Å; E646-R650 IonicContact OE1-NH1 2.69Å; E646-R650 PolarHBondContact OE1-NH1 2.65Å; E646-R650 IonicContact OE1-NH2 2.67Å; E646-R650 PolarHBondContact OE1-NH2 3.19Å
647	F	42.5	Very low	45.4	Very low	127 Å²	127	123.2 Å²	123.2	56%	0.557	61%	0.606	S	S	*	*	H	α-helix	trans	-82.9	-39	173.7	-161.4	-102.8	0	0	0	111.6	S643 D644 D645 R650 K651	S643-F647 PolarHBondContact O-N 3.4Å; D644-F647 WeakPolarHBondContact O-CB 3.46Å; D644-F647 PolarHBondContact O-N 2.96Å; D644-F647 VanDerWaalsContact O-N 3.08Å; D645-F647 VanDerWaalsContact C-N 3.26Å; D645-F647 PolarHBondContact O-N 3.34Å; F647-R650 PolarHBondContact O-N 2.72Å; F647-K651 HydrophobicContact CE1-CD 4.46Å; F647-K651 PolarHBondContact O-N 3.09Å
648	Q	45.3	Very low	46.8	Very low	121 Å²	121	119.3 Å²	119.3	57%	0.565	59%	0.591	S	S	*	*	H	α-helix	trans	-66.9	-40.9	172.7	-69.1	-172.3	24.1	0	0	112.2	D644 D645 K651 S652	D644-Q648 WeakPolarHBondContact O-CG 3.42Å; D644-Q648 PolarHBondContact O-N 2.89Å; D645-Q648 PolarHBondContact O-N 2.9Å; Q648-K651 PolarHBondContact O-N 3.07Å; Q648-S652 WeakPolarHBondContact O-CB 3.46Å; Q648-S652 PolarHBondContact O-N 2.65Å
649	I	47.7	Very low	48	Very low	109 Å²	109	114.1 Å²	114.1	56%	0.559	57%	0.573	S	S	*	*	H	α-helix	trans	-61.3	-48.2	173	-71.2	164.3	0	0	0	109.8	D645 K651 S652 T653	D645-I649 VanDerWaalsContact O-CB 3.3Å; D645-I649 WeakPolarHBondContact O-CB 3.31Å; D645-I649 WeakPolarHBondContact O-CD1 3.44Å; D645-I649 WeakPolarHBondContact O-CG1 3.44Å; D645-I649 PolarHBondContact O-N 2.92Å; I649-K651 VanDerWaalsContact C-N 3.33Å; I649-K651 PolarHBondContact O-N 3.44Å; I649-S652 PolarHBondContact O-N 3.31Å; I649-S652 VanDerWaalsContact O-N 3.1Å; I649-T653 PolarHBondContact O-N 2.97Å; I649-T653 PolarHBondContact O-OG1 2.98Å; I649-T653 VanDerWaalsContact O-OG1 3.06Å
650	R	48.5	Very low	49.5	Very low	146 Å²	146	108.8 Å²	108.8	55%	0.551	55%	0.55	S	S	*	*	H	α-helix	trans	-59.2	-40.1	175.6	-79.3	-175.8	-176.5	102.6	6.5	113.1	E646 F647 A654	E646-R650 VanDerWaalsContact CD-NH1 3.35Å; E646-R650 WeakPolarHBondContact O-CB 3.46Å; E646-R650 VanDerWaalsContact O-CG 3.32Å; E646-R650 WeakPolarHBondContact O-CG 3.23Å; E646-R650 PolarHBondContact O-N 3.1Å; E646-R650 IonicContact OE1-CZ 3.65Å; E646-R650 IonicContact OE1-NH1 2.69Å; E646-R650 PolarHBondContact OE1-NH1 2.65Å; E646-R650 IonicContact OE1-NH2 2.67Å; E646-R650 PolarHBondContact OE1-NH2 3.19Å; F647-R650 PolarHBondContact O-N 2.72Å; R650-A654 WeakPolarHBondContact O-CB 3.25Å; R650-A654 PolarHBondContact O-N 3.37Å
651	K	50	Low	50.6	Low	141 Å²	141	102.8 Å²	102.8	61%	0.613	53%	0.533	S	S	*	.	H	α-helix	trans	-65.8	-38.1	173.1	-86.3	-162.7	167.2	-163.8	0	113.1	F647 Q648 I649 A654 A655	F647-K651 HydrophobicContact CE1-CD 4.46Å; F647-K651 PolarHBondContact O-N 3.09Å; Q648-K651 PolarHBondContact O-N 3.07Å; I649-K651 VanDerWaalsContact C-N 3.33Å; I649-K651 PolarHBondContact O-N 3.44Å; K651-A654 PolarHBondContact O-N 2.9Å; K651-A655 WeakPolarHBondContact O-CB 3.49Å; K651-A655 PolarHBondContact O-N 3.26Å
652	S	51.2	Low	52	Low	68 Å²	68	98 Å²	98	48%	0.476	52%	0.516	S	S	.	.	H	α-helix	trans	-68.9	-39.9	177	-168.2	0	0	0	0	111.4	Q648 I649 A655 L656	Q648-S652 WeakPolarHBondContact O-CB 3.46Å; Q648-S652 PolarHBondContact O-N 2.65Å; I649-S652 PolarHBondContact O-N 3.31Å; I649-S652 VanDerWaalsContact O-N 3.1Å; S652-A655 PolarHBondContact O-N 3.13Å; S652-L656 WeakPolarHBondContact O-CB 3.47Å; S652-L656 VanDerWaalsContact O-CG 3.23Å; S652-L656 WeakPolarHBondContact O-CG 3.33Å; S652-L656 PolarHBondContact O-N 3.19Å
653	T	58.2	Low	53.2	Low	79 Å²	79	98.8 Å²	98.8	49%	0.485	51%	0.514	S	S	.	.	H	α-helix	trans	-64.7	-44.2	172.1	-52.3	0	0	0	0	111.5	I649 L656 E657	I649-T653 PolarHBondContact O-N 2.97Å; I649-T653 PolarHBondContact O-OG1 2.98Å; I649-T653 VanDerWaalsContact O-OG1 3.06Å; T653-L656 CarbonylContact O-C 3.57Å; T653-L656 PolarHBondContact O-N 3.33Å; T653-E657 WeakPolarHBondContact O-CB 3.41Å; T653-E657 PolarHBondContact O-N 2.77Å
654	A	59.9	Low	54	Low	41 Å²	41	103.6 Å²	103.6	34%	0.339	52%	0.523	S	S	.	.	H	α-helix	trans	-63.2	-42.5	176.3	0	0	0	0	0	112.3	R650 K651 L656 E657 E658	R650-A654 WeakPolarHBondContact O-CB 3.25Å; R650-A654 PolarHBondContact O-N 3.37Å; K651-A654 PolarHBondContact O-N 2.9Å; A654-L656 VanDerWaalsContact C-N 3.35Å; A654-L656 PolarHBondContact O-N 3.12Å; A654-E657 CarbonylContact O-C 3.52Å; A654-E657 PolarHBondContact O-N 2.89Å; A654-E657 VanDerWaalsContact O-N 3.15Å; A654-E658 WeakPolarHBondContact O-CG 3.41Å; A654-E658 PolarHBondContact O-N 3.03Å
655	A	61.3	Low	54.9	Low	44 Å²	44	102.6 Å²	102.6	36%	0.364	52%	0.52	S	S	.	.	H	α-helix	trans	-64.7	-37.4	174.9	0	0	0	0	0	112.3	K651 S652 E657 E658 D659	K651-A655 WeakPolarHBondContact O-CB 3.49Å; K651-A655 PolarHBondContact O-N 3.26Å; S652-A655 PolarHBondContact O-N 3.13Å; A655-E657 VanDerWaalsContact C-N 3.31Å; A655-E658 PolarHBondContact O-N 3.1Å; A655-D659 WeakPolarHBondContact O-CB 3.3Å; A655-D659 PolarHBondContact O-N 3.21Å
656	L	57	Low	55.8	Low	111 Å²	111	101.8 Å²	101.8	58%	0.581	52%	0.515	S	S	*	.	H	α-helix	trans	-71.5	-25	173.2	-72.1	168.8	0	0	0	113	S652 T653 A654 A660	S652-L656 WeakPolarHBondContact O-CB 3.47Å; S652-L656 VanDerWaalsContact O-CG 3.23Å; S652-L656 WeakPolarHBondContact O-CG 3.33Å; S652-L656 PolarHBondContact O-N 3.19Å; T653-L656 CarbonylContact O-C 3.57Å; T653-L656 PolarHBondContact O-N 3.33Å; A654-L656 VanDerWaalsContact C-N 3.35Å; A654-L656 PolarHBondContact O-N 3.12Å; L656-A660 WeakPolarHBondContact O-CB 3.44Å; L656-A660 PolarHBondContact O-N 3.45Å
657	E	63.7	Low	56.2	Low	136 Å²	136	103.2 Å²	103.2	64%	0.636	52%	0.522	S	S	*	.	H	α-helix	trans	-78.5	-38.6	173.5	-168.5	161.3	-153.6	0	0	110.8	T653 A654 A655 A660 Q661	T653-E657 WeakPolarHBondContact O-CB 3.41Å; T653-E657 PolarHBondContact O-N 2.77Å; A654-E657 CarbonylContact O-C 3.52Å; A654-E657 PolarHBondContact O-N 2.89Å; A654-E657 VanDerWaalsContact O-N 3.15Å; A655-E657 VanDerWaalsContact C-N 3.31Å; E657-A660 PolarHBondContact O-N 3.09Å; E657-Q661 WeakPolarHBondContact O-CB 3.17Å; E657-Q661 PolarHBondContact O-N 3.43Å
658	E	64.5	Low	56.6	Low	131 Å²	131	99.1 Å²	99.1	61%	0.612	51%	0.512	S	S	*	.	H	α-helix	trans	-63	-47.9	168	-73.5	172.6	-177.2	0	0	111.6	A654 A655 A660 Q661 I662	A654-E658 WeakPolarHBondContact O-CG 3.41Å; A654-E658 PolarHBondContact O-N 3.03Å; A655-E658 PolarHBondContact O-N 3.1Å; E658-A660 VanDerWaalsContact C-N 3.33Å; E658-A660 PolarHBondContact O-N 3.22Å; E658-Q661 CarbonylContact O-C 3.56Å; E658-Q661 WeakPolarHBondContact O-CA 3.22Å; E658-Q661 WeakPolarHBondContact O-CB 3.22Å; E658-Q661 PolarHBondContact O-N 2.99Å; E658-Q661 VanDerWaalsContact O-N 3.09Å; E658-I662 VanDerWaalsContact O-CG1 3.32Å; E658-I662 WeakPolarHBondContact O-CG1 3.15Å; E658-I662 PolarHBondContact O-N 2.63Å
659	D	57.3	Low	56.5	Low	89 Å²	89	101.8 Å²	101.8	48%	0.476	52%	0.518	S	S	.	.	H	α-helix	trans	-61.6	-39.1	173.7	-83.2	-21.5	0	0	0	111.5	A655 Q661 I662 L663	A655-D659 WeakPolarHBondContact O-CB 3.3Å; A655-D659 PolarHBondContact O-N 3.21Å; D659-Q661 VanDerWaalsContact C-N 3.33Å; D659-I662 PolarHBondContact O-N 2.84Å; D659-L663 WeakPolarHBondContact O-CB 3.34Å; D659-L663 VanDerWaalsContact O-CG 3.26Å; D659-L663 WeakPolarHBondContact O-CG 3.08Å; D659-L663 PolarHBondContact O-N 3.48Å
660	A	62.8	Low	56.2	Low	47 Å²	47	100.2 Å²	100.2	39%	0.388	52%	0.516	S	S	.	.	H	α-helix	trans	-66.3	-35.2	173.1	0	0	0	0	0	112	L656 E657 E658 R664	L656-A660 WeakPolarHBondContact O-CB 3.44Å; L656-A660 PolarHBondContact O-N 3.45Å; E657-A660 PolarHBondContact O-N 3.09Å; E658-A660 VanDerWaalsContact C-N 3.33Å; E658-A660 PolarHBondContact O-N 3.22Å; A660-R664 VanDerWaalsContact O-CB 3.3Å; A660-R664 WeakPolarHBondContact O-CB 3.44Å; A660-R664 WeakPolarHBondContact O-CG 3.32Å; A660-R664 PolarHBondContact O-N 2.63Å
661	Q	54.3	Low	56.2	Low	121 Å²	121	96.6 Å²	96.6	57%	0.565	51%	0.51	S	S	*	.	H	α-helix	trans	-67	-42.5	174.2	-151.3	79.5	-33.7	0	0	110.9	E657 E658 D659 R664 V665	E657-Q661 WeakPolarHBondContact O-CB 3.17Å; E657-Q661 PolarHBondContact O-N 3.43Å; E658-Q661 CarbonylContact O-C 3.56Å; E658-Q661 WeakPolarHBondContact O-CA 3.22Å; E658-Q661 WeakPolarHBondContact O-CB 3.22Å; E658-Q661 PolarHBondContact O-N 2.99Å; E658-Q661 VanDerWaalsContact O-N 3.09Å; D659-Q661 VanDerWaalsContact C-N 3.33Å; Q661-R664 WeakPolarHBondContact O-CB 3.17Å; Q661-R664 PolarHBondContact O-N 2.92Å; Q661-V665 WeakPolarHBondContact O-CG2 3.24Å; Q661-V665 PolarHBondContact O-N 3.35Å
662	I	67.4	Low	55.6	Low	91 Å²	91	92.9 Å²	92.9	47%	0.467	51%	0.511	S	S	.	.	H	α-helix	trans	-63.8	-46.1	174.7	-69.2	163.3	0	0	0	110.3	E658 D659 R664 V665 I666	E658-I662 VanDerWaalsContact O-CG1 3.32Å; E658-I662 WeakPolarHBondContact O-CG1 3.15Å; E658-I662 PolarHBondContact O-N 2.63Å; D659-I662 PolarHBondContact O-N 2.84Å; I662-R664 VanDerWaalsContact C-N 3.31Å; I662-R664 PolarHBondContact O-N 2.89Å; I662-V665 PolarHBondContact O-N 2.92Å; I662-V665 VanDerWaalsContact O-N 3.14Å; I662-I666 HydrophobicContact CG2-CD1 3.82Å; I662-I666 HydrophobicContact CG2-CG1 4.49Å; I662-I666 WeakPolarHBondContact O-CG1 3.43Å; I662-I666 PolarHBondContact O-N 2.75Å
663	L	59.9	Low	55	Low	114 Å²	114	93.8 Å²	93.8	60%	0.597	52%	0.523	S	S	*	.	H	α-helix	trans	-63	-35.6	175.3	-74.1	169.5	0	0	0	112.1	D659 I666 E667	D659-L663 WeakPolarHBondContact O-CB 3.34Å; D659-L663 VanDerWaalsContact O-CG 3.26Å; D659-L663 WeakPolarHBondContact O-CG 3.08Å; D659-L663 PolarHBondContact O-N 3.48Å; L663-I666 PolarHBondContact O-N 2.71Å; L663-E667 WeakPolarHBondContact O-CB 3.5Å; L663-E667 PolarHBondContact O-N 2.99Å
664	R	59.5	Low	53.7	Low	161 Å²	161	94.5 Å²	94.5	61%	0.608	53%	0.531	S	S	*	.	H	α-helix	trans	-67.8	-35.6	171.5	-77.9	-77.9	-164.1	70.3	6.8	113.1	A660 Q661 I662 E667 A668	A660-R664 VanDerWaalsContact O-CB 3.3Å; A660-R664 WeakPolarHBondContact O-CB 3.44Å; A660-R664 WeakPolarHBondContact O-CG 3.32Å; A660-R664 PolarHBondContact O-N 2.63Å; Q661-R664 WeakPolarHBondContact O-CB 3.17Å; Q661-R664 PolarHBondContact O-N 2.92Å; I662-R664 VanDerWaalsContact C-N 3.31Å; I662-R664 PolarHBondContact O-N 2.89Å; R664-E667 WeakPolarHBondContact CD-OE2 3.42Å; R664-A668 VanDerWaalsContact O-CB 3.25Å; R664-A668 WeakPolarHBondContact O-CB 3.34Å; R664-A668 PolarHBondContact O-N 3.43Å
665	V	59.1	Low	52.5	Low	91 Å²	91	97.4 Å²	97.4	55%	0.552	54%	0.541	S	S	*	.	H	α-helix	trans	-70.7	-40.8	174.5	167.9	0	0	0	0	110.7	Q661 I662 A668 Y669	Q661-V665 WeakPolarHBondContact O-CG2 3.24Å; Q661-V665 PolarHBondContact O-N 3.35Å; I662-V665 PolarHBondContact O-N 2.92Å; I662-V665 VanDerWaalsContact O-N 3.14Å; V665-A668 PolarHBondContact O-N 2.71Å; V665-Y669 WeakPolarHBondContact O-CB 3.47Å; V665-Y669 PolarHBondContact O-N 3.29Å
666	I	62	Low	51.5	Low	88 Å²	88	102.3 Å²	102.3	45%	0.451	56%	0.556	S	S	.	*	H	α-helix	trans	-64.9	-43.9	172.7	-66.9	166.4	0	0	0	110.3	I662 L663 A668 Y669 C670	I662-I666 HydrophobicContact CG2-CD1 3.82Å; I662-I666 HydrophobicContact CG2-CG1 4.49Å; I662-I666 WeakPolarHBondContact O-CG1 3.43Å; I662-I666 PolarHBondContact O-N 2.75Å; L663-I666 PolarHBondContact O-N 2.71Å; I666-A668 VanDerWaalsContact C-N 3.33Å; I666-A668 PolarHBondContact O-N 3.02Å; I666-Y669 PolarHBondContact O-N 3.21Å; I666-C670 VanDerWaalsContact O-CB 3.27Å; I666-C670 WeakPolarHBondContact O-CB 3.47Å; I666-C670 PolarHBondContact O-N 2.85Å; I666-C670 PolarHBondContact O-SG 2.93Å; I666-C670 VanDerWaalsContact O-SG 3.33Å
667	E	48.6	Very low	50.4	Low	112 Å²	112	104.4 Å²	104.4	52%	0.523	56%	0.563	S	S	.	*	H	α-helix	trans	-59.1	-42.9	173	-177.3	178.2	-148.3	0	0	111	L663 R664 T671	L663-E667 WeakPolarHBondContact O-CB 3.5Å; L663-E667 PolarHBondContact O-N 2.99Å; R664-E667 WeakPolarHBondContact CD-OE2 3.42Å; E667-T671 HydrophobicContact CG-CG2 4.44Å; E667-T671 VanDerWaalsContact O-CB 3.28Å; E667-T671 WeakPolarHBondContact O-CB 3.43Å; E667-T671 VanDerWaalsContact O-CG2 3.31Å; E667-T671 WeakPolarHBondContact O-CG2 3.33Å; E667-T671 PolarHBondContact O-N 3.35Å; E667-T671 PolarHBondContact O-OG1 2.7Å
668	A	50.2	Low	48.8	Very low	41 Å²	41	102.3 Å²	102.3	34%	0.339	56%	0.559	S	S	.	*	H	α-helix	trans	-67	-34.6	175.5	0	0	0	0	0	113.2	R664 V665 I666 T671 G672	R664-A668 VanDerWaalsContact O-CB 3.25Å; R664-A668 WeakPolarHBondContact O-CB 3.34Å; R664-A668 PolarHBondContact O-N 3.43Å; V665-A668 PolarHBondContact O-N 2.71Å; I666-A668 VanDerWaalsContact C-N 3.33Å; I666-A668 PolarHBondContact O-N 3.02Å; A668-T671 WeakPolarHBondContact CA-OG1 3.41Å; A668-T671 PolarHBondContact O-OG1 3.03Å; A668-G672 WeakPolarHBondContact O-CA 3.49Å; A668-G672 PolarHBondContact O-N 3.05Å
669	Y	44	Very low	46.9	Very low	176 Å²	176	102 Å²	102	69%	0.69	57%	0.566	S	S	*	*	H	α-helix	trans	-73.6	-44	176	-133.1	-88.6	0	0	0	111.6	V665 I666 G672 A673	V665-Y669 WeakPolarHBondContact O-CB 3.47Å; V665-Y669 PolarHBondContact O-N 3.29Å; I666-Y669 PolarHBondContact O-N 3.21Å; Y669-G672 PolarHBondContact O-N 3.19Å; Y669-A673 PolarHBondContact O-N 3.31Å
670	C	40.3	Very low	45.4	Very low	77 Å²	77	104.1 Å²	104.1	52%	0.52	58%	0.583	S	S	.	*	H	α-helix	trans	-70.1	-36.8	177.6	-69.9	0	0	0	0	112.2	I666 A673 S674	I666-C670 VanDerWaalsContact O-CB 3.27Å; I666-C670 WeakPolarHBondContact O-CB 3.47Å; I666-C670 PolarHBondContact O-N 2.85Å; I666-C670 PolarHBondContact O-SG 2.93Å; I666-C670 VanDerWaalsContact O-SG 3.33Å; C670-A673 PolarHBondContact O-N 3.4Å; C670-S674 WeakPolarHBondContact O-CB 3.44Å; C670-S674 PolarHBondContact O-N 3.14Å
671	T	48.4	Very low	43.7	Very low	69 Å²	69	105.8 Å²	105.8	42%	0.423	60%	0.596	S	S	.	*	H	α-helix	trans	-73.3	-30.8	169	54.9	0	0	0	0	111.8	E667 A668 A673 S674 L675	E667-T671 HydrophobicContact CG-CG2 4.44Å; E667-T671 VanDerWaalsContact O-CB 3.28Å; E667-T671 WeakPolarHBondContact O-CB 3.43Å; E667-T671 VanDerWaalsContact O-CG2 3.31Å; E667-T671 WeakPolarHBondContact O-CG2 3.33Å; E667-T671 PolarHBondContact O-N 3.35Å; E667-T671 PolarHBondContact O-OG1 2.7Å; A668-T671 WeakPolarHBondContact CA-OG1 3.41Å; A668-T671 PolarHBondContact O-OG1 3.03Å; T671-A673 PolarHBondContact O-N 2.83Å; T671-S674 PolarHBondContact O-N 3.34Å; T671-L675 WeakPolarHBondContact O-CA 3.27Å; T671-L675 WeakPolarHBondContact O-CB 3.35Å; T671-L675 PolarHBondContact O-N 2.98Å
672	G	38.7	Very low	42.4	Very low	63 Å²	63	106.2 Å²	106.2	65%	0.649	61%	0.607	S	S	*	*	H	α-helix	trans	-59	-34.5	167.5	0	0	0	0	0	113.2	A668 Y669	A668-G672 WeakPolarHBondContact O-CA 3.49Å; A668-G672 PolarHBondContact O-N 3.05Å; Y669-G672 PolarHBondContact O-N 3.19Å
673	A	37.6	Very low	40.4	Very low	88 Å²	88	113.6 Å²	113.6	73%	0.727	63%	0.629	S	S	*	*	H	α-helix	trans	-85.3	-21.6	174.5	0	0	0	0	0	114.5	Y669 C670 T671	Y669-A673 PolarHBondContact O-N 3.31Å; C670-A673 PolarHBondContact O-N 3.4Å; T671-A673 PolarHBondContact O-N 2.83Å
674	S	31.5	Very low	38.8	Very low	93 Å²	93	117.5 Å²	117.5	65%	0.65	64%	0.641	S	S	*	*	H	α-helix	trans	-109.7	-19.7	-171.3	-170	0	0	0	0	114.4	C670 T671 H676	C670-S674 WeakPolarHBondContact O-CB 3.44Å; C670-S674 PolarHBondContact O-N 3.14Å; T671-S674 PolarHBondContact O-N 3.34Å; S674-H676 PolarHBondContact O-N 3.38Å
675	L	34.3	Very low	37.4	Very low	102 Å²	102	119 Å²	119	53%	0.534	66%	0.655	S	S	.	*			trans	-78.9	42.7	179.3	-160.9	72.3	0	0	0	112.9	T671 T678	T671-L675 WeakPolarHBondContact O-CA 3.27Å; T671-L675 WeakPolarHBondContact O-CB 3.35Å; T671-L675 PolarHBondContact O-N 2.98Å; L675-T678 WeakPolarHBondContact CD1-O 3.28Å
676	H	41.1	Very low	35.7	Very low	147 Å²	147	120.7 Å²	120.7	68%	0.681	67%	0.67	S	S	*	*	S	Bend	trans	-109.6	31.4	164.5	-94.9	-32.3	0	0	0	113.4	S674	S674-H676 PolarHBondContact O-N 3.38Å
677	Q	34.3	Very low	34.1	Very low	156 Å²	156	122.3 Å²	122.3	73%	0.729	68%	0.683	S	S	*	*	S	Bend	trans	-141.2	5	164.5	-129.1	169.8	65.3	0	0	118.4
678	T	28.7	Very low	33.1	Very low	92 Å²	92	121.9 Å²	121.9	56%	0.564	69%	0.69	S	S	*	*			trans	-156.8	117.2	164.4	-0.5	0	0	0	0	114.6	L675	L675-T678 WeakPolarHBondContact CD1-O 3.28Å
679	T	25.8	Very low	32	Very low	123 Å²	123	127 Å²	127	76%	0.755	71%	0.707	S	S	*	*			trans	176.2	84.7	132.2	26.5	0	0	0	0	112.8
680	T	25.6	Very low	31.2	Very low	135 Å²	135	123.2 Å²	123.2	83%	0.828	70%	0.702	S	S	*	*			trans	-131.1	114.6	158	46.4	0	0	0	0	111
681	A	26.8	Very low	30.9	Very low	81 Å²	81	125.4 Å²	125.4	67%	0.669	71%	0.708	S	S	*	*			trans	-173	128.7	178	0	0	0	0	0	107.7
682	V	27.1	Very low	30	Very low	131 Å²	131	124.7 Å²	124.7	79%	0.794	70%	0.702	S	S	*	*			cis	-147.7	129.1	4.5	177.9	0	0	0	0	109.8
683	R	24.7	Very low	29.8	Very low	246 Å²	246	125.2 Å²	125.2	93%	0.928	69%	0.694	S	S	*	*	S	Bend	trans	-148.3	110.5	143.2	-75.3	-156.4	172.6	166.1	1.2	111.7
684	K	25.7	Very low	29.9	Very low	196 Å²	196	129.5 Å²	129.5	85%	0.852	70%	0.698	S	S	*	*			trans	29.8	99.8	162.1	-67.3	-169.6	173.5	-173.1	0	119.4
685	E	30.8	Very low	30.4	Very low	191 Å²	191	133.7 Å²	133.7	89%	0.893	71%	0.708	S	S	*	*			trans	5.5	109.5	143.5	-61.4	168.1	141	0	0	118.6
686	C	22.9	Very low	30.6	Very low	127 Å²	127	135.2 Å²	135.2	86%	0.858	71%	0.712	S	S	*	*			trans	-128.4	150.2	132.2	-163.2	0	0	0	0	107	P688	C686-P688 WeakPolarHBondContact O-CD 3.48Å
687	V	28.9	Very low	30.7	Very low	122 Å²	122	133.9 Å²	133.9	74%	0.739	70%	0.704	S	S	*	*			trans	-116.6	106.1	-169.4	-178.9	0	0	0	0	111.5
688	P	26.9	Very low	30.9	Very low	104 Å²	104	130.8 Å²	130.8	68%	0.675	69%	0.692	S	S	*	*			trans	-73.6	130.4	160.2	-8.6	25.8	0	0	0	109.4	C686 V690	C686-P688 WeakPolarHBondContact O-CD 3.48Å; P688-V690 PolarHBondContact O-N 3.5Å
689	Q	27.4	Very low	31.4	Very low	148 Å²	148	131.5 Å²	131.5	69%	0.692	69%	0.691	S	S	*	*			trans	-80.3	103.9	166.6	-78	-169.6	-106	0	0	109.3	Y234 L691	Y234-Q689 PolarHBondContact OH-O 2.65Å; Q689-L691 PolarHBondContact O-N 3.14Å
690	V	28.6	Very low	32.2	Very low	97 Å²	97	129.3 Å²	129.3	59%	0.588	68%	0.677	S	S	*	*			trans	-68.3	114.5	168.9	-178.4	0	0	0	0	108.8	P688 L692	P688-V690 PolarHBondContact O-N 3.5Å; V690-L692 HydrophobicContact CG1-CD2 3.85Å; V690-L692 HydrophobicContact CG1-CG 4.05Å
691	L	32.2	Very low	32.7	Very low	122 Å²	122	129.1 Å²	129.1	64%	0.639	67%	0.667	S	S	*	*			trans	-106.5	117.2	164.3	-80.5	164.9	0	0	0	107.4	Q689	Q689-L691 PolarHBondContact O-N 3.14Å
692	L	30.8	Very low	33.5	Very low	55 Å²	55	129.9 Å²	129.9	29%	0.288	66%	0.657	S	S	.	*			trans	-94	135.2	171.7	-58.8	173.9	0	0	0	108.4	V690 V717	V690-L692 HydrophobicContact CG1-CD2 3.85Å; V690-L692 HydrophobicContact CG1-CG 4.05Å; L692-V717 HydrophobicContact CB-CG2 4.3Å; L692-V717 HydrophobicContact CD1-CG2 4.31Å
693	P	34.3	Very low	34.1	Very low	74 Å²	74	130 Å²	130	48%	0.481	65%	0.651	S	S	.	*			trans	-60.5	148.8	165.7	-22.3	34.7	0	0	0	111.4	E695	P693-E695 PolarHBondContact O-N 2.94Å; P693-E695 VanDerWaalsContact O-N 3.13Å
694	E	38.9	Very low	34.7	Very low	177 Å²	177	124.3 Å²	124.3	83%	0.827	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	17	-165.7	-61.9	175.3	107.4	0	0	114.5
695	E	41.8	Very low	35.6	Very low	182 Å²	182	121.6 Å²	121.6	85%	0.85	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.5	13.4	-161.5	-60.8	-164.9	152.3	0	0	116.3	P693	P693-E695 PolarHBondContact O-N 2.94Å; P693-E695 VanDerWaalsContact O-N 3.13Å
696	E	39.5	Very low	36.1	Very low	134 Å²	134	118.2 Å²	118.2	63%	0.626	63%	0.627	S	S	*	*			trans	-98.6	93.1	162.1	-74.7	-165.4	161.6	0	0	111.1
697	K	42.3	Very low	36.8	Very low	118 Å²	118	115.5 Å²	115.5	51%	0.513	62%	0.621	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.1	122.2	169.8	-55.7	-173.2	-169.3	177.5	0	109.9	I699 E713	K697-I699 PolarHBondContact O-N 2.96Å; K697-E713 HydrophobicContact CB-CB 4.47Å; K697-E713 HydrophobicContact CD-CB 4.16Å; K697-E713 HydrophobicContact CD-CG 4.07Å; K697-E713 WeakPolarHBondContact CD-OE1 3.45Å; K697-E713 WeakPolarHBondContact CD-OE2 3.26Å; K697-E713 IonicContact NZ-OE1 2.74Å; K697-E713 PolarHBondContact NZ-OE1 2.82Å; K697-E713 IonicContact NZ-OE2 3.79Å; K697-E713 PolarHBondContact NZ-OE2 3.43Å
698	I	40	Very low	36.9	Very low	92 Å²	92	116 Å²	116	47%	0.472	62%	0.615	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.6	118.8	170.6	-58.6	178.3	0	0	0	108.2	V700 K714 L716	I698-V700 HydrophobicContact CG2-CG2 3.91Å; I698-K714 PolarHBondContact N-O 2.98Å; I698-K714 PolarHBondContact O-N 2.87Å; I698-L716 HydrophobicContact CD1-CD1 3.84Å
699	I	38.4	Very low	37.2	Very low	106 Å²	106	114.7 Å²	114.7	54%	0.544	61%	0.605	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.6	113.1	165.8	-60.2	175.8	0	0	0	107.4	K697 T711	K697-I699 PolarHBondContact O-N 2.96Å; I699-T711 HydrophobicContact CG2-CG2 3.6Å
700	V	43.1	Very low	37.9	Very low	77 Å²	77	111.5 Å²	111.5	47%	0.467	60%	0.596	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.3	116.7	169.1	-176.9	0	0	0	0	108.4	I698 E702 E712	I698-V700 HydrophobicContact CG2-CG2 3.91Å; V700-E702 PolarHBondContact O-N 2.72Å; V700-E712 PolarHBondContact N-O 2.73Å; V700-E712 PolarHBondContact O-N 2.8Å
701	E	35.6	Very low	38.2	Very low	131 Å²	131	110.8 Å²	110.8	61%	0.612	59%	0.592	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-84.5	100.2	168.7	-73.3	-165.7	161.4	0	0	109.9	T711	E701-T711 HydrophobicContact CG-CG2 3.89Å
702	E	44.5	Very low	38.8	Very low	98 Å²	98	107.9 Å²	107.9	46%	0.458	58%	0.575	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99	99.6	179.8	-157	166	-147.9	0	0	108.8	K21 V700 K704	K21-E702 IonicContact NZ-OE2 2.81Å; K21-E702 PolarHBondContact NZ-OE2 3.46Å; V700-E702 PolarHBondContact O-N 2.72Å; E702-K704 PolarHBondContact O-N 2.73Å
703	I	38.7	Very low	39.3	Very low	132 Å²	132	110.4 Å²	110.4	68%	0.677	59%	0.585	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-70.3	114.6	179.6	-58.1	173.2	0	0	0	109.1	T709	I703-T709 HydrophobicContact CG1-CG2 3.85Å
704	K	37.7	Very low	40.1	Very low	127 Å²	127	113.4 Å²	113.4	55%	0.552	59%	0.591	S	S	*	*			trans	-82.8	154.4	172.7	-70	-172.4	176.7	-174.9	0	111.6	E702 N706 G707	E702-K704 PolarHBondContact O-N 2.73Å; K704-N706 WeakPolarHBondContact CB-OD1 3.45Å; K704-N706 PolarHBondContact O-N 2.88Å; K704-G707 PolarHBondContact O-N 3.32Å
705	S	44.9	Very low	40.8	Very low	139 Å²	139	107.2 Å²	107.2	97%	0.972	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	0.1	-176.9	49.3	0	0	0	0	115.7
706	N	41.3	Very low	41.3	Very low	120 Å²	120	101.2 Å²	101.2	64%	0.642	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	3.7	169.9	69	-18.2	0	0	0	113.7	K704	K704-N706 WeakPolarHBondContact CB-OD1 3.45Å; K704-N706 PolarHBondContact O-N 2.88Å
707	G	37.6	Very low	41.7	Very low	70 Å²	70	96.5 Å²	96.5	72%	0.722	52%	0.521	S	S	*	.	S	Bend	trans	82.1	9.8	173.7	0	0	0	0	0	115.8	K704	K704-G707 PolarHBondContact O-N 3.32Å
708	Q	30.8	Very low	42.7	Very low	133 Å²	133	96.5 Å²	96.5	62%	0.621	53%	0.526	S	S	*	.			trans	-106.9	120.9	175.8	-166.9	170.6	14.2	0	0	110.9
709	T	33.9	Very low	44.1	Very low	76 Å²	76	94.6 Å²	94.6	47%	0.466	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	138.6	171.2	37.1	0	0	0	0	110.8	I703	I703-T709 HydrophobicContact CG1-CG2 3.85Å
710	V	40.4	Very low	45.3	Very low	81 Å²	81	93 Å²	93	49%	0.491	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	113.2	169	-179.7	0	0	0	0	108.2
711	T	35.3	Very low	46.2	Very low	82 Å²	82	95.1 Å²	95.1	50%	0.503	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	124.7	171.6	49.3	0	0	0	0	110.1	I699 E701	I699-T711 HydrophobicContact CG2-CG2 3.6Å; E701-T711 HydrophobicContact CG-CG2 3.89Å
712	E	45.9	Very low	48	Very low	62 Å²	62	91.8 Å²	91.8	29%	0.29	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	127	172.4	-163	174.6	-125.6	0	0	110.2	K21 V700	K21-E712 WeakPolarHBondContact CD-OE2 3.13Å; K21-E712 WeakPolarHBondContact CE-OE2 3.46Å; K21-E712 IonicContact NZ-OE2 2.9Å; K21-E712 PolarHBondContact NZ-OE2 2.89Å; V700-E712 PolarHBondContact N-O 2.73Å; V700-E712 PolarHBondContact O-N 2.8Å
713	E	40	Very low	49.2	Very low	108 Å²	108	91.2 Å²	91.2	51%	0.505	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	137	-179.2	-59.9	178	136.4	0	0	110.8	K697	K697-E713 HydrophobicContact CB-CB 4.47Å; K697-E713 HydrophobicContact CD-CB 4.16Å; K697-E713 HydrophobicContact CD-CG 4.07Å; K697-E713 WeakPolarHBondContact CD-OE1 3.45Å; K697-E713 WeakPolarHBondContact CD-OE2 3.26Å; K697-E713 IonicContact NZ-OE1 2.74Å; K697-E713 PolarHBondContact NZ-OE1 2.82Å; K697-E713 IonicContact NZ-OE2 3.79Å; K697-E713 PolarHBondContact NZ-OE2 3.43Å
714	K	52.6	Low	51	Low	136 Å²	136	90.8 Å²	90.8	59%	0.591	51%	0.507	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.4	149.1	163.8	-72.4	-167.8	175.3	-171	0	111.6	I698	I698-K714 PolarHBondContact N-O 2.98Å; I698-K714 PolarHBondContact O-N 2.87Å
715	S	53.4	Low	53	Low	47 Å²	47	89.2 Å²	89.2	33%	0.329	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	132.2	176.4	-178.7	0	0	0	0	111	V717	S715-V717 PolarHBondContact O-N 3.44Å; S715-V717 PolarHBondContact OG-N 2.91Å
716	L	52.1	Low	54.8	Low	57 Å²	57	88.4 Å²	88.4	30%	0.298	49%	0.486	S	S	.	.	H	α-helix	trans	-56.4	-33.9	173.5	-170.6	74.3	0	0	0	112.2	I698 A719 V720	I698-L716 HydrophobicContact CD1-CD1 3.84Å; L716-A719 PolarHBondContact O-N 2.97Å; L716-V720 HydrophobicContact CG-CG2 4.41Å; L716-V720 WeakPolarHBondContact O-CG2 3.42Å; L716-V720 PolarHBondContact O-N 3.07Å; L716-V720 VanDerWaalsContact O-N 3.1Å
717	V	46.9	Very low	56.5	Low	35 Å²	35	85.9 Å²	85.9	21%	0.212	48%	0.475	C	S	.	.	H	α-helix	trans	-64.1	-45.3	-171.4	-178.2	0	0	0	0	112.1	L692 S715 A719 V720 Y721	L692-V717 HydrophobicContact CB-CG2 4.3Å; L692-V717 HydrophobicContact CD1-CG2 4.31Å; S715-V717 PolarHBondContact O-N 3.44Å; S715-V717 PolarHBondContact OG-N 2.91Å; V717-A719 PolarHBondContact O-N 3.01Å; V717-V720 PolarHBondContact O-N 2.88Å; V717-Y721 HydrophobicContact CG1-CD2 3.76Å; V717-Y721 HydrophobicContact CG1-CE2 3.5Å; V717-Y721 VanDerWaalsContact CG1-CE2 3.5Å; V717-Y721 VanDerWaalsContact O-CD2 3.27Å; V717-Y721 WeakPolarHBondContact O-CD2 3.28Å; V717-Y721 PolarHBondContact O-N 3.44Å
718	D	62.9	Low	58.7	Low	117 Å²	117	88.3 Å²	88.3	63%	0.626	47%	0.467	S	S	*	.	H	α-helix	trans	-67.3	-37.8	-178.8	-64.3	-43	0	0	0	111.8	Y721 A722	D718-Y721 PolarHBondContact O-N 3.09Å; D718-A722 WeakPolarHBondContact O-CB 3.42Å; D718-A722 PolarHBondContact O-N 3.31Å
719	A	69.6	Low	61.3	Low	53 Å²	53	86.4 Å²	86.4	44%	0.438	46%	0.458	S	S	.	.	H	α-helix	trans	-65.3	-41.4	176.6	0	0	0	0	0	111.8	L716 V717 A722 L723	L716-A719 PolarHBondContact O-N 2.97Å; V717-A719 PolarHBondContact O-N 3.01Å; A719-A722 PolarHBondContact O-N 3.45Å; A719-L723 WeakPolarHBondContact O-CB 3.4Å; A719-L723 WeakPolarHBondContact O-CG 3.5Å; A719-L723 PolarHBondContact O-N 3.35Å
720	V	63.5	Low	63.4	Low	71 Å²	71	87.4 Å²	87.4	43%	0.43	46%	0.46	S	S	.	.	H	α-helix	trans	-66.7	-39.1	177.3	170.7	0	0	0	0	111.8	L716 V717 K724	L716-V720 HydrophobicContact CG-CG2 4.41Å; L716-V720 WeakPolarHBondContact O-CG2 3.42Å; L716-V720 PolarHBondContact O-N 3.07Å; L716-V720 VanDerWaalsContact O-N 3.1Å; V717-V720 PolarHBondContact O-N 2.88Å; V720-K724 VanDerWaalsContact O-CB 3.24Å; V720-K724 WeakPolarHBondContact O-CB 3.31Å; V720-K724 PolarHBondContact O-N 3.28Å
721	Y	62.6	Low	65.4	Low	122 Å²	122	89.5 Å²	89.5	48%	0.478	46%	0.463	S	S	.	.	H	α-helix	trans	-68.4	-41.5	175	-77.2	-57.6	0	0	0	112.7	V717 D718 K724 D725	V717-Y721 HydrophobicContact CG1-CD2 3.76Å; V717-Y721 HydrophobicContact CG1-CE2 3.5Å; V717-Y721 VanDerWaalsContact CG1-CE2 3.5Å; V717-Y721 VanDerWaalsContact O-CD2 3.27Å; V717-Y721 WeakPolarHBondContact O-CD2 3.28Å; V717-Y721 PolarHBondContact O-N 3.44Å; D718-Y721 PolarHBondContact O-N 3.09Å; Y721-K724 HydrophobicContact CD1-CD 4.44Å; Y721-K724 PolarHBondContact O-N 3.39Å; Y721-D725 PolarHBondContact O-N 3.37Å; Y721-D725 VanDerWaalsContact O-N 3.12Å
722	A	74.1	Confident	67.8	Low	61 Å²	61	91.1 Å²	91.1	50%	0.504	46%	0.463	S	S	.	.	H	α-helix	trans	-60	-50.5	176.2	0	0	0	0	0	112.1	D718 A719 K724 D725 E726	D718-A722 WeakPolarHBondContact O-CB 3.42Å; D718-A722 PolarHBondContact O-N 3.31Å; A719-A722 PolarHBondContact O-N 3.45Å; A722-K724 VanDerWaalsContact C-N 3.3Å; A722-K724 PolarHBondContact O-N 2.88Å; A722-D725 PolarHBondContact O-N 3.01Å; A722-E726 PolarHBondContact O-N 3.04Å
723	L	68.8	Low	69.7	Low	86 Å²	86	93.2 Å²	93.2	45%	0.45	47%	0.472	S	S	.	.	H	α-helix	trans	-60.4	-38.2	177	-77	167.4	0	0	0	112.4	A719 V727	A719-L723 WeakPolarHBondContact O-CB 3.4Å; A719-L723 WeakPolarHBondContact O-CG 3.5Å; A719-L723 PolarHBondContact O-N 3.35Å; L723-V727 WeakPolarHBondContact O-CB 3.47Å; L723-V727 VanDerWaalsContact O-CG2 3.24Å; L723-V727 WeakPolarHBondContact O-CG2 3.38Å; L723-V727 PolarHBondContact O-N 3.43Å
724	K	76.8	Confident	71.4	Confident	123 Å²	123	93.2 Å²	93.2	54%	0.535	48%	0.476	S	S	.	.	H	α-helix	trans	-63.2	-43.7	178.4	179.1	-164.8	166.9	-150.5	0	112	V720 Y721 A722 H728	V720-K724 VanDerWaalsContact O-CB 3.24Å; V720-K724 WeakPolarHBondContact O-CB 3.31Å; V720-K724 PolarHBondContact O-N 3.28Å; Y721-K724 HydrophobicContact CD1-CD 4.44Å; Y721-K724 PolarHBondContact O-N 3.39Å; A722-K724 VanDerWaalsContact C-N 3.3Å; A722-K724 PolarHBondContact O-N 2.88Å; K724-H728 WeakPolarHBondContact O-CB 3.2Å; K724-H728 PolarHBondContact O-N 3.15Å
725	D	78.9	Confident	73.1	Confident	95 Å²	95	93.4 Å²	93.4	51%	0.508	48%	0.477	S	S	.	.	H	α-helix	trans	-74.1	-37	-177.9	-71.8	-7.3	0	0	0	111.1	Y721 A722 H728 E729	Y721-D725 PolarHBondContact O-N 3.37Å; Y721-D725 VanDerWaalsContact O-N 3.12Å; A722-D725 PolarHBondContact O-N 3.01Å; D725-H728 WeakPolarHBondContact O-CB 3.2Å; D725-H728 PolarHBondContact O-N 2.65Å; D725-H728 VanDerWaalsContact O-N 3.1Å; D725-E729 PolarHBondContact O-N 3.04Å
726	E	82.5	Confident	74.6	Confident	122 Å²	122	99.4 Å²	99.4	57%	0.57	49%	0.493	S	S	*	.	H	α-helix	trans	-61.1	-47.3	171.5	-173.8	170.3	-141.6	0	0	111.9	A722 H728 E729 L730	A722-E726 PolarHBondContact O-N 3.04Å; E726-H728 PolarHBondContact O-N 2.99Å; E726-E729 PolarHBondContact O-N 2.85Å; E726-L730 HydrophobicContact CG-CD1 4.27Å; E726-L730 WeakPolarHBondContact O-CB 3.34Å; E726-L730 WeakPolarHBondContact O-CG 3.26Å; E726-L730 PolarHBondContact O-N 2.89Å
727	V	77.7	Confident	75.9	Confident	67 Å²	67	102.2 Å²	102.2	41%	0.406	51%	0.505	S	S	.	.	H	α-helix	trans	-61.2	-31	172.2	168.1	0	0	0	0	111.9	L723 K731	L723-V727 WeakPolarHBondContact O-CB 3.47Å; L723-V727 VanDerWaalsContact O-CG2 3.24Å; L723-V727 WeakPolarHBondContact O-CG2 3.38Å; L723-V727 PolarHBondContact O-N 3.43Å; V727-K731 VanDerWaalsContact O-CB 3.23Å; V727-K731 WeakPolarHBondContact O-CB 3.23Å; V727-K731 PolarHBondContact O-N 2.8Å; V727-K731 VanDerWaalsContact O-N 3.09Å
728	H	83.1	Confident	77.9	Confident	120 Å²	120	106.5 Å²	106.5	56%	0.556	52%	0.521	S	S	*	.	H	α-helix	trans	-71.8	-42.5	178.6	-162.9	-6.3	0	0	0	112.5	K724 D725 E726 K731 K732	K724-H728 WeakPolarHBondContact O-CB 3.2Å; K724-H728 PolarHBondContact O-N 3.15Å; D725-H728 WeakPolarHBondContact O-CB 3.2Å; D725-H728 PolarHBondContact O-N 2.65Å; D725-H728 VanDerWaalsContact O-N 3.1Å; E726-H728 PolarHBondContact O-N 2.99Å; H728-K731 PolarHBondContact O-N 2.8Å; H728-K732 PolarHBondContact O-N 2.93Å
729	E	85.4	Confident	79	Confident	94 Å²	94	106.2 Å²	106.2	44%	0.439	52%	0.516	S	S	.	.	H	α-helix	trans	-69.5	-43.5	175.6	-74.9	-65.1	130.8	0	0	111.5	D725 E726 K731 K732 E733	D725-E729 PolarHBondContact O-N 3.04Å; E726-E729 PolarHBondContact O-N 2.85Å; E729-K731 PolarHBondContact O-N 3.28Å; E729-K732 CarbonylContact O-C 3.52Å; E729-K732 WeakPolarHBondContact O-CA 3.34Å; E729-K732 WeakPolarHBondContact O-CB 3.25Å; E729-K732 PolarHBondContact O-N 3.39Å; E729-K732 WeakPolarHBondContact OE1-CD 3.33Å; E729-K732 IonicContact OE1-NZ 2.73Å; E729-K732 PolarHBondContact OE1-NZ 2.86Å; E729-K732 WeakPolarHBondContact OE2-CD 3.47Å; E729-K732 WeakPolarHBondContact OE2-CE 3.44Å; E729-K732 IonicContact OE2-NZ 2.7Å; E729-K732 PolarHBondContact OE2-NZ 3.07Å; E729-E733 PolarHBondContact O-N 2.87Å
730	L	79.7	Confident	80	Confident	97 Å²	97	109.8 Å²	109.8	51%	0.508	52%	0.522	S	S	.	.	H	α-helix	trans	-55.8	-39.1	172.7	-74.1	170.3	0	0	0	112.4	E726 K732 N734	E726-L730 HydrophobicContact CG-CD1 4.27Å; E726-L730 WeakPolarHBondContact O-CB 3.34Å; E726-L730 WeakPolarHBondContact O-CG 3.26Å; E726-L730 PolarHBondContact O-N 2.89Å; L730-K732 VanDerWaalsContact C-N 3.29Å; L730-K732 PolarHBondContact O-N 3.23Å; L730-N734 VanDerWaalsContact O-CB 3.25Å; L730-N734 WeakPolarHBondContact O-CB 3.49Å; L730-N734 PolarHBondContact O-N 3.19Å
731	K	82.1	Confident	81.1	Confident	125 Å²	125	110.8 Å²	110.8	54%	0.543	53%	0.525	S	S	.	.	H	α-helix	trans	-68.2	-26.9	176.3	-168.7	172.9	-170.6	171.1	0	113.1	V727 H728 E729 K735	V727-K731 VanDerWaalsContact O-CB 3.23Å; V727-K731 WeakPolarHBondContact O-CB 3.23Å; V727-K731 PolarHBondContact O-N 2.8Å; V727-K731 VanDerWaalsContact O-N 3.09Å; H728-K731 PolarHBondContact O-N 2.8Å; E729-K731 PolarHBondContact O-N 3.28Å; K731-K735 PolarHBondContact O-N 2.85Å
732	K	85.6	Confident	82.4	Confident	115 Å²	115	110.2 Å²	110.2	50%	0.5	53%	0.526	S	S	.	.	H	α-helix	trans	-81.7	-42.2	176.5	167	-173.8	164.5	-148.6	0	111.2	H728 E729 L730 K735 W736	H728-K732 PolarHBondContact O-N 2.93Å; E729-K732 CarbonylContact O-C 3.52Å; E729-K732 WeakPolarHBondContact O-CA 3.34Å; E729-K732 WeakPolarHBondContact O-CB 3.25Å; E729-K732 PolarHBondContact O-N 3.39Å; E729-K732 WeakPolarHBondContact OE1-CD 3.33Å; E729-K732 IonicContact OE1-NZ 2.73Å; E729-K732 PolarHBondContact OE1-NZ 2.86Å; E729-K732 WeakPolarHBondContact OE2-CD 3.47Å; E729-K732 WeakPolarHBondContact OE2-CE 3.44Å; E729-K732 IonicContact OE2-NZ 2.7Å; E729-K732 PolarHBondContact OE2-NZ 3.07Å; L730-K732 VanDerWaalsContact C-N 3.29Å; L730-K732 PolarHBondContact O-N 3.23Å; K732-K735 PolarHBondContact O-N 3.16Å; K732-W736 PolarHBondContact O-N 3.39Å
733	E	85.5	Confident	83.1	Confident	106 Å²	106	113.2 Å²	113.2	50%	0.495	53%	0.53	S	S	.	.	H	α-helix	trans	-60.4	-48.6	170.6	-69	-168.9	146.6	0	0	111.7	E729 K735 W736 M737	E729-E733 PolarHBondContact O-N 2.87Å; E733-K735 VanDerWaalsContact C-N 3.28Å; E733-K735 PolarHBondContact O-N 3.47Å; E733-W736 WeakPolarHBondContact O-CB 3.39Å; E733-W736 PolarHBondContact O-N 2.74Å; E733-M737 WeakPolarHBondContact O-CB 3.38Å; E733-M737 PolarHBondContact O-N 3.31Å
734	N	75.9	Confident	84.3	Confident	109 Å²	109	112.2 Å²	112.2	58%	0.583	52%	0.523	S	S	*	.	H	α-helix	trans	-59.5	-39.1	179.3	-164.4	-66.8	0	0	0	111.8	L730 M737 K738	L730-N734 VanDerWaalsContact O-CB 3.25Å; L730-N734 WeakPolarHBondContact O-CB 3.49Å; L730-N734 PolarHBondContact O-N 3.19Å; N734-M737 PolarHBondContact O-N 3.4Å; N734-K738 WeakPolarHBondContact O-CB 3.22Å; N734-K738 PolarHBondContact O-N 3.1Å
735	K	87.6	Confident	84.7	Confident	139 Å²	139	110.5 Å²	110.5	60%	0.604	52%	0.517	S	S	*	.	H	α-helix	trans	-61.6	-45.4	172	-177.8	-174.2	173.6	-171.2	0	112.1	K731 K732 E733 K738 Q739	K731-K735 PolarHBondContact O-N 2.85Å; K732-K735 PolarHBondContact O-N 3.16Å; E733-K735 VanDerWaalsContact C-N 3.28Å; E733-K735 PolarHBondContact O-N 3.47Å; K735-K738 PolarHBondContact O-N 3.28Å; K735-Q739 WeakPolarHBondContact O-CG 3.36Å; K735-Q739 PolarHBondContact O-N 3.24Å; K735-Q739 VanDerWaalsContact O-N 3.09Å
736	W	84.6	Confident	85.3	Confident	174 Å²	174	111.3 Å²	111.3	66%	0.659	52%	0.516	S	S	*	.	H	α-helix	trans	-64.4	-45.2	178.3	-178	76.4	0	0	0	111.8	K732 E733 K738 Q739 F740	K732-W736 PolarHBondContact O-N 3.39Å; E733-W736 WeakPolarHBondContact O-CB 3.39Å; E733-W736 PolarHBondContact O-N 2.74Å; W736-K738 VanDerWaalsContact C-N 3.29Å; W736-K738 PolarHBondContact O-N 3.41Å; W736-Q739 PolarHBondContact O-N 2.72Å; W736-Q739 VanDerWaalsContact O-N 3.14Å; W736-F740 PolarHBondContact O-N 2.88Å
737	M	80.4	Confident	85.8	Confident	115 Å²	115	108.6 Å²	108.6	57%	0.567	51%	0.51	S	S	*	.	H	α-helix	trans	-57.2	-41.3	175.3	-133.6	-177.6	-61.5	0	0	111.8	E733 N734 F740 L741	E733-M737 WeakPolarHBondContact O-CB 3.38Å; E733-M737 PolarHBondContact O-N 3.31Å; N734-M737 PolarHBondContact O-N 3.4Å; M737-F740 PolarHBondContact O-N 2.95Å; M737-L741 WeakPolarHBondContact O-CB 3.35Å; M737-L741 PolarHBondContact O-N 3.12Å
738	K	87.8	Confident	86.4	Confident	126 Å²	126	113.1 Å²	113.1	55%	0.548	52%	0.52	S	S	.	.	H	α-helix	trans	-66.1	-41.4	176.2	-173.4	173.3	179.2	177.4	0	112.6	N734 K735 W736 L741 E742	N734-K738 WeakPolarHBondContact O-CB 3.22Å; N734-K738 PolarHBondContact O-N 3.1Å; K735-K738 PolarHBondContact O-N 3.28Å; W736-K738 VanDerWaalsContact C-N 3.29Å; W736-K738 PolarHBondContact O-N 3.41Å; K738-L741 PolarHBondContact O-N 3.28Å; K738-E742 WeakPolarHBondContact CE-OE1 3.47Å; K738-E742 WeakPolarHBondContact O-CG 3.36Å; K738-E742 PolarHBondContact O-N 3Å
739	Q	87.4	Confident	86.7	Confident	111 Å²	111	112.6 Å²	112.6	52%	0.519	52%	0.516	S	S	.	.	H	α-helix	trans	-63.5	-43.1	175.2	-69.2	-176.2	-77.2	0	0	111.5	K735 W736 L741 E742 E743	K735-Q739 WeakPolarHBondContact O-CG 3.36Å; K735-Q739 PolarHBondContact O-N 3.24Å; K735-Q739 VanDerWaalsContact O-N 3.09Å; W736-Q739 PolarHBondContact O-N 2.72Å; W736-Q739 VanDerWaalsContact O-N 3.14Å; Q739-L741 VanDerWaalsContact C-N 3.34Å; Q739-L741 PolarHBondContact O-N 3.4Å; Q739-E742 PolarHBondContact O-N 3.29Å; Q739-E743 PolarHBondContact O-N 2.85Å
740	F	90.4	Very high	87	Confident	128 Å²	128	112.2 Å²	112.2	56%	0.561	51%	0.514	S	S	*	.	H	α-helix	trans	-61.5	-40.7	175.5	-171.7	-95.3	0	0	0	112.2	W736 M737 E743 E744	W736-F740 PolarHBondContact O-N 2.88Å; M737-F740 PolarHBondContact O-N 2.95Å; F740-E743 PolarHBondContact O-N 2.85Å; F740-E744 WeakPolarHBondContact O-CB 3.5Å; F740-E744 PolarHBondContact O-N 3.41Å
741	L	86.5	Confident	87.4	Confident	92 Å²	92	112.9 Å²	112.9	48%	0.482	52%	0.518	S	S	.	.	H	α-helix	trans	-66.5	-39.8	176	-178.5	62.5	0	0	0	112.8	M737 K738 Q739 E743 Q745	M737-L741 WeakPolarHBondContact O-CB 3.35Å; M737-L741 PolarHBondContact O-N 3.12Å; K738-L741 PolarHBondContact O-N 3.28Å; Q739-L741 VanDerWaalsContact C-N 3.34Å; Q739-L741 PolarHBondContact O-N 3.4Å; L741-E743 VanDerWaalsContact C-N 3.32Å; L741-Q745 HydrophobicContact CD1-CG 4.49Å; L741-Q745 WeakPolarHBondContact O-CB 3.4Å; L741-Q745 VanDerWaalsContact O-CG 3.28Å; L741-Q745 WeakPolarHBondContact O-CG 3.48Å; L741-Q745 PolarHBondContact O-N 2.84Å
742	E	88.6	Confident	87.7	Confident	110 Å²	110	111.4 Å²	111.4	51%	0.514	51%	0.513	S	S	.	.	H	α-helix	trans	-65.2	-36.6	175.1	-75	175.4	-165.6	0	0	111.7	K738 Q739 K746	K738-E742 WeakPolarHBondContact CE-OE1 3.47Å; K738-E742 WeakPolarHBondContact O-CG 3.36Å; K738-E742 PolarHBondContact O-N 3Å; Q739-E742 PolarHBondContact O-N 3.29Å; E742-K746 WeakPolarHBondContact O-CB 3.25Å; E742-K746 PolarHBondContact O-N 3.48Å; E742-K746 VanDerWaalsContact O-N 3.07Å
743	E	90.2	Very high	88	Confident	124 Å²	124	113 Å²	113	58%	0.579	52%	0.516	S	S	*	.	H	α-helix	trans	-71	-43.7	175.3	-169.3	152.3	-124.2	0	0	112.3	Q739 F740 L741 Q745 K746 S747	Q739-E743 PolarHBondContact O-N 2.85Å; F740-E743 PolarHBondContact O-N 2.85Å; L741-E743 VanDerWaalsContact C-N 3.32Å; E743-Q745 PolarHBondContact O-N 3.38Å; E743-K746 WeakPolarHBondContact O-CB 3.33Å; E743-K746 PolarHBondContact O-N 3.38Å; E743-K746 VanDerWaalsContact O-N 3.1Å; E743-S747 PolarHBondContact O-N 2.79Å; E743-S747 PolarHBondContact O-OG 3.45Å
744	E	93	Very high	88.2	Confident	65 Å²	65	112.8 Å²	112.8	30%	0.304	52%	0.517	S	S	.	.	H	α-helix	trans	-59.7	-44.9	174.9	-160.3	-83.3	172.5	0	0	111.5	F740 K746 S747 R748	F740-E744 WeakPolarHBondContact O-CB 3.5Å; F740-E744 PolarHBondContact O-N 3.41Å; E744-K746 VanDerWaalsContact C-N 3.31Å; E744-K746 PolarHBondContact O-N 3.39Å; E744-S747 PolarHBondContact O-N 2.86Å; E744-R748 WeakPolarHBondContact O-CG 3.35Å; E744-R748 PolarHBondContact O-N 3.07Å; E744-R748 IonicContact OE1-CZ 2.65Å; E744-R748 IonicContact OE1-NE 2.8Å; E744-R748 PolarHBondContact OE1-NE 3.23Å; E744-R748 IonicContact OE1-NH2 3.04Å; E744-R748 PolarHBondContact OE1-NH2 2.84Å; E744-R748 IonicContact OE2-CZ 3.23Å; E744-R748 IonicContact OE2-NE 2.65Å; E744-R748 PolarHBondContact OE2-NE 3.48Å; E744-R748 IonicContact OE2-NH2 2.72Å
745	Q	86.6	Confident	88.7	Confident	86 Å²	86	111.6 Å²	111.6	40%	0.402	51%	0.514	S	S	.	.	H	α-helix	trans	-63.9	-33.7	174.6	-74.2	-176.6	29.4	0	0	113.1	L741 E743 K749	L741-Q745 HydrophobicContact CD1-CG 4.49Å; L741-Q745 WeakPolarHBondContact O-CB 3.4Å; L741-Q745 VanDerWaalsContact O-CG 3.28Å; L741-Q745 WeakPolarHBondContact O-CG 3.48Å; L741-Q745 PolarHBondContact O-N 2.84Å; E743-Q745 PolarHBondContact O-N 3.38Å; Q745-K749 WeakPolarHBondContact O-CD 3.45Å; Q745-K749 VanDerWaalsContact O-CG 3.31Å; Q745-K749 WeakPolarHBondContact O-CG 3.3Å; Q745-K749 PolarHBondContact O-N 3.49Å; Q745-K749 VanDerWaalsContact O-N 3.15Å
746	K	91	Very high	88.5	Confident	112 Å²	112	112.7 Å²	112.7	49%	0.487	51%	0.514	S	S	.	.	H	α-helix	trans	-67.8	-48.1	174.3	-179.9	-170.6	168.1	-161.7	0	110.2	E742 E743 E744 R748 K749 E750	E742-K746 WeakPolarHBondContact O-CB 3.25Å; E742-K746 PolarHBondContact O-N 3.48Å; E742-K746 VanDerWaalsContact O-N 3.07Å; E743-K746 WeakPolarHBondContact O-CB 3.33Å; E743-K746 PolarHBondContact O-N 3.38Å; E743-K746 VanDerWaalsContact O-N 3.1Å; E744-K746 VanDerWaalsContact C-N 3.31Å; E744-K746 PolarHBondContact O-N 3.39Å; K746-R748 VanDerWaalsContact C-N 3.33Å; K746-R748 PolarHBondContact O-N 3.17Å; K746-K749 PolarHBondContact O-N 2.88Å; K746-K749 VanDerWaalsContact O-N 3.12Å; K746-E750 WeakPolarHBondContact CE-OE1 3.3Å; K746-E750 WeakPolarHBondContact CG-OE1 3.28Å; K746-E750 PolarHBondContact O-N 2.78Å
747	S	92	Very high	88.5	Confident	66 Å²	66	111.5 Å²	111.5	46%	0.462	51%	0.514	S	S	.	.	H	α-helix	trans	-59.3	-40.2	175.4	-62.7	0	0	0	0	112.3	E743 E744 E750 L751	E743-S747 PolarHBondContact O-N 2.79Å; E743-S747 PolarHBondContact O-OG 3.45Å; E744-S747 PolarHBondContact O-N 2.86Å; S747-E750 PolarHBondContact O-N 3.21Å; S747-L751 WeakPolarHBondContact O-CB 3.37Å; S747-L751 PolarHBondContact O-N 2.76Å
748	R	91.1	Very high	88.4	Confident	162 Å²	162	111 Å²	111	61%	0.611	51%	0.513	S	S	*	.	H	α-helix	trans	-59.5	-46	172	-74.2	-168	-168.9	-159.8	4.8	112.5	E744 K746 E750 L751 E752	E744-R748 WeakPolarHBondContact O-CG 3.35Å; E744-R748 PolarHBondContact O-N 3.07Å; E744-R748 IonicContact OE1-CZ 2.65Å; E744-R748 IonicContact OE1-NE 2.8Å; E744-R748 PolarHBondContact OE1-NE 3.23Å; E744-R748 IonicContact OE1-NH2 3.04Å; E744-R748 PolarHBondContact OE1-NH2 2.84Å; E744-R748 IonicContact OE2-CZ 3.23Å; E744-R748 IonicContact OE2-NE 2.65Å; E744-R748 PolarHBondContact OE2-NE 3.48Å; E744-R748 IonicContact OE2-NH2 2.72Å; K746-R748 VanDerWaalsContact C-N 3.33Å; K746-R748 PolarHBondContact O-N 3.17Å; R748-E750 VanDerWaalsContact C-N 3.29Å; R748-E750 PolarHBondContact O-N 2.88Å; R748-L751 PolarHBondContact O-N 2.87Å; R748-E752 WeakPolarHBondContact O-CB 3.48Å; R748-E752 PolarHBondContact O-N 2.97Å
749	K	90.2	Very high	87.8	Confident	108 Å²	108	108.1 Å²	108.1	47%	0.47	51%	0.508	S	S	.	.	H	α-helix	trans	-65.9	-30.5	178.4	-71.9	164.3	-174.4	163.5	0	112.3	Q745 K746 R753	Q745-K749 WeakPolarHBondContact O-CD 3.45Å; Q745-K749 VanDerWaalsContact O-CG 3.31Å; Q745-K749 WeakPolarHBondContact O-CG 3.3Å; Q745-K749 PolarHBondContact O-N 3.49Å; Q745-K749 VanDerWaalsContact O-N 3.15Å; K746-K749 PolarHBondContact O-N 2.88Å; K746-K749 VanDerWaalsContact O-N 3.12Å; K749-R753 WeakPolarHBondContact O-CD 3.07Å; K749-R753 VanDerWaalsContact O-CG 3.22Å; K749-R753 WeakPolarHBondContact O-CG 3.28Å; K749-R753 PolarHBondContact O-N 3.21Å
750	E	90.3	Very high	87.2	Confident	86 Å²	86	109.6 Å²	109.6	40%	0.402	51%	0.513	S	S	.	.	H	α-helix	trans	-76.5	-42.8	175.1	-73	171.5	-169.6	0	0	112.1	K746 S747 R748 E752 R753 L754	K746-E750 WeakPolarHBondContact CE-OE1 3.3Å; K746-E750 WeakPolarHBondContact CG-OE1 3.28Å; K746-E750 PolarHBondContact O-N 2.78Å; S747-E750 PolarHBondContact O-N 3.21Å; R748-E750 VanDerWaalsContact C-N 3.29Å; R748-E750 PolarHBondContact O-N 2.88Å; E750-E752 PolarHBondContact O-N 3.41Å; E750-R753 WeakPolarHBondContact O-CB 3.5Å; E750-R753 PolarHBondContact O-N 3.46Å; E750-L754 PolarHBondContact O-N 3.07Å
751	L	88.5	Confident	86.2	Confident	111 Å²	111	109.4 Å²	109.4	58%	0.581	51%	0.514	S	S	*	.	H	α-helix	trans	-60.6	-42.9	171.8	-178.4	61.9	0	0	0	111.6	S747 R748 R753 L754 V755	S747-L751 WeakPolarHBondContact O-CB 3.37Å; S747-L751 PolarHBondContact O-N 2.76Å; R748-L751 PolarHBondContact O-N 2.87Å; L751-R753 PolarHBondContact O-N 2.9Å; L751-L754 WeakPolarHBondContact O-CA 3.45Å; L751-L754 WeakPolarHBondContact O-CB 3.37Å; L751-L754 PolarHBondContact O-N 2.84Å; L751-L754 VanDerWaalsContact O-N 3.07Å; L751-V755 HydrophobicContact CD1-CG2 4.38Å; L751-V755 HydrophobicContact CG-CG2 4.48Å; L751-V755 WeakPolarHBondContact O-CG2 3.44Å; L751-V755 PolarHBondContact O-N 3.22Å
752	E	89.4	Confident	85.2	Confident	95 Å²	95	112.9 Å²	112.9	44%	0.444	53%	0.525	S	S	.	.	H	α-helix	trans	-61.7	-42.4	176.8	-165.3	-164.5	-179.2	0	0	111.7	R748 E750 L754 V755 R756	R748-E752 WeakPolarHBondContact O-CB 3.48Å; R748-E752 PolarHBondContact O-N 2.97Å; E750-E752 PolarHBondContact O-N 3.41Å; E752-L754 VanDerWaalsContact C-N 3.28Å; E752-L754 PolarHBondContact O-N 3.43Å; E752-V755 PolarHBondContact O-N 3.04Å; E752-R756 WeakPolarHBondContact O-CB 3.09Å; E752-R756 VanDerWaalsContact O-CG 3.25Å; E752-R756 WeakPolarHBondContact O-CG 3.39Å; E752-R756 PolarHBondContact O-N 3.45Å; E752-R756 IonicContact OE1-CZ 3.79Å; E752-R756 VanDerWaalsContact OE1-CZ 3.23Å; E752-R756 IonicContact OE1-NE 3.04Å; E752-R756 PolarHBondContact OE1-NE 3.17Å; E752-R756 IonicContact OE1-NH2 3.23Å; E752-R756 PolarHBondContact OE1-NH2 3.2Å; E752-R756 IonicContact OE2-NH2 2.66Å
753	R	90	Very high	83.7	Confident	148 Å²	148	112.5 Å²	112.5	56%	0.558	53%	0.527	S	S	*	.	H	α-helix	trans	-61	-37.7	172.5	-70.9	164.2	-173.6	145.5	-3.4	111.7	K749 E750 L751 K757	K749-R753 WeakPolarHBondContact O-CD 3.07Å; K749-R753 VanDerWaalsContact O-CG 3.22Å; K749-R753 WeakPolarHBondContact O-CG 3.28Å; K749-R753 PolarHBondContact O-N 3.21Å; E750-R753 WeakPolarHBondContact O-CB 3.5Å; E750-R753 PolarHBondContact O-N 3.46Å; L751-R753 PolarHBondContact O-N 2.9Å; R753-K757 WeakPolarHBondContact O-CG 3.47Å; R753-K757 PolarHBondContact O-N 3.42Å
754	L	90.4	Very high	82	Confident	101 Å²	101	112 Å²	112	53%	0.529	53%	0.528	S	S	.	.	H	α-helix	trans	-66.8	-47.6	177.1	-137.4	80	0	0	0	111.5	E750 L751 E752 R756 K757 L758	E750-L754 PolarHBondContact O-N 3.07Å; L751-L754 WeakPolarHBondContact O-CA 3.45Å; L751-L754 WeakPolarHBondContact O-CB 3.37Å; L751-L754 PolarHBondContact O-N 2.84Å; L751-L754 VanDerWaalsContact O-N 3.07Å; E752-L754 VanDerWaalsContact C-N 3.28Å; E752-L754 PolarHBondContact O-N 3.43Å; L754-R756 PolarHBondContact O-N 2.96Å; L754-K757 WeakPolarHBondContact O-CB 3.45Å; L754-K757 PolarHBondContact O-N 2.93Å; L754-K757 VanDerWaalsContact O-N 3.17Å; L754-L758 WeakPolarHBondContact O-CG 3.32Å; L754-L758 PolarHBondContact O-N 2.9Å
755	V	87.1	Confident	80.2	Confident	84 Å²	84	114.3 Å²	114.3	51%	0.509	55%	0.55	S	S	.	*	H	α-helix	trans	-61.7	-42.9	176.6	171.8	0	0	0	0	111.1	L751 E752 K757 L758 S759	L751-V755 HydrophobicContact CD1-CG2 4.38Å; L751-V755 HydrophobicContact CG-CG2 4.48Å; L751-V755 WeakPolarHBondContact O-CG2 3.44Å; L751-V755 PolarHBondContact O-N 3.22Å; E752-V755 PolarHBondContact O-N 3.04Å; V755-K757 VanDerWaalsContact C-N 3.34Å; V755-K757 PolarHBondContact O-N 3.48Å; V755-L758 PolarHBondContact O-N 3.47Å; V755-S759 VanDerWaalsContact O-CB 3.3Å; V755-S759 WeakPolarHBondContact O-CB 3.44Å; V755-S759 PolarHBondContact O-N 3.41Å
756	R	83.6	Confident	78.4	Confident	163 Å²	163	113 Å²	113	62%	0.615	56%	0.559	S	S	*	*	H	α-helix	trans	-61.6	-38.4	174.1	-72.2	174.2	-177.4	-150	8.2	112.2	E752 L754 K760	E752-R756 WeakPolarHBondContact O-CB 3.09Å; E752-R756 VanDerWaalsContact O-CG 3.25Å; E752-R756 WeakPolarHBondContact O-CG 3.39Å; E752-R756 PolarHBondContact O-N 3.45Å; E752-R756 IonicContact OE1-CZ 3.79Å; E752-R756 VanDerWaalsContact OE1-CZ 3.23Å; E752-R756 IonicContact OE1-NE 3.04Å; E752-R756 PolarHBondContact OE1-NE 3.17Å; E752-R756 IonicContact OE1-NH2 3.23Å; E752-R756 PolarHBondContact OE1-NH2 3.2Å; E752-R756 IonicContact OE2-NH2 2.66Å; L754-R756 PolarHBondContact O-N 2.96Å; R756-K760 PolarHBondContact O-N 3.07Å
757	K	83.5	Confident	76.6	Confident	149 Å²	149	118.6 Å²	118.6	65%	0.648	58%	0.577	S	S	*	*	H	α-helix	trans	-65.3	-51.2	173.5	-78.2	179.4	177.1	-174.3	0	111.8	R753 L754 V755 S759 K760 Q761	R753-K757 WeakPolarHBondContact O-CG 3.47Å; R753-K757 PolarHBondContact O-N 3.42Å; L754-K757 WeakPolarHBondContact O-CB 3.45Å; L754-K757 PolarHBondContact O-N 2.93Å; L754-K757 VanDerWaalsContact O-N 3.17Å; V755-K757 VanDerWaalsContact C-N 3.34Å; V755-K757 PolarHBondContact O-N 3.48Å; K757-S759 VanDerWaalsContact C-N 3.33Å; K757-S759 PolarHBondContact O-N 3.27Å; K757-K760 WeakPolarHBondContact O-CB 3.46Å; K757-K760 PolarHBondContact O-N 2.91Å; K757-K760 VanDerWaalsContact O-N 3.07Å; K757-Q761 PolarHBondContact O-N 3.37Å
758	L	79.7	Confident	74.6	Confident	103 Å²	103	124.6 Å²	124.6	54%	0.539	60%	0.598	S	S	.	*	H	α-helix	trans	-61.8	-39.6	-180	-70.3	169.1	0	0	0	112.1	L754 V755 K760 Q761 K762	L754-L758 WeakPolarHBondContact O-CG 3.32Å; L754-L758 PolarHBondContact O-N 2.9Å; V755-L758 PolarHBondContact O-N 3.47Å; L758-K760 VanDerWaalsContact C-N 3.28Å; L758-K760 PolarHBondContact O-N 3.22Å; L758-Q761 PolarHBondContact O-N 3.02Å; L758-K762 WeakPolarHBondContact O-CB 3.41Å; L758-K762 PolarHBondContact O-N 3.46Å
759	S	74.4	Confident	72.6	Confident	66 Å²	66	124.3 Å²	124.3	46%	0.462	61%	0.609	S	S	.	*	H	α-helix	trans	-66.2	-29.2	174.9	-172.1	0	0	0	0	112.9	V755 K757 N763	V755-S759 VanDerWaalsContact O-CB 3.3Å; V755-S759 WeakPolarHBondContact O-CB 3.44Å; V755-S759 PolarHBondContact O-N 3.41Å; K757-S759 VanDerWaalsContact C-N 3.33Å; K757-S759 PolarHBondContact O-N 3.27Å; S759-N763 PolarHBondContact O-N 3.07Å; S759-N763 PolarHBondContact O-OD1 3.2Å
760	K	74.4	Confident	70.5	Confident	143 Å²	143	125 Å²	125	62%	0.622	63%	0.628	S	S	*	*	H	α-helix	trans	-74.5	-50.5	175.1	-155	178.8	-174.5	-170.5	0	110.4	R756 K757 L758 K762 N763 D764	R756-K760 PolarHBondContact O-N 3.07Å; K757-K760 WeakPolarHBondContact O-CB 3.46Å; K757-K760 PolarHBondContact O-N 2.91Å; K757-K760 VanDerWaalsContact O-N 3.07Å; L758-K760 VanDerWaalsContact C-N 3.28Å; L758-K760 PolarHBondContact O-N 3.22Å; K760-K762 PolarHBondContact O-N 3.31Å; K760-N763 WeakPolarHBondContact O-CA 3.46Å; K760-N763 WeakPolarHBondContact O-CB 3.34Å; K760-N763 PolarHBondContact O-N 2.59Å; K760-D764 VanDerWaalsContact O-CG 3.25Å; K760-D764 PolarHBondContact O-N 3.19Å
761	Q	69.6	Low	68.3	Low	124 Å²	124	126.3 Å²	126.3	58%	0.579	65%	0.646	S	S	*	*	H	α-helix	trans	-57.3	-35.5	176.4	-165.6	172.4	10.1	0	0	112.8	K757 L758 D764 C765	K757-Q761 PolarHBondContact O-N 3.37Å; L758-Q761 PolarHBondContact O-N 3.02Å; Q761-D764 PolarHBondContact O-N 2.96Å; Q761-C765 PolarHBondContact O-N 3.04Å
762	K	65.1	Low	65.9	Low	165 Å²	165	133.5 Å²	133.5	72%	0.717	68%	0.676	S	S	*	*	H	α-helix	trans	-67.1	-35.5	172.6	-178.5	175.4	177.3	179.4	0	113.4	L758 K760	L758-K762 WeakPolarHBondContact O-CB 3.41Å; L758-K762 PolarHBondContact O-N 3.46Å; K760-K762 PolarHBondContact O-N 3.31Å
763	N	57	Low	64.7	Low	102 Å²	102	135.5 Å²	135.5	55%	0.545	69%	0.688	S	S	.	*	H	α-helix	trans	-73.8	-36.5	175.6	-73.9	0.1	0	0	0	111.4	S759 K760 C765 G766	S759-N763 PolarHBondContact O-N 3.07Å; S759-N763 PolarHBondContact O-OD1 3.2Å; K760-N763 WeakPolarHBondContact O-CA 3.46Å; K760-N763 WeakPolarHBondContact O-CB 3.34Å; K760-N763 PolarHBondContact O-N 2.59Å; N763-C765 VanDerWaalsContact C-N 3.31Å; N763-C765 PolarHBondContact O-N 3.17Å; N763-G766 PolarHBondContact O-N 3.07Å
764	D	55.6	Low	63.4	Low	114 Å²	114	134.8 Å²	134.8	61%	0.61	70%	0.695	S	S	*	*	H	α-helix	trans	-66.1	-33	178.8	-59	-33.8	0	0	0	111.5	K760 Q761 G766	K760-D764 VanDerWaalsContact O-CG 3.25Å; K760-D764 PolarHBondContact O-N 3.19Å; Q761-D764 PolarHBondContact O-N 2.96Å; D764-G766 PolarHBondContact O-N 2.66Å
765	C	53.9	Low	61.9	Low	113 Å²	113	136.7 Å²	136.7	76%	0.764	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	4.1	169.8	-71.9	0	0	0	0	115.1	Q761 N763	Q761-C765 PolarHBondContact O-N 3.04Å; N763-C765 VanDerWaalsContact C-N 3.31Å; N763-C765 PolarHBondContact O-N 3.17Å
766	G	50.4	Low	60.4	Low	57 Å²	57	139.8 Å²	139.8	59%	0.588	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	3.2	-172.8	0	0	0	0	0	116.5	N763 D764	N763-G766 PolarHBondContact O-N 3.07Å; D764-G766 PolarHBondContact O-N 2.66Å
767	W	51.8	Low	59	Low	230 Å²	230	138.3 Å²	138.3	87%	0.871	72%	0.722	S	S	*	*	S	Bend	trans	-127.9	8.5	-162.7	-73.6	81.2	0	0	0	116.1
768	E	50	Low	57.3	Low	192 Å²	192	137.6 Å²	137.6	90%	0.897	73%	0.726	S	S	*	*	S	Bend	trans	-126.3	62.5	172.9	-70.3	-165.8	138.9	0	0	112.2
769	D	49.3	Very low	55.7	Low	157 Å²	157	140.1 Å²	140.1	84%	0.84	74%	0.74	S	S	*	*	S	Bend	trans	-163.6	82.6	150.1	-127.5	-16.1	0	0	0	112.8
770	S	46.3	Very low	54.3	Low	123 Å²	123	145.8 Å²	145.8	86%	0.86	76%	0.761	S	S	*	*	S	Bend	trans	-168.1	41.6	166.7	-81.3	0	0	0	0	112
771	S	43.7	Very low	52.6	Low	113 Å²	113	146 Å²	146	79%	0.79	77%	0.773	S	S	*	*			trans	-158.9	55.2	172.6	-77.3	0	0	0	0	112.8
772	H	39	Very low	51.1	Low	262 Å²	262	148 Å²	148	100%	1.213	79%	0.79	S	S	*	*			trans	-160	0	136.7	-112.8	-58.1	0	0	0	113.4

Retrieved 772 of 772 residues in 145.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).