A0A5K4FCS0_SCHMA Loading...

Saposin B-type domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4FCS0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 142 aa.

						>A0A5K4FCS0_SCHMA|A0A5K4FCS0
MNIFFTFMNMIPYLHSNNNYSNNNNIIIITILLQCIGLIFVKTESIHGSYELIGLTKDPKTFNGKLCGTCLKFYNSIMSLFLDYGKLESFQEKLIDICEYIGPFRDQCVALVTFTMFKAINKSISKIDPSISCEGWYLCYRK
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	33.2	Very low	39.2	Very low	187 Å²	187	84.5 Å²	84.5	92%	0.921	42%	0.416	S	S	*	.				0	117.7	0	-153.9	144.5	81.1	0	0	106.8	I3 F104	M1-I3 PolarHBondContact O-N 2.74Å; M1-F104 HydrophobicContact CE-CD1 4.38Å; M1-F104 HydrophobicContact CE-CE1 3.3Å; M1-F104 HydrophobicContact CE-CZ 3.62Å; M1-F104 HydrophobicContact CG-CE1 4.22Å; M1-F104 HydrophobicContact CG-CZ 4.48Å; M1-F104 HydrophobicContact SD-CE1 4.45Å
2	N	32.1	Very low	39.1	Very low	113 Å²	113	83.9 Å²	83.9	60%	0.604	42%	0.423	S	S	*	.			trans	-72.9	109.3	-157.3	-112.1	-28	0	0	0	110.8	F4 F5	N2-F4 HydrophobicContact CB-CB 3.98Å; N2-F4 PolarHBondContact O-N 3.29Å; N2-F5 PolarHBondContact O-N 2.76Å
3	I	42.6	Very low	39.2	Very low	86 Å²	86	91.6 Å²	91.6	44%	0.441	45%	0.446	S	S	.	.	H	α-helix	trans	-45	-32.7	166.7	-71.6	163.9	0	0	0	110.4	M1 F5 T6 F7 L111	M1-I3 PolarHBondContact O-N 2.74Å; I3-F5 PolarHBondContact O-N 3.07Å; I3-T6 PolarHBondContact O-N 3.27Å; I3-F7 HydrophobicContact CG2-CD2 3.76Å; I3-F7 HydrophobicContact CG2-CE2 3.78Å; I3-F7 WeakPolarHBondContact O-CD2 3.39Å; I3-F7 PolarHBondContact O-N 3.4Å; I3-L111 HydrophobicContact CD1-CD1 4.49Å; I3-L111 HydrophobicContact CG2-CD2 3.98Å
4	F	36.6	Very low	39.1	Very low	89 Å²	89	90.3 Å²	90.3	39%	0.39	44%	0.442	S	S	.	.	H	α-helix	trans	-47.7	-44.5	169.7	-174.6	-94.7	0	0	0	115.3	N2 M8 L38	N2-F4 HydrophobicContact CB-CB 3.98Å; N2-F4 PolarHBondContact O-N 3.29Å; F4-M8 HydrophobicContact CD1-CG 4.41Å; F4-M8 HydrophobicContact CE1-CG 4.17Å; F4-M8 HydrophobicContact CE2-CE 4.43Å; F4-M8 HydrophobicContact CZ-CE 4.44Å; F4-M8 HydrophobicContact CZ-CG 4.36Å; F4-M8 WeakPolarHBondContact O-CB 3.43Å; F4-M8 WeakPolarHBondContact O-CG 3.49Å; F4-M8 PolarHBondContact O-N 3.18Å; F4-M8 VanDerWaalsContact O-N 3.14Å; F4-L38 HydrophobicContact CD2-CD1 3.89Å; F4-L38 HydrophobicContact CD2-CD2 3.81Å; F4-L38 HydrophobicContact CD2-CG 4.41Å; F4-L38 HydrophobicContact CE2-CD1 3.76Å; F4-L38 HydrophobicContact CE2-CD2 3.47Å; F4-L38 VanDerWaalsContact CE2-CD2 3.47Å; F4-L38 HydrophobicContact CE2-CG 4.26Å
5	F	33.1	Very low	39.1	Very low	136 Å²	136	90.6 Å²	90.6	60%	0.596	44%	0.442	S	S	*	.	H	α-helix	trans	-72.1	-35.3	-177.9	-116.9	-89.3	0	0	0	112.2	N2 I3 N9	N2-F5 PolarHBondContact O-N 2.76Å; I3-F5 PolarHBondContact O-N 3.07Å; F5-N9 PolarHBondContact O-N 3.08Å; F5-N9 PolarHBondContact O-ND2 3.16Å
6	T	41.9	Very low	39	Very low	20 Å²	20	91.5 Å²	91.5	12%	0.123	46%	0.46	C	S	.	.	H	α-helix	trans	-69.5	-39.9	-178.9	-44.7	0	0	0	0	111.5	I3 M10 I101 F104	I3-T6 PolarHBondContact O-N 3.27Å; T6-M10 PolarHBondContact O-N 3.09Å; T6-I101 HydrophobicContact CG2-CD1 4.49Å; T6-I101 HydrophobicContact CG2-CG2 3.05Å; T6-F104 HydrophobicContact CG2-CB 4.03Å; T6-F104 HydrophobicContact CG2-CD2 4.37Å; T6-F104 HydrophobicContact CG2-CG 4.2Å
7	F	46.9	Very low	39.2	Very low	46 Å²	46	94.4 Å²	94.4	20%	0.202	48%	0.477	C	S	.	.	H	α-helix	trans	-71.9	-39.4	174.3	-84	-86.1	0	0	0	112.9	I3 N9 M10 I11 I36 L111	I3-F7 HydrophobicContact CG2-CD2 3.76Å; I3-F7 HydrophobicContact CG2-CE2 3.78Å; I3-F7 WeakPolarHBondContact O-CD2 3.39Å; I3-F7 PolarHBondContact O-N 3.4Å; F7-N9 PolarHBondContact O-N 3.34Å; F7-M10 HydrophobicContact CD1-CE 3.91Å; F7-M10 HydrophobicContact CD2-CE 4.48Å; F7-M10 HydrophobicContact CE1-CE 4.01Å; F7-M10 HydrophobicContact CG-CE 4.16Å; F7-M10 HydrophobicContact CZ-CE 4.34Å; F7-M10 PolarHBondContact O-N 3.44Å; F7-I11 WeakPolarHBondContact O-CG1 3.37Å; F7-I11 PolarHBondContact O-N 3.29Å; F7-I36 HydrophobicContact CD1-CD1 3.75Å; F7-I36 HydrophobicContact CE1-CD1 4.06Å; F7-I36 HydrophobicContact CG-CD1 4.05Å; F7-L111 HydrophobicContact CE2-CD2 3.39Å; F7-L111 HydrophobicContact CZ-CD2 3.68Å
8	M	36.2	Very low	39.1	Very low	71 Å²	71	94.7 Å²	94.7	35%	0.35	48%	0.48	S	S	.	.	H	α-helix	trans	-58.1	-35.7	175.5	-76.5	-76.1	134.5	0	0	112.2	F4 M10 I11 L33 L38	F4-M8 HydrophobicContact CD1-CG 4.41Å; F4-M8 HydrophobicContact CE1-CG 4.17Å; F4-M8 HydrophobicContact CE2-CE 4.43Å; F4-M8 HydrophobicContact CZ-CE 4.44Å; F4-M8 HydrophobicContact CZ-CG 4.36Å; F4-M8 WeakPolarHBondContact O-CB 3.43Å; F4-M8 WeakPolarHBondContact O-CG 3.49Å; F4-M8 PolarHBondContact O-N 3.18Å; F4-M8 VanDerWaalsContact O-N 3.14Å; M8-M10 VanDerWaalsContact C-N 3.33Å; M8-M10 PolarHBondContact O-N 3.44Å; M8-I11 HydrophobicContact CE-CD1 3.78Å; M8-I11 HydrophobicContact SD-CD1 3.95Å; M8-L33 HydrophobicContact CE-CD2 4.29Å; M8-L38 HydrophobicContact CE-CD1 4.41Å
9	N	38	Very low	39.3	Very low	102 Å²	102	99.2 Å²	99.2	55%	0.545	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-15.9	175.9	-74.2	-34.7	0	0	0	114.4	F5 F7 P12 Y13	F5-N9 PolarHBondContact O-N 3.08Å; F5-N9 PolarHBondContact O-ND2 3.16Å; F7-N9 PolarHBondContact O-N 3.34Å; N9-P12 WeakPolarHBondContact O-CD 3.43Å; N9-Y13 WeakPolarHBondContact O-CD2 3.44Å; N9-Y13 WeakPolarHBondContact O-CE2 3.28Å
10	M	46.1	Very low	39.5	Very low	23 Å²	23	103.1 Å²	103.1	11%	0.113	52%	0.515	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-21.1	176.6	-77.9	-167.9	-88.6	0	0	113.7	T6 F7 M8 P12 Y13 L14 I97 I101	T6-M10 PolarHBondContact O-N 3.09Å; F7-M10 HydrophobicContact CD1-CE 3.91Å; F7-M10 HydrophobicContact CD2-CE 4.48Å; F7-M10 HydrophobicContact CE1-CE 4.01Å; F7-M10 HydrophobicContact CG-CE 4.16Å; F7-M10 HydrophobicContact CZ-CE 4.34Å; F7-M10 PolarHBondContact O-N 3.44Å; M8-M10 VanDerWaalsContact C-N 3.33Å; M8-M10 PolarHBondContact O-N 3.44Å; M10-P12 VanDerWaalsContact C-CD 3.47Å; M10-Y13 PolarHBondContact O-N 3.15Å; M10-Y13 VanDerWaalsContact O-N 3.14Å; M10-L14 PolarHBondContact O-N 3.16Å; M10-L14 VanDerWaalsContact O-N 3.15Å; M10-I97 HydrophobicContact SD-CG2 3.67Å; M10-I101 HydrophobicContact CE-CD1 3.28Å; M10-I101 HydrophobicContact CE-CG1 4.22Å; M10-I101 HydrophobicContact CG-CD1 4.44Å; M10-I101 HydrophobicContact CG-CG1 4.44Å; M10-I101 HydrophobicContact SD-CD1 3.36Å; M10-I101 WeakPolarHBondContact SD-CD1 3Å; M10-I101 HydrophobicContact SD-CG1 3.83Å
11	I	44.3	Very low	40	Very low	56 Å²	56	101.6 Å²	101.6	29%	0.287	52%	0.515	S	S	.	.	H	α-helix	trans	-56.3	-42.2	-179	-63.1	170.4	0	0	0	112.7	F7 M8 H15	F7-I11 WeakPolarHBondContact O-CG1 3.37Å; F7-I11 PolarHBondContact O-N 3.29Å; M8-I11 HydrophobicContact CE-CD1 3.78Å; M8-I11 HydrophobicContact SD-CD1 3.95Å; I11-H15 PolarHBondContact O-N 3.2Å
12	P	37.8	Very low	40.8	Very low	78 Å²	78	98.3 Å²	98.3	51%	0.506	50%	0.501	S	S	.	.	H	α-helix	trans	-67.7	-34.5	177.4	-18.3	31.8	0	0	0	113.2	N9 M10 H15 S16	N9-P12 WeakPolarHBondContact O-CD 3.43Å; M10-P12 VanDerWaalsContact C-CD 3.47Å; P12-H15 PolarHBondContact O-N 3.3Å; P12-S16 PolarHBondContact O-N 3.4Å
13	Y	41.1	Very low	41.5	Very low	184 Å²	184	96.8 Å²	96.8	72%	0.722	49%	0.493	S	S	*	.	H	α-helix	trans	-72.6	-33.2	-178.2	-70.2	-83.9	0	0	0	112.4	N9 M10	N9-Y13 WeakPolarHBondContact O-CD2 3.44Å; N9-Y13 WeakPolarHBondContact O-CE2 3.28Å; M10-Y13 PolarHBondContact O-N 3.15Å; M10-Y13 VanDerWaalsContact O-N 3.14Å
14	L	37.4	Very low	41.7	Very low	73 Å²	73	95.5 Å²	95.5	38%	0.382	49%	0.486	S	S	.	.	H	α-helix	trans	-71.4	-32.2	172	-85.8	146	0	0	0	112.7	M10 S16	M10-L14 PolarHBondContact O-N 3.16Å; M10-L14 VanDerWaalsContact O-N 3.15Å; L14-S16 VanDerWaalsContact C-N 3.35Å
15	H	39.3	Very low	42.3	Very low	95 Å²	95	92 Å²	92	44%	0.44	47%	0.472	S	S	.	.	H	α-helix	trans	-72.9	-27.9	178	-139.9	102.4	0	0	0	112.7	I11 P12	I11-H15 PolarHBondContact O-N 3.2Å; P12-H15 PolarHBondContact O-N 3.3Å
16	S	38.4	Very low	43.2	Very low	105 Å²	105	89.9 Å²	89.9	73%	0.734	47%	0.466	S	S	*	.	H	α-helix	trans	-84.2	-16.8	-173.2	-169.1	0	0	0	0	114.7	P12 L14	P12-S16 PolarHBondContact O-N 3.4Å; L14-S16 VanDerWaalsContact C-N 3.35Å
17	N	40.9	Very low	43.7	Very low	140 Å²	140	89.5 Å²	89.5	75%	0.749	46%	0.463	S	S	*	.	S	Bend	trans	-111.2	2.4	-164.4	-130.6	8.4	0	0	0	115.8
18	N	38.8	Very low	44.1	Very low	100 Å²	100	90.4 Å²	90.4	54%	0.535	47%	0.469	S	S	.	.			trans	-134.3	106.9	179.4	-82.6	-40.1	0	0	0	112.2	Y20 N25	N18-Y20 PolarHBondContact O-N 3.4Å; N18-N25 PolarHBondContact O-ND2 2.98Å
19	N	41.2	Very low	45	Very low	181 Å²	181	88.8 Å²	88.8	97%	0.968	46%	0.461	S	S	*	.			trans	-66.7	25	169.8	-93.6	-34.5	0	0	0	113.9
20	Y	43.7	Very low	45.8	Very low	177 Å²	177	85 Å²	85	69%	0.694	44%	0.442	S	S	*	.	S	Bend	trans	-101.1	100.3	-178.7	-124.1	-91.7	0	0	0	109.7	N18	N18-Y20 PolarHBondContact O-N 3.4Å
21	S	49.7	Very low	46.3	Very low	72 Å²	72	84.5 Å²	84.5	50%	0.503	44%	0.44	S	S	.	.			trans	27.6	107.8	166	-170.5	0	0	0	0	116	N23 N24	S21-N23 PolarHBondContact O-N 3.05Å; S21-N24 PolarHBondContact O-N 3.39Å
22	N	51.3	Low	46.9	Very low	118 Å²	118	84.2 Å²	84.2	63%	0.631	44%	0.439	S	S	*	.	H	α-helix	trans	-37.2	-32.1	179.8	-72.7	-13.2	0	0	0	115.6	I26	N22-I26 WeakPolarHBondContact O-CD1 3.35Å; N22-I26 VanDerWaalsContact O-CG1 3.26Å; N22-I26 WeakPolarHBondContact O-CG1 3.18Å; N22-I26 PolarHBondContact O-N 3.05Å
23	N	46.1	Very low	47.7	Very low	81 Å²	81	81.9 Å²	81.9	43%	0.433	42%	0.422	S	S	.	.	H	α-helix	trans	-67.1	-37.7	178.3	-60.7	-21.1	0	0	0	113.9	S21 I27	S21-N23 PolarHBondContact O-N 3.05Å; N23-I27 VanDerWaalsContact O-CG1 3.32Å; N23-I27 WeakPolarHBondContact O-CG1 3.04Å; N23-I27 PolarHBondContact O-N 3.14Å
24	N	48	Very low	48.3	Very low	58 Å²	58	76.2 Å²	76.2	31%	0.31	40%	0.402	S	S	.	.	H	α-helix	trans	-71.7	-39.2	179.4	-74.8	-4.1	0	0	0	111.1	S21 I26 I27 I28	S21-N24 PolarHBondContact O-N 3.39Å; N24-I26 VanDerWaalsContact C-N 3.34Å; N24-I26 PolarHBondContact O-N 3.01Å; N24-I27 PolarHBondContact O-N 3.31Å; N24-I28 VanDerWaalsContact O-CG1 3.28Å; N24-I28 WeakPolarHBondContact O-CG1 3.41Å; N24-I28 PolarHBondContact O-N 2.82Å
25	N	49.2	Very low	49	Very low	16 Å²	16	75 Å²	75	9%	0.086	40%	0.399	C	S	.	.	H	α-helix	trans	-63.1	-41.1	176.7	-71.8	-14.2	0	0	0	111.5	N18 I27 I28 I29	N18-N25 PolarHBondContact O-ND2 2.98Å; N25-I27 PolarHBondContact O-N 3.07Å; N25-I28 PolarHBondContact O-N 3.42Å; N25-I29 WeakPolarHBondContact O-CB 3.5Å; N25-I29 WeakPolarHBondContact O-CD1 3.06Å; N25-I29 WeakPolarHBondContact O-CG1 3.47Å; N25-I29 PolarHBondContact O-N 2.96Å
26	I	50.6	Low	49.7	Very low	92 Å²	92	73.9 Å²	73.9	47%	0.472	40%	0.395	S	S	.	.	H	α-helix	trans	-60.5	-47	175.6	-68.9	165.1	0	0	0	110.7	N22 N24 I28 I29 T30	N22-I26 WeakPolarHBondContact O-CD1 3.35Å; N22-I26 VanDerWaalsContact O-CG1 3.26Å; N22-I26 WeakPolarHBondContact O-CG1 3.18Å; N22-I26 PolarHBondContact O-N 3.05Å; N24-I26 VanDerWaalsContact C-N 3.34Å; N24-I26 PolarHBondContact O-N 3.01Å; I26-I28 PolarHBondContact O-N 3.43Å; I26-I29 PolarHBondContact O-N 2.9Å; I26-T30 WeakPolarHBondContact O-CB 3.5Å; I26-T30 PolarHBondContact O-N 2.94Å; I26-T30 PolarHBondContact O-OG1 3.36Å
27	I	52.9	Low	50.1	Low	12 Å²	12	71.4 Å²	71.4	6%	0.062	39%	0.387	C	S	.	.	H	α-helix	trans	-63.9	-42.2	-179	-67.1	167.8	0	0	0	111.6	N23 N24 N25 I29 T30 I31 T69 F73	N23-I27 VanDerWaalsContact O-CG1 3.32Å; N23-I27 WeakPolarHBondContact O-CG1 3.04Å; N23-I27 PolarHBondContact O-N 3.14Å; N24-I27 PolarHBondContact O-N 3.31Å; N25-I27 PolarHBondContact O-N 3.07Å; I27-I29 VanDerWaalsContact C-N 3.35Å; I27-I29 PolarHBondContact O-N 3.24Å; I27-T30 PolarHBondContact O-N 3.1Å; I27-I31 HydrophobicContact CG2-CD1 3.85Å; I27-I31 WeakPolarHBondContact O-CB 3.46Å; I27-I31 PolarHBondContact O-N 3.45Å; I27-T69 HydrophobicContact CD1-CG2 3.46Å; I27-T69 VanDerWaalsContact CD1-CG2 3.46Å; I27-F73 HydrophobicContact CG2-CB 3.98Å; I27-F73 HydrophobicContact CG2-CD1 3.61Å; I27-F73 HydrophobicContact CG2-CD2 3.9Å; I27-F73 HydrophobicContact CG2-CE1 3.94Å; I27-F73 HydrophobicContact CG2-CE2 4.26Å; I27-F73 HydrophobicContact CG2-CG 3.54Å; I27-F73 HydrophobicContact CG2-CZ 4.27Å
28	I	55.5	Low	50.1	Low	64 Å²	64	66.8 Å²	66.8	33%	0.328	36%	0.362	S	S	.	.	H	α-helix	trans	-60.7	-45.8	175.8	-68.7	164.4	0	0	0	110.3	N24 N25 I26 I31 L32 F73	N24-I28 VanDerWaalsContact O-CG1 3.28Å; N24-I28 WeakPolarHBondContact O-CG1 3.41Å; N24-I28 PolarHBondContact O-N 2.82Å; N25-I28 PolarHBondContact O-N 3.42Å; I26-I28 PolarHBondContact O-N 3.43Å; I28-I31 PolarHBondContact O-N 3.06Å; I28-L32 HydrophobicContact CG2-CD1 3.89Å; I28-L32 HydrophobicContact CG2-CG 4.48Å; I28-L32 WeakPolarHBondContact O-CB 3.48Å; I28-L32 VanDerWaalsContact O-CG 3.27Å; I28-L32 WeakPolarHBondContact O-CG 3.49Å; I28-L32 PolarHBondContact O-N 2.87Å; I28-F73 HydrophobicContact CB-CZ 4.41Å; I28-F73 HydrophobicContact CD1-CE2 4.42Å; I28-F73 HydrophobicContact CG1-CE2 3.52Å; I28-F73 HydrophobicContact CG1-CZ 3.66Å
29	I	55.8	Low	50.4	Low	37 Å²	37	69.4 Å²	69.4	19%	0.19	37%	0.374	C	S	.	.	H	α-helix	trans	-63.7	-45.1	178	-68.9	165.3	0	0	0	110.8	N25 I26 I27 I31 L32 L33	N25-I29 WeakPolarHBondContact O-CB 3.5Å; N25-I29 WeakPolarHBondContact O-CD1 3.06Å; N25-I29 WeakPolarHBondContact O-CG1 3.47Å; N25-I29 PolarHBondContact O-N 2.96Å; I26-I29 PolarHBondContact O-N 2.9Å; I27-I29 VanDerWaalsContact C-N 3.35Å; I27-I29 PolarHBondContact O-N 3.24Å; I29-I31 VanDerWaalsContact C-N 3.31Å; I29-I31 PolarHBondContact O-N 2.03Å; I29-L32 PolarHBondContact O-N 3.48Å; I29-L33 HydrophobicContact CG2-CD1 3.82Å; I29-L33 HydrophobicContact CG2-CG 4.46Å; I29-L33 WeakPolarHBondContact O-CB 3.36Å; I29-L33 WeakPolarHBondContact O-CD1 3.34Å; I29-L33 VanDerWaalsContact O-CG 3.23Å; I29-L33 WeakPolarHBondContact O-CG 3.33Å; I29-L33 PolarHBondContact O-N 2.84Å
30	T	53.8	Low	50.3	Low	22 Å²	22	69.7 Å²	69.7	14%	0.135	37%	0.367	C	S	.	.	H	α-helix	trans	-60	-40.7	177.7	-58.8	0	0	0	0	111.7	I26 I27 L33 Q34 W136	I26-T30 WeakPolarHBondContact O-CB 3.5Å; I26-T30 PolarHBondContact O-N 2.94Å; I26-T30 PolarHBondContact O-OG1 3.36Å; I27-T30 PolarHBondContact O-N 3.1Å; T30-L33 WeakPolarHBondContact O-CB 3.35Å; T30-L33 PolarHBondContact O-N 3.27Å; T30-Q34 WeakPolarHBondContact O-CG 3.23Å; T30-Q34 PolarHBondContact O-N 2.84Å; T30-W136 HydrophobicContact CG2-CD2 3.68Å; T30-W136 HydrophobicContact CG2-CE3 3.68Å; T30-W136 HydrophobicContact CG2-CG 4.36Å; T30-W136 HydrophobicContact CG2-CH2 3.97Å; T30-W136 HydrophobicContact CG2-CZ2 3.99Å; T30-W136 HydrophobicContact CG2-CZ3 3.81Å
31	I	56.6	Low	50.1	Low	13 Å²	13	63.9 Å²	63.9	7%	0.067	35%	0.35	C	S	.	.	H	α-helix	trans	-78.5	-33.4	-177.8	-74.5	167.2	0	0	0	111.9	I27 I28 I29 L33 Q34 C35 F73 Y74 I77	I27-I31 HydrophobicContact CG2-CD1 3.85Å; I27-I31 WeakPolarHBondContact O-CB 3.46Å; I27-I31 PolarHBondContact O-N 3.45Å; I28-I31 PolarHBondContact O-N 3.06Å; I29-I31 VanDerWaalsContact C-N 3.31Å; I29-I31 PolarHBondContact O-N 2.03Å; I31-L33 VanDerWaalsContact C-N 3.33Å; I31-Q34 WeakPolarHBondContact O-CB 3.1Å; I31-Q34 PolarHBondContact O-N 3.19Å; I31-C35 WeakPolarHBondContact O-CB 3.25Å; I31-C35 PolarHBondContact O-N 2.94Å; I31-C35 PolarHBondContact O-SG 3.09Å; I31-F73 HydrophobicContact CB-CE1 3.93Å; I31-F73 HydrophobicContact CD1-CD1 3.1Å; I31-F73 HydrophobicContact CD1-CE1 3.11Å; I31-F73 HydrophobicContact CD1-CG 4.3Å; I31-F73 HydrophobicContact CD1-CZ 4.33Å; I31-F73 HydrophobicContact CG1-CD1 4.42Å; I31-F73 HydrophobicContact CG1-CE1 4.05Å; I31-F73 HydrophobicContact CG2-CE1 4.01Å; I31-Y74 HydrophobicContact CD1-CE1 4.24Å; I31-Y74 HydrophobicContact CD1-CE2 4.18Å; I31-I77 HydrophobicContact CG2-CD1 3.77Å
32	L	57.4	Low	49.5	Very low	51 Å²	51	66.6 Å²	66.6	27%	0.267	35%	0.353	S	S	.	.	H	α-helix	trans	-60.9	-43	167.2	-73	169.7	0	0	0	111.3	I28 I29 Q34 C35 I36 M116	I28-L32 HydrophobicContact CG2-CD1 3.89Å; I28-L32 HydrophobicContact CG2-CG 4.48Å; I28-L32 WeakPolarHBondContact O-CB 3.48Å; I28-L32 VanDerWaalsContact O-CG 3.27Å; I28-L32 WeakPolarHBondContact O-CG 3.49Å; I28-L32 PolarHBondContact O-N 2.87Å; I29-L32 PolarHBondContact O-N 3.48Å; L32-Q34 VanDerWaalsContact C-N 3.33Å; L32-Q34 PolarHBondContact O-N 3.46Å; L32-C35 PolarHBondContact O-N 3.32Å; L32-I36 WeakPolarHBondContact O-CD1 3.34Å; L32-I36 WeakPolarHBondContact O-CG1 3.5Å; L32-I36 PolarHBondContact O-N 2.94Å; L32-I36 VanDerWaalsContact O-N 3.14Å; L32-M116 HydrophobicContact CD2-CE 4.07Å
33	L	53.7	Low	48.9	Very low	29 Å²	29	64 Å²	64	15%	0.152	34%	0.341	C	S	.	.	H	α-helix	trans	-62	-38.6	175.2	-73.9	163.6	0	0	0	112.4	M8 I29 T30 I31 I36 G37 L38 V41	M8-L33 HydrophobicContact CE-CD2 4.29Å; I29-L33 HydrophobicContact CG2-CD1 3.82Å; I29-L33 HydrophobicContact CG2-CG 4.46Å; I29-L33 WeakPolarHBondContact O-CB 3.36Å; I29-L33 WeakPolarHBondContact O-CD1 3.34Å; I29-L33 VanDerWaalsContact O-CG 3.23Å; I29-L33 WeakPolarHBondContact O-CG 3.33Å; I29-L33 PolarHBondContact O-N 2.84Å; T30-L33 WeakPolarHBondContact O-CB 3.35Å; T30-L33 PolarHBondContact O-N 3.27Å; I31-L33 VanDerWaalsContact C-N 3.33Å; L33-I36 PolarHBondContact O-N 2.76Å; L33-G37 PolarHBondContact O-N 2.91Å; L33-L38 HydrophobicContact CD2-CB 4.36Å; L33-L38 HydrophobicContact CD2-CD1 4.02Å; L33-L38 PolarHBondContact O-N 3.46Å; L33-V41 HydrophobicContact CD1-CG2 3.84Å
34	Q	54.2	Low	48.6	Very low	64 Å²	64	65.7 Å²	65.7	30%	0.299	35%	0.346	S	S	.	.	H	α-helix	trans	-65.8	-45.4	173.3	-79.7	-167.3	-59.8	0	0	113.5	T30 I31 L32 I36 G37 Y74 W136	T30-Q34 WeakPolarHBondContact O-CG 3.23Å; T30-Q34 PolarHBondContact O-N 2.84Å; I31-Q34 WeakPolarHBondContact O-CB 3.1Å; I31-Q34 PolarHBondContact O-N 3.19Å; L32-Q34 VanDerWaalsContact C-N 3.33Å; L32-Q34 PolarHBondContact O-N 3.46Å; Q34-I36 PolarHBondContact O-N 3.36Å; Q34-G37 PolarHBondContact O-N 3.24Å; Q34-Y74 PolarHBondContact OE1-OH 3.46Å; Q34-W136 VanDerWaalsContact CD-CE2 3.48Å; Q34-W136 VanDerWaalsContact CD-CZ2 3.49Å; Q34-W136 HydrophobicContact CG-CH2 4.23Å; Q34-W136 HydrophobicContact CG-CZ2 3.24Å
35	C	52.5	Low	48.2	Very low	47 Å²	47	66.6 Å²	66.6	32%	0.318	36%	0.358	S	S	.	.	H	α-helix	trans	-63.9	-25.6	-179.7	-71.7	0	0	0	0	112.2	I31 L32 G37 I120	I31-C35 WeakPolarHBondContact O-CB 3.25Å; I31-C35 PolarHBondContact O-N 2.94Å; I31-C35 PolarHBondContact O-SG 3.09Å; L32-C35 PolarHBondContact O-N 3.32Å; C35-G37 VanDerWaalsContact C-N 3.34Å; C35-I120 HydrophobicContact CB-CG1 4.48Å
36	I	53.8	Low	47.9	Very low	72 Å²	72	67.8 Å²	67.8	37%	0.369	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-4.1	178.2	-62.8	165.2	0	0	0	112	F7 L32 L33 Q34 L38	F7-I36 HydrophobicContact CD1-CD1 3.75Å; F7-I36 HydrophobicContact CE1-CD1 4.06Å; F7-I36 HydrophobicContact CG-CD1 4.05Å; L32-I36 WeakPolarHBondContact O-CD1 3.34Å; L32-I36 WeakPolarHBondContact O-CG1 3.5Å; L32-I36 PolarHBondContact O-N 2.94Å; L32-I36 VanDerWaalsContact O-N 3.14Å; L33-I36 PolarHBondContact O-N 2.76Å; Q34-I36 PolarHBondContact O-N 3.36Å; I36-L38 VanDerWaalsContact C-N 3.27Å; I36-L38 HydrophobicContact CG2-CD1 4.05Å; I36-L38 HydrophobicContact CG2-CG 4.24Å; I36-L38 PolarHBondContact O-N 2.91Å
37	G	46	Very low	47.7	Very low	54 Å²	54	67 Å²	67	56%	0.557	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.8	15.6	-179.8	0	0	0	0	0	113.8	L33 Q34 C35 I39	L33-G37 PolarHBondContact O-N 2.91Å; Q34-G37 PolarHBondContact O-N 3.24Å; C35-G37 VanDerWaalsContact C-N 3.34Å; G37-I39 PolarHBondContact O-N 3.26Å
38	L	42.3	Very low	47.2	Very low	42 Å²	42	68 Å²	68	22%	0.22	37%	0.371	C	S	.	.			trans	-80	71.3	172.3	-76.1	168.4	0	0	0	110.1	F4 M8 L33 I36 F40	F4-L38 HydrophobicContact CD2-CD1 3.89Å; F4-L38 HydrophobicContact CD2-CD2 3.81Å; F4-L38 HydrophobicContact CD2-CG 4.41Å; F4-L38 HydrophobicContact CE2-CD1 3.76Å; F4-L38 HydrophobicContact CE2-CD2 3.47Å; F4-L38 VanDerWaalsContact CE2-CD2 3.47Å; F4-L38 HydrophobicContact CE2-CG 4.26Å; M8-L38 HydrophobicContact CE-CD1 4.41Å; L33-L38 HydrophobicContact CD2-CB 4.36Å; L33-L38 HydrophobicContact CD2-CD1 4.02Å; L33-L38 PolarHBondContact O-N 3.46Å; I36-L38 VanDerWaalsContact C-N 3.27Å; I36-L38 HydrophobicContact CG2-CD1 4.05Å; I36-L38 HydrophobicContact CG2-CG 4.24Å; I36-L38 PolarHBondContact O-N 2.91Å; L38-F40 PolarHBondContact O-N 3.06Å
39	I	43.6	Very low	46.9	Very low	156 Å²	156	67.2 Å²	67.2	80%	0.8	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	52.1	165.3	-50	174.9	0	0	0	108.8	G37	G37-I39 PolarHBondContact O-N 3.26Å
40	F	39.5	Very low	46.7	Very low	187 Å²	187	66.9 Å²	66.9	82%	0.82	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-146.3	12.3	-177.6	-113	-83	0	0	0	114.7	L38 K42	L38-F40 PolarHBondContact O-N 3.06Å; F40-K42 PolarHBondContact O-N 3.11Å
41	V	40.5	Very low	46.5	Very low	55 Å²	55	71.9 Å²	71.9	33%	0.333	39%	0.389	S	S	.	.	S	Bend	trans	-75.2	94.6	150.1	-178.3	0	0	0	0	105.5	L33 T43 I46	L33-V41 HydrophobicContact CD1-CG2 3.84Å; V41-T43 PolarHBondContact O-N 2.95Å; V41-I46 HydrophobicContact CG1-CD1 4.32Å; V41-I46 HydrophobicContact CG1-CG1 4.42Å
42	K	36.8	Very low	46	Very low	128 Å²	128	77.1 Å²	77.1	56%	0.557	42%	0.416	S	S	*	.			trans	-41.2	110.5	172.8	-129.8	178.3	177.1	-148.1	0	107.9	F40 E44 S45	F40-K42 PolarHBondContact O-N 3.11Å; K42-E44 HydrophobicContact CB-CB 4.44Å; K42-E44 VanDerWaalsContact CD-OE2 3.32Å; K42-E44 WeakPolarHBondContact CD-OE2 3.47Å; K42-E44 WeakPolarHBondContact CE-OE1 3.21Å; K42-E44 WeakPolarHBondContact CE-OE2 3.2Å; K42-E44 HydrophobicContact CG-CB 4.44Å; K42-E44 HydrophobicContact CG-CG 4.3Å; K42-E44 IonicContact NZ-OE1 3.32Å; K42-E44 PolarHBondContact NZ-OE1 2.69Å; K42-E44 IonicContact NZ-OE2 2.72Å; K42-E44 PolarHBondContact NZ-OE2 2.91Å; K42-E44 PolarHBondContact O-N 3.4Å; K42-S45 PolarHBondContact O-N 2.84Å; K42-S45 PolarHBondContact O-OG 2.95Å
43	T	39.1	Very low	45.6	Very low	63 Å²	63	77.5 Å²	77.5	39%	0.387	42%	0.418	S	S	.	.	H	α-helix	trans	-50.9	-18.9	177.3	43.7	0	0	0	0	112.6	V41 I46 H47	V41-T43 PolarHBondContact O-N 2.95Å; T43-I46 PolarHBondContact O-N 3.41Å; T43-H47 WeakPolarHBondContact O-CB 3.41Å; T43-H47 PolarHBondContact O-N 3.23Å
44	E	38.3	Very low	45.5	Very low	117 Å²	117	77.3 Å²	77.3	55%	0.547	42%	0.424	S	S	.	.	H	α-helix	trans	-55.8	-41.7	171.2	-65	175.8	-166.5	0	0	114.5	K42 I46 H47 G48	K42-E44 HydrophobicContact CB-CB 4.44Å; K42-E44 VanDerWaalsContact CD-OE2 3.32Å; K42-E44 WeakPolarHBondContact CD-OE2 3.47Å; K42-E44 WeakPolarHBondContact CE-OE1 3.21Å; K42-E44 WeakPolarHBondContact CE-OE2 3.2Å; K42-E44 HydrophobicContact CG-CB 4.44Å; K42-E44 HydrophobicContact CG-CG 4.3Å; K42-E44 IonicContact NZ-OE1 3.32Å; K42-E44 PolarHBondContact NZ-OE1 2.69Å; K42-E44 IonicContact NZ-OE2 2.72Å; K42-E44 PolarHBondContact NZ-OE2 2.91Å; K42-E44 PolarHBondContact O-N 3.4Å; E44-I46 VanDerWaalsContact C-N 3.28Å; E44-I46 PolarHBondContact O-N 2.86Å; E44-H47 PolarHBondContact O-N 3.32Å; E44-G48 PolarHBondContact O-N 2.8Å
45	S	39.6	Very low	45.4	Very low	78 Å²	78	81.3 Å²	81.3	55%	0.545	45%	0.446	S	S	.	.	H	α-helix	trans	-69.2	-34.5	-177.3	60.1	0	0	0	0	111.5	K42 S49	K42-S45 PolarHBondContact O-N 2.84Å; K42-S45 PolarHBondContact O-OG 2.95Å; S45-S49 PolarHBondContact O-OG 3.47Å
46	I	44.4	Very low	45.6	Very low	40 Å²	40	84.4 Å²	84.4	21%	0.205	46%	0.464	C	S	.	.	H	α-helix	trans	-78	-34.8	177.2	-30.2	179.1	0	0	0	109.1	V41 T43 E44 G48 S49 Y50 W136	V41-I46 HydrophobicContact CG1-CD1 4.32Å; V41-I46 HydrophobicContact CG1-CG1 4.42Å; T43-I46 PolarHBondContact O-N 3.41Å; E44-I46 VanDerWaalsContact C-N 3.28Å; E44-I46 PolarHBondContact O-N 2.86Å; I46-G48 PolarHBondContact O-N 2.97Å; I46-S49 WeakPolarHBondContact CA-OG 3.36Å; I46-S49 PolarHBondContact O-N 2.95Å; I46-S49 VanDerWaalsContact O-N 3.15Å; I46-S49 PolarHBondContact O-OG 3.48Å; I46-Y50 VanDerWaalsContact C-CD2 3.47Å; I46-Y50 HydrophobicContact CB-CE1 3.93Å; I46-Y50 HydrophobicContact CB-CE2 4Å; I46-Y50 WeakPolarHBondContact CB-OH 3.25Å; I46-Y50 HydrophobicContact CG2-CD1 4.17Å; I46-Y50 HydrophobicContact CG2-CE1 3.14Å; I46-Y50 HydrophobicContact CG2-CE2 4.15Å; I46-Y50 WeakPolarHBondContact CG2-OH 3.38Å; I46-Y50 WeakPolarHBondContact O-CD1 3.27Å; I46-Y50 WeakPolarHBondContact O-CD2 3.48Å; I46-Y50 WeakPolarHBondContact O-CE1 3.47Å; I46-Y50 WeakPolarHBondContact O-CE2 3.21Å; I46-Y50 VanDerWaalsContact O-CZ 3.23Å; I46-Y50 PolarHBondContact O-N 2.84Å; I46-Y50 VanDerWaalsContact O-N 3.13Å; I46-W136 HydrophobicContact CD1-CE3 3.89Å; I46-W136 HydrophobicContact CD1-CZ3 3.95Å
47	H	44.8	Very low	45.7	Very low	77 Å²	77	87.2 Å²	87.2	36%	0.356	47%	0.473	S	S	.	.	H	α-helix	trans	-51.3	-53.4	175.5	-152.4	77.7	0	0	0	113.8	T43 E44 S49 Y50 E51	T43-H47 WeakPolarHBondContact O-CB 3.41Å; T43-H47 PolarHBondContact O-N 3.23Å; E44-H47 PolarHBondContact O-N 3.32Å; H47-S49 VanDerWaalsContact C-N 3.3Å; H47-S49 PolarHBondContact O-N 2.9Å; H47-Y50 HydrophobicContact CB-CD2 4.29Å; H47-Y50 HydrophobicContact CB-CE2 4.14Å; H47-Y50 WeakPolarHBondContact O-CD2 3.36Å; H47-Y50 PolarHBondContact O-N 3.34Å; H47-Y50 VanDerWaalsContact O-N 3.13Å; H47-E51 PolarHBondContact O-N 3.44Å
48	G	44.3	Very low	46.4	Very low	32 Å²	32	89 Å²	89	33%	0.33	47%	0.47	S	S	.	.	H	α-helix	trans	-63.1	-35.2	-180	0	0	0	0	0	113.2	E44 I46 L52	E44-G48 PolarHBondContact O-N 2.8Å; I46-G48 PolarHBondContact O-N 2.97Å; G48-L52 WeakPolarHBondContact O-CD1 3.48Å; G48-L52 PolarHBondContact O-N 2.89Å
49	S	48.3	Very low	47	Very low	47 Å²	47	90.1 Å²	90.1	33%	0.329	48%	0.48	S	S	.	.	H	α-helix	trans	-68.9	-30.2	175.4	39.1	0	0	0	0	113.4	S45 I46 H47 I53	S45-S49 PolarHBondContact O-OG 3.47Å; I46-S49 WeakPolarHBondContact CA-OG 3.36Å; I46-S49 PolarHBondContact O-N 2.95Å; I46-S49 VanDerWaalsContact O-N 3.15Å; I46-S49 PolarHBondContact O-OG 3.48Å; H47-S49 VanDerWaalsContact C-N 3.3Å; H47-S49 PolarHBondContact O-N 2.9Å; S49-I53 WeakPolarHBondContact O-CD1 3.16Å; S49-I53 WeakPolarHBondContact O-CG1 3.41Å; S49-I53 PolarHBondContact O-N 3.3Å; S49-I53 VanDerWaalsContact O-N 3.12Å
50	Y	50.5	Low	47.8	Very low	31 Å²	31	91.2 Å²	91.2	12%	0.122	48%	0.479	C	S	.	.	H	α-helix	trans	-74.4	-36.2	176.8	-30.1	-70.4	0	0	0	112.6	I46 H47 L52 I53 G54 W136 Y137	I46-Y50 VanDerWaalsContact C-CD2 3.47Å; I46-Y50 HydrophobicContact CB-CE1 3.93Å; I46-Y50 HydrophobicContact CB-CE2 4Å; I46-Y50 WeakPolarHBondContact CB-OH 3.25Å; I46-Y50 HydrophobicContact CG2-CD1 4.17Å; I46-Y50 HydrophobicContact CG2-CE1 3.14Å; I46-Y50 HydrophobicContact CG2-CE2 4.15Å; I46-Y50 WeakPolarHBondContact CG2-OH 3.38Å; I46-Y50 WeakPolarHBondContact O-CD1 3.27Å; I46-Y50 WeakPolarHBondContact O-CD2 3.48Å; I46-Y50 WeakPolarHBondContact O-CE1 3.47Å; I46-Y50 WeakPolarHBondContact O-CE2 3.21Å; I46-Y50 VanDerWaalsContact O-CZ 3.23Å; I46-Y50 PolarHBondContact O-N 2.84Å; I46-Y50 VanDerWaalsContact O-N 3.13Å; H47-Y50 HydrophobicContact CB-CD2 4.29Å; H47-Y50 HydrophobicContact CB-CE2 4.14Å; H47-Y50 WeakPolarHBondContact O-CD2 3.36Å; H47-Y50 PolarHBondContact O-N 3.34Å; H47-Y50 VanDerWaalsContact O-N 3.13Å; Y50-L52 VanDerWaalsContact C-N 3.31Å; Y50-L52 PolarHBondContact O-N 3.18Å; Y50-I53 PolarHBondContact O-N 3.14Å; Y50-G54 PolarHBondContact O-N 2.74Å; Y50-W136 PolarHBondContact OH-O 3.5Å; Y50-Y137 HydrophobicContact CE2-CD2 4.5Å; Y50-Y137 HydrophobicContact CE2-CG 4.3Å
51	E	49.5	Very low	48.8	Very low	127 Å²	127	86 Å²	86	59%	0.593	46%	0.463	S	S	*	.	H	α-helix	trans	-61.5	-42.9	174.6	-74.6	-172.3	146.8	0	0	110.7	H47 I53 G54 L55	H47-E51 PolarHBondContact O-N 3.44Å; E51-I53 PolarHBondContact O-N 3.32Å; E51-G54 PolarHBondContact O-N 2.82Å; E51-L55 VanDerWaalsContact O-CG 3.3Å; E51-L55 WeakPolarHBondContact O-CG 3.07Å; E51-L55 PolarHBondContact O-N 3.25Å
52	L	48.1	Very low	49.8	Very low	122 Å²	122	85 Å²	85	64%	0.639	45%	0.454	S	S	*	.	H	α-helix	trans	-63.6	-36.6	175.6	-79.4	158.3	0	0	0	113	G48 Y50	G48-L52 WeakPolarHBondContact O-CD1 3.48Å; G48-L52 PolarHBondContact O-N 2.89Å; Y50-L52 VanDerWaalsContact C-N 3.31Å; Y50-L52 PolarHBondContact O-N 3.18Å
53	I	48.8	Very low	50.9	Low	59 Å²	59	80.4 Å²	80.4	30%	0.303	44%	0.435	S	S	.	.	H	α-helix	trans	-80.1	-35.1	179.5	-60.8	161.3	0	0	0	111.7	S49 Y50 E51 L55 T56 K57 F62	S49-I53 WeakPolarHBondContact O-CD1 3.16Å; S49-I53 WeakPolarHBondContact O-CG1 3.41Å; S49-I53 PolarHBondContact O-N 3.3Å; S49-I53 VanDerWaalsContact O-N 3.12Å; Y50-I53 PolarHBondContact O-N 3.14Å; E51-I53 PolarHBondContact O-N 3.32Å; I53-L55 PolarHBondContact O-N 3.15Å; I53-T56 PolarHBondContact O-N 3.39Å; I53-T56 PolarHBondContact O-OG1 3.49Å; I53-T56 VanDerWaalsContact O-OG1 3.05Å; I53-K57 PolarHBondContact O-N 2.99Å; I53-K57 VanDerWaalsContact O-N 3.13Å; I53-F62 HydrophobicContact CB-CD1 4.49Å; I53-F62 HydrophobicContact CB-CE1 3.99Å; I53-F62 HydrophobicContact CB-CZ 4.26Å; I53-F62 HydrophobicContact CD1-CE1 4.22Å; I53-F62 HydrophobicContact CD1-CZ 4.02Å; I53-F62 HydrophobicContact CG2-CD1 3.72Å; I53-F62 HydrophobicContact CG2-CD2 3.96Å; I53-F62 HydrophobicContact CG2-CE1 3.39Å; I53-F62 HydrophobicContact CG2-CE2 3.68Å; I53-F62 HydrophobicContact CG2-CG 3.99Å; I53-F62 HydrophobicContact CG2-CZ 3.39Å
54	G	50.7	Low	52.2	Low	26 Å²	26	79.5 Å²	79.5	27%	0.268	44%	0.439	S	S	.	.	H	α-helix	trans	-63.9	-22	174.1	0	0	0	0	0	113.7	Y50 E51 K57	Y50-G54 PolarHBondContact O-N 2.74Å; E51-G54 PolarHBondContact O-N 2.82Å; G54-K57 VanDerWaalsContact O-O 3.07Å
55	L	52.4	Low	53.6	Low	148 Å²	148	80.8 Å²	80.8	78%	0.775	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-20.8	172.3	-72.3	166	0	0	0	113.6	E51 I53	E51-L55 VanDerWaalsContact O-CG 3.3Å; E51-L55 WeakPolarHBondContact O-CG 3.07Å; E51-L55 PolarHBondContact O-N 3.25Å; I53-L55 PolarHBondContact O-N 3.15Å
56	T	56.9	Low	54.8	Low	112 Å²	112	78.2 Å²	78.2	69%	0.687	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	-15.4	-177	60.8	0	0	0	0	114	I53	I53-T56 PolarHBondContact O-N 3.39Å; I53-T56 PolarHBondContact O-OG1 3.49Å; I53-T56 VanDerWaalsContact O-OG1 3.05Å
57	K	55.7	Low	56.1	Low	130 Å²	130	77.6 Å²	77.6	57%	0.565	42%	0.421	S	S	*	.	S	Bend	trans	-142.5	146.8	-179.5	-69.6	-177.7	179.6	171.1	0	110.1	I53 G54 P59 F62	I53-K57 PolarHBondContact O-N 2.99Å; I53-K57 VanDerWaalsContact O-N 3.13Å; G54-K57 VanDerWaalsContact O-O 3.07Å; K57-P59 WeakPolarHBondContact O-CD 3.49Å; K57-F62 HydrophobicContact CB-CB 4.45Å; K57-F62 HydrophobicContact CD-CD2 4.3Å
58	D	59.4	Low	57.3	Low	93 Å²	93	75.3 Å²	75.3	50%	0.497	42%	0.418	S	S	.	.			trans	-48.6	115.4	175.5	179.4	-71.6	0	0	0	110	K60 T61 F62	D58-K60 PolarHBondContact O-N 3.49Å; D58-K60 WeakPolarHBondContact OD1-CB 3.35Å; D58-K60 PolarHBondContact OD1-N 3.19Å; D58-T61 PolarHBondContact O-N 3Å; D58-T61 VanDerWaalsContact O-N 3.1Å; D58-T61 PolarHBondContact OD1-N 3.31Å; D58-T61 PolarHBondContact OD1-OG1 3.26Å; D58-F62 PolarHBondContact O-N 3.35Å
59	P	55.8	Low	58.5	Low	65 Å²	65	76 Å²	76	42%	0.422	42%	0.416	S	S	.	.	H	α-helix	trans	-65	-28.8	-168	21.9	-32.5	0	0	0	111.9	K57 N63	K57-P59 WeakPolarHBondContact O-CD 3.49Å; P59-N63 WeakPolarHBondContact O-CB 3.42Å; P59-N63 PolarHBondContact O-N 2.7Å; P59-N63 PolarHBondContact O-ND2 3.28Å; P59-N63 VanDerWaalsContact O-ND2 3.13Å
60	K	59.8	Low	59.4	Low	178 Å²	178	73.8 Å²	73.8	77%	0.774	40%	0.401	S	S	*	.	H	α-helix	trans	-71.4	-40.1	177.3	-64.5	179.9	178.4	176.9	0	111	D58 G64	D58-K60 PolarHBondContact O-N 3.49Å; D58-K60 WeakPolarHBondContact OD1-CB 3.35Å; D58-K60 PolarHBondContact OD1-N 3.19Å; K60-G64 WeakPolarHBondContact O-CA 3.4Å; K60-G64 PolarHBondContact O-N 3.18Å
61	T	61.3	Low	60.4	Low	79 Å²	79	74.8 Å²	74.8	49%	0.485	41%	0.408	S	S	.	.	H	α-helix	trans	-71.3	-40.8	179.1	-53.4	0	0	0	0	111.6	D58 K65	D58-T61 PolarHBondContact O-N 3Å; D58-T61 VanDerWaalsContact O-N 3.1Å; D58-T61 PolarHBondContact OD1-N 3.31Å; D58-T61 PolarHBondContact OD1-OG1 3.26Å; T61-K65 WeakPolarHBondContact O-CG 3.18Å; T61-K65 PolarHBondContact O-N 3.23Å; T61-K65 VanDerWaalsContact O-N 3.07Å
62	F	61.6	Low	61.5	Low	34 Å²	34	76 Å²	76	15%	0.149	41%	0.411	C	S	.	.	H	α-helix	trans	-68.4	-48.9	177.9	-174.9	-105.6	0	0	0	111.6	I53 K57 D58 G64 K65 L66	I53-F62 HydrophobicContact CB-CD1 4.49Å; I53-F62 HydrophobicContact CB-CE1 3.99Å; I53-F62 HydrophobicContact CB-CZ 4.26Å; I53-F62 HydrophobicContact CD1-CE1 4.22Å; I53-F62 HydrophobicContact CD1-CZ 4.02Å; I53-F62 HydrophobicContact CG2-CD1 3.72Å; I53-F62 HydrophobicContact CG2-CD2 3.96Å; I53-F62 HydrophobicContact CG2-CE1 3.39Å; I53-F62 HydrophobicContact CG2-CE2 3.68Å; I53-F62 HydrophobicContact CG2-CG 3.99Å; I53-F62 HydrophobicContact CG2-CZ 3.39Å; K57-F62 HydrophobicContact CB-CB 4.45Å; K57-F62 HydrophobicContact CD-CD2 4.3Å; D58-F62 PolarHBondContact O-N 3.35Å; F62-G64 VanDerWaalsContact C-N 3.34Å; F62-G64 PolarHBondContact O-N 3.2Å; F62-K65 PolarHBondContact O-N 2.87Å; F62-L66 HydrophobicContact CD1-CD1 3.83Å; F62-L66 HydrophobicContact CD1-CG 4.42Å; F62-L66 HydrophobicContact CE1-CD1 3.22Å; F62-L66 HydrophobicContact CE1-CG 4.02Å; F62-L66 HydrophobicContact CE2-CD1 4.44Å; F62-L66 HydrophobicContact CE2-CG 4.45Å; F62-L66 HydrophobicContact CZ-CD1 3.56Å; F62-L66 HydrophobicContact CZ-CD2 4.34Å; F62-L66 HydrophobicContact CZ-CG 4.01Å; F62-L66 PolarHBondContact O-N 3.12Å
63	N	60.1	Low	62.4	Low	31 Å²	31	72.1 Å²	72.1	17%	0.166	39%	0.389	C	S	.	.	H	α-helix	trans	-64.1	-38.4	176	-68.6	-20.3	0	0	0	111.6	P59 K65 L66 C67	P59-N63 WeakPolarHBondContact O-CB 3.42Å; P59-N63 PolarHBondContact O-N 2.7Å; P59-N63 PolarHBondContact O-ND2 3.28Å; P59-N63 VanDerWaalsContact O-ND2 3.13Å; N63-K65 VanDerWaalsContact C-N 3.33Å; N63-K65 PolarHBondContact O-N 3.43Å; N63-L66 PolarHBondContact O-N 2.89Å; N63-C67 WeakPolarHBondContact O-CB 3.47Å; N63-C67 PolarHBondContact O-N 3.44Å
64	G	65.5	Low	63.3	Low	44 Å²	44	69.8 Å²	69.8	45%	0.454	38%	0.377	S	S	.	.	H	α-helix	trans	-61.1	-40.1	174.8	0	0	0	0	0	112.8	K60 F62 G68	K60-G64 WeakPolarHBondContact O-CA 3.4Å; K60-G64 PolarHBondContact O-N 3.18Å; F62-G64 VanDerWaalsContact C-N 3.34Å; F62-G64 PolarHBondContact O-N 3.2Å; G64-G68 PolarHBondContact O-N 2.84Å
65	K	68.4	Low	64.2	Low	144 Å²	144	73 Å²	73	63%	0.626	39%	0.388	S	S	*	.	H	α-helix	trans	-69	-44.1	175.4	-76.5	179.1	179.6	-179.5	0	112.3	T61 F62 N63 G68 T69	T61-K65 WeakPolarHBondContact O-CG 3.18Å; T61-K65 PolarHBondContact O-N 3.23Å; T61-K65 VanDerWaalsContact O-N 3.07Å; F62-K65 PolarHBondContact O-N 2.87Å; N63-K65 VanDerWaalsContact C-N 3.33Å; N63-K65 PolarHBondContact O-N 3.43Å; K65-G68 PolarHBondContact O-N 2.78Å; K65-T69 WeakPolarHBondContact O-CB 3.43Å; K65-T69 PolarHBondContact O-N 3.31Å; K65-T69 PolarHBondContact O-OG1 3.4Å
66	L	65.4	Low	64.9	Low	23 Å²	23	69.2 Å²	69.2	12%	0.12	37%	0.374	C	S	.	.	H	α-helix	trans	-64.5	-45.6	176.7	-74.7	-177.8	0	0	0	111.5	F62 N63 G68 T69 C70 L138	F62-L66 HydrophobicContact CD1-CD1 3.83Å; F62-L66 HydrophobicContact CD1-CG 4.42Å; F62-L66 HydrophobicContact CE1-CD1 3.22Å; F62-L66 HydrophobicContact CE1-CG 4.02Å; F62-L66 HydrophobicContact CE2-CD1 4.44Å; F62-L66 HydrophobicContact CE2-CG 4.45Å; F62-L66 HydrophobicContact CZ-CD1 3.56Å; F62-L66 HydrophobicContact CZ-CD2 4.34Å; F62-L66 HydrophobicContact CZ-CG 4.01Å; F62-L66 PolarHBondContact O-N 3.12Å; N63-L66 PolarHBondContact O-N 2.89Å; L66-G68 PolarHBondContact O-N 2.73Å; L66-T69 WeakPolarHBondContact O-CB 3.34Å; L66-T69 PolarHBondContact O-N 2.79Å; L66-T69 VanDerWaalsContact O-N 3.13Å; L66-C70 WeakPolarHBondContact O-CB 3.49Å; L66-C70 PolarHBondContact O-N 3.32Å; L66-L138 HydrophobicContact CB-CD2 4.48Å; L66-L138 HydrophobicContact CD1-CD2 4.31Å
67	C	70.2	Confident	65.3	Low	27 Å²	27	65.5 Å²	65.5	18%	0.182	35%	0.349	C	S	.	.	H	α-helix	trans	-57.5	-50.6	174.9	-175	0	0	0	0	110.9	N63 T69 C70 L71 L138 C139	N63-C67 WeakPolarHBondContact O-CB 3.47Å; N63-C67 PolarHBondContact O-N 3.44Å; C67-T69 VanDerWaalsContact C-N 3.27Å; C67-T69 PolarHBondContact O-N 2.92Å; C67-C70 PolarHBondContact O-N 2.85Å; C67-L71 WeakPolarHBondContact O-CB 3.19Å; C67-L71 WeakPolarHBondContact O-CG 3.23Å; C67-L71 PolarHBondContact O-N 3.38Å; C67-L138 VanDerWaalsContact CA-O 3.25Å; C67-L138 WeakPolarHBondContact CA-O 3.34Å; C67-L138 VanDerWaalsContact CB-O 3.32Å; C67-L138 WeakPolarHBondContact CB-O 3.28Å; C67-L138 PolarHBondContact N-O 2.92Å; C67-C139 WeakPolarHBondContact CA-SG 3.39Å; C67-C139 HydrophobicContact CB-CB 3.83Å; C67-C139 WeakPolarHBondContact CB-SG 3.4Å; C67-C139 WeakPolarHBondContact SG-CB 3.27Å; C67-C139 CovalentContact SG-SG 2.03Å; C67-C139 PolarHBondContact SG-SG 3.31Å
68	G	70.6	Confident	65.8	Low	29 Å²	29	61.9 Å²	61.9	30%	0.299	34%	0.335	S	S	.	.	H	α-helix	trans	-60.1	-36.4	176	0	0	0	0	0	112.9	G64 K65 L66 K72	G64-G68 PolarHBondContact O-N 2.84Å; K65-G68 PolarHBondContact O-N 2.78Å; L66-G68 PolarHBondContact O-N 2.73Å; G68-K72 VanDerWaalsContact O-CB 3.23Å; G68-K72 WeakPolarHBondContact O-CB 3.38Å; G68-K72 WeakPolarHBondContact O-CG 3.13Å; G68-K72 PolarHBondContact O-N 3.09Å
69	T	69.7	Low	66.3	Low	47 Å²	47	60.2 Å²	60.2	29%	0.288	33%	0.331	S	S	.	.	H	α-helix	trans	-69.8	-44.4	176.4	-53.8	0	0	0	0	111.1	I27 K65 L66 C67 K72 F73	I27-T69 HydrophobicContact CD1-CG2 3.46Å; I27-T69 VanDerWaalsContact CD1-CG2 3.46Å; K65-T69 WeakPolarHBondContact O-CB 3.43Å; K65-T69 PolarHBondContact O-N 3.31Å; K65-T69 PolarHBondContact O-OG1 3.4Å; L66-T69 WeakPolarHBondContact O-CB 3.34Å; L66-T69 PolarHBondContact O-N 2.79Å; L66-T69 VanDerWaalsContact O-N 3.13Å; C67-T69 VanDerWaalsContact C-N 3.27Å; C67-T69 PolarHBondContact O-N 2.92Å; T69-K72 PolarHBondContact O-N 2.85Å; T69-F73 VanDerWaalsContact O-CB 3.29Å; T69-F73 WeakPolarHBondContact O-CB 3.33Å; T69-F73 PolarHBondContact O-N 3.08Å
70	C	67	Low	66.7	Low	1 Å²	1	59.3 Å²	59.3	1%	0.007	32%	0.322	C	S	.	.	H	α-helix	trans	-61	-48.7	177.4	-178.6	0	0	0	0	111.3	L66 C67 F73 Y74 C133 L138	L66-C70 WeakPolarHBondContact O-CB 3.49Å; L66-C70 PolarHBondContact O-N 3.32Å; C67-C70 PolarHBondContact O-N 2.85Å; C70-F73 WeakPolarHBondContact O-CB 3.36Å; C70-F73 PolarHBondContact O-N 3.32Å; C70-Y74 WeakPolarHBondContact O-CD2 3.4Å; C70-Y74 PolarHBondContact O-N 3.2Å; C70-C133 HydrophobicContact CB-CB 3.87Å; C70-C133 WeakPolarHBondContact CB-SG 3.39Å; C70-C133 WeakPolarHBondContact SG-CA 3.46Å; C70-C133 WeakPolarHBondContact SG-CB 3.22Å; C70-C133 CovalentContact SG-SG 2.02Å; C70-C133 PolarHBondContact SG-SG 2.92Å; C70-L138 HydrophobicContact CB-CB 4.16Å; C70-L138 HydrophobicContact CB-CD1 3.93Å
71	L	71.2	Confident	67	Low	51 Å²	51	51.8 Å²	51.8	27%	0.267	29%	0.289	S	S	.	.	H	α-helix	trans	-62.5	-45.1	176.5	-69	174.6	0	0	0	112	C67 F73 Y74 N75 P129	C67-L71 WeakPolarHBondContact O-CB 3.19Å; C67-L71 WeakPolarHBondContact O-CG 3.23Å; C67-L71 PolarHBondContact O-N 3.38Å; L71-F73 PolarHBondContact O-N 3.22Å; L71-Y74 PolarHBondContact O-N 3.49Å; L71-N75 WeakPolarHBondContact O-CB 3.15Å; L71-N75 VanDerWaalsContact O-CG 3.28Å; L71-N75 PolarHBondContact O-N 3.43Å; L71-N75 PolarHBondContact O-ND2 3.36Å; L71-P129 HydrophobicContact CD2-CB 3.71Å
72	K	72.5	Confident	67.4	Low	152 Å²	152	54.4 Å²	54.4	66%	0.661	30%	0.3	S	S	*	.	H	α-helix	trans	-58.8	-38.1	174.6	-82.3	176.8	177	-176.2	0	111.8	G68 T69 S76	G68-K72 VanDerWaalsContact O-CB 3.23Å; G68-K72 WeakPolarHBondContact O-CB 3.38Å; G68-K72 WeakPolarHBondContact O-CG 3.13Å; G68-K72 PolarHBondContact O-N 3.09Å; T69-K72 PolarHBondContact O-N 2.85Å; K72-S76 WeakPolarHBondContact O-CB 3.26Å; K72-S76 PolarHBondContact O-N 3.39Å; K72-S76 PolarHBondContact O-OG 2.99Å
73	F	68.3	Low	67.9	Low	42 Å²	42	55.8 Å²	55.8	18%	0.184	31%	0.309	C	S	.	.	H	α-helix	trans	-68.2	-48.7	179.2	-173.7	-91.9	0	0	0	111.6	I27 I28 I31 T69 C70 L71 N75 S76 I77	I27-F73 HydrophobicContact CG2-CB 3.98Å; I27-F73 HydrophobicContact CG2-CD1 3.61Å; I27-F73 HydrophobicContact CG2-CD2 3.9Å; I27-F73 HydrophobicContact CG2-CE1 3.94Å; I27-F73 HydrophobicContact CG2-CE2 4.26Å; I27-F73 HydrophobicContact CG2-CG 3.54Å; I27-F73 HydrophobicContact CG2-CZ 4.27Å; I28-F73 HydrophobicContact CB-CZ 4.41Å; I28-F73 HydrophobicContact CD1-CE2 4.42Å; I28-F73 HydrophobicContact CG1-CE2 3.52Å; I28-F73 HydrophobicContact CG1-CZ 3.66Å; I31-F73 HydrophobicContact CB-CE1 3.93Å; I31-F73 HydrophobicContact CD1-CD1 3.1Å; I31-F73 HydrophobicContact CD1-CE1 3.11Å; I31-F73 HydrophobicContact CD1-CG 4.3Å; I31-F73 HydrophobicContact CD1-CZ 4.33Å; I31-F73 HydrophobicContact CG1-CD1 4.42Å; I31-F73 HydrophobicContact CG1-CE1 4.05Å; I31-F73 HydrophobicContact CG2-CE1 4.01Å; T69-F73 VanDerWaalsContact O-CB 3.29Å; T69-F73 WeakPolarHBondContact O-CB 3.33Å; T69-F73 PolarHBondContact O-N 3.08Å; C70-F73 WeakPolarHBondContact O-CB 3.36Å; C70-F73 PolarHBondContact O-N 3.32Å; L71-F73 PolarHBondContact O-N 3.22Å; F73-N75 VanDerWaalsContact C-N 3.3Å; F73-N75 PolarHBondContact O-N 3.24Å; F73-S76 WeakPolarHBondContact O-CB 3.42Å; F73-S76 PolarHBondContact O-N 3.39Å; F73-S76 VanDerWaalsContact O-N 3.12Å; F73-I77 HydrophobicContact CD1-CD1 3.76Å; F73-I77 HydrophobicContact CD1-CG1 4.19Å; F73-I77 HydrophobicContact CE1-CD1 3.07Å; F73-I77 HydrophobicContact CE1-CG1 3.82Å; F73-I77 HydrophobicContact CZ-CD1 3.59Å; F73-I77 HydrophobicContact CZ-CG1 4.12Å; F73-I77 WeakPolarHBondContact O-CB 3.41Å; F73-I77 PolarHBondContact O-N 3.5Å
74	Y	66.7	Low	68.4	Low	9 Å²	9	63.7 Å²	63.7	4%	0.035	34%	0.338	C	S	.	.	H	α-helix	trans	-57.6	-43.8	173.5	-84.1	-69.6	0	0	0	111.8	I31 Q34 C70 L71 S76 I77 M78 I127 P129 S132 C133	I31-Y74 HydrophobicContact CD1-CE1 4.24Å; I31-Y74 HydrophobicContact CD1-CE2 4.18Å; Q34-Y74 PolarHBondContact OE1-OH 3.46Å; C70-Y74 WeakPolarHBondContact O-CD2 3.4Å; C70-Y74 PolarHBondContact O-N 3.2Å; L71-Y74 PolarHBondContact O-N 3.49Å; Y74-S76 VanDerWaalsContact C-N 3.33Å; Y74-S76 PolarHBondContact O-N 2.91Å; Y74-I77 PolarHBondContact O-N 2.93Å; Y74-M78 WeakPolarHBondContact O-CB 3.32Å; Y74-M78 VanDerWaalsContact O-CG 3.22Å; Y74-M78 WeakPolarHBondContact O-CG 3.26Å; Y74-M78 PolarHBondContact O-N 2.69Å; Y74-I127 HydrophobicContact CD1-CG2 3.93Å; Y74-I127 HydrophobicContact CE1-CG2 3.72Å; Y74-P129 HydrophobicContact CD2-CB 4.14Å; Y74-P129 HydrophobicContact CG-CB 4Å; Y74-P129 HydrophobicContact CG-CG 4.39Å; Y74-S132 VanDerWaalsContact OH-CB 3.3Å; Y74-S132 WeakPolarHBondContact OH-CB 3.39Å; Y74-C133 VanDerWaalsContact CD2-SG 3.59Å
75	N	69.7	Low	68.7	Low	93 Å²	93	63.8 Å²	63.8	50%	0.497	34%	0.339	S	S	.	.	H	α-helix	trans	-62.9	-39.5	176.2	-72.7	-21.6	0	0	0	112.2	L71 F73 M78 S79	L71-N75 WeakPolarHBondContact O-CB 3.15Å; L71-N75 VanDerWaalsContact O-CG 3.28Å; L71-N75 PolarHBondContact O-N 3.43Å; L71-N75 PolarHBondContact O-ND2 3.36Å; F73-N75 VanDerWaalsContact C-N 3.3Å; F73-N75 PolarHBondContact O-N 3.24Å; N75-M78 PolarHBondContact O-N 3.5Å; N75-S79 WeakPolarHBondContact O-CB 3.3Å; N75-S79 PolarHBondContact O-N 2.84Å
76	S	67.9	Low	68.9	Low	70 Å²	70	61.5 Å²	61.5	49%	0.49	33%	0.329	S	S	.	.	H	α-helix	trans	-65.7	-43.8	176.9	-58.3	0	0	0	0	111.1	K72 F73 Y74 S79 L80	K72-S76 WeakPolarHBondContact O-CB 3.26Å; K72-S76 PolarHBondContact O-N 3.39Å; K72-S76 PolarHBondContact O-OG 2.99Å; F73-S76 WeakPolarHBondContact O-CB 3.42Å; F73-S76 PolarHBondContact O-N 3.39Å; F73-S76 VanDerWaalsContact O-N 3.12Å; Y74-S76 VanDerWaalsContact C-N 3.33Å; Y74-S76 PolarHBondContact O-N 2.91Å; S76-S79 PolarHBondContact O-N 3.25Å; S76-S79 PolarHBondContact O-OG 2.98Å; S76-L80 WeakPolarHBondContact O-CB 3.45Å; S76-L80 PolarHBondContact O-N 2.88Å
77	I	64.7	Low	69	Low	33 Å²	33	61.3 Å²	61.3	17%	0.169	33%	0.328	C	S	.	.	H	α-helix	trans	-59.4	-53	173.1	-83	-168.3	0	0	0	110.2	I31 F73 Y74 S79 L80 F81 I124	I31-I77 HydrophobicContact CG2-CD1 3.77Å; F73-I77 HydrophobicContact CD1-CD1 3.76Å; F73-I77 HydrophobicContact CD1-CG1 4.19Å; F73-I77 HydrophobicContact CE1-CD1 3.07Å; F73-I77 HydrophobicContact CE1-CG1 3.82Å; F73-I77 HydrophobicContact CZ-CD1 3.59Å; F73-I77 HydrophobicContact CZ-CG1 4.12Å; F73-I77 WeakPolarHBondContact O-CB 3.41Å; F73-I77 PolarHBondContact O-N 3.5Å; Y74-I77 PolarHBondContact O-N 2.93Å; I77-S79 PolarHBondContact O-N 3.14Å; I77-L80 CarbonylContact O-C 3.57Å; I77-L80 WeakPolarHBondContact O-CA 3.2Å; I77-L80 WeakPolarHBondContact O-CB 3.43Å; I77-L80 PolarHBondContact O-N 3.32Å; I77-F81 HydrophobicContact CB-CD2 4.49Å; I77-F81 HydrophobicContact CG2-CD2 3.58Å; I77-F81 HydrophobicContact CG2-CE2 3.69Å; I77-F81 WeakPolarHBondContact O-CD2 3.49Å; I77-F81 PolarHBondContact O-N 2.82Å; I77-I124 HydrophobicContact CG2-CD1 3.77Å; I77-I124 HydrophobicContact CG2-CG1 4.5Å
78	M	67.2	Low	69	Low	55 Å²	55	66 Å²	66	27%	0.271	35%	0.347	S	S	.	.	H	α-helix	trans	-54.8	-43.1	178.1	-73.9	172.9	77.2	0	0	111	Y74 N75 L80 F81 L82 I124 P129	Y74-M78 WeakPolarHBondContact O-CB 3.32Å; Y74-M78 VanDerWaalsContact O-CG 3.22Å; Y74-M78 WeakPolarHBondContact O-CG 3.26Å; Y74-M78 PolarHBondContact O-N 2.69Å; N75-M78 PolarHBondContact O-N 3.5Å; M78-L80 VanDerWaalsContact C-N 3.31Å; M78-L80 PolarHBondContact O-N 3.13Å; M78-F81 PolarHBondContact O-N 2.96Å; M78-L82 WeakPolarHBondContact O-CB 3.46Å; M78-L82 WeakPolarHBondContact O-CG 3.32Å; M78-L82 PolarHBondContact O-N 2.86Å; M78-I124 HydrophobicContact CG-CG2 3.71Å; M78-P129 HydrophobicContact SD-CG 3.94Å
79	S	69.4	Low	69.1	Low	58 Å²	58	67 Å²	67	41%	0.406	35%	0.35	S	S	.	.	H	α-helix	trans	-64.6	-33.4	175.9	80.1	0	0	0	0	113.3	N75 S76 I77 D83	N75-S79 WeakPolarHBondContact O-CB 3.3Å; N75-S79 PolarHBondContact O-N 2.84Å; S76-S79 PolarHBondContact O-N 3.25Å; S76-S79 PolarHBondContact O-OG 2.98Å; I77-S79 PolarHBondContact O-N 3.14Å; S79-D83 WeakPolarHBondContact O-CB 3.23Å; S79-D83 PolarHBondContact O-N 3.33Å
80	L	63.9	Low	69.1	Low	45 Å²	45	67.7 Å²	67.7	24%	0.236	35%	0.349	C	S	.	.	H	α-helix	trans	-72.7	-37.3	176.3	-175.1	147.7	0	0	0	111.5	S76 I77 M78 K86 L87 F90	S76-L80 WeakPolarHBondContact O-CB 3.45Å; S76-L80 PolarHBondContact O-N 2.88Å; I77-L80 CarbonylContact O-C 3.57Å; I77-L80 WeakPolarHBondContact O-CA 3.2Å; I77-L80 WeakPolarHBondContact O-CB 3.43Å; I77-L80 PolarHBondContact O-N 3.32Å; M78-L80 VanDerWaalsContact C-N 3.31Å; M78-L80 PolarHBondContact O-N 3.13Å; L80-K86 HydrophobicContact CG-CB 4.18Å; L80-L87 HydrophobicContact CD2-CD1 4.36Å; L80-F90 HydrophobicContact CD1-CD2 4.37Å; L80-F90 HydrophobicContact CD2-CB 4.02Å; L80-F90 HydrophobicContact CD2-CD1 4.1Å; L80-F90 HydrophobicContact CD2-CD2 4.48Å; L80-F90 HydrophobicContact CD2-CG 3.95Å
81	F	65.9	Low	69.2	Low	20 Å²	20	70.1 Å²	70.1	9%	0.088	36%	0.36	C	S	.	.	H	α-helix	trans	-78.8	-25.6	178.4	-76.4	-78.6	0	0	0	113.7	I77 M78 L87 F90 F117 I120 I124	I77-F81 HydrophobicContact CB-CD2 4.49Å; I77-F81 HydrophobicContact CG2-CD2 3.58Å; I77-F81 HydrophobicContact CG2-CE2 3.69Å; I77-F81 WeakPolarHBondContact O-CD2 3.49Å; I77-F81 PolarHBondContact O-N 2.82Å; M78-F81 PolarHBondContact O-N 2.96Å; F81-L87 HydrophobicContact CD1-CD1 3.37Å; F81-L87 HydrophobicContact CE1-CD1 3.58Å; F81-L87 HydrophobicContact CG-CD1 4.23Å; F81-F90 HydrophobicContact CZ-CE1 4.42Å; F81-F117 HydrophobicContact CD1-CD1 4.36Å; F81-F117 AromaticContact CE1-CD1 3.75Å; F81-F117 HydrophobicContact CE1-CD1 3.75Å; F81-F117 AromaticContact CE1-CE1 3.79Å; F81-F117 HydrophobicContact CE1-CE1 3.79Å; F81-I120 HydrophobicContact CD1-CB 4.44Å; F81-I120 HydrophobicContact CD1-CG2 3.64Å; F81-I120 HydrophobicContact CD2-CG2 3.96Å; F81-I120 HydrophobicContact CE1-CB 3.91Å; F81-I120 HydrophobicContact CE1-CD1 3.95Å; F81-I120 HydrophobicContact CE1-CG2 3.32Å; F81-I120 HydrophobicContact CE2-CG2 3.69Å; F81-I120 HydrophobicContact CG-CG2 3.99Å; F81-I120 HydrophobicContact CZ-CB 4.2Å; F81-I120 HydrophobicContact CZ-CD1 3.7Å; F81-I120 HydrophobicContact CZ-CG1 4.47Å; F81-I120 HydrophobicContact CZ-CG2 3.39Å; F81-I124 HydrophobicContact CB-CD1 3.68Å; F81-I124 HydrophobicContact CD1-CD1 4.14Å; F81-I124 HydrophobicContact CD2-CD1 3.14Å; F81-I124 HydrophobicContact CE2-CD1 3.86Å; F81-I124 HydrophobicContact CG-CD1 3.36Å
82	L	68.8	Low	69.5	Low	135 Å²	135	73 Å²	73	71%	0.707	37%	0.372	S	S	*	.	H	α-helix	trans	-80.7	-23	174	-70.3	170.4	0	0	0	112.8	M78	M78-L82 WeakPolarHBondContact O-CB 3.46Å; M78-L82 WeakPolarHBondContact O-CG 3.32Å; M78-L82 PolarHBondContact O-N 2.86Å
83	D	73.3	Confident	69.5	Low	63 Å²	63	72 Å²	72	34%	0.337	37%	0.368	S	S	.	.			trans	-94.7	98.2	179.8	-172.9	-22.5	0	0	0	110	S79 G85 K86 L87	S79-D83 WeakPolarHBondContact O-CB 3.23Å; S79-D83 PolarHBondContact O-N 3.33Å; D83-G85 PolarHBondContact O-N 3.17Å; D83-G85 VanDerWaalsContact O-N 3.16Å; D83-G85 PolarHBondContact OD1-N 3.22Å; D83-K86 HydrophobicContact CB-CB 4.11Å; D83-K86 HydrophobicContact CB-CD 3.98Å; D83-K86 HydrophobicContact CB-CG 4.16Å; D83-K86 PolarHBondContact O-N 2.79Å; D83-K86 PolarHBondContact OD1-N 3.38Å; D83-K86 VanDerWaalsContact OD2-CD 3.25Å; D83-K86 WeakPolarHBondContact OD2-CD 3.19Å; D83-K86 WeakPolarHBondContact OD2-CE 3.29Å; D83-K86 WeakPolarHBondContact OD2-CG 3.47Å; D83-K86 IonicContact OD2-NZ 3.59Å; D83-K86 PolarHBondContact OD2-NZ 2.93Å; D83-L87 PolarHBondContact O-N 3.24Å
84	Y	69.4	Low	69.6	Low	196 Å²	196	71.3 Å²	71.3	77%	0.769	37%	0.366	S	S	*	.	H	α-helix	trans	-52.9	-36.9	-176.9	-74.1	-82.2	0	0	0	113.5	L87 E88	Y84-L87 WeakPolarHBondContact O-CB 3.45Å; Y84-L87 PolarHBondContact O-N 2.88Å; Y84-E88 PolarHBondContact O-N 3.37Å; Y84-E88 VanDerWaalsContact O-N 3.09Å
85	G	73.3	Confident	70	Confident	46 Å²	46	73 Å²	73	47%	0.474	38%	0.375	S	S	.	.	H	α-helix	trans	-70	-38.3	179.5	0	0	0	0	0	112.4	D83 L87 S89	D83-G85 PolarHBondContact O-N 3.17Å; D83-G85 VanDerWaalsContact O-N 3.16Å; D83-G85 PolarHBondContact OD1-N 3.22Å; G85-L87 VanDerWaalsContact C-N 3.32Å; G85-S89 PolarHBondContact O-N 3.36Å
86	K	71.4	Confident	70.3	Confident	97 Å²	97	72.7 Å²	72.7	42%	0.422	37%	0.373	S	S	.	.	H	α-helix	trans	-68.7	-35.8	173	-69.3	179.3	-174.1	138.9	0	111.6	L80 D83 S89 F90	L80-K86 HydrophobicContact CG-CB 4.18Å; D83-K86 HydrophobicContact CB-CB 4.11Å; D83-K86 HydrophobicContact CB-CD 3.98Å; D83-K86 HydrophobicContact CB-CG 4.16Å; D83-K86 PolarHBondContact O-N 2.79Å; D83-K86 PolarHBondContact OD1-N 3.38Å; D83-K86 VanDerWaalsContact OD2-CD 3.25Å; D83-K86 WeakPolarHBondContact OD2-CD 3.19Å; D83-K86 WeakPolarHBondContact OD2-CE 3.29Å; D83-K86 WeakPolarHBondContact OD2-CG 3.47Å; D83-K86 IonicContact OD2-NZ 3.59Å; D83-K86 PolarHBondContact OD2-NZ 2.93Å; K86-S89 PolarHBondContact O-N 3.44Å; K86-S89 PolarHBondContact O-OG 3.17Å; K86-F90 WeakPolarHBondContact O-CB 3.39Å; K86-F90 PolarHBondContact O-N 3.5Å
87	L	67.2	Low	70.4	Confident	19 Å²	19	72.4 Å²	72.4	10%	0.099	37%	0.365	C	S	.	.	H	α-helix	trans	-61.9	-46.5	179.1	-167.6	64.7	0	0	0	112	L80 F81 D83 Y84 G85 F90 Q91 F117	L80-L87 HydrophobicContact CD2-CD1 4.36Å; F81-L87 HydrophobicContact CD1-CD1 3.37Å; F81-L87 HydrophobicContact CE1-CD1 3.58Å; F81-L87 HydrophobicContact CG-CD1 4.23Å; D83-L87 PolarHBondContact O-N 3.24Å; Y84-L87 WeakPolarHBondContact O-CB 3.45Å; Y84-L87 PolarHBondContact O-N 2.88Å; G85-L87 VanDerWaalsContact C-N 3.32Å; L87-F90 WeakPolarHBondContact O-CB 3.47Å; L87-F90 PolarHBondContact O-N 3.14Å; L87-Q91 WeakPolarHBondContact O-CB 3.43Å; L87-Q91 PolarHBondContact O-N 3.29Å; L87-F117 HydrophobicContact CD1-CD1 3.49Å; L87-F117 VanDerWaalsContact CD1-CD1 3.49Å; L87-F117 HydrophobicContact CD1-CE1 3.25Å; L87-F117 HydrophobicContact CD1-CZ 4.3Å; L87-F117 HydrophobicContact CD2-CD1 4.28Å; L87-F117 HydrophobicContact CG-CD1 4Å; L87-F117 HydrophobicContact CG-CE1 3.9Å
88	E	71	Confident	70.5	Confident	125 Å²	125	70.8 Å²	70.8	58%	0.584	36%	0.357	S	S	*	.	H	α-helix	trans	-60.2	-48.6	176.1	-174.9	172.7	-149.1	0	0	111	Y84 F90 Q91 E92	Y84-E88 PolarHBondContact O-N 3.37Å; Y84-E88 VanDerWaalsContact O-N 3.09Å; E88-F90 PolarHBondContact O-N 2.95Å; E88-Q91 WeakPolarHBondContact O-CB 3.5Å; E88-Q91 PolarHBondContact O-N 2.95Å; E88-Q91 VanDerWaalsContact O-N 3.08Å; E88-E92 PolarHBondContact O-N 3.36Å
89	S	73	Confident	70.9	Confident	50 Å²	50	73 Å²	73	35%	0.35	37%	0.367	S	S	.	.	H	α-helix	trans	-61.3	-29.8	176.9	78	0	0	0	0	113.5	G85 K86 K93	G85-S89 PolarHBondContact O-N 3.36Å; K86-S89 PolarHBondContact O-N 3.44Å; K86-S89 PolarHBondContact O-OG 3.17Å; S89-K93 WeakPolarHBondContact O-CG 3.34Å; S89-K93 PolarHBondContact O-N 3.5Å
90	F	69.4	Low	71.1	Confident	62 Å²	62	80 Å²	80	27%	0.272	39%	0.386	S	S	.	.	H	α-helix	trans	-77.7	-37.6	176.8	-176.2	-105.9	0	0	0	111.4	L80 F81 K86 L87 E88 K93 L94 F117	L80-F90 HydrophobicContact CD1-CD2 4.37Å; L80-F90 HydrophobicContact CD2-CB 4.02Å; L80-F90 HydrophobicContact CD2-CD1 4.1Å; L80-F90 HydrophobicContact CD2-CD2 4.48Å; L80-F90 HydrophobicContact CD2-CG 3.95Å; F81-F90 HydrophobicContact CZ-CE1 4.42Å; K86-F90 WeakPolarHBondContact O-CB 3.39Å; K86-F90 PolarHBondContact O-N 3.5Å; L87-F90 WeakPolarHBondContact O-CB 3.47Å; L87-F90 PolarHBondContact O-N 3.14Å; E88-F90 PolarHBondContact O-N 2.95Å; F90-K93 PolarHBondContact O-N 3.26Å; F90-L94 HydrophobicContact CD1-CD1 3.9Å; F90-L94 HydrophobicContact CD1-CG 4.48Å; F90-L94 HydrophobicContact CE1-CD1 3.46Å; F90-L94 VanDerWaalsContact CE1-CD1 3.46Å; F90-L94 HydrophobicContact CE1-CG 4.14Å; F90-L94 HydrophobicContact CZ-CD1 4.01Å; F90-L94 HydrophobicContact CZ-CD2 4.48Å; F90-L94 HydrophobicContact CZ-CG 4.28Å; F90-L94 WeakPolarHBondContact O-CG 3.44Å; F90-L94 PolarHBondContact O-N 3.25Å; F90-L94 VanDerWaalsContact O-N 3.07Å; F90-F117 HydrophobicContact CD1-CE1 4.09Å; F90-F117 HydrophobicContact CD1-CZ 4.09Å
91	Q	69.7	Low	71	Confident	52 Å²	52	79 Å²	79	24%	0.243	38%	0.38	C	S	.	.	H	α-helix	trans	-60.3	-47.8	172.8	175.7	168	-18.3	0	0	111.4	L87 E88 K93 L94 I95 V112 F117	L87-Q91 WeakPolarHBondContact O-CB 3.43Å; L87-Q91 PolarHBondContact O-N 3.29Å; E88-Q91 WeakPolarHBondContact O-CB 3.5Å; E88-Q91 PolarHBondContact O-N 2.95Å; E88-Q91 VanDerWaalsContact O-N 3.08Å; Q91-K93 VanDerWaalsContact C-N 3.33Å; Q91-K93 PolarHBondContact O-N 3.06Å; Q91-L94 PolarHBondContact O-N 2.92Å; Q91-L94 VanDerWaalsContact O-N 3.14Å; Q91-I95 HydrophobicContact CG-CD1 3.78Å; Q91-I95 HydrophobicContact CG-CG1 4.42Å; Q91-I95 WeakPolarHBondContact O-CG1 3.46Å; Q91-I95 PolarHBondContact O-N 3.31Å; Q91-V112 HydrophobicContact CG-CG1 4.27Å; Q91-F117 HydrophobicContact CB-CE2 3.48Å; Q91-F117 VanDerWaalsContact CB-CE2 3.48Å; Q91-F117 HydrophobicContact CB-CZ 3.57Å; Q91-F117 HydrophobicContact CG-CD2 4.47Å; Q91-F117 HydrophobicContact CG-CE2 3.6Å; Q91-F117 HydrophobicContact CG-CZ 4.23Å
92	E	76	Confident	71.1	Confident	111 Å²	111	80.1 Å²	80.1	52%	0.519	40%	0.398	S	S	.	.	H	α-helix	trans	-57.2	-47	177.4	-71.1	-179.5	159.8	0	0	111.2	E88 L94 I95 D96	E88-E92 PolarHBondContact O-N 3.36Å; E92-L94 VanDerWaalsContact C-N 3.29Å; E92-L94 PolarHBondContact O-N 3.37Å; E92-I95 CarbonylContact O-C 3.57Å; E92-I95 WeakPolarHBondContact O-CA 3.45Å; E92-I95 WeakPolarHBondContact O-CB 3.45Å; E92-I95 PolarHBondContact O-N 2.95Å; E92-D96 VanDerWaalsContact O-CG 3.31Å; E92-D96 PolarHBondContact O-N 3.32Å
93	K	73.4	Confident	71.5	Confident	131 Å²	131	79.5 Å²	79.5	57%	0.57	40%	0.402	S	S	*	.	H	α-helix	trans	-60.2	-37	176.4	-72.7	173.5	-177.1	177.1	0	113.5	S89 F90 Q91 I97	S89-K93 WeakPolarHBondContact O-CG 3.34Å; S89-K93 PolarHBondContact O-N 3.5Å; F90-K93 PolarHBondContact O-N 3.26Å; Q91-K93 VanDerWaalsContact C-N 3.33Å; Q91-K93 PolarHBondContact O-N 3.06Å; K93-I97 WeakPolarHBondContact O-CG1 3.43Å; K93-I97 PolarHBondContact O-N 2.83Å; K93-I97 VanDerWaalsContact O-N 3.15Å
94	L	69.8	Low	71.3	Confident	28 Å²	28	79 Å²	79	15%	0.147	40%	0.397	C	S	.	.	H	α-helix	trans	-70.9	-36.6	175.9	-74.8	176.8	0	0	0	111.7	F90 Q91 E92 D96 I97 C98 V112 M116 F117	F90-L94 HydrophobicContact CD1-CD1 3.9Å; F90-L94 HydrophobicContact CD1-CG 4.48Å; F90-L94 HydrophobicContact CE1-CD1 3.46Å; F90-L94 VanDerWaalsContact CE1-CD1 3.46Å; F90-L94 HydrophobicContact CE1-CG 4.14Å; F90-L94 HydrophobicContact CZ-CD1 4.01Å; F90-L94 HydrophobicContact CZ-CD2 4.48Å; F90-L94 HydrophobicContact CZ-CG 4.28Å; F90-L94 WeakPolarHBondContact O-CG 3.44Å; F90-L94 PolarHBondContact O-N 3.25Å; F90-L94 VanDerWaalsContact O-N 3.07Å; Q91-L94 PolarHBondContact O-N 2.92Å; Q91-L94 VanDerWaalsContact O-N 3.14Å; E92-L94 VanDerWaalsContact C-N 3.29Å; E92-L94 PolarHBondContact O-N 3.37Å; L94-D96 VanDerWaalsContact C-N 3.35Å; L94-I97 HydrophobicContact CD2-CD1 4.39Å; L94-I97 WeakPolarHBondContact O-CB 3.21Å; L94-I97 PolarHBondContact O-N 3.11Å; L94-C98 PolarHBondContact O-N 2.94Å; L94-C98 PolarHBondContact O-SG 3.42Å; L94-V112 HydrophobicContact CB-CB 4.5Å; L94-V112 HydrophobicContact CB-CG1 3.63Å; L94-V112 HydrophobicContact CB-CG2 4Å; L94-V112 HydrophobicContact CD1-CG1 4.08Å; L94-M116 HydrophobicContact CD1-CE 3.96Å; L94-M116 HydrophobicContact CD1-SD 3.85Å; L94-F117 HydrophobicContact CD1-CZ 4.37Å
95	I	75.9	Confident	71.4	Confident	43 Å²	43	74.9 Å²	74.9	22%	0.221	38%	0.38	C	S	.	.	H	α-helix	trans	-64.8	-40.3	173.5	-70.1	169.6	0	0	0	110.5	Q91 E92 I97 C98 E99 V109 V112	Q91-I95 HydrophobicContact CG-CD1 3.78Å; Q91-I95 HydrophobicContact CG-CG1 4.42Å; Q91-I95 WeakPolarHBondContact O-CG1 3.46Å; Q91-I95 PolarHBondContact O-N 3.31Å; E92-I95 CarbonylContact O-C 3.57Å; E92-I95 WeakPolarHBondContact O-CA 3.45Å; E92-I95 WeakPolarHBondContact O-CB 3.45Å; E92-I95 PolarHBondContact O-N 2.95Å; I95-I97 VanDerWaalsContact C-N 3.29Å; I95-I97 PolarHBondContact O-N 3.07Å; I95-C98 WeakPolarHBondContact O-CA 3.5Å; I95-C98 WeakPolarHBondContact O-CB 3.5Å; I95-C98 PolarHBondContact O-N 3.36Å; I95-E99 PolarHBondContact O-N 2.89Å; I95-V109 HydrophobicContact CG1-CG1 4.46Å; I95-V109 HydrophobicContact CG2-CG2 4.16Å; I95-V112 HydrophobicContact CG1-CG1 4.16Å
96	D	75.7	Confident	71.4	Confident	87 Å²	87	78.6 Å²	78.6	47%	0.465	39%	0.389	S	S	.	.	H	α-helix	trans	-60.6	-40.5	174.8	-67.9	-16	0	0	0	111.1	E92 L94 C98 E99 Y100	E92-D96 VanDerWaalsContact O-CG 3.31Å; E92-D96 PolarHBondContact O-N 3.32Å; L94-D96 VanDerWaalsContact C-N 3.35Å; D96-C98 VanDerWaalsContact C-N 3.26Å; D96-C98 PolarHBondContact O-N 3.21Å; D96-E99 WeakPolarHBondContact O-CB 3.44Å; D96-E99 PolarHBondContact O-N 3.49Å; D96-Y100 VanDerWaalsContact O-CD2 3.28Å; D96-Y100 WeakPolarHBondContact O-CD2 3.37Å; D96-Y100 WeakPolarHBondContact O-CE2 3.04Å
97	I	69.7	Low	71.3	Confident	64 Å²	64	79 Å²	79	33%	0.328	39%	0.392	S	S	.	.	H	α-helix	trans	-62.6	-36.8	173.5	-67.9	165.2	0	0	0	110.8	M10 K93 L94 I95 E99 Y100 I101	M10-I97 HydrophobicContact SD-CG2 3.67Å; K93-I97 WeakPolarHBondContact O-CG1 3.43Å; K93-I97 PolarHBondContact O-N 2.83Å; K93-I97 VanDerWaalsContact O-N 3.15Å; L94-I97 HydrophobicContact CD2-CD1 4.39Å; L94-I97 WeakPolarHBondContact O-CB 3.21Å; L94-I97 PolarHBondContact O-N 3.11Å; I95-I97 VanDerWaalsContact C-N 3.29Å; I95-I97 PolarHBondContact O-N 3.07Å; I97-E99 PolarHBondContact O-N 2.77Å; I97-E99 VanDerWaalsContact O-N 3.16Å; I97-Y100 PolarHBondContact O-N 2.02Å; I97-Y100 VanDerWaalsContact O-N 3.09Å; I97-I101 WeakPolarHBondContact O-CG1 3.33Å
98	C	67.8	Low	71.3	Confident	0 Å²	0	78.6 Å²	78.6	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-60.1	-24.5	177.9	-64.6	0	0	0	0	113.4	L94 I95 D96 Y100 I101 C108 V109	L94-C98 PolarHBondContact O-N 2.94Å; L94-C98 PolarHBondContact O-SG 3.42Å; I95-C98 WeakPolarHBondContact O-CA 3.5Å; I95-C98 WeakPolarHBondContact O-CB 3.5Å; I95-C98 PolarHBondContact O-N 3.36Å; D96-C98 VanDerWaalsContact C-N 3.26Å; D96-C98 PolarHBondContact O-N 3.21Å; C98-Y100 VanDerWaalsContact C-N 3.29Å; C98-Y100 PolarHBondContact O-N 2.87Å; C98-I101 HydrophobicContact CB-CD1 4.44Å; C98-I101 PolarHBondContact O-N 2.86Å; C98-C108 VanDerWaalsContact CA-SG 3.51Å; C98-C108 HydrophobicContact CB-CB 3.52Å; C98-C108 WeakPolarHBondContact CB-SG 3.17Å; C98-C108 WeakPolarHBondContact SG-CB 3.46Å; C98-C108 CovalentContact SG-SG 2.03Å; C98-C108 PolarHBondContact SG-SG 3.45Å; C98-V109 HydrophobicContact CB-CG2 3.73Å; C98-V109 PolarHBondContact SG-N 3.47Å
99	E	75.2	Confident	71.5	Confident	100 Å²	100	74.5 Å²	74.5	47%	0.467	37%	0.374	S	S	.	.	H	α-helix	trans	-66.3	-31.7	177	-54.5	-156	136.2	0	0	112.5	I95 D96 I97 I101 R105	I95-E99 PolarHBondContact O-N 2.89Å; D96-E99 WeakPolarHBondContact O-CB 3.44Å; D96-E99 PolarHBondContact O-N 3.49Å; I97-E99 PolarHBondContact O-N 2.77Å; I97-E99 VanDerWaalsContact O-N 3.16Å; E99-I101 PolarHBondContact O-N 2.96Å; E99-R105 IonicContact OE1-CZ 2.74Å; E99-R105 IonicContact OE1-NE 2.84Å; E99-R105 IonicContact OE1-NH2 3.68Å; E99-R105 PolarHBondContact OE1-NH2 2.99Å
100	Y	72.4	Confident	71.6	Confident	207 Å²	207	74.1 Å²	74.1	81%	0.812	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-7.7	179.5	-63.4	-85.1	0	0	0	113.5	D96 I97 C98 G102	D96-Y100 VanDerWaalsContact O-CD2 3.28Å; D96-Y100 WeakPolarHBondContact O-CD2 3.37Å; D96-Y100 WeakPolarHBondContact O-CE2 3.04Å; I97-Y100 PolarHBondContact O-N 2.02Å; I97-Y100 VanDerWaalsContact O-N 3.09Å; C98-Y100 VanDerWaalsContact C-N 3.29Å; C98-Y100 PolarHBondContact O-N 2.87Å; Y100-G102 VanDerWaalsContact C-N 3.26Å; Y100-G102 PolarHBondContact O-N 2.03Å
101	I	62.9	Low	71.4	Confident	23 Å²	23	72.8 Å²	72.8	12%	0.118	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	6.7	-175.8	-45.2	177.5	0	0	0	111.7	T6 M10 I97 C98 E99 P103 F104 C108	T6-I101 HydrophobicContact CG2-CD1 4.49Å; T6-I101 HydrophobicContact CG2-CG2 3.05Å; M10-I101 HydrophobicContact CE-CD1 3.28Å; M10-I101 HydrophobicContact CE-CG1 4.22Å; M10-I101 HydrophobicContact CG-CD1 4.44Å; M10-I101 HydrophobicContact CG-CG1 4.44Å; M10-I101 HydrophobicContact SD-CD1 3.36Å; M10-I101 WeakPolarHBondContact SD-CD1 3Å; M10-I101 HydrophobicContact SD-CG1 3.83Å; I97-I101 WeakPolarHBondContact O-CG1 3.33Å; C98-I101 HydrophobicContact CB-CD1 4.44Å; C98-I101 PolarHBondContact O-N 2.86Å; E99-I101 PolarHBondContact O-N 2.96Å; I101-P103 WeakPolarHBondContact O-CD 3.32Å; I101-F104 HydrophobicContact CG2-CB 3.77Å; I101-F104 HydrophobicContact CG2-CD2 4.49Å; I101-F104 PolarHBondContact O-N 3.45Å; I101-C108 HydrophobicContact CD1-CB 3.74Å; I101-C108 WeakPolarHBondContact CD1-SG 3.25Å
102	G	68.9	Low	71.4	Confident	44 Å²	44	70.5 Å²	70.5	45%	0.454	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	57.4	-122.6	173.2	0	0	0	0	0	112.5	Y100 F104 R105	Y100-G102 VanDerWaalsContact C-N 3.26Å; Y100-G102 PolarHBondContact O-N 2.03Å; G102-F104 PolarHBondContact O-N 3.06Å; G102-R105 WeakPolarHBondContact O-CB 3.35Å; G102-R105 PolarHBondContact O-N 3.39Å
103	P	75.6	Confident	71.3	Confident	122 Å²	122	67.4 Å²	67.4	79%	0.792	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-65.8	-10.9	-172	28.9	-35.9	0	0	0	114.4	I101	I101-P103 WeakPolarHBondContact O-CD 3.32Å
104	F	70.3	Confident	71.1	Confident	51 Å²	51	68.3 Å²	68.3	22%	0.224	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-95.3	3.7	177.5	-62.1	-81.4	0	0	0	113.6	M1 T6 I101 G102 D106 Q107 C108	M1-F104 HydrophobicContact CE-CD1 4.38Å; M1-F104 HydrophobicContact CE-CE1 3.3Å; M1-F104 HydrophobicContact CE-CZ 3.62Å; M1-F104 HydrophobicContact CG-CE1 4.22Å; M1-F104 HydrophobicContact CG-CZ 4.48Å; M1-F104 HydrophobicContact SD-CE1 4.45Å; T6-F104 HydrophobicContact CG2-CB 4.03Å; T6-F104 HydrophobicContact CG2-CD2 4.37Å; T6-F104 HydrophobicContact CG2-CG 4.2Å; I101-F104 HydrophobicContact CG2-CB 3.77Å; I101-F104 HydrophobicContact CG2-CD2 4.49Å; I101-F104 PolarHBondContact O-N 3.45Å; G102-F104 PolarHBondContact O-N 3.06Å; F104-D106 VanDerWaalsContact C-N 3.33Å; F104-D106 PolarHBondContact O-N 2.92Å; F104-Q107 PolarHBondContact O-N 3.32Å; F104-C108 PolarHBondContact O-N 3.09Å
105	R	70.1	Confident	70.9	Confident	111 Å²	111	70.6 Å²	70.6	42%	0.419	37%	0.368	S	S	.	.	H	α-helix	trans	-46.6	-53.8	-177.5	-179.3	-178.3	-177.8	-135	9.3	112.1	E99 G102 Q107 C108 V109	E99-R105 IonicContact OE1-CZ 2.74Å; E99-R105 IonicContact OE1-NE 2.84Å; E99-R105 IonicContact OE1-NH2 3.68Å; E99-R105 PolarHBondContact OE1-NH2 2.99Å; G102-R105 WeakPolarHBondContact O-CB 3.35Å; G102-R105 PolarHBondContact O-N 3.39Å; R105-Q107 VanDerWaalsContact C-N 3.28Å; R105-Q107 PolarHBondContact O-N 2.77Å; R105-C108 WeakPolarHBondContact O-CB 3.49Å; R105-C108 PolarHBondContact O-N 3.28Å; R105-C108 VanDerWaalsContact O-N 3.1Å; R105-V109 HydrophobicContact CG-CG2 4.31Å; R105-V109 WeakPolarHBondContact O-CG2 3.36Å; R105-V109 PolarHBondContact O-N 3.34Å
106	D	75	Confident	70.3	Confident	123 Å²	123	69.9 Å²	69.9	66%	0.658	36%	0.364	S	S	*	.	H	α-helix	trans	-62.3	-36.5	-176	-60.8	-19.4	0	0	0	112.5	F104 A110	F104-D106 VanDerWaalsContact C-N 3.33Å; F104-D106 PolarHBondContact O-N 2.92Å; D106-A110 VanDerWaalsContact O-CB 3.23Å; D106-A110 WeakPolarHBondContact O-CB 3.47Å; D106-A110 PolarHBondContact O-N 2.81Å
107	Q	67.5	Low	69.8	Low	105 Å²	105	66.4 Å²	66.4	49%	0.491	34%	0.344	S	S	.	.	H	α-helix	trans	-72.5	-37	178.1	-64.5	164.2	24.5	0	0	111.1	F104 R105 L111	F104-Q107 PolarHBondContact O-N 3.32Å; R105-Q107 VanDerWaalsContact C-N 3.28Å; R105-Q107 PolarHBondContact O-N 2.77Å; Q107-L111 VanDerWaalsContact O-CB 3.25Å; Q107-L111 WeakPolarHBondContact O-CB 3.02Å; Q107-L111 PolarHBondContact O-N 3.31Å
108	C	67.6	Low	69.6	Low	11 Å²	11	71.2 Å²	71.2	7%	0.074	36%	0.363	C	S	.	.	H	α-helix	trans	-66.1	-48.4	173.6	-179.7	0	0	0	0	111.3	C98 I101 F104 R105 A110 L111 V112	C98-C108 VanDerWaalsContact CA-SG 3.51Å; C98-C108 HydrophobicContact CB-CB 3.52Å; C98-C108 WeakPolarHBondContact CB-SG 3.17Å; C98-C108 WeakPolarHBondContact SG-CB 3.46Å; C98-C108 CovalentContact SG-SG 2.03Å; C98-C108 PolarHBondContact SG-SG 3.45Å; I101-C108 HydrophobicContact CD1-CB 3.74Å; I101-C108 WeakPolarHBondContact CD1-SG 3.25Å; F104-C108 PolarHBondContact O-N 3.09Å; R105-C108 WeakPolarHBondContact O-CB 3.49Å; R105-C108 PolarHBondContact O-N 3.28Å; R105-C108 VanDerWaalsContact O-N 3.1Å; C108-A110 VanDerWaalsContact C-N 3.32Å; C108-A110 PolarHBondContact O-N 3.3Å; C108-L111 WeakPolarHBondContact O-CB 3.49Å; C108-L111 PolarHBondContact O-N 2.91Å; C108-L111 VanDerWaalsContact O-N 3.11Å; C108-V112 WeakPolarHBondContact O-CG2 3.06Å; C108-V112 PolarHBondContact O-N 2.93Å
109	V	75.4	Confident	69.3	Low	39 Å²	39	73 Å²	73	24%	0.236	38%	0.378	C	S	.	.	H	α-helix	trans	-60.4	-44.2	178.6	174.1	0	0	0	0	110.6	I95 C98 R105 L111 V112 T113	I95-V109 HydrophobicContact CG1-CG1 4.46Å; I95-V109 HydrophobicContact CG2-CG2 4.16Å; C98-V109 HydrophobicContact CB-CG2 3.73Å; C98-V109 PolarHBondContact SG-N 3.47Å; R105-V109 HydrophobicContact CG-CG2 4.31Å; R105-V109 WeakPolarHBondContact O-CG2 3.36Å; R105-V109 PolarHBondContact O-N 3.34Å; V109-L111 VanDerWaalsContact C-N 3.33Å; V109-L111 PolarHBondContact O-N 3.41Å; V109-V112 PolarHBondContact O-N 3.05Å; V109-T113 WeakPolarHBondContact O-CB 3.36Å; V109-T113 PolarHBondContact O-N 3.24Å; V109-T113 PolarHBondContact O-OG1 3.16Å
110	A	74.6	Confident	68.6	Low	43 Å²	43	68.8 Å²	68.8	36%	0.355	36%	0.358	S	S	.	.	H	α-helix	trans	-62.4	-40.4	175.5	0	0	0	0	0	112.2	D106 C108 F114	D106-A110 VanDerWaalsContact O-CB 3.23Å; D106-A110 WeakPolarHBondContact O-CB 3.47Å; D106-A110 PolarHBondContact O-N 2.81Å; C108-A110 VanDerWaalsContact C-N 3.32Å; C108-A110 PolarHBondContact O-N 3.3Å; A110-F114 WeakPolarHBondContact O-CB 2.99Å; A110-F114 PolarHBondContact O-N 3.12Å
111	L	67	Low	68.1	Low	34 Å²	34	62.5 Å²	62.5	18%	0.178	34%	0.339	C	S	.	.	I	π-helix	trans	-65.7	-49	177.9	-171.7	76.1	0	0	0	111.4	I3 F7 Q107 C108 V109 T115 M116	I3-L111 HydrophobicContact CD1-CD1 4.49Å; I3-L111 HydrophobicContact CG2-CD2 3.98Å; F7-L111 HydrophobicContact CE2-CD2 3.39Å; F7-L111 HydrophobicContact CZ-CD2 3.68Å; Q107-L111 VanDerWaalsContact O-CB 3.25Å; Q107-L111 WeakPolarHBondContact O-CB 3.02Å; Q107-L111 PolarHBondContact O-N 3.31Å; C108-L111 WeakPolarHBondContact O-CB 3.49Å; C108-L111 PolarHBondContact O-N 2.91Å; C108-L111 VanDerWaalsContact O-N 3.11Å; V109-L111 VanDerWaalsContact C-N 3.33Å; V109-L111 PolarHBondContact O-N 3.41Å; L111-T115 HydrophobicContact CD1-CG2 3.85Å; L111-T115 CarbonylContact O-C 3.56Å; L111-T115 WeakPolarHBondContact O-CA 3.32Å; L111-T115 WeakPolarHBondContact O-CB 3.45Å; L111-T115 PolarHBondContact O-N 2.7Å; L111-M116 WeakPolarHBondContact O-CB 3.29Å; L111-M116 PolarHBondContact O-N 2.97Å
112	V	69.5	Low	68.2	Low	4 Å²	4	68.2 Å²	68.2	2%	0.024	36%	0.363	C	S	.	.	I	π-helix	trans	-58.7	-51.6	177.9	170.8	0	0	0	0	109.9	Q91 L94 I95 C108 V109 M116 F117	Q91-V112 HydrophobicContact CG-CG1 4.27Å; L94-V112 HydrophobicContact CB-CB 4.5Å; L94-V112 HydrophobicContact CB-CG1 3.63Å; L94-V112 HydrophobicContact CB-CG2 4Å; L94-V112 HydrophobicContact CD1-CG1 4.08Å; I95-V112 HydrophobicContact CG1-CG1 4.16Å; C108-V112 WeakPolarHBondContact O-CG2 3.06Å; C108-V112 PolarHBondContact O-N 2.93Å; V109-V112 PolarHBondContact O-N 3.05Å; V112-M116 HydrophobicContact CG2-SD 4.47Å; V112-F117 HydrophobicContact CG1-CE2 3.96Å; V112-F117 WeakPolarHBondContact O-CD2 3.4Å; V112-F117 WeakPolarHBondContact O-CE2 3.28Å
113	T	73	Confident	67.8	Low	46 Å²	46	68.5 Å²	68.5	28%	0.282	36%	0.358	S	S	.	.	I	π-helix	trans	-68.2	-48.2	-173.7	-55.2	0	0	0	0	112.8	V109	V109-T113 WeakPolarHBondContact O-CB 3.36Å; V109-T113 PolarHBondContact O-N 3.24Å; V109-T113 PolarHBondContact O-OG1 3.16Å
114	F	68.9	Low	67.3	Low	150 Å²	150	63.9 Å²	63.9	66%	0.658	33%	0.326	S	S	*	.	I	π-helix	trans	-101.2	-32.4	-169.6	-66.6	-70.4	0	0	0	114.3	A110	A110-F114 WeakPolarHBondContact O-CB 2.99Å; A110-F114 PolarHBondContact O-N 3.12Å
115	T	65.8	Low	67.1	Low	76 Å²	76	66 Å²	66	47%	0.466	35%	0.348	S	S	.	.	I	π-helix	trans	-103.9	-48.1	-167.7	-53	0	0	0	0	111.7	L111 K118 A119	L111-T115 HydrophobicContact CD1-CG2 3.85Å; L111-T115 CarbonylContact O-C 3.56Å; L111-T115 WeakPolarHBondContact O-CA 3.32Å; L111-T115 WeakPolarHBondContact O-CB 3.45Å; L111-T115 PolarHBondContact O-N 2.7Å; T115-K118 PolarHBondContact O-N 2.95Å; T115-A119 WeakPolarHBondContact O-CB 3.45Å; T115-A119 PolarHBondContact O-N 2.8Å
116	M	63.2	Low	67	Low	27 Å²	27	68.8 Å²	68.8	13%	0.133	36%	0.363	C	S	.	.	I	π-helix	trans	-65	-50.8	-171.5	-172	169.6	178.8	0	0	111.1	L32 L94 L111 V112 K118 A119 I120	L32-M116 HydrophobicContact CD2-CE 4.07Å; L94-M116 HydrophobicContact CD1-CE 3.96Å; L94-M116 HydrophobicContact CD1-SD 3.85Å; L111-M116 WeakPolarHBondContact O-CB 3.29Å; L111-M116 PolarHBondContact O-N 2.97Å; V112-M116 HydrophobicContact CG2-SD 4.47Å; M116-K118 PolarHBondContact O-N 3.13Å; M116-A119 PolarHBondContact O-N 3.19Å; M116-I120 HydrophobicContact CE-CD1 3.87Å; M116-I120 HydrophobicContact CG-CD1 3.53Å; M116-I120 HydrophobicContact CG-CG1 4.35Å; M116-I120 WeakPolarHBondContact O-CB 3.2Å; M116-I120 WeakPolarHBondContact O-CG1 3.37Å; M116-I120 PolarHBondContact O-N 2.89Å
117	F	65	Low	66.6	Low	14 Å²	14	65.3 Å²	65.3	6%	0.061	34%	0.343	C	S	.	.	H	α-helix	trans	-65.6	-40.4	179	-71.7	-64.5	0	0	0	113.5	F81 L87 F90 Q91 L94 V112 A119 I120 N121	F81-F117 HydrophobicContact CD1-CD1 4.36Å; F81-F117 AromaticContact CE1-CD1 3.75Å; F81-F117 HydrophobicContact CE1-CD1 3.75Å; F81-F117 AromaticContact CE1-CE1 3.79Å; F81-F117 HydrophobicContact CE1-CE1 3.79Å; L87-F117 HydrophobicContact CD1-CD1 3.49Å; L87-F117 VanDerWaalsContact CD1-CD1 3.49Å; L87-F117 HydrophobicContact CD1-CE1 3.25Å; L87-F117 HydrophobicContact CD1-CZ 4.3Å; L87-F117 HydrophobicContact CD2-CD1 4.28Å; L87-F117 HydrophobicContact CG-CD1 4Å; L87-F117 HydrophobicContact CG-CE1 3.9Å; F90-F117 HydrophobicContact CD1-CE1 4.09Å; F90-F117 HydrophobicContact CD1-CZ 4.09Å; Q91-F117 HydrophobicContact CB-CE2 3.48Å; Q91-F117 VanDerWaalsContact CB-CE2 3.48Å; Q91-F117 HydrophobicContact CB-CZ 3.57Å; Q91-F117 HydrophobicContact CG-CD2 4.47Å; Q91-F117 HydrophobicContact CG-CE2 3.6Å; Q91-F117 HydrophobicContact CG-CZ 4.23Å; L94-F117 HydrophobicContact CD1-CZ 4.37Å; V112-F117 HydrophobicContact CG1-CE2 3.96Å; V112-F117 WeakPolarHBondContact O-CD2 3.4Å; V112-F117 WeakPolarHBondContact O-CE2 3.28Å; F117-A119 VanDerWaalsContact C-N 3.35Å; F117-A119 PolarHBondContact O-N 3.1Å; F117-I120 PolarHBondContact O-N 2.99Å; F117-N121 WeakPolarHBondContact O-CB 3.3Å; F117-N121 PolarHBondContact O-N 3.22Å
118	K	66	Low	66.8	Low	166 Å²	166	63.9 Å²	63.9	72%	0.722	34%	0.339	S	S	*	.	H	α-helix	trans	-64.2	-41.8	176.5	-171.3	175.4	-177.5	176.4	0	111.5	T115 M116 K122	T115-K118 PolarHBondContact O-N 2.95Å; M116-K118 PolarHBondContact O-N 3.13Å; K118-K122 VanDerWaalsContact O-CB 3.3Å; K118-K122 WeakPolarHBondContact O-CB 3.13Å; K118-K122 PolarHBondContact O-N 3.17Å
119	A	62.4	Low	66.9	Low	38 Å²	38	64.4 Å²	64.4	31%	0.314	34%	0.342	S	S	.	.	H	α-helix	trans	-66.1	-44.5	175.3	0	0	0	0	0	111	T115 M116 F117 K122 S123	T115-A119 WeakPolarHBondContact O-CB 3.45Å; T115-A119 PolarHBondContact O-N 2.8Å; M116-A119 PolarHBondContact O-N 3.19Å; F117-A119 VanDerWaalsContact C-N 3.35Å; F117-A119 PolarHBondContact O-N 3.1Å; A119-K122 PolarHBondContact O-N 3.44Å; A119-S123 VanDerWaalsContact O-CB 3.26Å; A119-S123 WeakPolarHBondContact O-CB 3.33Å; A119-S123 PolarHBondContact O-N 3.42Å; A119-S123 PolarHBondContact O-OG 3.01Å
120	I	60.5	Low	66.8	Low	11 Å²	11	64.8 Å²	64.8	6%	0.056	35%	0.347	C	S	.	.	H	α-helix	trans	-68.1	-45.9	-178.3	-67	168.2	0	0	0	111.4	C35 F81 M116 F117 K122 S123 I124	C35-I120 HydrophobicContact CB-CG1 4.48Å; F81-I120 HydrophobicContact CD1-CB 4.44Å; F81-I120 HydrophobicContact CD1-CG2 3.64Å; F81-I120 HydrophobicContact CD2-CG2 3.96Å; F81-I120 HydrophobicContact CE1-CB 3.91Å; F81-I120 HydrophobicContact CE1-CD1 3.95Å; F81-I120 HydrophobicContact CE1-CG2 3.32Å; F81-I120 HydrophobicContact CE2-CG2 3.69Å; F81-I120 HydrophobicContact CG-CG2 3.99Å; F81-I120 HydrophobicContact CZ-CB 4.2Å; F81-I120 HydrophobicContact CZ-CD1 3.7Å; F81-I120 HydrophobicContact CZ-CG1 4.47Å; F81-I120 HydrophobicContact CZ-CG2 3.39Å; M116-I120 HydrophobicContact CE-CD1 3.87Å; M116-I120 HydrophobicContact CG-CD1 3.53Å; M116-I120 HydrophobicContact CG-CG1 4.35Å; M116-I120 WeakPolarHBondContact O-CB 3.2Å; M116-I120 WeakPolarHBondContact O-CG1 3.37Å; M116-I120 PolarHBondContact O-N 2.89Å; F117-I120 PolarHBondContact O-N 2.99Å; I120-K122 VanDerWaalsContact C-N 3.27Å; I120-K122 PolarHBondContact O-N 3.06Å; I120-S123 CarbonylContact O-C 3.58Å; I120-S123 PolarHBondContact O-N 2.85Å; I120-S123 VanDerWaalsContact O-N 3.09Å; I120-I124 HydrophobicContact CG2-CD1 3.24Å; I120-I124 HydrophobicContact CG2-CG1 3.74Å; I120-I124 WeakPolarHBondContact O-CB 3.01Å; I120-I124 WeakPolarHBondContact O-CG1 3.42Å; I120-I124 PolarHBondContact O-N 3.24Å
121	N	61	Low	66.8	Low	75 Å²	75	68.1 Å²	68.1	40%	0.401	36%	0.358	S	S	.	.	H	α-helix	trans	-60.5	-38.8	176.5	-79.4	-8.5	0	0	0	112.1	F117 S125	F117-N121 WeakPolarHBondContact O-CB 3.3Å; F117-N121 PolarHBondContact O-N 3.22Å; N121-S125 PolarHBondContact O-N 2.99Å; N121-S125 PolarHBondContact O-OG 3.45Å
122	K	64.4	Low	66.9	Low	142 Å²	142	67.4 Å²	67.4	62%	0.617	36%	0.355	S	S	*	.	H	α-helix	trans	-69.6	-34.2	175.7	-172.9	177.6	-179.6	-178.1	0	112.5	K118 A119 I120 S125	K118-K122 VanDerWaalsContact O-CB 3.3Å; K118-K122 WeakPolarHBondContact O-CB 3.13Å; K118-K122 PolarHBondContact O-N 3.17Å; A119-K122 PolarHBondContact O-N 3.44Å; I120-K122 VanDerWaalsContact C-N 3.27Å; I120-K122 PolarHBondContact O-N 3.06Å; K122-S125 PolarHBondContact O-OG 3.27Å; K122-S125 VanDerWaalsContact O-OG 3.08Å
123	S	62.2	Low	66.9	Low	51 Å²	51	67.2 Å²	67.2	36%	0.357	35%	0.354	S	S	.	.	H	α-helix	trans	-77.5	-47.4	179.1	-67.5	0	0	0	0	111.2	A119 I120 S125 K126 I127	A119-S123 VanDerWaalsContact O-CB 3.26Å; A119-S123 WeakPolarHBondContact O-CB 3.33Å; A119-S123 PolarHBondContact O-N 3.42Å; A119-S123 PolarHBondContact O-OG 3.01Å; I120-S123 CarbonylContact O-C 3.58Å; I120-S123 PolarHBondContact O-N 2.85Å; I120-S123 VanDerWaalsContact O-N 3.09Å; S123-S125 VanDerWaalsContact C-N 3.31Å; S123-S125 PolarHBondContact O-N 3.1Å; S123-K126 CarbonylContact O-C 3.45Å; S123-K126 WeakPolarHBondContact O-CA 2.97Å; S123-K126 PolarHBondContact O-N 2.92Å; S123-I127 WeakPolarHBondContact O-CB 3.34Å; S123-I127 WeakPolarHBondContact O-CD1 3.28Å; S123-I127 WeakPolarHBondContact O-CG1 3Å; S123-I127 PolarHBondContact O-N 3.17Å
124	I	64.1	Low	66.7	Low	25 Å²	25	67.6 Å²	67.6	13%	0.128	35%	0.353	C	S	.	.	H	α-helix	trans	-59.1	-40.9	-179	-72.7	176.8	0	0	0	111.7	I77 M78 F81 I120 K126 I127	I77-I124 HydrophobicContact CG2-CD1 3.77Å; I77-I124 HydrophobicContact CG2-CG1 4.5Å; M78-I124 HydrophobicContact CG-CG2 3.71Å; F81-I124 HydrophobicContact CB-CD1 3.68Å; F81-I124 HydrophobicContact CD1-CD1 4.14Å; F81-I124 HydrophobicContact CD2-CD1 3.14Å; F81-I124 HydrophobicContact CE2-CD1 3.86Å; F81-I124 HydrophobicContact CG-CD1 3.36Å; I120-I124 HydrophobicContact CG2-CD1 3.24Å; I120-I124 HydrophobicContact CG2-CG1 3.74Å; I120-I124 WeakPolarHBondContact O-CB 3.01Å; I120-I124 WeakPolarHBondContact O-CG1 3.42Å; I120-I124 PolarHBondContact O-N 3.24Å; I124-K126 PolarHBondContact O-N 3.49Å; I124-K126 VanDerWaalsContact O-N 3.11Å; I124-I127 PolarHBondContact O-N 2.88Å
125	S	66.6	Low	66.5	Low	96 Å²	96	62.2 Å²	62.2	67%	0.671	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-16.4	176	50.2	0	0	0	0	113.9	N121 K122 S123	N121-S125 PolarHBondContact O-N 2.99Å; N121-S125 PolarHBondContact O-OG 3.45Å; K122-S125 PolarHBondContact O-OG 3.27Å; K122-S125 VanDerWaalsContact O-OG 3.08Å; S123-S125 VanDerWaalsContact C-N 3.31Å; S123-S125 PolarHBondContact O-N 3.1Å
126	K	67.6	Low	66.4	Low	169 Å²	169	60.1 Å²	60.1	74%	0.735	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.7	-12.5	178.1	-63.3	-173.5	177	-164.1	0	113.8	S123 I124 D128	S123-K126 CarbonylContact O-C 3.45Å; S123-K126 WeakPolarHBondContact O-CA 2.97Å; S123-K126 PolarHBondContact O-N 2.92Å; I124-K126 PolarHBondContact O-N 3.49Å; I124-K126 VanDerWaalsContact O-N 3.11Å; K126-D128 PolarHBondContact O-N 3.32Å
127	I	67.1	Low	66.4	Low	49 Å²	49	63.9 Å²	63.9	25%	0.251	34%	0.337	S	S	.	.			trans	-80.7	115.2	-178.5	-78.6	163.8	0	0	0	107.5	Y74 S123 I124 P129 S132	Y74-I127 HydrophobicContact CD1-CG2 3.93Å; Y74-I127 HydrophobicContact CE1-CG2 3.72Å; S123-I127 WeakPolarHBondContact O-CB 3.34Å; S123-I127 WeakPolarHBondContact O-CD1 3.28Å; S123-I127 WeakPolarHBondContact O-CG1 3Å; S123-I127 PolarHBondContact O-N 3.17Å; I124-I127 PolarHBondContact O-N 2.88Å; I127-P129 WeakPolarHBondContact O-CD 3.36Å; I127-S132 WeakPolarHBondContact CG2-OG 3Å
128	D	71	Confident	66.3	Low	75 Å²	75	64.5 Å²	64.5	40%	0.401	34%	0.34	S	S	.	.			trans	-83.9	117.9	161.3	-174.5	-43.9	0	0	0	107.8	K126 S130 I131 S132	K126-D128 PolarHBondContact O-N 3.32Å; D128-S130 PolarHBondContact O-N 3.13Å; D128-S130 WeakPolarHBondContact OD1-CA 3.5Å; D128-S130 VanDerWaalsContact OD1-CB 3.28Å; D128-S130 WeakPolarHBondContact OD1-CB 3.4Å; D128-S130 PolarHBondContact OD1-N 3.27Å; D128-I131 HydrophobicContact CB-CB 3.96Å; D128-I131 HydrophobicContact CB-CD1 3.7Å; D128-I131 HydrophobicContact CB-CG1 3.75Å; D128-I131 PolarHBondContact O-N 2.82Å; D128-I131 PolarHBondContact OD1-N 2.88Å; D128-S132 WeakPolarHBondContact O-CB 3.32Å; D128-S132 PolarHBondContact O-N 3.44Å; D128-S132 PolarHBondContact O-OG 3.27Å
129	P	70.5	Confident	66.3	Low	22 Å²	22	56.9 Å²	56.9	14%	0.143	31%	0.308	C	S	.	.	H	α-helix	trans	-55.9	-37.3	178.3	-28.3	37.1	0	0	0	113.2	L71 Y74 M78 I127 C133	L71-P129 HydrophobicContact CD2-CB 3.71Å; Y74-P129 HydrophobicContact CD2-CB 4.14Å; Y74-P129 HydrophobicContact CG-CB 4Å; Y74-P129 HydrophobicContact CG-CG 4.39Å; M78-P129 HydrophobicContact SD-CG 3.94Å; I127-P129 WeakPolarHBondContact O-CD 3.36Å; P129-C133 VanDerWaalsContact O-CB 3.29Å; P129-C133 WeakPolarHBondContact O-CB 3.44Å; P129-C133 PolarHBondContact O-N 3.04Å; P129-C133 PolarHBondContact O-SG 3.13Å
130	S	73.6	Confident	66.4	Low	47 Å²	47	63.6 Å²	63.6	33%	0.329	33%	0.327	S	S	.	.	H	α-helix	trans	-67.8	-50.4	180	-161.2	0	0	0	0	110.4	D128 S132 C133 E134	D128-S130 PolarHBondContact O-N 3.13Å; D128-S130 WeakPolarHBondContact OD1-CA 3.5Å; D128-S130 VanDerWaalsContact OD1-CB 3.28Å; D128-S130 WeakPolarHBondContact OD1-CB 3.4Å; D128-S130 PolarHBondContact OD1-N 3.27Å; S130-S132 VanDerWaalsContact C-N 3.26Å; S130-S132 PolarHBondContact O-N 3.22Å; S130-C133 PolarHBondContact O-N 3.26Å; S130-E134 WeakPolarHBondContact O-CB 3.21Å; S130-E134 VanDerWaalsContact O-CG 3.28Å; S130-E134 WeakPolarHBondContact O-CG 3.37Å; S130-E134 PolarHBondContact O-N 3.13Å; S130-E134 PolarHBondContact OG-OE1 3.45Å
131	I	72.9	Confident	66.2	Low	113 Å²	113	71.2 Å²	71.2	58%	0.579	36%	0.355	S	S	*	.	H	α-helix	trans	-60.6	-40.3	179	-59.3	179.3	0	0	0	110.4	D128 G135	D128-I131 HydrophobicContact CB-CB 3.96Å; D128-I131 HydrophobicContact CB-CD1 3.7Å; D128-I131 HydrophobicContact CB-CG1 3.75Å; D128-I131 PolarHBondContact O-N 2.82Å; D128-I131 PolarHBondContact OD1-N 2.88Å; I131-G135 PolarHBondContact O-N 3.35Å
132	S	70.4	Confident	65.6	Low	19 Å²	19	80 Å²	80	13%	0.133	39%	0.389	C	S	.	.	H	α-helix	trans	-67.8	-49.1	180	-58.4	0	0	0	0	111.3	Y74 I127 D128 S130 E134 G135 W136	Y74-S132 VanDerWaalsContact OH-CB 3.3Å; Y74-S132 WeakPolarHBondContact OH-CB 3.39Å; I127-S132 WeakPolarHBondContact CG2-OG 3Å; D128-S132 WeakPolarHBondContact O-CB 3.32Å; D128-S132 PolarHBondContact O-N 3.44Å; D128-S132 PolarHBondContact O-OG 3.27Å; S130-S132 VanDerWaalsContact C-N 3.26Å; S130-S132 PolarHBondContact O-N 3.22Å; S132-E134 VanDerWaalsContact C-N 3.3Å; S132-E134 PolarHBondContact O-N 3.27Å; S132-G135 PolarHBondContact O-N 3.49Å; S132-G135 VanDerWaalsContact O-N 3.09Å; S132-W136 PolarHBondContact O-N 3.15Å
133	C	68.2	Low	65.7	Low	0 Å²	0	76.9 Å²	76.9	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-63.1	-35.5	177.6	-65	0	0	0	0	112.8	C70 Y74 P129 S130 W136 Y137 L138 C139	C70-C133 HydrophobicContact CB-CB 3.87Å; C70-C133 WeakPolarHBondContact CB-SG 3.39Å; C70-C133 WeakPolarHBondContact SG-CA 3.46Å; C70-C133 WeakPolarHBondContact SG-CB 3.22Å; C70-C133 CovalentContact SG-SG 2.02Å; C70-C133 PolarHBondContact SG-SG 2.92Å; Y74-C133 VanDerWaalsContact CD2-SG 3.59Å; P129-C133 VanDerWaalsContact O-CB 3.29Å; P129-C133 WeakPolarHBondContact O-CB 3.44Å; P129-C133 PolarHBondContact O-N 3.04Å; P129-C133 PolarHBondContact O-SG 3.13Å; S130-C133 PolarHBondContact O-N 3.26Å; C133-W136 PolarHBondContact O-N 3.43Å; C133-Y137 PolarHBondContact O-N 3.04Å; C133-L138 WeakPolarHBondContact O-CB 3.32Å; C133-L138 PolarHBondContact O-N 2.91Å; C133-C139 HydrophobicContact CB-CB 4.22Å; C133-C139 WeakPolarHBondContact CB-SG 3.3Å; C133-C139 PolarHBondContact O-N 3.25Å
134	E	69.4	Low	65.8	Low	54 Å²	54	78.3 Å²	78.3	25%	0.252	38%	0.379	S	S	.	.	H	α-helix	trans	-65.9	-40	171.2	-74.9	175	-152.4	0	0	112	S130 S132 W136 Y137 C139	S130-E134 WeakPolarHBondContact O-CB 3.21Å; S130-E134 VanDerWaalsContact O-CG 3.28Å; S130-E134 WeakPolarHBondContact O-CG 3.37Å; S130-E134 PolarHBondContact O-N 3.13Å; S130-E134 PolarHBondContact OG-OE1 3.45Å; S132-E134 VanDerWaalsContact C-N 3.3Å; S132-E134 PolarHBondContact O-N 3.27Å; E134-W136 PolarHBondContact O-N 3.23Å; E134-Y137 PolarHBondContact O-N 3.25Å; E134-C139 HydrophobicContact CG-CB 3.8Å
135	G	65	Low	65.9	Low	37 Å²	37	81.2 Å²	81.2	38%	0.381	39%	0.393	S	S	.	.	H	α-helix	trans	-60.6	-29.4	176.5	0	0	0	0	0	113.7	I131 S132	I131-G135 PolarHBondContact O-N 3.35Å; S132-G135 PolarHBondContact O-N 3.49Å; S132-G135 VanDerWaalsContact O-N 3.09Å
136	W	62.8	Low	65.9	Low	33 Å²	33	80.4 Å²	80.4	13%	0.125	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	7.1	174.2	-68.5	105.4	0	0	0	114.6	T30 Q34 I46 Y50 S132 C133 E134 L138	T30-W136 HydrophobicContact CG2-CD2 3.68Å; T30-W136 HydrophobicContact CG2-CE3 3.68Å; T30-W136 HydrophobicContact CG2-CG 4.36Å; T30-W136 HydrophobicContact CG2-CH2 3.97Å; T30-W136 HydrophobicContact CG2-CZ2 3.99Å; T30-W136 HydrophobicContact CG2-CZ3 3.81Å; Q34-W136 VanDerWaalsContact CD-CE2 3.48Å; Q34-W136 VanDerWaalsContact CD-CZ2 3.49Å; Q34-W136 HydrophobicContact CG-CH2 4.23Å; Q34-W136 HydrophobicContact CG-CZ2 3.24Å; I46-W136 HydrophobicContact CD1-CE3 3.89Å; I46-W136 HydrophobicContact CD1-CZ3 3.95Å; Y50-W136 PolarHBondContact OH-O 3.5Å; S132-W136 PolarHBondContact O-N 3.15Å; C133-W136 PolarHBondContact O-N 3.43Å; E134-W136 PolarHBondContact O-N 3.23Å; W136-L138 HydrophobicContact CB-CD1 3.82Å; W136-L138 HydrophobicContact CB-CG 3.75Å; W136-L138 PolarHBondContact O-N 2.95Å; W136-L138 VanDerWaalsContact O-N 3.1Å
137	Y	62.9	Low	65.8	Low	106 Å²	106	74.8 Å²	74.8	42%	0.416	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.4	23.5	-172.9	-61.3	-91.1	0	0	0	113.3	Y50 C133 E134	Y50-Y137 HydrophobicContact CE2-CD2 4.5Å; Y50-Y137 HydrophobicContact CE2-CG 4.3Å; C133-Y137 PolarHBondContact O-N 3.04Å; E134-Y137 PolarHBondContact O-N 3.25Å
138	L	64	Low	65.7	Low	26 Å²	26	76.5 Å²	76.5	14%	0.136	36%	0.361	C	S	.	.	S	Bend	trans	-84.7	-26.4	175.9	-62.4	174.5	0	0	0	111.2	L66 C67 C70 C133 W136	L66-L138 HydrophobicContact CB-CD2 4.48Å; L66-L138 HydrophobicContact CD1-CD2 4.31Å; C67-L138 VanDerWaalsContact CA-O 3.25Å; C67-L138 WeakPolarHBondContact CA-O 3.34Å; C67-L138 VanDerWaalsContact CB-O 3.32Å; C67-L138 WeakPolarHBondContact CB-O 3.28Å; C67-L138 PolarHBondContact N-O 2.92Å; C70-L138 HydrophobicContact CB-CB 4.16Å; C70-L138 HydrophobicContact CB-CD1 3.93Å; C133-L138 WeakPolarHBondContact O-CB 3.32Å; C133-L138 PolarHBondContact O-N 2.91Å; W136-L138 HydrophobicContact CB-CD1 3.82Å; W136-L138 HydrophobicContact CB-CG 3.75Å; W136-L138 PolarHBondContact O-N 2.95Å; W136-L138 VanDerWaalsContact O-N 3.1Å
139	C	65.4	Low	65.3	Low	7 Å²	7	76.6 Å²	76.6	5%	0.047	36%	0.358	C	S	.	.	S	Bend	trans	-110.6	141.9	167.8	-66.2	0	0	0	0	109.8	C67 C133 E134 R141	C67-C139 WeakPolarHBondContact CA-SG 3.39Å; C67-C139 HydrophobicContact CB-CB 3.83Å; C67-C139 WeakPolarHBondContact CB-SG 3.4Å; C67-C139 WeakPolarHBondContact SG-CB 3.27Å; C67-C139 CovalentContact SG-SG 2.03Å; C67-C139 PolarHBondContact SG-SG 3.31Å; C133-C139 HydrophobicContact CB-CB 4.22Å; C133-C139 WeakPolarHBondContact CB-SG 3.3Å; C133-C139 PolarHBondContact O-N 3.25Å; E134-C139 HydrophobicContact CG-CB 3.8Å; C139-R141 PolarHBondContact O-N 2.72Å
140	Y	64.2	Low	64.9	Low	178 Å²	178	80.8 Å²	80.8	70%	0.698	38%	0.375	S	S	*	.			trans	-66.7	119.4	173	-161.4	-91.4	0	0	0	108.4	K142	Y140-K142 PolarHBondContact O-N 3.32Å
141	R	57.1	Low	64.2	Low	171 Å²	171	83.7 Å²	83.7	65%	0.645	38%	0.379	S	S	*	.			trans	-66.3	118.3	169.4	-169.1	-173.2	-83.2	174.1	-4.9	106.8	C139	C139-R141 PolarHBondContact O-N 2.72Å
142	K	48.3	Very low	63.4	Low	260 Å²	260	81 Å²	81	100%	1.13	36%	0.36	S	S	*	.			trans	-57.7	0	174.3	-83.1	-174.2	178.6	176.8	0	111.2	Y140	Y140-K142 PolarHBondContact O-N 3.32Å

Retrieved 142 of 142 residues in 103.6 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).