A0A5K4FCU6_SCHMA Loading...

Signal peptide peptidase AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4FCU6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 368 aa.

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(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	38.4	Very low	31.4	Very low	236 Å²	236	129.5 Å²	129.5	100%	1.163	75%	0.747	S	S	*	*				0	129.3	0	-84.6	164.9	165	0	0	107.5
2	N	28.3	Very low	31.5	Very low	135 Å²	135	124.8 Å²	124.8	72%	0.722	72%	0.722	S	S	*	*			trans	-75.4	143.9	-170	-147.1	1.7	0	0	0	110	S4	N2-S4 PolarHBondContact O-N 2.98Å
3	V	40.4	Very low	32.4	Very low	129 Å²	129	126.3 Å²	126.3	78%	0.782	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	7.8	-170.5	-179.8	0	0	0	0	113.3
4	S	33.3	Very low	33.5	Very low	82 Å²	82	118 Å²	118	57%	0.573	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-7.5	178.9	52.6	0	0	0	0	115.1	N2 I6	N2-S4 PolarHBondContact O-N 2.98Å; S4-I6 PolarHBondContact O-N 3.37Å
5	D	34.1	Very low	34.4	Very low	142 Å²	142	114.7 Å²	114.7	76%	0.759	66%	0.664	S	S	*	*			trans	-85.1	13.8	177.5	-72.8	-20.9	0	0	0	113.8	G7	D5-G7 PolarHBondContact O-N 3.37Å
6	I	33.4	Very low	35.9	Very low	139 Å²	139	109.1 Å²	109.1	71%	0.713	63%	0.63	S	S	*	*			trans	-86.5	49.3	157.7	-43.5	176.8	0	0	0	107.8	S4	S4-I6 PolarHBondContact O-N 3.37Å
7	G	25.7	Very low	36.9	Very low	56 Å²	56	108.9 Å²	108.9	58%	0.577	63%	0.632	S	S	*	*			trans	-77.1	119.8	171.4	0	0	0	0	0	108.9	D5	D5-G7 PolarHBondContact O-N 3.37Å
8	N	23.5	Very low	38.2	Very low	140 Å²	140	108.7 Å²	108.7	75%	0.749	63%	0.628	S	S	*	*			trans	54.9	76.2	163.9	-68.7	-7.4	0	0	0	116.1	S10	N8-S10 PolarHBondContact O-N 2.93Å
9	V	28	Very low	39.6	Very low	143 Å²	143	103.4 Å²	103.4	87%	0.867	60%	0.597	S	S	*	*			trans	-71.8	67	147.6	-173.6	0	0	0	0	107.9
10	S	30.6	Very low	41.1	Very low	75 Å²	75	104.4 Å²	104.4	52%	0.524	60%	0.596	S	S	.	*			trans	-145.9	48.7	175	52.7	0	0	0	0	109.9	N8	N8-S10 PolarHBondContact O-N 2.93Å
11	D	29.8	Very low	42.7	Very low	148 Å²	148	106.5 Å²	106.5	79%	0.791	60%	0.599	S	S	*	*	S	Bend	trans	-143.5	110.5	158.4	-85.7	-41.7	0	0	0	110.8
12	T	32.8	Very low	44.9	Very low	73 Å²	73	99.1 Å²	99.1	45%	0.448	56%	0.564	S	S	.	*			trans	71.5	83.1	162.7	64.3	0	0	0	0	117.6	G14	T12-G14 VanDerWaalsContact C-N 3.35Å; T12-G14 PolarHBondContact O-N 3.2Å
13	N	43.1	Very low	47.6	Very low	144 Å²	144	98 Å²	98	77%	0.77	56%	0.557	S	S	*	*	S	Bend	trans	-46.5	101.1	145.6	-76.3	-13	0	0	0	108.9	T15 H313	N13-T15 PolarHBondContact O-N 3Å; N13-T15 PolarHBondContact O-OG1 3.44Å; N13-T15 VanDerWaalsContact O-OG1 3.12Å; N13-H313 PolarHBondContact O-CD2 3.43Å; N13-H313 PolarHBondContact O-NE2 2.87Å
14	G	48.2	Very low	49.8	Very low	10 Å²	10	93.4 Å²	93.4	10%	0.103	53%	0.528	C	S	.	.	S	Bend	trans	53.7	3.2	165.9	0	0	0	0	0	119	T12 I16 H313	T12-G14 VanDerWaalsContact C-N 3.35Å; T12-G14 PolarHBondContact O-N 3.2Å; G14-I16 PolarHBondContact O-N 2.8Å; G14-H313 WeakPolarHBondContact CA-NE2 3.49Å
15	T	46.2	Very low	52.2	Low	68 Å²	68	90.2 Å²	90.2	42%	0.417	51%	0.506	S	S	.	.	B	Isolated β-bridge	trans	-70.6	116.2	-175.7	-53.2	0	0	0	0	108.8	N13 T17 K312	N13-T15 PolarHBondContact O-N 3Å; N13-T15 PolarHBondContact O-OG1 3.44Å; N13-T15 VanDerWaalsContact O-OG1 3.12Å; T15-T17 PolarHBondContact O-N 2.63Å; T15-T17 VanDerWaalsContact O-N 3.15Å; T15-K312 CarbonylContact C-O 3.52Å; T15-K312 WeakPolarHBondContact CA-O 3.16Å
16	I	57.9	Low	54.8	Low	25 Å²	25	87.2 Å²	87.2	13%	0.128	49%	0.489	C	S	.	.			trans	-82.3	95.4	177.6	-54.2	171.1	0	0	0	106.8	G14 N18 L19 M308 K312	G14-I16 PolarHBondContact O-N 2.8Å; I16-N18 PolarHBondContact O-N 3.21Å; I16-L19 HydrophobicContact CB-CB 3.94Å; I16-L19 HydrophobicContact CD1-CD2 4.21Å; I16-L19 HydrophobicContact CG2-CB 3.75Å; I16-L19 HydrophobicContact CG2-CD1 4.42Å; I16-L19 PolarHBondContact O-N 2.66Å; I16-M308 HydrophobicContact CD1-CG 4.14Å; I16-M308 HydrophobicContact CD1-SD 4.18Å; I16-K312 PolarHBondContact N-O 2.89Å
17	T	54.1	Low	57.5	Low	107 Å²	107	83 Å²	83	66%	0.656	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-18.5	-173	47.5	0	0	0	0	114.5	T15	T15-T17 PolarHBondContact O-N 2.63Å; T15-T17 VanDerWaalsContact O-N 3.15Å
18	N	59.4	Low	60.5	Low	104 Å²	104	80.4 Å²	80.4	56%	0.556	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.8	27.9	-179.7	-63.1	-59	0	0	0	113.5	I16 E20	I16-N18 PolarHBondContact O-N 3.21Å; N18-E20 VanDerWaalsContact C-N 3.33Å; N18-E20 PolarHBondContact O-N 2.94Å; N18-E20 VanDerWaalsContact O-N 3.11Å
19	L	64.5	Low	63.8	Low	8 Å²	8	74.9 Å²	74.9	4%	0.042	41%	0.411	C	S	.	.			trans	-86	79.3	175.6	-160	68.9	0	0	0	110.5	I16 M308 H309	I16-L19 HydrophobicContact CB-CB 3.94Å; I16-L19 HydrophobicContact CD1-CD2 4.21Å; I16-L19 HydrophobicContact CG2-CB 3.75Å; I16-L19 HydrophobicContact CG2-CD1 4.42Å; I16-L19 PolarHBondContact O-N 2.66Å; L19-M308 HydrophobicContact CD2-CG 3.99Å; L19-M308 WeakPolarHBondContact CD2-O 3.33Å; L19-H309 VanDerWaalsContact CD1-CE1 3.47Å; L19-H309 WeakPolarHBondContact CD1-CE1 3.32Å; L19-H309 VanDerWaalsContact CG-ND1 3.35Å; L19-H309 WeakPolarHBondContact CG-ND1 3.33Å
20	E	70	Confident	66.8	Low	123 Å²	123	70.9 Å²	70.9	58%	0.575	39%	0.389	S	S	*	.			trans	-95.4	143.2	168	-68.2	-173.3	168.7	0	0	110.4	N18 N22 S25	N18-E20 VanDerWaalsContact C-N 3.33Å; N18-E20 PolarHBondContact O-N 2.94Å; N18-E20 VanDerWaalsContact O-N 3.11Å; E20-N22 VanDerWaalsContact C-N 3.27Å; E20-N22 WeakPolarHBondContact CB-ND2 3.5Å; E20-N22 PolarHBondContact O-N 3.39Å; E20-N22 PolarHBondContact OE2-ND2 3.47Å; E20-N22 VanDerWaalsContact OE2-ND2 3.14Å; E20-S25 WeakPolarHBondContact O-CB 3.46Å; E20-S25 PolarHBondContact O-OG 2.83Å
21	F	75.6	Confident	69.8	Low	150 Å²	150	68.2 Å²	68.2	66%	0.658	37%	0.372	S	S	*	.			trans	-78.2	80.4	176.7	-168.5	-96.9	0	0	0	109.8	I26	F21-I26 HydrophobicContact CE1-CD1 4.18Å; F21-I26 HydrophobicContact CE2-CG1 4.44Å; F21-I26 HydrophobicContact CZ-CD1 4.08Å; F21-I26 HydrophobicContact CZ-CG1 4.19Å
22	N	83.3	Confident	72.8	Confident	80 Å²	80	61.3 Å²	61.3	43%	0.428	34%	0.335	S	S	.	.	S	Bend	trans	-116.9	170.5	-179.8	-66.6	-28.5	0	0	0	111	E20 D24 S25 I26	E20-N22 VanDerWaalsContact C-N 3.27Å; E20-N22 WeakPolarHBondContact CB-ND2 3.5Å; E20-N22 PolarHBondContact O-N 3.39Å; E20-N22 PolarHBondContact OE2-ND2 3.47Å; E20-N22 VanDerWaalsContact OE2-ND2 3.14Å; N22-D24 PolarHBondContact O-N 3.38Å; N22-S25 WeakPolarHBondContact O-CB 3.48Å; N22-S25 PolarHBondContact O-N 3.49Å; N22-S25 VanDerWaalsContact O-N 3.07Å; N22-I26 PolarHBondContact O-N 3.26Å; N22-I26 VanDerWaalsContact O-N 3.17Å
23	L	86.4	Confident	75.8	Confident	111 Å²	111	59.9 Å²	59.9	58%	0.581	32%	0.322	S	S	*	.	H	α-helix	trans	-57.3	-38.8	179.6	-160.1	153.1	0	0	0	112	S25 I26 I27 L247	L23-S25 PolarHBondContact O-N 2.81Å; L23-I26 PolarHBondContact O-N 2.85Å; L23-I27 HydrophobicContact CD2-CD1 3.42Å; L23-I27 VanDerWaalsContact CD2-CD1 3.42Å; L23-I27 HydrophobicContact CD2-CG1 3.92Å; L23-I27 WeakPolarHBondContact O-CG1 3.39Å; L23-I27 PolarHBondContact O-N 3.32Å; L23-L247 HydrophobicContact CB-CD1 4.04Å; L23-L247 HydrophobicContact CD2-CD1 3.44Å; L23-L247 VanDerWaalsContact CD2-CD1 3.44Å; L23-L247 HydrophobicContact CD2-CD2 4.33Å; L23-L247 HydrophobicContact CD2-CG 4.4Å; L23-L247 HydrophobicContact CG-CD1 4.29Å
24	D	85.4	Confident	78.3	Confident	34 Å²	34	57.6 Å²	57.6	18%	0.182	31%	0.31	C	S	.	.	H	α-helix	trans	-51.8	-54	171.4	-97	-34.7	0	0	0	112.1	N22 I26 I27 T28 R244 F246 L247	N22-D24 PolarHBondContact O-N 3.38Å; D24-I26 VanDerWaalsContact C-N 3.26Å; D24-I26 PolarHBondContact O-N 3.33Å; D24-I27 PolarHBondContact O-N 2.94Å; D24-I27 VanDerWaalsContact O-N 3.15Å; D24-T28 PolarHBondContact O-N 2.95Å; D24-T28 PolarHBondContact O-OG1 2.86Å; D24-R244 VanDerWaalsContact CB-O 3.29Å; D24-R244 WeakPolarHBondContact CB-O 3.46Å; D24-F246 PolarHBondContact OD1-N 2.85Å; D24-L247 HydrophobicContact CB-CD1 4.32Å; D24-L247 WeakPolarHBondContact OD1-CB 3.49Å; D24-L247 WeakPolarHBondContact OD1-CD1 3.23Å; D24-L247 WeakPolarHBondContact OD1-CG 3.41Å; D24-L247 PolarHBondContact OD1-N 3.35Å
25	S	84.6	Confident	80.6	Confident	15 Å²	15	58.9 Å²	58.9	11%	0.105	31%	0.314	C	S	.	.	H	α-helix	trans	-59.1	-35	178.1	-66	0	0	0	0	113.1	E20 N22 L23 N29	E20-S25 WeakPolarHBondContact O-CB 3.46Å; E20-S25 PolarHBondContact O-OG 2.83Å; N22-S25 WeakPolarHBondContact O-CB 3.48Å; N22-S25 PolarHBondContact O-N 3.49Å; N22-S25 VanDerWaalsContact O-N 3.07Å; L23-S25 PolarHBondContact O-N 2.81Å; S25-N29 VanDerWaalsContact O-CB 3.3Å; S25-N29 WeakPolarHBondContact O-CB 3.11Å; S25-N29 VanDerWaalsContact O-CG 3.25Å; S25-N29 PolarHBondContact O-N 3.22Å
26	I	88.3	Confident	82.9	Confident	79 Å²	79	55.7 Å²	55.7	41%	0.405	29%	0.294	S	S	.	.	H	α-helix	trans	-69.1	-44.7	177.1	-63.8	171.8	0	0	0	110.6	F21 N22 L23 D24 S30	F21-I26 HydrophobicContact CE1-CD1 4.18Å; F21-I26 HydrophobicContact CE2-CG1 4.44Å; F21-I26 HydrophobicContact CZ-CD1 4.08Å; F21-I26 HydrophobicContact CZ-CG1 4.19Å; N22-I26 PolarHBondContact O-N 3.26Å; N22-I26 VanDerWaalsContact O-N 3.17Å; L23-I26 PolarHBondContact O-N 2.85Å; D24-I26 VanDerWaalsContact C-N 3.26Å; D24-I26 PolarHBondContact O-N 3.33Å; I26-S30 VanDerWaalsContact O-CB 3.22Å; I26-S30 WeakPolarHBondContact O-CB 3.39Å; I26-S30 PolarHBondContact O-N 3.08Å; I26-S30 PolarHBondContact O-OG 3.12Å
27	I	90.2	Very high	84.8	Confident	51 Å²	51	55.4 Å²	55.4	26%	0.262	29%	0.293	S	S	.	.	H	α-helix	trans	-61.4	-49.8	176.7	-68.2	174.4	0	0	0	109.7	L23 D24 N29 S30 A31 F242 F246 L247	L23-I27 HydrophobicContact CD2-CD1 3.42Å; L23-I27 VanDerWaalsContact CD2-CD1 3.42Å; L23-I27 HydrophobicContact CD2-CG1 3.92Å; L23-I27 WeakPolarHBondContact O-CG1 3.39Å; L23-I27 PolarHBondContact O-N 3.32Å; D24-I27 PolarHBondContact O-N 2.94Å; D24-I27 VanDerWaalsContact O-N 3.15Å; I27-N29 PolarHBondContact O-N 3Å; I27-S30 PolarHBondContact O-N 3.31Å; I27-A31 WeakPolarHBondContact O-CB 3.23Å; I27-A31 PolarHBondContact O-N 3.22Å; I27-F242 HydrophobicContact CG2-CE1 4Å; I27-F242 HydrophobicContact CG2-CZ 4.32Å; I27-F246 HydrophobicContact CD1-CD1 4.48Å; I27-F246 HydrophobicContact CG2-CD1 4.07Å; I27-L247 HydrophobicContact CD1-CD1 4.2Å; I27-L247 HydrophobicContact CD1-CD2 3.78Å; I27-L247 HydrophobicContact CD1-CG 4.02Å
28	T	89.9	Confident	86.9	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.006	28%	0.281	C	S	.	.	H	α-helix	trans	-58.5	-47.4	-179.5	-56.6	0	0	0	0	111.9	D24 S30 A31 L32 F242 P243 R244 A257	D24-T28 PolarHBondContact O-N 2.95Å; D24-T28 PolarHBondContact O-OG1 2.86Å; T28-S30 VanDerWaalsContact C-N 3.33Å; T28-S30 PolarHBondContact O-N 3.15Å; T28-A31 PolarHBondContact O-N 3.28Å; T28-L32 HydrophobicContact CG2-CD1 4.41Å; T28-L32 WeakPolarHBondContact O-CG 3.44Å; T28-L32 PolarHBondContact O-N 3.08Å; T28-F242 HydrophobicContact CG2-CB 4.21Å; T28-F242 HydrophobicContact CG2-CD1 4Å; T28-P243 PolarHBondContact OG1-O 3.17Å; T28-R244 HydrophobicContact CG2-CG 4.16Å; T28-R244 WeakPolarHBondContact OG1-CA 3.37Å; T28-A257 HydrophobicContact CG2-CB 3.34Å
29	N	90.9	Very high	88.7	Confident	24 Å²	24	48.5 Å²	48.5	13%	0.128	26%	0.255	C	S	.	.	H	α-helix	trans	-66.2	-36.9	178.4	-77.2	-4.3	0	0	0	112.2	S25 I27 L32 F33 F305 H309	S25-N29 VanDerWaalsContact O-CB 3.3Å; S25-N29 WeakPolarHBondContact O-CB 3.11Å; S25-N29 VanDerWaalsContact O-CG 3.25Å; S25-N29 PolarHBondContact O-N 3.22Å; I27-N29 PolarHBondContact O-N 3Å; N29-L32 PolarHBondContact O-N 2.83Å; N29-F33 WeakPolarHBondContact O-CB 3.31Å; N29-F33 PolarHBondContact O-N 2.84Å; N29-F305 HydrophobicContact CB-CD2 4.3Å; N29-H309 PolarHBondContact ND2-CD2 3.25Å; N29-H309 VanDerWaalsContact ND2-CD2 3.32Å; N29-H309 PolarHBondContact ND2-NE2 2.9Å
30	S	92.2	Very high	90.3	Very high	59 Å²	59	48.1 Å²	48.1	41%	0.413	25%	0.253	S	S	.	.	H	α-helix	trans	-66.6	-39.9	176.7	-61.4	0	0	0	0	111.3	I26 I27 T28 F33 L34	I26-S30 VanDerWaalsContact O-CB 3.22Å; I26-S30 WeakPolarHBondContact O-CB 3.39Å; I26-S30 PolarHBondContact O-N 3.08Å; I26-S30 PolarHBondContact O-OG 3.12Å; I27-S30 PolarHBondContact O-N 3.31Å; T28-S30 VanDerWaalsContact C-N 3.33Å; T28-S30 PolarHBondContact O-N 3.15Å; S30-F33 WeakPolarHBondContact O-CB 3.3Å; S30-F33 PolarHBondContact O-N 3.09Å; S30-L34 WeakPolarHBondContact O-CG 3.49Å; S30-L34 PolarHBondContact O-N 3.13Å
31	A	93.1	Very high	91.6	Very high	19 Å²	19	46.5 Å²	46.5	16%	0.157	24%	0.242	C	C	.	.	H	α-helix	trans	-65.6	-46.2	174.3	0	0	0	0	0	111.9	I27 T28 F33 L34 L35 F242	I27-A31 WeakPolarHBondContact O-CB 3.23Å; I27-A31 PolarHBondContact O-N 3.22Å; T28-A31 PolarHBondContact O-N 3.28Å; A31-F33 VanDerWaalsContact C-N 3.32Å; A31-F33 PolarHBondContact O-N 3.25Å; A31-L34 PolarHBondContact O-N 2.91Å; A31-L35 WeakPolarHBondContact O-CB 3.24Å; A31-L35 VanDerWaalsContact O-CG 3.28Å; A31-L35 WeakPolarHBondContact O-CG 3.33Å; A31-L35 PolarHBondContact O-N 3.47Å; A31-F242 HydrophobicContact CB-CB 4.41Å; A31-F242 HydrophobicContact CB-CD1 3.98Å; A31-F242 HydrophobicContact CB-CD2 3.44Å; A31-F242 VanDerWaalsContact CB-CD2 3.44Å; A31-F242 HydrophobicContact CB-CE1 4.07Å; A31-F242 HydrophobicContact CB-CE2 3.54Å; A31-F242 HydrophobicContact CB-CG 3.66Å; A31-F242 HydrophobicContact CB-CZ 3.86Å
32	L	93.3	Very high	92.6	Very high	3 Å²	3	42.3 Å²	42.3	2%	0.016	23%	0.225	C	C	.	.	H	α-helix	trans	-62.7	-38.7	175.7	-71.4	179.3	0	0	0	112.2	T28 N29 L35 A36 V240 F242 A257 L259 F305	T28-L32 HydrophobicContact CG2-CD1 4.41Å; T28-L32 WeakPolarHBondContact O-CG 3.44Å; T28-L32 PolarHBondContact O-N 3.08Å; N29-L32 PolarHBondContact O-N 2.83Å; L32-L35 HydrophobicContact CD2-CD1 4.5Å; L32-L35 PolarHBondContact O-N 3.21Å; L32-A36 PolarHBondContact O-N 3.44Å; L32-V240 HydrophobicContact CD2-CG2 4.18Å; L32-F242 HydrophobicContact CD2-CB 4.08Å; L32-F242 HydrophobicContact CG-CB 4.23Å; L32-A257 HydrophobicContact CD1-CB 3.69Å; L32-L259 HydrophobicContact CD2-CB 4.41Å; L32-F305 HydrophobicContact CB-CZ 3.95Å
33	F	94.8	Very high	93.2	Very high	42 Å²	42	38.5 Å²	38.5	18%	0.184	21%	0.205	C	C	.	.	H	α-helix	trans	-57.5	-51	173.4	174.7	-103.3	0	0	0	111.2	N29 S30 A31 L35 A36 I37 I298 I301 I302 F305	N29-F33 WeakPolarHBondContact O-CB 3.31Å; N29-F33 PolarHBondContact O-N 2.84Å; S30-F33 WeakPolarHBondContact O-CB 3.3Å; S30-F33 PolarHBondContact O-N 3.09Å; A31-F33 VanDerWaalsContact C-N 3.32Å; A31-F33 PolarHBondContact O-N 3.25Å; F33-L35 VanDerWaalsContact C-N 3.34Å; F33-L35 PolarHBondContact O-N 3.06Å; F33-A36 WeakPolarHBondContact O-CB 3.44Å; F33-A36 PolarHBondContact O-N 3.4Å; F33-A36 VanDerWaalsContact O-N 3.09Å; F33-I37 HydrophobicContact CD1-CD1 4.21Å; F33-I37 HydrophobicContact CD2-CG2 4.17Å; F33-I37 HydrophobicContact CE1-CD1 3.55Å; F33-I37 HydrophobicContact CE1-CG1 4.3Å; F33-I37 HydrophobicContact CE1-CG2 4.44Å; F33-I37 HydrophobicContact CE2-CG2 3.78Å; F33-I37 HydrophobicContact CZ-CD1 3.85Å; F33-I37 HydrophobicContact CZ-CG2 3.93Å; F33-I37 WeakPolarHBondContact O-CG1 3.03Å; F33-I37 PolarHBondContact O-N 2.87Å; F33-I298 HydrophobicContact CE2-CB 4.38Å; F33-I298 HydrophobicContact CE2-CG1 4.24Å; F33-I298 HydrophobicContact CE2-CG2 3.91Å; F33-I298 HydrophobicContact CZ-CB 4.49Å; F33-I298 HydrophobicContact CZ-CG1 4.13Å; F33-I298 HydrophobicContact CZ-CG2 3.83Å; F33-I301 HydrophobicContact CD2-CG2 3.73Å; F33-I301 HydrophobicContact CE2-CG2 3.79Å; F33-I302 HydrophobicContact CD2-CG1 4.25Å; F33-I302 HydrophobicContact CE2-CD1 4.12Å; F33-I302 HydrophobicContact CE2-CG1 3.99Å; F33-F305 HydrophobicContact CB-CE2 4.07Å
34	L	96	Very high	93.7	Very high	97 Å²	97	33.2 Å²	33.2	51%	0.508	18%	0.177	S	C	.	.	H	α-helix	trans	-61.8	-41.6	177.5	-69.2	175.4	0	0	0	112.2	S30 A31 A36 I37 V38	S30-L34 WeakPolarHBondContact O-CG 3.49Å; S30-L34 PolarHBondContact O-N 3.13Å; A31-L34 PolarHBondContact O-N 2.91Å; L34-A36 PolarHBondContact O-N 2.98Å; L34-I37 HydrophobicContact CD2-CD1 4.3Å; L34-I37 PolarHBondContact O-N 3.47Å; L34-V38 WeakPolarHBondContact O-CB 3.22Å; L34-V38 VanDerWaalsContact O-CG2 3.3Å; L34-V38 WeakPolarHBondContact O-CG2 3.32Å; L34-V38 PolarHBondContact O-N 3.15Å; L34-V38 VanDerWaalsContact O-N 3.16Å
35	L	95.9	Very high	94.2	Very high	37 Å²	37	33.9 Å²	33.9	19%	0.194	18%	0.179	C	C	.	.	H	α-helix	trans	-64.9	-17.4	176.2	-72.2	167.6	0	0	0	113.3	A31 L32 F33 P39 V188 V240	A31-L35 WeakPolarHBondContact O-CB 3.24Å; A31-L35 VanDerWaalsContact O-CG 3.28Å; A31-L35 WeakPolarHBondContact O-CG 3.33Å; A31-L35 PolarHBondContact O-N 3.47Å; L32-L35 HydrophobicContact CD2-CD1 4.5Å; L32-L35 PolarHBondContact O-N 3.21Å; F33-L35 VanDerWaalsContact C-N 3.34Å; F33-L35 PolarHBondContact O-N 3.06Å; L35-P39 VanDerWaalsContact O-CD 3.23Å; L35-P39 WeakPolarHBondContact O-CD 3.47Å; L35-P39 WeakPolarHBondContact O-CG 3.22Å; L35-V188 HydrophobicContact CD2-CG2 3.72Å; L35-V240 HydrophobicContact CB-CB 4.4Å; L35-V240 HydrophobicContact CB-CG2 4.27Å; L35-V240 HydrophobicContact CD1-CB 4.4Å
36	A	96.2	Very high	94.6	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-91.5	-46.6	174.7	0	0	0	0	0	112.6	L32 F33 L34 P39 I40 L259 I264 Y297 I301	L32-A36 PolarHBondContact O-N 3.44Å; F33-A36 WeakPolarHBondContact O-CB 3.44Å; F33-A36 PolarHBondContact O-N 3.4Å; F33-A36 VanDerWaalsContact O-N 3.09Å; L34-A36 PolarHBondContact O-N 2.98Å; A36-P39 WeakPolarHBondContact O-CD 3.44Å; A36-I40 WeakPolarHBondContact O-CD1 3.46Å; A36-I40 WeakPolarHBondContact O-CG1 3.14Å; A36-L259 HydrophobicContact CB-CD2 3.73Å; A36-I264 HydrophobicContact CB-CD1 4.21Å; A36-I264 HydrophobicContact CB-CG1 4.03Å; A36-Y297 HydrophobicContact CB-CE1 4.29Å; A36-I301 HydrophobicContact CB-CD1 3.45Å; A36-I301 VanDerWaalsContact CB-CD1 3.45Å
37	I	97.4	Very high	94.8	Very high	20 Å²	20	31.4 Å²	31.4	10%	0.103	16%	0.162	C	C	.	.	H	α-helix	trans	-79.6	-28.2	-170.8	67.2	160.7	0	0	0	113.6	F33 L34 Y41 Y294 Y297 I298	F33-I37 HydrophobicContact CD1-CD1 4.21Å; F33-I37 HydrophobicContact CD2-CG2 4.17Å; F33-I37 HydrophobicContact CE1-CD1 3.55Å; F33-I37 HydrophobicContact CE1-CG1 4.3Å; F33-I37 HydrophobicContact CE1-CG2 4.44Å; F33-I37 HydrophobicContact CE2-CG2 3.78Å; F33-I37 HydrophobicContact CZ-CD1 3.85Å; F33-I37 HydrophobicContact CZ-CG2 3.93Å; F33-I37 WeakPolarHBondContact O-CG1 3.03Å; F33-I37 PolarHBondContact O-N 2.87Å; L34-I37 HydrophobicContact CD2-CD1 4.3Å; L34-I37 PolarHBondContact O-N 3.47Å; I37-Y41 PolarHBondContact O-N 3.19Å; I37-Y294 HydrophobicContact CB-CE2 4.4Å; I37-Y294 PolarHBondContact O-OH 3.47Å; I37-Y294 VanDerWaalsContact O-OH 3.06Å; I37-Y297 HydrophobicContact CG2-CD1 4.34Å; I37-Y297 HydrophobicContact CG2-CE1 4.22Å; I37-I298 HydrophobicContact CG2-CG1 3.87Å
38	V	97.5	Very high	94.7	Very high	65 Å²	65	30.8 Å²	30.8	39%	0.394	16%	0.159	S	C	.	.	H	α-helix	trans	-70.3	-48.7	-178.7	170.2	0	0	0	0	111.5	L34 I40 Y41 I42	L34-V38 WeakPolarHBondContact O-CB 3.22Å; L34-V38 VanDerWaalsContact O-CG2 3.3Å; L34-V38 WeakPolarHBondContact O-CG2 3.32Å; L34-V38 PolarHBondContact O-N 3.15Å; L34-V38 VanDerWaalsContact O-N 3.16Å; V38-I40 VanDerWaalsContact C-N 3.28Å; V38-I40 PolarHBondContact O-N 3.35Å; V38-Y41 PolarHBondContact O-N 2.88Å; V38-I42 HydrophobicContact CG1-CD1 3.57Å; V38-I42 HydrophobicContact CG1-CG1 4.29Å; V38-I42 WeakPolarHBondContact O-CG1 3.27Å; V38-I42 PolarHBondContact O-N 3.26Å
39	P	97.5	Very high	94.4	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.006	19%	0.193	C	C	.	.	H	α-helix	trans	-57.4	-41.1	175.6	-24.2	31.9	0	0	0	113.2	L35 A36 G43 V188 A191 I192 I264	L35-P39 VanDerWaalsContact O-CD 3.23Å; L35-P39 WeakPolarHBondContact O-CD 3.47Å; L35-P39 WeakPolarHBondContact O-CG 3.22Å; A36-P39 WeakPolarHBondContact O-CD 3.44Å; P39-G43 WeakPolarHBondContact O-CA 3.48Å; P39-G43 PolarHBondContact O-N 3.31Å; P39-V188 HydrophobicContact CG-CB 4.46Å; P39-V188 HydrophobicContact CG-CG1 4.06Å; P39-V188 HydrophobicContact CG-CG2 4.19Å; P39-A191 HydrophobicContact CB-CB 3.96Å; P39-I192 HydrophobicContact CB-CG1 3.85Å; P39-I264 HydrophobicContact CB-CG2 4.2Å; P39-I264 HydrophobicContact CG-CG2 4.48Å
40	I	98	Very high	93.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-61.5	-48.2	179.2	-66.7	171.5	0	0	0	110.6	A36 V38 S44 I195 I264 I271 Y294 Y297	A36-I40 WeakPolarHBondContact O-CD1 3.46Å; A36-I40 WeakPolarHBondContact O-CG1 3.14Å; V38-I40 VanDerWaalsContact C-N 3.28Å; V38-I40 PolarHBondContact O-N 3.35Å; I40-S44 WeakPolarHBondContact O-CB 3.22Å; I40-S44 PolarHBondContact O-N 2.95Å; I40-S44 PolarHBondContact O-OG 3.49Å; I40-I195 HydrophobicContact CB-CD1 4.46Å; I40-I195 HydrophobicContact CG1-CD1 3.98Å; I40-I264 HydrophobicContact CD1-CG2 4.2Å; I40-I264 HydrophobicContact CG1-CG2 3.89Å; I40-I271 HydrophobicContact CG2-CB 4.33Å; I40-I271 HydrophobicContact CG2-CD1 4.01Å; I40-I271 HydrophobicContact CG2-CG2 4.1Å; I40-Y294 HydrophobicContact CB-CE2 4.34Å; I40-Y294 HydrophobicContact CG2-CD2 3.91Å; I40-Y294 HydrophobicContact CG2-CE2 4.04Å; I40-Y297 HydrophobicContact CD1-CD1 3.81Å; I40-Y297 HydrophobicContact CD1-CD2 3.98Å; I40-Y297 HydrophobicContact CD1-CE1 3.4Å; I40-Y297 VanDerWaalsContact CD1-CE1 3.4Å; I40-Y297 HydrophobicContact CD1-CE2 3.57Å; I40-Y297 HydrophobicContact CD1-CG 4.1Å
41	Y	97.9	Very high	91.9	Very high	88 Å²	88	41.4 Å²	41.4	35%	0.345	21%	0.208	S	C	.	.	H	α-helix	trans	-63	-52.8	179.8	-169.5	-87.1	0	0	0	111.4	I37 V38 S44 F45 F290 Y294	I37-Y41 PolarHBondContact O-N 3.19Å; V38-Y41 PolarHBondContact O-N 2.88Å; Y41-S44 PolarHBondContact O-N 3.38Å; Y41-F45 AromaticContact CD1-CD2 3.96Å; Y41-F45 HydrophobicContact CD1-CD2 3.96Å; Y41-F45 HydrophobicContact CD1-CE2 4.26Å; Y41-F45 HydrophobicContact CD2-CD2 4.42Å; Y41-F45 HydrophobicContact CD2-CE2 4.06Å; Y41-F45 AromaticContact CE1-CD2 3.67Å; Y41-F45 HydrophobicContact CE1-CD2 3.67Å; Y41-F45 AromaticContact CE1-CE2 3.72Å; Y41-F45 HydrophobicContact CE1-CE2 3.72Å; Y41-F45 HydrophobicContact CE2-CD2 4.18Å; Y41-F45 AromaticContact CE2-CE2 3.5Å; Y41-F45 HydrophobicContact CE2-CE2 3.5Å; Y41-F45 HydrophobicContact CE2-CZ 4.42Å; Y41-F45 HydrophobicContact CG-CD2 4.32Å; Y41-F45 HydrophobicContact CG-CE2 4.41Å; Y41-F45 AromaticContact CZ-CD2 3.79Å; Y41-F45 AromaticContact CZ-CE2 3.3Å; Y41-F45 WeakPolarHBondContact O-CD2 3.31Å; Y41-F45 PolarHBondContact O-N 3.36Å; Y41-F45 VanDerWaalsContact O-N 3.17Å; Y41-F290 HydrophobicContact CD2-CE1 4.17Å; Y41-F290 AromaticContact CD2-CZ 3.88Å; Y41-F290 HydrophobicContact CD2-CZ 3.88Å; Y41-F290 HydrophobicContact CE2-CE1 4.04Å; Y41-F290 HydrophobicContact CE2-CZ 4.18Å; Y41-Y294 HydrophobicContact CD2-CE1 4.3Å; Y41-Y294 HydrophobicContact CD2-CE2 4.46Å
42	I	96.6	Very high	89.7	Confident	62 Å²	62	48 Å²	48	32%	0.318	23%	0.233	S	C	.	.	H	α-helix	trans	-62.7	-48.6	-177.7	-64	174.8	0	0	0	110.9	V38 S44 F45 R46 I192	V38-I42 HydrophobicContact CG1-CD1 3.57Å; V38-I42 HydrophobicContact CG1-CG1 4.29Å; V38-I42 WeakPolarHBondContact O-CG1 3.27Å; V38-I42 PolarHBondContact O-N 3.26Å; I42-S44 VanDerWaalsContact C-N 3.34Å; I42-S44 PolarHBondContact O-N 2.67Å; I42-F45 PolarHBondContact O-N 3.41Å; I42-R46 HydrophobicContact CG2-CG 4.28Å; I42-R46 WeakPolarHBondContact O-CB 3.39Å; I42-R46 VanDerWaalsContact O-CG 3.29Å; I42-R46 WeakPolarHBondContact O-CG 3.25Å; I42-R46 PolarHBondContact O-N 3.37Å; I42-I192 HydrophobicContact CB-CD1 4.34Å; I42-I192 HydrophobicContact CB-CG1 4.42Å; I42-I192 HydrophobicContact CD1-CD1 4.39Å; I42-I192 HydrophobicContact CG2-CD1 4.16Å; I42-I192 HydrophobicContact CG2-CG1 4.42Å; I42-I192 HydrophobicContact CG2-CG2 3.96Å
43	G	96.4	Very high	87.7	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-60.8	-42.1	179.3	0	0	0	0	0	112.3	P39 R46 S47	P39-G43 WeakPolarHBondContact O-CA 3.48Å; P39-G43 PolarHBondContact O-N 3.31Å; G43-R46 PolarHBondContact O-N 2.97Å; G43-S47 WeakPolarHBondContact O-CB 3.23Å; G43-S47 PolarHBondContact O-N 2.9Å
44	S	96.6	Very high	85.7	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-60.7	-50.2	178.2	-61.5	0	0	0	0	111.8	I40 Y41 I42 S47 L275	I40-S44 WeakPolarHBondContact O-CB 3.22Å; I40-S44 PolarHBondContact O-N 2.95Å; I40-S44 PolarHBondContact O-OG 3.49Å; Y41-S44 PolarHBondContact O-N 3.38Å; I42-S44 VanDerWaalsContact C-N 3.34Å; I42-S44 PolarHBondContact O-N 2.67Å; S44-S47 WeakPolarHBondContact O-CB 3.48Å; S44-S47 PolarHBondContact O-N 2.91Å; S44-S47 PolarHBondContact O-OG 3.15Å; S44-L275 WeakPolarHBondContact O-CD2 3.29Å
45	F	95.1	Very high	83.8	Confident	49 Å²	49	55.1 Å²	55.1	22%	0.215	28%	0.276	C	S	.	.	H	α-helix	trans	-69	-35	179.5	-82.7	-81.8	0	0	0	113	Y41 I42 S47 L48 L275 Y287 F290	Y41-F45 AromaticContact CD1-CD2 3.96Å; Y41-F45 HydrophobicContact CD1-CD2 3.96Å; Y41-F45 HydrophobicContact CD1-CE2 4.26Å; Y41-F45 HydrophobicContact CD2-CD2 4.42Å; Y41-F45 HydrophobicContact CD2-CE2 4.06Å; Y41-F45 AromaticContact CE1-CD2 3.67Å; Y41-F45 HydrophobicContact CE1-CD2 3.67Å; Y41-F45 AromaticContact CE1-CE2 3.72Å; Y41-F45 HydrophobicContact CE1-CE2 3.72Å; Y41-F45 HydrophobicContact CE2-CD2 4.18Å; Y41-F45 AromaticContact CE2-CE2 3.5Å; Y41-F45 HydrophobicContact CE2-CE2 3.5Å; Y41-F45 HydrophobicContact CE2-CZ 4.42Å; Y41-F45 HydrophobicContact CG-CD2 4.32Å; Y41-F45 HydrophobicContact CG-CE2 4.41Å; Y41-F45 AromaticContact CZ-CD2 3.79Å; Y41-F45 AromaticContact CZ-CE2 3.3Å; Y41-F45 WeakPolarHBondContact O-CD2 3.31Å; Y41-F45 PolarHBondContact O-N 3.36Å; Y41-F45 VanDerWaalsContact O-N 3.17Å; I42-F45 PolarHBondContact O-N 3.41Å; F45-S47 VanDerWaalsContact C-N 3.27Å; F45-S47 PolarHBondContact O-N 2.93Å; F45-L48 HydrophobicContact CD1-CD1 4.3Å; F45-L48 WeakPolarHBondContact O-CB 3.25Å; F45-L48 PolarHBondContact O-N 3.44Å; F45-L275 HydrophobicContact CD1-CD2 4.02Å; F45-L275 HydrophobicContact CD2-CD2 4.26Å; F45-L275 HydrophobicContact CE1-CD1 4.28Å; F45-L275 HydrophobicContact CE1-CD2 4.19Å; F45-L275 HydrophobicContact CE2-CD2 4.4Å; F45-L275 HydrophobicContact CG-CD2 4.06Å; F45-L275 HydrophobicContact CZ-CD1 4.27Å; F45-L275 HydrophobicContact CZ-CD2 4.38Å; F45-Y287 HydrophobicContact CE1-CD2 4.48Å; F45-Y287 HydrophobicContact CE1-CE2 4.15Å; F45-Y287 HydrophobicContact CZ-CD2 4.42Å; F45-F290 HydrophobicContact CD2-CZ 4.28Å; F45-F290 HydrophobicContact CE2-CD1 4.46Å; F45-F290 AromaticContact CE2-CE1 3.61Å; F45-F290 HydrophobicContact CE2-CE1 3.61Å; F45-F290 AromaticContact CE2-CZ 3.68Å; F45-F290 HydrophobicContact CE2-CZ 3.68Å; F45-F290 HydrophobicContact CZ-CE1 4.07Å; F45-F290 HydrophobicContact CZ-CZ 4.49Å
46	R	92.3	Very high	82.4	Confident	40 Å²	40	57.8 Å²	57.8	15%	0.151	29%	0.288	C	S	.	.	H	α-helix	trans	-62.5	-36.7	172.4	-76.2	-179.1	63.2	147.4	-2.9	111.7	I42 G43 L48 T49 S50 F110 E196	I42-R46 HydrophobicContact CG2-CG 4.28Å; I42-R46 WeakPolarHBondContact O-CB 3.39Å; I42-R46 VanDerWaalsContact O-CG 3.29Å; I42-R46 WeakPolarHBondContact O-CG 3.25Å; I42-R46 PolarHBondContact O-N 3.37Å; G43-R46 PolarHBondContact O-N 2.97Å; R46-L48 PolarHBondContact O-N 2.8Å; R46-L48 VanDerWaalsContact O-N 3.15Å; R46-T49 PolarHBondContact O-N 3.22Å; R46-S50 PolarHBondContact O-N 3.49Å; R46-F110 VanDerWaalsContact NH1-CE2 3.25Å; R46-F110 PolarHBondContact NH1-O 3Å; R46-E196 HydrophobicContact CB-CB 4.35Å; R46-E196 HydrophobicContact CB-CG 4Å; R46-E196 IonicContact CZ-OE1 3.62Å; R46-E196 IonicContact CZ-OE2 2.66Å; R46-E196 VanDerWaalsContact NE-CD 3.26Å; R46-E196 IonicContact NE-OE1 3.41Å; R46-E196 PolarHBondContact NE-OE1 3.37Å; R46-E196 VanDerWaalsContact NE-OE1 3.11Å; R46-E196 IonicContact NE-OE2 3.4Å; R46-E196 PolarHBondContact NE-OE2 2.88Å; R46-E196 IonicContact NH2-OE1 3.26Å; R46-E196 PolarHBondContact NH2-OE1 3.15Å; R46-E196 VanDerWaalsContact NH2-OE1 3.07Å; R46-E196 IonicContact NH2-OE2 2.67Å; R46-E196 PolarHBondContact NH2-OE2 3.01Å
47	S	92.6	Very high	81.4	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.007	29%	0.292	C	S	.	.	H	α-helix	trans	-58.3	-28.5	176.8	86.7	0	0	0	0	113.4	G43 S44 F45 R199 R276	G43-S47 WeakPolarHBondContact O-CB 3.23Å; G43-S47 PolarHBondContact O-N 2.9Å; S44-S47 WeakPolarHBondContact O-CB 3.48Å; S44-S47 PolarHBondContact O-N 2.91Å; S44-S47 PolarHBondContact O-OG 3.15Å; F45-S47 VanDerWaalsContact C-N 3.27Å; F45-S47 PolarHBondContact O-N 2.93Å; S47-R199 PolarHBondContact O-NH2 3.36Å; S47-R276 PolarHBondContact OG-NH1 3.27Å
48	L	89.7	Confident	80.7	Confident	39 Å²	39	63.7 Å²	63.7	20%	0.204	32%	0.315	C	S	.	.	H	α-helix	trans	-69.9	-34.7	174.3	-63	-175.9	0	0	0	113.2	F45 R46 L275 R276 T279	F45-L48 HydrophobicContact CD1-CD1 4.3Å; F45-L48 WeakPolarHBondContact O-CB 3.25Å; F45-L48 PolarHBondContact O-N 3.44Å; R46-L48 PolarHBondContact O-N 2.8Å; R46-L48 VanDerWaalsContact O-N 3.15Å; L48-L275 HydrophobicContact CD1-CD1 4.37Å; L48-L275 HydrophobicContact CD1-CD2 3.7Å; L48-L275 HydrophobicContact CD1-CG 3.84Å; L48-L275 HydrophobicContact CD2-CD2 4.3Å; L48-L275 HydrophobicContact CD2-CG 4.08Å; L48-L275 HydrophobicContact CG-CD2 3.81Å; L48-L275 HydrophobicContact CG-CG 4.07Å; L48-R276 HydrophobicContact CD2-CB 4.42Å; L48-R276 HydrophobicContact CD2-CG 3.59Å; L48-T279 HydrophobicContact CD1-CG2 3.92Å; L48-T279 HydrophobicContact CD2-CG2 3.87Å
49	T	83.7	Confident	80.1	Confident	116 Å²	116	62 Å²	62	71%	0.712	31%	0.305	S	S	*	.	H	α-helix	trans	-89.4	-20.4	-174.1	-54	0	0	0	0	111.8	R46 K51	R46-T49 PolarHBondContact O-N 3.22Å; T49-K51 PolarHBondContact O-N 2.89Å
50	S	71.3	Confident	79.6	Confident	13 Å²	13	62.6 Å²	62.6	9%	0.091	31%	0.309	C	S	.	.			trans	-71.7	56.6	177.1	-164.2	0	0	0	0	112.2	R46 R199	R46-S50 PolarHBondContact O-N 3.49Å; S50-R199 PolarHBondContact O-NH2 3.39Å
51	K	57.4	Low	79.2	Confident	178 Å²	178	63.9 Å²	63.9	77%	0.774	32%	0.318	S	S	*	.			trans	-83.4	-3.7	165.8	-65.8	-172.6	178.1	-174	0	112.3	T49 S53	T49-K51 PolarHBondContact O-N 2.89Å; K51-S53 PolarHBondContact O-N 3.31Å
52	K	48.3	Very low	78.8	Confident	156 Å²	156	61.7 Å²	61.7	68%	0.678	32%	0.316	S	S	*	.	S	Bend	trans	-78.7	114.2	-179.7	-73.6	179.1	178	172.8	0	107.2
53	S	50.2	Low	78.6	Confident	52 Å²	52	63.6 Å²	63.6	36%	0.364	32%	0.321	S	S	.	.			trans	57.1	94.7	-177.4	41.3	0	0	0	0	115.1	K51 E55 E56	K51-S53 PolarHBondContact O-N 3.31Å; S53-E55 PolarHBondContact O-N 2.81Å; S53-E56 PolarHBondContact O-N 3.35Å
54	T	53.4	Low	78.3	Confident	80 Å²	80	67.4 Å²	67.4	49%	0.491	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-44.2	-24.5	157.9	-55.5	0	0	0	0	112.3
55	E	56.5	Low	78.1	Confident	161 Å²	161	67.4 Å²	67.4	75%	0.752	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-70.4	-24.7	176.2	-60.9	178	178.9	0	0	115.5	S53	S53-E55 PolarHBondContact O-N 2.81Å
56	E	65.4	Low	78.1	Confident	93 Å²	93	67.2 Å²	67.2	44%	0.435	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-92.5	-8.8	179.5	-69.3	-167.7	149.7	0	0	113.1	S53 R109	S53-E56 PolarHBondContact O-N 3.35Å; E56-R109 IonicContact OE1-NH2 2.77Å
57	V	76.8	Confident	78.2	Confident	14 Å²	14	70.3 Å²	70.3	9%	0.085	37%	0.368	C	S	.	.			trans	-90	121.8	-176.4	175.7	0	0	0	0	109	V59 R199	V57-V59 HydrophobicContact CG1-CG2 4.29Å; V57-V59 PolarHBondContact O-N 2.91Å; V57-R199 HydrophobicContact CG1-CB 4.04Å; V57-R199 VanDerWaalsContact CG1-CD 3.47Å; V57-R199 HydrophobicContact CG1-CG 3.6Å
58	E	81.2	Confident	78.3	Confident	129 Å²	129	74.5 Å²	74.5	60%	0.603	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.7	111.1	175.2	-172.4	179.5	172.6	0	0	108.8	F197 R199	E58-F197 PolarHBondContact N-O 3.26Å; E58-R199 PolarHBondContact O-N 3.18Å
59	V	86.4	Confident	78.5	Confident	29 Å²	29	73.3 Å²	73.3	18%	0.176	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	122.4	176.7	-179.2	0	0	0	0	108.9	V57 S61 R199 N201	V57-V59 HydrophobicContact CG1-CG2 4.29Å; V57-V59 PolarHBondContact O-N 2.91Å; V59-S61 PolarHBondContact O-N 3.48Å; V59-R199 WeakPolarHBondContact CA-O 3.22Å; V59-N201 HydrophobicContact CG1-CB 3.67Å
60	V	86.4	Confident	79.1	Confident	15 Å²	15	74.8 Å²	74.8	9%	0.091	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	111.1	179.3	-180	0	0	0	0	108.8	D64 A65 I198 R199 L200 N205	V60-D64 HydrophobicContact CG1-CB 4.11Å; V60-A65 HydrophobicContact CG1-CB 4.08Å; V60-I198 HydrophobicContact CG2-CG2 3.49Å; V60-I198 VanDerWaalsContact CG2-CG2 3.49Å; V60-R199 PolarHBondContact N-O 2.86Å; V60-L200 HydrophobicContact CB-CD2 4.08Å; V60-L200 HydrophobicContact CG1-CD2 4.2Å; V60-N205 PolarHBondContact O-ND2 3.23Å
61	S	88.6	Confident	80.2	Confident	26 Å²	26	80 Å²	80	18%	0.182	40%	0.404	C	S	.	.			trans	-74.1	164.8	175.5	-169.7	0	0	0	0	111.8	V59 K63 D64 A65	V59-S61 PolarHBondContact O-N 3.48Å; S61-K63 PolarHBondContact O-N 3.05Å; S61-D64 VanDerWaalsContact CB-OD2 3.28Å; S61-D64 WeakPolarHBondContact CB-OD2 3.41Å; S61-D64 PolarHBondContact N-OD2 3.35Å; S61-D64 PolarHBondContact O-N 2.84Å; S61-A65 WeakPolarHBondContact O-CB 3.29Å; S61-A65 PolarHBondContact O-N 3.5Å
62	S	90.4	Very high	81.9	Confident	43 Å²	43	72.6 Å²	72.6	30%	0.301	38%	0.376	S	S	.	.	H	α-helix	trans	-60.5	-33.2	177.5	-50.1	0	0	0	0	112.2	A66 N205	S62-A66 WeakPolarHBondContact O-CB 3.31Å; S62-A66 PolarHBondContact O-N 3.18Å; S62-A66 VanDerWaalsContact O-N 3.12Å; S62-N205 WeakPolarHBondContact CA-OD1 3.45Å; S62-N205 WeakPolarHBondContact CB-OD1 3.42Å; S62-N205 PolarHBondContact N-ND2 3.45Å; S62-N205 PolarHBondContact OG-OD1 3.27Å
63	K	91.6	Very high	84.1	Confident	101 Å²	101	66.6 Å²	66.6	44%	0.439	35%	0.353	S	S	.	.	H	α-helix	trans	-67.3	-46.1	177	-68.9	175.3	-177.7	163.8	0	111	S61 A66 L67 S361	S61-K63 PolarHBondContact O-N 3.05Å; K63-A66 PolarHBondContact O-N 2.94Å; K63-L67 WeakPolarHBondContact O-CB 3.1Å; K63-L67 WeakPolarHBondContact O-CG 3.26Å; K63-L67 PolarHBondContact O-N 3.15Å; K63-S361 PolarHBondContact NZ-OG 3.25Å
64	D	90.6	Very high	86.2	Confident	81 Å²	81	67.1 Å²	67.1	43%	0.433	36%	0.361	S	S	.	.	H	α-helix	trans	-64.4	-45	-179.9	-52.5	-36.5	0	0	0	110.6	V60 S61 A66 L67 F68	V60-D64 HydrophobicContact CG1-CB 4.11Å; S61-D64 VanDerWaalsContact CB-OD2 3.28Å; S61-D64 WeakPolarHBondContact CB-OD2 3.41Å; S61-D64 PolarHBondContact N-OD2 3.35Å; S61-D64 PolarHBondContact O-N 2.84Å; D64-A66 VanDerWaalsContact C-N 3.29Å; D64-A66 PolarHBondContact O-N 3.35Å; D64-L67 PolarHBondContact O-N 2.66Å; D64-F68 WeakPolarHBondContact O-CB 3.39Å; D64-F68 PolarHBondContact O-N 2.83Å
65	A	93.2	Very high	88.1	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-56.8	-41.5	175.2	0	0	0	0	0	112.5	V60 S61 N205 L208 L209	V60-A65 HydrophobicContact CG1-CB 4.08Å; S61-A65 WeakPolarHBondContact O-CB 3.29Å; S61-A65 PolarHBondContact O-N 3.5Å; A65-N205 HydrophobicContact CB-CB 4.3Å; A65-N205 WeakPolarHBondContact CB-O 3.04Å; A65-L208 HydrophobicContact CB-CB 4.16Å; A65-L209 HydrophobicContact CB-CB 4.1Å
66	A	93.8	Very high	89.8	Confident	44 Å²	44	59.1 Å²	59.1	36%	0.364	33%	0.328	S	S	.	.	H	α-helix	trans	-74.9	-30.9	178.7	0	0	0	0	0	113.4	S62 K63 D64 P69	S62-A66 WeakPolarHBondContact O-CB 3.31Å; S62-A66 PolarHBondContact O-N 3.18Å; S62-A66 VanDerWaalsContact O-N 3.12Å; K63-A66 PolarHBondContact O-N 2.94Å; D64-A66 VanDerWaalsContact C-N 3.29Å; D64-A66 PolarHBondContact O-N 3.35Å; A66-P69 WeakPolarHBondContact O-CD 3.22Å
67	L	95	Very high	91.2	Very high	105 Å²	105	59.4 Å²	59.4	55%	0.55	33%	0.328	S	S	.	.	H	α-helix	trans	-81.1	-21.7	177.3	-71.7	173.8	0	0	0	112.8	K63 D64 P69 F70 L71	K63-L67 WeakPolarHBondContact O-CB 3.1Å; K63-L67 WeakPolarHBondContact O-CG 3.26Å; K63-L67 PolarHBondContact O-N 3.15Å; D64-L67 PolarHBondContact O-N 2.66Å; L67-P69 VanDerWaalsContact C-CD 3.48Å; L67-F70 WeakPolarHBondContact O-CB 3.5Å; L67-F70 PolarHBondContact O-N 3.31Å; L67-L71 PolarHBondContact O-N 3.5Å
68	F	94.3	Very high	92	Very high	90 Å²	90	60.2 Å²	60.2	40%	0.395	34%	0.339	S	S	.	.	H	α-helix	trans	-51.4	-46	-175.7	-163.1	-87.6	0	0	0	114.3	D64 F70 L71 A72 L209 L213	D64-F68 WeakPolarHBondContact O-CB 3.39Å; D64-F68 PolarHBondContact O-N 2.83Å; F68-F70 VanDerWaalsContact C-N 3.29Å; F68-F70 PolarHBondContact O-N 3.43Å; F68-L71 PolarHBondContact O-N 3.41Å; F68-A72 VanDerWaalsContact O-CB 3.3Å; F68-A72 WeakPolarHBondContact O-CB 3.25Å; F68-A72 PolarHBondContact O-N 3Å; F68-L209 HydrophobicContact CB-CD1 3.64Å; F68-L209 HydrophobicContact CD1-CD1 3.69Å; F68-L209 HydrophobicContact CD2-CD1 4.21Å; F68-L209 HydrophobicContact CE1-CD1 4.4Å; F68-L209 HydrophobicContact CG-CD1 3.58Å; F68-L213 HydrophobicContact CD1-CD1 3.85Å; F68-L213 HydrophobicContact CD1-CD2 3.84Å; F68-L213 HydrophobicContact CD1-CG 4.03Å; F68-L213 HydrophobicContact CE1-CD1 3.87Å; F68-L213 HydrophobicContact CE1-CD2 3.98Å; F68-L213 HydrophobicContact CE1-CG 4.37Å
69	P	94.4	Very high	92.4	Very high	14 Å²	14	56.9 Å²	56.9	9%	0.091	33%	0.325	C	S	.	.	H	α-helix	trans	-63.4	-33.8	178.1	-20.8	33.8	0	0	0	113.3	A66 L67 S73 G212	A66-P69 WeakPolarHBondContact O-CD 3.22Å; L67-P69 VanDerWaalsContact C-CD 3.48Å; P69-S73 VanDerWaalsContact O-CB 3.29Å; P69-S73 WeakPolarHBondContact O-CB 3.5Å; P69-S73 PolarHBondContact O-N 2.65Å; P69-S73 PolarHBondContact O-OG 2.64Å; P69-G212 VanDerWaalsContact CG-CA 3.47Å
70	F	95.6	Very high	92.7	Very high	147 Å²	147	59.8 Å²	59.8	65%	0.645	33%	0.333	S	S	*	.	H	α-helix	trans	-72.6	-42.6	177.2	-63.1	-80.9	0	0	0	111	L67 F68 S73 A74	L67-F70 WeakPolarHBondContact O-CB 3.5Å; L67-F70 PolarHBondContact O-N 3.31Å; F68-F70 VanDerWaalsContact C-N 3.29Å; F68-F70 PolarHBondContact O-N 3.43Å; F70-S73 WeakPolarHBondContact O-CB 3.27Å; F70-S73 PolarHBondContact O-N 2.94Å; F70-A74 WeakPolarHBondContact O-CB 3.42Å; F70-A74 PolarHBondContact O-N 3.37Å
71	L	94.3	Very high	93	Very high	123 Å²	123	62.3 Å²	62.3	64%	0.644	35%	0.345	S	S	*	.	H	α-helix	trans	-63.9	-44.1	175.4	-175.9	61.8	0	0	0	111.3	L67 F68 S73 A74 A75	L67-L71 PolarHBondContact O-N 3.5Å; F68-L71 PolarHBondContact O-N 3.41Å; L71-S73 VanDerWaalsContact C-N 3.29Å; L71-S73 PolarHBondContact O-N 3.14Å; L71-A74 PolarHBondContact O-N 3.33Å; L71-A75 WeakPolarHBondContact O-CB 3.47Å; L71-A75 PolarHBondContact O-N 3.4Å
72	A	93	Very high	93.1	Very high	21 Å²	21	64.3 Å²	64.3	17%	0.174	36%	0.356	C	S	.	.	H	α-helix	trans	-61.3	-37.6	174.3	0	0	0	0	0	112	F68 L76 Y216	F68-A72 VanDerWaalsContact O-CB 3.3Å; F68-A72 WeakPolarHBondContact O-CB 3.25Å; F68-A72 PolarHBondContact O-N 3Å; A72-L76 VanDerWaalsContact O-CB 3.25Å; A72-L76 WeakPolarHBondContact O-CB 3.47Å; A72-L76 PolarHBondContact O-N 2.99Å; A72-Y216 HydrophobicContact CB-CD2 4.28Å; A72-Y216 HydrophobicContact CB-CE2 3.76Å
73	S	94.8	Very high	93.1	Very high	30 Å²	30	63.5 Å²	63.5	21%	0.21	35%	0.348	C	S	.	.	H	α-helix	trans	-66.7	-45.4	175.7	-64.8	0	0	0	0	111.9	P69 F70 L71 L76 F77 Y216 W220	P69-S73 VanDerWaalsContact O-CB 3.29Å; P69-S73 WeakPolarHBondContact O-CB 3.5Å; P69-S73 PolarHBondContact O-N 2.65Å; P69-S73 PolarHBondContact O-OG 2.64Å; F70-S73 WeakPolarHBondContact O-CB 3.27Å; F70-S73 PolarHBondContact O-N 2.94Å; L71-S73 VanDerWaalsContact C-N 3.29Å; L71-S73 PolarHBondContact O-N 3.14Å; S73-L76 PolarHBondContact O-N 3.01Å; S73-F77 WeakPolarHBondContact O-CB 3.44Å; S73-F77 PolarHBondContact O-N 3.14Å; S73-Y216 VanDerWaalsContact OG-CD2 3.29Å; S73-Y216 WeakPolarHBondContact OG-CD2 3.42Å; S73-Y216 WeakPolarHBondContact OG-CE2 3.28Å; S73-W220 PolarHBondContact OG-NE1 2.94Å
74	A	95.7	Very high	92.9	Very high	64 Å²	64	66.7 Å²	66.7	53%	0.529	36%	0.361	S	S	.	.	H	α-helix	trans	-63.1	-42.6	176.4	0	0	0	0	0	111.5	F70 L71 G78	F70-A74 WeakPolarHBondContact O-CB 3.42Å; F70-A74 PolarHBondContact O-N 3.37Å; L71-A74 PolarHBondContact O-N 3.33Å; A74-G78 WeakPolarHBondContact O-CA 3.47Å; A74-G78 PolarHBondContact O-N 3.43Å
75	A	92.8	Very high	93	Very high	53 Å²	53	70.6 Å²	70.6	44%	0.438	38%	0.375	S	S	.	.	H	α-helix	trans	-64	-48.3	177.3	0	0	0	0	0	112	L71 G78 I79	L71-A75 WeakPolarHBondContact O-CB 3.47Å; L71-A75 PolarHBondContact O-N 3.4Å; A75-G78 PolarHBondContact O-N 2.98Å; A75-I79 WeakPolarHBondContact O-CG1 3.41Å; A75-I79 PolarHBondContact O-N 3.21Å
76	L	92.3	Very high	92.9	Very high	20 Å²	20	73.2 Å²	73.2	11%	0.105	39%	0.391	C	S	.	.	H	α-helix	trans	-64.5	-46.4	179.7	-177.4	150.6	0	0	0	111.5	A72 S73 I79 Y80 Y216 W220 V226 M227	A72-L76 VanDerWaalsContact O-CB 3.25Å; A72-L76 WeakPolarHBondContact O-CB 3.47Å; A72-L76 PolarHBondContact O-N 2.99Å; S73-L76 PolarHBondContact O-N 3.01Å; L76-I79 PolarHBondContact O-N 3.39Å; L76-Y80 PolarHBondContact O-N 3.42Å; L76-Y216 WeakPolarHBondContact CD1-OH 3.32Å; L76-W220 HydrophobicContact CD2-CD2 3.82Å; L76-W220 HydrophobicContact CD2-CE3 3.44Å; L76-W220 VanDerWaalsContact CD2-CE3 3.44Å; L76-W220 HydrophobicContact CD2-CH2 4.02Å; L76-W220 HydrophobicContact CD2-CZ2 4.32Å; L76-W220 HydrophobicContact CD2-CZ3 3.57Å; L76-V226 HydrophobicContact CD2-CB 4.13Å; L76-V226 HydrophobicContact CD2-CG1 3.36Å; L76-M227 HydrophobicContact CD1-CB 4.23Å; L76-M227 HydrophobicContact CD1-CG 4.28Å
77	F	93.9	Very high	92.8	Very high	99 Å²	99	74.8 Å²	74.8	43%	0.434	40%	0.397	S	S	.	.	H	α-helix	trans	-65.7	-38.5	176.8	-173.2	-115.7	0	0	0	112.2	S73 Y80 I81 W220	S73-F77 WeakPolarHBondContact O-CB 3.44Å; S73-F77 PolarHBondContact O-N 3.14Å; F77-Y80 HydrophobicContact CD2-CD1 4.47Å; F77-Y80 HydrophobicContact CE2-CD1 4.48Å; F77-Y80 WeakPolarHBondContact O-CB 3.38Å; F77-Y80 PolarHBondContact O-N 2.89Å; F77-I81 HydrophobicContact CD1-CD1 3.79Å; F77-I81 HydrophobicContact CE1-CD1 3.37Å; F77-I81 HydrophobicContact CE1-CG1 4.23Å; F77-I81 HydrophobicContact CZ-CD1 3.77Å; F77-I81 HydrophobicContact CZ-CG1 4.23Å; F77-I81 WeakPolarHBondContact O-CG1 3.18Å; F77-I81 PolarHBondContact O-N 2.88Å; F77-W220 HydrophobicContact CB-CH2 3.91Å; F77-W220 HydrophobicContact CB-CZ2 4.46Å; F77-W220 HydrophobicContact CD2-CH2 4.14Å; F77-W220 HydrophobicContact CG-CH2 4.38Å
78	G	93.3	Very high	92.5	Very high	31 Å²	31	73.1 Å²	73.1	32%	0.32	39%	0.388	S	S	.	.	H	α-helix	trans	-59.8	-48.9	174.9	0	0	0	0	0	111.9	A74 A75 Y80 I81 V82	A74-G78 WeakPolarHBondContact O-CA 3.47Å; A74-G78 PolarHBondContact O-N 3.43Å; A75-G78 PolarHBondContact O-N 2.98Å; G78-Y80 VanDerWaalsContact C-N 3.3Å; G78-Y80 PolarHBondContact O-N 3.44Å; G78-I81 PolarHBondContact O-N 3.19Å; G78-V82 WeakPolarHBondContact O-CG2 3.45Å; G78-V82 PolarHBondContact O-N 3.2Å
79	I	90.7	Very high	92.3	Very high	59 Å²	59	76.4 Å²	76.4	30%	0.303	40%	0.404	S	S	.	.	H	α-helix	trans	-61.1	-40.6	175.6	-70	168.5	0	0	0	111.1	A75 L76 I81 V82 F83 V230	A75-I79 WeakPolarHBondContact O-CG1 3.41Å; A75-I79 PolarHBondContact O-N 3.21Å; L76-I79 PolarHBondContact O-N 3.39Å; I79-I81 PolarHBondContact O-N 3.4Å; I79-V82 WeakPolarHBondContact O-CB 3.48Å; I79-V82 PolarHBondContact O-N 3.18Å; I79-F83 HydrophobicContact CG2-CD2 3.73Å; I79-F83 HydrophobicContact CG2-CE2 3.41Å; I79-F83 VanDerWaalsContact CG2-CE2 3.41Å; I79-F83 HydrophobicContact CG2-CZ 4.35Å; I79-F83 VanDerWaalsContact O-CD2 3.3Å; I79-F83 WeakPolarHBondContact O-CD2 3.36Å; I79-F83 PolarHBondContact O-N 3.15Å; I79-V230 HydrophobicContact CG2-CG1 4.04Å; I79-V230 HydrophobicContact CG2-CG2 4.32Å
80	Y	91.5	Very high	92.1	Very high	90 Å²	90	82.9 Å²	82.9	35%	0.353	43%	0.428	S	S	.	.	H	α-helix	trans	-61.1	-42.6	176.2	177.5	-107.4	0	0	0	112.9	L76 F77 G78 V82 F83 K84 V226 A229 V230	L76-Y80 PolarHBondContact O-N 3.42Å; F77-Y80 HydrophobicContact CD2-CD1 4.47Å; F77-Y80 HydrophobicContact CE2-CD1 4.48Å; F77-Y80 WeakPolarHBondContact O-CB 3.38Å; F77-Y80 PolarHBondContact O-N 2.89Å; G78-Y80 VanDerWaalsContact C-N 3.3Å; G78-Y80 PolarHBondContact O-N 3.44Å; Y80-V82 VanDerWaalsContact C-N 3.32Å; Y80-V82 PolarHBondContact O-N 3.43Å; Y80-F83 PolarHBondContact O-N 3.49Å; Y80-K84 PolarHBondContact O-N 2.86Å; Y80-V226 HydrophobicContact CD1-CG1 4.01Å; Y80-V226 HydrophobicContact CD1-CG2 4.21Å; Y80-V226 HydrophobicContact CD2-CB 4.44Å; Y80-V226 HydrophobicContact CD2-CG1 3.71Å; Y80-V226 HydrophobicContact CD2-CG2 4.48Å; Y80-V226 HydrophobicContact CE1-CG2 4.16Å; Y80-V226 HydrophobicContact CE2-CG1 4.4Å; Y80-V226 HydrophobicContact CE2-CG2 4.43Å; Y80-V226 HydrophobicContact CG-CB 4.47Å; Y80-V226 HydrophobicContact CG-CG1 3.48Å; Y80-V226 VanDerWaalsContact CG-CG1 3.48Å; Y80-V226 HydrophobicContact CG-CG2 4.37Å; Y80-A229 HydrophobicContact CD2-CB 4.19Å; Y80-A229 HydrophobicContact CE2-CB 3.92Å; Y80-V230 HydrophobicContact CD2-CG2 4.48Å
81	I	92.7	Very high	91.8	Very high	67 Å²	67	76.8 Å²	76.8	34%	0.344	40%	0.402	S	S	.	.	H	α-helix	trans	-61.1	-44.2	173.4	-72.3	173.7	0	0	0	110.4	F77 G78 I79 F83 K84 F85	F77-I81 HydrophobicContact CD1-CD1 3.79Å; F77-I81 HydrophobicContact CE1-CD1 3.37Å; F77-I81 HydrophobicContact CE1-CG1 4.23Å; F77-I81 HydrophobicContact CZ-CD1 3.77Å; F77-I81 HydrophobicContact CZ-CG1 4.23Å; F77-I81 WeakPolarHBondContact O-CG1 3.18Å; F77-I81 PolarHBondContact O-N 2.88Å; G78-I81 PolarHBondContact O-N 3.19Å; I79-I81 PolarHBondContact O-N 3.4Å; I81-F83 VanDerWaalsContact C-N 3.32Å; I81-F83 PolarHBondContact O-N 3.03Å; I81-K84 VanDerWaalsContact O-CB 3.29Å; I81-K84 WeakPolarHBondContact O-CB 3.3Å; I81-K84 PolarHBondContact O-N 3.24Å; I81-F85 HydrophobicContact CG2-CD2 3.81Å; I81-F85 HydrophobicContact CG2-CE2 3.69Å; I81-F85 VanDerWaalsContact O-CD2 3.25Å; I81-F85 WeakPolarHBondContact O-CD2 3.24Å; I81-F85 PolarHBondContact O-N 2.73Å
82	V	92.4	Very high	91.6	Very high	68 Å²	68	72.1 Å²	72.1	41%	0.412	38%	0.378	S	S	.	.	H	α-helix	trans	-59.5	-42.6	178.2	173.5	0	0	0	0	111.2	G78 I79 Y80 K84 F85 V86 I91	G78-V82 WeakPolarHBondContact O-CG2 3.45Å; G78-V82 PolarHBondContact O-N 3.2Å; I79-V82 WeakPolarHBondContact O-CB 3.48Å; I79-V82 PolarHBondContact O-N 3.18Å; Y80-V82 VanDerWaalsContact C-N 3.32Å; Y80-V82 PolarHBondContact O-N 3.43Å; V82-K84 PolarHBondContact O-N 3.18Å; V82-F85 PolarHBondContact O-N 2.92Å; V82-F85 VanDerWaalsContact O-N 3.09Å; V82-V86 HydrophobicContact CG1-CB 4.22Å; V82-V86 HydrophobicContact CG1-CG2 4.09Å; V82-V86 WeakPolarHBondContact O-CB 3.36Å; V82-V86 PolarHBondContact O-N 3.49Å; V82-I91 HydrophobicContact CG1-CD1 3.84Å; V82-I91 HydrophobicContact CG1-CG1 4.09Å
83	F	89.3	Confident	91.4	Very high	27 Å²	27	74.2 Å²	74.2	12%	0.118	39%	0.39	C	S	.	.	H	α-helix	trans	-59.5	-25.8	174.4	-81.5	-57.4	0	0	0	114	I79 Y80 I81 I88 I91 V230 N233 L234	I79-F83 HydrophobicContact CG2-CD2 3.73Å; I79-F83 HydrophobicContact CG2-CE2 3.41Å; I79-F83 VanDerWaalsContact CG2-CE2 3.41Å; I79-F83 HydrophobicContact CG2-CZ 4.35Å; I79-F83 VanDerWaalsContact O-CD2 3.3Å; I79-F83 WeakPolarHBondContact O-CD2 3.36Å; I79-F83 PolarHBondContact O-N 3.15Å; Y80-F83 PolarHBondContact O-N 3.49Å; I81-F83 VanDerWaalsContact C-N 3.32Å; I81-F83 PolarHBondContact O-N 3.03Å; F83-I88 HydrophobicContact CD1-CG1 3.99Å; F83-I88 HydrophobicContact CE1-CG1 4.29Å; F83-I88 HydrophobicContact CE1-CG2 4.38Å; F83-I91 HydrophobicContact CB-CD1 4.4Å; F83-I91 HydrophobicContact CD1-CD1 3.17Å; F83-I91 HydrophobicContact CD1-CG1 4.44Å; F83-I91 HydrophobicContact CE1-CB 4Å; F83-I91 HydrophobicContact CE1-CD1 3.48Å; F83-I91 VanDerWaalsContact CE1-CD1 3.48Å; F83-I91 HydrophobicContact CE1-CG1 4.36Å; F83-I91 HydrophobicContact CE1-CG2 3.72Å; F83-I91 HydrophobicContact CG-CD1 3.89Å; F83-I91 HydrophobicContact CZ-CD1 4.43Å; F83-I91 HydrophobicContact CZ-CG2 3.93Å; F83-V230 HydrophobicContact CD2-CG2 4.37Å; F83-V230 HydrophobicContact CE2-CG1 4.3Å; F83-V230 HydrophobicContact CE2-CG2 4.43Å; F83-N233 HydrophobicContact CD1-CB 4.19Å; F83-N233 HydrophobicContact CE1-CB 3.83Å; F83-N233 HydrophobicContact CE2-CB 4.27Å; F83-N233 HydrophobicContact CZ-CB 3.87Å; F83-L234 HydrophobicContact CE2-CB 4.45Å; F83-L234 HydrophobicContact CE2-CD1 4.44Å; F83-L234 HydrophobicContact CZ-CB 4.08Å; F83-L234 HydrophobicContact CZ-CD1 3.85Å
84	K	88.3	Confident	91.3	Very high	168 Å²	168	77.4 Å²	77.4	73%	0.73	41%	0.409	S	S	*	.	H	α-helix	trans	-76	-29.4	177.4	-168.4	174.8	-179.8	177.8	0	112.7	Y80 I81 V82	Y80-K84 PolarHBondContact O-N 2.86Å; I81-K84 VanDerWaalsContact O-CB 3.29Å; I81-K84 WeakPolarHBondContact O-CB 3.3Å; I81-K84 PolarHBondContact O-N 3.24Å; V82-K84 PolarHBondContact O-N 3.18Å
85	F	91.4	Very high	91	Very high	162 Å²	162	76.4 Å²	76.4	71%	0.711	39%	0.393	S	S	*	.	H	α-helix	trans	-104	-27.2	-175.6	-67.7	-69.3	0	0	0	113.7	I81 V82	I81-F85 HydrophobicContact CG2-CD2 3.81Å; I81-F85 HydrophobicContact CG2-CE2 3.69Å; I81-F85 VanDerWaalsContact O-CD2 3.25Å; I81-F85 WeakPolarHBondContact O-CD2 3.24Å; I81-F85 PolarHBondContact O-N 2.73Å; V82-F85 PolarHBondContact O-N 2.92Å; V82-F85 VanDerWaalsContact O-N 3.09Å
86	V	92.2	Very high	90.9	Very high	56 Å²	56	76 Å²	76	34%	0.339	38%	0.382	S	S	.	.	S	Bend	trans	-114.8	129.8	-174.9	-177.2	0	0	0	0	109.5	V82 I88 I91	V82-V86 HydrophobicContact CG1-CB 4.22Å; V82-V86 HydrophobicContact CG1-CG2 4.09Å; V82-V86 WeakPolarHBondContact O-CB 3.36Å; V82-V86 PolarHBondContact O-N 3.49Å; V86-I88 PolarHBondContact O-N 3.05Å; V86-I91 HydrophobicContact CB-CD1 4.05Å; V86-I91 HydrophobicContact CB-CG1 4.11Å; V86-I91 HydrophobicContact CG1-CD1 4.29Å; V86-I91 HydrophobicContact CG1-CG1 3.85Å; V86-I91 WeakPolarHBondContact O-CD1 3.21Å
87	P	91.7	Very high	91	Very high	76 Å²	76	78.4 Å²	78.4	49%	0.494	40%	0.397	S	S	.	.			trans	-56	137.2	175.3	-24.1	31.5	0	0	0	112.5	Q89 Y90 I91	P87-Q89 PolarHBondContact O-N 3.25Å; P87-Y90 HydrophobicContact CB-CD2 3.75Å; P87-Y90 HydrophobicContact CB-CE2 4.09Å; P87-Y90 HydrophobicContact CG-CD2 3.82Å; P87-Y90 HydrophobicContact CG-CE2 3.92Å; P87-Y90 PolarHBondContact O-N 3.4Å; P87-I91 PolarHBondContact O-N 3.33Å
88	I	88.5	Confident	90.9	Very high	70 Å²	70	79.5 Å²	79.5	36%	0.359	40%	0.399	S	S	.	.	H	α-helix	trans	-52.5	-34.2	-175.4	-63.8	158.2	0	0	0	112.5	F83 V86 Y90 I91 N92 N233	F83-I88 HydrophobicContact CD1-CG1 3.99Å; F83-I88 HydrophobicContact CE1-CG1 4.29Å; F83-I88 HydrophobicContact CE1-CG2 4.38Å; V86-I88 PolarHBondContact O-N 3.05Å; I88-Y90 PolarHBondContact O-N 3.07Å; I88-I91 PolarHBondContact O-N 3.18Å; I88-N92 VanDerWaalsContact CG2-ND2 3.34Å; I88-N92 WeakPolarHBondContact CG2-ND2 3.37Å; I88-N92 WeakPolarHBondContact O-CB 3.37Å; I88-N92 PolarHBondContact O-N 3.47Å; I88-N233 HydrophobicContact CD1-CB 4.41Å; I88-N233 VanDerWaalsContact CD1-OD1 3.26Å; I88-N233 WeakPolarHBondContact CD1-OD1 3.47Å; I88-N233 HydrophobicContact CG1-CB 4.39Å; I88-N233 HydrophobicContact CG2-CB 4.39Å
89	Q	89.5	Confident	90.9	Very high	159 Å²	159	79.1 Å²	79.1	74%	0.743	39%	0.389	S	S	*	.	H	α-helix	trans	-61.8	-40.8	180	-64	178.7	-3	0	0	112.6	P87 C93	P87-Q89 PolarHBondContact O-N 3.25Å; Q89-C93 VanDerWaalsContact O-CB 3.26Å; Q89-C93 WeakPolarHBondContact O-CB 3.25Å; Q89-C93 PolarHBondContact O-N 2.9Å
90	Y	91.3	Very high	90.9	Very high	151 Å²	151	77.2 Å²	77.2	59%	0.592	38%	0.381	S	S	*	.	H	α-helix	trans	-71.6	-39.8	178.9	-63.1	-64.7	0	0	0	111.3	P87 I88 C93 V94	P87-Y90 HydrophobicContact CB-CD2 3.75Å; P87-Y90 HydrophobicContact CB-CE2 4.09Å; P87-Y90 HydrophobicContact CG-CD2 3.82Å; P87-Y90 HydrophobicContact CG-CE2 3.92Å; P87-Y90 PolarHBondContact O-N 3.4Å; I88-Y90 PolarHBondContact O-N 3.07Å; Y90-C93 WeakPolarHBondContact O-CB 3.46Å; Y90-C93 PolarHBondContact O-N 3.46Å; Y90-V94 WeakPolarHBondContact O-CG2 3.42Å; Y90-V94 PolarHBondContact O-N 2.88Å
91	I	88.8	Confident	91	Very high	18 Å²	18	79.8 Å²	79.8	9%	0.092	39%	0.394	C	S	.	.	H	α-helix	trans	-61.5	-51.1	176.1	-62.9	165.6	0	0	0	109.9	V82 F83 V86 P87 I88 C93 V94 M95 L234	V82-I91 HydrophobicContact CG1-CD1 3.84Å; V82-I91 HydrophobicContact CG1-CG1 4.09Å; F83-I91 HydrophobicContact CB-CD1 4.4Å; F83-I91 HydrophobicContact CD1-CD1 3.17Å; F83-I91 HydrophobicContact CD1-CG1 4.44Å; F83-I91 HydrophobicContact CE1-CB 4Å; F83-I91 HydrophobicContact CE1-CD1 3.48Å; F83-I91 VanDerWaalsContact CE1-CD1 3.48Å; F83-I91 HydrophobicContact CE1-CG1 4.36Å; F83-I91 HydrophobicContact CE1-CG2 3.72Å; F83-I91 HydrophobicContact CG-CD1 3.89Å; F83-I91 HydrophobicContact CZ-CD1 4.43Å; F83-I91 HydrophobicContact CZ-CG2 3.93Å; V86-I91 HydrophobicContact CB-CD1 4.05Å; V86-I91 HydrophobicContact CB-CG1 4.11Å; V86-I91 HydrophobicContact CG1-CD1 4.29Å; V86-I91 HydrophobicContact CG1-CG1 3.85Å; V86-I91 WeakPolarHBondContact O-CD1 3.21Å; P87-I91 PolarHBondContact O-N 3.33Å; I88-I91 PolarHBondContact O-N 3.18Å; I91-C93 VanDerWaalsContact C-N 3.28Å; I91-C93 PolarHBondContact O-N 2.99Å; I91-V94 PolarHBondContact O-N 3.44Å; I91-M95 HydrophobicContact CG2-CG 4.16Å; I91-M95 WeakPolarHBondContact O-CB 3.44Å; I91-M95 WeakPolarHBondContact O-CG 3.36Å; I91-M95 PolarHBondContact O-N 3.15Å; I91-L234 HydrophobicContact CG2-CD1 4.33Å
92	N	88.9	Confident	91	Very high	26 Å²	26	80.3 Å²	80.3	14%	0.139	40%	0.396	C	S	.	.	H	α-helix	trans	-63.3	-34.4	178.4	-75.6	-26.6	0	0	0	112.1	I88 K96 N233 D235	I88-N92 VanDerWaalsContact CG2-ND2 3.34Å; I88-N92 WeakPolarHBondContact CG2-ND2 3.37Å; I88-N92 WeakPolarHBondContact O-CB 3.37Å; I88-N92 PolarHBondContact O-N 3.47Å; N92-K96 VanDerWaalsContact O-CB 3.24Å; N92-K96 WeakPolarHBondContact O-CB 3.2Å; N92-K96 WeakPolarHBondContact O-CG 3.48Å; N92-K96 PolarHBondContact O-N 3.28Å; N92-N233 PolarHBondContact ND2-O 2.93Å; N92-N233 PolarHBondContact OD1-O 2.87Å; N92-D235 PolarHBondContact OD1-N 2.89Å
93	C	90.2	Very high	91	Very high	64 Å²	64	77 Å²	77	43%	0.432	38%	0.376	S	S	.	.	H	α-helix	trans	-62.4	-53.2	174	-176.1	0	0	0	0	111.7	Q89 Y90 I91 M95 K96 V97	Q89-C93 VanDerWaalsContact O-CB 3.26Å; Q89-C93 WeakPolarHBondContact O-CB 3.25Å; Q89-C93 PolarHBondContact O-N 2.9Å; Y90-C93 WeakPolarHBondContact O-CB 3.46Å; Y90-C93 PolarHBondContact O-N 3.46Å; I91-C93 VanDerWaalsContact C-N 3.28Å; I91-C93 PolarHBondContact O-N 2.99Å; C93-M95 VanDerWaalsContact C-N 3.33Å; C93-M95 PolarHBondContact O-N 3.29Å; C93-K96 PolarHBondContact O-N 2.86Å; C93-V97 WeakPolarHBondContact O-CG2 3.38Å; C93-V97 PolarHBondContact O-N 2.9Å; C93-V97 VanDerWaalsContact O-N 3.07Å
94	V	91.9	Very high	91.2	Very high	98 Å²	98	76.5 Å²	76.5	59%	0.594	38%	0.376	S	S	*	.	H	α-helix	trans	-59.2	-45.8	179.1	171.7	0	0	0	0	110.8	Y90 I91 K96 V97 Y98	Y90-V94 WeakPolarHBondContact O-CG2 3.42Å; Y90-V94 PolarHBondContact O-N 2.88Å; I91-V94 PolarHBondContact O-N 3.44Å; V94-K96 PolarHBondContact O-N 3.06Å; V94-V97 PolarHBondContact O-N 3.27Å; V94-Y98 PolarHBondContact O-N 3.43Å
95	M	89.8	Confident	91.3	Very high	42 Å²	42	70.8 Å²	70.8	21%	0.207	36%	0.357	C	S	.	.	H	α-helix	trans	-68.5	-35.6	-179.2	-61.2	-70.4	-83.9	0	0	112.2	I91 C93 Y98 F99 L234 I236	I91-M95 HydrophobicContact CG2-CG 4.16Å; I91-M95 WeakPolarHBondContact O-CB 3.44Å; I91-M95 WeakPolarHBondContact O-CG 3.36Å; I91-M95 PolarHBondContact O-N 3.15Å; C93-M95 VanDerWaalsContact C-N 3.33Å; C93-M95 PolarHBondContact O-N 3.29Å; M95-Y98 PolarHBondContact O-N 3.43Å; M95-F99 HydrophobicContact CB-CD2 4.41Å; M95-F99 HydrophobicContact CE-CD2 4.41Å; M95-F99 HydrophobicContact CE-CE2 3.67Å; M95-F99 WeakPolarHBondContact O-CB 3.43Å; M95-F99 WeakPolarHBondContact O-CD2 3.29Å; M95-F99 PolarHBondContact O-N 3.04Å; M95-F99 HydrophobicContact SD-CE2 4.46Å; M95-L234 HydrophobicContact CE-CD1 4.13Å; M95-L234 HydrophobicContact CG-CD1 4.28Å; M95-I236 HydrophobicContact CB-CG2 3.5Å; M95-I236 HydrophobicContact CE-CD1 3.56Å; M95-I236 HydrophobicContact CG-CG2 4.4Å
96	K	91.1	Very high	91.4	Very high	44 Å²	44	63.5 Å²	63.5	19%	0.191	33%	0.327	C	S	.	.	H	α-helix	trans	-62.5	-43.2	173.8	-81.5	179	-178.6	-173.5	0	111.9	N92 C93 V94 S100 Y174 Y175 D235	N92-K96 VanDerWaalsContact O-CB 3.24Å; N92-K96 WeakPolarHBondContact O-CB 3.2Å; N92-K96 WeakPolarHBondContact O-CG 3.48Å; N92-K96 PolarHBondContact O-N 3.28Å; C93-K96 PolarHBondContact O-N 2.86Å; V94-K96 PolarHBondContact O-N 3.06Å; K96-S100 WeakPolarHBondContact O-CB 3.41Å; K96-S100 PolarHBondContact O-N 3.16Å; K96-S100 PolarHBondContact O-OG 3.25Å; K96-S100 VanDerWaalsContact O-OG 3.08Å; K96-Y174 HydrophobicContact CB-CE1 4.5Å; K96-Y174 HydrophobicContact CG-CE1 4.3Å; K96-Y175 HydrophobicContact CB-CD2 4.31Å; K96-D235 WeakPolarHBondContact CE-OD2 3.28Å; K96-D235 IonicContact NZ-OD2 2.84Å; K96-D235 PolarHBondContact NZ-OD2 2.77Å
97	V	92.6	Very high	91.4	Very high	71 Å²	71	60.8 Å²	60.8	43%	0.43	31%	0.311	S	S	.	.	H	α-helix	trans	-59.1	-54.2	173.5	175.7	0	0	0	0	110.1	C93 V94 F99 S100 F101 Y175	C93-V97 WeakPolarHBondContact O-CG2 3.38Å; C93-V97 PolarHBondContact O-N 2.9Å; C93-V97 VanDerWaalsContact O-N 3.07Å; V94-V97 PolarHBondContact O-N 3.27Å; V97-F99 PolarHBondContact O-N 3.27Å; V97-S100 PolarHBondContact O-N 3.39Å; V97-S100 PolarHBondContact O-OG 3.41Å; V97-F101 PolarHBondContact O-N 2.66Å; V97-F101 VanDerWaalsContact O-N 3.17Å; V97-Y175 HydrophobicContact CG2-CD2 4.35Å; V97-Y175 HydrophobicContact CG2-CE2 3.58Å
98	Y	92.8	Very high	91.4	Very high	122 Å²	122	58 Å²	58	48%	0.478	29%	0.293	S	S	.	.	H	α-helix	trans	-56.7	-51.4	-179.1	174.4	-96.3	0	0	0	112.8	V94 M95 F101 M102	V94-Y98 PolarHBondContact O-N 3.43Å; M95-Y98 PolarHBondContact O-N 3.43Å; Y98-F101 PolarHBondContact O-N 2.94Å; Y98-M102 HydrophobicContact CE2-CE 4.29Å; Y98-M102 WeakPolarHBondContact O-CB 3.42Å; Y98-M102 PolarHBondContact O-N 2.83Å; Y98-M102 VanDerWaalsContact OH-CE 3.28Å; Y98-M102 WeakPolarHBondContact OH-CE 3.36Å
99	F	92.3	Very high	91.4	Very high	24 Å²	24	60.6 Å²	60.6	11%	0.105	30%	0.298	C	S	.	.	H	α-helix	trans	-74.7	-24.9	-177.5	-82.2	-73.7	0	0	0	113.9	M95 V97 G103 Y174 I236 P237 I238	M95-F99 HydrophobicContact CB-CD2 4.41Å; M95-F99 HydrophobicContact CE-CD2 4.41Å; M95-F99 HydrophobicContact CE-CE2 3.67Å; M95-F99 WeakPolarHBondContact O-CB 3.43Å; M95-F99 WeakPolarHBondContact O-CD2 3.29Å; M95-F99 PolarHBondContact O-N 3.04Å; M95-F99 HydrophobicContact SD-CE2 4.46Å; V97-F99 PolarHBondContact O-N 3.27Å; F99-G103 WeakPolarHBondContact O-CA 3.47Å; F99-G103 PolarHBondContact O-N 3.27Å; F99-Y174 HydrophobicContact CB-CE1 4.34Å; F99-I236 HydrophobicContact CD2-CB 4.02Å; F99-I236 HydrophobicContact CD2-CD1 4.19Å; F99-I236 HydrophobicContact CD2-CG2 4.29Å; F99-I236 HydrophobicContact CE2-CB 4.42Å; F99-I236 HydrophobicContact CE2-CD1 3.72Å; F99-I236 HydrophobicContact CZ-CD1 4.31Å; F99-P237 HydrophobicContact CB-CG 3.56Å; F99-P237 HydrophobicContact CD1-CG 3.78Å; F99-P237 HydrophobicContact CG-CG 3.81Å; F99-I238 HydrophobicContact CE1-CD1 4.07Å; F99-I238 HydrophobicContact CE1-CG1 3.67Å; F99-I238 HydrophobicContact CE2-CD1 3.88Å; F99-I238 HydrophobicContact CE2-CG1 4.1Å; F99-I238 HydrophobicContact CZ-CD1 3.33Å; F99-I238 HydrophobicContact CZ-CG1 3.44Å; F99-I238 VanDerWaalsContact CZ-CG1 3.44Å
100	S	92.5	Very high	91.5	Very high	19 Å²	19	54.4 Å²	54.4	13%	0.133	27%	0.269	C	S	.	.	H	α-helix	trans	-64.9	-41.6	170.1	69.3	0	0	0	0	111.5	K96 V97 A104 G171	K96-S100 WeakPolarHBondContact O-CB 3.41Å; K96-S100 PolarHBondContact O-N 3.16Å; K96-S100 PolarHBondContact O-OG 3.25Å; K96-S100 VanDerWaalsContact O-OG 3.08Å; V97-S100 PolarHBondContact O-N 3.39Å; V97-S100 PolarHBondContact O-OG 3.41Å; S100-A104 WeakPolarHBondContact O-CB 3.44Å; S100-A104 PolarHBondContact O-N 3.02Å; S100-G171 WeakPolarHBondContact CB-O 3.38Å
101	F	93	Very high	91.4	Very high	144 Å²	144	48 Å²	48	63%	0.632	25%	0.245	S	C	*	.	H	α-helix	trans	-70.4	-51.3	177.2	178.3	-100.7	0	0	0	111.3	V97 Y98 G103 A104 C105	V97-F101 PolarHBondContact O-N 2.66Å; V97-F101 VanDerWaalsContact O-N 3.17Å; Y98-F101 PolarHBondContact O-N 2.94Å; F101-G103 VanDerWaalsContact C-N 3.28Å; F101-G103 PolarHBondContact O-N 3.19Å; F101-A104 PolarHBondContact O-N 3.25Å; F101-C105 PolarHBondContact O-N 3.27Å; F101-C105 PolarHBondContact O-SG 3.44Å
102	M	91.6	Very high	91.2	Very high	77 Å²	77	48.2 Å²	48.2	38%	0.379	25%	0.248	S	C	.	.	H	α-helix	trans	-58.6	-42.2	177.1	-173.4	64.3	79.7	0	0	111.5	Y98 C105 A106	Y98-M102 HydrophobicContact CE2-CE 4.29Å; Y98-M102 WeakPolarHBondContact O-CB 3.42Å; Y98-M102 PolarHBondContact O-N 2.83Å; Y98-M102 VanDerWaalsContact OH-CE 3.28Å; Y98-M102 WeakPolarHBondContact OH-CE 3.36Å; M102-C105 PolarHBondContact O-N 3.09Å; M102-A106 WeakPolarHBondContact O-CB 3.4Å; M102-A106 PolarHBondContact O-N 3.29Å
103	G	93.1	Very high	91	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-63.9	-41.5	176.7	0	0	0	0	0	113.1	F99 F101 C105 A106 I107	F99-G103 WeakPolarHBondContact O-CA 3.47Å; F99-G103 PolarHBondContact O-N 3.27Å; F101-G103 VanDerWaalsContact C-N 3.28Å; F101-G103 PolarHBondContact O-N 3.19Å; G103-C105 VanDerWaalsContact C-N 3.34Å; G103-C105 PolarHBondContact O-N 3.4Å; G103-A106 PolarHBondContact O-N 2.97Å; G103-I107 WeakPolarHBondContact O-CB 3.33Å; G103-I107 WeakPolarHBondContact O-CD1 3.43Å; G103-I107 VanDerWaalsContact O-CG1 3.22Å; G103-I107 WeakPolarHBondContact O-CG1 3.45Å; G103-I107 PolarHBondContact O-N 3.25Å
104	A	93.1	Very high	90.8	Very high	15 Å²	15	50.5 Å²	50.5	12%	0.124	26%	0.259	C	S	.	.	H	α-helix	trans	-61.3	-43.6	174.7	0	0	0	0	0	111.8	S100 F101 I107 S108 G167	S100-A104 WeakPolarHBondContact O-CB 3.44Å; S100-A104 PolarHBondContact O-N 3.02Å; F101-A104 PolarHBondContact O-N 3.25Å; A104-I107 PolarHBondContact O-N 3.18Å; A104-S108 WeakPolarHBondContact O-CB 3.4Å; A104-S108 PolarHBondContact O-N 3.41Å; A104-G167 WeakPolarHBondContact CA-O 3.45Å; A104-G167 WeakPolarHBondContact CB-O 3.48Å
105	C	91.9	Very high	90.3	Very high	48 Å²	48	48.4 Å²	48.4	32%	0.324	24%	0.242	S	C	.	.	H	α-helix	trans	-63.2	-45.2	175.2	-68.2	0	0	0	0	112.1	F101 M102 G103 S108 R109	F101-C105 PolarHBondContact O-N 3.27Å; F101-C105 PolarHBondContact O-SG 3.44Å; M102-C105 PolarHBondContact O-N 3.09Å; G103-C105 VanDerWaalsContact C-N 3.34Å; G103-C105 PolarHBondContact O-N 3.4Å; C105-S108 PolarHBondContact O-N 2.93Å; C105-R109 PolarHBondContact O-N 3.42Å
106	A	92.3	Very high	89.9	Confident	9 Å²	9	50.6 Å²	50.6	7%	0.074	25%	0.248	C	C	.	.	H	α-helix	trans	-60.8	-46.4	177.3	0	0	0	0	0	111.6	M102 G103 S108 R109 F110 T189 V190 L193	M102-A106 WeakPolarHBondContact O-CB 3.4Å; M102-A106 PolarHBondContact O-N 3.29Å; G103-A106 PolarHBondContact O-N 2.97Å; A106-S108 VanDerWaalsContact C-N 3.35Å; A106-S108 PolarHBondContact O-N 2.94Å; A106-R109 PolarHBondContact O-N 3.28Å; A106-F110 WeakPolarHBondContact O-CB 3.44Å; A106-F110 PolarHBondContact O-N 3.05Å; A106-T189 HydrophobicContact CB-CG2 4.07Å; A106-T189 WeakPolarHBondContact O-CG2 3.46Å; A106-V190 HydrophobicContact CB-CG2 3.98Å; A106-L193 HydrophobicContact CB-CD1 3.86Å; A106-L193 WeakPolarHBondContact O-CD1 3.49Å
107	I	93.4	Very high	89.4	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-63.5	-42.1	178.1	-67.6	165.1	0	0	0	111.1	G103 A104 R109 F110 L111 I166 L170 F185 I186 T189	G103-I107 WeakPolarHBondContact O-CB 3.33Å; G103-I107 WeakPolarHBondContact O-CD1 3.43Å; G103-I107 VanDerWaalsContact O-CG1 3.22Å; G103-I107 WeakPolarHBondContact O-CG1 3.45Å; G103-I107 PolarHBondContact O-N 3.25Å; A104-I107 PolarHBondContact O-N 3.18Å; I107-R109 PolarHBondContact O-N 2.86Å; I107-F110 PolarHBondContact O-N 3.43Å; I107-L111 HydrophobicContact CG2-CD1 3.51Å; I107-L111 HydrophobicContact CG2-CG 4.12Å; I107-L111 VanDerWaalsContact O-CB 3.29Å; I107-L111 WeakPolarHBondContact O-CB 3.46Å; I107-L111 VanDerWaalsContact O-CG 3.28Å; I107-L111 WeakPolarHBondContact O-CG 3.26Å; I107-L111 PolarHBondContact O-N 3.44Å; I107-I166 HydrophobicContact CG2-CG2 4.3Å; I107-L170 HydrophobicContact CD1-CB 3.79Å; I107-L170 HydrophobicContact CD1-CD1 3.99Å; I107-L170 HydrophobicContact CG2-CD1 4.37Å; I107-F185 HydrophobicContact CD1-CD1 3.74Å; I107-F185 HydrophobicContact CD1-CE1 4.04Å; I107-F185 HydrophobicContact CG1-CD1 4.03Å; I107-F185 HydrophobicContact CG1-CE1 3.98Å; I107-F185 HydrophobicContact CG2-CE1 4.12Å; I107-I186 HydrophobicContact CD1-CG1 3.84Å; I107-T189 HydrophobicContact CG1-CG2 4.05Å
108	S	91.5	Very high	88.8	Confident	18 Å²	18	59 Å²	59	13%	0.126	29%	0.285	C	S	.	.	H	α-helix	trans	-57.6	-50	175.3	-175.7	0	0	0	0	111.7	A104 C105 A106 F110 L111 S112 T164	A104-S108 WeakPolarHBondContact O-CB 3.4Å; A104-S108 PolarHBondContact O-N 3.41Å; C105-S108 PolarHBondContact O-N 2.93Å; A106-S108 VanDerWaalsContact C-N 3.35Å; A106-S108 PolarHBondContact O-N 2.94Å; S108-F110 PolarHBondContact O-N 2.95Å; S108-L111 PolarHBondContact O-N 2.95Å; S108-S112 WeakPolarHBondContact O-CB 3.3Å; S108-S112 PolarHBondContact O-N 2.6Å; S108-T164 WeakPolarHBondContact OG-CA 3.4Å; S108-T164 PolarHBondContact OG-N 3.09Å; S108-T164 PolarHBondContact OG-OG1 2.91Å
109	R	88.3	Confident	87.8	Confident	123 Å²	123	54.6 Å²	54.6	46%	0.464	27%	0.269	S	S	.	.	H	α-helix	trans	-62.4	-40.7	177.7	-78	-177.7	150.5	158.5	-8.3	113	E56 C105 A106 I107 P113 L193	E56-R109 IonicContact OE1-NH2 2.77Å; C105-R109 PolarHBondContact O-N 3.42Å; A106-R109 PolarHBondContact O-N 3.28Å; I107-R109 PolarHBondContact O-N 2.86Å; R109-P113 WeakPolarHBondContact O-CD 3.39Å; R109-L193 HydrophobicContact CB-CD1 4.08Å
110	F	90.3	Very high	86.8	Confident	30 Å²	30	57 Å²	57	13%	0.132	29%	0.287	C	S	.	.	H	α-helix	trans	-65.6	-41.1	177.8	171.3	-98.5	0	0	0	112.5	R46 A106 I107 S108 I114 T189 I192 L193	R46-F110 VanDerWaalsContact NH1-CE2 3.25Å; R46-F110 PolarHBondContact NH1-O 3Å; A106-F110 WeakPolarHBondContact O-CB 3.44Å; A106-F110 PolarHBondContact O-N 3.05Å; I107-F110 PolarHBondContact O-N 3.43Å; S108-F110 PolarHBondContact O-N 2.95Å; F110-I114 HydrophobicContact CD1-CD1 4.38Å; F110-I114 HydrophobicContact CE1-CD1 3.83Å; F110-I114 HydrophobicContact CZ-CD1 3.96Å; F110-T189 HydrophobicContact CB-CG2 3.49Å; F110-T189 VanDerWaalsContact CB-CG2 3.49Å; F110-T189 HydrophobicContact CD1-CG2 4.41Å; F110-T189 HydrophobicContact CG-CG2 3.91Å; F110-I192 HydrophobicContact CD2-CB 4.49Å; F110-I192 HydrophobicContact CD2-CD1 4.4Å; F110-I192 HydrophobicContact CD2-CG2 4.01Å; F110-I192 HydrophobicContact CE2-CD1 3.74Å; F110-I192 HydrophobicContact CE2-CG2 3.95Å; F110-I192 HydrophobicContact CZ-CD1 4.26Å; F110-L193 HydrophobicContact CB-CD2 4.17Å; F110-L193 HydrophobicContact CB-CG 4.49Å
111	L	89.6	Confident	85.6	Confident	16 Å²	16	62 Å²	62	8%	0.084	32%	0.322	C	S	.	.	H	α-helix	trans	-82.5	-27.6	-176.2	-70.7	177.9	0	0	0	113.9	I107 S108 I114 F115 I166	I107-L111 HydrophobicContact CG2-CD1 3.51Å; I107-L111 HydrophobicContact CG2-CG 4.12Å; I107-L111 VanDerWaalsContact O-CB 3.29Å; I107-L111 WeakPolarHBondContact O-CB 3.46Å; I107-L111 VanDerWaalsContact O-CG 3.28Å; I107-L111 WeakPolarHBondContact O-CG 3.26Å; I107-L111 PolarHBondContact O-N 3.44Å; S108-L111 PolarHBondContact O-N 2.95Å; L111-I114 HydrophobicContact CD2-CD1 4.28Å; L111-I114 WeakPolarHBondContact O-CA 3.33Å; L111-I114 WeakPolarHBondContact O-CB 3.49Å; L111-I114 PolarHBondContact O-N 3.45Å; L111-F115 HydrophobicContact CB-CD2 3.9Å; L111-F115 HydrophobicContact CB-CE2 3.86Å; L111-F115 HydrophobicContact CD1-CE2 4.11Å; L111-F115 HydrophobicContact CD2-CE2 3.98Å; L111-F115 HydrophobicContact CG-CE2 4.19Å; L111-F115 WeakPolarHBondContact O-CD2 3.31Å; L111-F115 PolarHBondContact O-N 3.05Å; L111-I166 HydrophobicContact CD1-CB 3.75Å; L111-I166 HydrophobicContact CD1-CD1 4.02Å; L111-I166 HydrophobicContact CD1-CG2 3.53Å
112	S	85.9	Confident	84.1	Confident	22 Å²	22	60.9 Å²	60.9	15%	0.154	33%	0.331	C	S	.	.	H	α-helix	trans	-46.4	-56.7	178.2	166.4	0	0	0	0	113.5	S108 I114 F115 R116 D160	S108-S112 WeakPolarHBondContact O-CB 3.3Å; S108-S112 PolarHBondContact O-N 2.6Å; S112-I114 PolarHBondContact O-N 3.09Å; S112-F115 PolarHBondContact O-N 3.43Å; S112-R116 WeakPolarHBondContact O-CB 3.22Å; S112-R116 PolarHBondContact O-N 3.22Å; S112-D160 VanDerWaalsContact CB-OD1 3.23Å; S112-D160 WeakPolarHBondContact CB-OD1 3.27Å; S112-D160 PolarHBondContact OG-OD1 2.8Å
113	P	83.1	Confident	82.7	Confident	66 Å²	66	59.7 Å²	59.7	43%	0.429	33%	0.328	S	S	.	.	H	α-helix	trans	-66.3	-21.6	-179.5	26.2	-35.1	0	0	0	113.5	R109 P117	R109-P113 WeakPolarHBondContact O-CD 3.39Å; P113-P117 VanDerWaalsContact O-CD 3.27Å; P113-P117 WeakPolarHBondContact O-CD 3.47Å
114	I	86.3	Confident	81	Confident	73 Å²	73	68.2 Å²	68.2	37%	0.374	37%	0.365	S	S	.	.	H	α-helix	trans	-76.9	-41.9	178.2	-60.9	173.4	0	0	0	110.6	F110 L111 S112 P117 Y118	F110-I114 HydrophobicContact CD1-CD1 4.38Å; F110-I114 HydrophobicContact CE1-CD1 3.83Å; F110-I114 HydrophobicContact CZ-CD1 3.96Å; L111-I114 HydrophobicContact CD2-CD1 4.28Å; L111-I114 WeakPolarHBondContact O-CA 3.33Å; L111-I114 WeakPolarHBondContact O-CB 3.49Å; L111-I114 PolarHBondContact O-N 3.45Å; S112-I114 PolarHBondContact O-N 3.09Å; I114-P117 WeakPolarHBondContact O-CD 3.3Å; I114-Y118 WeakPolarHBondContact O-CD2 3.42Å; I114-Y118 WeakPolarHBondContact O-CE2 3.39Å
115	F	83	Confident	79.4	Confident	53 Å²	53	70.4 Å²	70.4	23%	0.232	37%	0.374	C	S	.	.	H	α-helix	trans	-84.7	-26.3	-178.5	-73.3	-66.6	0	0	0	113.9	L111 S112 P117 Y118 M119 I162 I166	L111-F115 HydrophobicContact CB-CD2 3.9Å; L111-F115 HydrophobicContact CB-CE2 3.86Å; L111-F115 HydrophobicContact CD1-CE2 4.11Å; L111-F115 HydrophobicContact CD2-CE2 3.98Å; L111-F115 HydrophobicContact CG-CE2 4.19Å; L111-F115 WeakPolarHBondContact O-CD2 3.31Å; L111-F115 PolarHBondContact O-N 3.05Å; S112-F115 PolarHBondContact O-N 3.43Å; F115-P117 VanDerWaalsContact C-CD 3.44Å; F115-P117 VanDerWaalsContact C-N 3.34Å; F115-Y118 PolarHBondContact O-N 3.24Å; F115-M119 PolarHBondContact O-N 3.48Å; F115-I162 HydrophobicContact CD1-CG2 4.02Å; F115-I162 HydrophobicContact CD2-CB 4.48Å; F115-I162 HydrophobicContact CD2-CG2 3.99Å; F115-I162 HydrophobicContact CE1-CG2 3.96Å; F115-I162 HydrophobicContact CE2-CG2 3.92Å; F115-I162 HydrophobicContact CG-CB 4.42Å; F115-I162 HydrophobicContact CG-CG2 4.04Å; F115-I162 HydrophobicContact CZ-CG2 3.91Å; F115-I166 HydrophobicContact CE2-CD1 3.67Å; F115-I166 HydrophobicContact CZ-CD1 3.65Å
116	R	80.2	Confident	77.8	Confident	89 Å²	89	71.3 Å²	71.3	34%	0.336	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-53.7	-39.7	-177.1	-163.3	172.1	-162.3	-108.1	11.1	114.5	S112 Y118 M119 N125 E157 K159	S112-R116 WeakPolarHBondContact O-CB 3.22Å; S112-R116 PolarHBondContact O-N 3.22Å; R116-Y118 VanDerWaalsContact C-N 3.29Å; R116-Y118 PolarHBondContact O-N 3.48Å; R116-M119 PolarHBondContact O-N 3.46Å; R116-N125 PolarHBondContact NH2-ND2 3.48Å; R116-E157 IonicContact CZ-OE1 3.25Å; R116-E157 IonicContact CZ-OE2 4Å; R116-E157 VanDerWaalsContact CZ-OE2 3.26Å; R116-E157 IonicContact NE-OE2 2.9Å; R116-E157 PolarHBondContact NE-OE2 3.17Å; R116-E157 VanDerWaalsContact NH2-CD 3.33Å; R116-E157 IonicContact NH2-OE1 3.38Å; R116-E157 PolarHBondContact NH2-OE1 3.28Å; R116-E157 IonicContact NH2-OE2 2.98Å; R116-E157 PolarHBondContact NH2-OE2 3.43Å; R116-K159 HydrophobicContact CG-CB 4.47Å; R116-K159 HydrophobicContact CG-CD 4.04Å
117	P	80.3	Confident	76	Confident	101 Å²	101	77.7 Å²	77.7	66%	0.656	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-66.6	-26.6	175.3	-21.9	34.7	0	0	0	114.3	P113 I114 F115	P113-P117 VanDerWaalsContact O-CD 3.27Å; P113-P117 WeakPolarHBondContact O-CD 3.47Å; I114-P117 WeakPolarHBondContact O-CD 3.3Å; F115-P117 VanDerWaalsContact C-CD 3.44Å; F115-P117 VanDerWaalsContact C-N 3.34Å
118	Y	80.8	Confident	74.2	Confident	189 Å²	189	83 Å²	83	74%	0.741	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-89.9	-7.1	-179	-59.8	-77.4	0	0	0	113.2	I114 F115 R116	I114-Y118 WeakPolarHBondContact O-CD2 3.42Å; I114-Y118 WeakPolarHBondContact O-CE2 3.39Å; F115-Y118 PolarHBondContact O-N 3.24Å; R116-Y118 VanDerWaalsContact C-N 3.29Å; R116-Y118 PolarHBondContact O-N 3.48Å
119	M	71.2	Confident	72.3	Confident	31 Å²	31	87.2 Å²	87.2	15%	0.153	44%	0.44	C	S	.	.	S	Bend	trans	-71.4	126.3	178.5	-80	-66.2	-170.5	0	0	111	F115 R116 K159 I162	F115-M119 PolarHBondContact O-N 3.48Å; R116-M119 PolarHBondContact O-N 3.46Å; M119-K159 HydrophobicContact CB-CD 4.49Å; M119-K159 HydrophobicContact CB-CG 4.49Å; M119-K159 WeakPolarHBondContact CE-O 2.94Å; M119-K159 HydrophobicContact CG-CB 4.35Å; M119-K159 HydrophobicContact CG-CG 4.41Å; M119-I162 HydrophobicContact CE-CB 4.23Å; M119-I162 HydrophobicContact CE-CD1 3.3Å; M119-I162 HydrophobicContact CE-CG1 3.56Å; M119-I162 HydrophobicContact SD-CD1 4.17Å
120	P	72.2	Confident	70.5	Confident	74 Å²	74	88.5 Å²	88.5	48%	0.481	45%	0.449	S	S	.	.			trans	-62.7	141.7	178.3	24.4	-31.1	0	0	0	110.5	C122 V123	P120-C122 PolarHBondContact O-N 3.07Å; P120-V123 HydrophobicContact CG-CG2 4.25Å; P120-V123 PolarHBondContact O-N 3.37Å
121	S	67.3	Low	68.8	Low	125 Å²	125	92.8 Å²	92.8	87%	0.874	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-14.7	178	-56.9	0	0	0	0	114.1	V123	S121-V123 VanDerWaalsContact C-N 3.26Å; S121-V123 PolarHBondContact O-N 3.24Å
122	C	60.1	Low	67.1	Low	120 Å²	120	100.4 Å²	100.4	81%	0.811	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-25.7	174.5	-55	0	0	0	0	113.5	P120 K124	P120-C122 PolarHBondContact O-N 3.07Å; C122-K124 PolarHBondContact O-N 2.88Å
123	V	61.9	Low	65.7	Low	52 Å²	52	103.9 Å²	103.9	32%	0.315	53%	0.527	S	S	.	.	S	Bend	trans	-82.1	103.2	178.9	-175.1	0	0	0	0	109.1	P120 S121 N125	P120-V123 HydrophobicContact CG-CG2 4.25Å; P120-V123 PolarHBondContact O-N 3.37Å; S121-V123 VanDerWaalsContact C-N 3.26Å; S121-V123 PolarHBondContact O-N 3.24Å; V123-N125 PolarHBondContact O-N 3.33Å
124	K	58.9	Low	64.2	Low	179 Å²	179	111 Å²	111	78%	0.778	55%	0.545	S	S	*	.			trans	-58.3	125.8	172.2	-73.9	-175.9	-179.5	179.7	0	109.1	C122 T126	C122-K124 PolarHBondContact O-N 2.88Å; K124-T126 PolarHBondContact O-N 3.24Å
125	N	58.4	Low	62.5	Low	61 Å²	61	112.8 Å²	112.8	33%	0.326	56%	0.564	S	S	.	*			trans	-76.4	91.4	173.9	-170.4	14.8	0	0	0	108.9	R116 V123 E157	R116-N125 PolarHBondContact NH2-ND2 3.48Å; V123-N125 PolarHBondContact O-N 3.33Å; N125-E157 PolarHBondContact ND2-OE1 2.71Å; N125-E157 PolarHBondContact ND2-OE2 2.99Å; N125-E157 VanDerWaalsContact OD1-CB 3.24Å; N125-E157 WeakPolarHBondContact OD1-CB 3.44Å; N125-E157 VanDerWaalsContact OD1-CG 3.23Å; N125-E157 WeakPolarHBondContact OD1-CG 3.33Å
126	T	58	Low	61	Low	67 Å²	67	116.3 Å²	116.3	41%	0.411	59%	0.585	S	S	.	*	P	Polyproline II helix	trans	-84.5	121.3	167.1	42	0	0	0	0	108.6	K124 S158	K124-T126 PolarHBondContact O-N 3.24Å; T126-S158 PolarHBondContact O-N 3.39Å; T126-S158 PolarHBondContact OG1-OG 2.94Å
127	R	55.3	Low	59.5	Low	142 Å²	142	121 Å²	121	54%	0.536	61%	0.61	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-91.1	118.9	170.4	-73.5	-89.6	-158.7	178.8	14.8	107.3	E157	R127-E157 HydrophobicContact CG-CG 4.39Å; R127-E157 IonicContact CZ-OE1 2.94Å; R127-E157 IonicContact NE-OE1 2.78Å; R127-E157 PolarHBondContact NE-OE1 3.16Å; R127-E157 IonicContact NH1-OE1 3.48Å; R127-E157 PolarHBondContact NH1-OE1 3.06Å; R127-E157 IonicContact NH2-OE1 3.33Å; R127-E157 PolarHBondContact NH2-OE1 3.17Å
128	F	55.7	Low	58	Low	113 Å²	113	119.8 Å²	119.8	50%	0.496	60%	0.598	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.4	116.8	167.8	-64.2	-83.4	0	0	0	107.8	S155 V156	F128-S155 WeakPolarHBondContact O-CA 3.43Å; F128-V156 PolarHBondContact N-O 3.29Å
129	K	50.5	Low	56.8	Low	106 Å²	106	116.9 Å²	116.9	46%	0.461	61%	0.606	S	S	.	*			trans	-105.6	127.6	173.6	-76.5	177.7	160.7	-98.1	0	108.7	D153	K129-D153 IonicContact NZ-OD1 3.11Å; K129-D153 PolarHBondContact NZ-OD1 3.12Å; K129-D153 IonicContact NZ-OD2 2.86Å; K129-D153 PolarHBondContact NZ-OD2 3.28Å
130	F	51	Low	55.9	Low	149 Å²	149	122.5 Å²	122.5	65%	0.654	64%	0.636	S	S	*	*			trans	-104.5	94.9	170.7	-72.5	-81.3	0	0	0	108.2
131	E	54.8	Low	55	Low	120 Å²	120	122.6 Å²	122.6	56%	0.561	65%	0.651	S	S	*	*			trans	-93.8	124.3	175.3	-68.7	174.3	-171.2	0	0	108.7
132	F	53.7	Low	53.8	Low	176 Å²	176	120.1 Å²	120.1	77%	0.772	63%	0.634	S	S	*	*			trans	-114.9	89.1	175.8	-146.1	-93.7	0	0	0	109.1	L149	F132-L149 HydrophobicContact CB-CD2 4.18Å
133	S	57.8	Low	52.8	Low	95 Å²	95	123.8 Å²	123.8	66%	0.664	64%	0.639	S	S	*	*			trans	-96.1	133.3	176.3	61.6	0	0	0	0	110.8
134	R	50.3	Low	52	Low	217 Å²	217	124.3 Å²	124.3	82%	0.819	64%	0.644	S	S	*	*			trans	-109.5	121.4	165.8	-175.6	177.3	-178.2	173.5	0.6	108.8
135	S	51.3	Low	50.9	Low	110 Å²	110	123.1 Å²	123.1	77%	0.769	64%	0.641	S	S	*	*			trans	-89.2	140.5	170.1	-175.7	0	0	0	0	110
136	L	51.9	Low	50	Low	127 Å²	127	130.3 Å²	130.3	67%	0.665	66%	0.664	S	S	*	*			trans	-115.3	116.9	169.6	-127	147.7	0	0	0	106.6	N138	L136-N138 PolarHBondContact O-N 3.27Å
137	E	48.3	Very low	49.1	Very low	187 Å²	187	131.7 Å²	131.7	87%	0.874	67%	0.669	S	S	*	*			trans	-74.9	114.3	-179.6	-169.2	174	-167.3	0	0	109
138	N	48.9	Very low	48.5	Very low	75 Å²	75	132.7 Å²	132.7	40%	0.401	68%	0.684	S	S	.	*			trans	-82.2	140.1	171.5	-80.8	-15.3	0	0	0	109.8	L136 D140 G141 C144	L136-N138 PolarHBondContact O-N 3.27Å; N138-D140 PolarHBondContact O-N 2.98Å; N138-G141 PolarHBondContact O-N 3.23Å; N138-C144 PolarHBondContact ND2-SG 3.27Å
139	S	56.1	Low	48	Very low	129 Å²	129	132.6 Å²	132.6	90%	0.902	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.9	-12	-176.3	-66.7	0	0	0	0	116
140	D	51.7	Low	47.7	Very low	149 Å²	149	132.8 Å²	132.8	80%	0.797	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.5	20.7	-179.5	-75	-10.3	0	0	0	113.9	N138 S142	N138-D140 PolarHBondContact O-N 2.98Å; D140-S142 PolarHBondContact O-N 2.79Å
141	G	52.1	Low	47	Very low	76 Å²	76	129.4 Å²	129.4	78%	0.784	68%	0.683	S	S	*	*			trans	62.9	12.5	166.6	0	0	0	0	0	116.1	N138	N138-G141 PolarHBondContact O-N 3.23Å
142	S	43.9	Very low	46.3	Very low	73 Å²	73	132.1 Å²	132.1	51%	0.51	69%	0.689	S	S	.	*			trans	-95.1	131.1	174.3	39.4	0	0	0	0	110.3	D140 C144	D140-S142 PolarHBondContact O-N 2.79Å; S142-C144 PolarHBondContact O-N 2.7Å
143	E	39.2	Very low	45.7	Very low	196 Å²	196	126.4 Å²	126.4	92%	0.916	67%	0.667	S	S	*	*			trans	-64.3	97.8	176.7	-69.3	-176.8	164	0	0	110.1	Q145	E143-Q145 PolarHBondContact O-N 2.69Å
144	C	44.3	Very low	45	Very low	64 Å²	64	126.8 Å²	126.8	43%	0.432	66%	0.657	S	S	.	*			trans	-83	90.4	163.4	-78	0	0	0	0	108.9	N138 S142 W146	N138-C144 PolarHBondContact ND2-SG 3.27Å; S142-C144 PolarHBondContact O-N 2.7Å; C144-W146 PolarHBondContact O-N 3.31Å
145	Q	36.7	Very low	45	Very low	154 Å²	154	117.7 Å²	117.7	72%	0.72	63%	0.626	S	S	*	*			trans	-71.5	104.1	170.6	-175.2	-179.3	3.1	0	0	109.7	E143	E143-Q145 PolarHBondContact O-N 2.69Å
146	W	38.6	Very low	45.1	Very low	212 Å²	212	114.5 Å²	114.5	80%	0.803	60%	0.602	S	S	*	*			trans	-133	103.7	163.8	-67.7	104.4	0	0	0	109.7	C144 L148	C144-W146 PolarHBondContact O-N 3.31Å; W146-L148 VanDerWaalsContact C-N 3.33Å; W146-L148 PolarHBondContact O-N 2.84Å; W146-L148 VanDerWaalsContact O-N 3.07Å
147	N	38.6	Very low	45.7	Very low	96 Å²	96	108.9 Å²	108.9	51%	0.513	57%	0.572	S	S	.	*			trans	-76.6	83.3	169.1	-72.1	-19.8	0	0	0	108.4	L149	N147-L149 PolarHBondContact O-N 3.43Å
148	L	43.9	Very low	46.3	Very low	163 Å²	163	100.7 Å²	100.7	85%	0.853	54%	0.536	S	S	*	.			trans	-82.2	-2	179.3	-146.2	138.4	0	0	0	113.2	W146	W146-L148 VanDerWaalsContact C-N 3.33Å; W146-L148 PolarHBondContact O-N 2.84Å; W146-L148 VanDerWaalsContact O-N 3.07Å
149	L	43.8	Very low	47.1	Very low	111 Å²	111	99.1 Å²	99.1	58%	0.581	53%	0.525	S	S	*	.	S	Bend	trans	-100.9	106.1	158.3	-122.8	68.9	0	0	0	105.5	F132 N147 N151	F132-L149 HydrophobicContact CB-CD2 4.18Å; N147-L149 PolarHBondContact O-N 3.43Å; L149-N151 PolarHBondContact O-N 3.45Å; L149-N151 VanDerWaalsContact O-N 3.15Å
150	D	44.3	Very low	48.1	Very low	109 Å²	109	94 Å²	94	58%	0.583	49%	0.488	S	S	*	.			trans	-42.5	127.5	159.5	-80.4	-41.4	0	0	0	107.1	Y152 K353	D150-Y152 VanDerWaalsContact C-N 3.28Å; D150-Y152 PolarHBondContact O-N 3.11Å; D150-K353 IonicContact OD1-NZ 3.81Å; D150-K353 PolarHBondContact OD1-NZ 3.01Å; D150-K353 IonicContact OD2-NZ 2.9Å; D150-K353 PolarHBondContact OD2-NZ 3.03Å
151	N	36.9	Very low	49.6	Very low	79 Å²	79	93.1 Å²	93.1	42%	0.422	48%	0.477	S	S	.	.			trans	-48.6	100.8	174.6	-72	-31.2	0	0	0	106.9	L149 D153	L149-N151 PolarHBondContact O-N 3.45Å; L149-N151 VanDerWaalsContact O-N 3.15Å; N151-D153 PolarHBondContact O-N 2.87Å
152	Y	39.3	Very low	51.2	Low	176 Å²	176	93.2 Å²	93.2	69%	0.69	46%	0.459	S	S	*	.			trans	-74.2	81.5	168.6	-156.1	-93	0	0	0	103.8	D150 F154	D150-Y152 VanDerWaalsContact C-N 3.28Å; D150-Y152 PolarHBondContact O-N 3.11Å; Y152-F154 HydrophobicContact CD1-CB 4.34Å; Y152-F154 PolarHBondContact O-N 2.99Å
153	D	42.5	Very low	53.3	Low	56 Å²	56	89.8 Å²	89.8	30%	0.299	44%	0.435	S	S	.	.			trans	-70	73	-177.1	-109.2	-2.5	0	0	0	106.5	K129 N151 S155	K129-D153 IonicContact NZ-OD1 3.11Å; K129-D153 PolarHBondContact NZ-OD1 3.12Å; K129-D153 IonicContact NZ-OD2 2.86Å; K129-D153 PolarHBondContact NZ-OD2 3.28Å; N151-D153 PolarHBondContact O-N 2.87Å; D153-S155 PolarHBondContact O-N 3.16Å
154	F	43.5	Very low	55.6	Low	104 Å²	104	82.5 Å²	82.5	46%	0.456	40%	0.404	S	S	.	.			trans	-74.6	70.1	168.5	-168.8	-109.1	0	0	0	108.2	Y152 V156	Y152-F154 HydrophobicContact CD1-CB 4.34Å; Y152-F154 PolarHBondContact O-N 2.99Å; F154-V156 HydrophobicContact CD1-CG2 3.61Å; F154-V156 HydrophobicContact CE1-CG2 3.05Å; F154-V156 HydrophobicContact CE2-CG2 4.3Å; F154-V156 HydrophobicContact CG-CG2 4.44Å; F154-V156 HydrophobicContact CZ-CG2 3.46Å; F154-V156 VanDerWaalsContact CZ-CG2 3.46Å; F154-V156 PolarHBondContact O-N 3.27Å; F154-V156 VanDerWaalsContact O-N 3.11Å
155	S	49.5	Very low	57.9	Low	26 Å²	26	81.3 Å²	81.3	18%	0.182	40%	0.402	C	S	.	.			trans	-81.3	84	178.3	-76.4	0	0	0	0	109.6	F128 D153 E157	F128-S155 WeakPolarHBondContact O-CA 3.43Å; D153-S155 PolarHBondContact O-N 3.16Å; S155-E157 PolarHBondContact O-N 3.06Å
156	V	54	Low	60.6	Low	43 Å²	43	76.7 Å²	76.7	26%	0.261	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	114.1	166.8	-178.1	0	0	0	0	107.8	F128 F154	F128-V156 PolarHBondContact N-O 3.29Å; F154-V156 HydrophobicContact CD1-CG2 3.61Å; F154-V156 HydrophobicContact CE1-CG2 3.05Å; F154-V156 HydrophobicContact CE2-CG2 4.3Å; F154-V156 HydrophobicContact CG-CG2 4.44Å; F154-V156 HydrophobicContact CZ-CG2 3.46Å; F154-V156 VanDerWaalsContact CZ-CG2 3.46Å; F154-V156 PolarHBondContact O-N 3.27Å; F154-V156 VanDerWaalsContact O-N 3.11Å
157	E	62.7	Low	63.2	Low	8 Å²	8	66.6 Å²	66.6	4%	0.037	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	140.2	170.5	-71.7	-166.6	164.7	0	0	109.4	R116 N125 R127 S155 K159 D160	R116-E157 IonicContact CZ-OE1 3.25Å; R116-E157 IonicContact CZ-OE2 4Å; R116-E157 VanDerWaalsContact CZ-OE2 3.26Å; R116-E157 IonicContact NE-OE2 2.9Å; R116-E157 PolarHBondContact NE-OE2 3.17Å; R116-E157 VanDerWaalsContact NH2-CD 3.33Å; R116-E157 IonicContact NH2-OE1 3.38Å; R116-E157 PolarHBondContact NH2-OE1 3.28Å; R116-E157 IonicContact NH2-OE2 2.98Å; R116-E157 PolarHBondContact NH2-OE2 3.43Å; N125-E157 PolarHBondContact ND2-OE1 2.71Å; N125-E157 PolarHBondContact ND2-OE2 2.99Å; N125-E157 VanDerWaalsContact OD1-CB 3.24Å; N125-E157 WeakPolarHBondContact OD1-CB 3.44Å; N125-E157 VanDerWaalsContact OD1-CG 3.23Å; N125-E157 WeakPolarHBondContact OD1-CG 3.33Å; R127-E157 HydrophobicContact CG-CG 4.39Å; R127-E157 IonicContact CZ-OE1 2.94Å; R127-E157 IonicContact NE-OE1 2.78Å; R127-E157 PolarHBondContact NE-OE1 3.16Å; R127-E157 IonicContact NH1-OE1 3.48Å; R127-E157 PolarHBondContact NH1-OE1 3.06Å; R127-E157 IonicContact NH2-OE1 3.33Å; R127-E157 PolarHBondContact NH2-OE1 3.17Å; S155-E157 PolarHBondContact O-N 3.06Å; E157-K159 PolarHBondContact O-N 3.1Å; E157-D160 PolarHBondContact N-OD2 2.93Å; E157-D160 WeakPolarHBondContact O-CB 3.39Å; E157-D160 PolarHBondContact O-N 3.38Å
158	S	62.2	Low	65.9	Low	15 Å²	15	66.6 Å²	66.6	11%	0.105	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-56.3	-16.8	170	-69.6	0	0	0	0	113.5	T126 D160 F161	T126-S158 PolarHBondContact O-N 3.39Å; T126-S158 PolarHBondContact OG1-OG 2.94Å; S158-D160 PolarHBondContact O-N 3.25Å; S158-F161 WeakPolarHBondContact O-CD2 3.47Å
159	K	65.9	Low	68.3	Low	42 Å²	42	64.2 Å²	64.2	18%	0.183	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-75.6	-10.5	175	-66.8	-174.3	175.6	-177.4	0	113.5	R116 M119 E157	R116-K159 HydrophobicContact CG-CB 4.47Å; R116-K159 HydrophobicContact CG-CD 4.04Å; M119-K159 HydrophobicContact CB-CD 4.49Å; M119-K159 HydrophobicContact CB-CG 4.49Å; M119-K159 WeakPolarHBondContact CE-O 2.94Å; M119-K159 HydrophobicContact CG-CB 4.35Å; M119-K159 HydrophobicContact CG-CG 4.41Å; E157-K159 PolarHBondContact O-N 3.1Å
160	D	76.1	Confident	70.7	Confident	22 Å²	22	60 Å²	60	12%	0.118	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-92.8	-0.1	-177	-57.7	-30.3	0	0	0	113.3	S112 E157 S158 I162 G163 T164	S112-D160 VanDerWaalsContact CB-OD1 3.23Å; S112-D160 WeakPolarHBondContact CB-OD1 3.27Å; S112-D160 PolarHBondContact OG-OD1 2.8Å; E157-D160 PolarHBondContact N-OD2 2.93Å; E157-D160 WeakPolarHBondContact O-CB 3.39Å; E157-D160 PolarHBondContact O-N 3.38Å; S158-D160 PolarHBondContact O-N 3.25Å; D160-I162 VanDerWaalsContact C-N 3.33Å; D160-I162 PolarHBondContact O-N 3.45Å; D160-G163 PolarHBondContact O-N 3.29Å; D160-T164 WeakPolarHBondContact O-CB 3.37Å; D160-T164 PolarHBondContact O-N 3.03Å; D160-T164 PolarHBondContact O-OG1 2.95Å
161	F	83.4	Confident	73.1	Confident	131 Å²	131	54.9 Å²	54.9	58%	0.575	28%	0.282	S	S	*	.	H	α-helix	trans	-59.4	-38.7	-176.4	-79	-58	0	0	0	113.6	S158 T164 G165	S158-F161 WeakPolarHBondContact O-CD2 3.47Å; F161-T164 PolarHBondContact O-N 2.65Å; F161-G165 PolarHBondContact O-N 3.15Å
162	I	86.6	Confident	75.8	Confident	77 Å²	77	54.2 Å²	54.2	40%	0.395	28%	0.28	S	S	.	.	H	α-helix	trans	-66.4	-48	178.5	-64.1	176.4	0	0	0	110.4	F115 M119 D160 T164 G165 I166	F115-I162 HydrophobicContact CD1-CG2 4.02Å; F115-I162 HydrophobicContact CD2-CB 4.48Å; F115-I162 HydrophobicContact CD2-CG2 3.99Å; F115-I162 HydrophobicContact CE1-CG2 3.96Å; F115-I162 HydrophobicContact CE2-CG2 3.92Å; F115-I162 HydrophobicContact CG-CB 4.42Å; F115-I162 HydrophobicContact CG-CG2 4.04Å; F115-I162 HydrophobicContact CZ-CG2 3.91Å; M119-I162 HydrophobicContact CE-CB 4.23Å; M119-I162 HydrophobicContact CE-CD1 3.3Å; M119-I162 HydrophobicContact CE-CG1 3.56Å; M119-I162 HydrophobicContact SD-CD1 4.17Å; D160-I162 VanDerWaalsContact C-N 3.33Å; D160-I162 PolarHBondContact O-N 3.45Å; I162-T164 VanDerWaalsContact C-N 3.3Å; I162-T164 PolarHBondContact O-N 2.96Å; I162-G165 PolarHBondContact O-N 2.84Å; I162-I166 HydrophobicContact CG2-CD1 3.95Å; I162-I166 WeakPolarHBondContact O-CG1 3.28Å; I162-I166 PolarHBondContact O-N 3.32Å
163	G	87.4	Confident	78.4	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.01	27%	0.267	C	S	.	.	H	α-helix	trans	-60.3	-42.3	176.8	0	0	0	0	0	111.7	D160 I166 G167	D160-G163 PolarHBondContact O-N 3.29Å; G163-I166 PolarHBondContact O-N 2.84Å; G163-G167 PolarHBondContact O-N 3.47Å
164	T	88.4	Confident	80.8	Confident	43 Å²	43	48.3 Å²	48.3	26%	0.264	25%	0.253	S	S	.	.	H	α-helix	trans	-63.7	-43.8	176.4	-55.9	0	0	0	0	111.8	S108 D160 F161 I162 G167 I168	S108-T164 WeakPolarHBondContact OG-CA 3.4Å; S108-T164 PolarHBondContact OG-N 3.09Å; S108-T164 PolarHBondContact OG-OG1 2.91Å; D160-T164 WeakPolarHBondContact O-CB 3.37Å; D160-T164 PolarHBondContact O-N 3.03Å; D160-T164 PolarHBondContact O-OG1 2.95Å; F161-T164 PolarHBondContact O-N 2.65Å; I162-T164 VanDerWaalsContact C-N 3.3Å; I162-T164 PolarHBondContact O-N 2.96Å; T164-G167 PolarHBondContact O-N 3.14Å; T164-I168 HydrophobicContact CG2-CD1 3.95Å; T164-I168 HydrophobicContact CG2-CG1 4.49Å; T164-I168 WeakPolarHBondContact O-CG1 3.38Å; T164-I168 PolarHBondContact O-N 2.89Å
165	G	92	Very high	83.1	Confident	39 Å²	39	47.9 Å²	47.9	40%	0.402	25%	0.249	S	C	.	.	H	α-helix	trans	-61.5	-44.4	176.7	0	0	0	0	0	112.7	F161 I162 I168 L169	F161-G165 PolarHBondContact O-N 3.15Å; I162-G165 PolarHBondContact O-N 2.84Å; G165-I168 PolarHBondContact O-N 2.64Å; G165-L169 WeakPolarHBondContact O-CB 3.36Å; G165-L169 PolarHBondContact O-N 3.01Å
166	I	92.7	Very high	85.1	Confident	57 Å²	57	54.3 Å²	54.3	29%	0.292	27%	0.274	S	S	.	.	H	α-helix	trans	-65.5	-41.5	175.3	-65.1	166	0	0	0	110.7	I107 L111 F115 I162 G163 L169 L170	I107-I166 HydrophobicContact CG2-CG2 4.3Å; L111-I166 HydrophobicContact CD1-CB 3.75Å; L111-I166 HydrophobicContact CD1-CD1 4.02Å; L111-I166 HydrophobicContact CD1-CG2 3.53Å; F115-I166 HydrophobicContact CE2-CD1 3.67Å; F115-I166 HydrophobicContact CZ-CD1 3.65Å; I162-I166 HydrophobicContact CG2-CD1 3.95Å; I162-I166 WeakPolarHBondContact O-CG1 3.28Å; I162-I166 PolarHBondContact O-N 3.32Å; G163-I166 PolarHBondContact O-N 2.84Å; I166-L169 PolarHBondContact O-N 3.22Å; I166-L170 HydrophobicContact CG2-CD1 3.87Å; I166-L170 HydrophobicContact CG2-CG 4.27Å; I166-L170 WeakPolarHBondContact O-CG 3.41Å; I166-L170 PolarHBondContact O-N 3.2Å
167	G	93.9	Very high	86.7	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-59.5	-47.2	176.3	0	0	0	0	0	112.6	A104 G163 T164 L169 L170 G171	A104-G167 WeakPolarHBondContact CA-O 3.45Å; A104-G167 WeakPolarHBondContact CB-O 3.48Å; G163-G167 PolarHBondContact O-N 3.47Å; T164-G167 PolarHBondContact O-N 3.14Å; G167-L169 PolarHBondContact O-N 3.42Å; G167-L170 PolarHBondContact O-N 2.97Å; G167-G171 PolarHBondContact O-N 3.1Å
168	I	94.2	Very high	87.7	Confident	96 Å²	96	55.6 Å²	55.6	49%	0.492	29%	0.289	S	S	.	.	H	α-helix	trans	-62.1	-43.4	176	-68.2	167.7	0	0	0	110.6	T164 G165 T172	T164-I168 HydrophobicContact CG2-CD1 3.95Å; T164-I168 HydrophobicContact CG2-CG1 4.49Å; T164-I168 WeakPolarHBondContact O-CG1 3.38Å; T164-I168 PolarHBondContact O-N 2.89Å; G165-I168 PolarHBondContact O-N 2.64Å; I168-T172 WeakPolarHBondContact O-CB 3.49Å; I168-T172 PolarHBondContact O-N 2.96Å; I168-T172 PolarHBondContact O-OG1 3.44Å
169	L	95.2	Very high	89	Confident	113 Å²	113	56.9 Å²	56.9	59%	0.592	29%	0.293	S	S	*	.	H	α-helix	trans	-61	-49.1	179.1	-176.3	150.9	0	0	0	111.6	G165 I166 G167 W173	G165-L169 WeakPolarHBondContact O-CB 3.36Å; G165-L169 PolarHBondContact O-N 3.01Å; I166-L169 PolarHBondContact O-N 3.22Å; G167-L169 PolarHBondContact O-N 3.42Å; L169-W173 WeakPolarHBondContact O-CB 3.4Å; L169-W173 PolarHBondContact O-N 2.81Å
170	L	94.2	Very high	90.1	Very high	23 Å²	23	56.3 Å²	56.3	12%	0.12	29%	0.29	C	S	.	.	H	α-helix	trans	-70.7	-38	-179.3	-67.8	179.7	0	0	0	112.4	I107 I166 G167 W173 Y174 F185	I107-L170 HydrophobicContact CD1-CB 3.79Å; I107-L170 HydrophobicContact CD1-CD1 3.99Å; I107-L170 HydrophobicContact CG2-CD1 4.37Å; I166-L170 HydrophobicContact CG2-CD1 3.87Å; I166-L170 HydrophobicContact CG2-CG 4.27Å; I166-L170 WeakPolarHBondContact O-CG 3.41Å; I166-L170 PolarHBondContact O-N 3.2Å; G167-L170 PolarHBondContact O-N 2.97Å; L170-W173 HydrophobicContact CD2-CE3 3.7Å; L170-W173 HydrophobicContact CD2-CZ3 4.05Å; L170-W173 PolarHBondContact O-N 3.08Å; L170-Y174 WeakPolarHBondContact O-CB 3.42Å; L170-Y174 PolarHBondContact O-N 3.22Å; L170-F185 HydrophobicContact CD1-CD1 3.4Å; L170-F185 VanDerWaalsContact CD1-CD1 3.4Å; L170-F185 HydrophobicContact CD1-CE1 3.31Å; L170-F185 HydrophobicContact CD1-CG 4.11Å; L170-F185 HydrophobicContact CD1-CZ 3.97Å
171	G	93.9	Very high	90.9	Very high	2 Å²	2	58 Å²	58	2%	0.021	30%	0.298	C	S	.	.	H	α-helix	trans	-63.8	-42.6	174.3	0	0	0	0	0	112.4	S100 G167 Y174 Y175	S100-G171 WeakPolarHBondContact CB-O 3.38Å; G167-G171 PolarHBondContact O-N 3.1Å; G171-Y174 PolarHBondContact O-N 3.01Å; G171-Y175 PolarHBondContact O-N 3.27Å
172	T	93.6	Very high	91.3	Very high	64 Å²	64	51.8 Å²	51.8	39%	0.393	27%	0.271	S	S	.	.	H	α-helix	trans	-67.4	-41.2	176	-55.7	0	0	0	0	111.2	I168 Y174 Y175 F176	I168-T172 WeakPolarHBondContact O-CB 3.49Å; I168-T172 PolarHBondContact O-N 2.96Å; I168-T172 PolarHBondContact O-OG1 3.44Å; T172-Y174 VanDerWaalsContact C-N 3.34Å; T172-Y174 PolarHBondContact O-N 2.83Å; T172-Y175 PolarHBondContact O-N 3.14Å; T172-F176 HydrophobicContact CG2-CD2 3.65Å; T172-F176 HydrophobicContact CG2-CE2 3.53Å; T172-F176 VanDerWaalsContact O-CD2 3.32Å; T172-F176 WeakPolarHBondContact O-CD2 3.48Å; T172-F176 PolarHBondContact O-N 3.21Å; T172-F176 VanDerWaalsContact O-N 3.11Å
173	W	94.4	Very high	91.6	Very high	107 Å²	107	48.4 Å²	48.4	41%	0.405	25%	0.254	S	S	.	.	H	α-helix	trans	-60.1	-45.2	174.1	179.3	20.7	0	0	0	111.2	L169 L170 Y175 S177 I181 A182	L169-W173 WeakPolarHBondContact O-CB 3.4Å; L169-W173 PolarHBondContact O-N 2.81Å; L170-W173 HydrophobicContact CD2-CE3 3.7Å; L170-W173 HydrophobicContact CD2-CZ3 4.05Å; L170-W173 PolarHBondContact O-N 3.08Å; W173-Y175 PolarHBondContact O-N 2.79Å; W173-S177 PolarHBondContact NE1-OG 2.96Å; W173-S177 VanDerWaalsContact NE1-OG 3.15Å; W173-S177 VanDerWaalsContact O-CB 3.31Å; W173-S177 WeakPolarHBondContact O-CB 3.5Å; W173-S177 PolarHBondContact O-N 2.73Å; W173-S177 PolarHBondContact O-OG 3.24Å; W173-I181 HydrophobicContact CH2-CG2 4.45Å; W173-A182 HydrophobicContact CD2-CB 4.08Å; W173-A182 HydrophobicContact CE3-CB 4.22Å; W173-A182 HydrophobicContact CG-CB 4.35Å
174	Y	93	Very high	92	Very high	1 Å²	1	48.9 Å²	48.9	0%	0.004	26%	0.256	C	S	.	.	H	α-helix	trans	-59	-45.8	174.5	167.1	-100.6	0	0	0	112	K96 F99 L170 G171 T172 F176 G178 N183 I186 D235 I236 P237	K96-Y174 HydrophobicContact CB-CE1 4.5Å; K96-Y174 HydrophobicContact CG-CE1 4.3Å; F99-Y174 HydrophobicContact CB-CE1 4.34Å; L170-Y174 WeakPolarHBondContact O-CB 3.42Å; L170-Y174 PolarHBondContact O-N 3.22Å; G171-Y174 PolarHBondContact O-N 3.01Å; T172-Y174 VanDerWaalsContact C-N 3.34Å; T172-Y174 PolarHBondContact O-N 2.83Å; Y174-F176 PolarHBondContact O-N 3.34Å; Y174-G178 WeakPolarHBondContact O-CA 3.32Å; Y174-G178 PolarHBondContact O-N 2.83Å; Y174-N183 HydrophobicContact CD2-CB 4.19Å; Y174-N183 HydrophobicContact CE2-CB 4.16Å; Y174-I186 HydrophobicContact CD1-CD1 3.96Å; Y174-I186 HydrophobicContact CD2-CD1 4.29Å; Y174-I186 HydrophobicContact CG-CD1 3.67Å; Y174-D235 PolarHBondContact OH-O 2.91Å; Y174-I236 WeakPolarHBondContact OH-CA 3.45Å; Y174-P237 HydrophobicContact CE1-CG 4.47Å; Y174-P237 HydrophobicContact CE2-CG 4.45Å; Y174-P237 VanDerWaalsContact CZ-CD 3.5Å; Y174-P237 WeakPolarHBondContact OH-CD 3.42Å
175	Y	91.5	Very high	92.2	Very high	96 Å²	96	50.8 Å²	50.8	38%	0.376	26%	0.261	S	S	.	.	H	α-helix	trans	-58	-48.6	-179.8	178.6	-101.9	0	0	0	112.8	K96 V97 G171 T172 W173	K96-Y175 HydrophobicContact CB-CD2 4.31Å; V97-Y175 HydrophobicContact CG2-CD2 4.35Å; V97-Y175 HydrophobicContact CG2-CE2 3.58Å; G171-Y175 PolarHBondContact O-N 3.27Å; T172-Y175 PolarHBondContact O-N 3.14Å; W173-Y175 PolarHBondContact O-N 2.79Å
176	F	91.6	Very high	92.4	Very high	161 Å²	161	48.9 Å²	48.9	71%	0.706	24%	0.242	S	C	*	.	H	α-helix	trans	-79.5	-39.8	-176.7	-74.6	-67.1	0	0	0	113.8	T172 Y174	T172-F176 HydrophobicContact CG2-CD2 3.65Å; T172-F176 HydrophobicContact CG2-CE2 3.53Å; T172-F176 VanDerWaalsContact O-CD2 3.32Å; T172-F176 WeakPolarHBondContact O-CD2 3.48Å; T172-F176 PolarHBondContact O-N 3.21Å; T172-F176 VanDerWaalsContact O-N 3.11Å; Y174-F176 PolarHBondContact O-N 3.34Å
177	S	87.6	Confident	92.5	Very high	56 Å²	56	46.2 Å²	46.2	39%	0.392	23%	0.228	S	C	.	.	H	α-helix	trans	-94.5	-27.2	-171.4	70.6	0	0	0	0	113.9	W173 H179	W173-S177 PolarHBondContact NE1-OG 2.96Å; W173-S177 VanDerWaalsContact NE1-OG 3.15Å; W173-S177 VanDerWaalsContact O-CB 3.31Å; W173-S177 WeakPolarHBondContact O-CB 3.5Å; W173-S177 PolarHBondContact O-N 2.73Å; W173-S177 PolarHBondContact O-OG 3.24Å; S177-H179 PolarHBondContact O-N 3.45Å; S177-H179 VanDerWaalsContact O-N 3.11Å; S177-H179 WeakPolarHBondContact OG-CB 3.35Å; S177-H179 PolarHBondContact OG-N 2.81Å; S177-H179 VanDerWaalsContact OG-N 3.13Å
178	G	84.1	Confident	92.6	Very high	22 Å²	22	47.5 Å²	47.5	23%	0.227	24%	0.236	C	C	.	.			trans	54.3	23.6	-167.2	0	0	0	0	0	113.3	Y174	Y174-G178 WeakPolarHBondContact O-CA 3.32Å; Y174-G178 PolarHBondContact O-N 2.83Å
179	H	89.1	Confident	92.7	Very high	41 Å²	41	43.1 Å²	43.1	19%	0.19	21%	0.213	C	C	.	.			trans	-70.8	137.5	-170.6	-156	67.1	0	0	0	111	S177 I181 A182 N183	S177-H179 PolarHBondContact O-N 3.45Å; S177-H179 VanDerWaalsContact O-N 3.11Å; S177-H179 WeakPolarHBondContact OG-CB 3.35Å; S177-H179 PolarHBondContact OG-N 2.81Å; S177-H179 VanDerWaalsContact OG-N 3.13Å; H179-I181 PolarHBondContact O-N 3.22Å; H179-I181 VanDerWaalsContact O-N 3.14Å; H179-A182 PolarHBondContact O-N 3.48Å; H179-N183 PolarHBondContact O-N 3.48Å
180	W	89.5	Confident	92.6	Very high	31 Å²	31	39.8 Å²	39.8	12%	0.117	20%	0.198	C	C	.	.	H	α-helix	trans	-59	-30.4	-175.5	64.3	-93.4	0	0	0	112.8	N183 N184 F242 P243 L251 L256	W180-N183 WeakPolarHBondContact O-CB 3.46Å; W180-N184 WeakPolarHBondContact O-CB 3.2Å; W180-N184 PolarHBondContact O-N 3.25Å; W180-N184 PolarHBondContact O-OD1 2.91Å; W180-F242 HydrophobicContact CH2-CD2 4.19Å; W180-F242 AromaticContact CH2-CE2 3.92Å; W180-F242 HydrophobicContact CH2-CE2 3.92Å; W180-F242 AromaticContact CZ3-CD2 3.82Å; W180-F242 HydrophobicContact CZ3-CD2 3.82Å; W180-F242 AromaticContact CZ3-CE2 3.99Å; W180-F242 HydrophobicContact CZ3-CE2 3.99Å; W180-P243 HydrophobicContact CZ2-CG 4.2Å; W180-L251 HydrophobicContact CH2-CD2 4.31Å; W180-L251 HydrophobicContact CZ2-CD2 3.71Å; W180-L251 PolarHBondContact NE1-O 2.91Å; W180-L256 HydrophobicContact CB-CD1 4.19Å; W180-L256 HydrophobicContact CB-CD2 4.1Å; W180-L256 HydrophobicContact CG-CD2 4.25Å
181	I	92.1	Very high	92.8	Very high	57 Å²	57	38.7 Å²	38.7	29%	0.292	19%	0.192	S	C	.	.	H	α-helix	trans	-65.9	-48.9	175.7	-57.6	171.8	0	0	0	111	W173 H179 N183 N184 F185 L251	W173-I181 HydrophobicContact CH2-CG2 4.45Å; H179-I181 PolarHBondContact O-N 3.22Å; H179-I181 VanDerWaalsContact O-N 3.14Å; I181-N183 VanDerWaalsContact C-N 3.32Å; I181-N183 PolarHBondContact O-N 2.84Å; I181-N184 PolarHBondContact O-N 2.89Å; I181-F185 PolarHBondContact O-N 2.84Å; I181-L251 HydrophobicContact CD1-CD2 4.41Å
182	A	92.6	Very high	92.9	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.008	19%	0.192	C	C	.	.	H	α-helix	trans	-64	-41.6	178.7	0	0	0	0	0	110.5	W173 H179 F185 I186	W173-A182 HydrophobicContact CD2-CB 4.08Å; W173-A182 HydrophobicContact CE3-CB 4.22Å; W173-A182 HydrophobicContact CG-CB 4.35Å; H179-A182 PolarHBondContact O-N 3.48Å; A182-F185 PolarHBondContact O-N 3.29Å; A182-I186 WeakPolarHBondContact O-CG1 3.47Å; A182-I186 PolarHBondContact O-N 3.19Å; A182-I186 VanDerWaalsContact O-N 3.13Å
183	N	92.8	Very high	92.9	Very high	6 Å²	6	36.5 Å²	36.5	3%	0.032	18%	0.177	C	C	.	.	H	α-helix	trans	-56	-50.7	172	175.9	86.8	0	0	0	111.9	Y174 H179 W180 I181 F185 I186 A187 I236 P237 K239	Y174-N183 HydrophobicContact CD2-CB 4.19Å; Y174-N183 HydrophobicContact CE2-CB 4.16Å; H179-N183 PolarHBondContact O-N 3.48Å; W180-N183 WeakPolarHBondContact O-CB 3.46Å; I181-N183 VanDerWaalsContact C-N 3.32Å; I181-N183 PolarHBondContact O-N 2.84Å; N183-F185 VanDerWaalsContact C-N 3.34Å; N183-F185 PolarHBondContact O-N 3.34Å; N183-I186 PolarHBondContact O-N 2.86Å; N183-A187 VanDerWaalsContact O-CB 3.31Å; N183-A187 WeakPolarHBondContact O-CB 3.44Å; N183-A187 PolarHBondContact O-N 3.19Å; N183-I236 VanDerWaalsContact OD1-C 3.32Å; N183-I236 PolarHBondContact OD1-O 2.8Å; N183-P237 WeakPolarHBondContact OD1-CA 3.3Å; N183-P237 WeakPolarHBondContact OD1-CB 3.36Å; N183-P237 VanDerWaalsContact OD1-N 3.16Å; N183-K239 PolarHBondContact ND2-O 3.4Å
184	N	94.8	Very high	92.9	Very high	10 Å²	10	32.3 Å²	32.3	5%	0.053	17%	0.166	C	C	.	.	H	α-helix	trans	-63.9	-38.6	-179.4	-74.7	-1.6	0	0	0	112.5	W180 I181 A187 V188 T241	W180-N184 WeakPolarHBondContact O-CB 3.2Å; W180-N184 PolarHBondContact O-N 3.25Å; W180-N184 PolarHBondContact O-OD1 2.91Å; I181-N184 PolarHBondContact O-N 2.89Å; N184-A187 PolarHBondContact O-N 3.35Å; N184-V188 VanDerWaalsContact O-CB 3.27Å; N184-V188 WeakPolarHBondContact O-CB 3.37Å; N184-V188 VanDerWaalsContact O-CG2 3.29Å; N184-V188 WeakPolarHBondContact O-CG2 3.47Å; N184-V188 PolarHBondContact O-N 3.44Å; N184-T241 PolarHBondContact ND2-O 3.35Å; N184-T241 PolarHBondContact OD1-N 2.97Å; N184-T241 PolarHBondContact OD1-O 2.87Å; N184-T241 PolarHBondContact OD1-OG1 2.7Å
185	F	94.1	Very high	93.1	Very high	83 Å²	83	32.3 Å²	32.3	36%	0.364	17%	0.166	S	C	.	.	H	α-helix	trans	-63.2	-44.6	178.5	-163.9	-86.6	0	0	0	111	I107 L170 I181 A182 N183 T189	I107-F185 HydrophobicContact CD1-CD1 3.74Å; I107-F185 HydrophobicContact CD1-CE1 4.04Å; I107-F185 HydrophobicContact CG1-CD1 4.03Å; I107-F185 HydrophobicContact CG1-CE1 3.98Å; I107-F185 HydrophobicContact CG2-CE1 4.12Å; L170-F185 HydrophobicContact CD1-CD1 3.4Å; L170-F185 VanDerWaalsContact CD1-CD1 3.4Å; L170-F185 HydrophobicContact CD1-CE1 3.31Å; L170-F185 HydrophobicContact CD1-CG 4.11Å; L170-F185 HydrophobicContact CD1-CZ 3.97Å; I181-F185 PolarHBondContact O-N 2.84Å; A182-F185 PolarHBondContact O-N 3.29Å; N183-F185 VanDerWaalsContact C-N 3.34Å; N183-F185 PolarHBondContact O-N 3.34Å; F185-T189 VanDerWaalsContact O-CB 3.31Å; F185-T189 WeakPolarHBondContact O-CB 3.49Å; F185-T189 PolarHBondContact O-N 2.85Å; F185-T189 PolarHBondContact O-OG1 2.97Å
186	I	94.8	Very high	93.1	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-62.2	-49.8	173.6	-66.8	168.9	0	0	0	110.2	I107 Y174 A182 N183 V188 T189 V190 P237	I107-I186 HydrophobicContact CD1-CG1 3.84Å; Y174-I186 HydrophobicContact CD1-CD1 3.96Å; Y174-I186 HydrophobicContact CD2-CD1 4.29Å; Y174-I186 HydrophobicContact CG-CD1 3.67Å; A182-I186 WeakPolarHBondContact O-CG1 3.47Å; A182-I186 PolarHBondContact O-N 3.19Å; A182-I186 VanDerWaalsContact O-N 3.13Å; N183-I186 PolarHBondContact O-N 2.86Å; I186-V188 PolarHBondContact O-N 2.91Å; I186-T189 WeakPolarHBondContact O-CB 3.3Å; I186-T189 PolarHBondContact O-N 3.41Å; I186-V190 HydrophobicContact CG2-CG2 4.2Å; I186-V190 WeakPolarHBondContact O-CB 3.46Å; I186-V190 VanDerWaalsContact O-CG2 3.32Å; I186-V190 WeakPolarHBondContact O-CG2 3.46Å; I186-V190 PolarHBondContact O-N 3.35Å; I186-P237 HydrophobicContact CB-CB 4.04Å; I186-P237 HydrophobicContact CB-CG 4.42Å; I186-P237 HydrophobicContact CG2-CB 3.78Å; I186-P237 HydrophobicContact CG2-CG 3.78Å
187	A	95.2	Very high	93.1	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-60.9	-45.5	-177	0	0	0	0	0	112.5	N183 N184 T189 V190 A191 P237 V240 L261	N183-A187 VanDerWaalsContact O-CB 3.31Å; N183-A187 WeakPolarHBondContact O-CB 3.44Å; N183-A187 PolarHBondContact O-N 3.19Å; N184-A187 PolarHBondContact O-N 3.35Å; A187-T189 VanDerWaalsContact C-N 3.35Å; A187-T189 PolarHBondContact O-N 3.48Å; A187-V190 PolarHBondContact O-N 2.9Å; A187-A191 WeakPolarHBondContact O-CB 3.42Å; A187-A191 PolarHBondContact O-N 2.98Å; A187-P237 HydrophobicContact CB-CB 4.35Å; A187-V240 HydrophobicContact CB-CG1 3.86Å; A187-L261 HydrophobicContact CB-CD1 4.1Å; A187-L261 HydrophobicContact CB-CD2 4.1Å; A187-L261 HydrophobicContact CB-CG 4.37Å
188	V	96.1	Very high	93.3	Very high	28 Å²	28	22 Å²	22	17%	0.17	12%	0.117	C	C	.	.	H	α-helix	trans	-61.9	-43.1	175.2	161.2	0	0	0	0	111.1	L35 P39 N184 I186 A191 I192 V240	L35-V188 HydrophobicContact CD2-CG2 3.72Å; P39-V188 HydrophobicContact CG-CB 4.46Å; P39-V188 HydrophobicContact CG-CG1 4.06Å; P39-V188 HydrophobicContact CG-CG2 4.19Å; N184-V188 VanDerWaalsContact O-CB 3.27Å; N184-V188 WeakPolarHBondContact O-CB 3.37Å; N184-V188 VanDerWaalsContact O-CG2 3.29Å; N184-V188 WeakPolarHBondContact O-CG2 3.47Å; N184-V188 PolarHBondContact O-N 3.44Å; I186-V188 PolarHBondContact O-N 2.91Å; V188-A191 PolarHBondContact O-N 3.45Å; V188-I192 HydrophobicContact CG1-CD1 3.89Å; V188-I192 VanDerWaalsContact O-CG1 3.32Å; V188-I192 WeakPolarHBondContact O-CG1 3.5Å; V188-I192 PolarHBondContact O-N 3Å; V188-V240 HydrophobicContact CG2-CG1 4.28Å
189	T	95.5	Very high	93.7	Very high	3 Å²	3	21.6 Å²	21.6	2%	0.018	11%	0.109	C	C	.	.	H	α-helix	trans	-62.7	-48.5	178	-59.6	0	0	0	0	111.1	A106 I107 F110 F185 I186 A187 A191 I192 L193	A106-T189 HydrophobicContact CB-CG2 4.07Å; A106-T189 WeakPolarHBondContact O-CG2 3.46Å; I107-T189 HydrophobicContact CG1-CG2 4.05Å; F110-T189 HydrophobicContact CB-CG2 3.49Å; F110-T189 VanDerWaalsContact CB-CG2 3.49Å; F110-T189 HydrophobicContact CD1-CG2 4.41Å; F110-T189 HydrophobicContact CG-CG2 3.91Å; F185-T189 VanDerWaalsContact O-CB 3.31Å; F185-T189 WeakPolarHBondContact O-CB 3.49Å; F185-T189 PolarHBondContact O-N 2.85Å; F185-T189 PolarHBondContact O-OG1 2.97Å; I186-T189 WeakPolarHBondContact O-CB 3.3Å; I186-T189 PolarHBondContact O-N 3.41Å; A187-T189 VanDerWaalsContact C-N 3.35Å; A187-T189 PolarHBondContact O-N 3.48Å; T189-A191 VanDerWaalsContact C-N 3.27Å; T189-A191 PolarHBondContact O-N 3.02Å; T189-I192 PolarHBondContact O-N 2.96Å; T189-L193 HydrophobicContact CG2-CD1 4.44Å; T189-L193 WeakPolarHBondContact O-CG 3.35Å; T189-L193 PolarHBondContact O-N 3.34Å
190	V	95	Very high	93.8	Very high	43 Å²	43	19.7 Å²	19.7	26%	0.261	10%	0.1	S	C	.	.	H	α-helix	trans	-59.1	-41.3	176.5	170	0	0	0	0	110.5	A106 I186 A187 L193 A194 L261	A106-V190 HydrophobicContact CB-CG2 3.98Å; I186-V190 HydrophobicContact CG2-CG2 4.2Å; I186-V190 WeakPolarHBondContact O-CB 3.46Å; I186-V190 VanDerWaalsContact O-CG2 3.32Å; I186-V190 WeakPolarHBondContact O-CG2 3.46Å; I186-V190 PolarHBondContact O-N 3.35Å; A187-V190 PolarHBondContact O-N 2.9Å; V190-L193 PolarHBondContact O-N 3.06Å; V190-A194 VanDerWaalsContact O-CB 3.22Å; V190-A194 WeakPolarHBondContact O-CB 3.15Å; V190-A194 PolarHBondContact O-N 2.81Å; V190-L261 HydrophobicContact CG1-CD1 4.34Å
191	A	96.8	Very high	93.8	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-63.2	-44.8	176.8	0	0	0	0	0	112.6	P39 A187 V188 T189 A194 I195 L261 I264 V265	P39-A191 HydrophobicContact CB-CB 3.96Å; A187-A191 WeakPolarHBondContact O-CB 3.42Å; A187-A191 PolarHBondContact O-N 2.98Å; V188-A191 PolarHBondContact O-N 3.45Å; T189-A191 VanDerWaalsContact C-N 3.27Å; T189-A191 PolarHBondContact O-N 3.02Å; A191-A194 PolarHBondContact O-N 3.06Å; A191-I195 VanDerWaalsContact O-CG1 3.22Å; A191-I195 WeakPolarHBondContact O-CG1 3.36Å; A191-I195 PolarHBondContact O-N 3.5Å; A191-L261 HydrophobicContact CB-CD2 4.01Å; A191-I264 HydrophobicContact CB-CG2 4.38Å; A191-V265 HydrophobicContact CB-CG2 3.83Å
192	I	96.3	Very high	93.9	Very high	3 Å²	3	18.4 Å²	18.4	2%	0.015	9%	0.093	C	C	.	.	H	α-helix	trans	-60.5	-48.8	177	-69.2	166	0	0	0	110.5	P39 I42 F110 V188 T189 I195 E196	P39-I192 HydrophobicContact CB-CG1 3.85Å; I42-I192 HydrophobicContact CB-CD1 4.34Å; I42-I192 HydrophobicContact CB-CG1 4.42Å; I42-I192 HydrophobicContact CD1-CD1 4.39Å; I42-I192 HydrophobicContact CG2-CD1 4.16Å; I42-I192 HydrophobicContact CG2-CG1 4.42Å; I42-I192 HydrophobicContact CG2-CG2 3.96Å; F110-I192 HydrophobicContact CD2-CB 4.49Å; F110-I192 HydrophobicContact CD2-CD1 4.4Å; F110-I192 HydrophobicContact CD2-CG2 4.01Å; F110-I192 HydrophobicContact CE2-CD1 3.74Å; F110-I192 HydrophobicContact CE2-CG2 3.95Å; F110-I192 HydrophobicContact CZ-CD1 4.26Å; V188-I192 HydrophobicContact CG1-CD1 3.89Å; V188-I192 VanDerWaalsContact O-CG1 3.32Å; V188-I192 WeakPolarHBondContact O-CG1 3.5Å; V188-I192 PolarHBondContact O-N 3Å; T189-I192 PolarHBondContact O-N 2.96Å; I192-I195 PolarHBondContact O-N 2.9Å; I192-E196 WeakPolarHBondContact O-CB 3.18Å; I192-E196 PolarHBondContact O-N 3.49Å
193	L	93.9	Very high	94	Very high	17 Å²	17	18.5 Å²	18.5	9%	0.089	9%	0.094	C	C	.	.	H	α-helix	trans	-66.2	-39.3	-179	-66.5	-172.2	0	0	0	112.1	A106 R109 F110 T189 V190 I195 E196 F197	A106-L193 HydrophobicContact CB-CD1 3.86Å; A106-L193 WeakPolarHBondContact O-CD1 3.49Å; R109-L193 HydrophobicContact CB-CD1 4.08Å; F110-L193 HydrophobicContact CB-CD2 4.17Å; F110-L193 HydrophobicContact CB-CG 4.49Å; T189-L193 HydrophobicContact CG2-CD1 4.44Å; T189-L193 WeakPolarHBondContact O-CG 3.35Å; T189-L193 PolarHBondContact O-N 3.34Å; V190-L193 PolarHBondContact O-N 3.06Å; L193-I195 VanDerWaalsContact C-N 3.32Å; L193-I195 PolarHBondContact O-N 3.28Å; L193-E196 WeakPolarHBondContact CD2-OE2 3.45Å; L193-E196 PolarHBondContact O-N 3.17Å; L193-F197 HydrophobicContact CB-CD2 4.19Å; L193-F197 HydrophobicContact CB-CE2 4.34Å; L193-F197 HydrophobicContact CD2-CE2 3.93Å; L193-F197 WeakPolarHBondContact O-CB 3.36Å; L193-F197 VanDerWaalsContact O-CD2 3.24Å; L193-F197 WeakPolarHBondContact O-CD2 3.36Å; L193-F197 PolarHBondContact O-N 2.93Å
194	A	94.7	Very high	94.1	Very high	20 Å²	20	21 Å²	21	17%	0.165	11%	0.109	C	C	.	.	H	α-helix	trans	-60.5	-43.8	175.1	0	0	0	0	0	111	V190 A191 E196 I198 V265	V190-A194 VanDerWaalsContact O-CB 3.22Å; V190-A194 WeakPolarHBondContact O-CB 3.15Å; V190-A194 PolarHBondContact O-N 2.81Å; A191-A194 PolarHBondContact O-N 3.06Å; A194-E196 VanDerWaalsContact C-N 3.33Å; A194-E196 PolarHBondContact O-N 2.92Å; A194-I198 HydrophobicContact CB-CD1 4.08Å; A194-I198 WeakPolarHBondContact O-CB 3.32Å; A194-I198 WeakPolarHBondContact O-CG1 3.39Å; A194-I198 PolarHBondContact O-N 3.07Å; A194-V265 HydrophobicContact CB-CG1 3.62Å; A194-V265 HydrophobicContact CB-CG2 4.14Å
195	I	96.2	Very high	94.2	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-69.6	-30.9	178	-63.5	168.8	0	0	0	112.2	I40 A191 I192 L193 V265 I269 A272	I40-I195 HydrophobicContact CB-CD1 4.46Å; I40-I195 HydrophobicContact CG1-CD1 3.98Å; A191-I195 VanDerWaalsContact O-CG1 3.22Å; A191-I195 WeakPolarHBondContact O-CG1 3.36Å; A191-I195 PolarHBondContact O-N 3.5Å; I192-I195 PolarHBondContact O-N 2.9Å; L193-I195 VanDerWaalsContact C-N 3.32Å; L193-I195 PolarHBondContact O-N 3.28Å; I195-V265 HydrophobicContact CG1-CG1 4.42Å; I195-I269 HydrophobicContact CG1-CG2 4.32Å; I195-A272 HydrophobicContact CG2-CB 3.83Å
196	E	93.1	Very high	94.3	Very high	15 Å²	15	16.6 Å²	16.6	7%	0.07	9%	0.089	C	C	.	.	H	α-helix	trans	-71.3	-44.3	177.3	177.4	175	-159.2	0	0	112.8	R46 I192 L193 A194	R46-E196 HydrophobicContact CB-CB 4.35Å; R46-E196 HydrophobicContact CB-CG 4Å; R46-E196 IonicContact CZ-OE1 3.62Å; R46-E196 IonicContact CZ-OE2 2.66Å; R46-E196 VanDerWaalsContact NE-CD 3.26Å; R46-E196 IonicContact NE-OE1 3.41Å; R46-E196 PolarHBondContact NE-OE1 3.37Å; R46-E196 VanDerWaalsContact NE-OE1 3.11Å; R46-E196 IonicContact NE-OE2 3.4Å; R46-E196 PolarHBondContact NE-OE2 2.88Å; R46-E196 IonicContact NH2-OE1 3.26Å; R46-E196 PolarHBondContact NH2-OE1 3.15Å; R46-E196 VanDerWaalsContact NH2-OE1 3.07Å; R46-E196 IonicContact NH2-OE2 2.67Å; R46-E196 PolarHBondContact NH2-OE2 3.01Å; I192-E196 WeakPolarHBondContact O-CB 3.18Å; I192-E196 PolarHBondContact O-N 3.49Å; L193-E196 WeakPolarHBondContact CD2-OE2 3.45Å; L193-E196 PolarHBondContact O-N 3.17Å; A194-E196 VanDerWaalsContact C-N 3.33Å; A194-E196 PolarHBondContact O-N 2.92Å
197	F	90.6	Very high	94.4	Very high	40 Å²	40	18.5 Å²	18.5	18%	0.175	10%	0.099	C	C	.	.	H	α-helix	trans	-99.6	-29.3	-170.2	-66.1	-58.9	0	0	0	114.9	E58 L193 R199	E58-F197 PolarHBondContact N-O 3.26Å; L193-F197 HydrophobicContact CB-CD2 4.19Å; L193-F197 HydrophobicContact CB-CE2 4.34Å; L193-F197 HydrophobicContact CD2-CE2 3.93Å; L193-F197 WeakPolarHBondContact O-CB 3.36Å; L193-F197 VanDerWaalsContact O-CD2 3.24Å; L193-F197 WeakPolarHBondContact O-CD2 3.36Å; L193-F197 PolarHBondContact O-N 2.93Å; F197-R199 PolarHBondContact O-N 3.01Å
198	I	92.4	Very high	94.4	Very high	42 Å²	42	21.7 Å²	21.7	22%	0.215	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	116.5	176.4	-57.2	174	0	0	0	108.5	V60 A194 I269	V60-I198 HydrophobicContact CG2-CG2 3.49Å; V60-I198 VanDerWaalsContact CG2-CG2 3.49Å; A194-I198 HydrophobicContact CB-CD1 4.08Å; A194-I198 WeakPolarHBondContact O-CB 3.32Å; A194-I198 WeakPolarHBondContact O-CG1 3.39Å; A194-I198 PolarHBondContact O-N 3.07Å; I198-I269 HydrophobicContact CB-CG2 4.01Å; I198-I269 HydrophobicContact CG2-CD1 4.27Å; I198-I269 HydrophobicContact CG2-CG2 4.21Å
199	R	91.6	Very high	94.4	Very high	13 Å²	13	20.6 Å²	20.6	5%	0.049	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	133.3	-178.2	-66.4	-163.8	-171.7	171.3	9.8	112.5	S47 S50 V57 E58 V59 V60 F197 E348	S47-R199 PolarHBondContact O-NH2 3.36Å; S50-R199 PolarHBondContact O-NH2 3.39Å; V57-R199 HydrophobicContact CG1-CB 4.04Å; V57-R199 VanDerWaalsContact CG1-CD 3.47Å; V57-R199 HydrophobicContact CG1-CG 3.6Å; E58-R199 PolarHBondContact O-N 3.18Å; V59-R199 WeakPolarHBondContact CA-O 3.22Å; V60-R199 PolarHBondContact N-O 2.86Å; F197-R199 PolarHBondContact O-N 3.01Å; R199-E348 IonicContact CZ-OE1 2.73Å; R199-E348 IonicContact NH1-OE1 3.62Å; R199-E348 PolarHBondContact NH1-OE1 3.34Å
200	L	92.7	Very high	94.5	Very high	1 Å²	1	20.5 Å²	20.5	1%	0.005	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	118.4	167.1	-62.9	167.4	0	0	0	108.2	V60 N205 L209 I269 F270 M273	V60-L200 HydrophobicContact CB-CD2 4.08Å; V60-L200 HydrophobicContact CG1-CD2 4.2Å; L200-N205 HydrophobicContact CD2-CB 4.1Å; L200-L209 HydrophobicContact CD2-CD2 4.2Å; L200-I269 HydrophobicContact CD1-CG1 4.35Å; L200-I269 HydrophobicContact CD2-CD1 4.49Å; L200-I269 HydrophobicContact CG-CD1 4.47Å; L200-F270 HydrophobicContact CD1-CB 4.19Å; L200-F270 HydrophobicContact CD1-CD2 4.16Å; L200-M273 HydrophobicContact CB-CB 4.3Å; L200-M273 HydrophobicContact CB-CG 4.19Å; L200-M273 HydrophobicContact CB-SD 3.56Å; L200-M273 VanDerWaalsContact CB-SD 3.56Å; L200-M273 HydrophobicContact CD1-CB 4.48Å; L200-M273 HydrophobicContact CD1-SD 4.16Å
201	N	88.6	Confident	94.6	Very high	2 Å²	2	21 Å²	21	1%	0.011	11%	0.113	C	C	.	.	S	Bend	trans	-68.9	-44	179.5	-167.1	8.8	0	0	0	111.9	V59 E346 D347 E348 E350	V59-N201 HydrophobicContact CG1-CB 3.67Å; N201-E346 WeakPolarHBondContact O-CA 2.99Å; N201-E346 VanDerWaalsContact OD1-CG 3.25Å; N201-E346 WeakPolarHBondContact OD1-CG 3.31Å; N201-D347 PolarHBondContact O-N 3.2Å; N201-D347 PolarHBondContact OD1-N 3.09Å; N201-E348 PolarHBondContact ND2-O 3.38Å; N201-E348 PolarHBondContact OD1-N 3.47Å; N201-E348 PolarHBondContact OD1-O 3.43Å; N201-E350 WeakPolarHBondContact ND2-CG 3.36Å
202	K	93.8	Very high	94.5	Very high	59 Å²	59	22 Å²	22	26%	0.257	12%	0.123	S	C	.	.	B	Isolated β-bridge	trans	-121.8	147.6	-173.9	-64.7	172.4	179.5	154.1	0	110.6	V204 N205 E346 E350	K202-V204 PolarHBondContact O-N 2.92Å; K202-N205 WeakPolarHBondContact O-CB 3.49Å; K202-N205 PolarHBondContact O-N 3.33Å; K202-E346 WeakPolarHBondContact CE-OE1 3.32Å; K202-E346 IonicContact NZ-OE1 2.63Å; K202-E350 IonicContact NZ-OE1 3.53Å; K202-E350 PolarHBondContact NZ-OE1 3.44Å
203	F	95.3	Very high	94.4	Very high	4 Å²	4	22.3 Å²	22.3	2%	0.018	13%	0.125	C	C	.	.	H	α-helix	trans	-57	-36.1	176.4	-175.5	-102.2	0	0	0	112.6	N205 G206 I207 F270 M273 L274 L330 M342 F343	F203-N205 VanDerWaalsContact C-N 3.29Å; F203-N205 PolarHBondContact O-N 3.28Å; F203-G206 PolarHBondContact O-N 3.06Å; F203-G206 VanDerWaalsContact O-N 3.14Å; F203-I207 HydrophobicContact CD1-CD1 3.63Å; F203-I207 HydrophobicContact CD1-CG1 4.24Å; F203-I207 HydrophobicContact CE1-CD1 3.39Å; F203-I207 HydrophobicContact CE1-CG1 3.9Å; F203-I207 HydrophobicContact CZ-CD1 4.35Å; F203-I207 HydrophobicContact CZ-CG1 4.44Å; F203-I207 PolarHBondContact O-N 3.45Å; F203-I207 VanDerWaalsContact O-N 3.14Å; F203-F270 HydrophobicContact CD2-CE2 4.04Å; F203-F270 HydrophobicContact CD2-CZ 4.18Å; F203-F270 AromaticContact CE2-CE2 3.71Å; F203-F270 HydrophobicContact CE2-CE2 3.71Å; F203-F270 AromaticContact CE2-CZ 3.4Å; F203-F270 HydrophobicContact CE2-CZ 3.4Å; F203-F270 VanDerWaalsContact CE2-CZ 3.4Å; F203-F270 HydrophobicContact CZ-CE2 4.34Å; F203-F270 AromaticContact CZ-CZ 3.92Å; F203-F270 HydrophobicContact CZ-CZ 3.92Å; F203-M273 HydrophobicContact CB-CE 4.42Å; F203-M273 HydrophobicContact CD2-CE 3.59Å; F203-M273 HydrophobicContact CE2-CE 4.31Å; F203-M273 HydrophobicContact CG-CE 4.4Å; F203-L274 HydrophobicContact CE2-CD2 4.1Å; F203-L330 HydrophobicContact CE1-CD2 3.71Å; F203-L330 HydrophobicContact CE1-CG 4.27Å; F203-L330 HydrophobicContact CZ-CD2 3.85Å; F203-L330 HydrophobicContact CZ-CG 3.99Å; F203-M342 HydrophobicContact CB-CG 4.27Å; F203-M342 VanDerWaalsContact CB-O 3.23Å; F203-M342 WeakPolarHBondContact CB-O 3.14Å; F203-M342 HydrophobicContact CD1-CG 3.92Å; F203-M342 HydrophobicContact CD1-SD 4.3Å; F203-M342 HydrophobicContact CD2-CG 3.59Å; F203-M342 HydrophobicContact CD2-SD 3.93Å; F203-M342 HydrophobicContact CE1-CG 4.12Å; F203-M342 HydrophobicContact CE1-SD 3.88Å; F203-M342 HydrophobicContact CE2-CE 4.34Å; F203-M342 HydrophobicContact CE2-CG 3.83Å; F203-M342 HydrophobicContact CE2-SD 3.48Å; F203-M342 WeakPolarHBondContact CE2-SD 3.49Å; F203-M342 HydrophobicContact CG-CG 3.66Å; F203-M342 HydrophobicContact CG-SD 4.33Å; F203-M342 HydrophobicContact CZ-CG 4.1Å; F203-M342 HydrophobicContact CZ-SD 3.47Å; F203-M342 WeakPolarHBondContact CZ-SD 3.47Å; F203-F343 HydrophobicContact CD1-CD1 4.32Å; F203-F343 HydrophobicContact CD1-CE1 4.09Å; F203-F343 HydrophobicContact CD1-CE2 4.39Å; F203-F343 HydrophobicContact CD1-CZ 4.13Å; F203-F343 HydrophobicContact CE1-CE1 4.37Å; F203-F343 HydrophobicContact CE1-CE2 4.25Å; F203-F343 AromaticContact CE1-CZ 3.99Å; F203-F343 HydrophobicContact CE1-CZ 3.99Å
204	V	95.8	Very high	94.5	Very high	57 Å²	57	24.2 Å²	24.2	35%	0.345	13%	0.132	S	C	.	.	H	α-helix	trans	-60.5	-36.1	175.9	179.3	0	0	0	0	112	K202 G206 I207 L208 F343	K202-V204 PolarHBondContact O-N 2.92Å; V204-G206 VanDerWaalsContact C-N 3.27Å; V204-G206 PolarHBondContact O-N 3.47Å; V204-I207 PolarHBondContact O-N 3.35Å; V204-L208 HydrophobicContact CG1-CD1 4.05Å; V204-L208 HydrophobicContact CG1-CG 4.26Å; V204-L208 WeakPolarHBondContact O-CG 3.24Å; V204-L208 PolarHBondContact O-N 3.11Å; V204-F343 HydrophobicContact CG2-CD1 3.95Å; V204-F343 HydrophobicContact CG2-CE1 4.31Å
205	N	95.2	Very high	94.5	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-63.9	-38.7	177.9	-58.2	-0.7	0	0	0	110.1	V60 S62 A65 L200 K202 F203 L208 L209	V60-N205 PolarHBondContact O-ND2 3.23Å; S62-N205 WeakPolarHBondContact CA-OD1 3.45Å; S62-N205 WeakPolarHBondContact CB-OD1 3.42Å; S62-N205 PolarHBondContact N-ND2 3.45Å; S62-N205 PolarHBondContact OG-OD1 3.27Å; A65-N205 HydrophobicContact CB-CB 4.3Å; A65-N205 WeakPolarHBondContact CB-O 3.04Å; L200-N205 HydrophobicContact CD2-CB 4.1Å; K202-N205 WeakPolarHBondContact O-CB 3.49Å; K202-N205 PolarHBondContact O-N 3.33Å; F203-N205 VanDerWaalsContact C-N 3.29Å; F203-N205 PolarHBondContact O-N 3.28Å; N205-L208 PolarHBondContact O-N 2.77Å; N205-L209 VanDerWaalsContact O-CB 3.28Å; N205-L209 WeakPolarHBondContact O-CB 3.05Å; N205-L209 PolarHBondContact O-N 3.14Å
206	G	96	Very high	94.4	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-61.8	-44.1	172.9	0	0	0	0	0	113.6	F203 V204 L210	F203-G206 PolarHBondContact O-N 3.06Å; F203-G206 VanDerWaalsContact O-N 3.14Å; V204-G206 VanDerWaalsContact C-N 3.27Å; V204-G206 PolarHBondContact O-N 3.47Å; G206-L210 WeakPolarHBondContact O-CB 3.3Å; G206-L210 WeakPolarHBondContact O-CG 3.2Å; G206-L210 PolarHBondContact O-N 3Å
207	I	96.8	Very high	94.3	Very high	40 Å²	40	28.9 Å²	28.9	21%	0.205	16%	0.156	C	C	.	.	H	α-helix	trans	-61.9	-49.4	175.2	-66.3	164.7	0	0	0	110.7	F203 V204 L209 L210 C211 L326 F343	F203-I207 HydrophobicContact CD1-CD1 3.63Å; F203-I207 HydrophobicContact CD1-CG1 4.24Å; F203-I207 HydrophobicContact CE1-CD1 3.39Å; F203-I207 HydrophobicContact CE1-CG1 3.9Å; F203-I207 HydrophobicContact CZ-CD1 4.35Å; F203-I207 HydrophobicContact CZ-CG1 4.44Å; F203-I207 PolarHBondContact O-N 3.45Å; F203-I207 VanDerWaalsContact O-N 3.14Å; V204-I207 PolarHBondContact O-N 3.35Å; I207-L209 VanDerWaalsContact C-N 3.32Å; I207-L209 PolarHBondContact O-N 3.46Å; I207-L210 PolarHBondContact O-N 2.83Å; I207-C211 WeakPolarHBondContact O-CB 3.21Å; I207-C211 PolarHBondContact O-N 3.04Å; I207-C211 PolarHBondContact O-SG 2.93Å; I207-C211 VanDerWaalsContact O-SG 3.39Å; I207-L326 HydrophobicContact CG1-CD2 4Å; I207-F343 HydrophobicContact CD1-CE1 3.87Å; I207-F343 HydrophobicContact CD1-CZ 4.03Å
208	L	96.6	Very high	94.4	Very high	67 Å²	67	29.8 Å²	29.8	35%	0.351	16%	0.162	S	C	.	.	H	α-helix	trans	-58.6	-45.8	-179.3	-73.2	171.7	0	0	0	111.3	A65 V204 N205 G212	A65-L208 HydrophobicContact CB-CB 4.16Å; V204-L208 HydrophobicContact CG1-CD1 4.05Å; V204-L208 HydrophobicContact CG1-CG 4.26Å; V204-L208 WeakPolarHBondContact O-CG 3.24Å; V204-L208 PolarHBondContact O-N 3.11Å; N205-L208 PolarHBondContact O-N 2.77Å; L208-G212 WeakPolarHBondContact O-CA 3.48Å; L208-G212 PolarHBondContact O-N 3.23Å
209	L	96.2	Very high	94.4	Very high	5 Å²	5	33.2 Å²	33.2	3%	0.026	18%	0.176	C	C	.	.	H	α-helix	trans	-63.8	-50.9	179.7	-177.2	64.5	0	0	0	111.9	A65 F68 L200 N205 I207 G212 L213 V266 I269	A65-L209 HydrophobicContact CB-CB 4.1Å; F68-L209 HydrophobicContact CB-CD1 3.64Å; F68-L209 HydrophobicContact CD1-CD1 3.69Å; F68-L209 HydrophobicContact CD2-CD1 4.21Å; F68-L209 HydrophobicContact CE1-CD1 4.4Å; F68-L209 HydrophobicContact CG-CD1 3.58Å; L200-L209 HydrophobicContact CD2-CD2 4.2Å; N205-L209 VanDerWaalsContact O-CB 3.28Å; N205-L209 WeakPolarHBondContact O-CB 3.05Å; N205-L209 PolarHBondContact O-N 3.14Å; I207-L209 VanDerWaalsContact C-N 3.32Å; I207-L209 PolarHBondContact O-N 3.46Å; L209-G212 PolarHBondContact O-N 2.72Å; L209-L213 HydrophobicContact CD1-CD1 3.9Å; L209-L213 HydrophobicContact CG-CD1 4.14Å; L209-L213 WeakPolarHBondContact O-CB 3.35Å; L209-L213 WeakPolarHBondContact O-CG 3.23Å; L209-L213 PolarHBondContact O-N 2.81Å; L209-V266 HydrophobicContact CD2-CG1 4.1Å; L209-V266 HydrophobicContact CG-CG1 4.11Å; L209-I269 HydrophobicContact CD2-CD1 3.44Å; L209-I269 VanDerWaalsContact CD2-CD1 3.44Å
210	L	96.6	Very high	94.4	Very high	2 Å²	2	33.4 Å²	33.4	1%	0.01	18%	0.176	C	C	.	.	H	α-helix	trans	-67.4	-44.5	-177.5	-73.8	172.6	0	0	0	112	G206 I207 L213 F214 V266 P267 F270 V322 L326	G206-L210 WeakPolarHBondContact O-CB 3.3Å; G206-L210 WeakPolarHBondContact O-CG 3.2Å; G206-L210 PolarHBondContact O-N 3Å; I207-L210 PolarHBondContact O-N 2.83Å; L210-L213 PolarHBondContact O-N 2.95Å; L210-F214 WeakPolarHBondContact O-CB 3.44Å; L210-F214 PolarHBondContact O-N 2.76Å; L210-V266 HydrophobicContact CD2-CG1 3.72Å; L210-P267 HydrophobicContact CD2-CG 4.48Å; L210-F270 HydrophobicContact CD1-CB 3.96Å; L210-F270 HydrophobicContact CD1-CD1 3.93Å; L210-F270 HydrophobicContact CD1-CD2 3.94Å; L210-F270 HydrophobicContact CD1-CE1 4.4Å; L210-F270 HydrophobicContact CD1-CE2 4.4Å; L210-F270 HydrophobicContact CD1-CG 3.66Å; L210-V322 HydrophobicContact CB-CG1 3.99Å; L210-V322 HydrophobicContact CB-CG2 4.05Å; L210-V322 HydrophobicContact CD2-CG2 4.08Å; L210-V322 WeakPolarHBondContact O-CG2 3.36Å; L210-L326 HydrophobicContact CB-CD1 4.25Å; L210-L326 HydrophobicContact CB-CG 4.48Å; L210-L326 HydrophobicContact CD1-CD2 3.64Å; L210-L326 HydrophobicContact CD1-CG 3.96Å
211	C	96.6	Very high	94.1	Very high	54 Å²	54	34 Å²	34	37%	0.365	18%	0.18	S	C	.	.	H	α-helix	trans	-67.1	-37.3	176.5	-70.5	0	0	0	0	112.1	I207 F214 V215	I207-C211 WeakPolarHBondContact O-CB 3.21Å; I207-C211 PolarHBondContact O-N 3.04Å; I207-C211 PolarHBondContact O-SG 2.93Å; I207-C211 VanDerWaalsContact O-SG 3.39Å; C211-F214 WeakPolarHBondContact O-CB 3.29Å; C211-F214 PolarHBondContact O-N 3.07Å; C211-V215 PolarHBondContact O-N 2.69Å
212	G	95.8	Very high	94.1	Very high	20 Å²	20	39.3 Å²	39.3	21%	0.206	20%	0.203	C	C	.	.	H	α-helix	trans	-62.3	-46	174.7	0	0	0	0	0	111.9	P69 L208 L209 V215 Y216	P69-G212 VanDerWaalsContact CG-CA 3.47Å; L208-G212 WeakPolarHBondContact O-CA 3.48Å; L208-G212 PolarHBondContact O-N 3.23Å; L209-G212 PolarHBondContact O-N 2.72Å; G212-V215 PolarHBondContact O-N 3.37Å; G212-Y216 PolarHBondContact O-N 3.11Å
213	L	94.9	Very high	93.7	Very high	9 Å²	9	39.2 Å²	39.2	5%	0.047	22%	0.219	C	C	.	.	H	α-helix	trans	-72.7	-27.3	178.4	-75.6	168.9	0	0	0	113.5	F68 L209 L210 Y216 D217 V266 L318	F68-L213 HydrophobicContact CD1-CD1 3.85Å; F68-L213 HydrophobicContact CD1-CD2 3.84Å; F68-L213 HydrophobicContact CD1-CG 4.03Å; F68-L213 HydrophobicContact CE1-CD1 3.87Å; F68-L213 HydrophobicContact CE1-CD2 3.98Å; F68-L213 HydrophobicContact CE1-CG 4.37Å; L209-L213 HydrophobicContact CD1-CD1 3.9Å; L209-L213 HydrophobicContact CG-CD1 4.14Å; L209-L213 WeakPolarHBondContact O-CB 3.35Å; L209-L213 WeakPolarHBondContact O-CG 3.23Å; L209-L213 PolarHBondContact O-N 2.81Å; L210-L213 PolarHBondContact O-N 2.95Å; L213-Y216 HydrophobicContact CD2-CD1 4.13Å; L213-Y216 HydrophobicContact CD2-CG 4.27Å; L213-Y216 WeakPolarHBondContact O-CB 3.45Å; L213-Y216 PolarHBondContact O-N 2.93Å; L213-D217 WeakPolarHBondContact O-CB 3.29Å; L213-D217 PolarHBondContact O-N 3.3Å; L213-V266 HydrophobicContact CD1-CB 4.1Å; L213-V266 HydrophobicContact CD1-CG1 3.39Å; L213-V266 HydrophobicContact CD1-CG2 3.7Å; L213-L318 HydrophobicContact CB-CD1 3.59Å
214	F	95.4	Very high	93.4	Very high	57 Å²	57	40.8 Å²	40.8	25%	0.25	23%	0.229	C	C	.	.	H	α-helix	trans	-58.7	-48.1	169.3	172.2	-92.1	0	0	0	111.8	L210 C211 D217 I218 L319 V322 P323	L210-F214 WeakPolarHBondContact O-CB 3.44Å; L210-F214 PolarHBondContact O-N 2.76Å; C211-F214 WeakPolarHBondContact O-CB 3.29Å; C211-F214 PolarHBondContact O-N 3.07Å; F214-D217 PolarHBondContact O-N 3.02Å; F214-I218 HydrophobicContact CD1-CD1 3.9Å; F214-I218 HydrophobicContact CE1-CD1 3.42Å; F214-I218 VanDerWaalsContact CE1-CD1 3.42Å; F214-I218 HydrophobicContact CE2-CD1 4.16Å; F214-I218 HydrophobicContact CG-CD1 4.42Å; F214-I218 HydrophobicContact CZ-CD1 3.57Å; F214-I218 WeakPolarHBondContact O-CG1 3.32Å; F214-I218 PolarHBondContact O-N 3.22Å; F214-L319 HydrophobicContact CE2-CD1 3.66Å; F214-L319 HydrophobicContact CZ-CD1 3.93Å; F214-V322 HydrophobicContact CB-CB 4.24Å; F214-V322 HydrophobicContact CB-CG1 4.14Å; F214-V322 HydrophobicContact CB-CG2 4.12Å; F214-V322 HydrophobicContact CD2-CB 4.11Å; F214-V322 HydrophobicContact CD2-CG1 4.41Å; F214-P323 HydrophobicContact CE2-CG 4.3Å
215	V	94.4	Very high	92.9	Very high	94 Å²	94	40.5 Å²	40.5	57%	0.57	24%	0.238	S	C	*	.	H	α-helix	trans	-67.3	-40.9	178	177.9	0	0	0	0	111	C211 G212 D217 I218 F219	C211-V215 PolarHBondContact O-N 2.69Å; G212-V215 PolarHBondContact O-N 3.37Å; V215-D217 PolarHBondContact O-N 3.07Å; V215-I218 PolarHBondContact O-N 2.97Å; V215-F219 WeakPolarHBondContact O-CB 3.3Å; V215-F219 PolarHBondContact O-N 3.25Å
216	Y	93.9	Very high	92.7	Very high	35 Å²	35	41.2 Å²	41.2	14%	0.137	24%	0.242	C	C	.	.	H	α-helix	trans	-54.1	-50.7	174.2	168.1	-88.7	0	0	0	112.1	A72 S73 L76 G212 L213 I218 F219 W220	A72-Y216 HydrophobicContact CB-CD2 4.28Å; A72-Y216 HydrophobicContact CB-CE2 3.76Å; S73-Y216 VanDerWaalsContact OG-CD2 3.29Å; S73-Y216 WeakPolarHBondContact OG-CD2 3.42Å; S73-Y216 WeakPolarHBondContact OG-CE2 3.28Å; L76-Y216 WeakPolarHBondContact CD1-OH 3.32Å; G212-Y216 PolarHBondContact O-N 3.11Å; L213-Y216 HydrophobicContact CD2-CD1 4.13Å; L213-Y216 HydrophobicContact CD2-CG 4.27Å; L213-Y216 WeakPolarHBondContact O-CB 3.45Å; L213-Y216 PolarHBondContact O-N 2.93Å; Y216-I218 PolarHBondContact O-N 2.96Å; Y216-F219 PolarHBondContact O-N 3.03Å; Y216-W220 AromaticContact CD2-CD1 3.22Å; Y216-W220 HydrophobicContact CD2-CG 4.44Å; Y216-W220 AromaticContact CD2-NE1 3.41Å; Y216-W220 AromaticContact CE2-CD1 3.12Å; Y216-W220 HydrophobicContact CE2-CG 4.11Å; Y216-W220 AromaticContact CE2-NE1 3.21Å; Y216-W220 AromaticContact CG-CD1 3.75Å; Y216-W220 AromaticContact CZ-CD1 3.59Å; Y216-W220 VanDerWaalsContact O-CD1 3.24Å; Y216-W220 PolarHBondContact O-N 2.93Å
217	D	91.7	Very high	92.2	Very high	5 Å²	5	43.7 Å²	43.7	3%	0.027	25%	0.254	C	S	.	.	H	α-helix	trans	-66.3	-41.4	-174.4	-157.5	28.6	0	0	0	110.9	L213 F214 V215 F219 W220 V221 P316 A317 L318	L213-D217 WeakPolarHBondContact O-CB 3.29Å; L213-D217 PolarHBondContact O-N 3.3Å; F214-D217 PolarHBondContact O-N 3.02Å; V215-D217 PolarHBondContact O-N 3.07Å; D217-F219 PolarHBondContact O-N 3.46Å; D217-W220 PolarHBondContact O-N 3.44Å; D217-V221 WeakPolarHBondContact O-CB 3.23Å; D217-V221 VanDerWaalsContact O-CG2 3.23Å; D217-V221 WeakPolarHBondContact O-CG2 3.32Å; D217-V221 PolarHBondContact O-N 2.96Å; D217-V221 VanDerWaalsContact OD1-CG2 3.3Å; D217-V221 WeakPolarHBondContact OD1-CG2 3.09Å; D217-P316 HydrophobicContact CB-CB 4.12Å; D217-P316 WeakPolarHBondContact OD2-CA 3.32Å; D217-P316 WeakPolarHBondContact OD2-CB 3.28Å; D217-A317 PolarHBondContact OD2-N 2.84Å; D217-L318 HydrophobicContact CB-CB 4.25Å; D217-L318 HydrophobicContact CB-CD1 4.42Å; D217-L318 PolarHBondContact OD2-N 3.46Å
218	I	91.4	Very high	91.6	Very high	58 Å²	58	44.1 Å²	44.1	30%	0.297	26%	0.256	S	S	.	.	H	α-helix	trans	-58.8	-47	173.6	-68.1	170	0	0	0	111.1	F214 V215 Y216 F222 L319	F214-I218 HydrophobicContact CD1-CD1 3.9Å; F214-I218 HydrophobicContact CE1-CD1 3.42Å; F214-I218 VanDerWaalsContact CE1-CD1 3.42Å; F214-I218 HydrophobicContact CE2-CD1 4.16Å; F214-I218 HydrophobicContact CG-CD1 4.42Å; F214-I218 HydrophobicContact CZ-CD1 3.57Å; F214-I218 WeakPolarHBondContact O-CG1 3.32Å; F214-I218 PolarHBondContact O-N 3.22Å; V215-I218 PolarHBondContact O-N 2.97Å; Y216-I218 PolarHBondContact O-N 2.96Å; I218-F222 HydrophobicContact CG2-CD2 4.3Å; I218-F222 WeakPolarHBondContact O-CB 3.3Å; I218-F222 PolarHBondContact O-N 3.48Å; I218-F222 VanDerWaalsContact O-N 3.09Å; I218-L319 HydrophobicContact CD1-CD1 4.07Å; I218-L319 HydrophobicContact CG1-CD1 4.33Å
219	F	92.7	Very high	91.1	Very high	115 Å²	115	42.2 Å²	42.2	50%	0.504	25%	0.25	S	C	.	.	I	π-helix	trans	-64.8	-46.7	-179.3	175.9	-95.9	0	0	0	112.3	V215 Y216 D217 G223 T224	V215-F219 WeakPolarHBondContact O-CB 3.3Å; V215-F219 PolarHBondContact O-N 3.25Å; Y216-F219 PolarHBondContact O-N 3.03Å; D217-F219 PolarHBondContact O-N 3.46Å; F219-G223 CarbonylContact O-C 3.54Å; F219-G223 WeakPolarHBondContact O-CA 3.25Å; F219-G223 PolarHBondContact O-N 2.96Å; F219-T224 HydrophobicContact CE1-CG2 4.07Å; F219-T224 HydrophobicContact CZ-CG2 4.09Å; F219-T224 PolarHBondContact O-N 3.15Å
220	W	92.1	Very high	90.7	Very high	16 Å²	16	42.7 Å²	42.7	6%	0.061	25%	0.253	C	S	.	.	I	π-helix	trans	-81.8	-26.1	-173.9	-74.9	107.4	0	0	0	114.3	S73 L76 F77 Y216 D217 T224 V226 M227	S73-W220 PolarHBondContact OG-NE1 2.94Å; L76-W220 HydrophobicContact CD2-CD2 3.82Å; L76-W220 HydrophobicContact CD2-CE3 3.44Å; L76-W220 VanDerWaalsContact CD2-CE3 3.44Å; L76-W220 HydrophobicContact CD2-CH2 4.02Å; L76-W220 HydrophobicContact CD2-CZ2 4.32Å; L76-W220 HydrophobicContact CD2-CZ3 3.57Å; F77-W220 HydrophobicContact CB-CH2 3.91Å; F77-W220 HydrophobicContact CB-CZ2 4.46Å; F77-W220 HydrophobicContact CD2-CH2 4.14Å; F77-W220 HydrophobicContact CG-CH2 4.38Å; Y216-W220 AromaticContact CD2-CD1 3.22Å; Y216-W220 HydrophobicContact CD2-CG 4.44Å; Y216-W220 AromaticContact CD2-NE1 3.41Å; Y216-W220 AromaticContact CE2-CD1 3.12Å; Y216-W220 HydrophobicContact CE2-CG 4.11Å; Y216-W220 AromaticContact CE2-NE1 3.21Å; Y216-W220 AromaticContact CG-CD1 3.75Å; Y216-W220 AromaticContact CZ-CD1 3.59Å; Y216-W220 VanDerWaalsContact O-CD1 3.24Å; Y216-W220 PolarHBondContact O-N 2.93Å; D217-W220 PolarHBondContact O-N 3.44Å; W220-T224 HydrophobicContact CE3-CG2 4.33Å; W220-T224 VanDerWaalsContact CE3-OG1 3.23Å; W220-T224 HydrophobicContact CZ3-CG2 4.4Å; W220-T224 PolarHBondContact O-OG1 2.85Å; W220-V226 HydrophobicContact CE3-CB 3.84Å; W220-V226 HydrophobicContact CE3-CG1 4.23Å; W220-V226 HydrophobicContact CE3-CG2 4.47Å; W220-V226 HydrophobicContact CZ3-CB 3.62Å; W220-V226 HydrophobicContact CZ3-CG1 3.77Å; W220-V226 HydrophobicContact CZ3-CG2 3.9Å; W220-M227 HydrophobicContact CB-CB 4.22Å; W220-M227 HydrophobicContact CB-SD 4.19Å; W220-M227 WeakPolarHBondContact O-CB 3.43Å
221	V	86.9	Confident	90.1	Very high	15 Å²	15	44 Å²	44	9%	0.091	26%	0.264	C	S	.	.	I	π-helix	trans	-85.1	-46.8	176.5	178.4	0	0	0	0	111.8	D217 M227 P316	D217-V221 WeakPolarHBondContact O-CB 3.23Å; D217-V221 VanDerWaalsContact O-CG2 3.23Å; D217-V221 WeakPolarHBondContact O-CG2 3.32Å; D217-V221 PolarHBondContact O-N 2.96Å; D217-V221 VanDerWaalsContact OD1-CG2 3.3Å; D217-V221 WeakPolarHBondContact OD1-CG2 3.09Å; V221-M227 HydrophobicContact CG2-CE 4Å; V221-M227 HydrophobicContact CG2-SD 3.35Å; V221-M227 WeakPolarHBondContact CG2-SD 3.43Å; V221-P316 HydrophobicContact CB-CB 4.27Å; V221-P316 HydrophobicContact CG1-CB 4.47Å; V221-P316 HydrophobicContact CG1-CG 4.5Å; V221-P316 HydrophobicContact CG2-CB 4.08Å
222	F	87.2	Confident	89.4	Confident	112 Å²	112	48.3 Å²	48.3	49%	0.491	28%	0.277	S	S	.	.	I	π-helix	trans	-95.9	-34.8	-176.8	-63.4	-56.1	0	0	0	113.6	I218 P316	I218-F222 HydrophobicContact CG2-CD2 4.3Å; I218-F222 WeakPolarHBondContact O-CB 3.3Å; I218-F222 PolarHBondContact O-N 3.48Å; I218-F222 VanDerWaalsContact O-N 3.09Å; F222-P316 HydrophobicContact CD2-CG 4.3Å; F222-P316 HydrophobicContact CE2-CG 3.46Å; F222-P316 VanDerWaalsContact CE2-CG 3.46Å; F222-P316 HydrophobicContact CZ-CG 3.73Å
223	G	86.7	Confident	89	Confident	57 Å²	57	50 Å²	50	59%	0.588	28%	0.281	S	S	*	.	I	π-helix	trans	-80.5	-26	-175.5	0	0	0	0	0	114.1	F219	F219-G223 CarbonylContact O-C 3.54Å; F219-G223 WeakPolarHBondContact O-CA 3.25Å; F219-G223 PolarHBondContact O-N 2.96Å
224	T	88.7	Confident	88.4	Confident	38 Å²	38	50.5 Å²	50.5	23%	0.233	28%	0.284	C	S	.	.			trans	-141.2	153.8	-176.6	81.9	0	0	0	0	112.4	F219 W220 V226	F219-T224 HydrophobicContact CE1-CG2 4.07Å; F219-T224 HydrophobicContact CZ-CG2 4.09Å; F219-T224 PolarHBondContact O-N 3.15Å; W220-T224 HydrophobicContact CE3-CG2 4.33Å; W220-T224 VanDerWaalsContact CE3-OG1 3.23Å; W220-T224 HydrophobicContact CZ3-CG2 4.4Å; W220-T224 PolarHBondContact O-OG1 2.85Å; T224-V226 PolarHBondContact O-N 3.23Å; T224-V226 PolarHBondContact OG1-N 3.03Å
225	G	86.1	Confident	87.8	Confident	51 Å²	51	50.8 Å²	50.8	53%	0.526	29%	0.288	S	S	.	.	S	Bend	trans	-81.8	3.1	171.4	0	0	0	0	0	114.5	A229	G225-A229 WeakPolarHBondContact O-CB 3.33Å; G225-A229 PolarHBondContact O-N 3.33Å
226	V	90.2	Very high	87.3	Confident	15 Å²	15	46.4 Å²	46.4	9%	0.091	26%	0.261	C	S	.	.	H	α-helix	trans	-70.2	-44.1	-167.2	179.9	0	0	0	0	111.7	L76 Y80 W220 T224 M228 A229 V230	L76-V226 HydrophobicContact CD2-CB 4.13Å; L76-V226 HydrophobicContact CD2-CG1 3.36Å; Y80-V226 HydrophobicContact CD1-CG1 4.01Å; Y80-V226 HydrophobicContact CD1-CG2 4.21Å; Y80-V226 HydrophobicContact CD2-CB 4.44Å; Y80-V226 HydrophobicContact CD2-CG1 3.71Å; Y80-V226 HydrophobicContact CD2-CG2 4.48Å; Y80-V226 HydrophobicContact CE1-CG2 4.16Å; Y80-V226 HydrophobicContact CE2-CG1 4.4Å; Y80-V226 HydrophobicContact CE2-CG2 4.43Å; Y80-V226 HydrophobicContact CG-CB 4.47Å; Y80-V226 HydrophobicContact CG-CG1 3.48Å; Y80-V226 VanDerWaalsContact CG-CG1 3.48Å; Y80-V226 HydrophobicContact CG-CG2 4.37Å; W220-V226 HydrophobicContact CE3-CB 3.84Å; W220-V226 HydrophobicContact CE3-CG1 4.23Å; W220-V226 HydrophobicContact CE3-CG2 4.47Å; W220-V226 HydrophobicContact CZ3-CB 3.62Å; W220-V226 HydrophobicContact CZ3-CG1 3.77Å; W220-V226 HydrophobicContact CZ3-CG2 3.9Å; T224-V226 PolarHBondContact O-N 3.23Å; T224-V226 PolarHBondContact OG1-N 3.03Å; V226-M228 VanDerWaalsContact C-N 3.31Å; V226-M228 PolarHBondContact O-N 3.12Å; V226-A229 PolarHBondContact O-N 2.69Å; V226-A229 VanDerWaalsContact O-N 3.17Å; V226-V230 HydrophobicContact CG1-CG2 4.42Å; V226-V230 WeakPolarHBondContact O-CG2 3.44Å; V226-V230 PolarHBondContact O-N 2.9Å
227	M	86.4	Confident	86.7	Confident	53 Å²	53	44.8 Å²	44.8	26%	0.261	26%	0.255	S	S	.	.	H	α-helix	trans	-60.5	-42.4	179.9	-177.2	168.4	175.4	0	0	111.8	L76 W220 V221 V230 A231	L76-M227 HydrophobicContact CD1-CB 4.23Å; L76-M227 HydrophobicContact CD1-CG 4.28Å; W220-M227 HydrophobicContact CB-CB 4.22Å; W220-M227 HydrophobicContact CB-SD 4.19Å; W220-M227 WeakPolarHBondContact O-CB 3.43Å; V221-M227 HydrophobicContact CG2-CE 4Å; V221-M227 HydrophobicContact CG2-SD 3.35Å; V221-M227 WeakPolarHBondContact CG2-SD 3.43Å; M227-V230 PolarHBondContact O-N 3.05Å; M227-A231 VanDerWaalsContact O-CB 3.25Å; M227-A231 WeakPolarHBondContact O-CB 3.4Å; M227-A231 PolarHBondContact O-N 3.38Å
228	M	82.8	Confident	86.3	Confident	48 Å²	48	48.4 Å²	48.4	24%	0.236	27%	0.274	C	S	.	.	H	α-helix	trans	-68.8	-36	176.9	-66.5	-55.5	-61.9	0	0	112.5	V226 K232 A314	V226-M228 VanDerWaalsContact C-N 3.31Å; V226-M228 PolarHBondContact O-N 3.12Å; M228-K232 WeakPolarHBondContact O-CB 3.49Å; M228-K232 VanDerWaalsContact O-CG 3.28Å; M228-K232 WeakPolarHBondContact O-CG 3.22Å; M228-K232 PolarHBondContact O-N 3.05Å; M228-K232 VanDerWaalsContact O-N 3.12Å; M228-A314 HydrophobicContact CE-CB 4.19Å; M228-A314 HydrophobicContact SD-CB 4.05Å
229	A	87	Confident	86.1	Confident	28 Å²	28	47.5 Å²	47.5	23%	0.231	27%	0.267	C	S	.	.	H	α-helix	trans	-64.8	-44.6	175	0	0	0	0	0	111.6	Y80 G225 V226 N233	Y80-A229 HydrophobicContact CD2-CB 4.19Å; Y80-A229 HydrophobicContact CE2-CB 3.92Å; G225-A229 WeakPolarHBondContact O-CB 3.33Å; G225-A229 PolarHBondContact O-N 3.33Å; V226-A229 PolarHBondContact O-N 2.69Å; V226-A229 VanDerWaalsContact O-N 3.17Å; A229-N233 PolarHBondContact O-N 3.24Å; A229-N233 PolarHBondContact O-ND2 3.29Å
230	V	88	Confident	86.1	Confident	14 Å²	14	42 Å²	42	9%	0.085	24%	0.243	C	C	.	.	H	α-helix	trans	-65.6	-47.1	176.5	173.2	0	0	0	0	110.6	I79 Y80 F83 V226 M227 K232 N233 L234	I79-V230 HydrophobicContact CG2-CG1 4.04Å; I79-V230 HydrophobicContact CG2-CG2 4.32Å; Y80-V230 HydrophobicContact CD2-CG2 4.48Å; F83-V230 HydrophobicContact CD2-CG2 4.37Å; F83-V230 HydrophobicContact CE2-CG1 4.3Å; F83-V230 HydrophobicContact CE2-CG2 4.43Å; V226-V230 HydrophobicContact CG1-CG2 4.42Å; V226-V230 WeakPolarHBondContact O-CG2 3.44Å; V226-V230 PolarHBondContact O-N 2.9Å; M227-V230 PolarHBondContact O-N 3.05Å; V230-K232 VanDerWaalsContact C-N 3.29Å; V230-K232 PolarHBondContact O-N 3.43Å; V230-N233 PolarHBondContact O-N 3.4Å; V230-L234 HydrophobicContact CG1-CD2 4.1Å; V230-L234 WeakPolarHBondContact O-CB 3.36Å; V230-L234 PolarHBondContact O-N 3.36Å
231	A	82.5	Confident	86	Confident	31 Å²	31	41.6 Å²	41.6	26%	0.256	24%	0.243	S	C	.	.	H	α-helix	trans	-61.2	-34.4	-177.7	0	0	0	0	0	113.8	M227 K239	M227-A231 VanDerWaalsContact O-CB 3.25Å; M227-A231 WeakPolarHBondContact O-CB 3.4Å; M227-A231 PolarHBondContact O-N 3.38Å; A231-K239 PolarHBondContact O-NZ 3.24Å; A231-K239 VanDerWaalsContact O-NZ 3.13Å
232	K	83.5	Confident	86.2	Confident	143 Å²	143	42 Å²	42	62%	0.622	24%	0.243	S	C	*	.	H	α-helix	trans	-75.4	-38.4	177.6	-75.1	178.8	179.8	-177.1	0	113	M228 V230	M228-K232 WeakPolarHBondContact O-CB 3.49Å; M228-K232 VanDerWaalsContact O-CG 3.28Å; M228-K232 WeakPolarHBondContact O-CG 3.22Å; M228-K232 PolarHBondContact O-N 3.05Å; M228-K232 VanDerWaalsContact O-N 3.12Å; V230-K232 VanDerWaalsContact C-N 3.29Å; V230-K232 PolarHBondContact O-N 3.43Å
233	N	85.8	Confident	86.1	Confident	57 Å²	57	36.6 Å²	36.6	31%	0.305	22%	0.22	S	C	.	.	H	α-helix	trans	-87.7	-20.5	-174.1	-69.6	-55.5	0	0	0	113.7	F83 I88 N92 A229 V230	F83-N233 HydrophobicContact CD1-CB 4.19Å; F83-N233 HydrophobicContact CE1-CB 3.83Å; F83-N233 HydrophobicContact CE2-CB 4.27Å; F83-N233 HydrophobicContact CZ-CB 3.87Å; I88-N233 HydrophobicContact CD1-CB 4.41Å; I88-N233 VanDerWaalsContact CD1-OD1 3.26Å; I88-N233 WeakPolarHBondContact CD1-OD1 3.47Å; I88-N233 HydrophobicContact CG1-CB 4.39Å; I88-N233 HydrophobicContact CG2-CB 4.39Å; N92-N233 PolarHBondContact ND2-O 2.93Å; N92-N233 PolarHBondContact OD1-O 2.87Å; A229-N233 PolarHBondContact O-N 3.24Å; A229-N233 PolarHBondContact O-ND2 3.29Å; V230-N233 PolarHBondContact O-N 3.4Å
234	L	83.6	Confident	85.9	Confident	19 Å²	19	36.8 Å²	36.8	10%	0.099	20%	0.203	C	C	.	.			trans	-96.3	112.6	-174.4	-164.8	68	0	0	0	111.7	F83 I91 M95 V230 I236 K239	F83-L234 HydrophobicContact CE2-CB 4.45Å; F83-L234 HydrophobicContact CE2-CD1 4.44Å; F83-L234 HydrophobicContact CZ-CB 4.08Å; F83-L234 HydrophobicContact CZ-CD1 3.85Å; I91-L234 HydrophobicContact CG2-CD1 4.33Å; M95-L234 HydrophobicContact CE-CD1 4.13Å; M95-L234 HydrophobicContact CG-CD1 4.28Å; V230-L234 HydrophobicContact CG1-CD2 4.1Å; V230-L234 WeakPolarHBondContact O-CB 3.36Å; V230-L234 PolarHBondContact O-N 3.36Å; L234-I236 HydrophobicContact CD1-CD1 3.93Å; L234-I236 HydrophobicContact CD1-CG1 4.48Å; L234-I236 HydrophobicContact CD1-CG2 4.18Å; L234-I236 HydrophobicContact CD2-CD1 3.32Å; L234-I236 HydrophobicContact CD2-CG1 3.97Å; L234-I236 HydrophobicContact CG-CD1 3.47Å; L234-I236 VanDerWaalsContact CG-CD1 3.47Å; L234-I236 HydrophobicContact CG-CG1 3.76Å; L234-I236 HydrophobicContact CG-CG2 4.21Å; L234-K239 PolarHBondContact O-NZ 2.76Å
235	D	81.9	Confident	85.5	Confident	63 Å²	63	35.7 Å²	35.7	34%	0.337	20%	0.195	S	C	.	.			trans	-107.9	78	-177.3	-176.9	37.4	0	0	0	111.7	N92 K96 Y174	N92-D235 PolarHBondContact OD1-N 2.89Å; K96-D235 WeakPolarHBondContact CE-OD2 3.28Å; K96-D235 IonicContact NZ-OD2 2.84Å; K96-D235 PolarHBondContact NZ-OD2 2.77Å; Y174-D235 PolarHBondContact OH-O 2.91Å
236	I	83.3	Confident	85.3	Confident	2 Å²	2	36.2 Å²	36.2	1%	0.01	18%	0.183	C	C	.	.	S	Bend	trans	-146	159.3	-169.9	69.8	178.7	0	0	0	112.9	M95 F99 Y174 N183 L234 I238	M95-I236 HydrophobicContact CB-CG2 3.5Å; M95-I236 HydrophobicContact CE-CD1 3.56Å; M95-I236 HydrophobicContact CG-CG2 4.4Å; F99-I236 HydrophobicContact CD2-CB 4.02Å; F99-I236 HydrophobicContact CD2-CD1 4.19Å; F99-I236 HydrophobicContact CD2-CG2 4.29Å; F99-I236 HydrophobicContact CE2-CB 4.42Å; F99-I236 HydrophobicContact CE2-CD1 3.72Å; F99-I236 HydrophobicContact CZ-CD1 4.31Å; Y174-I236 WeakPolarHBondContact OH-CA 3.45Å; N183-I236 VanDerWaalsContact OD1-C 3.32Å; N183-I236 PolarHBondContact OD1-O 2.8Å; L234-I236 HydrophobicContact CD1-CD1 3.93Å; L234-I236 HydrophobicContact CD1-CG1 4.48Å; L234-I236 HydrophobicContact CD1-CG2 4.18Å; L234-I236 HydrophobicContact CD2-CD1 3.32Å; L234-I236 HydrophobicContact CD2-CG1 3.97Å; L234-I236 HydrophobicContact CG-CD1 3.47Å; L234-I236 VanDerWaalsContact CG-CD1 3.47Å; L234-I236 HydrophobicContact CG-CG1 3.76Å; L234-I236 HydrophobicContact CG-CG2 4.21Å; I236-I238 HydrophobicContact CD1-CB 4.26Å; I236-I238 HydrophobicContact CD1-CD1 3.28Å; I236-I238 HydrophobicContact CD1-CG1 3.55Å; I236-I238 HydrophobicContact CG1-CB 4.25Å; I236-I238 HydrophobicContact CG1-CD1 4.15Å; I236-I238 HydrophobicContact CG1-CG1 3.87Å; I236-I238 PolarHBondContact O-N 3.4Å
237	P	82.4	Confident	84.8	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.006	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	43.4	-177.1	35.7	-40.3	0	0	0	113.5	F99 Y174 N183 I186 A187 K239	F99-P237 HydrophobicContact CB-CG 3.56Å; F99-P237 HydrophobicContact CD1-CG 3.78Å; F99-P237 HydrophobicContact CG-CG 3.81Å; Y174-P237 HydrophobicContact CE1-CG 4.47Å; Y174-P237 HydrophobicContact CE2-CG 4.45Å; Y174-P237 VanDerWaalsContact CZ-CD 3.5Å; Y174-P237 WeakPolarHBondContact OH-CD 3.42Å; N183-P237 WeakPolarHBondContact OD1-CA 3.3Å; N183-P237 WeakPolarHBondContact OD1-CB 3.36Å; N183-P237 VanDerWaalsContact OD1-N 3.16Å; I186-P237 HydrophobicContact CB-CB 4.04Å; I186-P237 HydrophobicContact CB-CG 4.42Å; I186-P237 HydrophobicContact CG2-CB 3.78Å; I186-P237 HydrophobicContact CG2-CG 3.78Å; A187-P237 HydrophobicContact CB-CB 4.35Å; P237-K239 VanDerWaalsContact C-N 3.3Å
238	I	83.1	Confident	84.4	Confident	81 Å²	81	41.3 Å²	41.3	42%	0.415	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96	6.8	162.9	-48.1	179.6	0	0	0	110.3	F99 I236 L261	F99-I238 HydrophobicContact CE1-CD1 4.07Å; F99-I238 HydrophobicContact CE1-CG1 3.67Å; F99-I238 HydrophobicContact CE2-CD1 3.88Å; F99-I238 HydrophobicContact CE2-CG1 4.1Å; F99-I238 HydrophobicContact CZ-CD1 3.33Å; F99-I238 HydrophobicContact CZ-CG1 3.44Å; F99-I238 VanDerWaalsContact CZ-CG1 3.44Å; I236-I238 HydrophobicContact CD1-CB 4.26Å; I236-I238 HydrophobicContact CD1-CD1 3.28Å; I236-I238 HydrophobicContact CD1-CG1 3.55Å; I236-I238 HydrophobicContact CG1-CB 4.25Å; I236-I238 HydrophobicContact CG1-CD1 4.15Å; I236-I238 HydrophobicContact CG1-CG1 3.87Å; I236-I238 PolarHBondContact O-N 3.4Å; I238-L261 HydrophobicContact CG2-CB 4.46Å; I238-L261 VanDerWaalsContact O-CB 3.3Å; I238-L261 WeakPolarHBondContact O-CB 3.38Å; I238-L261 VanDerWaalsContact O-CG 3.28Å; I238-L261 WeakPolarHBondContact O-CG 3.18Å; I238-L261 PolarHBondContact O-N 2.9Å
239	K	87.5	Confident	84.2	Confident	38 Å²	38	44.4 Å²	44.4	17%	0.165	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	142.9	179	60.5	-168.1	-175	-170.3	0	110.3	N183 A231 L234 P237 T241 L259	N183-K239 PolarHBondContact ND2-O 3.4Å; A231-K239 PolarHBondContact O-NZ 3.24Å; A231-K239 VanDerWaalsContact O-NZ 3.13Å; L234-K239 PolarHBondContact O-NZ 2.76Å; P237-K239 VanDerWaalsContact C-N 3.3Å; K239-T241 HydrophobicContact CD-CG2 4.45Å; K239-T241 HydrophobicContact CG-CG2 4.06Å; K239-L259 WeakPolarHBondContact CA-O 3.36Å
240	V	91.9	Very high	84	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	141.3	167.1	-63.2	0	0	0	0	108.6	L32 L35 A187 V188 L258 L259 L261 I264	L32-V240 HydrophobicContact CD2-CG2 4.18Å; L35-V240 HydrophobicContact CB-CB 4.4Å; L35-V240 HydrophobicContact CB-CG2 4.27Å; L35-V240 HydrophobicContact CD1-CB 4.4Å; A187-V240 HydrophobicContact CB-CG1 3.86Å; V188-V240 HydrophobicContact CG2-CG1 4.28Å; V240-L258 WeakPolarHBondContact O-CA 3.4Å; V240-L259 HydrophobicContact CG2-CB 3.74Å; V240-L259 HydrophobicContact CG2-CD2 4.32Å; V240-L259 HydrophobicContact CG2-CG 4.42Å; V240-L259 PolarHBondContact N-O 3.28Å; V240-L259 PolarHBondContact O-N 3.12Å; V240-L261 HydrophobicContact CG1-CD2 4.13Å; V240-I264 HydrophobicContact CG1-CD1 4.43Å; V240-I264 HydrophobicContact CG2-CD1 4Å
241	T	90.4	Very high	83.6	Confident	7 Å²	7	47.8 Å²	47.8	4%	0.043	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	145.5	-171.5	55.8	0	0	0	0	111.8	N184 K239 L256 A257	N184-T241 PolarHBondContact ND2-O 3.35Å; N184-T241 PolarHBondContact OD1-N 2.97Å; N184-T241 PolarHBondContact OD1-O 2.87Å; N184-T241 PolarHBondContact OD1-OG1 2.7Å; K239-T241 HydrophobicContact CD-CG2 4.45Å; K239-T241 HydrophobicContact CG-CG2 4.06Å; T241-L256 HydrophobicContact CG2-CB 4.46Å; T241-L256 HydrophobicContact CG2-CD1 4.48Å; T241-A257 CarbonylContact C-O 3.55Å; T241-A257 WeakPolarHBondContact CA-O 3.45Å
242	F	90.5	Very high	83.2	Confident	23 Å²	23	54.2 Å²	54.2	10%	0.101	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	136.6	174	-164.6	-87.7	0	0	0	110.2	I27 T28 A31 L32 W180 R244 F246 A257	I27-F242 HydrophobicContact CG2-CE1 4Å; I27-F242 HydrophobicContact CG2-CZ 4.32Å; T28-F242 HydrophobicContact CG2-CB 4.21Å; T28-F242 HydrophobicContact CG2-CD1 4Å; A31-F242 HydrophobicContact CB-CB 4.41Å; A31-F242 HydrophobicContact CB-CD1 3.98Å; A31-F242 HydrophobicContact CB-CD2 3.44Å; A31-F242 VanDerWaalsContact CB-CD2 3.44Å; A31-F242 HydrophobicContact CB-CE1 4.07Å; A31-F242 HydrophobicContact CB-CE2 3.54Å; A31-F242 HydrophobicContact CB-CG 3.66Å; A31-F242 HydrophobicContact CB-CZ 3.86Å; L32-F242 HydrophobicContact CD2-CB 4.08Å; L32-F242 HydrophobicContact CG-CB 4.23Å; W180-F242 HydrophobicContact CH2-CD2 4.19Å; W180-F242 AromaticContact CH2-CE2 3.92Å; W180-F242 HydrophobicContact CH2-CE2 3.92Å; W180-F242 AromaticContact CZ3-CD2 3.82Å; W180-F242 HydrophobicContact CZ3-CD2 3.82Å; W180-F242 AromaticContact CZ3-CE2 3.99Å; W180-F242 HydrophobicContact CZ3-CE2 3.99Å; F242-R244 PolarHBondContact O-N 2.69Å; F242-F246 HydrophobicContact CE1-CB 4.02Å; F242-F246 HydrophobicContact CE1-CD2 4.12Å; F242-F246 HydrophobicContact CE1-CG 4.02Å; F242-F246 AromaticContact CZ-CD2 3.98Å; F242-F246 HydrophobicContact CZ-CD2 3.98Å; F242-F246 HydrophobicContact CZ-CE2 4.28Å; F242-F246 HydrophobicContact CZ-CG 4.21Å; F242-A257 PolarHBondContact N-O 2.81Å; F242-A257 PolarHBondContact O-N 3Å
243	P	86.1	Confident	82.6	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	129.6	179.5	23.8	-33.7	0	0	0	111.5	T28 W180 D245 F246 L256	T28-P243 PolarHBondContact OG1-O 3.17Å; W180-P243 HydrophobicContact CZ2-CG 4.2Å; P243-D245 VanDerWaalsContact C-N 3.31Å; P243-F246 HydrophobicContact CG-CB 4.24Å; P243-F246 HydrophobicContact CG-CD2 3.95Å; P243-L256 HydrophobicContact CB-CD2 4.23Å
244	R	82.1	Confident	81.8	Confident	61 Å²	61	54.2 Å²	54.2	23%	0.23	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-27.1	173.1	-71	-179.7	177.6	155.3	0.8	111.8	D24 T28 F242 F246 Q255 A257	D24-R244 VanDerWaalsContact CB-O 3.29Å; D24-R244 WeakPolarHBondContact CB-O 3.46Å; T28-R244 HydrophobicContact CG2-CG 4.16Å; T28-R244 WeakPolarHBondContact OG1-CA 3.37Å; F242-R244 PolarHBondContact O-N 2.69Å; R244-F246 VanDerWaalsContact C-N 3.31Å; R244-Q255 HydrophobicContact CB-CB 4.26Å; R244-Q255 VanDerWaalsContact CB-O 3.28Å; R244-Q255 WeakPolarHBondContact CB-O 3.29Å; R244-Q255 WeakPolarHBondContact CG-O 3.37Å; R244-Q255 PolarHBondContact N-O 3.25Å; R244-A257 HydrophobicContact CG-CB 3.78Å
245	D	80.9	Confident	81.5	Confident	15 Å²	15	57.6 Å²	57.6	8%	0.08	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	34.4	-179.6	54	-28.8	0	0	0	111.1	P243 L247 S248 H249 G253 K254 Q255	P243-D245 VanDerWaalsContact C-N 3.31Å; D245-L247 PolarHBondContact O-N 2.83Å; D245-S248 WeakPolarHBondContact CB-OG 3.16Å; D245-S248 PolarHBondContact O-N 3.04Å; D245-S248 PolarHBondContact O-OG 3.19Å; D245-H249 HydrophobicContact CB-CB 4.46Å; D245-H249 PolarHBondContact O-N 3.5Å; D245-H249 IonicContact OD2-CG 2.83Å; D245-H249 IonicContact OD2-ND1 2.73Å; D245-H249 PolarHBondContact OD2-ND1 3.3Å; D245-G253 VanDerWaalsContact CG-CA 3.41Å; D245-G253 WeakPolarHBondContact OD1-CA 3.47Å; D245-G253 VanDerWaalsContact OD2-CA 3.25Å; D245-G253 WeakPolarHBondContact OD2-CA 3.37Å; D245-K254 PolarHBondContact OD1-N 3.41Å; D245-K254 PolarHBondContact OD2-N 2.8Å; D245-Q255 PolarHBondContact OD1-N 3.26Å
246	F	81.9	Confident	81.5	Confident	61 Å²	61	57.4 Å²	57.4	27%	0.268	29%	0.286	S	S	.	.	H	α-helix	trans	-62.8	-39.6	-173	-179.6	-102.1	0	0	0	113	D24 I27 F242 P243 R244 G250 L251	D24-F246 PolarHBondContact OD1-N 2.85Å; I27-F246 HydrophobicContact CD1-CD1 4.48Å; I27-F246 HydrophobicContact CG2-CD1 4.07Å; F242-F246 HydrophobicContact CE1-CB 4.02Å; F242-F246 HydrophobicContact CE1-CD2 4.12Å; F242-F246 HydrophobicContact CE1-CG 4.02Å; F242-F246 AromaticContact CZ-CD2 3.98Å; F242-F246 HydrophobicContact CZ-CD2 3.98Å; F242-F246 HydrophobicContact CZ-CE2 4.28Å; F242-F246 HydrophobicContact CZ-CG 4.21Å; P243-F246 HydrophobicContact CG-CB 4.24Å; P243-F246 HydrophobicContact CG-CD2 3.95Å; R244-F246 VanDerWaalsContact C-N 3.31Å; F246-G250 WeakPolarHBondContact O-CA 3.32Å; F246-G250 PolarHBondContact O-N 3.45Å; F246-L251 HydrophobicContact CE2-CD2 4.02Å
247	L	79	Confident	81.4	Confident	99 Å²	99	57.6 Å²	57.6	52%	0.518	29%	0.287	S	S	.	.	H	α-helix	trans	-73.4	-32.7	178.2	-63.7	166.2	0	0	0	112.3	L23 D24 I27 D245	L23-L247 HydrophobicContact CB-CD1 4.04Å; L23-L247 HydrophobicContact CD2-CD1 3.44Å; L23-L247 VanDerWaalsContact CD2-CD1 3.44Å; L23-L247 HydrophobicContact CD2-CD2 4.33Å; L23-L247 HydrophobicContact CD2-CG 4.4Å; L23-L247 HydrophobicContact CG-CD1 4.29Å; D24-L247 HydrophobicContact CB-CD1 4.32Å; D24-L247 WeakPolarHBondContact OD1-CB 3.49Å; D24-L247 WeakPolarHBondContact OD1-CD1 3.23Å; D24-L247 WeakPolarHBondContact OD1-CG 3.41Å; D24-L247 PolarHBondContact OD1-N 3.35Å; I27-L247 HydrophobicContact CD1-CD1 4.2Å; I27-L247 HydrophobicContact CD1-CD2 3.78Å; I27-L247 HydrophobicContact CD1-CG 4.02Å; D245-L247 PolarHBondContact O-N 2.83Å
248	S	77.9	Confident	81.6	Confident	76 Å²	76	61.7 Å²	61.7	53%	0.531	31%	0.309	S	S	.	.	H	α-helix	trans	-85.7	-35.7	-176.6	50.7	0	0	0	0	113.4	D245	D245-S248 WeakPolarHBondContact CB-OG 3.16Å; D245-S248 PolarHBondContact O-N 3.04Å; D245-S248 PolarHBondContact O-OG 3.19Å
249	H	78.2	Confident	81.8	Confident	113 Å²	113	58.4 Å²	58.4	52%	0.523	29%	0.292	S	S	.	.	H	α-helix	trans	-123.3	0.1	-174.6	-63.6	82	0	0	0	113.6	D245 F252	D245-H249 HydrophobicContact CB-CB 4.46Å; D245-H249 PolarHBondContact O-N 3.5Å; D245-H249 IonicContact OD2-CG 2.83Å; D245-H249 IonicContact OD2-ND1 2.73Å; D245-H249 PolarHBondContact OD2-ND1 3.3Å; H249-F252 PolarHBondContact O-N 2.89Å
250	G	83.1	Confident	81.9	Confident	27 Å²	27	57.6 Å²	57.6	28%	0.278	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	61.3	-139.8	177.3	0	0	0	0	0	112.8	F246 F252 G253	F246-G250 WeakPolarHBondContact O-CA 3.32Å; F246-G250 PolarHBondContact O-N 3.45Å; G250-F252 PolarHBondContact O-N 2.98Å; G250-G253 PolarHBondContact O-N 3.39Å
251	L	79.3	Confident	81.8	Confident	86 Å²	86	58.1 Å²	58.1	45%	0.45	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-67.6	-11.2	177.6	-58.1	175.7	0	0	0	113.5	W180 I181 F246	W180-L251 HydrophobicContact CH2-CD2 4.31Å; W180-L251 HydrophobicContact CZ2-CD2 3.71Å; W180-L251 PolarHBondContact NE1-O 2.91Å; I181-L251 HydrophobicContact CD1-CD2 4.41Å; F246-L251 HydrophobicContact CE2-CD2 4.02Å
252	F	74.6	Confident	81.9	Confident	167 Å²	167	59.6 Å²	59.6	73%	0.732	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-102	13.9	-178.7	-58.8	-74.4	0	0	0	113.3	H249 G250 K254	H249-F252 PolarHBondContact O-N 2.89Å; G250-F252 PolarHBondContact O-N 2.98Å; F252-K254 PolarHBondContact O-N 2.85Å
253	G	71.3	Confident	82	Confident	8 Å²	8	59.7 Å²	59.7	8%	0.082	32%	0.315	C	S	.	.			trans	-54.3	135.2	175.3	0	0	0	0	0	112.4	D245 G250	D245-G253 VanDerWaalsContact CG-CA 3.41Å; D245-G253 WeakPolarHBondContact OD1-CA 3.47Å; D245-G253 VanDerWaalsContact OD2-CA 3.25Å; D245-G253 WeakPolarHBondContact OD2-CA 3.37Å; G250-G253 PolarHBondContact O-N 3.39Å
254	K	69.4	Low	82.5	Confident	192 Å²	192	59.7 Å²	59.7	84%	0.835	32%	0.315	S	S	*	.	S	Bend	trans	-95	-22.3	-175.5	-69.1	-175.8	-179.9	178.3	0	112.5	D245 F252 L256	D245-K254 PolarHBondContact OD1-N 3.41Å; D245-K254 PolarHBondContact OD2-N 2.8Å; F252-K254 PolarHBondContact O-N 2.85Å; K254-L256 PolarHBondContact O-N 3.44Å
255	Q	77.1	Confident	83.2	Confident	90 Å²	90	57.8 Å²	57.8	42%	0.421	31%	0.31	S	S	.	.			trans	-93.9	91.3	-177	-65.7	-171.5	40.1	0	0	110	R244 D245	R244-Q255 HydrophobicContact CB-CB 4.26Å; R244-Q255 VanDerWaalsContact CB-O 3.28Å; R244-Q255 WeakPolarHBondContact CB-O 3.29Å; R244-Q255 WeakPolarHBondContact CG-O 3.37Å; R244-Q255 PolarHBondContact N-O 3.25Å; D245-Q255 PolarHBondContact OD1-N 3.26Å
256	L	81.4	Confident	83.9	Confident	59 Å²	59	57.6 Å²	57.6	31%	0.309	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	123.4	-179	-59.5	178	0	0	0	111.2	W180 T241 P243 K254	W180-L256 HydrophobicContact CB-CD1 4.19Å; W180-L256 HydrophobicContact CB-CD2 4.1Å; W180-L256 HydrophobicContact CG-CD2 4.25Å; T241-L256 HydrophobicContact CG2-CB 4.46Å; T241-L256 HydrophobicContact CG2-CD1 4.48Å; P243-L256 HydrophobicContact CB-CD2 4.23Å; K254-L256 PolarHBondContact O-N 3.44Å
257	A	82.1	Confident	84.6	Confident	5 Å²	5	54.7 Å²	54.7	4%	0.041	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	150.7	158.8	0	0	0	0	0	109	T28 L32 T241 F242 R244	T28-A257 HydrophobicContact CG2-CB 3.34Å; L32-A257 HydrophobicContact CD1-CB 3.69Å; T241-A257 CarbonylContact C-O 3.55Å; T241-A257 WeakPolarHBondContact CA-O 3.45Å; F242-A257 PolarHBondContact N-O 2.81Å; F242-A257 PolarHBondContact O-N 3Å; R244-A257 HydrophobicContact CG-CB 3.78Å
258	L	85.9	Confident	85.5	Confident	88 Å²	88	50 Å²	50	46%	0.461	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	145.9	-171.6	70.1	102.4	0	0	0	110.9	V240	V240-L258 WeakPolarHBondContact O-CA 3.4Å
259	L	87.1	Confident	86.4	Confident	11 Å²	11	46.7 Å²	46.7	6%	0.058	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	131.6	167.1	-177.4	69.5	0	0	0	108.3	L32 A36 K239 V240 D263 I264 I301	L32-L259 HydrophobicContact CD2-CB 4.41Å; A36-L259 HydrophobicContact CB-CD2 3.73Å; K239-L259 WeakPolarHBondContact CA-O 3.36Å; V240-L259 HydrophobicContact CG2-CB 3.74Å; V240-L259 HydrophobicContact CG2-CD2 4.32Å; V240-L259 HydrophobicContact CG2-CG 4.42Å; V240-L259 PolarHBondContact N-O 3.28Å; V240-L259 PolarHBondContact O-N 3.12Å; L259-D263 HydrophobicContact CD1-CB 4.44Å; L259-I264 HydrophobicContact CD2-CD1 4.06Å; L259-I264 HydrophobicContact CD2-CG1 4.15Å; L259-I301 HydrophobicContact CD2-CD1 3.89Å
260	G	89.3	Confident	87.3	Confident	22 Å²	22	41.4 Å²	41.4	23%	0.227	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	141.9	-176.4	0	0	0	0	0	111.7	G262 D263	G260-G262 PolarHBondContact O-N 3.45Å; G260-D263 PolarHBondContact O-N 2.67Å
261	L	91	Very high	88	Confident	11 Å²	11	40.1 Å²	40.1	6%	0.058	21%	0.211	C	C	.	.	S	Bend	trans	-63.7	-28.4	173.1	-76.5	-172.2	0	0	0	112.5	A187 V190 A191 I238 V240 D263 I264 V265	A187-L261 HydrophobicContact CB-CD1 4.1Å; A187-L261 HydrophobicContact CB-CD2 4.1Å; A187-L261 HydrophobicContact CB-CG 4.37Å; V190-L261 HydrophobicContact CG1-CD1 4.34Å; A191-L261 HydrophobicContact CB-CD2 4.01Å; I238-L261 HydrophobicContact CG2-CB 4.46Å; I238-L261 VanDerWaalsContact O-CB 3.3Å; I238-L261 WeakPolarHBondContact O-CB 3.38Å; I238-L261 VanDerWaalsContact O-CG 3.28Å; I238-L261 WeakPolarHBondContact O-CG 3.18Å; I238-L261 PolarHBondContact O-N 2.9Å; V240-L261 HydrophobicContact CG1-CD2 4.13Å; L261-D263 VanDerWaalsContact C-N 3.26Å; L261-D263 PolarHBondContact O-N 2.93Å; L261-I264 HydrophobicContact CD2-CD1 4.16Å; L261-I264 PolarHBondContact O-N 3.17Å; L261-I264 VanDerWaalsContact O-N 3.08Å; L261-V265 WeakPolarHBondContact O-CB 3.32Å; L261-V265 WeakPolarHBondContact O-CG2 3.3Å; L261-V265 PolarHBondContact O-N 2.95Å
262	G	91.4	Very high	88.9	Confident	37 Å²	37	36 Å²	36	38%	0.381	19%	0.189	S	C	.	.	H	α-helix	trans	-56.1	-41.6	174.5	0	0	0	0	0	112.3	G260 I264 V266 P267	G260-G262 PolarHBondContact O-N 3.45Å; G262-I264 PolarHBondContact O-N 3.49Å; G262-V266 VanDerWaalsContact O-CB 3.24Å; G262-V266 WeakPolarHBondContact O-CB 3.22Å; G262-V266 VanDerWaalsContact O-CG2 3.32Å; G262-V266 WeakPolarHBondContact O-CG2 3.49Å; G262-V266 PolarHBondContact O-N 2.63Å; G262-P267 WeakPolarHBondContact O-CD 3.24Å
263	D	93.2	Very high	89.9	Confident	26 Å²	26	28.2 Å²	28.2	14%	0.139	16%	0.155	C	C	.	.	H	α-helix	trans	-71.8	-12.1	-179.5	-52.2	-39.1	0	0	0	113.3	L259 G260 L261 Y297 A317 L321	L259-D263 HydrophobicContact CD1-CB 4.44Å; G260-D263 PolarHBondContact O-N 2.67Å; L261-D263 VanDerWaalsContact C-N 3.26Å; L261-D263 PolarHBondContact O-N 2.93Å; D263-Y297 VanDerWaalsContact O-CE2 3.3Å; D263-Y297 WeakPolarHBondContact O-CE2 3.39Å; D263-Y297 PolarHBondContact O-OH 3.28Å; D263-A317 HydrophobicContact CB-CB 4.03Å; D263-L321 HydrophobicContact CB-CD1 4.16Å
264	I	96.4	Very high	91.1	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-100.5	-53.9	176.3	-59	170.9	0	0	0	109.4	A36 P39 I40 A191 V240 L259 L261 G262 G268	A36-I264 HydrophobicContact CB-CD1 4.21Å; A36-I264 HydrophobicContact CB-CG1 4.03Å; P39-I264 HydrophobicContact CB-CG2 4.2Å; P39-I264 HydrophobicContact CG-CG2 4.48Å; I40-I264 HydrophobicContact CD1-CG2 4.2Å; I40-I264 HydrophobicContact CG1-CG2 3.89Å; A191-I264 HydrophobicContact CB-CG2 4.38Å; V240-I264 HydrophobicContact CG1-CD1 4.43Å; V240-I264 HydrophobicContact CG2-CD1 4Å; L259-I264 HydrophobicContact CD2-CD1 4.06Å; L259-I264 HydrophobicContact CD2-CG1 4.15Å; L261-I264 HydrophobicContact CD2-CD1 4.16Å; L261-I264 PolarHBondContact O-N 3.17Å; L261-I264 VanDerWaalsContact O-N 3.08Å; G262-I264 PolarHBondContact O-N 3.49Å; I264-G268 WeakPolarHBondContact O-CA 3.25Å; I264-G268 PolarHBondContact O-N 3.01Å
265	V	96.6	Very high	92.3	Very high	20 Å²	20	18.7 Å²	18.7	12%	0.121	11%	0.112	C	C	.	.	H	α-helix	trans	-69.5	-46.6	-173.1	175.4	0	0	0	0	111.3	A191 A194 I195 L261 G268 I269	A191-V265 HydrophobicContact CB-CG2 3.83Å; A194-V265 HydrophobicContact CB-CG1 3.62Å; A194-V265 HydrophobicContact CB-CG2 4.14Å; I195-V265 HydrophobicContact CG1-CG1 4.42Å; L261-V265 WeakPolarHBondContact O-CB 3.32Å; L261-V265 WeakPolarHBondContact O-CG2 3.3Å; L261-V265 PolarHBondContact O-N 2.95Å; V265-G268 CarbonylContact O-C 3.55Å; V265-G268 WeakPolarHBondContact O-CA 3.36Å; V265-G268 PolarHBondContact O-N 3.4Å; V265-G268 VanDerWaalsContact O-N 3.1Å; V265-I269 HydrophobicContact CG1-CG2 4.28Å; V265-I269 WeakPolarHBondContact O-CG1 3.38Å; V265-I269 PolarHBondContact O-N 3.38Å
266	V	95.4	Very high	93.1	Very high	12 Å²	12	14.8 Å²	14.8	7%	0.073	9%	0.093	C	C	.	.	H	α-helix	trans	-66.6	-48.9	-173.4	176.5	0	0	0	0	111.6	L209 L210 L213 G262 G268 I269	L209-V266 HydrophobicContact CD2-CG1 4.1Å; L209-V266 HydrophobicContact CG-CG1 4.11Å; L210-V266 HydrophobicContact CD2-CG1 3.72Å; L213-V266 HydrophobicContact CD1-CB 4.1Å; L213-V266 HydrophobicContact CD1-CG1 3.39Å; L213-V266 HydrophobicContact CD1-CG2 3.7Å; G262-V266 VanDerWaalsContact O-CB 3.24Å; G262-V266 WeakPolarHBondContact O-CB 3.22Å; G262-V266 VanDerWaalsContact O-CG2 3.32Å; G262-V266 WeakPolarHBondContact O-CG2 3.49Å; G262-V266 PolarHBondContact O-N 2.63Å; V266-G268 VanDerWaalsContact C-N 3.25Å; V266-G268 PolarHBondContact O-N 2.94Å; V266-I269 WeakPolarHBondContact O-CG1 3.47Å
267	P	97.2	Very high	93.7	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-66.1	-32	170.4	-22.6	37.4	0	0	0	111.9	L210 G262 F270 I271 Y297 L318 L321	L210-P267 HydrophobicContact CD2-CG 4.48Å; G262-P267 WeakPolarHBondContact O-CD 3.24Å; P267-F270 WeakPolarHBondContact O-CB 3.12Å; P267-F270 PolarHBondContact O-N 2.91Å; P267-I271 VanDerWaalsContact O-CG1 3.27Å; P267-I271 WeakPolarHBondContact O-CG1 3.5Å; P267-I271 PolarHBondContact O-N 3.26Å; P267-Y297 HydrophobicContact CB-CD2 3.62Å; P267-Y297 HydrophobicContact CB-CE2 3.68Å; P267-Y297 HydrophobicContact CG-CD2 4.25Å; P267-Y297 HydrophobicContact CG-CE2 3.91Å; P267-L318 HydrophobicContact CG-CD2 4.16Å; P267-L321 HydrophobicContact CG-CB 4.44Å; P267-L321 HydrophobicContact CG-CD1 4.35Å
268	G	97.8	Very high	94.3	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-60.7	-46.2	178.7	0	0	0	0	0	114	I264 V265 V266 F270 I271 A272	I264-G268 WeakPolarHBondContact O-CA 3.25Å; I264-G268 PolarHBondContact O-N 3.01Å; V265-G268 CarbonylContact O-C 3.55Å; V265-G268 WeakPolarHBondContact O-CA 3.36Å; V265-G268 PolarHBondContact O-N 3.4Å; V265-G268 VanDerWaalsContact O-N 3.1Å; V266-G268 VanDerWaalsContact C-N 3.25Å; V266-G268 PolarHBondContact O-N 2.94Å; G268-F270 VanDerWaalsContact C-N 3.26Å; G268-F270 PolarHBondContact O-N 2.81Å; G268-I271 PolarHBondContact O-N 2.94Å; G268-A272 WeakPolarHBondContact O-CB 3.36Å; G268-A272 PolarHBondContact O-N 3.19Å
269	I	96.7	Very high	94.6	Very high	7 Å²	7	11.4 Å²	11.4	4%	0.036	8%	0.077	C	C	.	.	H	α-helix	trans	-63.8	-33.9	176.5	56.5	171.6	0	0	0	111.6	I195 I198 L200 L209 V265 V266 M273	I195-I269 HydrophobicContact CG1-CG2 4.32Å; I198-I269 HydrophobicContact CB-CG2 4.01Å; I198-I269 HydrophobicContact CG2-CD1 4.27Å; I198-I269 HydrophobicContact CG2-CG2 4.21Å; L200-I269 HydrophobicContact CD1-CG1 4.35Å; L200-I269 HydrophobicContact CD2-CD1 4.49Å; L200-I269 HydrophobicContact CG-CD1 4.47Å; L209-I269 HydrophobicContact CD2-CD1 3.44Å; L209-I269 VanDerWaalsContact CD2-CD1 3.44Å; V265-I269 HydrophobicContact CG1-CG2 4.28Å; V265-I269 WeakPolarHBondContact O-CG1 3.38Å; V265-I269 PolarHBondContact O-N 3.38Å; V266-I269 WeakPolarHBondContact O-CG1 3.47Å; I269-M273 PolarHBondContact O-N 3.43Å
270	F	97.5	Very high	94.8	Very high	1 Å²	1	17.1 Å²	17.1	0%	0.004	10%	0.101	C	C	.	.	H	α-helix	trans	-68.9	-46.1	174.4	-177.4	-100.6	0	0	0	111.6	L200 F203 L210 P267 G268 A272 M273 L274 C325 L326	L200-F270 HydrophobicContact CD1-CB 4.19Å; L200-F270 HydrophobicContact CD1-CD2 4.16Å; F203-F270 HydrophobicContact CD2-CE2 4.04Å; F203-F270 HydrophobicContact CD2-CZ 4.18Å; F203-F270 AromaticContact CE2-CE2 3.71Å; F203-F270 HydrophobicContact CE2-CE2 3.71Å; F203-F270 AromaticContact CE2-CZ 3.4Å; F203-F270 HydrophobicContact CE2-CZ 3.4Å; F203-F270 VanDerWaalsContact CE2-CZ 3.4Å; F203-F270 HydrophobicContact CZ-CE2 4.34Å; F203-F270 AromaticContact CZ-CZ 3.92Å; F203-F270 HydrophobicContact CZ-CZ 3.92Å; L210-F270 HydrophobicContact CD1-CB 3.96Å; L210-F270 HydrophobicContact CD1-CD1 3.93Å; L210-F270 HydrophobicContact CD1-CD2 3.94Å; L210-F270 HydrophobicContact CD1-CE1 4.4Å; L210-F270 HydrophobicContact CD1-CE2 4.4Å; L210-F270 HydrophobicContact CD1-CG 3.66Å; P267-F270 WeakPolarHBondContact O-CB 3.12Å; P267-F270 PolarHBondContact O-N 2.91Å; G268-F270 VanDerWaalsContact C-N 3.26Å; G268-F270 PolarHBondContact O-N 2.81Å; F270-A272 VanDerWaalsContact C-N 3.3Å; F270-A272 PolarHBondContact O-N 3Å; F270-M273 HydrophobicContact CD2-CE 3.54Å; F270-M273 HydrophobicContact CE2-CE 3.44Å; F270-M273 VanDerWaalsContact CE2-CE 3.44Å; F270-M273 HydrophobicContact CG-CE 4.45Å; F270-M273 HydrophobicContact CZ-CE 4.29Å; F270-M273 WeakPolarHBondContact O-CB 3.2Å; F270-M273 PolarHBondContact O-N 3.45Å; F270-M273 VanDerWaalsContact O-N 3.16Å; F270-L274 HydrophobicContact CD1-CD1 4.13Å; F270-L274 HydrophobicContact CD1-CG 4.42Å; F270-L274 HydrophobicContact CE1-CD1 3.81Å; F270-L274 HydrophobicContact CE1-CD2 4.31Å; F270-L274 HydrophobicContact CE1-CG 4.15Å; F270-L274 HydrophobicContact CZ-CD2 4.32Å; F270-L274 WeakPolarHBondContact O-CG 3.27Å; F270-L274 PolarHBondContact O-N 2.8Å; F270-C325 VanDerWaalsContact CE1-O 3.32Å; F270-C325 WeakPolarHBondContact CE1-O 3.38Å; F270-L326 HydrophobicContact CE1-CD2 4.07Å; F270-L326 HydrophobicContact CE2-CD2 3.91Å; F270-L326 HydrophobicContact CZ-CD2 3.57Å
271	I	98	Very high	94.9	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-62.7	-38.6	176	-68.6	163.4	0	0	0	111	I40 P267 G268 M273 L274 L275 F290 Y297	I40-I271 HydrophobicContact CG2-CB 4.33Å; I40-I271 HydrophobicContact CG2-CD1 4.01Å; I40-I271 HydrophobicContact CG2-CG2 4.1Å; P267-I271 VanDerWaalsContact O-CG1 3.27Å; P267-I271 WeakPolarHBondContact O-CG1 3.5Å; P267-I271 PolarHBondContact O-N 3.26Å; G268-I271 PolarHBondContact O-N 2.94Å; I271-M273 VanDerWaalsContact C-N 3.34Å; I271-M273 PolarHBondContact O-N 3.02Å; I271-L274 WeakPolarHBondContact O-CB 3.43Å; I271-L274 PolarHBondContact O-N 3.28Å; I271-L275 PolarHBondContact O-N 3Å; I271-F290 HydrophobicContact CG2-CD2 3.47Å; I271-F290 VanDerWaalsContact CG2-CD2 3.47Å; I271-F290 HydrophobicContact CG2-CE2 3.48Å; I271-F290 VanDerWaalsContact CG2-CE2 3.48Å; I271-Y297 HydrophobicContact CD1-CD2 4.21Å; I271-Y297 HydrophobicContact CD1-CG 4.17Å
272	A	96.8	Very high	94.6	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-63	-39.6	174.1	0	0	0	0	0	112	I195 G268 F270 L275 R276	I195-A272 HydrophobicContact CG2-CB 3.83Å; G268-A272 WeakPolarHBondContact O-CB 3.36Å; G268-A272 PolarHBondContact O-N 3.19Å; F270-A272 VanDerWaalsContact C-N 3.3Å; F270-A272 PolarHBondContact O-N 3Å; A272-L275 WeakPolarHBondContact O-CB 3.14Å; A272-L275 PolarHBondContact O-N 3.17Å; A272-R276 PolarHBondContact O-N 3.36Å; A272-R276 VanDerWaalsContact O-N 3.07Å
273	M	95.7	Very high	94.2	Very high	3 Å²	3	24.1 Å²	24.1	2%	0.015	13%	0.131	C	C	.	.	H	α-helix	trans	-63	-39.7	172.3	-178.7	-162.3	64.9	0	0	111.7	L200 F203 I269 F270 I271 L275 R276 F277 Y345	L200-M273 HydrophobicContact CB-CB 4.3Å; L200-M273 HydrophobicContact CB-CG 4.19Å; L200-M273 HydrophobicContact CB-SD 3.56Å; L200-M273 VanDerWaalsContact CB-SD 3.56Å; L200-M273 HydrophobicContact CD1-CB 4.48Å; L200-M273 HydrophobicContact CD1-SD 4.16Å; F203-M273 HydrophobicContact CB-CE 4.42Å; F203-M273 HydrophobicContact CD2-CE 3.59Å; F203-M273 HydrophobicContact CE2-CE 4.31Å; F203-M273 HydrophobicContact CG-CE 4.4Å; I269-M273 PolarHBondContact O-N 3.43Å; F270-M273 HydrophobicContact CD2-CE 3.54Å; F270-M273 HydrophobicContact CE2-CE 3.44Å; F270-M273 VanDerWaalsContact CE2-CE 3.44Å; F270-M273 HydrophobicContact CG-CE 4.45Å; F270-M273 HydrophobicContact CZ-CE 4.29Å; F270-M273 WeakPolarHBondContact O-CB 3.2Å; F270-M273 PolarHBondContact O-N 3.45Å; F270-M273 VanDerWaalsContact O-N 3.16Å; I271-M273 VanDerWaalsContact C-N 3.34Å; I271-M273 PolarHBondContact O-N 3.02Å; M273-L275 VanDerWaalsContact C-N 3.29Å; M273-L275 PolarHBondContact O-N 3.26Å; M273-R276 PolarHBondContact O-N 2.85Å; M273-F277 PolarHBondContact O-N 2.54Å; M273-Y345 HydrophobicContact CG-CE1 4.18Å
274	L	96.6	Very high	93.3	Very high	1 Å²	1	33 Å²	33	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-61.9	-37.1	174.7	-64	175.3	0	0	0	112.3	F203 F270 I271 F277 D278 P329 M342	F203-L274 HydrophobicContact CE2-CD2 4.1Å; F270-L274 HydrophobicContact CD1-CD1 4.13Å; F270-L274 HydrophobicContact CD1-CG 4.42Å; F270-L274 HydrophobicContact CE1-CD1 3.81Å; F270-L274 HydrophobicContact CE1-CD2 4.31Å; F270-L274 HydrophobicContact CE1-CG 4.15Å; F270-L274 HydrophobicContact CZ-CD2 4.32Å; F270-L274 WeakPolarHBondContact O-CG 3.27Å; F270-L274 PolarHBondContact O-N 2.8Å; I271-L274 WeakPolarHBondContact O-CB 3.43Å; I271-L274 PolarHBondContact O-N 3.28Å; L274-F277 WeakPolarHBondContact O-CB 3.09Å; L274-F277 PolarHBondContact O-N 2.77Å; L274-D278 PolarHBondContact O-N 3.19Å; L274-P329 HydrophobicContact CD1-CB 3.94Å; L274-P329 HydrophobicContact CD1-CG 3.48Å; L274-P329 VanDerWaalsContact CD1-CG 3.48Å; L274-P329 HydrophobicContact CD2-CB 4.06Å; L274-P329 HydrophobicContact CD2-CG 4.48Å; L274-M342 HydrophobicContact CD2-CE 4.43Å
275	L	95.8	Very high	91.9	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-63.7	-43.2	174.1	-174.5	64.1	0	0	0	111.6	S44 F45 L48 I271 A272 M273 F277 D278 T279 Y287 F290	S44-L275 WeakPolarHBondContact O-CD2 3.29Å; F45-L275 HydrophobicContact CD1-CD2 4.02Å; F45-L275 HydrophobicContact CD2-CD2 4.26Å; F45-L275 HydrophobicContact CE1-CD1 4.28Å; F45-L275 HydrophobicContact CE1-CD2 4.19Å; F45-L275 HydrophobicContact CE2-CD2 4.4Å; F45-L275 HydrophobicContact CG-CD2 4.06Å; F45-L275 HydrophobicContact CZ-CD1 4.27Å; F45-L275 HydrophobicContact CZ-CD2 4.38Å; L48-L275 HydrophobicContact CD1-CD1 4.37Å; L48-L275 HydrophobicContact CD1-CD2 3.7Å; L48-L275 HydrophobicContact CD1-CG 3.84Å; L48-L275 HydrophobicContact CD2-CD2 4.3Å; L48-L275 HydrophobicContact CD2-CG 4.08Å; L48-L275 HydrophobicContact CG-CD2 3.81Å; L48-L275 HydrophobicContact CG-CG 4.07Å; I271-L275 PolarHBondContact O-N 3Å; A272-L275 WeakPolarHBondContact O-CB 3.14Å; A272-L275 PolarHBondContact O-N 3.17Å; M273-L275 VanDerWaalsContact C-N 3.29Å; M273-L275 PolarHBondContact O-N 3.26Å; L275-F277 VanDerWaalsContact C-N 3.34Å; L275-D278 WeakPolarHBondContact O-CB 3.29Å; L275-D278 PolarHBondContact O-N 2.98Å; L275-T279 WeakPolarHBondContact O-CG2 3.27Å; L275-T279 PolarHBondContact O-N 3.19Å; L275-Y287 HydrophobicContact CD1-CD1 3.31Å; L275-Y287 HydrophobicContact CD1-CD2 4.45Å; L275-Y287 HydrophobicContact CD1-CE1 3.85Å; L275-Y287 HydrophobicContact CD1-CG 3.65Å; L275-F290 HydrophobicContact CB-CB 3.93Å; L275-F290 HydrophobicContact CB-CD2 3.67Å; L275-F290 HydrophobicContact CB-CE2 4.47Å; L275-F290 HydrophobicContact CB-CG 3.99Å; L275-F290 HydrophobicContact CD1-CB 3.72Å; L275-F290 HydrophobicContact CD1-CD1 4.05Å; L275-F290 HydrophobicContact CD1-CD2 4.08Å; L275-F290 HydrophobicContact CD1-CG 3.67Å; L275-F290 HydrophobicContact CD2-CD2 4.28Å; L275-F290 HydrophobicContact CD2-CE2 4.38Å; L275-F290 HydrophobicContact CG-CB 4.42Å; L275-F290 HydrophobicContact CG-CD2 4.21Å; L275-F290 HydrophobicContact CG-CG 4.29Å
276	R	93.6	Very high	91.4	Very high	7 Å²	7	41 Å²	41	3%	0.026	22%	0.215	C	C	.	.	H	α-helix	trans	-63.2	-41.5	174.5	-69.7	-175.7	-57.6	-104.2	10.5	111.4	S47 L48 A272 M273 D278 T279 K280 Y345 D347	S47-R276 PolarHBondContact OG-NH1 3.27Å; L48-R276 HydrophobicContact CD2-CB 4.42Å; L48-R276 HydrophobicContact CD2-CG 3.59Å; A272-R276 PolarHBondContact O-N 3.36Å; A272-R276 VanDerWaalsContact O-N 3.07Å; M273-R276 PolarHBondContact O-N 2.85Å; R276-D278 PolarHBondContact O-N 3.25Å; R276-T279 WeakPolarHBondContact CA-OG1 3.28Å; R276-T279 PolarHBondContact O-N 2.92Å; R276-T279 VanDerWaalsContact O-N 3.15Å; R276-T279 PolarHBondContact O-OG1 2.9Å; R276-K280 PolarHBondContact O-N 3.33Å; R276-Y345 WeakPolarHBondContact CB-OH 3.41Å; R276-D347 WeakPolarHBondContact CD-OD2 3.35Å; R276-D347 IonicContact CZ-OD2 3.57Å; R276-D347 IonicContact NE-OD1 2.66Å; R276-D347 IonicContact NE-OD2 3.21Å; R276-D347 PolarHBondContact NE-OD2 3.33Å; R276-D347 IonicContact NH2-OD2 3.36Å; R276-D347 PolarHBondContact NH2-OD2 2.93Å
277	F	94.5	Very high	91.3	Very high	10 Å²	10	43 Å²	43	4%	0.044	22%	0.222	C	C	.	.	H	α-helix	trans	-58.5	-47.9	172.9	176.4	-117.9	0	0	0	112.8	M273 L274 L275 T279 K280 L281 Y289 A341 M342 Y345	M273-F277 PolarHBondContact O-N 2.54Å; L274-F277 WeakPolarHBondContact O-CB 3.09Å; L274-F277 PolarHBondContact O-N 2.77Å; L275-F277 VanDerWaalsContact C-N 3.34Å; F277-T279 VanDerWaalsContact C-N 3.28Å; F277-T279 PolarHBondContact O-N 2.94Å; F277-K280 PolarHBondContact O-N 3.06Å; F277-L281 HydrophobicContact CE1-CD2 4.4Å; F277-L281 HydrophobicContact CZ-CD2 4.34Å; F277-L281 WeakPolarHBondContact O-CB 3.42Å; F277-L281 PolarHBondContact O-N 3.36Å; F277-Y289 AromaticContact CD1-CD2 3.54Å; F277-Y289 HydrophobicContact CD1-CD2 3.54Å; F277-Y289 HydrophobicContact CD1-CE2 4.02Å; F277-Y289 AromaticContact CD1-CG 3.91Å; F277-Y289 HydrophobicContact CD1-CG 3.91Å; F277-Y289 HydrophobicContact CE1-CD1 4.42Å; F277-Y289 AromaticContact CE1-CD2 3.49Å; F277-Y289 HydrophobicContact CE1-CD2 3.49Å; F277-Y289 VanDerWaalsContact CE1-CD2 3.49Å; F277-Y289 HydrophobicContact CE1-CE1 4.36Å; F277-Y289 AromaticContact CE1-CE2 3.46Å; F277-Y289 HydrophobicContact CE1-CE2 3.46Å; F277-Y289 VanDerWaalsContact CE1-CE2 3.46Å; F277-Y289 HydrophobicContact CE1-CG 4.03Å; F277-Y289 AromaticContact CE1-CZ 3.92Å; F277-Y289 HydrophobicContact CZ-CE2 4.44Å; F277-A341 HydrophobicContact CZ-CB 4.5Å; F277-M342 HydrophobicContact CD1-CE 4.18Å; F277-M342 HydrophobicContact CE1-CB 4.23Å; F277-M342 HydrophobicContact CE1-CE 3.79Å; F277-M342 HydrophobicContact CE2-CB 4.44Å; F277-M342 HydrophobicContact CZ-CB 3.88Å; F277-Y345 HydrophobicContact CB-CD2 4.33Å; F277-Y345 HydrophobicContact CB-CE2 4.08Å; F277-Y345 AromaticContact CD2-CD2 3.41Å; F277-Y345 HydrophobicContact CD2-CD2 3.41Å; F277-Y345 VanDerWaalsContact CD2-CD2 3.41Å; F277-Y345 AromaticContact CD2-CE2 3.88Å; F277-Y345 HydrophobicContact CD2-CE2 3.88Å; F277-Y345 AromaticContact CD2-CG 3.84Å; F277-Y345 HydrophobicContact CD2-CG 3.84Å; F277-Y345 HydrophobicContact CE2-CD2 4.17Å; F277-Y345 HydrophobicContact CG-CD2 4.33Å; F277-Y345 PolarHBondContact N-OH 2.9Å
278	D	94.7	Very high	91.1	Very high	9 Å²	9	43.9 Å²	43.9	5%	0.048	23%	0.229	C	C	.	.	H	α-helix	trans	-55.2	-44.3	174.2	-86.4	-50.2	0	0	0	111.4	L274 L275 R276 L281 G282 Y287 A288 Y289 F290	L274-D278 PolarHBondContact O-N 3.19Å; L275-D278 WeakPolarHBondContact O-CB 3.29Å; L275-D278 PolarHBondContact O-N 2.98Å; R276-D278 PolarHBondContact O-N 3.25Å; D278-L281 PolarHBondContact O-N 3.38Å; D278-G282 PolarHBondContact O-N 3.46Å; D278-Y287 HydrophobicContact CB-CD1 4.15Å; D278-Y287 VanDerWaalsContact OD2-CA 3.26Å; D278-Y287 WeakPolarHBondContact OD2-CA 3.45Å; D278-A288 PolarHBondContact OD1-N 2.98Å; D278-A288 VanDerWaalsContact OD1-N 3.09Å; D278-A288 PolarHBondContact OD2-N 3.13Å; D278-A288 VanDerWaalsContact OD2-N 3.15Å; D278-Y289 WeakPolarHBondContact OD1-CD2 3.28Å; D278-Y289 PolarHBondContact OD1-N 3.33Å; D278-Y289 VanDerWaalsContact OD1-N 3.13Å; D278-Y289 WeakPolarHBondContact OD2-CA 3.15Å; D278-Y289 PolarHBondContact OD2-N 3.48Å; D278-F290 PolarHBondContact OD2-N 3.49Å
279	T	92.3	Very high	91	Very high	63 Å²	63	44 Å²	44	39%	0.387	23%	0.229	S	C	.	.	H	α-helix	trans	-65.3	-39.3	178.5	61.7	0	0	0	0	112.8	L48 L275 R276 F277 L281 G282 Y287	L48-T279 HydrophobicContact CD1-CG2 3.92Å; L48-T279 HydrophobicContact CD2-CG2 3.87Å; L275-T279 WeakPolarHBondContact O-CG2 3.27Å; L275-T279 PolarHBondContact O-N 3.19Å; R276-T279 WeakPolarHBondContact CA-OG1 3.28Å; R276-T279 PolarHBondContact O-N 2.92Å; R276-T279 VanDerWaalsContact O-N 3.15Å; R276-T279 PolarHBondContact O-OG1 2.9Å; F277-T279 VanDerWaalsContact C-N 3.28Å; F277-T279 PolarHBondContact O-N 2.94Å; T279-L281 VanDerWaalsContact C-N 3.32Å; T279-L281 PolarHBondContact O-N 3.4Å; T279-G282 PolarHBondContact O-N 3.36Å; T279-Y287 HydrophobicContact CG2-CE1 3.84Å
280	K	90.9	Very high	91	Very high	130 Å²	130	43.6 Å²	43.6	57%	0.565	23%	0.228	S	C	*	.	H	α-helix	trans	-67.1	-34.7	177.4	-168.4	177.2	-172.6	177.6	0	112	R276 F277 G282 Y345 E346	R276-K280 PolarHBondContact O-N 3.33Å; F277-K280 PolarHBondContact O-N 3.06Å; K280-G282 VanDerWaalsContact C-N 3.26Å; K280-G282 PolarHBondContact O-N 3.14Å; K280-Y345 HydrophobicContact CB-CE2 3.88Å; K280-Y345 HydrophobicContact CD-CD2 3.7Å; K280-Y345 HydrophobicContact CD-CE2 3.33Å; K280-Y345 HydrophobicContact CG-CE2 4.21Å; K280-E346 PolarHBondContact NZ-O 2.82Å
281	L	91.1	Very high	91	Very high	48 Å²	48	48.4 Å²	48.4	25%	0.251	25%	0.246	S	C	.	.	H	α-helix	trans	-71	-23	178.2	-162.5	58.5	0	0	0	112.7	F277 D278 T279 R283 Y289	F277-L281 HydrophobicContact CE1-CD2 4.4Å; F277-L281 HydrophobicContact CZ-CD2 4.34Å; F277-L281 WeakPolarHBondContact O-CB 3.42Å; F277-L281 PolarHBondContact O-N 3.36Å; D278-L281 PolarHBondContact O-N 3.38Å; T279-L281 VanDerWaalsContact C-N 3.32Å; T279-L281 PolarHBondContact O-N 3.4Å; L281-R283 VanDerWaalsContact C-N 3.29Å; L281-R283 VanDerWaalsContact CD2-CZ 3.45Å; L281-R283 HydrophobicContact CG-CG 4.1Å; L281-R283 PolarHBondContact O-N 2.85Å; L281-Y289 HydrophobicContact CD2-CE2 3.87Å
282	G	84.4	Confident	90.9	Very high	61 Å²	61	49.1 Å²	49.1	63%	0.629	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.2	18.4	168.1	0	0	0	0	0	115.5	D278 T279 K280 K284	D278-G282 PolarHBondContact O-N 3.46Å; T279-G282 PolarHBondContact O-N 3.36Å; K280-G282 VanDerWaalsContact C-N 3.26Å; K280-G282 PolarHBondContact O-N 3.14Å; G282-K284 PolarHBondContact O-N 3.36Å
283	R	83.2	Confident	91	Very high	109 Å²	109	49.1 Å²	49.1	41%	0.411	25%	0.251	S	S	.	.			trans	-81.8	108.5	-175	-70.3	-179	-177.1	150.1	-0.3	112.2	L281 N285 S286 D338	L281-R283 VanDerWaalsContact C-N 3.29Å; L281-R283 VanDerWaalsContact CD2-CZ 3.45Å; L281-R283 HydrophobicContact CG-CG 4.1Å; L281-R283 PolarHBondContact O-N 2.85Å; R283-N285 PolarHBondContact O-N 2.94Å; R283-S286 WeakPolarHBondContact O-CB 3.43Å; R283-S286 PolarHBondContact O-N 3.27Å; R283-D338 IonicContact CZ-OD1 3.55Å; R283-D338 IonicContact CZ-OD2 2.76Å; R283-D338 IonicContact NH1-OD1 3.93Å; R283-D338 PolarHBondContact NH1-OD1 3.43Å; R283-D338 IonicContact NH1-OD2 3.07Å; R283-D338 PolarHBondContact NH1-OD2 3.01Å; R283-D338 IonicContact NH2-OD1 2.63Å; R283-D338 PolarHBondContact NH2-OD1 2.91Å; R283-D338 IonicContact NH2-OD2 3.07Å
284	K	74.2	Confident	91.1	Very high	211 Å²	211	50.3 Å²	50.3	92%	0.917	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	36.4	41.4	166	-65	-171.2	178.9	-178.4	0	115.2	G282 S286	G282-K284 PolarHBondContact O-N 3.36Å; K284-S286 PolarHBondContact O-N 3.49Å; K284-S286 VanDerWaalsContact O-N 3.08Å
285	N	67.6	Low	91.1	Very high	133 Å²	133	53.8 Å²	53.8	71%	0.711	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	31.5	-177.1	-151.4	36.2	0	0	0	114.6	R283 Y287	R283-N285 PolarHBondContact O-N 2.94Å; N285-Y287 PolarHBondContact OD1-OH 3.44Å
286	S	84.4	Confident	91.2	Very high	57 Å²	57	54.2 Å²	54.2	40%	0.399	28%	0.281	S	S	.	.			trans	-95.7	113.4	-179.5	174.6	0	0	0	0	109.4	R283 K284 A288	R283-S286 WeakPolarHBondContact O-CB 3.43Å; R283-S286 PolarHBondContact O-N 3.27Å; K284-S286 PolarHBondContact O-N 3.49Å; K284-S286 VanDerWaalsContact O-N 3.08Å; S286-A288 PolarHBondContact O-N 2.7Å; S286-A288 VanDerWaalsContact O-N 3.12Å
287	Y	93.5	Very high	91.5	Very high	54 Å²	54	53.9 Å²	53.9	21%	0.212	28%	0.28	C	S	.	.			trans	-86.6	55	172.1	-54.6	-61.1	0	0	0	111.2	F45 L275 D278 T279 N285 Y291	F45-Y287 HydrophobicContact CE1-CD2 4.48Å; F45-Y287 HydrophobicContact CE1-CE2 4.15Å; F45-Y287 HydrophobicContact CZ-CD2 4.42Å; L275-Y287 HydrophobicContact CD1-CD1 3.31Å; L275-Y287 HydrophobicContact CD1-CD2 4.45Å; L275-Y287 HydrophobicContact CD1-CE1 3.85Å; L275-Y287 HydrophobicContact CD1-CG 3.65Å; D278-Y287 HydrophobicContact CB-CD1 4.15Å; D278-Y287 VanDerWaalsContact OD2-CA 3.26Å; D278-Y287 WeakPolarHBondContact OD2-CA 3.45Å; T279-Y287 HydrophobicContact CG2-CE1 3.84Å; N285-Y287 PolarHBondContact OD1-OH 3.44Å; Y287-Y291 HydrophobicContact CD2-CE2 4.39Å; Y287-Y291 WeakPolarHBondContact O-CB 3.28Å; Y287-Y291 WeakPolarHBondContact O-CD2 3.25Å; Y287-Y291 PolarHBondContact O-N 2.89Å
288	A	93.9	Very high	91.6	Very high	18 Å²	18	55.2 Å²	55.2	15%	0.149	29%	0.287	C	S	.	.	H	α-helix	trans	-68.5	-41.3	-168.7	0	0	0	0	0	112.8	D278 S286 S292 M332 K336	D278-A288 PolarHBondContact OD1-N 2.98Å; D278-A288 VanDerWaalsContact OD1-N 3.09Å; D278-A288 PolarHBondContact OD2-N 3.13Å; D278-A288 VanDerWaalsContact OD2-N 3.15Å; S286-A288 PolarHBondContact O-N 2.7Å; S286-A288 VanDerWaalsContact O-N 3.12Å; A288-S292 WeakPolarHBondContact O-CB 3.42Å; A288-S292 PolarHBondContact O-N 3.34Å; A288-M332 HydrophobicContact CB-SD 4.43Å; A288-K336 VanDerWaalsContact CB-NZ 3.28Å
289	Y	96	Very high	91.7	Very high	1 Å²	1	59 Å²	59	0%	0.004	31%	0.31	C	S	.	.	H	α-helix	trans	-71.8	-40.5	178.3	-66.5	-72.8	0	0	0	111.6	F277 D278 L281 S292 G293 P329 M332 A333 D338 M342	F277-Y289 AromaticContact CD1-CD2 3.54Å; F277-Y289 HydrophobicContact CD1-CD2 3.54Å; F277-Y289 HydrophobicContact CD1-CE2 4.02Å; F277-Y289 AromaticContact CD1-CG 3.91Å; F277-Y289 HydrophobicContact CD1-CG 3.91Å; F277-Y289 HydrophobicContact CE1-CD1 4.42Å; F277-Y289 AromaticContact CE1-CD2 3.49Å; F277-Y289 HydrophobicContact CE1-CD2 3.49Å; F277-Y289 VanDerWaalsContact CE1-CD2 3.49Å; F277-Y289 HydrophobicContact CE1-CE1 4.36Å; F277-Y289 AromaticContact CE1-CE2 3.46Å; F277-Y289 HydrophobicContact CE1-CE2 3.46Å; F277-Y289 VanDerWaalsContact CE1-CE2 3.46Å; F277-Y289 HydrophobicContact CE1-CG 4.03Å; F277-Y289 AromaticContact CE1-CZ 3.92Å; F277-Y289 HydrophobicContact CZ-CE2 4.44Å; D278-Y289 WeakPolarHBondContact OD1-CD2 3.28Å; D278-Y289 PolarHBondContact OD1-N 3.33Å; D278-Y289 VanDerWaalsContact OD1-N 3.13Å; D278-Y289 WeakPolarHBondContact OD2-CA 3.15Å; D278-Y289 PolarHBondContact OD2-N 3.48Å; L281-Y289 HydrophobicContact CD2-CE2 3.87Å; Y289-S292 WeakPolarHBondContact O-CB 3.46Å; Y289-S292 PolarHBondContact O-N 2.85Å; Y289-G293 PolarHBondContact O-N 3Å; Y289-P329 HydrophobicContact CD1-CB 4.41Å; Y289-M332 HydrophobicContact CD1-CG 4.45Å; Y289-M332 HydrophobicContact CE1-CB 4.22Å; Y289-M332 HydrophobicContact CE1-CG 4Å; Y289-A333 HydrophobicContact CE1-CB 3.91Å; Y289-D338 VanDerWaalsContact OH-CB 3.23Å; Y289-D338 WeakPolarHBondContact OH-CB 3.31Å; Y289-D338 PolarHBondContact OH-OD2 2.71Å; Y289-M342 HydrophobicContact CD1-CE 3.5Å; Y289-M342 VanDerWaalsContact CD1-CE 3.5Å; Y289-M342 HydrophobicContact CE1-CE 3.56Å; Y289-M342 HydrophobicContact CG-CE 4.2Å
290	F	97.2	Very high	91.9	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-56.8	-54.2	172.2	171	-105	0	0	0	111.5	Y41 F45 I271 L275 D278 S292 G293 Y294	Y41-F290 HydrophobicContact CD2-CE1 4.17Å; Y41-F290 AromaticContact CD2-CZ 3.88Å; Y41-F290 HydrophobicContact CD2-CZ 3.88Å; Y41-F290 HydrophobicContact CE2-CE1 4.04Å; Y41-F290 HydrophobicContact CE2-CZ 4.18Å; F45-F290 HydrophobicContact CD2-CZ 4.28Å; F45-F290 HydrophobicContact CE2-CD1 4.46Å; F45-F290 AromaticContact CE2-CE1 3.61Å; F45-F290 HydrophobicContact CE2-CE1 3.61Å; F45-F290 AromaticContact CE2-CZ 3.68Å; F45-F290 HydrophobicContact CE2-CZ 3.68Å; F45-F290 HydrophobicContact CZ-CE1 4.07Å; F45-F290 HydrophobicContact CZ-CZ 4.49Å; I271-F290 HydrophobicContact CG2-CD2 3.47Å; I271-F290 VanDerWaalsContact CG2-CD2 3.47Å; I271-F290 HydrophobicContact CG2-CE2 3.48Å; I271-F290 VanDerWaalsContact CG2-CE2 3.48Å; L275-F290 HydrophobicContact CB-CB 3.93Å; L275-F290 HydrophobicContact CB-CD2 3.67Å; L275-F290 HydrophobicContact CB-CE2 4.47Å; L275-F290 HydrophobicContact CB-CG 3.99Å; L275-F290 HydrophobicContact CD1-CB 3.72Å; L275-F290 HydrophobicContact CD1-CD1 4.05Å; L275-F290 HydrophobicContact CD1-CD2 4.08Å; L275-F290 HydrophobicContact CD1-CG 3.67Å; L275-F290 HydrophobicContact CD2-CD2 4.28Å; L275-F290 HydrophobicContact CD2-CE2 4.38Å; L275-F290 HydrophobicContact CG-CB 4.42Å; L275-F290 HydrophobicContact CG-CD2 4.21Å; L275-F290 HydrophobicContact CG-CG 4.29Å; D278-F290 PolarHBondContact OD2-N 3.49Å; F290-S292 VanDerWaalsContact C-N 3.29Å; F290-S292 PolarHBondContact O-N 3.31Å; F290-G293 PolarHBondContact O-N 3.37Å; F290-Y294 HydrophobicContact CZ-CG 4.49Å; F290-Y294 VanDerWaalsContact O-CB 3.22Å; F290-Y294 WeakPolarHBondContact O-CB 3.5Å; F290-Y294 PolarHBondContact O-N 2.86Å
291	Y	96.9	Very high	92.1	Very high	101 Å²	101	50.2 Å²	50.2	40%	0.396	27%	0.267	S	S	.	.	H	α-helix	trans	-66.1	-32.8	179.5	-75.5	-59.8	0	0	0	112.1	Y287 T295	Y287-Y291 HydrophobicContact CD2-CE2 4.39Å; Y287-Y291 WeakPolarHBondContact O-CB 3.28Å; Y287-Y291 WeakPolarHBondContact O-CD2 3.25Å; Y287-Y291 PolarHBondContact O-N 2.89Å; Y291-T295 VanDerWaalsContact O-CB 3.31Å; Y291-T295 WeakPolarHBondContact O-CB 3.43Å; Y291-T295 VanDerWaalsContact O-CG2 3.25Å; Y291-T295 WeakPolarHBondContact O-CG2 3.45Å; Y291-T295 PolarHBondContact O-N 3.46Å; Y291-T295 PolarHBondContact O-OG1 3.34Å
292	S	96.7	Very high	92.3	Very high	16 Å²	16	51.7 Å²	51.7	11%	0.112	28%	0.275	C	S	.	.	H	α-helix	trans	-61.2	-47	172.2	-176.4	0	0	0	0	111.8	A288 Y289 F290 T295 A296 A328	A288-S292 WeakPolarHBondContact O-CB 3.42Å; A288-S292 PolarHBondContact O-N 3.34Å; Y289-S292 WeakPolarHBondContact O-CB 3.46Å; Y289-S292 PolarHBondContact O-N 2.85Å; F290-S292 VanDerWaalsContact C-N 3.29Å; F290-S292 PolarHBondContact O-N 3.31Å; S292-T295 PolarHBondContact O-OG1 3.34Å; S292-A296 VanDerWaalsContact O-CB 3.25Å; S292-A296 WeakPolarHBondContact O-CB 3.45Å; S292-A296 PolarHBondContact O-N 2.78Å; S292-A296 VanDerWaalsContact O-N 3.15Å; S292-A328 VanDerWaalsContact OG-C 3.3Å; S292-A328 PolarHBondContact OG-O 3.46Å
293	G	97.6	Very high	92.7	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-69.7	-41.5	177.7	0	0	0	0	0	112.6	Y289 F290 A296 Y297	Y289-G293 PolarHBondContact O-N 3Å; F290-G293 PolarHBondContact O-N 3.37Å; G293-A296 PolarHBondContact O-N 2.78Å; G293-Y297 WeakPolarHBondContact O-CB 3.35Å; G293-Y297 PolarHBondContact O-N 2.69Å
294	Y	98.1	Very high	93.1	Very high	28 Å²	28	47.5 Å²	47.5	11%	0.11	25%	0.245	C	C	.	.	H	α-helix	trans	-66.1	-43.3	-179.6	-173.9	-108.9	0	0	0	112.6	I37 I40 Y41 F290 Y297 I298	I37-Y294 HydrophobicContact CB-CE2 4.4Å; I37-Y294 PolarHBondContact O-OH 3.47Å; I37-Y294 VanDerWaalsContact O-OH 3.06Å; I40-Y294 HydrophobicContact CB-CE2 4.34Å; I40-Y294 HydrophobicContact CG2-CD2 3.91Å; I40-Y294 HydrophobicContact CG2-CE2 4.04Å; Y41-Y294 HydrophobicContact CD2-CE1 4.3Å; Y41-Y294 HydrophobicContact CD2-CE2 4.46Å; F290-Y294 HydrophobicContact CZ-CG 4.49Å; F290-Y294 VanDerWaalsContact O-CB 3.22Å; F290-Y294 WeakPolarHBondContact O-CB 3.5Å; F290-Y294 PolarHBondContact O-N 2.86Å; Y294-Y297 WeakPolarHBondContact O-CB 3.43Å; Y294-Y297 PolarHBondContact O-N 3.13Å; Y294-I298 HydrophobicContact CD1-CD1 3.84Å; Y294-I298 HydrophobicContact CE1-CD1 3.54Å; Y294-I298 WeakPolarHBondContact O-CG1 3.49Å; Y294-I298 PolarHBondContact O-N 3.02Å
295	T	97.6	Very high	93.9	Very high	74 Å²	74	38.4 Å²	38.4	45%	0.454	21%	0.205	S	C	.	.	H	α-helix	trans	-68.5	-37.3	175	54.2	0	0	0	0	111.7	Y291 S292 Y297 I298 V299	Y291-T295 VanDerWaalsContact O-CB 3.31Å; Y291-T295 WeakPolarHBondContact O-CB 3.43Å; Y291-T295 VanDerWaalsContact O-CG2 3.25Å; Y291-T295 WeakPolarHBondContact O-CG2 3.45Å; Y291-T295 PolarHBondContact O-N 3.46Å; Y291-T295 PolarHBondContact O-OG1 3.34Å; S292-T295 PolarHBondContact O-OG1 3.34Å; T295-Y297 VanDerWaalsContact C-N 3.34Å; T295-Y297 PolarHBondContact O-N 2.9Å; T295-I298 PolarHBondContact O-N 2.87Å; T295-V299 WeakPolarHBondContact O-CG2 3.37Å; T295-V299 PolarHBondContact O-N 3.25Å
296	A	97.9	Very high	95	Very high	9 Å²	9	35.3 Å²	35.3	7%	0.074	19%	0.191	C	C	.	.	H	α-helix	trans	-61.8	-41.3	173	0	0	0	0	0	112.2	S292 G293 V299 A300 A324 A328	S292-A296 VanDerWaalsContact O-CB 3.25Å; S292-A296 WeakPolarHBondContact O-CB 3.45Å; S292-A296 PolarHBondContact O-N 2.78Å; S292-A296 VanDerWaalsContact O-N 3.15Å; G293-A296 PolarHBondContact O-N 2.78Å; A296-V299 PolarHBondContact O-N 3.25Å; A296-A300 VanDerWaalsContact O-CB 3.31Å; A296-A300 WeakPolarHBondContact O-CB 3.2Å; A296-A300 PolarHBondContact O-N 2.86Å; A296-A324 HydrophobicContact CB-CB 4.17Å; A296-A324 WeakPolarHBondContact CB-O 3.34Å; A296-A328 HydrophobicContact CB-CB 3.76Å
297	Y	98.1	Very high	95.2	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-58.9	-47.9	172.6	-178.9	-86.5	0	0	0	111.8	A36 I37 I40 D263 P267 I271 G293 Y294 T295 V299 A300 I301 L321	A36-Y297 HydrophobicContact CB-CE1 4.29Å; I37-Y297 HydrophobicContact CG2-CD1 4.34Å; I37-Y297 HydrophobicContact CG2-CE1 4.22Å; I40-Y297 HydrophobicContact CD1-CD1 3.81Å; I40-Y297 HydrophobicContact CD1-CD2 3.98Å; I40-Y297 HydrophobicContact CD1-CE1 3.4Å; I40-Y297 VanDerWaalsContact CD1-CE1 3.4Å; I40-Y297 HydrophobicContact CD1-CE2 3.57Å; I40-Y297 HydrophobicContact CD1-CG 4.1Å; D263-Y297 VanDerWaalsContact O-CE2 3.3Å; D263-Y297 WeakPolarHBondContact O-CE2 3.39Å; D263-Y297 PolarHBondContact O-OH 3.28Å; P267-Y297 HydrophobicContact CB-CD2 3.62Å; P267-Y297 HydrophobicContact CB-CE2 3.68Å; P267-Y297 HydrophobicContact CG-CD2 4.25Å; P267-Y297 HydrophobicContact CG-CE2 3.91Å; I271-Y297 HydrophobicContact CD1-CD2 4.21Å; I271-Y297 HydrophobicContact CD1-CG 4.17Å; G293-Y297 WeakPolarHBondContact O-CB 3.35Å; G293-Y297 PolarHBondContact O-N 2.69Å; Y294-Y297 WeakPolarHBondContact O-CB 3.43Å; Y294-Y297 PolarHBondContact O-N 3.13Å; T295-Y297 VanDerWaalsContact C-N 3.34Å; T295-Y297 PolarHBondContact O-N 2.9Å; Y297-V299 PolarHBondContact O-N 3.18Å; Y297-A300 PolarHBondContact O-N 2.74Å; Y297-I301 HydrophobicContact CD1-CG2 4.46Å; Y297-I301 HydrophobicContact CE1-CB 4.37Å; Y297-I301 HydrophobicContact CE1-CD1 4.11Å; Y297-I301 HydrophobicContact CE1-CG2 4.28Å; Y297-I301 WeakPolarHBondContact O-CG2 3.28Å; Y297-I301 PolarHBondContact O-N 2.69Å; Y297-L321 HydrophobicContact CD2-CD2 3.57Å; Y297-L321 HydrophobicContact CE2-CD1 4.21Å; Y297-L321 HydrophobicContact CE2-CD2 3.61Å; Y297-L321 HydrophobicContact CG-CD2 4.16Å
298	I	97.7	Very high	94.9	Very high	38 Å²	38	33.7 Å²	33.7	20%	0.195	18%	0.18	C	C	.	.	H	α-helix	trans	-57.3	-47.3	177.5	-75.6	168.1	0	0	0	111.2	F33 I37 Y294 T295 I301 I302	F33-I298 HydrophobicContact CE2-CB 4.38Å; F33-I298 HydrophobicContact CE2-CG1 4.24Å; F33-I298 HydrophobicContact CE2-CG2 3.91Å; F33-I298 HydrophobicContact CZ-CB 4.49Å; F33-I298 HydrophobicContact CZ-CG1 4.13Å; F33-I298 HydrophobicContact CZ-CG2 3.83Å; I37-I298 HydrophobicContact CG2-CG1 3.87Å; Y294-I298 HydrophobicContact CD1-CD1 3.84Å; Y294-I298 HydrophobicContact CE1-CD1 3.54Å; Y294-I298 WeakPolarHBondContact O-CG1 3.49Å; Y294-I298 PolarHBondContact O-N 3.02Å; T295-I298 PolarHBondContact O-N 2.87Å; I298-I301 VanDerWaalsContact O-CG2 3.29Å; I298-I301 WeakPolarHBondContact O-CG2 3.29Å; I298-I302 HydrophobicContact CG2-CD1 3.84Å; I298-I302 WeakPolarHBondContact O-CB 3.18Å; I298-I302 WeakPolarHBondContact O-CD1 3.43Å; I298-I302 WeakPolarHBondContact O-CG1 3.23Å; I298-I302 PolarHBondContact O-N 2.78Å; I298-I302 VanDerWaalsContact O-N 3.15Å
299	V	97	Very high	94.5	Very high	89 Å²	89	34.1 Å²	34.1	54%	0.539	18%	0.179	S	C	.	.	H	α-helix	trans	-63.3	-45.2	178.4	172.6	0	0	0	0	110.5	T295 A296 Y297 I302 M303	T295-V299 WeakPolarHBondContact O-CG2 3.37Å; T295-V299 PolarHBondContact O-N 3.25Å; A296-V299 PolarHBondContact O-N 3.25Å; Y297-V299 PolarHBondContact O-N 3.18Å; V299-I302 PolarHBondContact O-N 2.99Å; V299-M303 HydrophobicContact CG1-CG 4.45Å; V299-M303 VanDerWaalsContact O-CG 3.29Å; V299-M303 WeakPolarHBondContact O-CG 3.37Å; V299-M303 PolarHBondContact O-N 3.15Å
300	A	96.7	Very high	94	Very high	4 Å²	4	38.8 Å²	38.8	3%	0.033	21%	0.207	C	C	.	.	H	α-helix	trans	-65.1	-42.9	-178.9	0	0	0	0	0	113.3	A296 Y297 I302 M303 T304 Y320 L321 A324	A296-A300 VanDerWaalsContact O-CB 3.31Å; A296-A300 WeakPolarHBondContact O-CB 3.2Å; A296-A300 PolarHBondContact O-N 2.86Å; Y297-A300 PolarHBondContact O-N 2.74Å; A300-I302 VanDerWaalsContact C-N 3.34Å; A300-I302 PolarHBondContact O-N 3.48Å; A300-M303 WeakPolarHBondContact O-CB 3.25Å; A300-M303 PolarHBondContact O-N 3.31Å; A300-T304 PolarHBondContact O-N 3.18Å; A300-T304 PolarHBondContact O-OG1 3.33Å; A300-T304 VanDerWaalsContact O-OG1 3.06Å; A300-Y320 WeakPolarHBondContact CB-O 3.02Å; A300-L321 HydrophobicContact CB-CD2 3.6Å; A300-L321 HydrophobicContact CB-CG 4.24Å; A300-A324 HydrophobicContact CB-CB 3.79Å
301	I	94.8	Very high	93.5	Very high	3 Å²	3	44.8 Å²	44.8	2%	0.015	23%	0.234	C	C	.	.	H	α-helix	trans	-67.3	-36.7	178.1	-165.2	171.1	0	0	0	111.7	F33 A36 L259 Y297 I298 M303 T304 F305 L321	F33-I301 HydrophobicContact CD2-CG2 3.73Å; F33-I301 HydrophobicContact CE2-CG2 3.79Å; A36-I301 HydrophobicContact CB-CD1 3.45Å; A36-I301 VanDerWaalsContact CB-CD1 3.45Å; L259-I301 HydrophobicContact CD2-CD1 3.89Å; Y297-I301 HydrophobicContact CD1-CG2 4.46Å; Y297-I301 HydrophobicContact CE1-CB 4.37Å; Y297-I301 HydrophobicContact CE1-CD1 4.11Å; Y297-I301 HydrophobicContact CE1-CG2 4.28Å; Y297-I301 WeakPolarHBondContact O-CG2 3.28Å; Y297-I301 PolarHBondContact O-N 2.69Å; I298-I301 VanDerWaalsContact O-CG2 3.29Å; I298-I301 WeakPolarHBondContact O-CG2 3.29Å; I301-M303 VanDerWaalsContact C-N 3.33Å; I301-T304 WeakPolarHBondContact O-CB 3.5Å; I301-T304 PolarHBondContact O-N 2.99Å; I301-F305 HydrophobicContact CD1-CE2 4.36Å; I301-F305 HydrophobicContact CD1-CZ 4.12Å; I301-F305 HydrophobicContact CG1-CE1 4.45Å; I301-F305 HydrophobicContact CG1-CE2 4.01Å; I301-F305 HydrophobicContact CG1-CZ 3.94Å; I301-F305 WeakPolarHBondContact O-CG 3.31Å; I301-F305 PolarHBondContact O-N 2.94Å; I301-L321 HydrophobicContact CB-CD2 4.29Å
302	I	94.4	Very high	92.8	Very high	79 Å²	79	45 Å²	45	41%	0.405	24%	0.237	S	C	.	.	H	α-helix	trans	-61.8	-45.3	172.2	-69	167.3	0	0	0	109.6	F33 I298 V299 A300 T304 F305 V306	F33-I302 HydrophobicContact CD2-CG1 4.25Å; F33-I302 HydrophobicContact CE2-CD1 4.12Å; F33-I302 HydrophobicContact CE2-CG1 3.99Å; I298-I302 HydrophobicContact CG2-CD1 3.84Å; I298-I302 WeakPolarHBondContact O-CB 3.18Å; I298-I302 WeakPolarHBondContact O-CD1 3.43Å; I298-I302 WeakPolarHBondContact O-CG1 3.23Å; I298-I302 PolarHBondContact O-N 2.78Å; I298-I302 VanDerWaalsContact O-N 3.15Å; V299-I302 PolarHBondContact O-N 2.99Å; A300-I302 VanDerWaalsContact C-N 3.34Å; A300-I302 PolarHBondContact O-N 3.48Å; I302-T304 VanDerWaalsContact C-N 3.33Å; I302-T304 PolarHBondContact O-N 3.07Å; I302-F305 PolarHBondContact O-N 3.21Å; I302-V306 HydrophobicContact CG2-CG2 4.39Å; I302-V306 WeakPolarHBondContact O-CG2 3.22Å; I302-V306 PolarHBondContact O-N 3.24Å
303	M	93.6	Very high	91.8	Very high	74 Å²	74	46.1 Å²	46.1	37%	0.365	24%	0.24	S	C	.	.	H	α-helix	trans	-59.8	-41.5	175.5	-73.5	-59.6	-62.3	0	0	112.1	V299 A300 I301 F305 V306 M307 Y320	V299-M303 HydrophobicContact CG1-CG 4.45Å; V299-M303 VanDerWaalsContact O-CG 3.29Å; V299-M303 WeakPolarHBondContact O-CG 3.37Å; V299-M303 PolarHBondContact O-N 3.15Å; A300-M303 WeakPolarHBondContact O-CB 3.25Å; A300-M303 PolarHBondContact O-N 3.31Å; I301-M303 VanDerWaalsContact C-N 3.33Å; M303-F305 VanDerWaalsContact C-N 3.34Å; M303-F305 PolarHBondContact O-N 3.39Å; M303-V306 PolarHBondContact O-N 3.5Å; M303-M307 HydrophobicContact CE-CE 3.57Å; M303-M307 WeakPolarHBondContact O-CB 3.13Å; M303-M307 VanDerWaalsContact O-CG 3.27Å; M303-M307 WeakPolarHBondContact O-CG 3.47Å; M303-M307 PolarHBondContact O-N 2.98Å; M303-Y320 HydrophobicContact CB-CD1 4.34Å
304	T	91.6	Very high	90.8	Very high	9 Å²	9	47.3 Å²	47.3	6%	0.055	25%	0.25	C	S	.	.	H	α-helix	trans	-58.3	-45.2	174.4	-58.3	0	0	0	0	111.4	A300 I301 I302 M307 M308 Q315 A317 Y320	A300-T304 PolarHBondContact O-N 3.18Å; A300-T304 PolarHBondContact O-OG1 3.33Å; A300-T304 VanDerWaalsContact O-OG1 3.06Å; I301-T304 WeakPolarHBondContact O-CB 3.5Å; I301-T304 PolarHBondContact O-N 2.99Å; I302-T304 VanDerWaalsContact C-N 3.33Å; I302-T304 PolarHBondContact O-N 3.07Å; T304-M307 PolarHBondContact O-N 3.47Å; T304-M308 WeakPolarHBondContact O-CB 3.33Å; T304-M308 PolarHBondContact O-N 3.23Å; T304-Q315 HydrophobicContact CG2-CB 4.37Å; T304-A317 HydrophobicContact CG2-CB 4.07Å; T304-Y320 WeakPolarHBondContact OG1-CD2 3.47Å
305	F	90	Very high	90	Very high	19 Å²	19	47.6 Å²	47.6	8%	0.083	25%	0.252	C	S	.	.	H	α-helix	trans	-67.2	-39.4	177.8	-66	-27.5	0	0	0	113.1	N29 L32 F33 I301 I302 M303 M308 H309	N29-F305 HydrophobicContact CB-CD2 4.3Å; L32-F305 HydrophobicContact CB-CZ 3.95Å; F33-F305 HydrophobicContact CB-CE2 4.07Å; I301-F305 HydrophobicContact CD1-CE2 4.36Å; I301-F305 HydrophobicContact CD1-CZ 4.12Å; I301-F305 HydrophobicContact CG1-CE1 4.45Å; I301-F305 HydrophobicContact CG1-CE2 4.01Å; I301-F305 HydrophobicContact CG1-CZ 3.94Å; I301-F305 WeakPolarHBondContact O-CG 3.31Å; I301-F305 PolarHBondContact O-N 2.94Å; I302-F305 PolarHBondContact O-N 3.21Å; M303-F305 VanDerWaalsContact C-N 3.34Å; M303-F305 PolarHBondContact O-N 3.39Å; F305-M308 HydrophobicContact CD1-CE 4.26Å; F305-M308 PolarHBondContact O-N 3.14Å; F305-H309 PolarHBondContact O-CD2 3.03Å; F305-H309 VanDerWaalsContact O-CD2 3.29Å; F305-H309 PolarHBondContact O-N 3.39Å; F305-H309 VanDerWaalsContact O-N 3.14Å
306	V	90.5	Very high	89.5	Confident	68 Å²	68	44.1 Å²	44.1	41%	0.412	23%	0.231	S	C	.	.	H	α-helix	trans	-62.4	-48.1	175.1	171.3	0	0	0	0	110.3	I302 M303 M308 H309 V310	I302-V306 HydrophobicContact CG2-CG2 4.39Å; I302-V306 WeakPolarHBondContact O-CG2 3.22Å; I302-V306 PolarHBondContact O-N 3.24Å; M303-V306 PolarHBondContact O-N 3.5Å; V306-M308 VanDerWaalsContact C-N 3.34Å; V306-M308 PolarHBondContact O-N 2.97Å; V306-H309 WeakPolarHBondContact O-CB 3.47Å; V306-H309 PolarHBondContact O-N 3.18Å; V306-H309 VanDerWaalsContact O-N 3.15Å; V306-V310 HydrophobicContact CG1-CG2 4.44Å; V306-V310 WeakPolarHBondContact O-CG2 3.04Å; V306-V310 PolarHBondContact O-N 3.4Å
307	M	89.9	Confident	89	Confident	48 Å²	48	44 Å²	44	24%	0.236	23%	0.23	C	C	.	.	H	α-helix	trans	-66.1	-36.2	-180	-67.7	-62.3	169.6	0	0	112.2	M303 T304 H309 V310 F311 Q315 Y320	M303-M307 HydrophobicContact CE-CE 3.57Å; M303-M307 WeakPolarHBondContact O-CB 3.13Å; M303-M307 VanDerWaalsContact O-CG 3.27Å; M303-M307 WeakPolarHBondContact O-CG 3.47Å; M303-M307 PolarHBondContact O-N 2.98Å; T304-M307 PolarHBondContact O-N 3.47Å; M307-H309 VanDerWaalsContact C-N 3.3Å; M307-H309 PolarHBondContact O-N 3.43Å; M307-V310 PolarHBondContact O-N 3.28Å; M307-F311 HydrophobicContact CB-CD2 4.3Å; M307-F311 WeakPolarHBondContact O-CB 3.32Å; M307-F311 VanDerWaalsContact O-CD2 3.3Å; M307-F311 WeakPolarHBondContact O-CD2 3.37Å; M307-F311 PolarHBondContact O-N 3.18Å; M307-F311 HydrophobicContact SD-CD2 4.29Å; M307-F311 HydrophobicContact SD-CE2 3.73Å; M307-Q315 HydrophobicContact CB-CG 4.22Å; M307-Y320 HydrophobicContact CB-CE1 4.47Å; M307-Y320 WeakPolarHBondContact CB-OH 3.3Å; M307-Y320 HydrophobicContact CG-CE1 3.81Å; M307-Y320 WeakPolarHBondContact CG-OH 3.35Å
308	M	85.9	Confident	88.7	Confident	30 Å²	30	44.4 Å²	44.4	15%	0.148	23%	0.232	C	C	.	.	H	α-helix	trans	-58.7	-42.5	172.3	-177.1	-176.1	63.2	0	0	111.7	I16 L19 T304 F305 V306 K312 Q315	I16-M308 HydrophobicContact CD1-CG 4.14Å; I16-M308 HydrophobicContact CD1-SD 4.18Å; L19-M308 HydrophobicContact CD2-CG 3.99Å; L19-M308 WeakPolarHBondContact CD2-O 3.33Å; T304-M308 WeakPolarHBondContact O-CB 3.33Å; T304-M308 PolarHBondContact O-N 3.23Å; F305-M308 HydrophobicContact CD1-CE 4.26Å; F305-M308 PolarHBondContact O-N 3.14Å; V306-M308 VanDerWaalsContact C-N 3.34Å; V306-M308 PolarHBondContact O-N 2.97Å; M308-K312 WeakPolarHBondContact O-CA 3.43Å; M308-K312 PolarHBondContact O-N 2.94Å; M308-Q315 HydrophobicContact CB-CG 4.45Å
309	H	85.5	Confident	88.5	Confident	26 Å²	26	44.9 Å²	44.9	12%	0.12	24%	0.235	C	C	.	.	H	α-helix	trans	-67.2	-41.7	176.4	-85	-61.3	0	0	0	113.2	L19 N29 F305 V306 M307	L19-H309 VanDerWaalsContact CD1-CE1 3.47Å; L19-H309 WeakPolarHBondContact CD1-CE1 3.32Å; L19-H309 VanDerWaalsContact CG-ND1 3.35Å; L19-H309 WeakPolarHBondContact CG-ND1 3.33Å; N29-H309 PolarHBondContact ND2-CD2 3.25Å; N29-H309 VanDerWaalsContact ND2-CD2 3.32Å; N29-H309 PolarHBondContact ND2-NE2 2.9Å; F305-H309 PolarHBondContact O-CD2 3.03Å; F305-H309 VanDerWaalsContact O-CD2 3.29Å; F305-H309 PolarHBondContact O-N 3.39Å; F305-H309 VanDerWaalsContact O-N 3.14Å; V306-H309 WeakPolarHBondContact O-CB 3.47Å; V306-H309 PolarHBondContact O-N 3.18Å; V306-H309 VanDerWaalsContact O-N 3.15Å; M307-H309 VanDerWaalsContact C-N 3.3Å; M307-H309 PolarHBondContact O-N 3.43Å
310	V	87	Confident	88.4	Confident	99 Å²	99	43.1 Å²	43.1	60%	0.6	22%	0.219	S	C	*	.	H	α-helix	trans	-67.6	-46.7	-179.7	172.6	0	0	0	0	111.5	V306 M307	V306-V310 HydrophobicContact CG1-CG2 4.44Å; V306-V310 WeakPolarHBondContact O-CG2 3.04Å; V306-V310 PolarHBondContact O-N 3.4Å; M307-V310 PolarHBondContact O-N 3.28Å
311	F	85.9	Confident	88.4	Confident	127 Å²	127	43 Å²	43	56%	0.557	22%	0.218	S	C	*	.	H	α-helix	trans	-89.6	-7.6	-175.4	-69	-72.3	0	0	0	114.1	M307 H313	M307-F311 HydrophobicContact CB-CD2 4.3Å; M307-F311 WeakPolarHBondContact O-CB 3.32Å; M307-F311 VanDerWaalsContact O-CD2 3.3Å; M307-F311 WeakPolarHBondContact O-CD2 3.37Å; M307-F311 PolarHBondContact O-N 3.18Å; M307-F311 HydrophobicContact SD-CD2 4.29Å; M307-F311 HydrophobicContact SD-CE2 3.73Å; F311-H313 PolarHBondContact O-N 2.93Å
312	K	81.5	Confident	88.4	Confident	105 Å²	105	43.1 Å²	43.1	46%	0.457	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.4	29.9	-174.8	-60.4	-173.3	176.3	-174.5	0	113.6	T15 I16 M308	T15-K312 CarbonylContact C-O 3.52Å; T15-K312 WeakPolarHBondContact CA-O 3.16Å; I16-K312 PolarHBondContact N-O 2.89Å; M308-K312 WeakPolarHBondContact O-CA 3.43Å; M308-K312 PolarHBondContact O-N 2.94Å
313	H	76.1	Confident	88.5	Confident	40 Å²	40	42.8 Å²	42.8	19%	0.185	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-132.6	146.6	-177.5	-167.8	-82.4	0	0	0	109.2	N13 G14 F311 Q315	N13-H313 PolarHBondContact O-CD2 3.43Å; N13-H313 PolarHBondContact O-NE2 2.87Å; G14-H313 WeakPolarHBondContact CA-NE2 3.49Å; F311-H313 PolarHBondContact O-N 2.93Å; H313-Q315 PolarHBondContact O-N 3.29Å
314	A	76.3	Confident	88.7	Confident	25 Å²	25	40.6 Å²	40.6	21%	0.207	22%	0.215	C	C	.	.			trans	-58.7	124.5	171.1	0	0	0	0	0	109.9	M228	M228-A314 HydrophobicContact CE-CB 4.19Å; M228-A314 HydrophobicContact SD-CB 4.05Å
315	Q	82.7	Confident	88.9	Confident	34 Å²	34	40.2 Å²	40.2	16%	0.159	21%	0.213	C	C	.	.			trans	-99.2	141.3	179.8	-66.7	-66.7	-44.5	0	0	109.6	T304 M307 M308 H313 A317 Y320	T304-Q315 HydrophobicContact CG2-CB 4.37Å; M307-Q315 HydrophobicContact CB-CG 4.22Å; M308-Q315 HydrophobicContact CB-CG 4.45Å; H313-Q315 PolarHBondContact O-N 3.29Å; Q315-A317 PolarHBondContact O-N 3.43Å; Q315-A317 VanDerWaalsContact O-N 3.14Å; Q315-Y320 HydrophobicContact CB-CE2 4.2Å; Q315-Y320 PolarHBondContact OE1-OH 2.82Å
316	P	87	Confident	89.3	Confident	1 Å²	1	40 Å²	40	1%	0.006	21%	0.213	C	C	.	.			trans	-62.7	112.4	167.1	24.6	-29.5	0	0	0	108.8	D217 V221 F222 L318 L319	D217-P316 HydrophobicContact CB-CB 4.12Å; D217-P316 WeakPolarHBondContact OD2-CA 3.32Å; D217-P316 WeakPolarHBondContact OD2-CB 3.28Å; V221-P316 HydrophobicContact CB-CB 4.27Å; V221-P316 HydrophobicContact CG1-CB 4.47Å; V221-P316 HydrophobicContact CG1-CG 4.5Å; V221-P316 HydrophobicContact CG2-CB 4.08Å; F222-P316 HydrophobicContact CD2-CG 4.3Å; F222-P316 HydrophobicContact CE2-CG 3.46Å; F222-P316 VanDerWaalsContact CE2-CG 3.46Å; F222-P316 HydrophobicContact CZ-CG 3.73Å; P316-L318 VanDerWaalsContact C-N 3.28Å; P316-L318 PolarHBondContact O-N 3.38Å; P316-L319 HydrophobicContact CB-CB 4.21Å; P316-L319 HydrophobicContact CG-CB 3.85Å; P316-L319 HydrophobicContact CG-CD2 3.92Å; P316-L319 HydrophobicContact CG-CG 4.49Å; P316-L319 WeakPolarHBondContact O-CB 3.44Å; P316-L319 PolarHBondContact O-N 3.25Å
317	A	87.9	Confident	89.6	Confident	7 Å²	7	38.4 Å²	38.4	6%	0.058	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-34.1	-173.5	0	0	0	0	0	111.3	D217 D263 T304 Q315 L319 Y320 L321	D217-A317 PolarHBondContact OD2-N 2.84Å; D263-A317 HydrophobicContact CB-CB 4.03Å; T304-A317 HydrophobicContact CG2-CB 4.07Å; Q315-A317 PolarHBondContact O-N 3.43Å; Q315-A317 VanDerWaalsContact O-N 3.14Å; A317-L319 PolarHBondContact O-N 3.27Å; A317-Y320 PolarHBondContact O-N 3Å; A317-L321 HydrophobicContact CB-CD1 3.96Å; A317-L321 WeakPolarHBondContact O-CD1 3.36Å; A317-L321 VanDerWaalsContact O-CG 3.26Å; A317-L321 WeakPolarHBondContact O-CG 3.49Å; A317-L321 PolarHBondContact O-N 2.89Å; A317-L321 VanDerWaalsContact O-N 3.09Å
318	L	91.2	Very high	89.9	Confident	7 Å²	7	37.7 Å²	37.7	4%	0.037	21%	0.211	C	C	.	.	H	α-helix	trans	-66.6	-21.8	179.6	-65.7	-177.6	0	0	0	113	L213 D217 P267 P316 Y320 L321 V322	L213-L318 HydrophobicContact CB-CD1 3.59Å; D217-L318 HydrophobicContact CB-CB 4.25Å; D217-L318 HydrophobicContact CB-CD1 4.42Å; D217-L318 PolarHBondContact OD2-N 3.46Å; P267-L318 HydrophobicContact CG-CD2 4.16Å; P316-L318 VanDerWaalsContact C-N 3.28Å; P316-L318 PolarHBondContact O-N 3.38Å; L318-Y320 PolarHBondContact O-N 3.3Å; L318-L321 HydrophobicContact CD2-CB 4.42Å; L318-L321 HydrophobicContact CD2-CD1 4.26Å; L318-L321 PolarHBondContact O-N 3.42Å; L318-V322 HydrophobicContact CB-CG2 4.02Å; L318-V322 HydrophobicContact CD2-CG2 4.25Å; L318-V322 VanDerWaalsContact O-CB 3.3Å; L318-V322 WeakPolarHBondContact O-CB 3.29Å; L318-V322 VanDerWaalsContact O-CG2 3.31Å; L318-V322 WeakPolarHBondContact O-CG2 3.11Å; L318-V322 PolarHBondContact O-N 2.95Å
319	L	93.4	Very high	90.4	Very high	49 Å²	49	36.2 Å²	36.2	26%	0.257	20%	0.204	S	C	.	.	H	α-helix	trans	-56.8	-36.4	173.6	-178.9	67	0	0	0	112.2	F214 I218 P316 A317 P323	F214-L319 HydrophobicContact CE2-CD1 3.66Å; F214-L319 HydrophobicContact CZ-CD1 3.93Å; I218-L319 HydrophobicContact CD1-CD1 4.07Å; I218-L319 HydrophobicContact CG1-CD1 4.33Å; P316-L319 HydrophobicContact CB-CB 4.21Å; P316-L319 HydrophobicContact CG-CB 3.85Å; P316-L319 HydrophobicContact CG-CD2 3.92Å; P316-L319 HydrophobicContact CG-CG 4.49Å; P316-L319 WeakPolarHBondContact O-CB 3.44Å; P316-L319 PolarHBondContact O-N 3.25Å; A317-L319 PolarHBondContact O-N 3.27Å; L319-P323 VanDerWaalsContact O-CD 3.24Å; L319-P323 WeakPolarHBondContact O-CD 3.26Å; L319-P323 WeakPolarHBondContact O-CG 3.42Å
320	Y	94.7	Very high	90.9	Very high	52 Å²	52	37.3 Å²	37.3	20%	0.204	21%	0.21	C	C	.	.	H	α-helix	trans	-95.2	-37.9	179	-57.4	-87.3	0	0	0	111.6	A300 M303 T304 M307 Q315 A317 L318 A324	A300-Y320 WeakPolarHBondContact CB-O 3.02Å; M303-Y320 HydrophobicContact CB-CD1 4.34Å; T304-Y320 WeakPolarHBondContact OG1-CD2 3.47Å; M307-Y320 HydrophobicContact CB-CE1 4.47Å; M307-Y320 WeakPolarHBondContact CB-OH 3.3Å; M307-Y320 HydrophobicContact CG-CE1 3.81Å; M307-Y320 WeakPolarHBondContact CG-OH 3.35Å; Q315-Y320 HydrophobicContact CB-CE2 4.2Å; Q315-Y320 PolarHBondContact OE1-OH 2.82Å; A317-Y320 PolarHBondContact O-N 3Å; L318-Y320 PolarHBondContact O-N 3.3Å; Y320-A324 WeakPolarHBondContact O-CB 3.41Å
321	L	95.6	Very high	91.4	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-69.3	-44.2	-175.8	-65.1	164.3	0	0	0	112.1	D263 P267 Y297 A300 I301 A317 L318 A324 C325	D263-L321 HydrophobicContact CB-CD1 4.16Å; P267-L321 HydrophobicContact CG-CB 4.44Å; P267-L321 HydrophobicContact CG-CD1 4.35Å; Y297-L321 HydrophobicContact CD2-CD2 3.57Å; Y297-L321 HydrophobicContact CE2-CD1 4.21Å; Y297-L321 HydrophobicContact CE2-CD2 3.61Å; Y297-L321 HydrophobicContact CG-CD2 4.16Å; A300-L321 HydrophobicContact CB-CD2 3.6Å; A300-L321 HydrophobicContact CB-CG 4.24Å; I301-L321 HydrophobicContact CB-CD2 4.29Å; A317-L321 HydrophobicContact CB-CD1 3.96Å; A317-L321 WeakPolarHBondContact O-CD1 3.36Å; A317-L321 VanDerWaalsContact O-CG 3.26Å; A317-L321 WeakPolarHBondContact O-CG 3.49Å; A317-L321 PolarHBondContact O-N 2.89Å; A317-L321 VanDerWaalsContact O-N 3.09Å; L318-L321 HydrophobicContact CD2-CB 4.42Å; L318-L321 HydrophobicContact CD2-CD1 4.26Å; L318-L321 PolarHBondContact O-N 3.42Å; L321-A324 PolarHBondContact O-N 2.86Å; L321-C325 WeakPolarHBondContact O-CB 3.35Å; L321-C325 PolarHBondContact O-N 3.49Å; L321-C325 PolarHBondContact O-SG 2.98Å
322	V	96.4	Very high	91.8	Very high	5 Å²	5	34.6 Å²	34.6	3%	0.03	20%	0.197	C	C	.	.	H	α-helix	trans	-65.2	-50.8	-173.2	171.4	0	0	0	0	112.3	L210 F214 L318 A324 C325 L326	L210-V322 HydrophobicContact CB-CG1 3.99Å; L210-V322 HydrophobicContact CB-CG2 4.05Å; L210-V322 HydrophobicContact CD2-CG2 4.08Å; L210-V322 WeakPolarHBondContact O-CG2 3.36Å; F214-V322 HydrophobicContact CB-CB 4.24Å; F214-V322 HydrophobicContact CB-CG1 4.14Å; F214-V322 HydrophobicContact CB-CG2 4.12Å; F214-V322 HydrophobicContact CD2-CB 4.11Å; F214-V322 HydrophobicContact CD2-CG1 4.41Å; L318-V322 HydrophobicContact CB-CG2 4.02Å; L318-V322 HydrophobicContact CD2-CG2 4.25Å; L318-V322 VanDerWaalsContact O-CB 3.3Å; L318-V322 WeakPolarHBondContact O-CB 3.29Å; L318-V322 VanDerWaalsContact O-CG2 3.31Å; L318-V322 WeakPolarHBondContact O-CG2 3.11Å; L318-V322 PolarHBondContact O-N 2.95Å; V322-A324 VanDerWaalsContact C-N 3.29Å; V322-A324 PolarHBondContact O-N 2.91Å; V322-C325 PolarHBondContact O-N 3.27Å; V322-L326 HydrophobicContact CG1-CD1 3.75Å; V322-L326 HydrophobicContact CG1-CG 4.37Å; V322-L326 WeakPolarHBondContact O-CB 3.25Å; V322-L326 WeakPolarHBondContact O-CG 3.35Å; V322-L326 PolarHBondContact O-N 3.35Å
323	P	96.2	Very high	92.4	Very high	73 Å²	73	29.6 Å²	29.6	47%	0.474	18%	0.175	S	C	.	.	H	α-helix	trans	-60.1	-38.7	177.6	-24.4	35.3	0	0	0	113	F214 L319 G327	F214-P323 HydrophobicContact CE2-CG 4.3Å; L319-P323 VanDerWaalsContact O-CD 3.24Å; L319-P323 WeakPolarHBondContact O-CD 3.26Å; L319-P323 WeakPolarHBondContact O-CG 3.42Å; P323-G327 VanDerWaalsContact O-CA 3.32Å; P323-G327 WeakPolarHBondContact O-CA 3.24Å; P323-G327 PolarHBondContact O-N 3.07Å
324	A	96.8	Very high	93.4	Very high	28 Å²	28	32.8 Å²	32.8	23%	0.231	19%	0.193	C	C	.	.	H	α-helix	trans	-70.7	-51.6	179.9	0	0	0	0	0	112	A296 A300 Y320 L321 V322 L326 G327 A328	A296-A324 HydrophobicContact CB-CB 4.17Å; A296-A324 WeakPolarHBondContact CB-O 3.34Å; A300-A324 HydrophobicContact CB-CB 3.79Å; Y320-A324 WeakPolarHBondContact O-CB 3.41Å; L321-A324 PolarHBondContact O-N 2.86Å; V322-A324 VanDerWaalsContact C-N 3.29Å; V322-A324 PolarHBondContact O-N 2.91Å; A324-L326 VanDerWaalsContact C-N 3.34Å; A324-L326 PolarHBondContact O-N 3.42Å; A324-G327 PolarHBondContact O-N 3.46Å; A324-A328 PolarHBondContact O-N 3.35Å
325	C	96.9	Very high	94.3	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-66.1	-32.8	-177.3	-70.3	0	0	0	0	112.7	F270 L321 V322 P329	F270-C325 VanDerWaalsContact CE1-O 3.32Å; F270-C325 WeakPolarHBondContact CE1-O 3.38Å; L321-C325 WeakPolarHBondContact O-CB 3.35Å; L321-C325 PolarHBondContact O-N 3.49Å; L321-C325 PolarHBondContact O-SG 2.98Å; V322-C325 PolarHBondContact O-N 3.27Å; C325-P329 WeakPolarHBondContact O-CD 3.33Å; C325-P329 VanDerWaalsContact O-CG 3.22Å; C325-P329 WeakPolarHBondContact O-CG 3.23Å
326	L	97.2	Very high	94.8	Very high	16 Å²	16	38.9 Å²	38.9	8%	0.084	22%	0.222	C	C	.	.	H	α-helix	trans	-81.1	-45.4	172.9	-68.5	179.5	0	0	0	111.7	I207 L210 F270 V322 A324 L330	I207-L326 HydrophobicContact CG1-CD2 4Å; L210-L326 HydrophobicContact CB-CD1 4.25Å; L210-L326 HydrophobicContact CB-CG 4.48Å; L210-L326 HydrophobicContact CD1-CD2 3.64Å; L210-L326 HydrophobicContact CD1-CG 3.96Å; F270-L326 HydrophobicContact CE1-CD2 4.07Å; F270-L326 HydrophobicContact CE2-CD2 3.91Å; F270-L326 HydrophobicContact CZ-CD2 3.57Å; V322-L326 HydrophobicContact CG1-CD1 3.75Å; V322-L326 HydrophobicContact CG1-CG 4.37Å; V322-L326 WeakPolarHBondContact O-CB 3.25Å; V322-L326 WeakPolarHBondContact O-CG 3.35Å; V322-L326 PolarHBondContact O-N 3.35Å; A324-L326 VanDerWaalsContact C-N 3.34Å; A324-L326 PolarHBondContact O-N 3.42Å; L326-L330 HydrophobicContact CB-CD1 4.5Å; L326-L330 VanDerWaalsContact O-CB 3.27Å; L326-L330 WeakPolarHBondContact O-CB 3.45Å; L326-L330 WeakPolarHBondContact O-CD1 3.35Å; L326-L330 VanDerWaalsContact O-CG 3.25Å; L326-L330 WeakPolarHBondContact O-CG 3.47Å; L326-L330 PolarHBondContact O-N 2.86Å
327	G	96.7	Very high	95	Very high	33 Å²	33	45.6 Å²	45.6	34%	0.34	26%	0.258	S	S	.	.	H	α-helix	trans	-66.1	-44.1	-171.4	0	0	0	0	0	113.7	P323 A324 L330 L331	P323-G327 VanDerWaalsContact O-CA 3.32Å; P323-G327 WeakPolarHBondContact O-CA 3.24Å; P323-G327 PolarHBondContact O-N 3.07Å; A324-G327 PolarHBondContact O-N 3.46Å; G327-L330 PolarHBondContact O-N 3.35Å; G327-L331 VanDerWaalsContact O-CB 3.24Å; G327-L331 WeakPolarHBondContact O-CB 3.45Å; G327-L331 PolarHBondContact O-N 3.47Å
328	A	96.9	Very high	95.3	Very high	33 Å²	33	45.8 Å²	45.8	27%	0.273	26%	0.258	S	S	.	.	H	α-helix	trans	-66.4	-49	-176	0	0	0	0	0	113.1	S292 A296 A324 L330 L331 M332	S292-A328 VanDerWaalsContact OG-C 3.3Å; S292-A328 PolarHBondContact OG-O 3.46Å; A296-A328 HydrophobicContact CB-CB 3.76Å; A324-A328 PolarHBondContact O-N 3.35Å; A328-L330 PolarHBondContact O-N 3.26Å; A328-L331 PolarHBondContact O-N 3.11Å; A328-M332 WeakPolarHBondContact O-CB 3.45Å; A328-M332 PolarHBondContact O-N 3Å
329	P	96.2	Very high	95.4	Very high	0 Å²	0	48 Å²	48	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-63.9	-37.8	175.1	-22.9	35.5	0	0	0	113.2	L274 Y289 C325 M332 A333 M342	L274-P329 HydrophobicContact CD1-CB 3.94Å; L274-P329 HydrophobicContact CD1-CG 3.48Å; L274-P329 VanDerWaalsContact CD1-CG 3.48Å; L274-P329 HydrophobicContact CD2-CB 4.06Å; L274-P329 HydrophobicContact CD2-CG 4.48Å; Y289-P329 HydrophobicContact CD1-CB 4.41Å; C325-P329 WeakPolarHBondContact O-CD 3.33Å; C325-P329 VanDerWaalsContact O-CG 3.22Å; C325-P329 WeakPolarHBondContact O-CG 3.23Å; P329-M332 PolarHBondContact O-N 3.48Å; P329-A333 WeakPolarHBondContact O-CB 3.44Å; P329-A333 PolarHBondContact O-N 3.19Å; P329-M342 HydrophobicContact CB-CE 4.44Å
330	L	97.1	Very high	95.5	Very high	48 Å²	48	50.3 Å²	50.3	25%	0.251	29%	0.29	S	S	.	.	H	α-helix	trans	-64	-44.9	175.7	-81.6	171.5	0	0	0	112.1	F203 L326 G327 A328 M332 A333 L334 L339 M342 F343	F203-L330 HydrophobicContact CE1-CD2 3.71Å; F203-L330 HydrophobicContact CE1-CG 4.27Å; F203-L330 HydrophobicContact CZ-CD2 3.85Å; F203-L330 HydrophobicContact CZ-CG 3.99Å; L326-L330 HydrophobicContact CB-CD1 4.5Å; L326-L330 VanDerWaalsContact O-CB 3.27Å; L326-L330 WeakPolarHBondContact O-CB 3.45Å; L326-L330 WeakPolarHBondContact O-CD1 3.35Å; L326-L330 VanDerWaalsContact O-CG 3.25Å; L326-L330 WeakPolarHBondContact O-CG 3.47Å; L326-L330 PolarHBondContact O-N 2.86Å; G327-L330 PolarHBondContact O-N 3.35Å; A328-L330 PolarHBondContact O-N 3.26Å; L330-M332 VanDerWaalsContact C-N 3.33Å; L330-A333 PolarHBondContact O-N 3.42Å; L330-L334 WeakPolarHBondContact O-CB 3.37Å; L330-L334 PolarHBondContact O-N 3.43Å; L330-L339 HydrophobicContact CD2-CD2 4Å; L330-M342 HydrophobicContact CD2-SD 4.29Å; L330-F343 HydrophobicContact CD2-CE2 3.9Å; L330-F343 HydrophobicContact CD2-CZ 4.13Å
331	L	96.5	Very high	95.4	Very high	111 Å²	111	49.4 Å²	49.4	58%	0.581	29%	0.294	S	S	*	.	H	α-helix	trans	-63	-42.7	176.2	-176.2	147.8	0	0	0	110.7	G327 A328 A333 L334 V335	G327-L331 VanDerWaalsContact O-CB 3.24Å; G327-L331 WeakPolarHBondContact O-CB 3.45Å; G327-L331 PolarHBondContact O-N 3.47Å; A328-L331 PolarHBondContact O-N 3.11Å; L331-A333 VanDerWaalsContact C-N 3.33Å; L331-A333 PolarHBondContact O-N 2.81Å; L331-L334 WeakPolarHBondContact O-CB 3.38Å; L331-L334 PolarHBondContact O-N 3.35Å; L331-V335 HydrophobicContact CD2-CG2 4.17Å; L331-V335 WeakPolarHBondContact O-CG2 3.39Å; L331-V335 PolarHBondContact O-N 2.88Å
332	M	94.6	Very high	95.4	Very high	59 Å²	59	49.4 Å²	49.4	29%	0.291	29%	0.294	S	S	.	.	H	α-helix	trans	-63.2	-39.5	174.8	-176.4	134.2	-70.7	0	0	111.8	A288 Y289 A328 P329 L330 L334 V335 K336	A288-M332 HydrophobicContact CB-SD 4.43Å; Y289-M332 HydrophobicContact CD1-CG 4.45Å; Y289-M332 HydrophobicContact CE1-CB 4.22Å; Y289-M332 HydrophobicContact CE1-CG 4Å; A328-M332 WeakPolarHBondContact O-CB 3.45Å; A328-M332 PolarHBondContact O-N 3Å; P329-M332 PolarHBondContact O-N 3.48Å; L330-M332 VanDerWaalsContact C-N 3.33Å; M332-L334 VanDerWaalsContact C-N 3.35Å; M332-V335 PolarHBondContact O-N 3.04Å; M332-K336 HydrophobicContact CG-CD 4.01Å; M332-K336 HydrophobicContact CG-CG 4.5Å; M332-K336 WeakPolarHBondContact O-CB 3.41Å; M332-K336 WeakPolarHBondContact O-CG 3.2Å; M332-K336 PolarHBondContact O-N 3.49Å
333	A	95.1	Very high	95.3	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-66.3	-36.5	175.6	0	0	0	0	0	112.1	Y289 P329 L330 L331 N337 D338 L339 M342	Y289-A333 HydrophobicContact CE1-CB 3.91Å; P329-A333 WeakPolarHBondContact O-CB 3.44Å; P329-A333 PolarHBondContact O-N 3.19Å; L330-A333 PolarHBondContact O-N 3.42Å; L331-A333 VanDerWaalsContact C-N 3.33Å; L331-A333 PolarHBondContact O-N 2.81Å; A333-N337 CarbonylContact O-C 3.56Å; A333-N337 WeakPolarHBondContact O-CA 3.38Å; A333-N337 PolarHBondContact O-N 3.31Å; A333-D338 HydrophobicContact CB-CB 4.49Å; A333-D338 PolarHBondContact O-N 3.11Å; A333-L339 HydrophobicContact CB-CD2 3.69Å; A333-L339 HydrophobicContact CB-CG 4.13Å; A333-L339 PolarHBondContact O-N 2.84Å; A333-M342 HydrophobicContact CB-CE 3.7Å; A333-M342 HydrophobicContact CB-SD 3.82Å
334	L	95.8	Very high	95.2	Very high	106 Å²	106	54.6 Å²	54.6	56%	0.555	32%	0.319	S	S	*	.	H	α-helix	trans	-64.7	-48.6	173.8	-179.2	65.6	0	0	0	111	L330 L331 M332 K336 N337 L339	L330-L334 WeakPolarHBondContact O-CB 3.37Å; L330-L334 PolarHBondContact O-N 3.43Å; L331-L334 WeakPolarHBondContact O-CB 3.38Å; L331-L334 PolarHBondContact O-N 3.35Å; M332-L334 VanDerWaalsContact C-N 3.35Å; L334-K336 VanDerWaalsContact C-N 3.29Å; L334-K336 PolarHBondContact O-N 2.86Å; L334-N337 PolarHBondContact O-N 3.25Å; L334-L339 HydrophobicContact CB-CD1 3.9Å; L334-L339 HydrophobicContact CB-CG 4.33Å; L334-L339 HydrophobicContact CD1-CD1 3.46Å; L334-L339 VanDerWaalsContact CD1-CD1 3.46Å; L334-L339 HydrophobicContact CG-CD1 4.27Å
335	V	95.4	Very high	95	Very high	104 Å²	104	53.8 Å²	53.8	63%	0.63	31%	0.311	S	S	*	.	H	α-helix	trans	-63.1	-35.7	179.7	171.8	0	0	0	0	111.9	L331 M332	L331-V335 HydrophobicContact CD2-CG2 4.17Å; L331-V335 WeakPolarHBondContact O-CG2 3.39Å; L331-V335 PolarHBondContact O-N 2.88Å; M332-V335 PolarHBondContact O-N 3.04Å
336	K	92.4	Very high	94.6	Very high	83 Å²	83	57 Å²	57	36%	0.361	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	0.2	179.2	-65	-178.5	175.3	178.9	0	114.3	A288 M332 L334 D338	A288-K336 VanDerWaalsContact CB-NZ 3.28Å; M332-K336 HydrophobicContact CG-CD 4.01Å; M332-K336 HydrophobicContact CG-CG 4.5Å; M332-K336 WeakPolarHBondContact O-CB 3.41Å; M332-K336 WeakPolarHBondContact O-CG 3.2Å; M332-K336 PolarHBondContact O-N 3.49Å; L334-K336 VanDerWaalsContact C-N 3.29Å; L334-K336 PolarHBondContact O-N 2.86Å; K336-D338 WeakPolarHBondContact CB-OD2 3.32Å; K336-D338 PolarHBondContact O-N 3.38Å
337	N	92.6	Very high	93.8	Very high	143 Å²	143	58 Å²	58	77%	0.765	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	31.1	-173.9	-66	-58.7	0	0	0	114.8	A333 L334	A333-N337 CarbonylContact O-C 3.56Å; A333-N337 WeakPolarHBondContact O-CA 3.38Å; A333-N337 PolarHBondContact O-N 3.31Å; L334-N337 PolarHBondContact O-N 3.25Å
338	D	93.3	Very high	92.7	Very high	11 Å²	11	58.4 Å²	58.4	6%	0.059	32%	0.324	C	S	.	.			trans	-98.7	6.8	179.4	-66.4	-53.4	0	0	0	113.6	R283 Y289 A333 K336 S340 A341 M342	R283-D338 IonicContact CZ-OD1 3.55Å; R283-D338 IonicContact CZ-OD2 2.76Å; R283-D338 IonicContact NH1-OD1 3.93Å; R283-D338 PolarHBondContact NH1-OD1 3.43Å; R283-D338 IonicContact NH1-OD2 3.07Å; R283-D338 PolarHBondContact NH1-OD2 3.01Å; R283-D338 IonicContact NH2-OD1 2.63Å; R283-D338 PolarHBondContact NH2-OD1 2.91Å; R283-D338 IonicContact NH2-OD2 3.07Å; Y289-D338 VanDerWaalsContact OH-CB 3.23Å; Y289-D338 WeakPolarHBondContact OH-CB 3.31Å; Y289-D338 PolarHBondContact OH-OD2 2.71Å; A333-D338 HydrophobicContact CB-CB 4.49Å; A333-D338 PolarHBondContact O-N 3.11Å; K336-D338 WeakPolarHBondContact CB-OD2 3.32Å; K336-D338 PolarHBondContact O-N 3.38Å; D338-S340 VanDerWaalsContact C-N 3.31Å; D338-S340 PolarHBondContact O-N 3.17Å; D338-A341 PolarHBondContact O-N 3.33Å; D338-A341 VanDerWaalsContact O-N 3.08Å; D338-M342 WeakPolarHBondContact O-CB 3.34Å; D338-M342 PolarHBondContact O-N 2.88Å
339	L	94.3	Very high	90.8	Very high	53 Å²	53	62 Å²	62	28%	0.277	35%	0.345	S	S	.	.	H	α-helix	trans	-54.4	-47.8	-179.5	-75.6	174	0	0	0	111.8	L330 A333 L334 A341 M342 F343	L330-L339 HydrophobicContact CD2-CD2 4Å; A333-L339 HydrophobicContact CB-CD2 3.69Å; A333-L339 HydrophobicContact CB-CG 4.13Å; A333-L339 PolarHBondContact O-N 2.84Å; L334-L339 HydrophobicContact CB-CD1 3.9Å; L334-L339 HydrophobicContact CB-CG 4.33Å; L334-L339 HydrophobicContact CD1-CD1 3.46Å; L334-L339 VanDerWaalsContact CD1-CD1 3.46Å; L334-L339 HydrophobicContact CG-CD1 4.27Å; L339-A341 VanDerWaalsContact C-N 3.28Å; L339-A341 PolarHBondContact O-N 3.31Å; L339-M342 PolarHBondContact O-N 3.34Å; L339-F343 HydrophobicContact CD2-CE2 4.26Å; L339-F343 VanDerWaalsContact O-CD2 3.31Å; L339-F343 WeakPolarHBondContact O-CD2 3.4Å; L339-F343 PolarHBondContact O-N 2.91Å
340	S	94	Very high	88.8	Confident	97 Å²	97	65.1 Å²	65.1	68%	0.678	36%	0.359	S	S	*	.	H	α-helix	trans	-59.3	-42.3	178.7	-170.8	0	0	0	0	111.6	D338 S344	D338-S340 VanDerWaalsContact C-N 3.31Å; D338-S340 PolarHBondContact O-N 3.17Å; S340-S344 VanDerWaalsContact O-CB 3.3Å; S340-S344 WeakPolarHBondContact O-CB 3.45Å; S340-S344 PolarHBondContact O-N 2.91Å; S340-S344 PolarHBondContact O-OG 3.41Å
341	A	93.4	Very high	86.6	Confident	34 Å²	34	66.7 Å²	66.7	28%	0.281	37%	0.371	S	S	.	.	H	α-helix	trans	-68.5	-35.4	179.6	0	0	0	0	0	112.5	F277 D338 L339 S344 Y345	F277-A341 HydrophobicContact CZ-CB 4.5Å; D338-A341 PolarHBondContact O-N 3.33Å; D338-A341 VanDerWaalsContact O-N 3.08Å; L339-A341 VanDerWaalsContact C-N 3.28Å; L339-A341 PolarHBondContact O-N 3.31Å; A341-S344 PolarHBondContact O-OG 3.34Å; A341-Y345 PolarHBondContact O-N 3.44Å; A341-Y345 VanDerWaalsContact O-N 3.15Å
342	M	95.2	Very high	84.1	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.005	38%	0.377	C	S	.	.	H	α-helix	trans	-68.8	-43	176.7	-179.5	176.5	-81	0	0	111.5	F203 L274 F277 Y289 P329 L330 A333 D338 L339 Y345	F203-M342 HydrophobicContact CB-CG 4.27Å; F203-M342 VanDerWaalsContact CB-O 3.23Å; F203-M342 WeakPolarHBondContact CB-O 3.14Å; F203-M342 HydrophobicContact CD1-CG 3.92Å; F203-M342 HydrophobicContact CD1-SD 4.3Å; F203-M342 HydrophobicContact CD2-CG 3.59Å; F203-M342 HydrophobicContact CD2-SD 3.93Å; F203-M342 HydrophobicContact CE1-CG 4.12Å; F203-M342 HydrophobicContact CE1-SD 3.88Å; F203-M342 HydrophobicContact CE2-CE 4.34Å; F203-M342 HydrophobicContact CE2-CG 3.83Å; F203-M342 HydrophobicContact CE2-SD 3.48Å; F203-M342 WeakPolarHBondContact CE2-SD 3.49Å; F203-M342 HydrophobicContact CG-CG 3.66Å; F203-M342 HydrophobicContact CG-SD 4.33Å; F203-M342 HydrophobicContact CZ-CG 4.1Å; F203-M342 HydrophobicContact CZ-SD 3.47Å; F203-M342 WeakPolarHBondContact CZ-SD 3.47Å; L274-M342 HydrophobicContact CD2-CE 4.43Å; F277-M342 HydrophobicContact CD1-CE 4.18Å; F277-M342 HydrophobicContact CE1-CB 4.23Å; F277-M342 HydrophobicContact CE1-CE 3.79Å; F277-M342 HydrophobicContact CE2-CB 4.44Å; F277-M342 HydrophobicContact CZ-CB 3.88Å; Y289-M342 HydrophobicContact CD1-CE 3.5Å; Y289-M342 VanDerWaalsContact CD1-CE 3.5Å; Y289-M342 HydrophobicContact CE1-CE 3.56Å; Y289-M342 HydrophobicContact CG-CE 4.2Å; P329-M342 HydrophobicContact CB-CE 4.44Å; L330-M342 HydrophobicContact CD2-SD 4.29Å; A333-M342 HydrophobicContact CB-CE 3.7Å; A333-M342 HydrophobicContact CB-SD 3.82Å; D338-M342 WeakPolarHBondContact O-CB 3.34Å; D338-M342 PolarHBondContact O-N 2.88Å; L339-M342 PolarHBondContact O-N 3.34Å; M342-Y345 WeakPolarHBondContact O-CB 3.4Å; M342-Y345 PolarHBondContact O-N 3.44Å
343	F	95.6	Very high	81.8	Confident	98 Å²	98	71 Å²	71	43%	0.43	39%	0.386	S	S	.	.	H	α-helix	trans	-76.2	-26.2	178.3	-82.1	-86.9	0	0	0	113.4	F203 V204 I207 L330 L339 Y345	F203-F343 HydrophobicContact CD1-CD1 4.32Å; F203-F343 HydrophobicContact CD1-CE1 4.09Å; F203-F343 HydrophobicContact CD1-CE2 4.39Å; F203-F343 HydrophobicContact CD1-CZ 4.13Å; F203-F343 HydrophobicContact CE1-CE1 4.37Å; F203-F343 HydrophobicContact CE1-CE2 4.25Å; F203-F343 AromaticContact CE1-CZ 3.99Å; F203-F343 HydrophobicContact CE1-CZ 3.99Å; V204-F343 HydrophobicContact CG2-CD1 3.95Å; V204-F343 HydrophobicContact CG2-CE1 4.31Å; I207-F343 HydrophobicContact CD1-CE1 3.87Å; I207-F343 HydrophobicContact CD1-CZ 4.03Å; L330-F343 HydrophobicContact CD2-CE2 3.9Å; L330-F343 HydrophobicContact CD2-CZ 4.13Å; L339-F343 HydrophobicContact CD2-CE2 4.26Å; L339-F343 VanDerWaalsContact O-CD2 3.31Å; L339-F343 WeakPolarHBondContact O-CD2 3.4Å; L339-F343 PolarHBondContact O-N 2.91Å; F343-Y345 VanDerWaalsContact C-N 3.28Å
344	S	93.3	Very high	79.7	Confident	88 Å²	88	73.2 Å²	73.2	62%	0.615	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	7.7	171	74.1	0	0	0	0	113.3	S340 A341	S340-S344 VanDerWaalsContact O-CB 3.3Å; S340-S344 WeakPolarHBondContact O-CB 3.45Å; S340-S344 PolarHBondContact O-N 2.91Å; S340-S344 PolarHBondContact O-OG 3.41Å; A341-S344 PolarHBondContact O-OG 3.34Å
345	Y	91.9	Very high	77.3	Confident	12 Å²	12	70.4 Å²	70.4	5%	0.047	39%	0.385	C	S	.	.			trans	-69.7	136.3	-180	179.8	-103	0	0	0	111.2	M273 R276 F277 K280 A341 M342 F343 D347	M273-Y345 HydrophobicContact CG-CE1 4.18Å; R276-Y345 WeakPolarHBondContact CB-OH 3.41Å; F277-Y345 HydrophobicContact CB-CD2 4.33Å; F277-Y345 HydrophobicContact CB-CE2 4.08Å; F277-Y345 AromaticContact CD2-CD2 3.41Å; F277-Y345 HydrophobicContact CD2-CD2 3.41Å; F277-Y345 VanDerWaalsContact CD2-CD2 3.41Å; F277-Y345 AromaticContact CD2-CE2 3.88Å; F277-Y345 HydrophobicContact CD2-CE2 3.88Å; F277-Y345 AromaticContact CD2-CG 3.84Å; F277-Y345 HydrophobicContact CD2-CG 3.84Å; F277-Y345 HydrophobicContact CE2-CD2 4.17Å; F277-Y345 HydrophobicContact CG-CD2 4.33Å; F277-Y345 PolarHBondContact N-OH 2.9Å; K280-Y345 HydrophobicContact CB-CE2 3.88Å; K280-Y345 HydrophobicContact CD-CD2 3.7Å; K280-Y345 HydrophobicContact CD-CE2 3.33Å; K280-Y345 HydrophobicContact CG-CE2 4.21Å; A341-Y345 PolarHBondContact O-N 3.44Å; A341-Y345 VanDerWaalsContact O-N 3.15Å; M342-Y345 WeakPolarHBondContact O-CB 3.4Å; M342-Y345 PolarHBondContact O-N 3.44Å; F343-Y345 VanDerWaalsContact C-N 3.28Å; Y345-D347 HydrophobicContact CE1-CB 3.8Å; Y345-D347 PolarHBondContact OH-OD1 3.19Å
346	E	89.6	Confident	74.8	Confident	68 Å²	68	71 Å²	71	32%	0.318	38%	0.381	S	S	.	.	B	Isolated β-bridge	trans	-138.1	127.3	172.7	-167.9	164.7	-149.1	0	0	107.9	N201 K202 K280	N201-E346 WeakPolarHBondContact O-CA 2.99Å; N201-E346 VanDerWaalsContact OD1-CG 3.25Å; N201-E346 WeakPolarHBondContact OD1-CG 3.31Å; K202-E346 WeakPolarHBondContact CE-OE1 3.32Å; K202-E346 IonicContact NZ-OE1 2.63Å; K280-E346 PolarHBondContact NZ-O 2.82Å
347	D	80.7	Confident	72.9	Confident	36 Å²	36	74 Å²	74	19%	0.193	40%	0.396	C	S	.	.	S	Bend	trans	-82.1	-50.1	-172	-156.5	21.9	0	0	0	110.8	N201 R276 Y345	N201-D347 PolarHBondContact O-N 3.2Å; N201-D347 PolarHBondContact OD1-N 3.09Å; R276-D347 WeakPolarHBondContact CD-OD2 3.35Å; R276-D347 IonicContact CZ-OD2 3.57Å; R276-D347 IonicContact NE-OD1 2.66Å; R276-D347 IonicContact NE-OD2 3.21Å; R276-D347 PolarHBondContact NE-OD2 3.33Å; R276-D347 IonicContact NH2-OD2 3.36Å; R276-D347 PolarHBondContact NH2-OD2 2.93Å; Y345-D347 HydrophobicContact CE1-CB 3.8Å; Y345-D347 PolarHBondContact OH-OD1 3.19Å
348	E	72.7	Confident	71	Confident	42 Å²	42	68.6 Å²	68.6	20%	0.196	37%	0.372	C	S	.	.	S	Bend	trans	-135.9	140.5	175	-67.8	-177.3	-179.6	0	0	108.2	R199 N201 E350	R199-E348 IonicContact CZ-OE1 2.73Å; R199-E348 IonicContact NH1-OE1 3.62Å; R199-E348 PolarHBondContact NH1-OE1 3.34Å; N201-E348 PolarHBondContact ND2-O 3.38Å; N201-E348 PolarHBondContact OD1-N 3.47Å; N201-E348 PolarHBondContact OD1-O 3.43Å; E348-E350 PolarHBondContact O-N 3.33Å
349	P	57.9	Low	68.8	Low	109 Å²	109	74.4 Å²	74.4	71%	0.708	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-59.9	128.4	172.2	25.8	-31.2	0	0	0	108.3	T351	P349-T351 PolarHBondContact O-N 2.93Å
350	E	53.6	Low	66.9	Low	65 Å²	65	76.9 Å²	76.9	30%	0.304	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-46.4	117.8	176	-63.8	176.7	-173.9	0	0	108.1	N201 K202 E348 E354	N201-E350 WeakPolarHBondContact ND2-CG 3.36Å; K202-E350 IonicContact NZ-OE1 3.53Å; K202-E350 PolarHBondContact NZ-OE1 3.44Å; E348-E350 PolarHBondContact O-N 3.33Å; E350-E354 HydrophobicContact CB-CB 4.2Å
351	T	51.5	Low	64.8	Low	81 Å²	81	73.9 Å²	73.9	50%	0.497	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-65.1	150.5	-179.1	-54.3	0	0	0	0	108.3	P349 K353 E354	P349-T351 PolarHBondContact O-N 2.93Å; T351-K353 PolarHBondContact O-N 2.96Å; T351-E354 PolarHBondContact O-N 3.19Å
352	E	42.7	Very low	62.9	Low	151 Å²	151	76.9 Å²	76.9	71%	0.706	41%	0.406	S	S	*	.	H	α-helix	trans	-45.7	-29.3	-172.1	-70.6	-179.7	174.4	0	0	115	S355 Q356	E352-S355 VanDerWaalsContact C-OG 3.27Å; E352-S355 WeakPolarHBondContact CA-OG 3.2Å; E352-S355 PolarHBondContact O-N 3.15Å; E352-S355 PolarHBondContact O-OG 2.61Å; E352-Q356 VanDerWaalsContact O-CG 3.32Å; E352-Q356 WeakPolarHBondContact O-CG 3.47Å; E352-Q356 PolarHBondContact O-N 3.48Å
353	K	47.3	Very low	60.8	Low	110 Å²	110	82 Å²	82	48%	0.478	43%	0.433	S	S	.	.	H	α-helix	trans	-58.4	-44.1	173.3	-71.1	-178.2	179.9	171.3	0	114.1	D150 T351 Q356 E357	D150-K353 IonicContact OD1-NZ 3.81Å; D150-K353 PolarHBondContact OD1-NZ 3.01Å; D150-K353 IonicContact OD2-NZ 2.9Å; D150-K353 PolarHBondContact OD2-NZ 3.03Å; T351-K353 PolarHBondContact O-N 2.96Å; K353-Q356 PolarHBondContact O-N 3.26Å; K353-E357 PolarHBondContact O-N 3.48Å
354	E	49.9	Very low	58.7	Low	46 Å²	46	80.2 Å²	80.2	22%	0.215	43%	0.433	C	S	.	.	H	α-helix	trans	-72.3	-37.3	180	-76.9	-177.2	-162.5	0	0	111.6	E350 T351 Q356 E357 A358	E350-E354 HydrophobicContact CB-CB 4.2Å; T351-E354 PolarHBondContact O-N 3.19Å; E354-Q356 VanDerWaalsContact C-N 3.31Å; E354-Q356 PolarHBondContact O-N 2.83Å; E354-E357 PolarHBondContact O-N 2.69Å; E354-A358 VanDerWaalsContact O-CB 3.23Å; E354-A358 WeakPolarHBondContact O-CB 3.33Å; E354-A358 PolarHBondContact O-N 3.03Å
355	S	47	Very low	56.7	Low	46 Å²	46	83.9 Å²	83.9	32%	0.322	44%	0.438	S	S	.	.	H	α-helix	trans	-62.7	-37.9	171.5	34.8	0	0	0	0	111.8	E352 A358 E359	E352-S355 VanDerWaalsContact C-OG 3.27Å; E352-S355 WeakPolarHBondContact CA-OG 3.2Å; E352-S355 PolarHBondContact O-N 3.15Å; E352-S355 PolarHBondContact O-OG 2.61Å; S355-A358 PolarHBondContact O-N 3.13Å; S355-E359 WeakPolarHBondContact O-CB 3.26Å; S355-E359 WeakPolarHBondContact O-CG 3.47Å; S355-E359 PolarHBondContact O-N 2.69Å
356	Q	42.3	Very low	54.8	Low	118 Å²	118	91.5 Å²	91.5	55%	0.551	47%	0.471	S	S	*	.	H	α-helix	trans	-67.2	-43.8	175.2	-74.5	176.6	10.1	0	0	112.3	E352 K353 E354 A358 E359 V360	E352-Q356 VanDerWaalsContact O-CG 3.32Å; E352-Q356 WeakPolarHBondContact O-CG 3.47Å; E352-Q356 PolarHBondContact O-N 3.48Å; K353-Q356 PolarHBondContact O-N 3.26Å; E354-Q356 VanDerWaalsContact C-N 3.31Å; E354-Q356 PolarHBondContact O-N 2.83Å; Q356-A358 VanDerWaalsContact C-N 3.34Å; Q356-A358 PolarHBondContact O-N 3.48Å; Q356-E359 PolarHBondContact O-N 2.88Å; Q356-V360 VanDerWaalsContact O-CG2 3.25Å; Q356-V360 WeakPolarHBondContact O-CG2 3.32Å; Q356-V360 PolarHBondContact O-N 2.9Å
357	E	52.2	Low	52.9	Low	145 Å²	145	93.1 Å²	93.1	68%	0.678	49%	0.49	S	S	*	.	H	α-helix	trans	-66.6	-35.7	175	-71.8	-174.4	178.9	0	0	112.4	K353 E354 S361	K353-E357 PolarHBondContact O-N 3.48Å; E354-E357 PolarHBondContact O-N 2.69Å; E357-S361 VanDerWaalsContact O-CB 3.3Å; E357-S361 WeakPolarHBondContact O-CB 3.13Å; E357-S361 PolarHBondContact O-N 3.37Å; E357-S361 PolarHBondContact O-OG 2.97Å
358	A	52.1	Low	51.1	Low	30 Å²	30	103 Å²	103	25%	0.248	53%	0.531	C	S	.	.	H	α-helix	trans	-65	-42.8	172.3	0	0	0	0	0	112	E354 S355 Q356 S361 N362	E354-A358 VanDerWaalsContact O-CB 3.23Å; E354-A358 WeakPolarHBondContact O-CB 3.33Å; E354-A358 PolarHBondContact O-N 3.03Å; S355-A358 PolarHBondContact O-N 3.13Å; Q356-A358 VanDerWaalsContact C-N 3.34Å; Q356-A358 PolarHBondContact O-N 3.48Å; A358-S361 PolarHBondContact O-N 2.94Å; A358-S361 PolarHBondContact O-OG 3.07Å; A358-N362 WeakPolarHBondContact O-CB 3.24Å; A358-N362 PolarHBondContact O-N 2.91Å
359	E	47.9	Very low	50	Low	132 Å²	132	106.1 Å²	106.1	62%	0.617	55%	0.548	S	S	*	.	H	α-helix	trans	-64.4	-49	175.8	-80.4	-177.5	170	0	0	112.2	S355 Q356 S361 N362 D363	S355-E359 WeakPolarHBondContact O-CB 3.26Å; S355-E359 WeakPolarHBondContact O-CG 3.47Å; S355-E359 PolarHBondContact O-N 2.69Å; Q356-E359 PolarHBondContact O-N 2.88Å; E359-S361 PolarHBondContact O-N 2.89Å; E359-N362 PolarHBondContact O-N 3.34Å; E359-D363 PolarHBondContact O-N 2.95Å
360	V	54.3	Low	49.6	Very low	106 Å²	106	105.9 Å²	105.9	64%	0.642	54%	0.54	S	S	*	.	H	α-helix	trans	-59	-37.8	176.8	174	0	0	0	0	111.3	Q356 S364	Q356-V360 VanDerWaalsContact O-CG2 3.25Å; Q356-V360 WeakPolarHBondContact O-CG2 3.32Å; Q356-V360 PolarHBondContact O-N 2.9Å; V360-S364 WeakPolarHBondContact O-CB 3.49Å; V360-S364 PolarHBondContact O-N 3.45Å; V360-S364 PolarHBondContact O-OG 3.29Å
361	S	49.9	Very low	49.4	Very low	33 Å²	33	108.2 Å²	108.2	23%	0.231	55%	0.553	C	S	.	*	H	α-helix	trans	-71.4	-27.6	175.7	76.8	0	0	0	0	114.2	K63 E357 A358 E359 S364	K63-S361 PolarHBondContact NZ-OG 3.25Å; E357-S361 VanDerWaalsContact O-CB 3.3Å; E357-S361 WeakPolarHBondContact O-CB 3.13Å; E357-S361 PolarHBondContact O-N 3.37Å; E357-S361 PolarHBondContact O-OG 2.97Å; A358-S361 PolarHBondContact O-N 2.94Å; A358-S361 PolarHBondContact O-OG 3.07Å; E359-S361 PolarHBondContact O-N 2.89Å; S361-S364 WeakPolarHBondContact CA-OG 3.36Å; S361-S364 PolarHBondContact O-OG 3.11Å; S361-S364 VanDerWaalsContact O-OG 3.11Å
362	N	53	Low	49.2	Very low	98 Å²	98	109.8 Å²	109.8	52%	0.524	56%	0.556	S	S	.	*	H	α-helix	trans	-81.2	-35.9	176.4	-84.7	-20	0	0	0	111.5	A358 E359 K365 K366	A358-N362 WeakPolarHBondContact O-CB 3.24Å; A358-N362 PolarHBondContact O-N 2.91Å; E359-N362 PolarHBondContact O-N 3.34Å; N362-K365 PolarHBondContact O-N 3.08Å; N362-K366 PolarHBondContact O-N 2.72Å; N362-K366 VanDerWaalsContact O-N 3.16Å
363	D	51.5	Low	49.7	Very low	107 Å²	107	107.2 Å²	107.2	57%	0.572	55%	0.547	S	S	*	.	H	α-helix	trans	-70.7	-36.9	175.1	-99	-4.4	0	0	0	112.5	E359 K365 K366 S367	E359-D363 PolarHBondContact O-N 2.95Å; D363-K365 PolarHBondContact O-N 2.95Å; D363-K366 PolarHBondContact O-N 3.04Å; D363-K366 VanDerWaalsContact O-N 3.1Å; D363-S367 PolarHBondContact O-N 3.46Å; D363-S367 PolarHBondContact O-OG 3.01Å
364	S	52.4	Low	49.8	Very low	62 Å²	62	107 Å²	107	43%	0.434	55%	0.551	S	S	.	*	H	α-helix	trans	-66.6	-19.4	172	50.7	0	0	0	0	113.9	V360 S361	V360-S364 WeakPolarHBondContact O-CB 3.49Å; V360-S364 PolarHBondContact O-N 3.45Å; V360-S364 PolarHBondContact O-OG 3.29Å; S361-S364 WeakPolarHBondContact CA-OG 3.36Å; S361-S364 PolarHBondContact O-OG 3.11Å; S361-S364 VanDerWaalsContact O-OG 3.11Å
365	K	50.1	Low	49.8	Very low	164 Å²	164	111.4 Å²	111.4	71%	0.713	58%	0.575	S	S	*	*	H	α-helix	trans	-86.7	-21.6	170	-81.5	-177.2	178.7	177.1	0	113.8	N362 D363	N362-K365 PolarHBondContact O-N 3.08Å; D363-K365 PolarHBondContact O-N 2.95Å
366	K	52.2	Low	50	Low	173 Å²	173	116.4 Å²	116.4	75%	0.752	60%	0.595	S	S	*	*	H	α-helix	trans	-86.8	-19.1	174.8	-79	-178.4	179.4	173.2	0	113.3	N362 D363	N362-K366 PolarHBondContact O-N 2.72Å; N362-K366 VanDerWaalsContact O-N 3.16Å; D363-K366 PolarHBondContact O-N 3.04Å; D363-K366 VanDerWaalsContact O-N 3.1Å
367	S	49.7	Very low	50.7	Low	102 Å²	102	116.3 Å²	116.3	71%	0.713	60%	0.598	S	S	*	*			trans	-93.6	8.2	178.3	66.2	0	0	0	0	114.9	D363	D363-S367 PolarHBondContact O-N 3.46Å; D363-S367 PolarHBondContact O-OG 3.01Å
368	K	42.9	Very low	50.5	Low	243 Å²	243	113.6 Å²	113.6	100%	1.057	59%	0.591	S	S	*	*			trans	-112.3	0	163.8	-75.6	-174.4	177.5	179.5	0	109.2

Retrieved 368 of 368 residues in 117.2 ms (Link to these results)

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