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Probable G-protein coupled receptor 173

Is a receptor for the SMIM20 derived peptides Phoenixin-14 and Phoenixin-20 (By similarity). It mediates the Phoenixin-14 and Phoenixin-20 augmentation of gonadotropin-releasing hormone (GNRH) signaling in the hypothalamus and pituitary gland (By similarity). In the ovary, it mediates the effects of Phoenixin-14 and Phoenixin-20 induced granulosa cell proliferation during follicular growth¹.

AlphaFold DB , UniProt , Accession Q9NS66, Species HUMAN (Homo sapiens, Human), Gene GPR173, Length 373 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.8	Very low	39.2	Very low	250 Å²	250	148.5 Å²	148.5	100%	1.232	85%	0.847	S	S	*	*				0	88.9	0	-70.5	173.7	-179.1	0	0	107.7
2	A	43.4	Very low	39.1	Very low	99 Å²	99	144.8 Å²	144.8	82%	0.818	84%	0.837	S	S	*	*			trans	-115	103.6	172.6	0	0	0	0	0	106.2
3	N	43.8	Very low	38.7	Very low	148 Å²	148	139.7 Å²	139.7	79%	0.791	84%	0.835	S	S	*	*			trans	-92.2	98.7	-175.3	-149	22.2	0	0	0	106.8
4	T	44.8	Very low	38.7	Very low	136 Å²	136	135.9 Å²	135.9	83%	0.834	83%	0.826	S	S	*	*			trans	-123.8	73.1	168.1	53.1	0	0	0	0	107.6	G6	T4-G6 PolarHBondContact O-N 2.98Å; T4-G6 VanDerWaalsContact O-N 3.17Å
5	T	46.8	Very low	39	Very low	114 Å²	114	136.6 Å²	136.6	70%	0.699	82%	0.822	S	S	*	*			trans	-64.4	103.5	158.5	44.6	0	0	0	0	106.9	E7	T5-E7 PolarHBondContact O-N 3.4Å
6	G	38.9	Very low	39.8	Very low	71 Å²	71	134.3 Å²	134.3	73%	0.732	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-59.8	116	164.4	0	0	0	0	0	108.1	T4	T4-G6 PolarHBondContact O-N 2.98Å; T4-G6 VanDerWaalsContact O-N 3.17Å
7	E	35.2	Very low	40.7	Very low	183 Å²	183	133.2 Å²	133.2	86%	0.855	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-63.3	126.5	161.9	-71.2	179.4	130.1	0	0	107	T5 E9	T5-E7 PolarHBondContact O-N 3.4Å; E7-E9 PolarHBondContact O-N 2.87Å
8	P	35.5	Very low	41.9	Very low	120 Å²	120	129.9 Å²	129.9	78%	0.779	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-65.8	124	174.8	26.3	-30.5	0	0	0	108.1	E10	P8-E10 PolarHBondContact O-N 3.42Å
9	E	33.4	Very low	43.9	Very low	187 Å²	187	127.1 Å²	127.1	87%	0.874	78%	0.778	S	S	*	*			trans	-46.2	116	164.7	-73.4	178.8	118.2	0	0	108.2	E7 V11	E7-E9 PolarHBondContact O-N 2.87Å; E9-V11 VanDerWaalsContact C-N 3.33Å; E9-V11 PolarHBondContact O-N 3.14Å
10	E	32.6	Very low	45.9	Very low	196 Å²	196	124.8 Å²	124.8	92%	0.916	77%	0.773	S	S	*	*			trans	-57.6	103.9	169.4	-101	-172	155.1	0	0	107.3	P8 S12	P8-E10 PolarHBondContact O-N 3.42Å; E10-S12 PolarHBondContact O-N 3.4Å; E10-S12 VanDerWaalsContact O-N 3.12Å
11	V	36.8	Very low	47.8	Very low	130 Å²	130	122.2 Å²	122.2	79%	0.788	76%	0.76	S	S	*	*			trans	-42.4	119.3	173.8	173.6	0	0	0	0	108.3	E9 G13	E9-V11 VanDerWaalsContact C-N 3.33Å; E9-V11 PolarHBondContact O-N 3.14Å; V11-G13 PolarHBondContact O-N 2.98Å; V11-G13 VanDerWaalsContact O-N 3.13Å
12	S	38.4	Very low	50.1	Low	104 Å²	104	111 Å²	111	73%	0.727	71%	0.707	S	S	*	*			trans	-24.8	114.3	169.1	-34.9	0	0	0	0	110.1	E10 A14	E10-S12 PolarHBondContact O-N 3.4Å; E10-S12 VanDerWaalsContact O-N 3.12Å; S12-A14 VanDerWaalsContact C-N 3.31Å; S12-A14 PolarHBondContact O-N 2.93Å
13	G	34.1	Very low	52.4	Low	78 Å²	78	113.3 Å²	113.3	80%	0.804	70%	0.696	S	S	*	*			trans	-49.4	96.9	-179	0	0	0	0	0	110.4	V11 L15	V11-G13 PolarHBondContact O-N 2.98Å; V11-G13 VanDerWaalsContact O-N 3.13Å; G13-L15 PolarHBondContact O-N 3.42Å
14	A	37.9	Very low	54.7	Low	87 Å²	87	110.7 Å²	110.7	72%	0.719	69%	0.685	S	S	*	*			trans	-57.2	113.9	168.1	0	0	0	0	0	104.8	S12 S16	S12-A14 VanDerWaalsContact C-N 3.31Å; S12-A14 PolarHBondContact O-N 2.93Å; A14-S16 VanDerWaalsContact C-N 3.25Å; A14-S16 PolarHBondContact O-N 3.16Å
15	L	44.1	Very low	57	Low	146 Å²	146	105.2 Å²	105.2	76%	0.764	65%	0.65	S	S	*	*			trans	-56.5	96.7	177.5	-171.2	72.3	0	0	0	106.5	G13	G13-L15 PolarHBondContact O-N 3.42Å
16	S	50.8	Low	59.2	Low	100 Å²	100	101.2 Å²	101.2	70%	0.699	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-52.7	129	176.4	-67.5	0	0	0	0	106.1	A14	A14-S16 VanDerWaalsContact C-N 3.25Å; A14-S16 PolarHBondContact O-N 3.16Å
17	P	55.9	Low	61.9	Low	115 Å²	115	101 Å²	101	75%	0.747	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-51.8	139.1	-178.1	20	-31.1	0	0	0	108.5	S19	P17-S19 PolarHBondContact O-N 3.22Å
18	P	61.8	Low	64.7	Low	75 Å²	75	96 Å²	96	49%	0.487	59%	0.587	S	S	.	*	P	Polyproline II helix	trans	-52.4	124.4	-176.5	19.1	-30.2	0	0	0	108.4	A22	P18-A22 HydrophobicContact CB-CB 3.99Å
19	S	79.7	Confident	67.6	Low	75 Å²	75	90.4 Å²	90.4	52%	0.524	55%	0.55	S	S	.	.	P	Polyproline II helix	trans	-49.2	148.5	175.5	64.4	0	0	0	0	109.5	P17 S21 A22 Y23	P17-S19 PolarHBondContact O-N 3.22Å; S19-S21 CarbonylContact O-C 3.53Å; S19-S21 PolarHBondContact O-N 3.14Å; S19-A22 WeakPolarHBondContact O-CA 3.42Å; S19-A22 WeakPolarHBondContact O-CB 3.38Å; S19-A22 PolarHBondContact O-N 3.19Å; S19-A22 PolarHBondContact OG-N 3.15Å; S19-Y23 PolarHBondContact O-N 3.4Å; S19-Y23 VanDerWaalsContact O-N 3.08Å
20	A	83.8	Confident	70.6	Confident	82 Å²	82	82.5 Å²	82.5	68%	0.678	52%	0.519	S	S	*	.	H	α-helix	trans	-49.7	-34.8	179.4	0	0	0	0	0	112.3	Y23 V24	A20-Y23 PolarHBondContact O-N 2.92Å; A20-V24 WeakPolarHBondContact O-CG2 3.27Å; A20-V24 PolarHBondContact O-N 2.78Å; A20-V24 VanDerWaalsContact O-N 3.13Å
21	S	86.1	Confident	73.6	Confident	70 Å²	70	78.2 Å²	78.2	49%	0.49	50%	0.502	S	S	.	.	H	α-helix	trans	-60.1	-48.1	171.6	-177.9	0	0	0	0	113.1	S19 Y23 V24 K25	S19-S21 CarbonylContact O-C 3.53Å; S19-S21 PolarHBondContact O-N 3.14Å; S21-Y23 PolarHBondContact O-N 3.21Å; S21-V24 PolarHBondContact O-N 2.97Å; S21-K25 WeakPolarHBondContact O-CG 3.49Å; S21-K25 PolarHBondContact O-N 3.29Å
22	A	88.7	Confident	76.5	Confident	15 Å²	15	72.9 Å²	72.9	12%	0.124	47%	0.469	C	S	.	.	H	α-helix	trans	-62.1	-41.7	177.4	0	0	0	0	0	112.1	P18 S19 V24 K25 L26 V83	P18-A22 HydrophobicContact CB-CB 3.99Å; S19-A22 WeakPolarHBondContact O-CA 3.42Å; S19-A22 WeakPolarHBondContact O-CB 3.38Å; S19-A22 PolarHBondContact O-N 3.19Å; S19-A22 PolarHBondContact OG-N 3.15Å; A22-V24 PolarHBondContact O-N 2.94Å; A22-K25 WeakPolarHBondContact O-CB 3.46Å; A22-K25 PolarHBondContact O-N 3Å; A22-L26 VanDerWaalsContact O-CG 3.31Å; A22-L26 WeakPolarHBondContact O-CG 3.15Å; A22-L26 PolarHBondContact O-N 2.85Å; A22-V83 HydrophobicContact CB-CG1 4.39Å
23	Y	91.7	Very high	79.3	Confident	148 Å²	148	69.9 Å²	69.9	58%	0.58	44%	0.444	S	S	*	.	H	α-helix	trans	-60.8	-45.5	176.4	-177.7	-97.3	0	0	0	112	S19 A20 S21 K25 L26 V27	S19-Y23 PolarHBondContact O-N 3.4Å; S19-Y23 VanDerWaalsContact O-N 3.08Å; A20-Y23 PolarHBondContact O-N 2.92Å; S21-Y23 PolarHBondContact O-N 3.21Å; Y23-K25 VanDerWaalsContact C-N 3.34Å; Y23-K25 PolarHBondContact O-N 3.33Å; Y23-L26 PolarHBondContact O-N 3.41Å; Y23-V27 HydrophobicContact CD1-CG2 4.21Å; Y23-V27 HydrophobicContact CE1-CG2 3.74Å; Y23-V27 HydrophobicContact CE2-CG2 4.27Å; Y23-V27 WeakPolarHBondContact O-CG2 3.33Å; Y23-V27 PolarHBondContact O-N 2.61Å
24	V	91.9	Very high	82.3	Confident	92 Å²	92	70.1 Å²	70.1	56%	0.558	43%	0.432	S	S	*	.	H	α-helix	trans	-59.7	-44.1	176.1	171.5	0	0	0	0	111.4	A20 S21 A22 L26 V27 L28	A20-V24 WeakPolarHBondContact O-CG2 3.27Å; A20-V24 PolarHBondContact O-N 2.78Å; A20-V24 VanDerWaalsContact O-N 3.13Å; S21-V24 PolarHBondContact O-N 2.97Å; A22-V24 PolarHBondContact O-N 2.94Å; V24-L26 PolarHBondContact O-N 3Å; V24-V27 PolarHBondContact O-N 2.96Å; V24-L28 WeakPolarHBondContact O-CB 3.43Å; V24-L28 PolarHBondContact O-N 2.87Å
25	K	92.2	Very high	85.1	Confident	22 Å²	22	69.3 Å²	69.3	10%	0.096	42%	0.418	C	S	.	.	H	α-helix	trans	-56.6	-50	174.4	-72.1	-177.3	178.6	-170.7	0	111.2	S21 A22 Y23 V27 L28 L29 V83 D172 W327	S21-K25 WeakPolarHBondContact O-CG 3.49Å; S21-K25 PolarHBondContact O-N 3.29Å; A22-K25 WeakPolarHBondContact O-CB 3.46Å; A22-K25 PolarHBondContact O-N 3Å; Y23-K25 VanDerWaalsContact C-N 3.34Å; Y23-K25 PolarHBondContact O-N 3.33Å; K25-V27 PolarHBondContact O-N 2.81Å; K25-L28 PolarHBondContact O-N 3.4Å; K25-L29 WeakPolarHBondContact O-CB 3.37Å; K25-L29 PolarHBondContact O-N 2.92Å; K25-V83 HydrophobicContact CB-CG1 3.8Å; K25-V83 HydrophobicContact CD-CG1 4.21Å; K25-V83 HydrophobicContact CD-CG2 4.49Å; K25-D172 IonicContact NZ-OD1 2.69Å; K25-D172 IonicContact NZ-OD2 2.75Å; K25-D172 PolarHBondContact NZ-OD2 3.21Å; K25-W327 VanDerWaalsContact C-CH2 3.49Å; K25-W327 VanDerWaalsContact CA-CH2 3.43Å; K25-W327 HydrophobicContact CB-CH2 3.54Å; K25-W327 HydrophobicContact CB-CZ2 3.34Å; K25-W327 HydrophobicContact CD-CZ2 3.82Å; K25-W327 HydrophobicContact CG-CH2 4.02Å; K25-W327 HydrophobicContact CG-CZ2 3.31Å; K25-W327 WeakPolarHBondContact O-CH2 3.39Å; K25-W327 WeakPolarHBondContact O-CZ3 3.48Å
26	L	94.8	Very high	87.7	Confident	30 Å²	30	62.4 Å²	62.4	16%	0.157	38%	0.382	C	S	.	.	H	α-helix	trans	-60.4	-45.8	-178.7	-67.5	175	0	0	0	112.7	A22 Y23 V24 G30 L80 V83 R84	A22-L26 VanDerWaalsContact O-CG 3.31Å; A22-L26 WeakPolarHBondContact O-CG 3.15Å; A22-L26 PolarHBondContact O-N 2.85Å; Y23-L26 PolarHBondContact O-N 3.41Å; V24-L26 PolarHBondContact O-N 3Å; L26-G30 PolarHBondContact O-N 3.04Å; L26-L80 HydrophobicContact CB-CD1 4.3Å; L26-L80 HydrophobicContact CD2-CD1 3.47Å; L26-L80 VanDerWaalsContact CD2-CD1 3.47Å; L26-L80 HydrophobicContact CD2-CG 4Å; L26-V83 HydrophobicContact CD2-CB 3.76Å; L26-V83 HydrophobicContact CD2-CG1 3.57Å; L26-V83 HydrophobicContact CG-CG1 3.78Å; L26-R84 HydrophobicContact CD1-CG 3.79Å; L26-R84 HydrophobicContact CD2-CG 3.52Å; L26-R84 HydrophobicContact CG-CG 4.32Å
27	V	95.2	Very high	89.9	Confident	65 Å²	65	60.3 Å²	60.3	39%	0.394	36%	0.362	S	S	.	.	H	α-helix	trans	-63.6	-48.5	179	173.7	0	0	0	0	110.4	Y23 V24 K25 L29 G30 L31	Y23-V27 HydrophobicContact CD1-CG2 4.21Å; Y23-V27 HydrophobicContact CE1-CG2 3.74Å; Y23-V27 HydrophobicContact CE2-CG2 4.27Å; Y23-V27 WeakPolarHBondContact O-CG2 3.33Å; Y23-V27 PolarHBondContact O-N 2.61Å; V24-V27 PolarHBondContact O-N 2.96Å; K25-V27 PolarHBondContact O-N 2.81Å; V27-L29 PolarHBondContact O-N 3.23Å; V27-G30 PolarHBondContact O-N 2.69Å; V27-L31 HydrophobicContact CG1-CD1 4.09Å; V27-L31 VanDerWaalsContact O-CG 3.31Å; V27-L31 WeakPolarHBondContact O-CG 3.47Å; V27-L31 PolarHBondContact O-N 2.92Å
28	L	94.4	Very high	91.9	Very high	79 Å²	79	57.4 Å²	57.4	41%	0.414	35%	0.348	S	S	.	.	H	α-helix	trans	-64.5	-43	-177.9	-174.4	60.5	0	0	0	112	V24 K25 L31 I32 W327	V24-L28 WeakPolarHBondContact O-CB 3.43Å; V24-L28 PolarHBondContact O-N 2.87Å; K25-L28 PolarHBondContact O-N 3.4Å; L28-L31 PolarHBondContact O-N 3.17Å; L28-I32 HydrophobicContact CD1-CD1 4.47Å; L28-I32 HydrophobicContact CG-CD1 4.14Å; L28-I32 VanDerWaalsContact O-CG1 3.32Å; L28-I32 WeakPolarHBondContact O-CG1 3.33Å; L28-I32 PolarHBondContact O-N 3.14Å; L28-W327 HydrophobicContact CB-CE3 4.32Å; L28-W327 HydrophobicContact CB-CZ3 3.99Å; L28-W327 HydrophobicContact CD2-CD2 4.37Å; L28-W327 HydrophobicContact CD2-CE3 3.73Å; L28-W327 HydrophobicContact CD2-CZ3 4.24Å; L28-W327 HydrophobicContact CG-CE3 4Å; L28-W327 HydrophobicContact CG-CZ3 4.13Å
29	L	95.5	Very high	93.6	Very high	2 Å²	2	54.3 Å²	54.3	1%	0.01	33%	0.33	C	S	.	.	H	α-helix	trans	-68.5	-40.2	179	-171.9	58.3	0	0	0	111	K25 V27 L31 I32 M33 F76 V79 L80 W327 F330	K25-L29 WeakPolarHBondContact O-CB 3.37Å; K25-L29 PolarHBondContact O-N 2.92Å; V27-L29 PolarHBondContact O-N 3.23Å; L29-L31 VanDerWaalsContact C-N 3.32Å; L29-L31 PolarHBondContact O-N 2.82Å; L29-I32 PolarHBondContact O-N 2.77Å; L29-M33 VanDerWaalsContact O-CB 3.27Å; L29-M33 WeakPolarHBondContact O-CB 3.48Å; L29-M33 PolarHBondContact O-N 2.78Å; L29-F76 HydrophobicContact CD1-CB 4.49Å; L29-F76 HydrophobicContact CD1-CD2 4.4Å; L29-F76 HydrophobicContact CD1-CG 4.28Å; L29-V79 HydrophobicContact CD2-CB 3.88Å; L29-V79 HydrophobicContact CD2-CG1 3.64Å; L29-L80 HydrophobicContact CB-CD1 4.17Å; L29-L80 HydrophobicContact CD2-CB 4.04Å; L29-L80 HydrophobicContact CD2-CD1 4.1Å; L29-L80 HydrophobicContact CG-CD1 4.38Å; L29-W327 HydrophobicContact CB-CH2 3.68Å; L29-W327 HydrophobicContact CB-CZ3 3.55Å; L29-W327 HydrophobicContact CD1-CZ3 4.34Å; L29-W327 HydrophobicContact CG-CZ3 4.44Å; L29-F330 HydrophobicContact CD1-CB 4.43Å; L29-F330 HydrophobicContact CD1-CD2 4.06Å; L29-F330 HydrophobicContact CD1-CG 4.32Å
30	G	96.5	Very high	94.4	Very high	22 Å²	22	50.8 Å²	50.8	23%	0.227	31%	0.305	C	S	.	.	H	α-helix	trans	-58.1	-44.7	174.2	0	0	0	0	0	111.7	L26 V27 M33 C34	L26-G30 PolarHBondContact O-N 3.04Å; V27-G30 PolarHBondContact O-N 2.69Å; G30-M33 PolarHBondContact O-N 3.39Å; G30-C34 WeakPolarHBondContact O-CB 3.48Å; G30-C34 PolarHBondContact O-N 2.95Å; G30-C34 PolarHBondContact O-SG 2.71Å
31	L	96.5	Very high	95.1	Very high	105 Å²	105	49.2 Å²	49.2	55%	0.55	29%	0.292	S	S	.	.	H	α-helix	trans	-63.4	-47.1	175.3	-70.5	173	0	0	0	112.2	V27 L28 L29 M33 C34 V35	V27-L31 HydrophobicContact CG1-CD1 4.09Å; V27-L31 VanDerWaalsContact O-CG 3.31Å; V27-L31 WeakPolarHBondContact O-CG 3.47Å; V27-L31 PolarHBondContact O-N 2.92Å; L28-L31 PolarHBondContact O-N 3.17Å; L29-L31 VanDerWaalsContact C-N 3.32Å; L29-L31 PolarHBondContact O-N 2.82Å; L31-M33 VanDerWaalsContact C-N 3.32Å; L31-M33 PolarHBondContact O-N 3.35Å; L31-C34 PolarHBondContact O-N 3.15Å; L31-V35 WeakPolarHBondContact O-CB 3.19Å; L31-V35 VanDerWaalsContact O-CG2 3.3Å; L31-V35 WeakPolarHBondContact O-CG2 3.42Å; L31-V35 PolarHBondContact O-N 3.02Å
32	I	96.7	Very high	95.6	Very high	18 Å²	18	48.5 Å²	48.5	9%	0.092	28%	0.282	C	S	.	.	H	α-helix	trans	-58.6	-45.9	177.1	-69.8	166.8	0	0	0	110.6	L28 L29 V35 S36 F76 W327 A331	L28-I32 HydrophobicContact CD1-CD1 4.47Å; L28-I32 HydrophobicContact CG-CD1 4.14Å; L28-I32 VanDerWaalsContact O-CG1 3.32Å; L28-I32 WeakPolarHBondContact O-CG1 3.33Å; L28-I32 PolarHBondContact O-N 3.14Å; L29-I32 PolarHBondContact O-N 2.77Å; I32-V35 PolarHBondContact O-N 2.63Å; I32-S36 WeakPolarHBondContact O-CB 3.39Å; I32-S36 PolarHBondContact O-N 2.88Å; I32-F76 HydrophobicContact CG2-CE2 3.89Å; I32-W327 HydrophobicContact CD1-CE3 4.49Å; I32-A331 HydrophobicContact CD1-CB 4.22Å
33	M	97.2	Very high	95.9	Very high	42 Å²	42	47.8 Å²	47.8	21%	0.207	28%	0.276	C	S	.	.	H	α-helix	trans	-60.9	-48.4	178.6	-178.5	-178	166.6	0	0	111.3	L29 G30 L31 S36 L37 F76 P77	L29-M33 VanDerWaalsContact O-CB 3.27Å; L29-M33 WeakPolarHBondContact O-CB 3.48Å; L29-M33 PolarHBondContact O-N 2.78Å; G30-M33 PolarHBondContact O-N 3.39Å; L31-M33 VanDerWaalsContact C-N 3.32Å; L31-M33 PolarHBondContact O-N 3.35Å; M33-S36 PolarHBondContact O-N 3.01Å; M33-L37 HydrophobicContact CE-CD1 3.66Å; M33-L37 HydrophobicContact CG-CD1 3.79Å; M33-L37 HydrophobicContact CG-CG 4.41Å; M33-L37 WeakPolarHBondContact O-CB 3.48Å; M33-L37 VanDerWaalsContact O-CG 3.29Å; M33-L37 WeakPolarHBondContact O-CG 3.47Å; M33-L37 PolarHBondContact O-N 3.22Å; M33-F76 HydrophobicContact CB-CD2 4.06Å; M33-F76 HydrophobicContact CG-CB 4.36Å; M33-F76 HydrophobicContact CG-CD2 4.38Å; M33-F76 HydrophobicContact SD-CB 4.34Å; M33-P77 HydrophobicContact CE-CG 3.76Å; M33-P77 HydrophobicContact SD-CG 4.3Å
34	C	97.3	Very high	96.2	Very high	83 Å²	83	41.1 Å²	41.1	56%	0.561	25%	0.251	S	S	*	.	H	α-helix	trans	-61.7	-48.3	178.5	-72.7	0	0	0	0	112.3	G30 L31 S36 A38	G30-C34 WeakPolarHBondContact O-CB 3.48Å; G30-C34 PolarHBondContact O-N 2.95Å; G30-C34 PolarHBondContact O-SG 2.71Å; L31-C34 PolarHBondContact O-N 3.15Å; C34-S36 VanDerWaalsContact C-N 3.34Å; C34-S36 PolarHBondContact O-N 3.37Å; C34-A38 VanDerWaalsContact O-CB 3.26Å; C34-A38 WeakPolarHBondContact O-CB 3.32Å; C34-A38 PolarHBondContact O-N 3.34Å
35	V	97.2	Very high	96.4	Very high	70 Å²	70	41.2 Å²	41.2	42%	0.424	25%	0.248	S	C	.	.	H	α-helix	trans	-63.2	-42.9	179.3	173.9	0	0	0	0	110.8	L31 I32 G39 A334	L31-V35 WeakPolarHBondContact O-CB 3.19Å; L31-V35 VanDerWaalsContact O-CG2 3.3Å; L31-V35 WeakPolarHBondContact O-CG2 3.42Å; L31-V35 PolarHBondContact O-N 3.02Å; I32-V35 PolarHBondContact O-N 2.63Å; V35-G39 WeakPolarHBondContact O-CA 2.89Å; V35-G39 PolarHBondContact O-N 3.19Å; V35-A334 HydrophobicContact CB-CB 4.35Å; V35-A334 HydrophobicContact CG1-CB 3.81Å
36	S	97.7	Very high	96.5	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-64.1	-51.1	178.5	-179.3	0	0	0	0	111.9	I32 M33 C34 N40 S72 A333	I32-S36 WeakPolarHBondContact O-CB 3.39Å; I32-S36 PolarHBondContact O-N 2.88Å; M33-S36 PolarHBondContact O-N 3.01Å; C34-S36 VanDerWaalsContact C-N 3.34Å; C34-S36 PolarHBondContact O-N 3.37Å; S36-N40 VanDerWaalsContact O-CB 3.23Å; S36-N40 WeakPolarHBondContact O-CB 3.48Å; S36-N40 PolarHBondContact O-N 2.97Å; S36-N40 PolarHBondContact O-ND2 2.94Å; S36-N40 PolarHBondContact OG-ND2 3.11Å; S36-S72 WeakPolarHBondContact CB-OG 3.36Å; S36-S72 PolarHBondContact OG-OG 3.18Å; S36-A333 VanDerWaalsContact OG-CB 3.31Å; S36-A333 WeakPolarHBondContact OG-CB 3.28Å; S36-A333 PolarHBondContact OG-O 2.82Å
37	L	98	Very high	96.6	Very high	56 Å²	56	38.9 Å²	38.9	29%	0.293	24%	0.237	S	C	.	.	H	α-helix	trans	-63	-51.5	-178.8	-72.6	173.9	0	0	0	111.6	M33 A41 G69 A73	M33-L37 HydrophobicContact CE-CD1 3.66Å; M33-L37 HydrophobicContact CG-CD1 3.79Å; M33-L37 HydrophobicContact CG-CG 4.41Å; M33-L37 WeakPolarHBondContact O-CB 3.48Å; M33-L37 VanDerWaalsContact O-CG 3.29Å; M33-L37 WeakPolarHBondContact O-CG 3.47Å; M33-L37 PolarHBondContact O-N 3.22Å; L37-A41 WeakPolarHBondContact O-CB 3.16Å; L37-A41 PolarHBondContact O-N 3.08Å; L37-G69 WeakPolarHBondContact CD2-O 3.31Å; L37-A73 HydrophobicContact CD2-CB 3.83Å
38	A	97.2	Very high	96.6	Very high	54 Å²	54	40.7 Å²	40.7	45%	0.446	24%	0.244	S	C	.	.	H	α-helix	trans	-64.8	-47	-179.5	0	0	0	0	0	111.3	C34 A41 I42	C34-A38 VanDerWaalsContact O-CB 3.26Å; C34-A38 WeakPolarHBondContact O-CB 3.32Å; C34-A38 PolarHBondContact O-N 3.34Å; A38-A41 PolarHBondContact O-N 3.36Å; A38-I42 WeakPolarHBondContact O-CB 3.43Å; A38-I42 WeakPolarHBondContact O-CD1 3.13Å; A38-I42 WeakPolarHBondContact O-CG1 3.35Å; A38-I42 PolarHBondContact O-N 3.32Å
39	G	97	Very high	96.6	Very high	10 Å²	10	42.5 Å²	42.5	10%	0.103	25%	0.249	C	C	.	.	H	α-helix	trans	-65	-46.8	-176.9	0	0	0	0	0	113	V35 I42 L43	V35-G39 WeakPolarHBondContact O-CA 2.89Å; V35-G39 PolarHBondContact O-N 3.19Å; G39-I42 PolarHBondContact O-N 3.41Å; G39-L43 WeakPolarHBondContact O-CB 3.26Å; G39-L43 PolarHBondContact O-N 2.85Å
40	N	98	Very high	96.5	Very high	2 Å²	2	44 Å²	44	1%	0.011	26%	0.255	C	S	.	.	H	α-helix	trans	-70.1	-33.9	178.4	-71.6	-61.7	0	0	0	112.1	S36 S44 C65 A333	S36-N40 VanDerWaalsContact O-CB 3.23Å; S36-N40 WeakPolarHBondContact O-CB 3.48Å; S36-N40 PolarHBondContact O-N 2.97Å; S36-N40 PolarHBondContact O-ND2 2.94Å; S36-N40 PolarHBondContact OG-ND2 3.11Å; N40-S44 VanDerWaalsContact O-CB 3.28Å; N40-S44 WeakPolarHBondContact O-CB 3.3Å; N40-S44 PolarHBondContact O-N 3.34Å; N40-S44 PolarHBondContact O-OG 3.47Å; N40-C65 HydrophobicContact CB-CB 4.11Å; N40-C65 WeakPolarHBondContact CB-O 3.35Å; N40-C65 WeakPolarHBondContact OD1-CA 3.4Å; N40-A333 PolarHBondContact ND2-O 3.41Å
41	A	97.4	Very high	96.4	Very high	49 Å²	49	53 Å²	53	41%	0.405	28%	0.283	S	S	.	.	H	α-helix	trans	-63.8	-49.7	172.3	0	0	0	0	0	111.6	L37 A38 L43 S44 L45	L37-A41 WeakPolarHBondContact O-CB 3.16Å; L37-A41 PolarHBondContact O-N 3.08Å; A38-A41 PolarHBondContact O-N 3.36Å; A41-L43 PolarHBondContact O-N 2.81Å; A41-S44 PolarHBondContact O-N 3.34Å; A41-L45 WeakPolarHBondContact O-CB 3.33Å; A41-L45 VanDerWaalsContact O-CG 3.26Å; A41-L45 WeakPolarHBondContact O-CG 3.46Å; A41-L45 PolarHBondContact O-N 3.01Å
42	I	96	Very high	96.1	Very high	54 Å²	54	51 Å²	51	28%	0.277	28%	0.281	S	S	.	.	H	α-helix	trans	-56.4	-49.5	176.3	-72.7	169.6	0	0	0	110.6	A38 G39 S44 L45 L46 F341 L351 W358	A38-I42 WeakPolarHBondContact O-CB 3.43Å; A38-I42 WeakPolarHBondContact O-CD1 3.13Å; A38-I42 WeakPolarHBondContact O-CG1 3.35Å; A38-I42 PolarHBondContact O-N 3.32Å; G39-I42 PolarHBondContact O-N 3.41Å; I42-S44 VanDerWaalsContact C-N 3.35Å; I42-S44 PolarHBondContact O-N 3.46Å; I42-L45 PolarHBondContact O-N 3.1Å; I42-L46 HydrophobicContact CG2-CD1 4.23Å; I42-L46 VanDerWaalsContact O-CG 3.31Å; I42-L46 WeakPolarHBondContact O-CG 3.01Å; I42-L46 PolarHBondContact O-N 3.38Å; I42-F341 HydrophobicContact CG2-CE2 4.09Å; I42-F341 HydrophobicContact CG2-CZ 3.54Å; I42-L351 HydrophobicContact CG2-CD1 3.97Å; I42-W358 HydrophobicContact CB-CH2 4.17Å; I42-W358 HydrophobicContact CB-CZ3 4.46Å; I42-W358 HydrophobicContact CD1-CZ3 4.46Å; I42-W358 HydrophobicContact CG1-CH2 4.11Å; I42-W358 HydrophobicContact CG1-CZ3 4.08Å; I42-W358 HydrophobicContact CG2-CH2 3.57Å; I42-W358 HydrophobicContact CG2-CZ3 3.76Å
43	L	96.4	Very high	95.9	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-59.3	-45.8	177.8	-82.9	-173.6	0	0	0	112.2	G39 A41 L45 L46 V47 C65 P337 C340 F341 L347	G39-L43 WeakPolarHBondContact O-CB 3.26Å; G39-L43 PolarHBondContact O-N 2.85Å; A41-L43 PolarHBondContact O-N 2.81Å; L43-L45 PolarHBondContact O-N 3.24Å; L43-L46 PolarHBondContact O-N 3.49Å; L43-V47 WeakPolarHBondContact O-CG2 3.35Å; L43-V47 PolarHBondContact O-N 2.93Å; L43-C65 VanDerWaalsContact CD1-SG 3.57Å; L43-P337 VanDerWaalsContact CD1-CA 3.42Å; L43-P337 HydrophobicContact CD1-CB 3.93Å; L43-P337 HydrophobicContact CG-CB 4.24Å; L43-C340 HydrophobicContact CD1-CB 3.97Å; L43-C340 HydrophobicContact CD2-CB 3.91Å; L43-F341 HydrophobicContact CD2-CD1 4.39Å; L43-F341 HydrophobicContact CD2-CE1 3.72Å; L43-F341 HydrophobicContact CD2-CE2 3.86Å; L43-F341 HydrophobicContact CD2-CZ 3.39Å; L43-F341 HydrophobicContact CG-CE2 3.95Å; L43-F341 HydrophobicContact CG-CZ 3.85Å; L43-L347 HydrophobicContact CD2-CD1 4.08Å; L43-L347 HydrophobicContact CD2-CD2 4.44Å
44	S	97.3	Very high	95.8	Very high	8 Å²	8	52 Å²	52	6%	0.056	29%	0.285	C	S	.	.	H	α-helix	trans	-61.4	-45	179.4	-58.7	0	0	0	0	111.1	N40 A41 I42 L46 V47 L48	N40-S44 VanDerWaalsContact O-CB 3.28Å; N40-S44 WeakPolarHBondContact O-CB 3.3Å; N40-S44 PolarHBondContact O-N 3.34Å; N40-S44 PolarHBondContact O-OG 3.47Å; A41-S44 PolarHBondContact O-N 3.34Å; I42-S44 VanDerWaalsContact C-N 3.35Å; I42-S44 PolarHBondContact O-N 3.46Å; S44-L46 PolarHBondContact O-N 3.31Å; S44-V47 PolarHBondContact O-N 3.38Å; S44-L48 WeakPolarHBondContact O-CB 3.08Å; S44-L48 VanDerWaalsContact O-CG 3.23Å; S44-L48 WeakPolarHBondContact O-CG 3.42Å; S44-L48 PolarHBondContact O-N 2.96Å
45	L	96.1	Very high	95.6	Very high	94 Å²	94	53.6 Å²	53.6	49%	0.492	28%	0.282	S	S	.	.	H	α-helix	trans	-61.8	-41.5	176.7	-69.7	173.4	0	0	0	112.3	A41 I42 L43 L48 K49 W358	A41-L45 WeakPolarHBondContact O-CB 3.33Å; A41-L45 VanDerWaalsContact O-CG 3.26Å; A41-L45 WeakPolarHBondContact O-CG 3.46Å; A41-L45 PolarHBondContact O-N 3.01Å; I42-L45 PolarHBondContact O-N 3.1Å; L43-L45 PolarHBondContact O-N 3.24Å; L45-L48 PolarHBondContact O-N 3.34Å; L45-K49 WeakPolarHBondContact O-CB 3.49Å; L45-K49 PolarHBondContact O-N 2.92Å; L45-W358 HydrophobicContact CB-CZ2 4.44Å
46	L	95.4	Very high	95.5	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-62.5	-46.9	177.3	-71.4	175	0	0	0	111.6	I42 L43 S44 K49 E50 F341 C350 L351 H354 W358	I42-L46 HydrophobicContact CG2-CD1 4.23Å; I42-L46 VanDerWaalsContact O-CG 3.31Å; I42-L46 WeakPolarHBondContact O-CG 3.01Å; I42-L46 PolarHBondContact O-N 3.38Å; L43-L46 PolarHBondContact O-N 3.49Å; S44-L46 PolarHBondContact O-N 3.31Å; L46-K49 PolarHBondContact O-N 2.91Å; L46-E50 WeakPolarHBondContact O-CB 3.26Å; L46-E50 PolarHBondContact O-N 3.35Å; L46-F341 HydrophobicContact CD1-CE1 3.77Å; L46-F341 HydrophobicContact CD1-CZ 4.01Å; L46-C350 HydrophobicContact CD2-CB 4.26Å; L46-L351 HydrophobicContact CD1-CB 3.97Å; L46-L351 HydrophobicContact CD1-CD1 4.1Å; L46-H354 HydrophobicContact CD2-CB 4.16Å; L46-W358 HydrophobicContact CD2-CH2 4.17Å; L46-W358 HydrophobicContact CD2-CZ2 4.45Å; L46-W358 HydrophobicContact CG-CH2 4.26Å
47	V	95.5	Very high	95.4	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.012	27%	0.266	C	S	.	.	H	α-helix	trans	-64.8	-40.6	179.2	173.3	0	0	0	0	111.4	L43 S44 L53 H54 Y58 L62 L347	L43-V47 WeakPolarHBondContact O-CG2 3.35Å; L43-V47 PolarHBondContact O-N 2.93Å; S44-V47 PolarHBondContact O-N 3.38Å; V47-L53 HydrophobicContact CG2-CD1 4.4Å; V47-H54 PolarHBondContact O-CD2 3.08Å; V47-H54 PolarHBondContact O-NE2 2.94Å; V47-H54 VanDerWaalsContact O-NE2 3.15Å; V47-Y58 HydrophobicContact CG2-CD1 4.41Å; V47-L62 HydrophobicContact CG1-CB 4.12Å; V47-L62 HydrophobicContact CG1-CD2 4.47Å; V47-L347 HydrophobicContact CG2-CD2 4.31Å
48	L	95.5	Very high	95.4	Very high	103 Å²	103	48.2 Å²	48.2	54%	0.539	25%	0.252	S	S	.	.	H	α-helix	trans	-69.3	-41	179.6	-71.6	170.8	0	0	0	112.2	S44 L45 H54 L62	S44-L48 WeakPolarHBondContact O-CB 3.08Å; S44-L48 VanDerWaalsContact O-CG 3.23Å; S44-L48 WeakPolarHBondContact O-CG 3.42Å; S44-L48 PolarHBondContact O-N 2.96Å; L45-L48 PolarHBondContact O-N 3.34Å; L48-H54 PolarHBondContact O-NE2 2.88Å; L48-L62 HydrophobicContact CD1-CD1 4.43Å; L48-L62 HydrophobicContact CD2-CD2 3.72Å; L48-L62 HydrophobicContact CG-CD1 4.21Å; L48-L62 HydrophobicContact CG-CD2 4.2Å
49	K	94.4	Very high	95.4	Very high	118 Å²	118	48.1 Å²	48.1	51%	0.513	24%	0.241	S	C	.	.	H	α-helix	trans	-78.6	-40.6	-174.3	-171.8	174.7	-178.2	178.9	0	113.4	L45 L46 R51 H354	L45-K49 WeakPolarHBondContact O-CB 3.49Å; L45-K49 PolarHBondContact O-N 2.92Å; L46-K49 PolarHBondContact O-N 2.91Å; K49-R51 PolarHBondContact O-N 3.42Å; K49-H354 VanDerWaalsContact CE-CE1 3.44Å; K49-H354 WeakPolarHBondContact CE-CE1 3.38Å
50	E	94.2	Very high	95.5	Very high	32 Å²	32	47.7 Å²	47.7	15%	0.15	24%	0.236	C	C	.	.			trans	-89	112.1	-173.9	-178.7	56.7	-118	0	0	111.8	L46 A52 L53 H54	L46-E50 WeakPolarHBondContact O-CB 3.26Å; L46-E50 PolarHBondContact O-N 3.35Å; E50-A52 HydrophobicContact CG-CB 3.92Å; E50-A52 PolarHBondContact O-N 3.26Å; E50-A52 WeakPolarHBondContact OE1-CB 3.41Å; E50-A52 PolarHBondContact OE1-N 3.09Å; E50-L53 HydrophobicContact CB-CD1 4.03Å; E50-L53 HydrophobicContact CB-CG 4.09Å; E50-L53 HydrophobicContact CG-CD1 4.39Å; E50-L53 HydrophobicContact CG-CG 4.04Å; E50-L53 WeakPolarHBondContact O-CB 3.38Å; E50-L53 PolarHBondContact O-N 3.36Å; E50-H54 PolarHBondContact O-CD2 3.5Å
51	R	92.8	Very high	95.5	Very high	213 Å²	213	47.6 Å²	47.6	80%	0.804	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-61.2	-29.7	179.5	-56.9	-169.2	-145.9	-133.8	6.2	112.7	K49 L53 H54	K49-R51 PolarHBondContact O-N 3.42Å; R51-L53 PolarHBondContact O-N 3.02Å; R51-H54 WeakPolarHBondContact O-CB 3.14Å; R51-H54 PolarHBondContact O-N 3.03Å; R51-H54 VanDerWaalsContact O-N 3.07Å
52	A	90.6	Very high	95.5	Very high	61 Å²	61	46.4 Å²	46.4	50%	0.504	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-62	-22.2	176.2	0	0	0	0	0	113.2	E50 K55	E50-A52 HydrophobicContact CG-CB 3.92Å; E50-A52 PolarHBondContact O-N 3.26Å; E50-A52 WeakPolarHBondContact OE1-CB 3.41Å; E50-A52 PolarHBondContact OE1-N 3.09Å; A52-K55 WeakPolarHBondContact O-CE 3.36Å
53	L	93	Very high	95.6	Very high	3 Å²	3	44.5 Å²	44.5	2%	0.016	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-92.1	-1.5	177.4	-58.4	178.8	0	0	0	113.1	V47 E50 R51 K55 Y58 D346 L347 C350	V47-L53 HydrophobicContact CG2-CD1 4.4Å; E50-L53 HydrophobicContact CB-CD1 4.03Å; E50-L53 HydrophobicContact CB-CG 4.09Å; E50-L53 HydrophobicContact CG-CD1 4.39Å; E50-L53 HydrophobicContact CG-CG 4.04Å; E50-L53 WeakPolarHBondContact O-CB 3.38Å; E50-L53 PolarHBondContact O-N 3.36Å; R51-L53 PolarHBondContact O-N 3.02Å; L53-K55 PolarHBondContact O-N 3.27Å; L53-Y58 HydrophobicContact CB-CD2 4.11Å; L53-Y58 HydrophobicContact CB-CE2 4.48Å; L53-Y58 HydrophobicContact CB-CG 4.18Å; L53-Y58 HydrophobicContact CD2-CD1 4.31Å; L53-Y58 HydrophobicContact CD2-CD2 4.13Å; L53-Y58 HydrophobicContact CD2-CE1 3.87Å; L53-Y58 HydrophobicContact CD2-CE2 3.67Å; L53-Y58 HydrophobicContact CD2-CG 4.43Å; L53-Y58 WeakPolarHBondContact O-CB 3.36Å; L53-Y58 WeakPolarHBondContact O-CD2 3.06Å; L53-D346 HydrophobicContact CD2-CB 4.19Å; L53-L347 HydrophobicContact CD1-CD2 3.62Å; L53-L347 HydrophobicContact CD2-CD2 4.45Å; L53-C350 HydrophobicContact CD1-CB 4.48Å
54	H	94.8	Very high	95.7	Very high	80 Å²	80	44.7 Å²	44.7	37%	0.37	21%	0.214	S	C	.	.			trans	-75.9	69	178.8	-68.8	-179.9	0	0	0	111.4	V47 L48 E50 R51	V47-H54 PolarHBondContact O-CD2 3.08Å; V47-H54 PolarHBondContact O-NE2 2.94Å; V47-H54 VanDerWaalsContact O-NE2 3.15Å; L48-H54 PolarHBondContact O-NE2 2.88Å; E50-H54 PolarHBondContact O-CD2 3.5Å; R51-H54 WeakPolarHBondContact O-CB 3.14Å; R51-H54 PolarHBondContact O-N 3.03Å; R51-H54 VanDerWaalsContact O-N 3.07Å
55	K	93.9	Very high	95.7	Very high	115 Å²	115	44.4 Å²	44.4	50%	0.5	21%	0.211	S	C	.	.	S	Bend	trans	-134.7	154	179.9	-55.3	179.8	-178.4	178.8	0	109.6	A52 L53 P57 Y58 Y59	A52-K55 WeakPolarHBondContact O-CE 3.36Å; L53-K55 PolarHBondContact O-N 3.27Å; K55-P57 VanDerWaalsContact C-CD 3.48Å; K55-P57 HydrophobicContact CB-CG 4.38Å; K55-Y58 HydrophobicContact CB-CD2 4.19Å; K55-Y58 PolarHBondContact O-N 2.94Å; K55-Y59 PolarHBondContact O-N 3.27Å
56	A	95.2	Very high	95.8	Very high	9 Å²	9	44 Å²	44	7%	0.074	21%	0.209	C	C	.	.	H	α-helix	trans	-40.4	-52.2	180	0	0	0	0	0	116.3	Y58 Y59 F60 M135 C140	A56-Y58 VanDerWaalsContact C-N 3.26Å; A56-Y58 PolarHBondContact O-N 3.2Å; A56-Y59 PolarHBondContact O-N 3.41Å; A56-F60 WeakPolarHBondContact O-CD2 3.46Å; A56-F60 PolarHBondContact O-N 3.39Å; A56-M135 HydrophobicContact CB-CB 4.17Å; A56-C140 VanDerWaalsContact CB-SG 3.56Å
57	P	95.8	Very high	96	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.006	21%	0.211	C	C	.	.	H	α-helix	trans	-58.3	-37.9	180	18.2	-30.4	0	0	0	113	K55 F60 L61 Y131 L284 F288	K55-P57 VanDerWaalsContact C-CD 3.48Å; K55-P57 HydrophobicContact CB-CG 4.38Å; P57-F60 PolarHBondContact O-N 2.88Å; P57-L61 PolarHBondContact O-N 3.4Å; P57-Y131 WeakPolarHBondContact CD-OH 3.44Å; P57-L284 HydrophobicContact CB-CD1 4.13Å; P57-L284 HydrophobicContact CG-CD1 3.73Å; P57-F288 HydrophobicContact CB-CE2 3.85Å; P57-F288 HydrophobicContact CB-CZ 4.37Å; P57-F288 VanDerWaalsContact O-CZ 3.3Å; P57-F288 WeakPolarHBondContact O-CZ 3.35Å
58	Y	96.8	Very high	96.1	Very high	4 Å²	4	44.4 Å²	44.4	2%	0.016	21%	0.212	C	C	.	.	H	α-helix	trans	-77.2	-26.6	-178	-65.8	-66	0	0	0	112.4	V47 L53 K55 A56 L61 L62 L284 N344 D346 L347	V47-Y58 HydrophobicContact CG2-CD1 4.41Å; L53-Y58 HydrophobicContact CB-CD2 4.11Å; L53-Y58 HydrophobicContact CB-CE2 4.48Å; L53-Y58 HydrophobicContact CB-CG 4.18Å; L53-Y58 HydrophobicContact CD2-CD1 4.31Å; L53-Y58 HydrophobicContact CD2-CD2 4.13Å; L53-Y58 HydrophobicContact CD2-CE1 3.87Å; L53-Y58 HydrophobicContact CD2-CE2 3.67Å; L53-Y58 HydrophobicContact CD2-CG 4.43Å; L53-Y58 WeakPolarHBondContact O-CB 3.36Å; L53-Y58 WeakPolarHBondContact O-CD2 3.06Å; K55-Y58 HydrophobicContact CB-CD2 4.19Å; K55-Y58 PolarHBondContact O-N 2.94Å; A56-Y58 VanDerWaalsContact C-N 3.26Å; A56-Y58 PolarHBondContact O-N 3.2Å; Y58-L61 HydrophobicContact CD1-CD2 4.25Å; Y58-L61 PolarHBondContact O-N 3.34Å; Y58-L62 WeakPolarHBondContact O-CB 3.05Å; Y58-L62 PolarHBondContact O-N 2.91Å; Y58-L284 HydrophobicContact CE1-CD2 4.17Å; Y58-N344 WeakPolarHBondContact CE1-ND2 3.35Å; Y58-N344 PolarHBondContact OH-ND2 3.07Å; Y58-N344 VanDerWaalsContact OH-ND2 3.13Å; Y58-D346 PolarHBondContact OH-OD2 3.41Å; Y58-L347 HydrophobicContact CE1-CD1 4.2Å; Y58-L347 HydrophobicContact CE1-CD2 4.35Å; Y58-L347 HydrophobicContact CE1-CG 4.09Å
59	Y	97.7	Very high	96.2	Very high	52 Å²	52	40.2 Å²	40.2	20%	0.204	19%	0.194	C	C	.	.	H	α-helix	trans	-65.4	-41.4	169.7	-61.7	-42.3	0	0	0	112	K55 A56 L62 D63 L137 C140	K55-Y59 PolarHBondContact O-N 3.27Å; A56-Y59 PolarHBondContact O-N 3.41Å; Y59-L62 PolarHBondContact O-N 2.92Å; Y59-D63 PolarHBondContact O-N 3.15Å; Y59-D63 VanDerWaalsContact O-N 3.07Å; Y59-L137 HydrophobicContact CD2-CD1 4.05Å; Y59-L137 HydrophobicContact CE1-CD1 4.22Å; Y59-L137 HydrophobicContact CE2-CD1 3.65Å; Y59-C140 HydrophobicContact CD2-CB 4.19Å
60	F	98.2	Very high	96.3	Very high	1 Å²	1	38.2 Å²	38.2	0%	0.004	19%	0.188	C	C	.	.	H	α-helix	trans	-68.4	-35.4	174	-57.9	-38.6	0	0	0	112.5	A56 P57 L64 M113 I117 T120 C140 V143 I144	A56-F60 WeakPolarHBondContact O-CD2 3.46Å; A56-F60 PolarHBondContact O-N 3.39Å; P57-F60 PolarHBondContact O-N 2.88Å; F60-L64 PolarHBondContact O-N 3.05Å; F60-L64 VanDerWaalsContact O-N 3.1Å; F60-M113 HydrophobicContact CB-CE 3.89Å; F60-M113 HydrophobicContact CD1-CE 3.66Å; F60-M113 HydrophobicContact CG-CE 4.06Å; F60-I117 HydrophobicContact CB-CD1 3.85Å; F60-I117 HydrophobicContact CB-CG1 3.64Å; F60-I117 HydrophobicContact CD2-CG1 4.1Å; F60-I117 HydrophobicContact CG-CG1 4.1Å; F60-T120 HydrophobicContact CD2-CG2 4.24Å; F60-T120 HydrophobicContact CE2-CG2 3.65Å; F60-T120 WeakPolarHBondContact CE2-OG1 3.46Å; F60-C140 HydrophobicContact CE1-CB 3.96Å; F60-C140 HydrophobicContact CZ-CB 4.21Å; F60-V143 HydrophobicContact CE1-CB 4.01Å; F60-V143 HydrophobicContact CE1-CG1 3.83Å; F60-V143 HydrophobicContact CZ-CB 4.2Å; F60-V143 HydrophobicContact CZ-CG1 4.02Å; F60-I144 HydrophobicContact CD1-CD1 4.14Å; F60-I144 HydrophobicContact CD1-CG1 3.96Å; F60-I144 HydrophobicContact CE1-CD1 4.46Å; F60-I144 HydrophobicContact CE1-CG1 4.17Å
61	L	97.7	Very high	96.5	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-64.5	-42.8	172.5	-179	61.3	0	0	0	111.8	P57 Y58 D63 L64 C65 M287 F288 I291 C340 L347	P57-L61 PolarHBondContact O-N 3.4Å; Y58-L61 HydrophobicContact CD1-CD2 4.25Å; Y58-L61 PolarHBondContact O-N 3.34Å; L61-D63 VanDerWaalsContact C-N 3.34Å; L61-D63 PolarHBondContact O-N 3.25Å; L61-L64 PolarHBondContact O-N 3.48Å; L61-C65 PolarHBondContact O-N 3.02Å; L61-C65 PolarHBondContact O-SG 2.88Å; L61-M287 HydrophobicContact CD2-CE 4.32Å; L61-F288 HydrophobicContact CB-CE1 4.16Å; L61-F288 HydrophobicContact CB-CZ 3.99Å; L61-F288 HydrophobicContact CD1-CE1 4.24Å; L61-I291 HydrophobicContact CD1-CD1 4.41Å; L61-C340 VanDerWaalsContact CD1-SG 3.58Å; L61-L347 HydrophobicContact CD2-CD1 3.88Å
62	L	97.8	Very high	96.7	Very high	23 Å²	23	27.2 Å²	27.2	12%	0.12	15%	0.145	C	C	.	.	H	α-helix	trans	-58.3	-47.8	177.4	174.3	64.2	0	0	0	110.6	V47 L48 Y58 Y59 C65 L66	V47-L62 HydrophobicContact CG1-CB 4.12Å; V47-L62 HydrophobicContact CG1-CD2 4.47Å; L48-L62 HydrophobicContact CD1-CD1 4.43Å; L48-L62 HydrophobicContact CD2-CD2 3.72Å; L48-L62 HydrophobicContact CG-CD1 4.21Å; L48-L62 HydrophobicContact CG-CD2 4.2Å; Y58-L62 WeakPolarHBondContact O-CB 3.05Å; Y58-L62 PolarHBondContact O-N 2.91Å; Y59-L62 PolarHBondContact O-N 2.92Å; L62-C65 PolarHBondContact O-N 3.05Å; L62-L66 HydrophobicContact CD1-CD1 4.08Å; L62-L66 HydrophobicContact CD1-CG 4.11Å; L62-L66 HydrophobicContact CG-CD1 3.99Å; L62-L66 HydrophobicContact CG-CG 4.4Å; L62-L66 VanDerWaalsContact O-CG 3.3Å; L62-L66 WeakPolarHBondContact O-CG 3.32Å; L62-L66 PolarHBondContact O-N 3.2Å
63	D	98.4	Very high	97	Very high	15 Å²	15	26.8 Å²	26.8	8%	0.08	14%	0.141	C	C	.	.	H	α-helix	trans	-60.1	-45.1	177.2	173	76.8	0	0	0	112.6	Y59 L61 C65 L66 A67 H109 M113 I144 W148	Y59-D63 PolarHBondContact O-N 3.15Å; Y59-D63 VanDerWaalsContact O-N 3.07Å; L61-D63 VanDerWaalsContact C-N 3.34Å; L61-D63 PolarHBondContact O-N 3.25Å; D63-C65 VanDerWaalsContact C-N 3.34Å; D63-C65 PolarHBondContact O-N 2.92Å; D63-L66 PolarHBondContact O-N 3.33Å; D63-A67 WeakPolarHBondContact O-CB 3.35Å; D63-A67 PolarHBondContact O-N 2.73Å; D63-H109 IonicContact OD1-CE1 3.78Å; D63-H109 IonicContact OD1-NE2 3.63Å; D63-H109 IonicContact OD2-CE1 3.55Å; D63-H109 PolarHBondContact OD2-CE1 3.17Å; D63-H109 IonicContact OD2-NE2 2.64Å; D63-H109 PolarHBondContact OD2-NE2 3.21Å; D63-M113 HydrophobicContact CB-CE 4.47Å; D63-M113 WeakPolarHBondContact OD2-CE 3.45Å; D63-M113 WeakPolarHBondContact OD2-CG 3.44Å; D63-I144 HydrophobicContact CB-CD1 3.98Å; D63-I144 HydrophobicContact CB-CG1 4.21Å; D63-I144 HydrophobicContact CB-CG2 4.46Å; D63-I144 WeakPolarHBondContact OD1-CG2 3.39Å; D63-W148 PolarHBondContact OD1-NE1 3.46Å
64	L	98.2	Very high	97.2	Very high	4 Å²	4	28.9 Å²	28.9	2%	0.021	15%	0.154	C	C	.	.	H	α-helix	trans	-58.1	-43.4	172.4	-76.8	175.6	0	0	0	112.6	F60 L61 A67 D68 M113 L114 I117	F60-L64 PolarHBondContact O-N 3.05Å; F60-L64 VanDerWaalsContact O-N 3.1Å; L61-L64 PolarHBondContact O-N 3.48Å; L64-A67 PolarHBondContact O-N 3.09Å; L64-D68 WeakPolarHBondContact O-CB 3.42Å; L64-D68 PolarHBondContact O-N 2.99Å; L64-M113 HydrophobicContact CD2-CB 3.83Å; L64-M113 HydrophobicContact CG-CB 4.41Å; L64-L114 HydrophobicContact CD1-CD2 4.05Å; L64-I117 HydrophobicContact CD1-CD1 3.45Å; L64-I117 VanDerWaalsContact CD1-CD1 3.45Å; L64-I117 HydrophobicContact CG-CD1 4.21Å
65	C	98.2	Very high	97.3	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.007	14%	0.138	C	C	.	.	H	α-helix	trans	-66.7	-41.8	179.4	-65	0	0	0	0	111.9	N40 L43 L61 L62 D63 G69	N40-C65 HydrophobicContact CB-CB 4.11Å; N40-C65 WeakPolarHBondContact CB-O 3.35Å; N40-C65 WeakPolarHBondContact OD1-CA 3.4Å; L43-C65 VanDerWaalsContact CD1-SG 3.57Å; L61-C65 PolarHBondContact O-N 3.02Å; L61-C65 PolarHBondContact O-SG 2.88Å; L62-C65 PolarHBondContact O-N 3.05Å; D63-C65 VanDerWaalsContact C-N 3.34Å; D63-C65 PolarHBondContact O-N 2.92Å; C65-G69 PolarHBondContact O-N 3.15Å
66	L	98.1	Very high	97.4	Very high	85 Å²	85	19.8 Å²	19.8	45%	0.445	11%	0.114	S	C	.	.	H	α-helix	trans	-64.3	-44.5	176.4	-69.5	174	0	0	0	110.7	L62 D63 G69 I70	L62-L66 HydrophobicContact CD1-CD1 4.08Å; L62-L66 HydrophobicContact CD1-CG 4.11Å; L62-L66 HydrophobicContact CG-CD1 3.99Å; L62-L66 HydrophobicContact CG-CG 4.4Å; L62-L66 VanDerWaalsContact O-CG 3.3Å; L62-L66 WeakPolarHBondContact O-CG 3.32Å; L62-L66 PolarHBondContact O-N 3.2Å; D63-L66 PolarHBondContact O-N 3.33Å; L66-G69 PolarHBondContact O-N 2.82Å; L66-I70 WeakPolarHBondContact O-CB 3.35Å; L66-I70 WeakPolarHBondContact O-CD1 3.16Å; L66-I70 WeakPolarHBondContact O-CG1 3.4Å; L66-I70 PolarHBondContact O-N 2.94Å
67	A	98.3	Very high	97.5	Very high	5 Å²	5	21.6 Å²	21.6	4%	0.041	13%	0.125	C	C	.	.	H	α-helix	trans	-60.6	-48.3	176.7	0	0	0	0	0	112.3	D63 L64 I70 R71 F106	D63-A67 WeakPolarHBondContact O-CB 3.35Å; D63-A67 PolarHBondContact O-N 2.73Å; L64-A67 PolarHBondContact O-N 3.09Å; A67-I70 PolarHBondContact O-N 3.15Å; A67-R71 WeakPolarHBondContact O-CB 3.39Å; A67-R71 PolarHBondContact O-N 2.95Å; A67-F106 HydrophobicContact CB-CD1 3.93Å; A67-F106 HydrophobicContact CB-CE1 4.18Å
68	D	98	Very high	97.5	Very high	7 Å²	7	24.2 Å²	24.2	4%	0.037	14%	0.136	C	C	.	.	H	α-helix	trans	-68	-35.2	177.6	-82.5	-37.3	0	0	0	112.7	L64 R71 S72 N336	L64-D68 WeakPolarHBondContact O-CB 3.42Å; L64-D68 PolarHBondContact O-N 2.99Å; D68-R71 IonicContact OD1-CZ 3Å; D68-R71 IonicContact OD1-NE 3.81Å; D68-R71 PolarHBondContact OD1-NE 3.15Å; D68-R71 IonicContact OD1-NH2 3.4Å; D68-R71 PolarHBondContact OD1-NH2 3.41Å; D68-S72 WeakPolarHBondContact O-CB 2.63Å; D68-S72 PolarHBondContact O-N 3.45Å; D68-S72 PolarHBondContact O-OG 3.45Å; D68-N336 PolarHBondContact OD2-ND2 2.78Å
69	G	97.7	Very high	97.5	Very high	15 Å²	15	24.1 Å²	24.1	16%	0.155	14%	0.136	C	C	.	.	H	α-helix	trans	-62	-49.1	172.9	0	0	0	0	0	111.9	L37 C65 L66 S72 A73	L37-G69 WeakPolarHBondContact CD2-O 3.31Å; C65-G69 PolarHBondContact O-N 3.15Å; L66-G69 PolarHBondContact O-N 2.82Å; G69-S72 PolarHBondContact O-N 3.1Å; G69-A73 WeakPolarHBondContact O-CB 3.44Å; G69-A73 PolarHBondContact O-N 3.33Å
70	I	97.7	Very high	97.4	Very high	76 Å²	76	23 Å²	23	39%	0.39	13%	0.134	S	C	.	.	H	α-helix	trans	-63.8	-45.1	177	-64.5	162.9	0	0	0	110.4	L66 A67 S72 A73 V74 F106	L66-I70 WeakPolarHBondContact O-CB 3.35Å; L66-I70 WeakPolarHBondContact O-CD1 3.16Å; L66-I70 WeakPolarHBondContact O-CG1 3.4Å; L66-I70 PolarHBondContact O-N 2.94Å; A67-I70 PolarHBondContact O-N 3.15Å; I70-S72 VanDerWaalsContact C-N 3.27Å; I70-S72 PolarHBondContact O-N 2.94Å; I70-A73 PolarHBondContact O-N 3.18Å; I70-V74 HydrophobicContact CG2-CG2 3.94Å; I70-V74 WeakPolarHBondContact O-CB 3.44Å; I70-V74 WeakPolarHBondContact O-CG2 3.37Å; I70-V74 PolarHBondContact O-N 2.92Å; I70-F106 HydrophobicContact CB-CE1 4.21Å; I70-F106 HydrophobicContact CB-CZ 3.82Å; I70-F106 HydrophobicContact CG2-CE1 4.25Å; I70-F106 HydrophobicContact CG2-CE2 3.96Å; I70-F106 HydrophobicContact CG2-CZ 3.39Å
71	R	97.8	Very high	97.3	Very high	15 Å²	15	24 Å²	24	6%	0.057	14%	0.142	C	C	.	.	H	α-helix	trans	-56.3	-42.9	175.4	-177.8	174.6	59.3	101	-10.2	111.8	A67 D68 C75 F106 A333	A67-R71 WeakPolarHBondContact O-CB 3.39Å; A67-R71 PolarHBondContact O-N 2.95Å; D68-R71 IonicContact OD1-CZ 3Å; D68-R71 IonicContact OD1-NE 3.81Å; D68-R71 PolarHBondContact OD1-NE 3.15Å; D68-R71 IonicContact OD1-NH2 3.4Å; D68-R71 PolarHBondContact OD1-NH2 3.41Å; R71-C75 HydrophobicContact CG-CB 4.46Å; R71-C75 VanDerWaalsContact O-CB 3.27Å; R71-C75 WeakPolarHBondContact O-CB 3.21Å; R71-C75 PolarHBondContact O-N 3.03Å; R71-F106 HydrophobicContact CB-CB 4.12Å; R71-F106 HydrophobicContact CB-CD2 3.71Å; R71-F106 HydrophobicContact CB-CE2 4.31Å; R71-F106 HydrophobicContact CB-CG 3.88Å; R71-F106 HydrophobicContact CG-CB 4.21Å; R71-F106 HydrophobicContact CG-CD2 4.11Å; R71-F106 HydrophobicContact CG-CG 4.38Å; R71-A333 VanDerWaalsContact NH2-N 3.13Å
72	S	97.5	Very high	97.1	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-72	-33.7	179.7	-53.6	0	0	0	0	112.5	S36 D68 G69 I70 F76 P77 A333	S36-S72 WeakPolarHBondContact CB-OG 3.36Å; S36-S72 PolarHBondContact OG-OG 3.18Å; D68-S72 WeakPolarHBondContact O-CB 2.63Å; D68-S72 PolarHBondContact O-N 3.45Å; D68-S72 PolarHBondContact O-OG 3.45Å; G69-S72 PolarHBondContact O-N 3.1Å; I70-S72 VanDerWaalsContact C-N 3.27Å; I70-S72 PolarHBondContact O-N 2.94Å; S72-F76 WeakPolarHBondContact O-CB 3.27Å; S72-P77 WeakPolarHBondContact O-CD 3.42Å; S72-A333 WeakPolarHBondContact OG-CB 3.46Å
73	A	97.2	Very high	97	Very high	51 Å²	51	23 Å²	23	42%	0.421	14%	0.137	S	C	.	.	H	α-helix	trans	-74.8	-34.7	177.6	0	0	0	0	0	112.4	L37 G69 I70 P77	L37-A73 HydrophobicContact CD2-CB 3.83Å; G69-A73 WeakPolarHBondContact O-CB 3.44Å; G69-A73 PolarHBondContact O-N 3.33Å; I70-A73 PolarHBondContact O-N 3.18Å; A73-P77 VanDerWaalsContact O-CG 3.31Å; A73-P77 WeakPolarHBondContact O-CG 3.41Å
74	V	95.7	Very high	96.8	Very high	47 Å²	47	30 Å²	30	29%	0.285	16%	0.162	S	C	.	.	H	α-helix	trans	-94.8	-56.1	-174.4	177.3	0	0	0	0	111.3	I70 F78	I70-V74 HydrophobicContact CG2-CG2 3.94Å; I70-V74 WeakPolarHBondContact O-CB 3.44Å; I70-V74 WeakPolarHBondContact O-CG2 3.37Å; I70-V74 PolarHBondContact O-N 2.92Å; V74-F78 WeakPolarHBondContact O-CD2 3.4Å; V74-F78 WeakPolarHBondContact O-CE2 3.32Å
75	C	96.6	Very high	96.5	Very high	4 Å²	4	34.4 Å²	34.4	3%	0.027	18%	0.182	C	C	.	.	H	α-helix	trans	-77.8	-44.4	-170.5	-59.9	0	0	0	0	112.8	R71 F78 V79 V99	R71-C75 HydrophobicContact CG-CB 4.46Å; R71-C75 VanDerWaalsContact O-CB 3.27Å; R71-C75 WeakPolarHBondContact O-CB 3.21Å; R71-C75 PolarHBondContact O-N 3.03Å; C75-F78 PolarHBondContact O-N 3.2Å; C75-V79 PolarHBondContact O-N 3.42Å; C75-V99 HydrophobicContact CB-CG1 4.49Å
76	F	96.9	Very high	96.2	Very high	1 Å²	1	36.9 Å²	36.9	0%	0.004	21%	0.208	C	C	.	.	H	α-helix	trans	-65.8	-35	-170.5	-63.9	-6.7	0	0	0	115	L29 I32 M33 S72 F78 V79 L80 F330 A333	L29-F76 HydrophobicContact CD1-CB 4.49Å; L29-F76 HydrophobicContact CD1-CD2 4.4Å; L29-F76 HydrophobicContact CD1-CG 4.28Å; I32-F76 HydrophobicContact CG2-CE2 3.89Å; M33-F76 HydrophobicContact CB-CD2 4.06Å; M33-F76 HydrophobicContact CG-CB 4.36Å; M33-F76 HydrophobicContact CG-CD2 4.38Å; M33-F76 HydrophobicContact SD-CB 4.34Å; S72-F76 WeakPolarHBondContact O-CB 3.27Å; F76-F78 VanDerWaalsContact C-N 3.28Å; F76-F78 PolarHBondContact O-N 3.48Å; F76-V79 PolarHBondContact O-N 3Å; F76-L80 WeakPolarHBondContact O-CB 3.4Å; F76-L80 PolarHBondContact O-N 2.83Å; F76-F330 HydrophobicContact CD1-CD1 4.24Å; F76-F330 HydrophobicContact CE1-CB 4.32Å; F76-F330 AromaticContact CE1-CD1 3.56Å; F76-F330 HydrophobicContact CE1-CD1 3.56Å; F76-F330 HydrophobicContact CE1-CE1 4.19Å; F76-F330 HydrophobicContact CE1-CG 4.19Å; F76-F330 HydrophobicContact CZ-CB 4.11Å; F76-F330 HydrophobicContact CZ-CD1 4.18Å; F76-F330 HydrophobicContact CZ-CG 4.48Å; F76-A333 HydrophobicContact CE2-CB 3.85Å; F76-A333 HydrophobicContact CZ-CB 3.81Å
77	P	96.7	Very high	95.9	Very high	47 Å²	47	34.2 Å²	34.2	31%	0.305	20%	0.197	S	C	.	.	H	α-helix	trans	-59	-37.6	174.1	-28.2	36.9	0	0	0	113.5	M33 S72 A73 L80 A81	M33-P77 HydrophobicContact CE-CG 3.76Å; M33-P77 HydrophobicContact SD-CG 4.3Å; S72-P77 WeakPolarHBondContact O-CD 3.42Å; A73-P77 VanDerWaalsContact O-CG 3.31Å; A73-P77 WeakPolarHBondContact O-CG 3.41Å; P77-L80 PolarHBondContact O-N 3.46Å; P77-A81 WeakPolarHBondContact O-CB 3.33Å; P77-A81 PolarHBondContact O-N 3.14Å
78	F	96.4	Very high	95.6	Very high	55 Å²	55	36.2 Å²	36.2	24%	0.241	21%	0.21	C	C	.	.	H	α-helix	trans	-68	-40.2	176.5	-68.3	-78.3	0	0	0	111.8	V74 C75 F76 A81 S82 W89 F91 V99	V74-F78 WeakPolarHBondContact O-CD2 3.4Å; V74-F78 WeakPolarHBondContact O-CE2 3.32Å; C75-F78 PolarHBondContact O-N 3.2Å; F76-F78 VanDerWaalsContact C-N 3.28Å; F76-F78 PolarHBondContact O-N 3.48Å; F78-A81 PolarHBondContact O-N 3.08Å; F78-S82 WeakPolarHBondContact O-CB 3.42Å; F78-S82 PolarHBondContact O-N 2.92Å; F78-W89 HydrophobicContact CB-CH2 3.75Å; F78-W89 HydrophobicContact CB-CZ3 3.94Å; F78-W89 AromaticContact CD1-CH2 3.9Å; F78-W89 HydrophobicContact CD1-CH2 3.9Å; F78-W89 HydrophobicContact CD1-CZ2 4.32Å; F78-W89 AromaticContact CG-CH2 3.99Å; F78-W89 HydrophobicContact CG-CH2 3.99Å; F78-F91 HydrophobicContact CD1-CD1 4.47Å; F78-F91 AromaticContact CD1-CD2 3.82Å; F78-F91 HydrophobicContact CD1-CD2 3.82Å; F78-F91 HydrophobicContact CD1-CE1 4.36Å; F78-F91 AromaticContact CD1-CE2 3.71Å; F78-F91 HydrophobicContact CD1-CE2 3.71Å; F78-F91 HydrophobicContact CD1-CG 4.21Å; F78-F91 AromaticContact CD1-CZ 3.99Å; F78-F91 HydrophobicContact CD1-CZ 3.99Å; F78-F91 HydrophobicContact CE1-CD1 4.27Å; F78-F91 HydrophobicContact CE1-CD2 4.37Å; F78-F91 HydrophobicContact CE1-CE1 4.29Å; F78-F91 HydrophobicContact CE1-CE2 4.41Å; F78-F91 HydrophobicContact CE1-CG 4.31Å; F78-F91 HydrophobicContact CE1-CZ 4.35Å; F78-V99 HydrophobicContact CB-CG1 4.48Å; F78-V99 HydrophobicContact CB-CG2 4.35Å; F78-V99 HydrophobicContact CD1-CG2 4.41Å; F78-V99 HydrophobicContact CD2-CG2 3.4Å; F78-V99 HydrophobicContact CE2-CG2 3.71Å; F78-V99 HydrophobicContact CG-CG2 3.81Å; F78-V99 HydrophobicContact CZ-CG2 4.33Å
79	V	96	Very high	95.5	Very high	2 Å²	2	37.9 Å²	37.9	1%	0.012	22%	0.216	C	C	.	.	H	α-helix	trans	-62.7	-45.1	174.2	-176.9	0	0	0	0	110.2	L29 C75 F76 A81 S82 V83 D172 Q173 F330	L29-V79 HydrophobicContact CD2-CB 3.88Å; L29-V79 HydrophobicContact CD2-CG1 3.64Å; C75-V79 PolarHBondContact O-N 3.42Å; F76-V79 PolarHBondContact O-N 3Å; V79-A81 VanDerWaalsContact C-N 3.34Å; V79-A81 PolarHBondContact O-N 3.38Å; V79-S82 PolarHBondContact O-N 3.38Å; V79-S82 VanDerWaalsContact O-N 3.15Å; V79-V83 WeakPolarHBondContact O-CG2 3.26Å; V79-V83 PolarHBondContact O-N 3.36Å; V79-D172 HydrophobicContact CG1-CB 4.36Å; V79-Q173 HydrophobicContact CG2-CB 3.73Å; V79-F330 HydrophobicContact CG1-CE2 3.92Å; V79-F330 HydrophobicContact CG1-CZ 3.88Å; V79-F330 HydrophobicContact CG2-CE1 4.48Å; V79-F330 HydrophobicContact CG2-CZ 4.06Å
80	L	95.8	Very high	95.3	Very high	30 Å²	30	41 Å²	41	16%	0.157	23%	0.233	C	C	.	.	H	α-helix	trans	-60.9	-43.3	177.5	-167.6	74.2	0	0	0	111.6	L26 L29 F76 P77 V83 R84	L26-L80 HydrophobicContact CB-CD1 4.3Å; L26-L80 HydrophobicContact CD2-CD1 3.47Å; L26-L80 VanDerWaalsContact CD2-CD1 3.47Å; L26-L80 HydrophobicContact CD2-CG 4Å; L29-L80 HydrophobicContact CB-CD1 4.17Å; L29-L80 HydrophobicContact CD2-CB 4.04Å; L29-L80 HydrophobicContact CD2-CD1 4.1Å; L29-L80 HydrophobicContact CG-CD1 4.38Å; F76-L80 WeakPolarHBondContact O-CB 3.4Å; F76-L80 PolarHBondContact O-N 2.83Å; P77-L80 PolarHBondContact O-N 3.46Å; L80-V83 PolarHBondContact O-N 3.4Å; L80-R84 WeakPolarHBondContact O-CG 3.41Å; L80-R84 PolarHBondContact O-N 3.42Å
81	A	95.9	Very high	95.1	Very high	20 Å²	20	41.4 Å²	41.4	17%	0.165	23%	0.231	C	C	.	.	H	α-helix	trans	-63.6	-40.2	175.1	0	0	0	0	0	111.8	P77 F78 V79 R84 H85 F91	P77-A81 WeakPolarHBondContact O-CB 3.33Å; P77-A81 PolarHBondContact O-N 3.14Å; F78-A81 PolarHBondContact O-N 3.08Å; V79-A81 VanDerWaalsContact C-N 3.34Å; V79-A81 PolarHBondContact O-N 3.38Å; A81-R84 PolarHBondContact O-N 3.28Å; A81-H85 PolarHBondContact O-N 3.42Å; A81-H85 VanDerWaalsContact O-N 3.09Å; A81-H85 PolarHBondContact O-ND1 2.87Å; A81-F91 HydrophobicContact CB-CE2 3.78Å; A81-F91 HydrophobicContact CB-CZ 3.73Å
82	S	95	Very high	95	Very high	0 Å²	0	44 Å²	44	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-64	-43.8	177.2	-172	0	0	0	0	112.2	F78 V79 R84 H85 G86 S87 S88 F167 D172	F78-S82 WeakPolarHBondContact O-CB 3.42Å; F78-S82 PolarHBondContact O-N 2.92Å; V79-S82 PolarHBondContact O-N 3.38Å; V79-S82 VanDerWaalsContact O-N 3.15Å; S82-R84 VanDerWaalsContact C-N 3.31Å; S82-R84 PolarHBondContact O-N 3.48Å; S82-H85 CarbonylContact O-C 3.55Å; S82-H85 PolarHBondContact O-N 3.27Å; S82-G86 PolarHBondContact O-N 2.92Å; S82-S87 WeakPolarHBondContact O-CA 3.46Å; S82-S87 PolarHBondContact O-N 3.1Å; S82-S88 WeakPolarHBondContact CA-O 3.28Å; S82-S88 WeakPolarHBondContact CB-O 3.43Å; S82-S88 PolarHBondContact OG-O 3.22Å; S82-F167 WeakPolarHBondContact OG-CE2 3.35Å; S82-F167 WeakPolarHBondContact OG-CZ 3.44Å; S82-D172 WeakPolarHBondContact CB-O 3.24Å
83	V	94.3	Very high	94.7	Very high	4 Å²	4	47.7 Å²	47.7	2%	0.024	28%	0.283	C	S	.	.	H	α-helix	trans	-61.7	-39.5	175	177	0	0	0	0	111.2	A22 K25 L26 V79 L80 H85 G86 D172	A22-V83 HydrophobicContact CB-CG1 4.39Å; K25-V83 HydrophobicContact CB-CG1 3.8Å; K25-V83 HydrophobicContact CD-CG1 4.21Å; K25-V83 HydrophobicContact CD-CG2 4.49Å; L26-V83 HydrophobicContact CD2-CB 3.76Å; L26-V83 HydrophobicContact CD2-CG1 3.57Å; L26-V83 HydrophobicContact CG-CG1 3.78Å; V79-V83 WeakPolarHBondContact O-CG2 3.26Å; V79-V83 PolarHBondContact O-N 3.36Å; L80-V83 PolarHBondContact O-N 3.4Å; V83-H85 VanDerWaalsContact C-N 3.34Å; V83-H85 PolarHBondContact O-N 2.94Å; V83-G86 PolarHBondContact O-N 2.81Å; V83-D172 HydrophobicContact CG2-CB 3.64Å
84	R	94.4	Very high	94.6	Very high	160 Å²	160	50.9 Å²	50.9	60%	0.604	29%	0.292	S	S	*	.	H	α-helix	trans	-63.5	-36.9	176.7	-75.7	-172.2	-177.2	179.5	1.2	112.9	L26 L80 A81 S82 G86	L26-R84 HydrophobicContact CD1-CG 3.79Å; L26-R84 HydrophobicContact CD2-CG 3.52Å; L26-R84 HydrophobicContact CG-CG 4.32Å; L80-R84 WeakPolarHBondContact O-CG 3.41Å; L80-R84 PolarHBondContact O-N 3.42Å; A81-R84 PolarHBondContact O-N 3.28Å; S82-R84 VanDerWaalsContact C-N 3.31Å; S82-R84 PolarHBondContact O-N 3.48Å; R84-G86 VanDerWaalsContact C-N 3.28Å; R84-G86 PolarHBondContact O-N 3.38Å
85	H	93	Very high	94.5	Very high	97 Å²	97	49.6 Å²	49.6	45%	0.449	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	31	-179.9	-61.5	94.1	0	0	0	112.8	A81 S82 V83 S88 T90	A81-H85 PolarHBondContact O-N 3.42Å; A81-H85 VanDerWaalsContact O-N 3.09Å; A81-H85 PolarHBondContact O-ND1 2.87Å; S82-H85 CarbonylContact O-C 3.55Å; S82-H85 PolarHBondContact O-N 3.27Å; V83-H85 VanDerWaalsContact C-N 3.34Å; V83-H85 PolarHBondContact O-N 2.94Å; H85-S88 PolarHBondContact O-OG 2.94Å; H85-T90 HydrophobicContact CB-CG2 3.99Å
86	G	90.9	Very high	94.5	Very high	54 Å²	54	49.9 Å²	49.9	56%	0.557	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.5	38.4	172.4	0	0	0	0	0	114.8	S82 V83 R84 S88	S82-G86 PolarHBondContact O-N 2.92Å; V83-G86 PolarHBondContact O-N 2.81Å; R84-G86 VanDerWaalsContact C-N 3.28Å; R84-G86 PolarHBondContact O-N 3.38Å; G86-S88 VanDerWaalsContact C-N 3.33Å; G86-S88 PolarHBondContact O-N 3.01Å
87	S	92.1	Very high	94.3	Very high	28 Å²	28	53.6 Å²	53.6	20%	0.196	30%	0.303	C	S	.	.	S	Bend	trans	61.3	41.2	-178.2	-52.9	0	0	0	0	112.1	S82 F167 R169 D172	S82-S87 WeakPolarHBondContact O-CA 3.46Å; S82-S87 PolarHBondContact O-N 3.1Å; S87-F167 WeakPolarHBondContact O-CE1 3.44Å; S87-F167 WeakPolarHBondContact O-CZ 3.31Å; S87-R169 WeakPolarHBondContact O-CG 3.16Å; S87-D172 WeakPolarHBondContact CB-OD1 3.37Å; S87-D172 PolarHBondContact OG-OD1 3.43Å
88	S	93.1	Very high	94.3	Very high	47 Å²	47	55.6 Å²	55.6	33%	0.329	31%	0.31	S	S	.	.			trans	-118.4	151.8	176.1	69.7	0	0	0	0	110.9	S82 H85 G86	S82-S88 WeakPolarHBondContact CA-O 3.28Å; S82-S88 WeakPolarHBondContact CB-O 3.43Å; S82-S88 PolarHBondContact OG-O 3.22Å; H85-S88 PolarHBondContact O-OG 2.94Å; G86-S88 VanDerWaalsContact C-N 3.33Å; G86-S88 PolarHBondContact O-N 3.01Å
89	W	94.4	Very high	94.3	Very high	42 Å²	42	53.1 Å²	53.1	16%	0.159	30%	0.3	C	S	.	.			trans	-98	100.9	173.1	-170.6	-92.8	0	0	0	109.6	F78 F91 S92 S95 C96 V99 F167 C174	F78-W89 HydrophobicContact CB-CH2 3.75Å; F78-W89 HydrophobicContact CB-CZ3 3.94Å; F78-W89 AromaticContact CD1-CH2 3.9Å; F78-W89 HydrophobicContact CD1-CH2 3.9Å; F78-W89 HydrophobicContact CD1-CZ2 4.32Å; F78-W89 AromaticContact CG-CH2 3.99Å; F78-W89 HydrophobicContact CG-CH2 3.99Å; W89-F91 HydrophobicContact CD2-CD2 4.34Å; W89-F91 HydrophobicContact CH2-CD2 4.35Å; W89-F91 HydrophobicContact CZ2-CB 4.03Å; W89-F91 HydrophobicContact CZ2-CD2 4.06Å; W89-F91 HydrophobicContact CZ2-CG 4.43Å; W89-F91 PolarHBondContact NE1-O 3.43Å; W89-S92 PolarHBondContact NE1-O 3.29Å; W89-S92 VanDerWaalsContact NE1-O 3.13Å; W89-S95 WeakPolarHBondContact CZ2-OG 3.31Å; W89-C96 HydrophobicContact CD2-CB 4.26Å; W89-C96 VanDerWaalsContact CZ2-CA 3.42Å; W89-C96 HydrophobicContact CZ2-CB 3.9Å; W89-V99 HydrophobicContact CH2-CB 4.19Å; W89-V99 HydrophobicContact CH2-CG1 4.37Å; W89-V99 HydrophobicContact CH2-CG2 4.1Å; W89-F167 HydrophobicContact CB-CB 4Å; W89-F167 HydrophobicContact CB-CD1 4.04Å; W89-F167 HydrophobicContact CB-CD2 3.75Å; W89-F167 HydrophobicContact CB-CE1 4.48Å; W89-F167 HydrophobicContact CB-CE2 4.22Å; W89-F167 HydrophobicContact CB-CG 3.65Å; W89-F167 HydrophobicContact CD2-CD2 4.27Å; W89-F167 AromaticContact CE3-CD2 3.75Å; W89-F167 HydrophobicContact CE3-CD2 3.75Å; W89-F167 HydrophobicContact CE3-CE2 4.12Å; W89-F167 HydrophobicContact CG-CB 4.48Å; W89-F167 HydrophobicContact CG-CD2 4.32Å; W89-F167 HydrophobicContact CG-CG 4.43Å; W89-C174 HydrophobicContact CZ3-CB 4.41Å
90	T	93.6	Very high	94.3	Very high	82 Å²	82	53 Å²	53	50%	0.503	30%	0.299	S	S	.	.			trans	-90.2	-4.5	-177.4	54.8	0	0	0	0	113.5	H85	H85-T90 HydrophobicContact CB-CG2 3.99Å
91	F	94.5	Very high	94.3	Very high	83 Å²	83	53.4 Å²	53.4	36%	0.364	30%	0.3	S	S	.	.	S	Bend	trans	-90.7	177.4	178.5	-51.4	-84.5	0	0	0	111.9	F78 A81 W89 S95	F78-F91 HydrophobicContact CD1-CD1 4.47Å; F78-F91 AromaticContact CD1-CD2 3.82Å; F78-F91 HydrophobicContact CD1-CD2 3.82Å; F78-F91 HydrophobicContact CD1-CE1 4.36Å; F78-F91 AromaticContact CD1-CE2 3.71Å; F78-F91 HydrophobicContact CD1-CE2 3.71Å; F78-F91 HydrophobicContact CD1-CG 4.21Å; F78-F91 AromaticContact CD1-CZ 3.99Å; F78-F91 HydrophobicContact CD1-CZ 3.99Å; F78-F91 HydrophobicContact CE1-CD1 4.27Å; F78-F91 HydrophobicContact CE1-CD2 4.37Å; F78-F91 HydrophobicContact CE1-CE1 4.29Å; F78-F91 HydrophobicContact CE1-CE2 4.41Å; F78-F91 HydrophobicContact CE1-CG 4.31Å; F78-F91 HydrophobicContact CE1-CZ 4.35Å; A81-F91 HydrophobicContact CB-CE2 3.78Å; A81-F91 HydrophobicContact CB-CZ 3.73Å; W89-F91 HydrophobicContact CD2-CD2 4.34Å; W89-F91 HydrophobicContact CH2-CD2 4.35Å; W89-F91 HydrophobicContact CZ2-CB 4.03Å; W89-F91 HydrophobicContact CZ2-CD2 4.06Å; W89-F91 HydrophobicContact CZ2-CG 4.43Å; W89-F91 PolarHBondContact NE1-O 3.43Å; F91-S95 WeakPolarHBondContact CB-OG 3.49Å
92	S	94.6	Very high	94.3	Very high	69 Å²	69	54.7 Å²	54.7	48%	0.483	30%	0.303	S	S	.	.			trans	-64.6	154.7	179.8	71.6	0	0	0	0	112.9	W89 L94 S95 C96	W89-S92 PolarHBondContact NE1-O 3.29Å; W89-S92 VanDerWaalsContact NE1-O 3.13Å; S92-L94 PolarHBondContact O-N 3.2Å; S92-S95 PolarHBondContact N-OG 3.38Å; S92-S95 PolarHBondContact O-N 3Å; S92-S95 PolarHBondContact O-OG 3.36Å; S92-S95 PolarHBondContact OG-N 3.46Å; S92-S95 VanDerWaalsContact OG-N 3.12Å; S92-S95 PolarHBondContact OG-OG 2.87Å; S92-C96 PolarHBondContact O-N 3.36Å
93	A	92.5	Very high	94.3	Very high	79 Å²	79	55.4 Å²	55.4	65%	0.653	31%	0.309	S	S	*	.	H	α-helix	trans	-59.9	-33	173.2	0	0	0	0	0	112.5	C96 K97	A93-C96 WeakPolarHBondContact O-CB 3.48Å; A93-C96 PolarHBondContact O-N 3.5Å; A93-K97 PolarHBondContact O-N 2.64Å; A93-K97 VanDerWaalsContact O-N 3.16Å
94	L	93.6	Very high	94.4	Very high	118 Å²	118	56.2 Å²	56.2	62%	0.618	31%	0.313	S	S	*	.	H	α-helix	trans	-64.1	-45.9	175.1	177.9	60.8	0	0	0	111.6	S92 C96 K97 I98	S92-L94 PolarHBondContact O-N 3.2Å; L94-C96 VanDerWaalsContact C-N 3.26Å; L94-C96 PolarHBondContact O-N 2.93Å; L94-K97 PolarHBondContact O-N 2.83Å; L94-K97 VanDerWaalsContact O-N 3.16Å; L94-I98 HydrophobicContact CD1-CD1 4.1Å; L94-I98 HydrophobicContact CD1-CG1 4.29Å; L94-I98 HydrophobicContact CG-CD1 3.89Å; L94-I98 HydrophobicContact CG-CG1 4.49Å; L94-I98 WeakPolarHBondContact O-CG1 3.43Å; L94-I98 PolarHBondContact O-N 2.99Å
95	S	94.9	Very high	94.5	Very high	20 Å²	20	49 Å²	49	14%	0.14	29%	0.287	C	S	.	.	H	α-helix	trans	-61.5	-36.2	177.7	66.7	0	0	0	0	112.1	W89 F91 S92 I98 V99	W89-S95 WeakPolarHBondContact CZ2-OG 3.31Å; F91-S95 WeakPolarHBondContact CB-OG 3.49Å; S92-S95 PolarHBondContact N-OG 3.38Å; S92-S95 PolarHBondContact O-N 3Å; S92-S95 PolarHBondContact O-OG 3.36Å; S92-S95 PolarHBondContact OG-N 3.46Å; S92-S95 VanDerWaalsContact OG-N 3.12Å; S92-S95 PolarHBondContact OG-OG 2.87Å; S95-I98 PolarHBondContact O-N 3.06Å; S95-V99 WeakPolarHBondContact O-CB 3.32Å; S95-V99 VanDerWaalsContact O-CG2 3.31Å; S95-V99 WeakPolarHBondContact O-CG2 3.37Å; S95-V99 PolarHBondContact O-N 3.14Å
96	C	95.2	Very high	94.7	Very high	9 Å²	9	44.6 Å²	44.6	6%	0.061	27%	0.267	C	S	.	.	H	α-helix	trans	-59.8	-48.2	173.6	-175.7	0	0	0	0	111.7	W89 S92 A93 L94 I98 V99 A100 F167 C174	W89-C96 HydrophobicContact CD2-CB 4.26Å; W89-C96 VanDerWaalsContact CZ2-CA 3.42Å; W89-C96 HydrophobicContact CZ2-CB 3.9Å; S92-C96 PolarHBondContact O-N 3.36Å; A93-C96 WeakPolarHBondContact O-CB 3.48Å; A93-C96 PolarHBondContact O-N 3.5Å; L94-C96 VanDerWaalsContact C-N 3.26Å; L94-C96 PolarHBondContact O-N 2.93Å; C96-I98 PolarHBondContact O-N 3.16Å; C96-V99 PolarHBondContact O-N 3.08Å; C96-A100 VanDerWaalsContact O-CB 3.31Å; C96-A100 WeakPolarHBondContact O-CB 3.47Å; C96-A100 PolarHBondContact O-N 2.92Å; C96-F167 PolarHBondContact SG-N 2.89Å; C96-C174 WeakPolarHBondContact CA-SG 3.47Å; C96-C174 HydrophobicContact CB-CB 4.01Å; C96-C174 WeakPolarHBondContact CB-SG 3.36Å; C96-C174 WeakPolarHBondContact O-CB 3.46Å; C96-C174 WeakPolarHBondContact SG-CB 3.18Å; C96-C174 CovalentContact SG-SG 2.03Å; C96-C174 PolarHBondContact SG-SG 3.36Å
97	K	94.6	Very high	94.9	Very high	80 Å²	80	42.5 Å²	42.5	35%	0.348	24%	0.243	S	C	.	.	H	α-helix	trans	-61.2	-43.2	177	-70.4	-175.1	177.6	-169.9	0	112.2	A93 L94 A100 F101	A93-K97 PolarHBondContact O-N 2.64Å; A93-K97 VanDerWaalsContact O-N 3.16Å; L94-K97 PolarHBondContact O-N 2.83Å; L94-K97 VanDerWaalsContact O-N 3.16Å; K97-A100 PolarHBondContact O-N 3.45Å; K97-F101 VanDerWaalsContact O-CB 3.29Å; K97-F101 WeakPolarHBondContact O-CB 3.45Å; K97-F101 PolarHBondContact O-N 3.13Å
98	I	95.3	Very high	95	Very high	88 Å²	88	41.8 Å²	41.8	45%	0.451	24%	0.236	S	C	.	.	H	α-helix	trans	-63.7	-47.5	178.7	-67.5	168.7	0	0	0	110.7	L94 S95 C96 A100 F101 M102	L94-I98 HydrophobicContact CD1-CD1 4.1Å; L94-I98 HydrophobicContact CD1-CG1 4.29Å; L94-I98 HydrophobicContact CG-CD1 3.89Å; L94-I98 HydrophobicContact CG-CG1 4.49Å; L94-I98 WeakPolarHBondContact O-CG1 3.43Å; L94-I98 PolarHBondContact O-N 2.99Å; S95-I98 PolarHBondContact O-N 3.06Å; C96-I98 PolarHBondContact O-N 3.16Å; I98-A100 VanDerWaalsContact C-N 3.35Å; I98-A100 PolarHBondContact O-N 3.45Å; I98-F101 PolarHBondContact O-N 2.91Å; I98-M102 HydrophobicContact CG2-CG 4.34Å; I98-M102 WeakPolarHBondContact O-CB 3.26Å; I98-M102 VanDerWaalsContact O-CG 3.25Å; I98-M102 WeakPolarHBondContact O-CG 3.49Å; I98-M102 PolarHBondContact O-N 3.38Å
99	V	96.4	Very high	95.3	Very high	4 Å²	4	39.5 Å²	39.5	2%	0.024	22%	0.221	C	C	.	.	H	α-helix	trans	-63.9	-41.8	-180	170.4	0	0	0	0	111.1	C75 F78 W89 S95 C96 M102 A103	C75-V99 HydrophobicContact CB-CG1 4.49Å; F78-V99 HydrophobicContact CB-CG1 4.48Å; F78-V99 HydrophobicContact CB-CG2 4.35Å; F78-V99 HydrophobicContact CD1-CG2 4.41Å; F78-V99 HydrophobicContact CD2-CG2 3.4Å; F78-V99 HydrophobicContact CE2-CG2 3.71Å; F78-V99 HydrophobicContact CG-CG2 3.81Å; F78-V99 HydrophobicContact CZ-CG2 4.33Å; W89-V99 HydrophobicContact CH2-CB 4.19Å; W89-V99 HydrophobicContact CH2-CG1 4.37Å; W89-V99 HydrophobicContact CH2-CG2 4.1Å; S95-V99 WeakPolarHBondContact O-CB 3.32Å; S95-V99 VanDerWaalsContact O-CG2 3.31Å; S95-V99 WeakPolarHBondContact O-CG2 3.37Å; S95-V99 PolarHBondContact O-N 3.14Å; C96-V99 PolarHBondContact O-N 3.08Å; V99-M102 PolarHBondContact O-N 3.31Å; V99-A103 WeakPolarHBondContact O-CB 3.21Å; V99-A103 PolarHBondContact O-N 2.98Å
100	A	95.6	Very high	95.4	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-63.1	-46.4	176	0	0	0	0	0	112.1	C96 K97 I98 M102 A103 V104 Y165 C174	C96-A100 VanDerWaalsContact O-CB 3.31Å; C96-A100 WeakPolarHBondContact O-CB 3.47Å; C96-A100 PolarHBondContact O-N 2.92Å; K97-A100 PolarHBondContact O-N 3.45Å; I98-A100 VanDerWaalsContact C-N 3.35Å; I98-A100 PolarHBondContact O-N 3.45Å; A100-M102 PolarHBondContact O-N 2.89Å; A100-A103 PolarHBondContact O-N 3.47Å; A100-V104 WeakPolarHBondContact O-CG2 3.41Å; A100-V104 PolarHBondContact O-N 3.46Å; A100-Y165 HydrophobicContact CB-CD1 3.4Å; A100-Y165 VanDerWaalsContact CB-CD1 3.4Å; A100-Y165 HydrophobicContact CB-CE1 4.06Å; A100-Y165 HydrophobicContact CB-CG 3.72Å; A100-C174 VanDerWaalsContact CA-O 3.28Å; A100-C174 WeakPolarHBondContact CA-O 3.37Å; A100-C174 HydrophobicContact CB-CB 3.99Å; A100-C174 WeakPolarHBondContact CB-O 3.49Å
101	F	95.9	Very high	95.6	Very high	38 Å²	38	34 Å²	34	17%	0.167	19%	0.192	C	C	.	.	H	α-helix	trans	-57.5	-49.1	174.8	169.3	-99.1	0	0	0	111.4	K97 I98 A103 V104 L105 A155 F156 V159 Y165	K97-F101 VanDerWaalsContact O-CB 3.29Å; K97-F101 WeakPolarHBondContact O-CB 3.45Å; K97-F101 PolarHBondContact O-N 3.13Å; I98-F101 PolarHBondContact O-N 2.91Å; F101-A103 PolarHBondContact O-N 2.85Å; F101-V104 PolarHBondContact O-N 3.2Å; F101-L105 HydrophobicContact CE1-CD2 3.81Å; F101-L105 HydrophobicContact CZ-CD2 4.07Å; F101-L105 WeakPolarHBondContact O-CB 3.18Å; F101-L105 PolarHBondContact O-N 3.07Å; F101-A155 HydrophobicContact CD2-CB 3.9Å; F101-A155 WeakPolarHBondContact CD2-O 3.23Å; F101-A155 HydrophobicContact CE2-CB 3.65Å; F101-A155 HydrophobicContact CZ-CB 4.44Å; F101-F156 HydrophobicContact CE2-CB 4.32Å; F101-F156 HydrophobicContact CE2-CD2 4.14Å; F101-V159 HydrophobicContact CB-CG2 4.42Å; F101-V159 HydrophobicContact CD2-CG2 3.64Å; F101-V159 HydrophobicContact CE2-CG2 4.31Å; F101-V159 HydrophobicContact CG-CG2 4.29Å; F101-Y165 HydrophobicContact CB-CE2 4.09Å; F101-Y165 HydrophobicContact CD2-CE2 4.48Å
102	M	96.8	Very high	95.8	Very high	47 Å²	47	30.7 Å²	30.7	23%	0.232	18%	0.178	C	C	.	.	H	α-helix	trans	-62.4	-42.8	179.4	-70	-64	-107.4	0	0	111.6	I98 V99 A100 V104 L105 F106	I98-M102 HydrophobicContact CG2-CG 4.34Å; I98-M102 WeakPolarHBondContact O-CB 3.26Å; I98-M102 VanDerWaalsContact O-CG 3.25Å; I98-M102 WeakPolarHBondContact O-CG 3.49Å; I98-M102 PolarHBondContact O-N 3.38Å; V99-M102 PolarHBondContact O-N 3.31Å; A100-M102 PolarHBondContact O-N 2.89Å; M102-V104 VanDerWaalsContact C-N 3.35Å; M102-V104 PolarHBondContact O-N 3.19Å; M102-L105 PolarHBondContact O-N 3.42Å; M102-L105 HydrophobicContact SD-CD2 4Å; M102-F106 HydrophobicContact CB-CD2 4.32Å; M102-F106 HydrophobicContact CB-CE2 4.15Å; M102-F106 HydrophobicContact CE-CE2 4.05Å; M102-F106 HydrophobicContact CE-CZ 4.26Å; M102-F106 WeakPolarHBondContact O-CD2 3.07Å; M102-F106 PolarHBondContact O-N 3.25Å; M102-F106 HydrophobicContact SD-CE2 4.2Å
103	A	95.4	Very high	96	Very high	15 Å²	15	27.4 Å²	27.4	12%	0.124	16%	0.155	C	C	.	.	H	α-helix	trans	-59.7	-44.9	177.7	0	0	0	0	0	112	V99 A100 F101 C107	V99-A103 WeakPolarHBondContact O-CB 3.21Å; V99-A103 PolarHBondContact O-N 2.98Å; A100-A103 PolarHBondContact O-N 3.47Å; F101-A103 PolarHBondContact O-N 2.85Å; A103-C107 WeakPolarHBondContact O-CB 3.21Å; A103-C107 PolarHBondContact O-N 3.18Å
104	V	94.6	Very high	96.2	Very high	20 Å²	20	23.8 Å²	23.8	12%	0.121	12%	0.124	C	C	.	.	H	α-helix	trans	-68.6	-43.9	176.8	174.1	0	0	0	0	111.4	A100 F101 M102 F106 C107 F108 A155 Y165 F176	A100-V104 WeakPolarHBondContact O-CG2 3.41Å; A100-V104 PolarHBondContact O-N 3.46Å; F101-V104 PolarHBondContact O-N 3.2Å; M102-V104 VanDerWaalsContact C-N 3.35Å; M102-V104 PolarHBondContact O-N 3.19Å; V104-F106 PolarHBondContact O-N 3.49Å; V104-C107 WeakPolarHBondContact O-CB 3.46Å; V104-C107 PolarHBondContact O-N 3.27Å; V104-F108 HydrophobicContact CG1-CD2 3.66Å; V104-F108 HydrophobicContact CG1-CE2 3.74Å; V104-F108 WeakPolarHBondContact O-CD2 3.36Å; V104-F108 PolarHBondContact O-N 3.45Å; V104-A155 HydrophobicContact CB-CB 4.44Å; V104-A155 HydrophobicContact CG1-CB 4Å; V104-Y165 HydrophobicContact CB-CE1 4.5Å; V104-Y165 HydrophobicContact CG2-CE1 3.92Å; V104-F176 HydrophobicContact CG2-CB 4.17Å
105	L	96.8	Very high	96.4	Very high	9 Å²	9	21.1 Å²	21.1	5%	0.047	11%	0.108	C	C	.	.	H	α-helix	trans	-55.1	-51.7	177.7	176.2	65.5	0	0	0	111.6	F101 M102 C107 F108 H109 W148 V152 A155	F101-L105 HydrophobicContact CE1-CD2 3.81Å; F101-L105 HydrophobicContact CZ-CD2 4.07Å; F101-L105 WeakPolarHBondContact O-CB 3.18Å; F101-L105 PolarHBondContact O-N 3.07Å; M102-L105 PolarHBondContact O-N 3.42Å; M102-L105 HydrophobicContact SD-CD2 4Å; L105-C107 VanDerWaalsContact C-N 3.32Å; L105-C107 PolarHBondContact O-N 3.04Å; L105-F108 PolarHBondContact O-N 3.3Å; L105-H109 VanDerWaalsContact O-CB 3.23Å; L105-H109 WeakPolarHBondContact O-CB 3.46Å; L105-H109 PolarHBondContact O-N 2.93Å; L105-W148 HydrophobicContact CD1-CE3 4.49Å; L105-W148 HydrophobicContact CD1-CZ3 4.41Å; L105-W148 HydrophobicContact CD2-CZ3 3.94Å; L105-W148 HydrophobicContact CG-CZ3 4.12Å; L105-V152 HydrophobicContact CD1-CB 4.36Å; L105-V152 HydrophobicContact CD1-CG2 3.65Å; L105-A155 HydrophobicContact CB-CB 3.9Å; L105-A155 HydrophobicContact CD1-CB 4.25Å
106	F	97.3	Very high	96.6	Very high	5 Å²	5	20.7 Å²	20.7	2%	0.022	11%	0.105	C	C	.	.	H	α-helix	trans	-68.3	-30.5	-179.2	-72.6	-61.9	0	0	0	113	A67 I70 R71 M102 V104 A110 W148	A67-F106 HydrophobicContact CB-CD1 3.93Å; A67-F106 HydrophobicContact CB-CE1 4.18Å; I70-F106 HydrophobicContact CB-CE1 4.21Å; I70-F106 HydrophobicContact CB-CZ 3.82Å; I70-F106 HydrophobicContact CG2-CE1 4.25Å; I70-F106 HydrophobicContact CG2-CE2 3.96Å; I70-F106 HydrophobicContact CG2-CZ 3.39Å; R71-F106 HydrophobicContact CB-CB 4.12Å; R71-F106 HydrophobicContact CB-CD2 3.71Å; R71-F106 HydrophobicContact CB-CE2 4.31Å; R71-F106 HydrophobicContact CB-CG 3.88Å; R71-F106 HydrophobicContact CG-CB 4.21Å; R71-F106 HydrophobicContact CG-CD2 4.11Å; R71-F106 HydrophobicContact CG-CG 4.38Å; M102-F106 HydrophobicContact CB-CD2 4.32Å; M102-F106 HydrophobicContact CB-CE2 4.15Å; M102-F106 HydrophobicContact CE-CE2 4.05Å; M102-F106 HydrophobicContact CE-CZ 4.26Å; M102-F106 WeakPolarHBondContact O-CD2 3.07Å; M102-F106 PolarHBondContact O-N 3.25Å; M102-F106 HydrophobicContact SD-CE2 4.2Å; V104-F106 PolarHBondContact O-N 3.49Å; F106-A110 WeakPolarHBondContact O-CB 3.49Å; F106-A110 PolarHBondContact O-N 2.78Å; F106-W148 HydrophobicContact CD1-CH2 4.18Å; F106-W148 AromaticContact CE1-CH2 3.59Å; F106-W148 HydrophobicContact CE1-CH2 3.59Å; F106-W148 HydrophobicContact CE1-CZ2 4.44Å; F106-W148 HydrophobicContact CE1-CZ3 4.37Å; F106-W148 HydrophobicContact CZ-CH2 4.36Å
107	C	95.1	Very high	96.7	Very high	10 Å²	10	20.3 Å²	20.3	7%	0.068	10%	0.102	C	C	.	.	H	α-helix	trans	-64.3	-51.7	173.1	179	0	0	0	0	111.5	A103 V104 L105 H109 A110 A111 W299	A103-C107 WeakPolarHBondContact O-CB 3.21Å; A103-C107 PolarHBondContact O-N 3.18Å; V104-C107 WeakPolarHBondContact O-CB 3.46Å; V104-C107 PolarHBondContact O-N 3.27Å; L105-C107 VanDerWaalsContact C-N 3.32Å; L105-C107 PolarHBondContact O-N 3.04Å; C107-H109 VanDerWaalsContact C-N 3.32Å; C107-H109 PolarHBondContact O-N 3.27Å; C107-A110 PolarHBondContact O-N 3.17Å; C107-A111 PolarHBondContact O-N 2.78Å; C107-W299 HydrophobicContact CB-CH2 3.7Å; C107-W299 HydrophobicContact CB-CZ2 3.92Å; C107-W299 HydrophobicContact CB-CZ3 4.43Å; C107-W299 WeakPolarHBondContact SG-CH2 3.36Å; C107-W299 VanDerWaalsContact SG-CZ2 3.56Å; C107-W299 VanDerWaalsContact SG-CZ3 3.58Å
108	F	95.8	Very high	96.9	Very high	12 Å²	12	16.5 Å²	16.5	5%	0.053	9%	0.086	C	C	.	.	H	α-helix	trans	-64.2	-38	176.7	-83.6	-73.7	0	0	0	112.1	V104 L105 A111 F112 M154 M192 L193 L196	V104-F108 HydrophobicContact CG1-CD2 3.66Å; V104-F108 HydrophobicContact CG1-CE2 3.74Å; V104-F108 WeakPolarHBondContact O-CD2 3.36Å; V104-F108 PolarHBondContact O-N 3.45Å; L105-F108 PolarHBondContact O-N 3.3Å; F108-A111 PolarHBondContact O-N 2.83Å; F108-F112 HydrophobicContact CB-CD2 4.36Å; F108-F112 HydrophobicContact CB-CE2 4.38Å; F108-F112 HydrophobicContact CD1-CE2 4.23Å; F108-F112 WeakPolarHBondContact O-CD2 3.41Å; F108-F112 PolarHBondContact O-N 3.4Å; F108-M154 HydrophobicContact CB-CB 4.43Å; F108-M154 HydrophobicContact CD1-CB 3.97Å; F108-M154 HydrophobicContact CD1-CG 4.01Å; F108-M154 HydrophobicContact CD2-CB 3.89Å; F108-M154 HydrophobicContact CE1-CB 4.16Å; F108-M154 HydrophobicContact CE1-CG 4.17Å; F108-M154 HydrophobicContact CE2-CB 4.09Å; F108-M154 HydrophobicContact CG-CB 3.83Å; F108-M154 HydrophobicContact CG-CG 4.34Å; F108-M154 HydrophobicContact CZ-CB 4.23Å; F108-M192 HydrophobicContact CE1-CG 4.49Å; F108-L193 HydrophobicContact CE1-CB 4.13Å; F108-L193 HydrophobicContact CE1-CD1 4.38Å; F108-L193 HydrophobicContact CZ-CB 4.41Å; F108-L196 HydrophobicContact CD1-CD1 4.41Å
109	H	98.1	Very high	97	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-59.8	-48.5	175.8	-178.2	-99.5	0	0	0	112.3	D63 L105 C107 A111 F112 M113 W148 S151	D63-H109 IonicContact OD1-CE1 3.78Å; D63-H109 IonicContact OD1-NE2 3.63Å; D63-H109 IonicContact OD2-CE1 3.55Å; D63-H109 PolarHBondContact OD2-CE1 3.17Å; D63-H109 IonicContact OD2-NE2 2.64Å; D63-H109 PolarHBondContact OD2-NE2 3.21Å; L105-H109 VanDerWaalsContact O-CB 3.23Å; L105-H109 WeakPolarHBondContact O-CB 3.46Å; L105-H109 PolarHBondContact O-N 2.93Å; C107-H109 VanDerWaalsContact C-N 3.32Å; C107-H109 PolarHBondContact O-N 3.27Å; H109-A111 VanDerWaalsContact C-N 3.31Å; H109-A111 PolarHBondContact O-N 3.25Å; H109-F112 PolarHBondContact O-N 2.78Å; H109-M113 VanDerWaalsContact O-CB 3.28Å; H109-M113 WeakPolarHBondContact O-CB 3.31Å; H109-M113 WeakPolarHBondContact O-CG 3.45Å; H109-M113 PolarHBondContact O-N 3.36Å; H109-W148 AromaticContact CD2-CD1 3.89Å; H109-W148 AromaticContact CD2-CD2 3.59Å; H109-W148 AromaticContact CD2-CE2 3.64Å; H109-W148 AromaticContact CD2-CG 3.8Å; H109-W148 AromaticContact CD2-NE1 3.79Å; H109-W148 AromaticContact CE1-CE2 3.77Å; H109-W148 AromaticContact CE1-CZ2 3.95Å; H109-W148 AromaticContact CE1-NE1 3.67Å; H109-W148 AromaticContact NE2-CD1 3.37Å; H109-W148 AromaticContact NE2-CD2 3.71Å; H109-W148 AromaticContact NE2-CE2 3.32Å; H109-W148 VanDerWaalsContact NE2-CE2 3.32Å; H109-W148 AromaticContact NE2-CG 3.76Å; H109-W148 AromaticContact NE2-CZ2 3.95Å; H109-W148 AromaticContact NE2-NE1 3.06Å; H109-W148 PolarHBondContact NE2-NE1 3.39Å; H109-S151 WeakPolarHBondContact CA-OG 3.46Å; H109-S151 PolarHBondContact N-OG 3.42Å; H109-S151 VanDerWaalsContact N-OG 3.12Å
110	A	97.8	Very high	97	Very high	8 Å²	8	15 Å²	15	7%	0.066	8%	0.081	C	C	.	.	H	α-helix	trans	-58.1	-44.3	173.9	0	0	0	0	0	111.5	F106 C107 M113 L114 F295	F106-A110 WeakPolarHBondContact O-CB 3.49Å; F106-A110 PolarHBondContact O-N 2.78Å; C107-A110 PolarHBondContact O-N 3.17Å; A110-M113 PolarHBondContact O-N 2.99Å; A110-L114 WeakPolarHBondContact O-CB 3.47Å; A110-L114 WeakPolarHBondContact O-CG 3.17Å; A110-L114 PolarHBondContact O-N 3.06Å; A110-F295 HydrophobicContact CB-CD2 4.31Å; A110-F295 HydrophobicContact CB-CE2 3.63Å; A110-F295 HydrophobicContact CB-CZ 4.33Å
111	A	97	Very high	97.1	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-62.5	-48.9	178.8	0	0	0	0	0	112.9	C107 F108 H109 L114 F115 L193 F295	C107-A111 PolarHBondContact O-N 2.78Å; F108-A111 PolarHBondContact O-N 2.83Å; H109-A111 VanDerWaalsContact C-N 3.31Å; H109-A111 PolarHBondContact O-N 3.25Å; A111-L114 PolarHBondContact O-N 2.94Å; A111-F115 PolarHBondContact O-N 2.92Å; A111-L193 HydrophobicContact CB-CD1 3.85Å; A111-F295 HydrophobicContact CB-CE1 4.49Å; A111-F295 HydrophobicContact CB-CZ 4.38Å
112	F	98.1	Very high	97.1	Very high	13 Å²	13	16.2 Å²	16.2	6%	0.057	9%	0.085	C	C	.	.	H	α-helix	trans	-64.3	-40	177.5	-79.3	-63.9	0	0	0	112.3	F108 H109 F115 C116 A147 L150 S151 M154 L196	F108-F112 HydrophobicContact CB-CD2 4.36Å; F108-F112 HydrophobicContact CB-CE2 4.38Å; F108-F112 HydrophobicContact CD1-CE2 4.23Å; F108-F112 WeakPolarHBondContact O-CD2 3.41Å; F108-F112 PolarHBondContact O-N 3.4Å; H109-F112 PolarHBondContact O-N 2.78Å; F112-F115 WeakPolarHBondContact O-CB 3.35Å; F112-F115 PolarHBondContact O-N 3.14Å; F112-C116 PolarHBondContact O-N 3.39Å; F112-C116 PolarHBondContact O-SG 3.48Å; F112-A147 HydrophobicContact CB-CB 4.1Å; F112-L150 HydrophobicContact CD1-CB 4.25Å; F112-L150 HydrophobicContact CD1-CD1 3.98Å; F112-L150 HydrophobicContact CD2-CB 3.97Å; F112-L150 HydrophobicContact CE1-CB 4.02Å; F112-L150 HydrophobicContact CE1-CD1 3.91Å; F112-L150 HydrophobicContact CE2-CB 3.74Å; F112-L150 HydrophobicContact CG-CB 4.23Å; F112-L150 HydrophobicContact CZ-CB 3.76Å; F112-L150 HydrophobicContact CZ-CD1 4.47Å; F112-S151 WeakPolarHBondContact CD2-OG 3.16Å; F112-M154 HydrophobicContact CE2-CG 3.97Å; F112-M154 HydrophobicContact CZ-CE 4.14Å; F112-M154 HydrophobicContact CZ-CG 4.24Å; F112-L196 HydrophobicContact CD1-CD1 4.04Å; F112-L196 HydrophobicContact CD1-CD2 3.9Å; F112-L196 HydrophobicContact CD2-CD1 4.42Å; F112-L196 HydrophobicContact CE1-CD1 3.57Å; F112-L196 HydrophobicContact CE1-CD2 3.5Å; F112-L196 VanDerWaalsContact CE1-CD2 3.5Å; F112-L196 HydrophobicContact CE1-CG 4.19Å; F112-L196 HydrophobicContact CE2-CD1 3.98Å; F112-L196 HydrophobicContact CG-CD1 4.45Å; F112-L196 HydrophobicContact CZ-CD1 3.53Å; F112-L196 HydrophobicContact CZ-CD2 4.26Å
113	M	98.2	Very high	97.1	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-67.2	-41.4	176.9	-80.4	-57.3	-61.5	0	0	112.3	F60 D63 L64 H109 A110 F115 C116 I117 I144 A147	F60-M113 HydrophobicContact CB-CE 3.89Å; F60-M113 HydrophobicContact CD1-CE 3.66Å; F60-M113 HydrophobicContact CG-CE 4.06Å; D63-M113 HydrophobicContact CB-CE 4.47Å; D63-M113 WeakPolarHBondContact OD2-CE 3.45Å; D63-M113 WeakPolarHBondContact OD2-CG 3.44Å; L64-M113 HydrophobicContact CD2-CB 3.83Å; L64-M113 HydrophobicContact CG-CB 4.41Å; H109-M113 VanDerWaalsContact O-CB 3.28Å; H109-M113 WeakPolarHBondContact O-CB 3.31Å; H109-M113 WeakPolarHBondContact O-CG 3.45Å; H109-M113 PolarHBondContact O-N 3.36Å; A110-M113 PolarHBondContact O-N 2.99Å; M113-F115 VanDerWaalsContact C-N 3.3Å; M113-F115 PolarHBondContact O-N 3.09Å; M113-C116 PolarHBondContact O-N 3.33Å; M113-I117 WeakPolarHBondContact O-CB 3.43Å; M113-I117 WeakPolarHBondContact O-CD1 3.44Å; M113-I117 VanDerWaalsContact O-CG1 3.24Å; M113-I117 WeakPolarHBondContact O-CG1 3.18Å; M113-I117 PolarHBondContact O-N 3.16Å; M113-I144 HydrophobicContact CE-CG1 3.98Å; M113-I144 HydrophobicContact SD-CG1 4.28Å; M113-A147 HydrophobicContact CG-CB 3.7Å; M113-A147 HydrophobicContact SD-CB 3.37Å; M113-A147 WeakPolarHBondContact SD-CB 3.32Å
114	L	98	Very high	97.1	Very high	3 Å²	3	15.3 Å²	15.3	2%	0.016	8%	0.078	C	C	.	.	H	α-helix	trans	-63.6	-37.1	174.5	-70.4	171.7	0	0	0	111.8	L64 A110 A111 I117 S118 I291 F295	L64-L114 HydrophobicContact CD1-CD2 4.05Å; A110-L114 WeakPolarHBondContact O-CB 3.47Å; A110-L114 WeakPolarHBondContact O-CG 3.17Å; A110-L114 PolarHBondContact O-N 3.06Å; A111-L114 PolarHBondContact O-N 2.94Å; L114-I117 PolarHBondContact O-N 3.26Å; L114-S118 WeakPolarHBondContact O-CB 3.42Å; L114-S118 PolarHBondContact O-N 3.29Å; L114-I291 HydrophobicContact CD2-CG2 3.94Å; L114-F295 HydrophobicContact CD1-CB 3.77Å; L114-F295 HydrophobicContact CD1-CD1 4.2Å; L114-F295 HydrophobicContact CD1-CD2 3.88Å; L114-F295 HydrophobicContact CD1-CG 3.68Å
115	F	98.3	Very high	97	Very high	62 Å²	62	15.6 Å²	15.6	27%	0.272	8%	0.078	S	C	.	.	H	α-helix	trans	-60.5	-52.2	170.5	177.2	-108.6	0	0	0	111.5	A111 F112 M113 I117 S118 V119 A199 T200 V203	A111-F115 PolarHBondContact O-N 2.92Å; F112-F115 WeakPolarHBondContact O-CB 3.35Å; F112-F115 PolarHBondContact O-N 3.14Å; M113-F115 VanDerWaalsContact C-N 3.3Å; M113-F115 PolarHBondContact O-N 3.09Å; F115-I117 VanDerWaalsContact C-N 3.29Å; F115-I117 PolarHBondContact O-N 3.44Å; F115-S118 WeakPolarHBondContact O-CB 3.46Å; F115-S118 PolarHBondContact O-N 3.35Å; F115-S118 PolarHBondContact O-OG 3.33Å; F115-V119 HydrophobicContact CE1-CG2 4.29Å; F115-V119 HydrophobicContact CE2-CG2 4.23Å; F115-V119 HydrophobicContact CZ-CG2 4.01Å; F115-V119 PolarHBondContact O-N 2.96Å; F115-V119 VanDerWaalsContact O-N 3.09Å; F115-A199 HydrophobicContact CD2-CB 4.28Å; F115-A199 HydrophobicContact CE2-CB 3.97Å; F115-T200 WeakPolarHBondContact CA-OG1 3.31Å; F115-T200 WeakPolarHBondContact CB-OG1 3.43Å; F115-V203 HydrophobicContact CE2-CG2 4.11Å
116	C	98.3	Very high	96.8	Very high	12 Å²	12	16 Å²	16	8%	0.081	8%	0.084	C	C	.	.	H	α-helix	trans	-60.7	-38.7	179.1	-67	0	0	0	0	112.4	F112 M113 V119 T120 V143	F112-C116 PolarHBondContact O-N 3.39Å; F112-C116 PolarHBondContact O-SG 3.48Å; M113-C116 PolarHBondContact O-N 3.33Å; C116-V119 PolarHBondContact O-N 3.31Å; C116-T120 WeakPolarHBondContact O-CB 3.45Å; C116-T120 PolarHBondContact O-N 2.88Å; C116-T120 PolarHBondContact O-OG1 2.87Å; C116-V143 HydrophobicContact CB-CG1 3.62Å
117	I	98	Very high	96.6	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-62.2	-45.6	173.1	-73.6	161.6	0	0	0	110.2	F60 L64 M113 L114 F115 V119 T120 R121 F288	F60-I117 HydrophobicContact CB-CD1 3.85Å; F60-I117 HydrophobicContact CB-CG1 3.64Å; F60-I117 HydrophobicContact CD2-CG1 4.1Å; F60-I117 HydrophobicContact CG-CG1 4.1Å; L64-I117 HydrophobicContact CD1-CD1 3.45Å; L64-I117 VanDerWaalsContact CD1-CD1 3.45Å; L64-I117 HydrophobicContact CG-CD1 4.21Å; M113-I117 WeakPolarHBondContact O-CB 3.43Å; M113-I117 WeakPolarHBondContact O-CD1 3.44Å; M113-I117 VanDerWaalsContact O-CG1 3.24Å; M113-I117 WeakPolarHBondContact O-CG1 3.18Å; M113-I117 PolarHBondContact O-N 3.16Å; L114-I117 PolarHBondContact O-N 3.26Å; F115-I117 VanDerWaalsContact C-N 3.29Å; F115-I117 PolarHBondContact O-N 3.44Å; I117-V119 VanDerWaalsContact C-N 3.3Å; I117-V119 PolarHBondContact O-N 3.38Å; I117-T120 CarbonylContact O-C 3.59Å; I117-T120 WeakPolarHBondContact O-CB 3.47Å; I117-T120 PolarHBondContact O-N 3.21Å; I117-T120 VanDerWaalsContact O-N 3.14Å; I117-R121 HydrophobicContact CG2-CG 4.02Å; I117-R121 WeakPolarHBondContact O-CB 3.46Å; I117-R121 VanDerWaalsContact O-CG 3.3Å; I117-R121 WeakPolarHBondContact O-CG 3.3Å; I117-R121 PolarHBondContact O-N 3.49Å; I117-F288 HydrophobicContact CD1-CD1 4.07Å; I117-F288 HydrophobicContact CD1-CE1 3.95Å; I117-F288 HydrophobicContact CG2-CB 3.69Å; I117-F288 HydrophobicContact CG2-CD1 3.62Å; I117-F288 HydrophobicContact CG2-CD2 4.01Å; I117-F288 HydrophobicContact CG2-CE1 4.2Å; I117-F288 HydrophobicContact CG2-CG 3.5Å
118	S	98.1	Very high	96.4	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-57.7	-43.7	179.1	79.2	0	0	0	0	111.9	L114 F115 R121 Y122 V203	L114-S118 WeakPolarHBondContact O-CB 3.42Å; L114-S118 PolarHBondContact O-N 3.29Å; F115-S118 WeakPolarHBondContact O-CB 3.46Å; F115-S118 PolarHBondContact O-N 3.35Å; F115-S118 PolarHBondContact O-OG 3.33Å; S118-R121 PolarHBondContact O-N 3.42Å; S118-Y122 WeakPolarHBondContact O-CB 3.46Å; S118-Y122 PolarHBondContact O-N 3.11Å; S118-V203 WeakPolarHBondContact O-CG1 3.36Å; S118-V203 WeakPolarHBondContact OG-CG1 3.14Å
119	V	97.7	Very high	96.2	Very high	56 Å²	56	32.9 Å²	32.9	34%	0.339	15%	0.151	S	C	.	.	H	α-helix	trans	-64.7	-46	175.9	175.8	0	0	0	0	110.3	F115 C116 I117 R121 Y122 M123 V203	F115-V119 HydrophobicContact CE1-CG2 4.29Å; F115-V119 HydrophobicContact CE2-CG2 4.23Å; F115-V119 HydrophobicContact CZ-CG2 4.01Å; F115-V119 PolarHBondContact O-N 2.96Å; F115-V119 VanDerWaalsContact O-N 3.09Å; C116-V119 PolarHBondContact O-N 3.31Å; I117-V119 VanDerWaalsContact C-N 3.3Å; I117-V119 PolarHBondContact O-N 3.38Å; V119-R121 VanDerWaalsContact C-N 3.35Å; V119-R121 PolarHBondContact O-N 2.97Å; V119-Y122 WeakPolarHBondContact O-CB 3.32Å; V119-Y122 PolarHBondContact O-N 3.43Å; V119-M123 HydrophobicContact CG1-CG 4.39Å; V119-M123 VanDerWaalsContact O-CG 3.3Å; V119-M123 WeakPolarHBondContact O-CG 3.37Å; V119-M123 PolarHBondContact O-N 3.26Å; V119-V203 HydrophobicContact CG2-CG1 4.3Å; V119-V203 HydrophobicContact CG2-CG2 4.27Å
120	T	96.8	Very high	95.9	Very high	5 Å²	5	38.4 Å²	38.4	3%	0.031	18%	0.175	C	C	.	.	H	α-helix	trans	-58.3	-45.9	176.9	-62.9	0	0	0	0	111.5	F60 C116 I117 M123 A124 Y131 M135	F60-T120 HydrophobicContact CD2-CG2 4.24Å; F60-T120 HydrophobicContact CE2-CG2 3.65Å; F60-T120 WeakPolarHBondContact CE2-OG1 3.46Å; C116-T120 WeakPolarHBondContact O-CB 3.45Å; C116-T120 PolarHBondContact O-N 2.88Å; C116-T120 PolarHBondContact O-OG1 2.87Å; I117-T120 CarbonylContact O-C 3.59Å; I117-T120 WeakPolarHBondContact O-CB 3.47Å; I117-T120 PolarHBondContact O-N 3.21Å; I117-T120 VanDerWaalsContact O-N 3.14Å; T120-M123 PolarHBondContact O-N 3.48Å; T120-A124 WeakPolarHBondContact O-CB 3.47Å; T120-A124 PolarHBondContact O-N 2.72Å; T120-Y131 HydrophobicContact CG2-CD2 4.47Å; T120-Y131 HydrophobicContact CG2-CE2 3.79Å; T120-M135 HydrophobicContact CG2-CE 3.78Å
121	R	96.7	Very high	95.8	Very high	1 Å²	1	38.9 Å²	38.9	0%	0.004	18%	0.176	C	C	.	.	H	α-helix	trans	-65.4	-40.4	178.9	-66.9	-54	85.8	-163.4	-3.9	111.4	I117 S118 V119 A124 I125 Y131 L207 E281 F288	I117-R121 HydrophobicContact CG2-CG 4.02Å; I117-R121 WeakPolarHBondContact O-CB 3.46Å; I117-R121 VanDerWaalsContact O-CG 3.3Å; I117-R121 WeakPolarHBondContact O-CG 3.3Å; I117-R121 PolarHBondContact O-N 3.49Å; S118-R121 PolarHBondContact O-N 3.42Å; V119-R121 VanDerWaalsContact C-N 3.35Å; V119-R121 PolarHBondContact O-N 2.97Å; R121-A124 PolarHBondContact O-N 2.84Å; R121-I125 PolarHBondContact O-N 3.47Å; R121-Y131 PolarHBondContact NH2-OH 3.38Å; R121-L207 HydrophobicContact CB-CD2 4.22Å; R121-E281 IonicContact CZ-OE2 3.89Å; R121-E281 IonicContact NH1-OE2 3.58Å; R121-E281 PolarHBondContact NH1-OE2 2.89Å; R121-E281 IonicContact NH2-OE2 2.7Å; R121-F288 HydrophobicContact CG-CD2 4.31Å
122	Y	96.5	Very high	95.5	Very high	62 Å²	62	42 Å²	42	24%	0.243	20%	0.201	C	C	.	.	H	α-helix	trans	-58.1	-49.6	171.3	176.5	-94.9	0	0	0	111.4	S118 V119 A124 I125 A126 H127 K206 L207	S118-Y122 WeakPolarHBondContact O-CB 3.46Å; S118-Y122 PolarHBondContact O-N 3.11Å; V119-Y122 WeakPolarHBondContact O-CB 3.32Å; V119-Y122 PolarHBondContact O-N 3.43Å; Y122-A124 PolarHBondContact O-N 3.36Å; Y122-I125 PolarHBondContact O-N 3.49Å; Y122-A126 HydrophobicContact CD1-CB 4.48Å; Y122-A126 HydrophobicContact CD2-CB 4.36Å; Y122-A126 HydrophobicContact CE1-CB 4.09Å; Y122-A126 HydrophobicContact CE2-CB 3.97Å; Y122-A126 VanDerWaalsContact O-CB 3.28Å; Y122-A126 WeakPolarHBondContact O-CB 3.42Å; Y122-A126 PolarHBondContact O-N 2.79Å; Y122-H127 AromaticContact CE1-CD2 4Å; Y122-K206 HydrophobicContact CE2-CB 4.26Å; Y122-L207 HydrophobicContact CD2-CB 4.12Å
123	M	96	Very high	95.3	Very high	43 Å²	43	49.7 Å²	49.7	21%	0.212	24%	0.235	C	C	.	.	H	α-helix	trans	-64	-37.5	179.3	-66.2	-57.3	-73.4	0	0	112.8	V119 T120 I125 H127 H128 F130	V119-M123 HydrophobicContact CG1-CG 4.39Å; V119-M123 VanDerWaalsContact O-CG 3.3Å; V119-M123 WeakPolarHBondContact O-CG 3.37Å; V119-M123 PolarHBondContact O-N 3.26Å; T120-M123 PolarHBondContact O-N 3.48Å; M123-I125 VanDerWaalsContact C-N 3.31Å; M123-I125 PolarHBondContact O-N 3.35Å; M123-H127 HydrophobicContact CE-CB 3.89Å; M123-H127 CarbonylContact O-C 2.98Å; M123-H127 VanDerWaalsContact O-CA 3.26Å; M123-H127 WeakPolarHBondContact O-CA 3.3Å; M123-H127 PolarHBondContact O-N 2.9Å; M123-H127 HydrophobicContact SD-CB 4.37Å; M123-H128 PolarHBondContact O-N 2.89Å; M123-F130 HydrophobicContact CE-CD1 3.37Å; M123-F130 HydrophobicContact CE-CE1 3.66Å; M123-F130 HydrophobicContact CE-CG 4.16Å
124	A	95.3	Very high	95.1	Very high	1 Å²	1	57.2 Å²	57.2	1%	0.008	26%	0.263	C	S	.	.	H	α-helix	trans	-61.2	-39.3	177.1	0	0	0	0	0	112.4	T120 R121 Y122 H128 Y131	T120-A124 WeakPolarHBondContact O-CB 3.47Å; T120-A124 PolarHBondContact O-N 2.72Å; R121-A124 PolarHBondContact O-N 2.84Å; Y122-A124 PolarHBondContact O-N 3.36Å; A124-H128 WeakPolarHBondContact O-CA 3.39Å; A124-H128 WeakPolarHBondContact O-CB 3.34Å; A124-Y131 HydrophobicContact CB-CD1 3.98Å; A124-Y131 HydrophobicContact CB-CD2 3.78Å; A124-Y131 HydrophobicContact CB-CE1 3.97Å; A124-Y131 HydrophobicContact CB-CE2 3.81Å; A124-Y131 HydrophobicContact CB-CG 3.89Å
125	I	93.6	Very high	94.9	Very high	25 Å²	25	59.5 Å²	59.5	13%	0.128	28%	0.275	C	S	.	.	H	α-helix	trans	-90.6	-44.9	-175.5	-65.5	167.5	0	0	0	111.7	R121 Y122 M123 L207 F210 E211 K282	R121-I125 PolarHBondContact O-N 3.47Å; Y122-I125 PolarHBondContact O-N 3.49Å; M123-I125 VanDerWaalsContact C-N 3.31Å; M123-I125 PolarHBondContact O-N 3.35Å; I125-L207 HydrophobicContact CB-CD1 3.85Å; I125-L207 HydrophobicContact CD1-CD1 3.65Å; I125-L207 HydrophobicContact CD1-CD2 4.27Å; I125-L207 HydrophobicContact CG1-CD1 4.31Å; I125-L207 HydrophobicContact CG2-CD1 3.95Å; I125-F210 HydrophobicContact CG2-CD1 3.98Å; I125-F210 HydrophobicContact CG2-CE1 3.87Å; I125-E211 HydrophobicContact CG2-CG 4.37Å; I125-K282 HydrophobicContact CD1-CG 4.16Å; I125-K282 HydrophobicContact CG1-CG 4.5Å
126	A	92.6	Very high	94.8	Very high	19 Å²	19	59.7 Å²	59.7	16%	0.157	28%	0.281	C	S	.	.	H	α-helix	trans	-83.9	-30.9	-176.1	0	0	0	0	0	113.6	Y122 F210	Y122-A126 HydrophobicContact CD1-CB 4.48Å; Y122-A126 HydrophobicContact CD2-CB 4.36Å; Y122-A126 HydrophobicContact CE1-CB 4.09Å; Y122-A126 HydrophobicContact CE2-CB 3.97Å; Y122-A126 VanDerWaalsContact O-CB 3.28Å; Y122-A126 WeakPolarHBondContact O-CB 3.42Å; Y122-A126 PolarHBondContact O-N 2.79Å; A126-F210 VanDerWaalsContact CA-CZ 3.49Å; A126-F210 HydrophobicContact CB-CD1 4.22Å; A126-F210 HydrophobicContact CB-CD2 4.09Å; A126-F210 HydrophobicContact CB-CE1 4.03Å; A126-F210 HydrophobicContact CB-CE2 3.87Å; A126-F210 HydrophobicContact CB-CG 4.26Å; A126-F210 HydrophobicContact CB-CZ 3.85Å
127	H	93.2	Very high	94.7	Very high	92 Å²	92	64 Å²	64	43%	0.426	30%	0.302	S	S	.	.	S	Bend	trans	-132.8	47.5	-174.7	-61.6	-66.8	0	0	0	111.8	Y122 M123 R129 F130 Y131	Y122-H127 AromaticContact CE1-CD2 4Å; M123-H127 HydrophobicContact CE-CB 3.89Å; M123-H127 CarbonylContact O-C 2.98Å; M123-H127 VanDerWaalsContact O-CA 3.26Å; M123-H127 WeakPolarHBondContact O-CA 3.3Å; M123-H127 PolarHBondContact O-N 2.9Å; M123-H127 HydrophobicContact SD-CB 4.37Å; H127-R129 VanDerWaalsContact C-N 3.28Å; H127-R129 PolarHBondContact O-N 3.21Å; H127-R129 VanDerWaalsContact O-N 3.1Å; H127-F130 HydrophobicContact CB-CB 4.27Å; H127-F130 WeakPolarHBondContact O-CB 3.3Å; H127-F130 PolarHBondContact O-N 2.96Å; H127-Y131 PolarHBondContact O-N 2.88Å
128	H	91	Very high	94.6	Very high	57 Å²	57	73.9 Å²	73.9	26%	0.264	34%	0.34	S	S	.	.	H	α-helix	trans	-49	-42.7	-172.9	-172.9	-55.6	0	0	0	114.2	M123 A124 F130 Y131 A132	M123-H128 PolarHBondContact O-N 2.89Å; A124-H128 WeakPolarHBondContact O-CA 3.39Å; A124-H128 WeakPolarHBondContact O-CB 3.34Å; H128-F130 VanDerWaalsContact C-N 3.33Å; H128-F130 PolarHBondContact O-N 3.01Å; H128-Y131 PolarHBondContact O-N 3.25Å; H128-A132 VanDerWaalsContact O-CB 3.32Å; H128-A132 WeakPolarHBondContact O-CB 3.5Å; H128-A132 PolarHBondContact O-N 3.45Å
129	R	90.5	Very high	94.6	Very high	231 Å²	231	76.2 Å²	76.2	87%	0.872	35%	0.354	S	S	*	.	H	α-helix	trans	-62.5	-40.2	179.8	-68.5	-173.2	-179.4	-172.9	1	112.3	H127 K133	H127-R129 VanDerWaalsContact C-N 3.28Å; H127-R129 PolarHBondContact O-N 3.21Å; H127-R129 VanDerWaalsContact O-N 3.1Å; R129-K133 WeakPolarHBondContact O-CB 3.42Å; R129-K133 PolarHBondContact O-N 3.24Å
130	F	93	Very high	94.6	Very high	116 Å²	116	73.7 Å²	73.7	51%	0.509	34%	0.339	S	S	.	.	H	α-helix	trans	-68	-47.3	176.3	178	-88.6	0	0	0	110.3	M123 H127 H128 K133 R134	M123-F130 HydrophobicContact CE-CD1 3.37Å; M123-F130 HydrophobicContact CE-CE1 3.66Å; M123-F130 HydrophobicContact CE-CG 4.16Å; H127-F130 HydrophobicContact CB-CB 4.27Å; H127-F130 WeakPolarHBondContact O-CB 3.3Å; H127-F130 PolarHBondContact O-N 2.96Å; H128-F130 VanDerWaalsContact C-N 3.33Å; H128-F130 PolarHBondContact O-N 3.01Å; F130-K133 PolarHBondContact O-N 3.45Å; F130-R134 HydrophobicContact CD1-CG 4.38Å; F130-R134 HydrophobicContact CD2-CG 4.16Å; F130-R134 HydrophobicContact CE1-CB 4.24Å; F130-R134 HydrophobicContact CE1-CG 4.11Å; F130-R134 HydrophobicContact CE2-CG 3.87Å; F130-R134 HydrophobicContact CG-CG 4.41Å; F130-R134 HydrophobicContact CZ-CB 4.41Å; F130-R134 HydrophobicContact CZ-CG 3.85Å; F130-R134 VanDerWaalsContact O-CB 3.32Å; F130-R134 WeakPolarHBondContact O-CB 3.38Å; F130-R134 WeakPolarHBondContact O-CG 3.3Å; F130-R134 PolarHBondContact O-N 3.19Å
131	Y	94.5	Very high	94.7	Very high	19 Å²	19	75.3 Å²	75.3	8%	0.075	35%	0.353	C	S	.	.	H	α-helix	trans	-55.4	-53.6	176.9	170.1	-94.5	0	0	0	111.8	P57 T120 R121 A124 H127 H128 K133 R134 M135	P57-Y131 WeakPolarHBondContact CD-OH 3.44Å; T120-Y131 HydrophobicContact CG2-CD2 4.47Å; T120-Y131 HydrophobicContact CG2-CE2 3.79Å; R121-Y131 PolarHBondContact NH2-OH 3.38Å; A124-Y131 HydrophobicContact CB-CD1 3.98Å; A124-Y131 HydrophobicContact CB-CD2 3.78Å; A124-Y131 HydrophobicContact CB-CE1 3.97Å; A124-Y131 HydrophobicContact CB-CE2 3.81Å; A124-Y131 HydrophobicContact CB-CG 3.89Å; H127-Y131 PolarHBondContact O-N 2.88Å; H128-Y131 PolarHBondContact O-N 3.25Å; Y131-K133 VanDerWaalsContact C-N 3.26Å; Y131-K133 PolarHBondContact O-N 3.27Å; Y131-R134 PolarHBondContact O-N 3.09Å; Y131-M135 HydrophobicContact CD2-CB 4.17Å; Y131-M135 HydrophobicContact CD2-CE 4.4Å; Y131-M135 HydrophobicContact CD2-CG 3.43Å; Y131-M135 VanDerWaalsContact CD2-CG 3.43Å; Y131-M135 HydrophobicContact CE2-CB 4.03Å; Y131-M135 HydrophobicContact CE2-CG 3.52Å; Y131-M135 HydrophobicContact CE2-SD 4.49Å; Y131-M135 HydrophobicContact CG-CG 4.2Å; Y131-M135 VanDerWaalsContact O-CB 3.3Å; Y131-M135 WeakPolarHBondContact O-CB 3.4Å; Y131-M135 PolarHBondContact O-N 3.23Å
132	A	91.4	Very high	94.8	Very high	65 Å²	65	78 Å²	78	54%	0.537	38%	0.376	S	S	.	.	H	α-helix	trans	-61.5	-32.2	-177.8	0	0	0	0	0	113.3	H128	H128-A132 VanDerWaalsContact O-CB 3.32Å; H128-A132 WeakPolarHBondContact O-CB 3.5Å; H128-A132 PolarHBondContact O-N 3.45Å
133	K	93.7	Very high	94.9	Very high	174 Å²	174	76.6 Å²	76.6	76%	0.757	37%	0.373	S	S	*	.	H	α-helix	trans	-82	-31.6	178.4	-173.2	174.2	179.4	178.1	0	113.2	R129 F130 Y131	R129-K133 WeakPolarHBondContact O-CB 3.42Å; R129-K133 PolarHBondContact O-N 3.24Å; F130-K133 PolarHBondContact O-N 3.45Å; Y131-K133 VanDerWaalsContact C-N 3.26Å; Y131-K133 PolarHBondContact O-N 3.27Å
134	R	94.7	Very high	95	Very high	158 Å²	158	76 Å²	76	60%	0.596	37%	0.371	S	S	*	.	H	α-helix	trans	-102.2	-28	-170.1	-69.4	-68	-167.9	165.7	1.6	114.2	F130 Y131 T136 T139	F130-R134 HydrophobicContact CD1-CG 4.38Å; F130-R134 HydrophobicContact CD2-CG 4.16Å; F130-R134 HydrophobicContact CE1-CB 4.24Å; F130-R134 HydrophobicContact CE1-CG 4.11Å; F130-R134 HydrophobicContact CE2-CG 3.87Å; F130-R134 HydrophobicContact CG-CG 4.41Å; F130-R134 HydrophobicContact CZ-CB 4.41Å; F130-R134 HydrophobicContact CZ-CG 3.85Å; F130-R134 VanDerWaalsContact O-CB 3.32Å; F130-R134 WeakPolarHBondContact O-CB 3.38Å; F130-R134 WeakPolarHBondContact O-CG 3.3Å; F130-R134 PolarHBondContact O-N 3.19Å; Y131-R134 PolarHBondContact O-N 3.09Å; R134-T136 VanDerWaalsContact C-N 3.31Å; R134-T136 PolarHBondContact O-N 3.09Å; R134-T139 WeakPolarHBondContact O-CG2 3.46Å; R134-T139 PolarHBondContact O-OG1 3.47Å
135	M	94	Very high	95.2	Very high	52 Å²	52	79.6 Å²	79.6	26%	0.256	40%	0.395	S	S	.	.			trans	-79	81.6	-177.5	-75.6	-73.4	-174.4	0	0	111.4	A56 T120 Y131 T139	A56-M135 HydrophobicContact CB-CB 4.17Å; T120-M135 HydrophobicContact CG2-CE 3.78Å; Y131-M135 HydrophobicContact CD2-CB 4.17Å; Y131-M135 HydrophobicContact CD2-CE 4.4Å; Y131-M135 HydrophobicContact CD2-CG 3.43Å; Y131-M135 VanDerWaalsContact CD2-CG 3.43Å; Y131-M135 HydrophobicContact CE2-CB 4.03Å; Y131-M135 HydrophobicContact CE2-CG 3.52Å; Y131-M135 HydrophobicContact CE2-SD 4.49Å; Y131-M135 HydrophobicContact CG-CG 4.2Å; Y131-M135 VanDerWaalsContact O-CB 3.3Å; Y131-M135 WeakPolarHBondContact O-CB 3.4Å; Y131-M135 PolarHBondContact O-N 3.23Å; M135-T139 WeakPolarHBondContact CA-OG1 3.44Å
136	T	95.6	Very high	95.4	Very high	66 Å²	66	82.5 Å²	82.5	41%	0.405	41%	0.409	S	S	.	.			trans	-96.2	166.9	171.9	70	0	0	0	0	110.9	R134 W138 T139 C140	R134-T136 VanDerWaalsContact C-N 3.31Å; R134-T136 PolarHBondContact O-N 3.09Å; T136-W138 PolarHBondContact O-N 2.77Å; T136-T139 PolarHBondContact N-OG1 3.05Å; T136-T139 PolarHBondContact O-N 2.83Å; T136-T139 VanDerWaalsContact O-N 3.12Å; T136-T139 PolarHBondContact O-OG1 3.36Å; T136-T139 PolarHBondContact OG1-N 3.39Å; T136-C140 PolarHBondContact O-N 3.48Å; T136-C140 PolarHBondContact O-SG 3.02Å
137	L	95.4	Very high	95.7	Very high	101 Å²	101	81.6 Å²	81.6	53%	0.529	40%	0.402	S	S	.	.	H	α-helix	trans	-53	-42.5	173.8	179.8	64.3	0	0	0	112	Y59 T139 C140 A141	Y59-L137 HydrophobicContact CD2-CD1 4.05Å; Y59-L137 HydrophobicContact CE1-CD1 4.22Å; Y59-L137 HydrophobicContact CE2-CD1 3.65Å; L137-T139 PolarHBondContact O-N 3.21Å; L137-C140 WeakPolarHBondContact O-CB 3.34Å; L137-C140 PolarHBondContact O-N 3.29Å; L137-A141 WeakPolarHBondContact O-CB 3.32Å; L137-A141 PolarHBondContact O-N 2.95Å
138	W	97.2	Very high	95.9	Very high	208 Å²	208	80.8 Å²	80.8	79%	0.788	40%	0.395	S	S	*	.	H	α-helix	trans	-64.2	-39.7	178.3	-66.2	111.5	0	0	0	113	T136 C140 A141 A142	T136-W138 PolarHBondContact O-N 2.77Å; W138-C140 VanDerWaalsContact C-N 3.33Å; W138-A141 PolarHBondContact O-N 3.18Å; W138-A142 WeakPolarHBondContact O-CB 3.42Å; W138-A142 PolarHBondContact O-N 3.43Å
139	T	97.7	Very high	96.3	Very high	50 Å²	50	82.3 Å²	82.3	31%	0.307	41%	0.408	S	S	.	.	H	α-helix	trans	-67	-36.4	174.3	59	0	0	0	0	112.1	R134 M135 T136 L137 A142 V143	R134-T139 WeakPolarHBondContact O-CG2 3.46Å; R134-T139 PolarHBondContact O-OG1 3.47Å; M135-T139 WeakPolarHBondContact CA-OG1 3.44Å; T136-T139 PolarHBondContact N-OG1 3.05Å; T136-T139 PolarHBondContact O-N 2.83Å; T136-T139 VanDerWaalsContact O-N 3.12Å; T136-T139 PolarHBondContact O-OG1 3.36Å; T136-T139 PolarHBondContact OG1-N 3.39Å; L137-T139 PolarHBondContact O-N 3.21Å; T139-A142 PolarHBondContact O-N 2.95Å; T139-V143 WeakPolarHBondContact O-CG2 3.3Å; T139-V143 PolarHBondContact O-N 3.35Å
140	C	98.1	Very high	96.6	Very high	2 Å²	2	74.5 Å²	74.5	1%	0.014	38%	0.383	C	S	.	.	H	α-helix	trans	-64.7	-45.3	174.7	-60	0	0	0	0	110.6	A56 Y59 F60 T136 L137 W138 A142 V143 I144	A56-C140 VanDerWaalsContact CB-SG 3.56Å; Y59-C140 HydrophobicContact CD2-CB 4.19Å; F60-C140 HydrophobicContact CE1-CB 3.96Å; F60-C140 HydrophobicContact CZ-CB 4.21Å; T136-C140 PolarHBondContact O-N 3.48Å; T136-C140 PolarHBondContact O-SG 3.02Å; L137-C140 WeakPolarHBondContact O-CB 3.34Å; L137-C140 PolarHBondContact O-N 3.29Å; W138-C140 VanDerWaalsContact C-N 3.33Å; C140-A142 PolarHBondContact O-N 3.15Å; C140-V143 PolarHBondContact O-N 2.97Å; C140-I144 WeakPolarHBondContact O-CG1 3.25Å; C140-I144 PolarHBondContact O-N 2.93Å
141	A	98.2	Very high	96.8	Very high	39 Å²	39	69 Å²	69	32%	0.322	36%	0.359	S	S	.	.	H	α-helix	trans	-60	-43.6	175.4	0	0	0	0	0	111.8	L137 W138 V143 I144 C145	L137-A141 WeakPolarHBondContact O-CB 3.32Å; L137-A141 PolarHBondContact O-N 2.95Å; W138-A141 PolarHBondContact O-N 3.18Å; A141-V143 PolarHBondContact O-N 3.04Å; A141-I144 PolarHBondContact O-N 2.8Å; A141-C145 WeakPolarHBondContact O-CB 3.3Å; A141-C145 PolarHBondContact O-N 2.95Å; A141-C145 PolarHBondContact O-SG 3.47Å
142	A	98.4	Very high	96.9	Very high	59 Å²	59	70.8 Å²	70.8	49%	0.488	37%	0.372	S	S	.	.	H	α-helix	trans	-62.2	-41.5	176.6	0	0	0	0	0	112.6	W138 T139 C140 C145 M146	W138-A142 WeakPolarHBondContact O-CB 3.42Å; W138-A142 PolarHBondContact O-N 3.43Å; T139-A142 PolarHBondContact O-N 2.95Å; C140-A142 PolarHBondContact O-N 3.15Å; A142-C145 PolarHBondContact O-N 2.92Å; A142-M146 WeakPolarHBondContact O-CB 3.48Å; A142-M146 PolarHBondContact O-N 3.44Å
143	V	98.4	Very high	97.1	Very high	31 Å²	31	70.6 Å²	70.6	19%	0.188	37%	0.37	C	S	.	.	H	α-helix	trans	-64.4	-43.3	175.8	169.2	0	0	0	0	111.5	F60 C116 T139 C140 A141 M146 A147	F60-V143 HydrophobicContact CE1-CB 4.01Å; F60-V143 HydrophobicContact CE1-CG1 3.83Å; F60-V143 HydrophobicContact CZ-CB 4.2Å; F60-V143 HydrophobicContact CZ-CG1 4.02Å; C116-V143 HydrophobicContact CB-CG1 3.62Å; T139-V143 WeakPolarHBondContact O-CG2 3.3Å; T139-V143 PolarHBondContact O-N 3.35Å; C140-V143 PolarHBondContact O-N 2.97Å; A141-V143 PolarHBondContact O-N 3.04Å; V143-M146 WeakPolarHBondContact O-CB 3.36Å; V143-M146 PolarHBondContact O-N 3.5Å; V143-A147 PolarHBondContact O-N 3.46Å
144	I	98.7	Very high	97.1	Very high	31 Å²	31	64 Å²	64	16%	0.159	34%	0.343	C	S	.	.	H	α-helix	trans	-63.1	-48.8	176.6	-70.1	164.3	0	0	0	110.3	F60 D63 M113 C140 A141 M146 A147 W148	F60-I144 HydrophobicContact CD1-CD1 4.14Å; F60-I144 HydrophobicContact CD1-CG1 3.96Å; F60-I144 HydrophobicContact CE1-CD1 4.46Å; F60-I144 HydrophobicContact CE1-CG1 4.17Å; D63-I144 HydrophobicContact CB-CD1 3.98Å; D63-I144 HydrophobicContact CB-CG1 4.21Å; D63-I144 HydrophobicContact CB-CG2 4.46Å; D63-I144 WeakPolarHBondContact OD1-CG2 3.39Å; M113-I144 HydrophobicContact CE-CG1 3.98Å; M113-I144 HydrophobicContact SD-CG1 4.28Å; C140-I144 WeakPolarHBondContact O-CG1 3.25Å; C140-I144 PolarHBondContact O-N 2.93Å; A141-I144 PolarHBondContact O-N 2.8Å; I144-M146 VanDerWaalsContact C-N 3.28Å; I144-M146 PolarHBondContact O-N 3.48Å; I144-A147 PolarHBondContact O-N 3.37Å; I144-A147 VanDerWaalsContact O-N 3.09Å; I144-W148 PolarHBondContact O-N 2.9Å
145	C	98.6	Very high	97	Very high	77 Å²	77	56.5 Å²	56.5	52%	0.52	31%	0.314	S	S	.	.	H	α-helix	trans	-57.7	-41.5	176.3	-70.7	0	0	0	0	111.8	A141 A142 W148 T149	A141-C145 WeakPolarHBondContact O-CB 3.3Å; A141-C145 PolarHBondContact O-N 2.95Å; A141-C145 PolarHBondContact O-SG 3.47Å; A142-C145 PolarHBondContact O-N 2.92Å; C145-W148 PolarHBondContact O-N 3.43Å; C145-T149 VanDerWaalsContact O-CG2 3.32Å; C145-T149 WeakPolarHBondContact O-CG2 3.49Å; C145-T149 PolarHBondContact O-N 2.99Å; C145-T149 PolarHBondContact O-OG1 2.72Å
146	M	98.4	Very high	96.9	Very high	86 Å²	86	58.5 Å²	58.5	42%	0.424	32%	0.322	S	S	.	.	H	α-helix	trans	-62.4	-42.6	175.2	179.2	-172.1	68.2	0	0	112.1	A142 V143 I144 T149 L150	A142-M146 WeakPolarHBondContact O-CB 3.48Å; A142-M146 PolarHBondContact O-N 3.44Å; V143-M146 WeakPolarHBondContact O-CB 3.36Å; V143-M146 PolarHBondContact O-N 3.5Å; I144-M146 VanDerWaalsContact C-N 3.28Å; I144-M146 PolarHBondContact O-N 3.48Å; M146-T149 WeakPolarHBondContact CA-OG1 3.34Å; M146-T149 PolarHBondContact O-N 3.28Å; M146-T149 PolarHBondContact O-OG1 3.49Å; M146-L150 HydrophobicContact CG-CD1 3.99Å; M146-L150 HydrophobicContact CG-CG 4.48Å; M146-L150 WeakPolarHBondContact O-CB 3.48Å; M146-L150 VanDerWaalsContact O-CG 3.26Å; M146-L150 WeakPolarHBondContact O-CG 3.45Å; M146-L150 PolarHBondContact O-N 2.94Å
147	A	98.5	Very high	96.6	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-63.9	-42.6	177	0	0	0	0	0	111.5	F112 M113 V143 I144 S151	F112-A147 HydrophobicContact CB-CB 4.1Å; M113-A147 HydrophobicContact CG-CB 3.7Å; M113-A147 HydrophobicContact SD-CB 3.37Å; M113-A147 WeakPolarHBondContact SD-CB 3.32Å; V143-A147 PolarHBondContact O-N 3.46Å; I144-A147 PolarHBondContact O-N 3.37Å; I144-A147 VanDerWaalsContact O-N 3.09Å; A147-S151 WeakPolarHBondContact O-CB 3.06Å; A147-S151 PolarHBondContact O-N 3.34Å; A147-S151 PolarHBondContact O-OG 2.8Å
148	W	98.5	Very high	96.3	Very high	74 Å²	74	54 Å²	54	28%	0.28	30%	0.299	S	S	.	.	H	α-helix	trans	-60.6	-48	174	-84.6	103.9	0	0	0	112.7	D63 L105 F106 H109 I144 C145 L150 S151 V152	D63-W148 PolarHBondContact OD1-NE1 3.46Å; L105-W148 HydrophobicContact CD1-CE3 4.49Å; L105-W148 HydrophobicContact CD1-CZ3 4.41Å; L105-W148 HydrophobicContact CD2-CZ3 3.94Å; L105-W148 HydrophobicContact CG-CZ3 4.12Å; F106-W148 HydrophobicContact CD1-CH2 4.18Å; F106-W148 AromaticContact CE1-CH2 3.59Å; F106-W148 HydrophobicContact CE1-CH2 3.59Å; F106-W148 HydrophobicContact CE1-CZ2 4.44Å; F106-W148 HydrophobicContact CE1-CZ3 4.37Å; F106-W148 HydrophobicContact CZ-CH2 4.36Å; H109-W148 AromaticContact CD2-CD1 3.89Å; H109-W148 AromaticContact CD2-CD2 3.59Å; H109-W148 AromaticContact CD2-CE2 3.64Å; H109-W148 AromaticContact CD2-CG 3.8Å; H109-W148 AromaticContact CD2-NE1 3.79Å; H109-W148 AromaticContact CE1-CE2 3.77Å; H109-W148 AromaticContact CE1-CZ2 3.95Å; H109-W148 AromaticContact CE1-NE1 3.67Å; H109-W148 AromaticContact NE2-CD1 3.37Å; H109-W148 AromaticContact NE2-CD2 3.71Å; H109-W148 AromaticContact NE2-CE2 3.32Å; H109-W148 VanDerWaalsContact NE2-CE2 3.32Å; H109-W148 AromaticContact NE2-CG 3.76Å; H109-W148 AromaticContact NE2-CZ2 3.95Å; H109-W148 AromaticContact NE2-NE1 3.06Å; H109-W148 PolarHBondContact NE2-NE1 3.39Å; I144-W148 PolarHBondContact O-N 2.9Å; C145-W148 PolarHBondContact O-N 3.43Å; W148-L150 PolarHBondContact O-N 2.63Å; W148-S151 PolarHBondContact O-N 3.05Å; W148-V152 WeakPolarHBondContact O-CG2 3.17Å; W148-V152 PolarHBondContact O-N 3.44Å
149	T	98.4	Very high	95.9	Very high	90 Å²	90	46.2 Å²	46.2	55%	0.552	28%	0.275	S	S	*	.	H	α-helix	trans	-63.5	-43.1	-179.5	55.2	0	0	0	0	112	C145 M146 S151 V152 A153	C145-T149 VanDerWaalsContact O-CG2 3.32Å; C145-T149 WeakPolarHBondContact O-CG2 3.49Å; C145-T149 PolarHBondContact O-N 2.99Å; C145-T149 PolarHBondContact O-OG1 2.72Å; M146-T149 WeakPolarHBondContact CA-OG1 3.34Å; M146-T149 PolarHBondContact O-N 3.28Å; M146-T149 PolarHBondContact O-OG1 3.49Å; T149-S151 VanDerWaalsContact C-N 3.3Å; T149-S151 PolarHBondContact O-N 2.94Å; T149-V152 PolarHBondContact O-N 3.36Å; T149-A153 WeakPolarHBondContact O-CB 3.47Å; T149-A153 PolarHBondContact O-N 2.87Å
150	L	97.4	Very high	95.3	Very high	66 Å²	66	51 Å²	51	35%	0.346	29%	0.292	S	S	.	.	H	α-helix	trans	-63.5	-37	175.2	-69.9	172.7	0	0	0	112	F112 M146 W148 A153 M154	F112-L150 HydrophobicContact CD1-CB 4.25Å; F112-L150 HydrophobicContact CD1-CD1 3.98Å; F112-L150 HydrophobicContact CD2-CB 3.97Å; F112-L150 HydrophobicContact CE1-CB 4.02Å; F112-L150 HydrophobicContact CE1-CD1 3.91Å; F112-L150 HydrophobicContact CE2-CB 3.74Å; F112-L150 HydrophobicContact CG-CB 4.23Å; F112-L150 HydrophobicContact CZ-CB 3.76Å; F112-L150 HydrophobicContact CZ-CD1 4.47Å; M146-L150 HydrophobicContact CG-CD1 3.99Å; M146-L150 HydrophobicContact CG-CG 4.48Å; M146-L150 WeakPolarHBondContact O-CB 3.48Å; M146-L150 VanDerWaalsContact O-CG 3.26Å; M146-L150 WeakPolarHBondContact O-CG 3.45Å; M146-L150 PolarHBondContact O-N 2.94Å; W148-L150 PolarHBondContact O-N 2.63Å; L150-A153 PolarHBondContact O-N 3.46Å; L150-M154 WeakPolarHBondContact O-CG 3.39Å; L150-M154 PolarHBondContact O-N 3.47Å; L150-M154 VanDerWaalsContact O-N 3.09Å
151	S	97.7	Very high	94.5	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-69.8	-41.8	178.6	-54.8	0	0	0	0	112.2	H109 F112 A147 W148 T149 A153 M154 A155	H109-S151 WeakPolarHBondContact CA-OG 3.46Å; H109-S151 PolarHBondContact N-OG 3.42Å; H109-S151 VanDerWaalsContact N-OG 3.12Å; F112-S151 WeakPolarHBondContact CD2-OG 3.16Å; A147-S151 WeakPolarHBondContact O-CB 3.06Å; A147-S151 PolarHBondContact O-N 3.34Å; A147-S151 PolarHBondContact O-OG 2.8Å; W148-S151 PolarHBondContact O-N 3.05Å; T149-S151 VanDerWaalsContact C-N 3.3Å; T149-S151 PolarHBondContact O-N 2.94Å; S151-A153 VanDerWaalsContact C-N 3.33Å; S151-M154 PolarHBondContact O-N 3.31Å; S151-A155 WeakPolarHBondContact O-CB 3.3Å; S151-A155 PolarHBondContact O-N 3.44Å
152	V	96.8	Very high	93.3	Very high	58 Å²	58	57.2 Å²	57.2	35%	0.352	32%	0.323	S	S	.	.	H	α-helix	trans	-61.7	-44.3	172.3	172.2	0	0	0	0	110	L105 W148 T149 M154 A155 F156	L105-V152 HydrophobicContact CD1-CB 4.36Å; L105-V152 HydrophobicContact CD1-CG2 3.65Å; W148-V152 WeakPolarHBondContact O-CG2 3.17Å; W148-V152 PolarHBondContact O-N 3.44Å; T149-V152 PolarHBondContact O-N 3.36Å; V152-M154 PolarHBondContact O-N 2.92Å; V152-A155 PolarHBondContact O-N 3.36Å; V152-A155 VanDerWaalsContact O-N 3.17Å; V152-F156 HydrophobicContact CG1-CB 4.4Å; V152-F156 WeakPolarHBondContact O-CB 3.34Å; V152-F156 PolarHBondContact O-N 3Å
153	A	94.9	Very high	92.1	Very high	60 Å²	60	55.9 Å²	55.9	50%	0.496	32%	0.316	S	S	.	.	H	α-helix	trans	-58.7	-31.7	177.2	0	0	0	0	0	113	T149 L150 S151 P157	T149-A153 WeakPolarHBondContact O-CB 3.47Å; T149-A153 PolarHBondContact O-N 2.87Å; L150-A153 PolarHBondContact O-N 3.46Å; S151-A153 VanDerWaalsContact C-N 3.33Å; A153-P157 WeakPolarHBondContact O-CD 3.31Å; A153-P157 WeakPolarHBondContact O-CG 3.38Å
154	M	92.5	Very high	91.5	Very high	36 Å²	36	54.9 Å²	54.9	18%	0.177	31%	0.31	C	S	.	.	H	α-helix	trans	-81.5	-38.7	174.1	-64.4	-60.2	171.7	0	0	113.2	F108 F112 L150 S151 V152 F189 M192	F108-M154 HydrophobicContact CB-CB 4.43Å; F108-M154 HydrophobicContact CD1-CB 3.97Å; F108-M154 HydrophobicContact CD1-CG 4.01Å; F108-M154 HydrophobicContact CD2-CB 3.89Å; F108-M154 HydrophobicContact CE1-CB 4.16Å; F108-M154 HydrophobicContact CE1-CG 4.17Å; F108-M154 HydrophobicContact CE2-CB 4.09Å; F108-M154 HydrophobicContact CG-CB 3.83Å; F108-M154 HydrophobicContact CG-CG 4.34Å; F108-M154 HydrophobicContact CZ-CB 4.23Å; F112-M154 HydrophobicContact CE2-CG 3.97Å; F112-M154 HydrophobicContact CZ-CE 4.14Å; F112-M154 HydrophobicContact CZ-CG 4.24Å; L150-M154 WeakPolarHBondContact O-CG 3.39Å; L150-M154 PolarHBondContact O-N 3.47Å; L150-M154 VanDerWaalsContact O-N 3.09Å; S151-M154 PolarHBondContact O-N 3.31Å; V152-M154 PolarHBondContact O-N 2.92Å; M154-F189 WeakPolarHBondContact O-CE1 3.49Å; M154-M192 HydrophobicContact CE-CE 3.81Å; M154-M192 HydrophobicContact CE-CG 3.55Å; M154-M192 HydrophobicContact CE-SD 3.78Å; M154-M192 HydrophobicContact SD-CG 3.91Å
155	A	93.5	Very high	91.2	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-81.9	-22.9	-175.3	0	0	0	0	0	113.8	F101 V104 L105 S151 V152 Y165	F101-A155 HydrophobicContact CD2-CB 3.9Å; F101-A155 WeakPolarHBondContact CD2-O 3.23Å; F101-A155 HydrophobicContact CE2-CB 3.65Å; F101-A155 HydrophobicContact CZ-CB 4.44Å; V104-A155 HydrophobicContact CB-CB 4.44Å; V104-A155 HydrophobicContact CG1-CB 4Å; L105-A155 HydrophobicContact CB-CB 3.9Å; L105-A155 HydrophobicContact CD1-CB 4.25Å; S151-A155 WeakPolarHBondContact O-CB 3.3Å; S151-A155 PolarHBondContact O-N 3.44Å; V152-A155 PolarHBondContact O-N 3.36Å; V152-A155 VanDerWaalsContact O-N 3.17Å; A155-Y165 PolarHBondContact O-OH 2.7Å
156	F	92.3	Very high	90.9	Very high	95 Å²	95	53.8 Å²	53.8	42%	0.417	30%	0.295	S	S	.	.	S	Bend	trans	-78.8	-39.8	-171	-163.7	-111.3	0	0	0	115.6	F101 V152 V159 F160	F101-F156 HydrophobicContact CE2-CB 4.32Å; F101-F156 HydrophobicContact CE2-CD2 4.14Å; V152-F156 HydrophobicContact CG1-CB 4.4Å; V152-F156 WeakPolarHBondContact O-CB 3.34Å; V152-F156 PolarHBondContact O-N 3Å; F156-V159 HydrophobicContact CD2-CG2 4.28Å; F156-V159 WeakPolarHBondContact O-CB 3.14Å; F156-V159 VanDerWaalsContact O-CG2 3.28Å; F156-V159 WeakPolarHBondContact O-CG2 3.35Å; F156-V159 PolarHBondContact O-N 3.49Å; F156-F160 HydrophobicContact CD1-CD2 4.45Å; F156-F160 AromaticContact CD1-CE2 3.56Å; F156-F160 HydrophobicContact CD1-CE2 3.56Å; F156-F160 HydrophobicContact CD1-CZ 4.15Å; F156-F160 HydrophobicContact CE1-CD2 4.33Å; F156-F160 AromaticContact CE1-CE2 3.15Å; F156-F160 HydrophobicContact CE1-CE2 3.15Å; F156-F160 AromaticContact CE1-CZ 3.27Å; F156-F160 HydrophobicContact CE1-CZ 3.27Å; F156-F160 AromaticContact CZ-CE2 3.91Å; F156-F160 HydrophobicContact CZ-CE2 3.91Å; F156-F160 AromaticContact CZ-CZ 3.63Å; F156-F160 HydrophobicContact CZ-CZ 3.63Å
157	P	89.5	Confident	90.8	Very high	64 Å²	64	52 Å²	52	42%	0.416	29%	0.285	S	S	.	.	H	α-helix	trans	-55.9	-41.3	-176.7	-22.4	30.4	0	0	0	114.4	A153 V159 F160 F189	A153-P157 WeakPolarHBondContact O-CD 3.31Å; A153-P157 WeakPolarHBondContact O-CG 3.38Å; P157-V159 PolarHBondContact O-N 3.41Å; P157-F160 PolarHBondContact O-N 2.89Å; P157-F189 HydrophobicContact CB-CZ 4.18Å; P157-F189 HydrophobicContact CG-CZ 4.37Å
158	P	87.9	Confident	90.5	Very high	7 Å²	7	52.4 Å²	52.4	5%	0.045	29%	0.287	C	S	.	.	H	α-helix	trans	-62.6	-14	175	-23.6	34.6	0	0	0	114.6	F160 T164 Y165 F176 F189	P158-F160 VanDerWaalsContact C-N 3.27Å; P158-F160 PolarHBondContact O-N 3Å; P158-T164 PolarHBondContact O-OG1 2.85Å; P158-Y165 HydrophobicContact CB-CD2 4.19Å; P158-Y165 HydrophobicContact CB-CE1 4.15Å; P158-Y165 HydrophobicContact CB-CE2 3.66Å; P158-F176 HydrophobicContact CB-CD2 3.67Å; P158-F176 HydrophobicContact CB-CE2 3.64Å; P158-F176 HydrophobicContact CG-CD2 3.88Å; P158-F176 HydrophobicContact CG-CE2 3.67Å; P158-F176 HydrophobicContact CG-CZ 4.39Å; P158-F189 HydrophobicContact CG-CE1 4.34Å; P158-F189 HydrophobicContact CG-CE2 4.17Å; P158-F189 HydrophobicContact CG-CZ 3.89Å
159	V	88.8	Confident	90.1	Very high	46 Å²	46	56.9 Å²	56.9	28%	0.279	30%	0.304	S	S	.	.	H	α-helix	trans	-65.8	-31.8	176.3	-179.3	0	0	0	0	111.7	F101 F156 P157 Y165	F101-V159 HydrophobicContact CB-CG2 4.42Å; F101-V159 HydrophobicContact CD2-CG2 3.64Å; F101-V159 HydrophobicContact CE2-CG2 4.31Å; F101-V159 HydrophobicContact CG-CG2 4.29Å; F156-V159 HydrophobicContact CD2-CG2 4.28Å; F156-V159 WeakPolarHBondContact O-CB 3.14Å; F156-V159 VanDerWaalsContact O-CG2 3.28Å; F156-V159 WeakPolarHBondContact O-CG2 3.35Å; F156-V159 PolarHBondContact O-N 3.49Å; P157-V159 PolarHBondContact O-N 3.41Å; V159-Y165 HydrophobicContact CB-CE2 4.45Å; V159-Y165 HydrophobicContact CG2-CD2 4.15Å; V159-Y165 HydrophobicContact CG2-CE2 3.63Å
160	F	86.3	Confident	89.7	Confident	151 Å²	151	56.5 Å²	56.5	66%	0.662	30%	0.296	S	S	*	.	H	α-helix	trans	-84.6	-26.8	-175.4	-65.9	-64.8	0	0	0	114.3	F156 P157 P158	F156-F160 HydrophobicContact CD1-CD2 4.45Å; F156-F160 AromaticContact CD1-CE2 3.56Å; F156-F160 HydrophobicContact CD1-CE2 3.56Å; F156-F160 HydrophobicContact CD1-CZ 4.15Å; F156-F160 HydrophobicContact CE1-CD2 4.33Å; F156-F160 AromaticContact CE1-CE2 3.15Å; F156-F160 HydrophobicContact CE1-CE2 3.15Å; F156-F160 AromaticContact CE1-CZ 3.27Å; F156-F160 HydrophobicContact CE1-CZ 3.27Å; F156-F160 AromaticContact CZ-CE2 3.91Å; F156-F160 HydrophobicContact CZ-CE2 3.91Å; F156-F160 AromaticContact CZ-CZ 3.63Å; F156-F160 HydrophobicContact CZ-CZ 3.63Å; P157-F160 PolarHBondContact O-N 2.89Å; P158-F160 VanDerWaalsContact C-N 3.27Å; P158-F160 PolarHBondContact O-N 3Å
161	D	80.2	Confident	89.5	Confident	52 Å²	52	53.5 Å²	53.5	28%	0.278	28%	0.28	S	S	.	.	S	Bend	trans	-78.5	135.1	177.2	-173.9	19.8	0	0	0	110.9	G163 T164 R179	D161-G163 PolarHBondContact O-N 2.81Å; D161-T164 HydrophobicContact CB-CG2 3.6Å; D161-T164 PolarHBondContact O-OG1 2.92Å; D161-T164 WeakPolarHBondContact OD2-CG2 3.42Å; D161-R179 IonicContact OD2-NH1 3.31Å; D161-R179 PolarHBondContact OD2-NH1 3.19Å
162	V	73	Confident	89.3	Confident	118 Å²	118	53.7 Å²	53.7	72%	0.715	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	115.8	179.9	-76.1	0	0	0	0	109.8	R179	V162-R179 PolarHBondContact O-NH2 3.1Å
163	G	73.9	Confident	89.2	Confident	32 Å²	32	51.3 Å²	51.3	33%	0.33	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	88	15.9	173.6	0	0	0	0	0	115.7	D161 R179	D161-G163 PolarHBondContact O-N 2.81Å; G163-R179 VanDerWaalsContact C-NH2 3.28Å; G163-R179 PolarHBondContact O-NH2 3.11Å; G163-R179 VanDerWaalsContact O-NH2 3.09Å
164	T	85.8	Confident	89.2	Confident	9 Å²	9	48.5 Å²	48.5	6%	0.055	24%	0.243	C	C	.	.	S	Bend	trans	-76.7	-53.4	167	42.4	0	0	0	0	111.6	P158 D161 K166 F176 E177	P158-T164 PolarHBondContact O-OG1 2.85Å; D161-T164 HydrophobicContact CB-CG2 3.6Å; D161-T164 PolarHBondContact O-OG1 2.92Å; D161-T164 WeakPolarHBondContact OD2-CG2 3.42Å; T164-K166 PolarHBondContact O-N 3.24Å; T164-F176 HydrophobicContact CG2-CE2 3.96Å; T164-E177 PolarHBondContact O-N 3.02Å
165	Y	92.8	Very high	89.2	Confident	9 Å²	9	47.4 Å²	47.4	4%	0.035	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	105.5	172.2	-73.1	-42.1	0	0	0	109.9	A100 F101 V104 A155 P158 V159 F176	A100-Y165 HydrophobicContact CB-CD1 3.4Å; A100-Y165 VanDerWaalsContact CB-CD1 3.4Å; A100-Y165 HydrophobicContact CB-CE1 4.06Å; A100-Y165 HydrophobicContact CB-CG 3.72Å; F101-Y165 HydrophobicContact CB-CE2 4.09Å; F101-Y165 HydrophobicContact CD2-CE2 4.48Å; V104-Y165 HydrophobicContact CB-CE1 4.5Å; V104-Y165 HydrophobicContact CG2-CE1 3.92Å; A155-Y165 PolarHBondContact O-OH 2.7Å; P158-Y165 HydrophobicContact CB-CD2 4.19Å; P158-Y165 HydrophobicContact CB-CE1 4.15Å; P158-Y165 HydrophobicContact CB-CE2 3.66Å; V159-Y165 HydrophobicContact CB-CE2 4.45Å; V159-Y165 HydrophobicContact CG2-CD2 4.15Å; V159-Y165 HydrophobicContact CG2-CE2 3.63Å; Y165-F176 HydrophobicContact CD1-CB 4.18Å; Y165-F176 HydrophobicContact CD1-CD2 4.49Å; Y165-F176 HydrophobicContact CE1-CB 3.88Å; Y165-F176 HydrophobicContact CE1-CD2 4.29Å
166	K	92.4	Very high	89.1	Confident	76 Å²	76	48 Å²	48	33%	0.33	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	165.2	-178.6	72.9	-176	-158.5	-176	0	111.5	T164 C174 I175 E177	T164-K166 PolarHBondContact O-N 3.24Å; K166-C174 WeakPolarHBondContact O-CA 3.38Å; K166-I175 PolarHBondContact N-O 3.2Å; K166-I175 PolarHBondContact O-N 3.25Å; K166-E177 HydrophobicContact CD-CB 4.26Å; K166-E177 WeakPolarHBondContact CE-OE1 3.33Å; K166-E177 WeakPolarHBondContact CE-OE2 3.4Å; K166-E177 HydrophobicContact CG-CB 4.27Å; K166-E177 IonicContact NZ-OE1 3.27Å; K166-E177 PolarHBondContact NZ-OE1 2.87Å; K166-E177 IonicContact NZ-OE2 3.74Å; K166-E177 PolarHBondContact NZ-OE2 3.49Å
167	F	94.7	Very high	88.8	Confident	48 Å²	48	45.7 Å²	45.7	21%	0.211	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	128	175.1	-178.7	-107.7	0	0	0	110.8	S82 S87 W89 C96 R169	S82-F167 WeakPolarHBondContact OG-CE2 3.35Å; S82-F167 WeakPolarHBondContact OG-CZ 3.44Å; S87-F167 WeakPolarHBondContact O-CE1 3.44Å; S87-F167 WeakPolarHBondContact O-CZ 3.31Å; W89-F167 HydrophobicContact CB-CB 4Å; W89-F167 HydrophobicContact CB-CD1 4.04Å; W89-F167 HydrophobicContact CB-CD2 3.75Å; W89-F167 HydrophobicContact CB-CE1 4.48Å; W89-F167 HydrophobicContact CB-CE2 4.22Å; W89-F167 HydrophobicContact CB-CG 3.65Å; W89-F167 HydrophobicContact CD2-CD2 4.27Å; W89-F167 AromaticContact CE3-CD2 3.75Å; W89-F167 HydrophobicContact CE3-CD2 3.75Å; W89-F167 HydrophobicContact CE3-CE2 4.12Å; W89-F167 HydrophobicContact CG-CB 4.48Å; W89-F167 HydrophobicContact CG-CD2 4.32Å; W89-F167 HydrophobicContact CG-CG 4.43Å; C96-F167 PolarHBondContact SG-N 2.89Å; F167-R169 HydrophobicContact CE1-CB 4.1Å
168	I	92.6	Very high	88.4	Confident	10 Å²	10	43.7 Å²	43.7	5%	0.051	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	109.6	174.3	-57	-175.4	0	0	0	107.8	E170 E171 D172 Q173 I175	I168-E170 VanDerWaalsContact C-N 3.25Å; I168-E170 VanDerWaalsContact CG2-OE2 3.29Å; I168-E170 WeakPolarHBondContact CG2-OE2 3.35Å; I168-E170 PolarHBondContact O-N 3.06Å; I168-E171 HydrophobicContact CB-CB 4.27Å; I168-E171 HydrophobicContact CB-CG 4.24Å; I168-E171 HydrophobicContact CG2-CB 4.25Å; I168-E171 HydrophobicContact CG2-CG 3.78Å; I168-E171 PolarHBondContact O-N 3.01Å; I168-D172 PolarHBondContact O-N 3.34Å; I168-D172 VanDerWaalsContact O-N 3.13Å; I168-Q173 PolarHBondContact N-O 3.16Å; I168-I175 HydrophobicContact CD1-CG2 3.49Å; I168-I175 VanDerWaalsContact CD1-CG2 3.49Å; I168-I175 HydrophobicContact CG1-CG2 4.03Å
169	R	91.5	Very high	87.8	Confident	167 Å²	167	47.2 Å²	47.2	63%	0.63	23%	0.228	S	C	*	.	G	3₁₀ helix	trans	-58.1	-36.7	-175.1	178.8	172.9	175.3	-151.6	-1.3	112.7	S87 F167 E171 D172	S87-R169 WeakPolarHBondContact O-CG 3.16Å; F167-R169 HydrophobicContact CE1-CB 4.1Å; R169-E171 PolarHBondContact O-N 3.41Å; R169-D172 PolarHBondContact O-N 2.92Å
170	E	90	Very high	87	Confident	83 Å²	83	48.7 Å²	48.7	39%	0.388	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-71.9	-18.1	-179.3	-57.2	72.4	-155.1	0	0	113.3	I168 L322	I168-E170 VanDerWaalsContact C-N 3.25Å; I168-E170 VanDerWaalsContact CG2-OE2 3.29Å; I168-E170 WeakPolarHBondContact CG2-OE2 3.35Å; I168-E170 PolarHBondContact O-N 3.06Å; E170-L322 HydrophobicContact CB-CD2 3.52Å; E170-L322 HydrophobicContact CG-CD2 4.44Å
171	E	92.7	Very high	86.4	Confident	3 Å²	3	45.2 Å²	45.2	1%	0.014	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-106.2	-2.7	179.7	-55.2	-170.7	-159.6	0	0	112.9	I168 R169 Q173 Y302 R309 L322 V326	I168-E171 HydrophobicContact CB-CB 4.27Å; I168-E171 HydrophobicContact CB-CG 4.24Å; I168-E171 HydrophobicContact CG2-CB 4.25Å; I168-E171 HydrophobicContact CG2-CG 3.78Å; I168-E171 PolarHBondContact O-N 3.01Å; R169-E171 PolarHBondContact O-N 3.41Å; E171-Q173 HydrophobicContact CB-CG 4.07Å; E171-Q173 PolarHBondContact O-N 3.39Å; E171-Q173 VanDerWaalsContact O-N 3.07Å; E171-Y302 WeakPolarHBondContact OE2-CE2 3.46Å; E171-Y302 PolarHBondContact OE2-OH 3.35Å; E171-R309 IonicContact OE1-CZ 3.48Å; E171-R309 IonicContact OE1-NH2 2.75Å; E171-R309 PolarHBondContact OE1-NH2 3.35Å; E171-L322 HydrophobicContact CG-CD1 4.19Å; E171-L322 HydrophobicContact CG-CD2 4.01Å; E171-L322 HydrophobicContact CG-CG 4.17Å; E171-V326 HydrophobicContact CB-CG2 3.99Å; E171-V326 HydrophobicContact CG-CG2 3.77Å
172	D	93.5	Very high	85.7	Confident	4 Å²	4	50 Å²	50	2%	0.021	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	21.3	-179	-58.2	-66.1	0	0	0	114.1	K25 V79 S82 V83 S87 I168 R169	K25-D172 IonicContact NZ-OD1 2.69Å; K25-D172 IonicContact NZ-OD2 2.75Å; K25-D172 PolarHBondContact NZ-OD2 3.21Å; V79-D172 HydrophobicContact CG1-CB 4.36Å; S82-D172 WeakPolarHBondContact CB-O 3.24Å; V83-D172 HydrophobicContact CG2-CB 3.64Å; S87-D172 WeakPolarHBondContact CB-OD1 3.37Å; S87-D172 PolarHBondContact OG-OD1 3.43Å; I168-D172 PolarHBondContact O-N 3.34Å; I168-D172 VanDerWaalsContact O-N 3.13Å; R169-D172 PolarHBondContact O-N 2.92Å
173	Q	94.6	Very high	85.4	Confident	8 Å²	8	46.9 Å²	46.9	4%	0.037	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	161.4	-174.5	72.7	-175	-45.3	0	0	113.5	V79 I168 E171 I175 F330	V79-Q173 HydrophobicContact CG2-CB 3.73Å; I168-Q173 PolarHBondContact N-O 3.16Å; E171-Q173 HydrophobicContact CB-CG 4.07Å; E171-Q173 PolarHBondContact O-N 3.39Å; E171-Q173 VanDerWaalsContact O-N 3.07Å; Q173-I175 HydrophobicContact CG-CB 4.35Å; Q173-F330 VanDerWaalsContact NE2-CZ 3.33Å; Q173-F330 VanDerWaalsContact OE1-CE1 3.3Å
174	C	95	Very high	84.8	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	125.4	166.7	-67.4	0	0	0	0	110.3	W89 C96 A100 K166	W89-C174 HydrophobicContact CZ3-CB 4.41Å; C96-C174 WeakPolarHBondContact CA-SG 3.47Å; C96-C174 HydrophobicContact CB-CB 4.01Å; C96-C174 WeakPolarHBondContact CB-SG 3.36Å; C96-C174 WeakPolarHBondContact O-CB 3.46Å; C96-C174 WeakPolarHBondContact SG-CB 3.18Å; C96-C174 CovalentContact SG-SG 2.03Å; C96-C174 PolarHBondContact SG-SG 3.36Å; A100-C174 VanDerWaalsContact CA-O 3.28Å; A100-C174 WeakPolarHBondContact CA-O 3.37Å; A100-C174 HydrophobicContact CB-CB 3.99Å; A100-C174 WeakPolarHBondContact CB-O 3.49Å; K166-C174 WeakPolarHBondContact O-CA 3.38Å
175	I	93.1	Very high	84	Confident	14 Å²	14	56 Å²	56	7%	0.072	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	174.2	-177.5	-163.1	148.1	0	0	0	110.6	K166 I168 Q173 E177 Y302	K166-I175 PolarHBondContact N-O 3.2Å; K166-I175 PolarHBondContact O-N 3.25Å; I168-I175 HydrophobicContact CD1-CG2 3.49Å; I168-I175 VanDerWaalsContact CD1-CG2 3.49Å; I168-I175 HydrophobicContact CG1-CG2 4.03Å; Q173-I175 HydrophobicContact CG-CB 4.35Å; I175-E177 PolarHBondContact O-N 3.28Å; I175-Y302 WeakPolarHBondContact CD1-OH 3.45Å
176	F	89.6	Confident	83.3	Confident	12 Å²	12	55.8 Å²	55.8	5%	0.053	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	118.6	172.7	-176.2	-117.9	0	0	0	110.9	V104 P158 T164 Y165 H178 T186 F189	V104-F176 HydrophobicContact CG2-CB 4.17Å; P158-F176 HydrophobicContact CB-CD2 3.67Å; P158-F176 HydrophobicContact CB-CE2 3.64Å; P158-F176 HydrophobicContact CG-CD2 3.88Å; P158-F176 HydrophobicContact CG-CE2 3.67Å; P158-F176 HydrophobicContact CG-CZ 4.39Å; T164-F176 HydrophobicContact CG2-CE2 3.96Å; Y165-F176 HydrophobicContact CD1-CB 4.18Å; Y165-F176 HydrophobicContact CD1-CD2 4.49Å; Y165-F176 HydrophobicContact CE1-CB 3.88Å; Y165-F176 HydrophobicContact CE1-CD2 4.29Å; F176-H178 AromaticContact CD1-NE2 3.75Å; F176-H178 PolarHBondContact O-CE1 3.08Å; F176-H178 PolarHBondContact O-N 3.12Å; F176-H178 PolarHBondContact O-ND1 3.34Å; F176-T186 HydrophobicContact CE1-CG2 3.82Å; F176-T186 HydrophobicContact CZ-CG2 3.7Å; F176-F189 HydrophobicContact CE1-CD2 4.07Å; F176-F189 AromaticContact CZ-CD2 3.87Å; F176-F189 HydrophobicContact CZ-CD2 3.87Å; F176-F189 HydrophobicContact CZ-CE2 4.21Å
177	E	86.8	Confident	82.7	Confident	47 Å²	47	54.5 Å²	54.5	22%	0.22	26%	0.255	C	S	.	.			trans	-72.5	117.9	174.3	179.3	-179.7	-142.9	0	0	111.1	T164 K166 I175 R179	T164-E177 PolarHBondContact O-N 3.02Å; K166-E177 HydrophobicContact CD-CB 4.26Å; K166-E177 WeakPolarHBondContact CE-OE1 3.33Å; K166-E177 WeakPolarHBondContact CE-OE2 3.4Å; K166-E177 HydrophobicContact CG-CB 4.27Å; K166-E177 IonicContact NZ-OE1 3.27Å; K166-E177 PolarHBondContact NZ-OE1 2.87Å; K166-E177 IonicContact NZ-OE2 3.74Å; K166-E177 PolarHBondContact NZ-OE2 3.49Å; I175-E177 PolarHBondContact O-N 3.28Å; E177-R179 HydrophobicContact CG-CG 4.22Å; E177-R179 PolarHBondContact O-N 3.4Å; E177-R179 VanDerWaalsContact O-N 3.11Å; E177-R179 IonicContact OE2-NE 2.61Å
178	H	81.9	Confident	82.1	Confident	22 Å²	22	54.3 Å²	54.3	10%	0.102	27%	0.267	C	S	.	.			trans	-79.8	91	171.9	-61.6	87	0	0	0	110.6	F176 M190 C306 V310	F176-H178 AromaticContact CD1-NE2 3.75Å; F176-H178 PolarHBondContact O-CE1 3.08Å; F176-H178 PolarHBondContact O-N 3.12Å; F176-H178 PolarHBondContact O-ND1 3.34Å; H178-M190 PolarHBondContact NE2-SD 3.07Å; H178-C306 PolarHBondContact CE1-SG 3.08Å; H178-V310 HydrophobicContact CB-CG2 4.02Å
179	R	75.4	Confident	81.7	Confident	80 Å²	80	55.9 Å²	55.9	30%	0.302	27%	0.274	S	S	.	.			trans	-69.4	157.1	172.1	-61.3	-179.2	-178.6	159.9	1.4	111.4	D161 V162 G163 E177 A183 T186	D161-R179 IonicContact OD2-NH1 3.31Å; D161-R179 PolarHBondContact OD2-NH1 3.19Å; V162-R179 PolarHBondContact O-NH2 3.1Å; G163-R179 VanDerWaalsContact C-NH2 3.28Å; G163-R179 PolarHBondContact O-NH2 3.11Å; G163-R179 VanDerWaalsContact O-NH2 3.09Å; E177-R179 HydrophobicContact CG-CG 4.22Å; E177-R179 PolarHBondContact O-N 3.4Å; E177-R179 VanDerWaalsContact O-N 3.11Å; E177-R179 IonicContact OE2-NE 2.61Å; R179-A183 HydrophobicContact CB-CB 3.95Å; R179-T186 HydrophobicContact CB-CG2 4.07Å; R179-T186 PolarHBondContact O-OG1 2.93Å
180	Y	72.2	Confident	81.4	Confident	78 Å²	78	48.4 Å²	48.4	31%	0.306	25%	0.246	S	C	.	.			trans	-56.9	144.3	177.2	-176.1	-109.3	0	0	0	111.6	K182 A183 V310 K313	Y180-K182 HydrophobicContact CD1-CB 3.92Å; Y180-K182 HydrophobicContact CD1-CG 4.13Å; Y180-K182 HydrophobicContact CE1-CB 4.1Å; Y180-K182 HydrophobicContact CE1-CD 4.04Å; Y180-K182 HydrophobicContact CE1-CG 3.77Å; Y180-K182 PolarHBondContact O-N 3.08Å; Y180-A183 WeakPolarHBondContact O-CB 3.46Å; Y180-A183 PolarHBondContact O-N 3.08Å; Y180-V310 WeakPolarHBondContact CD2-O 3.35Å; Y180-K313 HydrophobicContact CD2-CB 3.81Å; Y180-K313 HydrophobicContact CD2-CG 4.43Å; Y180-K313 HydrophobicContact CE2-CB 3.68Å; Y180-K313 HydrophobicContact CG-CB 4.49Å
181	F	72.7	Confident	81.3	Confident	77 Å²	77	48.4 Å²	48.4	34%	0.338	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-51.6	-32.2	-168.5	90.1	-93.5	0	0	0	114.8	A183 N184 V310	F181-A183 PolarHBondContact O-N 2.73Å; F181-A183 VanDerWaalsContact O-N 3.16Å; F181-N184 PolarHBondContact O-N 2.99Å; F181-V310 HydrophobicContact CB-CG1 3.82Å; F181-V310 PolarHBondContact N-O 3.17Å; F181-V310 VanDerWaalsContact N-O 3.08Å
182	K	65.1	Low	81.2	Confident	154 Å²	154	51.7 Å²	51.7	67%	0.67	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-65.2	-13.7	178.7	-73	-170.9	177.5	-173.9	0	114.1	Y180 N184	Y180-K182 HydrophobicContact CD1-CB 3.92Å; Y180-K182 HydrophobicContact CD1-CG 4.13Å; Y180-K182 HydrophobicContact CE1-CB 4.1Å; Y180-K182 HydrophobicContact CE1-CD 4.04Å; Y180-K182 HydrophobicContact CE1-CG 3.77Å; Y180-K182 PolarHBondContact O-N 3.08Å; K182-N184 PolarHBondContact O-N 3.16Å
183	A	67.7	Low	81.1	Confident	51 Å²	51	52.1 Å²	52.1	42%	0.421	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-80	8.1	170.6	0	0	0	0	0	113	R179 Y180 F181 D185	R179-A183 HydrophobicContact CB-CB 3.95Å; Y180-A183 WeakPolarHBondContact O-CB 3.46Å; Y180-A183 PolarHBondContact O-N 3.08Å; F181-A183 PolarHBondContact O-N 2.73Å; F181-A183 VanDerWaalsContact O-N 3.16Å; A183-D185 PolarHBondContact O-N 3.1Å
184	N	61.5	Low	81	Confident	138 Å²	138	53.6 Å²	53.6	74%	0.738	28%	0.28	S	S	*	.	S	Bend	trans	54.9	-10	170.8	-89.2	2.7	0	0	0	120.5	F181 K182	F181-N184 PolarHBondContact O-N 2.99Å; K182-N184 PolarHBondContact O-N 3.16Å
185	D	68.8	Low	81	Confident	95 Å²	95	58 Å²	58	51%	0.508	31%	0.307	S	S	.	.	S	Bend	trans	-103	-30.2	-171.1	-72.2	-21.1	0	0	0	115.8	A183 F189	A183-D185 PolarHBondContact O-N 3.1Å; D185-F189 WeakPolarHBondContact O-CD2 3.43Å
186	T	76.6	Confident	81.1	Confident	5 Å²	5	58.1 Å²	58.1	3%	0.031	31%	0.308	C	S	.	.	H	α-helix	trans	-84.3	-25.3	-167.2	64.4	0	0	0	0	114.2	F176 R179 G188 M190	F176-T186 HydrophobicContact CE1-CG2 3.82Å; F176-T186 HydrophobicContact CZ-CG2 3.7Å; R179-T186 HydrophobicContact CB-CG2 4.07Å; R179-T186 PolarHBondContact O-OG1 2.93Å; T186-G188 PolarHBondContact O-N 3.46Å; T186-M190 PolarHBondContact O-N 3.1Å
187	L	80.6	Confident	81.3	Confident	48 Å²	48	58 Å²	58	25%	0.251	31%	0.307	S	S	.	.	H	α-helix	trans	-66.4	-36.9	-177.1	-177.6	65.3	0	0	0	111.9	F189 M190 L191 Y307 V310 F311	L187-F189 PolarHBondContact O-N 3.39Å; L187-M190 PolarHBondContact O-N 3.18Å; L187-L191 HydrophobicContact CD1-CD1 4.18Å; L187-L191 HydrophobicContact CD1-CG 4.08Å; L187-L191 HydrophobicContact CD2-CD1 4.22Å; L187-L191 HydrophobicContact CG-CD1 3.75Å; L187-L191 HydrophobicContact CG-CG 4.11Å; L187-L191 WeakPolarHBondContact O-CB 3.3Å; L187-L191 VanDerWaalsContact O-CG 3.29Å; L187-L191 WeakPolarHBondContact O-CG 3.34Å; L187-L191 PolarHBondContact O-N 2.86Å; L187-Y307 HydrophobicContact CD1-CE1 4.29Å; L187-V310 HydrophobicContact CD1-CG1 4.28Å; L187-F311 HydrophobicContact CD1-CE1 4.47Å; L187-F311 HydrophobicContact CD1-CZ 3.85Å
188	G	83	Confident	81.7	Confident	45 Å²	45	58.7 Å²	58.7	46%	0.464	32%	0.321	S	S	.	.	H	α-helix	trans	-60	-46.6	179.8	0	0	0	0	0	112.7	T186 M190 L191 M192	T186-G188 PolarHBondContact O-N 3.46Å; G188-M190 PolarHBondContact O-N 2.97Å; G188-L191 PolarHBondContact O-N 3.36Å; G188-M192 WeakPolarHBondContact O-CB 3.5Å; G188-M192 PolarHBondContact O-N 3.5Å
189	F	84	Confident	82.5	Confident	43 Å²	43	59.3 Å²	59.3	19%	0.189	33%	0.33	C	S	.	.	H	α-helix	trans	-62.5	-43	177.9	-67.2	-75.4	0	0	0	112.4	M154 P157 P158 F176 D185 L187 M192 L193	M154-F189 WeakPolarHBondContact O-CE1 3.49Å; P157-F189 HydrophobicContact CB-CZ 4.18Å; P157-F189 HydrophobicContact CG-CZ 4.37Å; P158-F189 HydrophobicContact CG-CE1 4.34Å; P158-F189 HydrophobicContact CG-CE2 4.17Å; P158-F189 HydrophobicContact CG-CZ 3.89Å; F176-F189 HydrophobicContact CE1-CD2 4.07Å; F176-F189 AromaticContact CZ-CD2 3.87Å; F176-F189 HydrophobicContact CZ-CD2 3.87Å; F176-F189 HydrophobicContact CZ-CE2 4.21Å; D185-F189 WeakPolarHBondContact O-CD2 3.43Å; L187-F189 PolarHBondContact O-N 3.39Å; F189-M192 PolarHBondContact O-N 3Å; F189-L193 PolarHBondContact O-N 3.34Å; F189-L193 VanDerWaalsContact O-N 3.1Å
190	M	84.6	Confident	83.6	Confident	10 Å²	10	55.5 Å²	55.5	5%	0.049	32%	0.315	C	S	.	.	H	α-helix	trans	-65.1	-45.6	177.7	-73	-62.3	-63	0	0	112.1	H178 T186 L187 G188 M192 L193 A194 I303 C306 Y307	H178-M190 PolarHBondContact NE2-SD 3.07Å; T186-M190 PolarHBondContact O-N 3.1Å; L187-M190 PolarHBondContact O-N 3.18Å; G188-M190 PolarHBondContact O-N 2.97Å; M190-M192 VanDerWaalsContact C-N 3.34Å; M190-M192 PolarHBondContact O-N 3.35Å; M190-L193 PolarHBondContact O-N 3.5Å; M190-A194 WeakPolarHBondContact O-CB 3.36Å; M190-A194 PolarHBondContact O-N 2.96Å; M190-I303 HydrophobicContact CE-CB 4.47Å; M190-I303 HydrophobicContact CE-CG2 3.93Å; M190-I303 WeakPolarHBondContact CE-O 3.46Å; M190-C306 HydrophobicContact CE-CB 3.23Å; M190-C306 HydrophobicContact SD-CB 3.6Å; M190-Y307 HydrophobicContact CB-CE1 4.04Å; M190-Y307 HydrophobicContact CE-CD2 3.66Å; M190-Y307 HydrophobicContact CE-CE2 3.69Å; M190-Y307 HydrophobicContact CE-CG 4.13Å; M190-Y307 PolarHBondContact O-OH 3.35Å
191	L	87.9	Confident	84.7	Confident	83 Å²	83	54 Å²	54	44%	0.435	31%	0.311	S	S	.	.	H	α-helix	trans	-62.9	-40.5	176.1	-73.3	175.3	0	0	0	111.7	L187 G188 A194 V195	L187-L191 HydrophobicContact CD1-CD1 4.18Å; L187-L191 HydrophobicContact CD1-CG 4.08Å; L187-L191 HydrophobicContact CD2-CD1 4.22Å; L187-L191 HydrophobicContact CG-CD1 3.75Å; L187-L191 HydrophobicContact CG-CG 4.11Å; L187-L191 WeakPolarHBondContact O-CB 3.3Å; L187-L191 VanDerWaalsContact O-CG 3.29Å; L187-L191 WeakPolarHBondContact O-CG 3.34Å; L187-L191 PolarHBondContact O-N 2.86Å; G188-L191 PolarHBondContact O-N 3.36Å; L191-A194 PolarHBondContact O-N 3.46Å; L191-V195 WeakPolarHBondContact O-CB 3.32Å; L191-V195 VanDerWaalsContact O-CG2 3.25Å; L191-V195 WeakPolarHBondContact O-CG2 3.16Å; L191-V195 PolarHBondContact O-N 3.44Å
192	M	90.6	Very high	85.9	Confident	72 Å²	72	53 Å²	53	36%	0.355	32%	0.317	S	S	.	.	H	α-helix	trans	-60.3	-48.2	176.9	-177.4	61.1	63.8	0	0	111.4	F108 M154 G188 F189 M190 A194 V195 L196	F108-M192 HydrophobicContact CE1-CG 4.49Å; M154-M192 HydrophobicContact CE-CE 3.81Å; M154-M192 HydrophobicContact CE-CG 3.55Å; M154-M192 HydrophobicContact CE-SD 3.78Å; M154-M192 HydrophobicContact SD-CG 3.91Å; G188-M192 WeakPolarHBondContact O-CB 3.5Å; G188-M192 PolarHBondContact O-N 3.5Å; F189-M192 PolarHBondContact O-N 3Å; M190-M192 VanDerWaalsContact C-N 3.34Å; M190-M192 PolarHBondContact O-N 3.35Å; M192-A194 VanDerWaalsContact C-N 3.33Å; M192-A194 PolarHBondContact O-N 2.83Å; M192-V195 PolarHBondContact O-N 3.31Å; M192-L196 HydrophobicContact CG-CD1 4.2Å; M192-L196 VanDerWaalsContact O-CG 3.31Å; M192-L196 WeakPolarHBondContact O-CG 3.38Å; M192-L196 PolarHBondContact O-N 3.21Å; M192-L196 HydrophobicContact SD-CG 4.4Å
193	L	91.9	Very high	87.5	Confident	13 Å²	13	46.9 Å²	46.9	7%	0.068	29%	0.293	C	S	.	.	H	α-helix	trans	-61	-43	176.8	-176.1	61.9	0	0	0	111.5	F108 A111 F189 M190 V195 L196 M197 I303	F108-L193 HydrophobicContact CE1-CB 4.13Å; F108-L193 HydrophobicContact CE1-CD1 4.38Å; F108-L193 HydrophobicContact CZ-CB 4.41Å; A111-L193 HydrophobicContact CB-CD1 3.85Å; F189-L193 PolarHBondContact O-N 3.34Å; F189-L193 VanDerWaalsContact O-N 3.1Å; M190-L193 PolarHBondContact O-N 3.5Å; L193-V195 PolarHBondContact O-N 2.65Å; L193-L196 PolarHBondContact O-N 2.88Å; L193-M197 WeakPolarHBondContact O-CG 3.39Å; L193-M197 PolarHBondContact O-N 3.48Å; L193-I303 HydrophobicContact CD2-CD1 4.17Å; L193-I303 HydrophobicContact CD2-CG1 4.29Å
194	A	92.2	Very high	88.9	Confident	38 Å²	38	44.6 Å²	44.6	31%	0.314	27%	0.273	S	S	.	.	H	α-helix	trans	-61.7	-43.2	176.5	0	0	0	0	0	112.4	M190 L191 M192 M197 A198	M190-A194 WeakPolarHBondContact O-CB 3.36Å; M190-A194 PolarHBondContact O-N 2.96Å; L191-A194 PolarHBondContact O-N 3.46Å; M192-A194 VanDerWaalsContact C-N 3.33Å; M192-A194 PolarHBondContact O-N 2.83Å; A194-M197 PolarHBondContact O-N 3.43Å; A194-A198 VanDerWaalsContact O-CB 3.31Å; A194-A198 WeakPolarHBondContact O-CB 3.23Å; A194-A198 PolarHBondContact O-N 2.87Å
195	V	94	Very high	90.6	Very high	92 Å²	92	39.4 Å²	39.4	56%	0.558	25%	0.253	S	S	*	.	H	α-helix	trans	-63.8	-43.3	176.5	168.7	0	0	0	0	111	L191 M192 L193 A198 A199	L191-V195 WeakPolarHBondContact O-CB 3.32Å; L191-V195 VanDerWaalsContact O-CG2 3.25Å; L191-V195 WeakPolarHBondContact O-CG2 3.16Å; L191-V195 PolarHBondContact O-N 3.44Å; M192-V195 PolarHBondContact O-N 3.31Å; L193-V195 PolarHBondContact O-N 2.65Å; V195-A198 PolarHBondContact O-N 3.5Å; V195-A199 VanDerWaalsContact O-CB 3.23Å; V195-A199 WeakPolarHBondContact O-CB 3.28Å; V195-A199 PolarHBondContact O-N 2.84Å
196	L	95.9	Very high	92	Very high	18 Å²	18	41.5 Å²	41.5	9%	0.094	26%	0.258	C	S	.	.	H	α-helix	trans	-62.6	-43	176.9	-71.1	172.2	0	0	0	112	F108 F112 M192 L193 A199 T200	F108-L196 HydrophobicContact CD1-CD1 4.41Å; F112-L196 HydrophobicContact CD1-CD1 4.04Å; F112-L196 HydrophobicContact CD1-CD2 3.9Å; F112-L196 HydrophobicContact CD2-CD1 4.42Å; F112-L196 HydrophobicContact CE1-CD1 3.57Å; F112-L196 HydrophobicContact CE1-CD2 3.5Å; F112-L196 VanDerWaalsContact CE1-CD2 3.5Å; F112-L196 HydrophobicContact CE1-CG 4.19Å; F112-L196 HydrophobicContact CE2-CD1 3.98Å; F112-L196 HydrophobicContact CG-CD1 4.45Å; F112-L196 HydrophobicContact CZ-CD1 3.53Å; F112-L196 HydrophobicContact CZ-CD2 4.26Å; M192-L196 HydrophobicContact CG-CD1 4.2Å; M192-L196 VanDerWaalsContact O-CG 3.31Å; M192-L196 WeakPolarHBondContact O-CG 3.38Å; M192-L196 PolarHBondContact O-N 3.21Å; M192-L196 HydrophobicContact SD-CG 4.4Å; L193-L196 PolarHBondContact O-N 2.88Å; L196-A199 PolarHBondContact O-N 2.69Å; L196-T200 WeakPolarHBondContact O-CB 3.47Å; L196-T200 PolarHBondContact O-N 3.23Å; L196-T200 PolarHBondContact O-OG1 3.46Å
197	M	94.2	Very high	92.9	Very high	9 Å²	9	41.5 Å²	41.5	4%	0.044	26%	0.257	C	S	.	.	H	α-helix	trans	-65.1	-44.9	176.3	-70.7	-54	-63.4	0	0	111.9	L193 A194 T200 H201 F295 L296	L193-M197 WeakPolarHBondContact O-CG 3.39Å; L193-M197 PolarHBondContact O-N 3.48Å; A194-M197 PolarHBondContact O-N 3.43Å; M197-T200 PolarHBondContact O-N 3.43Å; M197-H201 PolarHBondContact O-N 3.38Å; M197-H201 PolarHBondContact O-ND1 3.33Å; M197-H201 VanDerWaalsContact O-ND1 3.16Å; M197-F295 HydrophobicContact CE-CD1 3.59Å; M197-F295 HydrophobicContact CE-CE1 4.1Å; M197-F295 HydrophobicContact SD-CD1 3.69Å; M197-F295 HydrophobicContact SD-CE1 3.59Å; M197-F295 VanDerWaalsContact SD-CE1 3.59Å; M197-L296 HydrophobicContact CB-CD1 4.47Å; M197-L296 HydrophobicContact CE-CB 3.63Å; M197-L296 HydrophobicContact CE-CD1 3.85Å; M197-L296 HydrophobicContact CE-CG 4.28Å
198	A	96	Very high	93.6	Very high	61 Å²	61	42.9 Å²	42.9	50%	0.504	26%	0.264	S	S	.	.	H	α-helix	trans	-62.1	-44.6	176.1	0	0	0	0	0	111.9	A194 V195 T200 H201 A202	A194-A198 VanDerWaalsContact O-CB 3.31Å; A194-A198 WeakPolarHBondContact O-CB 3.23Å; A194-A198 PolarHBondContact O-N 2.87Å; V195-A198 PolarHBondContact O-N 3.5Å; A198-T200 PolarHBondContact O-N 2.86Å; A198-H201 PolarHBondContact O-N 2.94Å; A198-A202 WeakPolarHBondContact O-CB 3.4Å; A198-A202 PolarHBondContact O-N 3.25Å
199	A	97.6	Very high	94.2	Very high	35 Å²	35	45.7 Å²	45.7	29%	0.289	27%	0.268	S	S	.	.	H	α-helix	trans	-61.2	-44.7	176.5	0	0	0	0	0	111.6	F115 V195 L196 H201 A202 V203	F115-A199 HydrophobicContact CD2-CB 4.28Å; F115-A199 HydrophobicContact CE2-CB 3.97Å; V195-A199 VanDerWaalsContact O-CB 3.23Å; V195-A199 WeakPolarHBondContact O-CB 3.28Å; V195-A199 PolarHBondContact O-N 2.84Å; L196-A199 PolarHBondContact O-N 2.69Å; A199-H201 VanDerWaalsContact C-N 3.33Å; A199-H201 PolarHBondContact O-N 2.95Å; A199-A202 PolarHBondContact O-N 2.95Å; A199-V203 WeakPolarHBondContact O-CG2 3.26Å; A199-V203 PolarHBondContact O-N 2.97Å
200	T	97.9	Very high	94.6	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-58.9	-45.3	176.1	-56.9	0	0	0	0	111.2	F115 L196 M197 A198 V203 Y204 T292	F115-T200 WeakPolarHBondContact CA-OG1 3.31Å; F115-T200 WeakPolarHBondContact CB-OG1 3.43Å; L196-T200 WeakPolarHBondContact O-CB 3.47Å; L196-T200 PolarHBondContact O-N 3.23Å; L196-T200 PolarHBondContact O-OG1 3.46Å; M197-T200 PolarHBondContact O-N 3.43Å; A198-T200 PolarHBondContact O-N 2.86Å; T200-V203 PolarHBondContact O-N 2.89Å; T200-Y204 HydrophobicContact CG2-CD2 4.07Å; T200-Y204 HydrophobicContact CG2-CE2 4Å; T200-Y204 WeakPolarHBondContact O-CD2 3.49Å; T200-Y204 PolarHBondContact O-N 3.02Å; T200-T292 HydrophobicContact CG2-CG2 3.59Å
201	H	96.6	Very high	94.9	Very high	46 Å²	46	46.1 Å²	46.1	21%	0.213	27%	0.27	C	S	.	.	H	α-helix	trans	-70.5	-33	179.1	-75.6	40.2	0	0	0	112.4	M197 A198 A199 Y204 G205 L296	M197-H201 PolarHBondContact O-N 3.38Å; M197-H201 PolarHBondContact O-ND1 3.33Å; M197-H201 VanDerWaalsContact O-ND1 3.16Å; A198-H201 PolarHBondContact O-N 2.94Å; A199-H201 VanDerWaalsContact C-N 3.33Å; A199-H201 PolarHBondContact O-N 2.95Å; H201-Y204 PolarHBondContact O-N 2.95Å; H201-G205 PolarHBondContact O-N 2.93Å; H201-L296 WeakPolarHBondContact NE2-CD2 3.26Å
202	A	98	Very high	95.1	Very high	57 Å²	57	48.4 Å²	48.4	47%	0.471	27%	0.274	S	S	.	.	H	α-helix	trans	-64.3	-39.7	172.5	0	0	0	0	0	111.9	A198 A199 G205 K206	A198-A202 WeakPolarHBondContact O-CB 3.4Å; A198-A202 PolarHBondContact O-N 3.25Å; A199-A202 PolarHBondContact O-N 2.95Å; A202-G205 PolarHBondContact O-N 2.88Å; A202-K206 WeakPolarHBondContact O-CG 3.42Å; A202-K206 PolarHBondContact O-N 3.27Å
203	V	98.1	Very high	95.1	Very high	26 Å²	26	53.8 Å²	53.8	16%	0.158	29%	0.29	C	S	.	.	H	α-helix	trans	-64.7	-45.5	174.4	175.2	0	0	0	0	111.1	F115 S118 V119 A199 T200 G205 K206 L207	F115-V203 HydrophobicContact CE2-CG2 4.11Å; S118-V203 WeakPolarHBondContact O-CG1 3.36Å; S118-V203 WeakPolarHBondContact OG-CG1 3.14Å; V119-V203 HydrophobicContact CG2-CG1 4.3Å; V119-V203 HydrophobicContact CG2-CG2 4.27Å; A199-V203 WeakPolarHBondContact O-CG2 3.26Å; A199-V203 PolarHBondContact O-N 2.97Å; T200-V203 PolarHBondContact O-N 2.89Å; V203-G205 VanDerWaalsContact C-N 3.34Å; V203-G205 PolarHBondContact O-N 2.84Å; V203-K206 WeakPolarHBondContact O-CB 3.29Å; V203-K206 PolarHBondContact O-N 3.49Å; V203-L207 PolarHBondContact O-N 2.95Å
204	Y	97.6	Very high	94.8	Very high	2 Å²	2	57.2 Å²	57.2	1%	0.008	31%	0.306	C	S	.	.	H	α-helix	trans	-63.6	-38.4	173.8	-82.9	-66.2	0	0	0	112.7	T200 H201 K206 L207 L208 F288 Y289 T292	T200-Y204 HydrophobicContact CG2-CD2 4.07Å; T200-Y204 HydrophobicContact CG2-CE2 4Å; T200-Y204 WeakPolarHBondContact O-CD2 3.49Å; T200-Y204 PolarHBondContact O-N 3.02Å; H201-Y204 PolarHBondContact O-N 2.95Å; Y204-K206 VanDerWaalsContact C-N 3.35Å; Y204-K206 PolarHBondContact O-N 3.41Å; Y204-L207 HydrophobicContact CD1-CD2 4.09Å; Y204-L207 HydrophobicContact CE1-CD2 4.37Å; Y204-L207 WeakPolarHBondContact O-CB 3.23Å; Y204-L207 PolarHBondContact O-N 2.92Å; Y204-L207 VanDerWaalsContact O-N 3.14Å; Y204-L208 WeakPolarHBondContact O-CG 3.39Å; Y204-L208 PolarHBondContact O-N 2.86Å; Y204-F288 WeakPolarHBondContact OH-CB 3.25Å; Y204-F288 PolarHBondContact OH-O 2.98Å; Y204-Y289 AromaticContact CD1-CD2 3.52Å; Y204-Y289 HydrophobicContact CD1-CD2 3.52Å; Y204-Y289 HydrophobicContact CD1-CE2 4.39Å; Y204-Y289 HydrophobicContact CD1-CG 4.05Å; Y204-Y289 AromaticContact CD2-CD2 3.77Å; Y204-Y289 HydrophobicContact CD2-CD2 3.77Å; Y204-Y289 HydrophobicContact CD2-CE2 4.31Å; Y204-Y289 HydrophobicContact CE1-CD2 4Å; Y204-Y289 HydrophobicContact CE1-CG 4.29Å; Y204-Y289 HydrophobicContact CE2-CD2 4.21Å; Y204-Y289 AromaticContact CG-CD2 3.4Å; Y204-Y289 HydrophobicContact CG-CD2 3.4Å; Y204-Y289 AromaticContact CG-CE2 3.92Å; Y204-Y289 HydrophobicContact CG-CE2 3.92Å; Y204-Y289 HydrophobicContact CG-CG 4.36Å; Y204-T292 HydrophobicContact CD2-CG2 4.18Å; Y204-T292 HydrophobicContact CE2-CG2 3.78Å; Y204-T292 WeakPolarHBondContact CE2-OG1 3.42Å; Y204-T292 PolarHBondContact OH-OG1 3.48Å
205	G	96.9	Very high	94.5	Very high	30 Å²	30	63.8 Å²	63.8	31%	0.309	32%	0.322	S	S	.	.	H	α-helix	trans	-58.8	-45.6	173	0	0	0	0	0	111.7	H201 A202 V203 L207 L208 L209	H201-G205 PolarHBondContact O-N 2.93Å; A202-G205 PolarHBondContact O-N 2.88Å; V203-G205 VanDerWaalsContact C-N 3.34Å; V203-G205 PolarHBondContact O-N 2.84Å; G205-L207 VanDerWaalsContact C-N 3.34Å; G205-L207 PolarHBondContact O-N 3.08Å; G205-L208 PolarHBondContact O-N 3.36Å; G205-L209 WeakPolarHBondContact O-CB 3.42Å; G205-L209 VanDerWaalsContact O-CG 3.27Å; G205-L209 WeakPolarHBondContact O-CG 3.5Å; G205-L209 PolarHBondContact O-N 2.9Å
206	K	97.1	Very high	93.8	Very high	139 Å²	139	66 Å²	66	60%	0.604	33%	0.325	S	S	*	.	H	α-helix	trans	-59.6	-42.5	172.2	-75.3	-177.8	177.3	-179	0	112.1	Y122 A202 V203 Y204 F210	Y122-K206 HydrophobicContact CE2-CB 4.26Å; A202-K206 WeakPolarHBondContact O-CG 3.42Å; A202-K206 PolarHBondContact O-N 3.27Å; V203-K206 WeakPolarHBondContact O-CB 3.29Å; V203-K206 PolarHBondContact O-N 3.49Å; Y204-K206 VanDerWaalsContact C-N 3.35Å; Y204-K206 PolarHBondContact O-N 3.41Å; K206-F210 VanDerWaalsContact O-CB 3.32Å; K206-F210 WeakPolarHBondContact O-CB 3.42Å; K206-F210 PolarHBondContact O-N 3.37Å
207	L	96	Very high	92.8	Very high	4 Å²	4	70.7 Å²	70.7	2%	0.021	35%	0.347	C	S	.	.	H	α-helix	trans	-62	-47.7	176.3	171.6	58.9	0	0	0	112.1	R121 Y122 I125 V203 Y204 G205 F210 E211	R121-L207 HydrophobicContact CB-CD2 4.22Å; Y122-L207 HydrophobicContact CD2-CB 4.12Å; I125-L207 HydrophobicContact CB-CD1 3.85Å; I125-L207 HydrophobicContact CD1-CD1 3.65Å; I125-L207 HydrophobicContact CD1-CD2 4.27Å; I125-L207 HydrophobicContact CG1-CD1 4.31Å; I125-L207 HydrophobicContact CG2-CD1 3.95Å; V203-L207 PolarHBondContact O-N 2.95Å; Y204-L207 HydrophobicContact CD1-CD2 4.09Å; Y204-L207 HydrophobicContact CE1-CD2 4.37Å; Y204-L207 WeakPolarHBondContact O-CB 3.23Å; Y204-L207 PolarHBondContact O-N 2.92Å; Y204-L207 VanDerWaalsContact O-N 3.14Å; G205-L207 VanDerWaalsContact C-N 3.34Å; G205-L207 PolarHBondContact O-N 3.08Å; L207-F210 WeakPolarHBondContact O-CB 3.3Å; L207-F210 PolarHBondContact O-N 2.95Å; L207-E211 HydrophobicContact CD1-CG 4.41Å; L207-E211 PolarHBondContact O-N 3.29Å
208	L	95.2	Very high	91.5	Very high	77 Å²	77	79.3 Å²	79.3	40%	0.403	39%	0.385	S	S	.	.	H	α-helix	trans	-65.4	-40.5	-179.9	-67.9	174	0	0	0	111.8	Y204 G205 F210 E211 Y212 Y289	Y204-L208 WeakPolarHBondContact O-CG 3.39Å; Y204-L208 PolarHBondContact O-N 2.86Å; G205-L208 PolarHBondContact O-N 3.36Å; L208-F210 VanDerWaalsContact C-N 3.34Å; L208-E211 PolarHBondContact O-N 3.46Å; L208-Y212 WeakPolarHBondContact O-CB 3.36Å; L208-Y212 PolarHBondContact O-N 3.37Å; L208-Y289 HydrophobicContact CD1-CE1 4.17Å
209	L	95.2	Very high	90.2	Very high	104 Å²	104	81.8 Å²	81.8	55%	0.545	40%	0.395	S	S	.	.	H	α-helix	trans	-63.2	-40.8	173.7	-73.2	172.6	0	0	0	111.9	G205 Y212 R213	G205-L209 WeakPolarHBondContact O-CB 3.42Å; G205-L209 VanDerWaalsContact O-CG 3.27Å; G205-L209 WeakPolarHBondContact O-CG 3.5Å; G205-L209 PolarHBondContact O-N 2.9Å; L209-Y212 PolarHBondContact O-N 3.01Å; L209-R213 WeakPolarHBondContact O-CB 3.5Å; L209-R213 WeakPolarHBondContact O-CG 3.44Å; L209-R213 PolarHBondContact O-N 3.49Å
210	F	93.3	Very high	88.5	Confident	48 Å²	48	86 Å²	86	21%	0.211	42%	0.417	C	S	.	.	H	α-helix	trans	-60	-49.7	173.8	177.6	-90.2	0	0	0	110.9	I125 A126 K206 L207 L208 Y212 R213 H214	I125-F210 HydrophobicContact CG2-CD1 3.98Å; I125-F210 HydrophobicContact CG2-CE1 3.87Å; A126-F210 VanDerWaalsContact CA-CZ 3.49Å; A126-F210 HydrophobicContact CB-CD1 4.22Å; A126-F210 HydrophobicContact CB-CD2 4.09Å; A126-F210 HydrophobicContact CB-CE1 4.03Å; A126-F210 HydrophobicContact CB-CE2 3.87Å; A126-F210 HydrophobicContact CB-CG 4.26Å; A126-F210 HydrophobicContact CB-CZ 3.85Å; K206-F210 VanDerWaalsContact O-CB 3.32Å; K206-F210 WeakPolarHBondContact O-CB 3.42Å; K206-F210 PolarHBondContact O-N 3.37Å; L207-F210 WeakPolarHBondContact O-CB 3.3Å; L207-F210 PolarHBondContact O-N 2.95Å; L208-F210 VanDerWaalsContact C-N 3.34Å; F210-Y212 VanDerWaalsContact C-N 3.33Å; F210-Y212 PolarHBondContact O-N 3.44Å; F210-R213 PolarHBondContact O-N 2.88Å; F210-H214 AromaticContact CD1-CD2 3.94Å; F210-H214 AromaticContact CD2-CD2 3.75Å; F210-H214 AromaticContact CD2-NE2 3.83Å; F210-H214 AromaticContact CE1-CD2 3.6Å; F210-H214 AromaticContact CE1-CG 3.94Å; F210-H214 AromaticContact CE1-NE2 3.83Å; F210-H214 AromaticContact CE2-CD2 3.42Å; F210-H214 VanDerWaalsContact CE2-CD2 3.42Å; F210-H214 WeakPolarHBondContact CE2-CD2 3.31Å; F210-H214 AromaticContact CE2-CE1 3.94Å; F210-H214 AromaticContact CE2-NE2 3.06Å; F210-H214 WeakPolarHBondContact CE2-NE2 3.5Å; F210-H214 AromaticContact CZ-CD2 3.32Å; F210-H214 WeakPolarHBondContact CZ-CD2 3.48Å; F210-H214 AromaticContact CZ-CE1 3.5Å; F210-H214 AromaticContact CZ-CG 3.94Å; F210-H214 AromaticContact CZ-ND1 3.98Å; F210-H214 AromaticContact CZ-NE2 3.05Å; F210-H214 WeakPolarHBondContact CZ-NE2 3.32Å; F210-H214 WeakPolarHBondContact O-CB 3.33Å; F210-H214 PolarHBondContact O-CD2 3.3Å; F210-H214 VanDerWaalsContact O-CD2 3.27Å; F210-H214 PolarHBondContact O-N 3.06Å
211	E	91.1	Very high	86.5	Confident	14 Å²	14	94.1 Å²	94.1	7%	0.065	46%	0.455	C	S	.	.	H	α-helix	trans	-59	-43.7	176.3	-76.8	-163.8	-167.2	0	0	112.7	I125 L207 L208 H214 R215	I125-E211 HydrophobicContact CG2-CG 4.37Å; L207-E211 HydrophobicContact CD1-CG 4.41Å; L207-E211 PolarHBondContact O-N 3.29Å; L208-E211 PolarHBondContact O-N 3.46Å; E211-H214 PolarHBondContact O-N 3.18Å; E211-R215 WeakPolarHBondContact O-CG 3.37Å; E211-R215 PolarHBondContact O-N 3.4Å; E211-R215 IonicContact OE2-NH2 3.38Å; E211-R215 PolarHBondContact OE2-NH2 3.45Å
212	Y	91.6	Very high	84.6	Confident	132 Å²	132	99.4 Å²	99.4	52%	0.518	48%	0.482	S	S	.	.	H	α-helix	trans	-62.2	-47.1	179.3	178.3	-101.9	0	0	0	111.7	L208 L209 F210 H214 R215 K216	L208-Y212 WeakPolarHBondContact O-CB 3.36Å; L208-Y212 PolarHBondContact O-N 3.37Å; L209-Y212 PolarHBondContact O-N 3.01Å; F210-Y212 VanDerWaalsContact C-N 3.33Å; F210-Y212 PolarHBondContact O-N 3.44Å; Y212-H214 VanDerWaalsContact C-N 3.32Å; Y212-H214 PolarHBondContact O-N 2.97Å; Y212-R215 PolarHBondContact O-N 3.35Å; Y212-K216 HydrophobicContact CE1-CD 4.16Å; Y212-K216 VanDerWaalsContact CE1-CE 3.46Å; Y212-K216 PolarHBondContact O-N 2.91Å; Y212-K216 WeakPolarHBondContact OH-CE 3.27Å; Y212-K216 PolarHBondContact OH-NZ 3.06Å
213	R	90.4	Very high	82.6	Confident	185 Å²	185	102.1 Å²	102.1	70%	0.698	49%	0.492	S	S	*	.	H	α-helix	trans	-61.1	-41.7	175.1	-73.5	-179.8	178.3	-174.9	-0.1	111.4	L209 F210 R215 K216	L209-R213 WeakPolarHBondContact O-CB 3.5Å; L209-R213 WeakPolarHBondContact O-CG 3.44Å; L209-R213 PolarHBondContact O-N 3.49Å; F210-R213 PolarHBondContact O-N 2.88Å; R213-R215 PolarHBondContact O-N 3.27Å; R213-K216 PolarHBondContact O-N 3.14Å
214	H	85.9	Confident	80.6	Confident	85 Å²	85	105.2 Å²	105.2	39%	0.394	51%	0.513	S	S	.	.	H	α-helix	trans	-68.7	-32.2	179.5	-87.7	-103.5	0	0	0	113.6	F210 E211 Y212 K216 M217	F210-H214 AromaticContact CD1-CD2 3.94Å; F210-H214 AromaticContact CD2-CD2 3.75Å; F210-H214 AromaticContact CD2-NE2 3.83Å; F210-H214 AromaticContact CE1-CD2 3.6Å; F210-H214 AromaticContact CE1-CG 3.94Å; F210-H214 AromaticContact CE1-NE2 3.83Å; F210-H214 AromaticContact CE2-CD2 3.42Å; F210-H214 VanDerWaalsContact CE2-CD2 3.42Å; F210-H214 WeakPolarHBondContact CE2-CD2 3.31Å; F210-H214 AromaticContact CE2-CE1 3.94Å; F210-H214 AromaticContact CE2-NE2 3.06Å; F210-H214 WeakPolarHBondContact CE2-NE2 3.5Å; F210-H214 AromaticContact CZ-CD2 3.32Å; F210-H214 WeakPolarHBondContact CZ-CD2 3.48Å; F210-H214 AromaticContact CZ-CE1 3.5Å; F210-H214 AromaticContact CZ-CG 3.94Å; F210-H214 AromaticContact CZ-ND1 3.98Å; F210-H214 AromaticContact CZ-NE2 3.05Å; F210-H214 WeakPolarHBondContact CZ-NE2 3.32Å; F210-H214 WeakPolarHBondContact O-CB 3.33Å; F210-H214 PolarHBondContact O-CD2 3.3Å; F210-H214 VanDerWaalsContact O-CD2 3.27Å; F210-H214 PolarHBondContact O-N 3.06Å; E211-H214 PolarHBondContact O-N 3.18Å; Y212-H214 VanDerWaalsContact C-N 3.32Å; Y212-H214 PolarHBondContact O-N 2.97Å; H214-K216 VanDerWaalsContact C-N 3.28Å; H214-K216 PolarHBondContact O-N 3.37Å; H214-M217 HydrophobicContact CB-CE 3.96Å; H214-M217 VanDerWaalsContact CE1-CE 3.49Å; H214-M217 WeakPolarHBondContact CE1-CE 3.34Å; H214-M217 WeakPolarHBondContact ND1-CE 3.48Å; H214-M217 PolarHBondContact O-N 2.88Å
215	R	85.1	Confident	78.6	Confident	176 Å²	176	106.8 Å²	106.8	66%	0.664	53%	0.526	S	S	*	.	H	α-helix	trans	-67.6	-28	173.8	-74.2	178.8	-163.8	-153.2	7.3	113	E211 Y212 R213 M217	E211-R215 WeakPolarHBondContact O-CG 3.37Å; E211-R215 PolarHBondContact O-N 3.4Å; E211-R215 IonicContact OE2-NH2 3.38Å; E211-R215 PolarHBondContact OE2-NH2 3.45Å; Y212-R215 PolarHBondContact O-N 3.35Å; R213-R215 PolarHBondContact O-N 3.27Å; R215-M217 VanDerWaalsContact C-N 3.3Å
216	K	80.9	Confident	76.3	Confident	139 Å²	139	112.3 Å²	112.3	60%	0.604	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-10.3	177.2	-72.9	-168.3	175.8	-177.4	0	114	Y212 R213 H214 K218	Y212-K216 HydrophobicContact CE1-CD 4.16Å; Y212-K216 VanDerWaalsContact CE1-CE 3.46Å; Y212-K216 PolarHBondContact O-N 2.91Å; Y212-K216 WeakPolarHBondContact OH-CE 3.27Å; Y212-K216 PolarHBondContact OH-NZ 3.06Å; R213-K216 PolarHBondContact O-N 3.14Å; H214-K216 VanDerWaalsContact C-N 3.28Å; H214-K216 PolarHBondContact O-N 3.37Å; K216-K218 PolarHBondContact O-N 3.45Å
217	M	74.9	Confident	74.3	Confident	115 Å²	115	107.8 Å²	107.8	57%	0.567	53%	0.533	S	S	*	.	S	Bend	trans	-66	121.2	175.1	-67.2	-166.4	-66.1	0	0	109.2	H214 R215	H214-M217 HydrophobicContact CB-CE 3.96Å; H214-M217 VanDerWaalsContact CE1-CE 3.49Å; H214-M217 WeakPolarHBondContact CE1-CE 3.34Å; H214-M217 WeakPolarHBondContact ND1-CE 3.48Å; H214-M217 PolarHBondContact O-N 2.88Å; R215-M217 VanDerWaalsContact C-N 3.3Å
218	K	66.6	Low	72.5	Confident	191 Å²	191	116.9 Å²	116.9	83%	0.83	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-60.7	135.5	173.1	-66.5	-176.5	179.7	-176.8	0	107.9	K216 V220	K216-K218 PolarHBondContact O-N 3.45Å; K218-V220 PolarHBondContact O-N 3.18Å
219	P	67.7	Low	70.5	Confident	112 Å²	112	118.3 Å²	118.3	73%	0.727	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-54	138.8	169.7	24.8	-32.2	0	0	0	107.6	Q221	P219-Q221 PolarHBondContact O-N 2.86Å
220	V	63.5	Low	68.8	Low	123 Å²	123	119.9 Å²	119.9	75%	0.745	58%	0.582	S	S	*	*			trans	-54.9	107.1	174.1	176.5	0	0	0	0	106.4	K218 M222	K218-V220 PolarHBondContact O-N 3.18Å; V220-M222 VanDerWaalsContact C-N 3.3Å; V220-M222 HydrophobicContact CG1-SD 4.1Å; V220-M222 PolarHBondContact O-N 3.41Å
221	Q	54.5	Low	66.8	Low	171 Å²	171	119.7 Å²	119.7	80%	0.799	59%	0.585	S	S	*	*			trans	-68.7	99.5	170.3	-79.1	-177.4	-25.1	0	0	105.1	P219 V223	P219-Q221 PolarHBondContact O-N 2.86Å; Q221-V223 VanDerWaalsContact C-N 3.26Å; Q221-V223 PolarHBondContact O-N 3.34Å
222	M	56.8	Low	64.8	Low	157 Å²	157	121.9 Å²	121.9	77%	0.773	59%	0.594	S	S	*	*			trans	-65.5	98.8	164.7	-65.5	-63.6	-163.4	0	0	105.3	V220 P224	V220-M222 VanDerWaalsContact C-N 3.3Å; V220-M222 HydrophobicContact CG1-SD 4.1Å; V220-M222 PolarHBondContact O-N 3.41Å; M222-P224 WeakPolarHBondContact O-CD 3.37Å; M222-P224 VanDerWaalsContact O-N 3.11Å
223	V	55.8	Low	62.8	Low	114 Å²	114	122.1 Å²	122.1	69%	0.691	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-57.7	117.2	165.3	179.8	0	0	0	0	104.7	Q221 A225	Q221-V223 VanDerWaalsContact C-N 3.26Å; Q221-V223 PolarHBondContact O-N 3.34Å; V223-A225 PolarHBondContact O-N 3.47Å
224	P	57.4	Low	60.8	Low	92 Å²	92	114.2 Å²	114.2	60%	0.597	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-57.1	134.9	175	25.1	-32	0	0	0	107	M222 I226	M222-P224 WeakPolarHBondContact O-CD 3.37Å; M222-P224 VanDerWaalsContact O-N 3.11Å; P224-I226 WeakPolarHBondContact O-CG1 3.34Å; P224-I226 PolarHBondContact O-N 2.96Å
225	A	55	Low	58.9	Low	34 Å²	34	116.1 Å²	116.1	28%	0.281	60%	0.596	S	S	.	*	P	Polyproline II helix	trans	-53.8	117.5	175.3	0	0	0	0	0	108.2	V223 F232	V223-A225 PolarHBondContact O-N 3.47Å; A225-F232 HydrophobicContact CB-CE1 4.36Å; A225-F232 HydrophobicContact CB-CZ 4.01Å; A225-F232 WeakPolarHBondContact O-CE2 3.33Å; A225-F232 WeakPolarHBondContact O-CZ 3.49Å
226	I	49.2	Very low	57.2	Low	147 Å²	147	110.4 Å²	110.4	75%	0.754	59%	0.592	S	S	*	*			trans	-90.4	112.4	177.5	-57.7	176.6	0	0	0	106.3	P224	P224-I226 WeakPolarHBondContact O-CG1 3.34Å; P224-I226 PolarHBondContact O-N 2.96Å
227	S	55	Low	56	Low	43 Å²	43	104.4 Å²	104.4	30%	0.301	57%	0.568	S	S	.	*			trans	-92.4	133	168.3	64.1	0	0	0	0	109.5	N229 F232	S227-N229 VanDerWaalsContact C-N 3.26Å; S227-N229 WeakPolarHBondContact CB-O 3.39Å; S227-N229 PolarHBondContact OG-O 3.28Å; S227-F232 WeakPolarHBondContact OG-CA 3.28Å
228	Q	57.4	Low	55	Low	196 Å²	196	103 Å²	103	92%	0.916	57%	0.566	S	S	*	*	S	Bend	trans	-75.7	-17.3	173.5	-70.4	-173.6	-18.3	0	0	112.5
229	N	53.4	Low	54.6	Low	107 Å²	107	95.9 Å²	95.9	57%	0.572	55%	0.547	S	S	*	.	S	Bend	trans	-108.6	154.2	172.9	-77.9	-15.6	0	0	0	111.1	S227 T231	S227-N229 VanDerWaalsContact C-N 3.26Å; S227-N229 WeakPolarHBondContact CB-O 3.39Å; S227-N229 PolarHBondContact OG-O 3.28Å; N229-T231 WeakPolarHBondContact CB-OG1 3.35Å; N229-T231 CarbonylContact O-C 3.45Å; N229-T231 PolarHBondContact O-N 2.99Å
230	W	59.9	Low	54.2	Low	136 Å²	136	96.4 Å²	96.4	52%	0.515	54%	0.54	S	S	.	.	S	Bend	trans	-56.1	-12.4	173.6	55.4	-88.3	0	0	0	113.4	F232 P253	W230-F232 PolarHBondContact O-N 3.4Å; W230-P253 HydrophobicContact CH2-CG 3.83Å; W230-P253 WeakPolarHBondContact CH2-O 3.36Å; W230-P253 WeakPolarHBondContact CZ3-O 3.36Å
231	T	51.3	Low	53.9	Low	44 Å²	44	92.3 Å²	92.3	27%	0.27	52%	0.519	S	S	.	.	S	Bend	trans	-79.5	83.2	164.4	54.9	0	0	0	0	110.2	N229 H233	N229-T231 WeakPolarHBondContact CB-OG1 3.35Å; N229-T231 CarbonylContact O-C 3.45Å; N229-T231 PolarHBondContact O-N 2.99Å; T231-H233 PolarHBondContact O-CD2 3.5Å; T231-H233 PolarHBondContact O-N 2.93Å; T231-H233 VanDerWaalsContact O-N 3.14Å
232	F	48.8	Very low	54.3	Low	61 Å²	61	84.8 Å²	84.8	27%	0.268	49%	0.486	S	S	.	.			trans	-67.5	109.9	171.9	-170.9	-72.8	0	0	0	110.1	A225 S227 W230 A237	A225-F232 HydrophobicContact CB-CE1 4.36Å; A225-F232 HydrophobicContact CB-CZ 4.01Å; A225-F232 WeakPolarHBondContact O-CE2 3.33Å; A225-F232 WeakPolarHBondContact O-CZ 3.49Å; S227-F232 WeakPolarHBondContact OG-CA 3.28Å; W230-F232 PolarHBondContact O-N 3.4Å; F232-A237 HydrophobicContact CD1-CB 3.12Å; F232-A237 HydrophobicContact CE1-CB 3.17Å; F232-A237 VanDerWaalsContact CE1-N 3.29Å; F232-A237 HydrophobicContact CG-CB 4.32Å; F232-A237 HydrophobicContact CZ-CB 4.33Å
233	H	48.4	Very low	54.7	Low	136 Å²	136	79.9 Å²	79.9	63%	0.63	47%	0.47	S	S	*	.			trans	-117.2	108	174	-67.2	-81.3	0	0	0	109.6	T231	T231-H233 PolarHBondContact O-CD2 3.5Å; T231-H233 PolarHBondContact O-N 2.93Å; T231-H233 VanDerWaalsContact O-N 3.14Å
234	G	48.9	Very low	55.1	Low	20 Å²	20	78.3 Å²	78.3	21%	0.206	46%	0.458	C	S	.	.	S	Bend	trans	173.7	157.3	172.7	0	0	0	0	0	114.9	G236 A237	G234-G236 PolarHBondContact O-N 3.03Å; G234-G236 VanDerWaalsContact O-N 3.17Å; G234-A237 WeakPolarHBondContact O-CB 3.4Å; G234-A237 PolarHBondContact O-N 3.36Å; G234-A237 VanDerWaalsContact O-N 3.14Å
235	P	46.5	Very low	55.5	Low	125 Å²	125	78 Å²	78	81%	0.812	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	115.7	171.3	-14.8	28.2	0	0	0	109.6
236	G	49.7	Very low	56.1	Low	56 Å²	56	82.5 Å²	82.5	58%	0.577	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	111.3	2.5	-173.9	0	0	0	0	0	114.8	G234 T238	G234-G236 PolarHBondContact O-N 3.03Å; G234-G236 VanDerWaalsContact O-N 3.17Å; G236-T238 VanDerWaalsContact C-N 3.27Å; G236-T238 PolarHBondContact O-N 3.48Å
237	A	55	Low	57.2	Low	12 Å²	12	78.5 Å²	78.5	10%	0.099	45%	0.452	C	S	.	.			trans	-57.8	87.3	164.2	0	0	0	0	0	110.3	F232 G234 G239 L258	F232-A237 HydrophobicContact CD1-CB 3.12Å; F232-A237 HydrophobicContact CE1-CB 3.17Å; F232-A237 VanDerWaalsContact CE1-N 3.29Å; F232-A237 HydrophobicContact CG-CB 4.32Å; F232-A237 HydrophobicContact CZ-CB 4.33Å; G234-A237 WeakPolarHBondContact O-CB 3.4Å; G234-A237 PolarHBondContact O-N 3.36Å; G234-A237 VanDerWaalsContact O-N 3.14Å; A237-G239 PolarHBondContact O-N 2.9Å; A237-L258 HydrophobicContact CB-CD1 3.51Å
238	T	54.7	Low	58	Low	86 Å²	86	79.4 Å²	79.4	53%	0.528	47%	0.468	S	S	.	.			trans	-61.2	130.8	163.5	51.9	0	0	0	0	105.5	G236 Q240	G236-T238 VanDerWaalsContact C-N 3.27Å; G236-T238 PolarHBondContact O-N 3.48Å; T238-Q240 WeakPolarHBondContact O-CB 3.44Å; T238-Q240 PolarHBondContact O-N 3.04Å
239	G	58	Low	58.7	Low	41 Å²	41	78.1 Å²	78.1	42%	0.423	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	13.2	-177.8	0	0	0	0	0	116.4	A237 A241 A242 A243	A237-G239 PolarHBondContact O-N 2.9Å; G239-A241 PolarHBondContact O-N 3.18Å; G239-A241 VanDerWaalsContact O-N 3.15Å; G239-A242 WeakPolarHBondContact O-CA 3.34Å; G239-A242 WeakPolarHBondContact O-CB 3.28Å; G239-A242 PolarHBondContact O-N 3.27Å; G239-A243 PolarHBondContact O-N 2.9Å
240	Q	58.5	Low	59.1	Low	123 Å²	123	74.6 Å²	74.6	58%	0.575	45%	0.449	S	S	*	.	H	α-helix	trans	-39.6	-41.2	166.3	-145	91.7	3.8	0	0	112.9	T238 A243 N244	T238-Q240 WeakPolarHBondContact O-CB 3.44Å; T238-Q240 PolarHBondContact O-N 3.04Å; Q240-A243 PolarHBondContact O-N 2.96Å; Q240-N244 VanDerWaalsContact O-CB 3.27Å; Q240-N244 WeakPolarHBondContact O-CB 3.35Å; Q240-N244 PolarHBondContact O-N 3.2Å; Q240-N244 PolarHBondContact O-ND2 3.1Å
241	A	58.2	Low	59	Low	37 Å²	37	79.8 Å²	79.8	31%	0.306	47%	0.468	S	S	.	.	H	α-helix	trans	-64	-42.4	177.6	0	0	0	0	0	112.2	G239 W245 P255	G239-A241 PolarHBondContact O-N 3.18Å; G239-A241 VanDerWaalsContact O-N 3.15Å; A241-W245 WeakPolarHBondContact O-CB 3.35Å; A241-W245 PolarHBondContact O-N 3.49Å; A241-W245 VanDerWaalsContact O-N 3.16Å; A241-P255 HydrophobicContact CB-CG 4.48Å
242	A	63.1	Low	59.7	Low	14 Å²	14	79.4 Å²	79.4	12%	0.116	47%	0.473	C	S	.	.	H	α-helix	trans	-72	-40.2	174.7	0	0	0	0	0	111.8	G239 W245 I246	G239-A242 WeakPolarHBondContact O-CA 3.34Å; G239-A242 WeakPolarHBondContact O-CB 3.28Å; G239-A242 PolarHBondContact O-N 3.27Å; A242-W245 WeakPolarHBondContact O-CB 3.42Å; A242-W245 PolarHBondContact O-N 2.98Å; A242-I246 WeakPolarHBondContact O-CG1 3.47Å; A242-I246 PolarHBondContact O-N 3Å
243	A	64	Low	60.4	Low	53 Å²	53	81.3 Å²	81.3	44%	0.438	49%	0.491	S	S	.	.	H	α-helix	trans	-62.3	-43.4	177.3	0	0	0	0	0	112.2	G239 Q240 W245 I246 A247	G239-A243 PolarHBondContact O-N 2.9Å; Q240-A243 PolarHBondContact O-N 2.96Å; A243-W245 VanDerWaalsContact C-N 3.33Å; A243-I246 PolarHBondContact O-N 2.94Å; A243-A247 WeakPolarHBondContact O-CB 3.42Å; A243-A247 PolarHBondContact O-N 3.4Å
244	N	64.2	Low	60.9	Low	81 Å²	81	79.1 Å²	79.1	43%	0.433	48%	0.483	S	S	.	.	H	α-helix	trans	-66.8	-34.7	175.1	-70.8	-12.7	0	0	0	111.9	Q240 A247 G248 F249	Q240-N244 VanDerWaalsContact O-CB 3.27Å; Q240-N244 WeakPolarHBondContact O-CB 3.35Å; Q240-N244 PolarHBondContact O-N 3.2Å; Q240-N244 PolarHBondContact O-ND2 3.1Å; N244-A247 PolarHBondContact O-N 2.86Å; N244-G248 PolarHBondContact O-N 3.18Å; N244-F249 HydrophobicContact CB-CB 4.5Å; N244-F249 WeakPolarHBondContact O-CB 3.31Å; N244-F249 PolarHBondContact O-N 3.26Å
245	W	66.1	Low	61.2	Low	87 Å²	87	78.9 Å²	78.9	33%	0.33	48%	0.477	S	S	.	.	I	π-helix	trans	-64.9	-46.8	174.1	-166.9	96.6	0	0	0	111.5	A241 A242 A243 A247 G248 G252 M254 P255	A241-W245 WeakPolarHBondContact O-CB 3.35Å; A241-W245 PolarHBondContact O-N 3.49Å; A241-W245 VanDerWaalsContact O-N 3.16Å; A242-W245 WeakPolarHBondContact O-CB 3.42Å; A242-W245 PolarHBondContact O-N 2.98Å; A243-W245 VanDerWaalsContact C-N 3.33Å; W245-A247 VanDerWaalsContact C-N 3.28Å; W245-A247 PolarHBondContact O-N 3.06Å; W245-G248 PolarHBondContact O-N 3.32Å; W245-G252 PolarHBondContact NE1-O 2.86Å; W245-M254 HydrophobicContact CD2-CB 4.05Å; W245-M254 HydrophobicContact CD2-CG 3.96Å; W245-M254 HydrophobicContact CE3-CB 4.13Å; W245-M254 HydrophobicContact CE3-CG 3.75Å; W245-M254 HydrophobicContact CE3-SD 4.34Å; W245-M254 HydrophobicContact CH2-CB 3.86Å; W245-M254 HydrophobicContact CH2-CG 4.26Å; W245-M254 HydrophobicContact CZ2-CB 3.76Å; W245-M254 HydrophobicContact CZ2-CG 4.44Å; W245-M254 HydrophobicContact CZ3-CB 4.04Å; W245-M254 HydrophobicContact CZ3-CG 3.9Å; W245-M254 HydrophobicContact CZ3-SD 4.11Å; W245-P255 HydrophobicContact CB-CG 4.38Å
246	I	67.7	Low	61.8	Low	127 Å²	127	77.2 Å²	77.2	65%	0.651	47%	0.466	S	S	*	.	I	π-helix	trans	-61.4	-37.3	175.1	-66.7	165.5	0	0	0	111.3	A242 A243 G248	A242-I246 WeakPolarHBondContact O-CG1 3.47Å; A242-I246 PolarHBondContact O-N 3Å; A243-I246 PolarHBondContact O-N 2.94Å; I246-G248 PolarHBondContact O-N 2.96Å; I246-G248 VanDerWaalsContact O-N 3.14Å
247	A	73.4	Confident	61.8	Low	63 Å²	63	77.6 Å²	77.6	52%	0.521	46%	0.458	S	S	.	.	I	π-helix	trans	-72.1	4.3	174.8	0	0	0	0	0	113.9	A243 N244 W245 F249	A243-A247 WeakPolarHBondContact O-CB 3.42Å; A243-A247 PolarHBondContact O-N 3.4Å; N244-A247 PolarHBondContact O-N 2.86Å; W245-A247 VanDerWaalsContact C-N 3.28Å; W245-A247 PolarHBondContact O-N 3.06Å; A247-F249 HydrophobicContact CB-CD2 3.81Å; A247-F249 HydrophobicContact CB-CE2 3.93Å
248	G	71.5	Confident	61.4	Low	63 Å²	63	80.2 Å²	80.2	65%	0.649	47%	0.47	S	S	*	.	I	π-helix	trans	85.2	4.4	174.6	0	0	0	0	0	115.2	N244 W245 I246 G250	N244-G248 PolarHBondContact O-N 3.18Å; W245-G248 PolarHBondContact O-N 3.32Å; I246-G248 PolarHBondContact O-N 2.96Å; I246-G248 VanDerWaalsContact O-N 3.14Å; G248-G250 VanDerWaalsContact C-N 3.31Å
249	F	71.6	Confident	61	Low	169 Å²	169	83.7 Å²	83.7	74%	0.741	48%	0.484	S	S	*	.	I	π-helix	trans	-82.4	-5.9	177	-61.1	-74.1	0	0	0	113.4	N244 A247	N244-F249 HydrophobicContact CB-CB 4.5Å; N244-F249 WeakPolarHBondContact O-CB 3.31Å; N244-F249 PolarHBondContact O-N 3.26Å; A247-F249 HydrophobicContact CB-CD2 3.81Å; A247-F249 HydrophobicContact CB-CE2 3.93Å
250	G	61	Low	60.4	Low	33 Å²	33	85.1 Å²	85.1	34%	0.34	50%	0.499	S	S	.	.			trans	-89.7	114.1	-177.5	0	0	0	0	0	113.5	G248	G248-G250 VanDerWaalsContact C-N 3.31Å
251	R	58.9	Low	59.7	Low	245 Å²	245	83.1 Å²	83.1	93%	0.925	49%	0.492	S	S	*	.			trans	-95.7	110.3	162.1	-73.1	-167	179.7	-177.7	1.2	109.3
252	G	65.9	Low	59.3	Low	36 Å²	36	91.3 Å²	91.3	37%	0.371	52%	0.515	S	S	.	.	S	Bend	trans	135.2	171.8	-179.6	0	0	0	0	0	112.7	W245	W245-G252 PolarHBondContact NE1-O 2.86Å
253	P	63.7	Low	58.7	Low	100 Å²	100	98 Å²	98	65%	0.649	54%	0.544	S	S	*	.	S	Bend	trans	-57.8	144	178.1	17.5	-24.3	0	0	0	110.8	W230	W230-P253 HydrophobicContact CH2-CG 3.83Å; W230-P253 WeakPolarHBondContact CH2-O 3.36Å; W230-P253 WeakPolarHBondContact CZ3-O 3.36Å
254	M	58.4	Low	58.1	Low	91 Å²	91	100 Å²	100	45%	0.448	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-51.3	123.3	-180	-172.9	-177.8	71.1	0	0	109.6	W245 T257	W245-M254 HydrophobicContact CD2-CB 4.05Å; W245-M254 HydrophobicContact CD2-CG 3.96Å; W245-M254 HydrophobicContact CE3-CB 4.13Å; W245-M254 HydrophobicContact CE3-CG 3.75Å; W245-M254 HydrophobicContact CE3-SD 4.34Å; W245-M254 HydrophobicContact CH2-CB 3.86Å; W245-M254 HydrophobicContact CH2-CG 4.26Å; W245-M254 HydrophobicContact CZ2-CB 3.76Å; W245-M254 HydrophobicContact CZ2-CG 4.44Å; W245-M254 HydrophobicContact CZ3-CB 4.04Å; W245-M254 HydrophobicContact CZ3-CG 3.9Å; W245-M254 HydrophobicContact CZ3-SD 4.11Å; M254-T257 HydrophobicContact CE-CG2 4.31Å; M254-T257 HydrophobicContact SD-CG2 4.37Å
255	P	55.9	Low	57.8	Low	14 Å²	14	98.3 Å²	98.3	9%	0.091	55%	0.549	C	S	.	.	P	Polyproline II helix	trans	-58.5	138.9	170.1	25.2	-31.6	0	0	0	107.5	A241 W245 T257	A241-P255 HydrophobicContact CB-CG 4.48Å; W245-P255 HydrophobicContact CB-CG 4.38Å; P255-T257 PolarHBondContact O-N 2.87Å
256	P	57.8	Low	57.5	Low	90 Å²	90	100.6 Å²	100.6	58%	0.584	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-50.5	122.8	-177.8	20.2	-31.4	0	0	0	108.2	L258	P256-L258 PolarHBondContact O-N 3.47Å
257	T	50.2	Low	57.2	Low	64 Å²	64	95.9 Å²	95.9	39%	0.393	54%	0.543	S	S	.	.	P	Polyproline II helix	trans	-51.7	119.1	170.8	33.6	0	0	0	0	105.3	M254 P255 L259	M254-T257 HydrophobicContact CE-CG2 4.31Å; M254-T257 HydrophobicContact SD-CG2 4.37Å; P255-T257 PolarHBondContact O-N 2.87Å; T257-L259 PolarHBondContact O-N 3.31Å
258	L	47.8	Very low	56.8	Low	67 Å²	67	95.2 Å²	95.2	35%	0.351	54%	0.537	S	S	.	.			trans	-73	53.2	-178.7	-110.1	148.9	0	0	0	109.7	A237 P256 G260 I261	A237-L258 HydrophobicContact CB-CD1 3.51Å; P256-L258 PolarHBondContact O-N 3.47Å; L258-G260 PolarHBondContact O-N 3.39Å; L258-I261 HydrophobicContact CD2-CB 3.57Å; L258-I261 HydrophobicContact CD2-CD1 3.32Å; L258-I261 HydrophobicContact CD2-CG1 3.24Å; L258-I261 PolarHBondContact O-N 2.75Å
259	L	45.3	Very low	56.6	Low	159 Å²	159	95 Å²	95	83%	0.832	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-8.7	168	-76.6	164.1	0	0	0	111.8	T257	T257-L259 PolarHBondContact O-N 3.31Å
260	G	45.2	Very low	56.6	Low	72 Å²	72	95 Å²	95	74%	0.742	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	-25.8	-179.4	0	0	0	0	0	116.4	L258 R262	L258-G260 PolarHBondContact O-N 3.39Å; G260-R262 PolarHBondContact O-N 2.9Å
261	I	44.3	Very low	57.1	Low	80 Å²	80	101.6 Å²	101.6	41%	0.41	54%	0.536	S	S	.	.			trans	-95.6	67.9	170.5	-55.1	176.1	0	0	0	106.8	L258 Q263	L258-I261 HydrophobicContact CD2-CB 3.57Å; L258-I261 HydrophobicContact CD2-CD1 3.32Å; L258-I261 HydrophobicContact CD2-CG1 3.24Å; L258-I261 PolarHBondContact O-N 2.75Å; I261-Q263 VanDerWaalsContact C-N 3.32Å; I261-Q263 PolarHBondContact O-N 3.42Å
262	R	48.5	Very low	57.7	Low	209 Å²	209	95 Å²	95	79%	0.789	52%	0.518	S	S	*	.			trans	-51.5	111.3	150.1	-158.5	173.3	-169.9	160.3	1.7	103.6	G260 N264	G260-R262 PolarHBondContact O-N 2.9Å; R262-N264 PolarHBondContact O-N 3.31Å
263	Q	51.8	Low	58	Low	156 Å²	156	98 Å²	98	73%	0.729	53%	0.525	S	S	*	.			trans	-50	110.1	158.4	-80.3	-172.4	-3.7	0	0	102.7	I261 G265	I261-Q263 VanDerWaalsContact C-N 3.32Å; I261-Q263 PolarHBondContact O-N 3.42Å; Q263-G265 PolarHBondContact O-N 2.9Å
264	N	52	Low	58.7	Low	93 Å²	93	94.5 Å²	94.5	50%	0.497	51%	0.507	S	S	.	.			trans	-59.9	95.3	178.5	-98.2	-21	0	0	0	104	R262 H266 A267 A268	R262-N264 PolarHBondContact O-N 3.31Å; N264-H266 PolarHBondContact O-N 3.24Å; N264-H266 VanDerWaalsContact O-N 3.15Å; N264-A267 HydrophobicContact CB-CB 3.53Å; N264-A267 WeakPolarHBondContact O-CA 3.32Å; N264-A267 WeakPolarHBondContact O-CB 3.42Å; N264-A267 PolarHBondContact O-N 3.32Å; N264-A268 PolarHBondContact O-N 2.78Å
265	G	55.9	Low	59.7	Low	47 Å²	47	96.4 Å²	96.4	49%	0.485	52%	0.517	S	S	.	.	H	α-helix	trans	-55.3	-33.9	176.3	0	0	0	0	0	108.4	Q263 A267 A268 S269	Q263-G265 PolarHBondContact O-N 2.9Å; G265-A267 PolarHBondContact O-N 3.13Å; G265-A268 PolarHBondContact O-N 3.46Å; G265-S269 WeakPolarHBondContact O-CB 3.33Å; G265-S269 PolarHBondContact O-N 2.97Å
266	H	60.9	Low	61.1	Low	135 Å²	135	99.9 Å²	99.9	63%	0.625	54%	0.535	S	S	*	.	H	α-helix	trans	-59.2	-34.6	167.9	-63.1	-61.6	0	0	0	115	N264 R270	N264-H266 PolarHBondContact O-N 3.24Å; N264-H266 VanDerWaalsContact O-N 3.15Å; H266-R270 WeakPolarHBondContact O-CB 3.33Å; H266-R270 WeakPolarHBondContact O-CG 2.98Å; H266-R270 PolarHBondContact O-N 3Å; H266-R270 PolarHBondContact O-NE 3.43Å; H266-R270 VanDerWaalsContact O-NE 3.08Å
267	A	61.1	Low	62.5	Low	28 Å²	28	101.2 Å²	101.2	23%	0.231	53%	0.533	C	S	.	.	H	α-helix	trans	-79.7	-34	176.2	0	0	0	0	0	112.3	N264 G265 R271	N264-A267 HydrophobicContact CB-CB 3.53Å; N264-A267 WeakPolarHBondContact O-CA 3.32Å; N264-A267 WeakPolarHBondContact O-CB 3.42Å; N264-A267 PolarHBondContact O-N 3.32Å; G265-A267 PolarHBondContact O-N 3.13Å; A267-R271 WeakPolarHBondContact O-CB 3.35Å; A267-R271 VanDerWaalsContact O-CG 3.26Å; A267-R271 WeakPolarHBondContact O-CG 3.49Å; A267-R271 PolarHBondContact O-N 3.28Å; A267-R271 VanDerWaalsContact O-N 3.08Å; A267-R271 PolarHBondContact O-NE 3.44Å; A267-R271 VanDerWaalsContact O-NE 3.11Å
268	A	64.6	Low	64.3	Low	48 Å²	48	100.9 Å²	100.9	40%	0.397	53%	0.531	S	S	.	.	H	α-helix	trans	-68	-48.2	171.3	0	0	0	0	0	110.9	N264 G265 R271 L272	N264-A268 PolarHBondContact O-N 2.78Å; G265-A268 PolarHBondContact O-N 3.46Å; A268-R271 WeakPolarHBondContact O-CB 3.45Å; A268-R271 PolarHBondContact O-N 3.33Å; A268-L272 PolarHBondContact O-N 3.38Å
269	S	68.6	Low	66.2	Low	60 Å²	60	104.3 Å²	104.3	42%	0.42	54%	0.543	S	S	.	.	H	α-helix	trans	-59.4	-47.4	174.5	176.6	0	0	0	0	111.9	G265 R271 L272 L273	G265-S269 WeakPolarHBondContact O-CB 3.33Å; G265-S269 PolarHBondContact O-N 2.97Å; S269-R271 VanDerWaalsContact C-N 3.31Å; S269-R271 PolarHBondContact O-N 3.47Å; S269-L272 PolarHBondContact O-N 3.47Å; S269-L273 WeakPolarHBondContact O-CB 3.4Å; S269-L273 VanDerWaalsContact O-CG 3.3Å; S269-L273 WeakPolarHBondContact O-CG 3.27Å; S269-L273 PolarHBondContact O-N 3.27Å
270	R	71.6	Confident	68.4	Low	168 Å²	168	98 Å²	98	63%	0.634	52%	0.516	S	S	*	.	H	α-helix	trans	-59.9	-38.3	173.8	-80.9	-177.9	-76	-163.5	-1	113	H266 G274	H266-R270 WeakPolarHBondContact O-CB 3.33Å; H266-R270 WeakPolarHBondContact O-CG 2.98Å; H266-R270 PolarHBondContact O-N 3Å; H266-R270 PolarHBondContact O-NE 3.43Å; H266-R270 VanDerWaalsContact O-NE 3.08Å; R270-G274 PolarHBondContact O-N 2.93Å
271	R	70.9	Confident	70.6	Confident	171 Å²	171	95.8 Å²	95.8	65%	0.645	49%	0.486	S	S	*	.	H	α-helix	trans	-66	-43.6	175	-81.6	-178.5	-80.4	177.6	-4.8	111.6	A267 A268 S269 G274 M275	A267-R271 WeakPolarHBondContact O-CB 3.35Å; A267-R271 VanDerWaalsContact O-CG 3.26Å; A267-R271 WeakPolarHBondContact O-CG 3.49Å; A267-R271 PolarHBondContact O-N 3.28Å; A267-R271 VanDerWaalsContact O-N 3.08Å; A267-R271 PolarHBondContact O-NE 3.44Å; A267-R271 VanDerWaalsContact O-NE 3.11Å; A268-R271 WeakPolarHBondContact O-CB 3.45Å; A268-R271 PolarHBondContact O-N 3.33Å; S269-R271 VanDerWaalsContact C-N 3.31Å; S269-R271 PolarHBondContact O-N 3.47Å; R271-G274 PolarHBondContact O-N 2.92Å; R271-M275 WeakPolarHBondContact O-CG 3.29Å; R271-M275 PolarHBondContact O-N 3.49Å
272	L	71.3	Confident	72.9	Confident	107 Å²	107	94.7 Å²	94.7	56%	0.56	48%	0.479	S	S	*	.	H	α-helix	trans	-61.7	-48.9	176.7	-167.9	79.1	0	0	0	111.2	A268 S269 G274 M275 D276	A268-L272 PolarHBondContact O-N 3.38Å; S269-L272 PolarHBondContact O-N 3.47Å; L272-G274 VanDerWaalsContact C-N 3.31Å; L272-G274 PolarHBondContact O-N 3.32Å; L272-M275 WeakPolarHBondContact O-CB 3.31Å; L272-M275 PolarHBondContact O-N 2.87Å; L272-D276 PolarHBondContact O-N 2.69Å
273	L	72.6	Confident	75	Confident	99 Å²	99	86.5 Å²	86.5	52%	0.518	45%	0.449	S	S	.	.	H	α-helix	trans	-56.4	-44.8	176.1	-71.9	169.8	0	0	0	111.5	S269 M275 D276 E277	S269-L273 WeakPolarHBondContact O-CB 3.4Å; S269-L273 VanDerWaalsContact O-CG 3.3Å; S269-L273 WeakPolarHBondContact O-CG 3.27Å; S269-L273 PolarHBondContact O-N 3.27Å; L273-M275 VanDerWaalsContact C-N 3.33Å; L273-M275 PolarHBondContact O-N 3.36Å; L273-D276 PolarHBondContact O-N 3.47Å; L273-E277 WeakPolarHBondContact O-CG 3.21Å; L273-E277 PolarHBondContact O-N 3.21Å
274	G	78.6	Confident	77	Confident	26 Å²	26	79.6 Å²	79.6	27%	0.268	42%	0.417	S	S	.	.	H	α-helix	trans	-63.8	-34.7	175.6	0	0	0	0	0	113.5	R270 R271 L272 V278	R270-G274 PolarHBondContact O-N 2.93Å; R271-G274 PolarHBondContact O-N 2.92Å; L272-G274 VanDerWaalsContact C-N 3.31Å; L272-G274 PolarHBondContact O-N 3.32Å; G274-V278 VanDerWaalsContact O-CG2 3.26Å; G274-V278 WeakPolarHBondContact O-CG2 3.48Å; G274-V278 PolarHBondContact O-N 2.86Å; G274-V278 VanDerWaalsContact O-N 3.09Å
275	M	79.4	Confident	79.1	Confident	132 Å²	132	75.4 Å²	75.4	65%	0.65	40%	0.396	S	S	*	.	H	α-helix	trans	-68.4	-39.3	174.8	-71.6	175.2	65.1	0	0	112.1	R271 L272 L273 V278 K279	R271-M275 WeakPolarHBondContact O-CG 3.29Å; R271-M275 PolarHBondContact O-N 3.49Å; L272-M275 WeakPolarHBondContact O-CB 3.31Å; L272-M275 PolarHBondContact O-N 2.87Å; L273-M275 VanDerWaalsContact C-N 3.33Å; L273-M275 PolarHBondContact O-N 3.36Å; M275-V278 PolarHBondContact O-N 3.08Å; M275-K279 WeakPolarHBondContact O-CB 3.28Å; M275-K279 PolarHBondContact O-N 2.94Å
276	D	85.1	Confident	81	Confident	87 Å²	87	79.9 Å²	79.9	47%	0.465	40%	0.398	S	S	.	.	H	α-helix	trans	-68.2	-40.6	176.6	-75.7	-35	0	0	0	112.1	L272 L273 K279 G280	L272-D276 PolarHBondContact O-N 2.69Å; L273-D276 PolarHBondContact O-N 3.47Å; D276-K279 PolarHBondContact O-N 2.99Å; D276-G280 PolarHBondContact O-N 3.04Å
277	E	86.9	Confident	82.7	Confident	117 Å²	117	73.5 Å²	73.5	55%	0.547	37%	0.369	S	S	.	.	H	α-helix	trans	-58	-50	172.1	-75.3	178.5	174.2	0	0	111.4	L273 K279 G280 E281	L273-E277 WeakPolarHBondContact O-CG 3.21Å; L273-E277 PolarHBondContact O-N 3.21Å; E277-K279 VanDerWaalsContact C-N 3.29Å; E277-K279 PolarHBondContact O-N 3.23Å; E277-G280 PolarHBondContact O-N 3.23Å; E277-G280 VanDerWaalsContact O-N 3.15Å; E277-E281 WeakPolarHBondContact O-CG 3.29Å; E277-E281 PolarHBondContact O-N 2.89Å
278	V	86.8	Confident	84.4	Confident	57 Å²	57	72.2 Å²	72.2	35%	0.345	36%	0.358	S	S	.	.	H	α-helix	trans	-61	-38.7	177.4	170.2	0	0	0	0	111.6	G274 M275 E281 K282	G274-V278 VanDerWaalsContact O-CG2 3.26Å; G274-V278 WeakPolarHBondContact O-CG2 3.48Å; G274-V278 PolarHBondContact O-N 2.86Å; G274-V278 VanDerWaalsContact O-N 3.09Å; M275-V278 PolarHBondContact O-N 3.08Å; V278-E281 PolarHBondContact O-N 2.95Å; V278-K282 HydrophobicContact CG1-CD 4.4Å; V278-K282 WeakPolarHBondContact O-CG 3.39Å; V278-K282 PolarHBondContact O-N 3.49Å
279	K	88.8	Confident	85.9	Confident	140 Å²	140	73.3 Å²	73.3	61%	0.609	35%	0.352	S	S	*	.	H	α-helix	trans	-65.9	-39.9	176.8	-175.1	179.8	178.1	-177.6	0	111.6	M275 D276 E277 K282 Q283	M275-K279 WeakPolarHBondContact O-CB 3.28Å; M275-K279 PolarHBondContact O-N 2.94Å; D276-K279 PolarHBondContact O-N 2.99Å; E277-K279 VanDerWaalsContact C-N 3.29Å; E277-K279 PolarHBondContact O-N 3.23Å; K279-K282 PolarHBondContact O-N 3.42Å; K279-Q283 PolarHBondContact O-N 2.99Å
280	G	90.4	Very high	87.3	Confident	26 Å²	26	71.6 Å²	71.6	27%	0.268	34%	0.341	S	S	.	.	H	α-helix	trans	-61.3	-49.2	173.3	0	0	0	0	0	112.1	D276 E277 K282 Q283 L284	D276-G280 PolarHBondContact O-N 3.04Å; E277-G280 PolarHBondContact O-N 3.23Å; E277-G280 VanDerWaalsContact O-N 3.15Å; G280-K282 VanDerWaalsContact C-N 3.31Å; G280-K282 PolarHBondContact O-N 3.29Å; G280-Q283 WeakPolarHBondContact O-CB 3.41Å; G280-Q283 PolarHBondContact O-N 3.37Å; G280-L284 PolarHBondContact O-N 3.33Å
281	E	91.9	Very high	88.5	Confident	26 Å²	26	63.6 Å²	63.6	12%	0.121	31%	0.311	C	S	.	.	H	α-helix	trans	-60.3	-38.1	177.6	-69.3	-61.6	145.6	0	0	112.3	R121 E277 V278 L284 G285	R121-E281 IonicContact CZ-OE2 3.89Å; R121-E281 IonicContact NH1-OE2 3.58Å; R121-E281 PolarHBondContact NH1-OE2 2.89Å; R121-E281 IonicContact NH2-OE2 2.7Å; E277-E281 WeakPolarHBondContact O-CG 3.29Å; E277-E281 PolarHBondContact O-N 2.89Å; V278-E281 PolarHBondContact O-N 2.95Å; E281-L284 PolarHBondContact O-N 3.42Å; E281-G285 PolarHBondContact O-N 3.05Å
282	K	92.4	Very high	89.8	Confident	57 Å²	57	55.5 Å²	55.5	25%	0.248	28%	0.281	C	S	.	.	H	α-helix	trans	-67	-33.8	172.7	-73.4	178	-180	177.9	0	113.4	I125 V278 K279 G280 R286	I125-K282 HydrophobicContact CD1-CG 4.16Å; I125-K282 HydrophobicContact CG1-CG 4.5Å; V278-K282 HydrophobicContact CG1-CD 4.4Å; V278-K282 WeakPolarHBondContact O-CG 3.39Å; V278-K282 PolarHBondContact O-N 3.49Å; K279-K282 PolarHBondContact O-N 3.42Å; G280-K282 VanDerWaalsContact C-N 3.31Å; G280-K282 PolarHBondContact O-N 3.29Å; K282-R286 WeakPolarHBondContact O-CG 3.49Å; K282-R286 PolarHBondContact O-N 3.23Å; K282-R286 VanDerWaalsContact O-N 3.15Å; K282-R286 PolarHBondContact O-NE 3.39Å
283	Q	92.7	Very high	91	Very high	37 Å²	37	53.5 Å²	53.5	17%	0.173	27%	0.27	C	S	.	.	H	α-helix	trans	-66.5	-43.2	173.6	-177.2	172	-10.7	0	0	111.1	K279 G280 R286 M287 L343	K279-Q283 PolarHBondContact O-N 2.99Å; G280-Q283 WeakPolarHBondContact O-CB 3.41Å; G280-Q283 PolarHBondContact O-N 3.37Å; Q283-R286 PolarHBondContact O-N 2.87Å; Q283-M287 PolarHBondContact O-N 3.41Å; Q283-M287 VanDerWaalsContact O-N 3.09Å; Q283-L343 PolarHBondContact NE2-O 3.38Å
284	L	95.1	Very high	92.2	Very high	11 Å²	11	51.8 Å²	51.8	6%	0.058	26%	0.261	C	S	.	.	H	α-helix	trans	-62.5	-43.9	174.2	-67.3	171.1	0	0	0	111.8	P57 Y58 G280 E281 R286 M287 F288	P57-L284 HydrophobicContact CB-CD1 4.13Å; P57-L284 HydrophobicContact CG-CD1 3.73Å; Y58-L284 HydrophobicContact CE1-CD2 4.17Å; G280-L284 PolarHBondContact O-N 3.33Å; E281-L284 PolarHBondContact O-N 3.42Å; L284-R286 VanDerWaalsContact C-N 3.32Å; L284-R286 PolarHBondContact O-N 3.34Å; L284-M287 HydrophobicContact CD2-CE 4.26Å; L284-M287 WeakPolarHBondContact O-CB 3.49Å; L284-M287 PolarHBondContact O-N 3.43Å; L284-M287 VanDerWaalsContact O-N 3.16Å; L284-F288 VanDerWaalsContact O-CD2 3.26Å; L284-F288 WeakPolarHBondContact O-CD2 3.34Å; L284-F288 PolarHBondContact O-N 3.26Å
285	G	95.3	Very high	93	Very high	4 Å²	4	50.7 Å²	50.7	4%	0.041	25%	0.249	C	C	.	.	H	α-helix	trans	-55.8	-44.7	175.7	0	0	0	0	0	112.8	E281 Y289	E281-G285 PolarHBondContact O-N 3.05Å; G285-Y289 VanDerWaalsContact O-CB 3.31Å; G285-Y289 WeakPolarHBondContact O-CB 3.44Å; G285-Y289 PolarHBondContact O-N 3.4Å
286	R	95.1	Very high	93.8	Very high	142 Å²	142	46.9 Å²	46.9	54%	0.536	23%	0.231	S	C	.	.	H	α-helix	trans	-64.4	-40	175.6	-72.8	178	-71.5	162.7	-1.9	113.1	K282 Q283 L284 Y289 A290	K282-R286 WeakPolarHBondContact O-CG 3.49Å; K282-R286 PolarHBondContact O-N 3.23Å; K282-R286 VanDerWaalsContact O-N 3.15Å; K282-R286 PolarHBondContact O-NE 3.39Å; Q283-R286 PolarHBondContact O-N 2.87Å; L284-R286 VanDerWaalsContact C-N 3.32Å; L284-R286 PolarHBondContact O-N 3.34Å; R286-Y289 PolarHBondContact O-N 3.46Å; R286-A290 WeakPolarHBondContact O-CB 3.45Å; R286-A290 PolarHBondContact O-N 3.01Å
287	M	96.5	Very high	94.4	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-61.4	-52	176.9	-180	-167.1	77.1	0	0	111.1	L61 Q283 L284 Y289 A290 I291 V339 C340 L343 N344	L61-M287 HydrophobicContact CD2-CE 4.32Å; Q283-M287 PolarHBondContact O-N 3.41Å; Q283-M287 VanDerWaalsContact O-N 3.09Å; L284-M287 HydrophobicContact CD2-CE 4.26Å; L284-M287 WeakPolarHBondContact O-CB 3.49Å; L284-M287 PolarHBondContact O-N 3.43Å; L284-M287 VanDerWaalsContact O-N 3.16Å; M287-Y289 VanDerWaalsContact C-N 3.33Å; M287-Y289 PolarHBondContact O-N 3.39Å; M287-A290 WeakPolarHBondContact O-CB 3.46Å; M287-A290 PolarHBondContact O-N 3.12Å; M287-I291 HydrophobicContact CG-CD1 4.49Å; M287-I291 WeakPolarHBondContact O-CG1 3.17Å; M287-I291 PolarHBondContact O-N 3.1Å; M287-V339 HydrophobicContact CG-CG1 4.2Å; M287-C340 HydrophobicContact SD-CB 4.3Å; M287-L343 HydrophobicContact CB-CB 4.33Å; M287-L343 HydrophobicContact CG-CB 4.41Å; M287-N344 HydrophobicContact SD-CB 3.63Å
288	F	97.6	Very high	94.8	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-67.1	-33.8	179.3	-75.2	-67.7	0	0	0	113	P57 L61 I117 R121 Y204 L284 A290 I291 T292	P57-F288 HydrophobicContact CB-CE2 3.85Å; P57-F288 HydrophobicContact CB-CZ 4.37Å; P57-F288 VanDerWaalsContact O-CZ 3.3Å; P57-F288 WeakPolarHBondContact O-CZ 3.35Å; L61-F288 HydrophobicContact CB-CE1 4.16Å; L61-F288 HydrophobicContact CB-CZ 3.99Å; L61-F288 HydrophobicContact CD1-CE1 4.24Å; I117-F288 HydrophobicContact CD1-CD1 4.07Å; I117-F288 HydrophobicContact CD1-CE1 3.95Å; I117-F288 HydrophobicContact CG2-CB 3.69Å; I117-F288 HydrophobicContact CG2-CD1 3.62Å; I117-F288 HydrophobicContact CG2-CD2 4.01Å; I117-F288 HydrophobicContact CG2-CE1 4.2Å; I117-F288 HydrophobicContact CG2-CG 3.5Å; R121-F288 HydrophobicContact CG-CD2 4.31Å; Y204-F288 WeakPolarHBondContact OH-CB 3.25Å; Y204-F288 PolarHBondContact OH-O 2.98Å; L284-F288 VanDerWaalsContact O-CD2 3.26Å; L284-F288 WeakPolarHBondContact O-CD2 3.34Å; L284-F288 PolarHBondContact O-N 3.26Å; F288-A290 VanDerWaalsContact C-N 3.33Å; F288-I291 HydrophobicContact CD1-CD1 4.23Å; F288-I291 PolarHBondContact O-N 3.12Å; F288-T292 WeakPolarHBondContact O-CB 3.21Å; F288-T292 PolarHBondContact O-N 2.61Å; F288-T292 PolarHBondContact O-OG1 3.09Å
289	Y	96.9	Very high	95.2	Very high	71 Å²	71	41.8 Å²	41.8	28%	0.278	20%	0.203	S	C	.	.	H	α-helix	trans	-62.4	-41.7	172.5	-177.6	-121.9	0	0	0	111.5	Y204 L208 G285 R286 M287 T292 L293	Y204-Y289 AromaticContact CD1-CD2 3.52Å; Y204-Y289 HydrophobicContact CD1-CD2 3.52Å; Y204-Y289 HydrophobicContact CD1-CE2 4.39Å; Y204-Y289 HydrophobicContact CD1-CG 4.05Å; Y204-Y289 AromaticContact CD2-CD2 3.77Å; Y204-Y289 HydrophobicContact CD2-CD2 3.77Å; Y204-Y289 HydrophobicContact CD2-CE2 4.31Å; Y204-Y289 HydrophobicContact CE1-CD2 4Å; Y204-Y289 HydrophobicContact CE1-CG 4.29Å; Y204-Y289 HydrophobicContact CE2-CD2 4.21Å; Y204-Y289 AromaticContact CG-CD2 3.4Å; Y204-Y289 HydrophobicContact CG-CD2 3.4Å; Y204-Y289 AromaticContact CG-CE2 3.92Å; Y204-Y289 HydrophobicContact CG-CE2 3.92Å; Y204-Y289 HydrophobicContact CG-CG 4.36Å; L208-Y289 HydrophobicContact CD1-CE1 4.17Å; G285-Y289 VanDerWaalsContact O-CB 3.31Å; G285-Y289 WeakPolarHBondContact O-CB 3.44Å; G285-Y289 PolarHBondContact O-N 3.4Å; R286-Y289 PolarHBondContact O-N 3.46Å; M287-Y289 VanDerWaalsContact C-N 3.33Å; M287-Y289 PolarHBondContact O-N 3.39Å; Y289-T292 PolarHBondContact O-N 3.44Å; Y289-L293 WeakPolarHBondContact O-CB 3.33Å; Y289-L293 PolarHBondContact O-N 2.95Å
290	A	97.7	Very high	95.5	Very high	24 Å²	24	37.1 Å²	37.1	20%	0.198	19%	0.189	C	C	.	.	H	α-helix	trans	-62.8	-43	175.1	0	0	0	0	0	112.4	R286 M287 F288 T292 L293 L294 V339 L343	R286-A290 WeakPolarHBondContact O-CB 3.45Å; R286-A290 PolarHBondContact O-N 3.01Å; M287-A290 WeakPolarHBondContact O-CB 3.46Å; M287-A290 PolarHBondContact O-N 3.12Å; F288-A290 VanDerWaalsContact C-N 3.33Å; A290-T292 VanDerWaalsContact C-N 3.33Å; A290-T292 PolarHBondContact O-N 3.2Å; A290-L293 PolarHBondContact O-N 3.44Å; A290-L294 WeakPolarHBondContact O-CB 3.44Å; A290-L294 WeakPolarHBondContact O-CG 3.48Å; A290-L294 PolarHBondContact O-N 3.45Å; A290-V339 HydrophobicContact CB-CG1 3.91Å; A290-L343 HydrophobicContact CB-CD1 3.74Å
291	I	97.6	Very high	95.8	Very high	1 Å²	1	37 Å²	37	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-59	-46.4	173.4	-64.8	172.1	0	0	0	110.4	L61 L114 M287 F288 L293 L294 F295 N336 V339	L61-I291 HydrophobicContact CD1-CD1 4.41Å; L114-I291 HydrophobicContact CD2-CG2 3.94Å; M287-I291 HydrophobicContact CG-CD1 4.49Å; M287-I291 WeakPolarHBondContact O-CG1 3.17Å; M287-I291 PolarHBondContact O-N 3.1Å; F288-I291 HydrophobicContact CD1-CD1 4.23Å; F288-I291 PolarHBondContact O-N 3.12Å; I291-L293 PolarHBondContact O-N 3.32Å; I291-L294 PolarHBondContact O-N 2.95Å; I291-F295 PolarHBondContact O-N 2.85Å; I291-N336 WeakPolarHBondContact CG2-OD1 3.02Å; I291-V339 HydrophobicContact CD1-CG1 4.46Å; I291-V339 HydrophobicContact CG1-CB 3.86Å; I291-V339 HydrophobicContact CG1-CG1 3.71Å; I291-V339 HydrophobicContact CG1-CG2 4.28Å
292	T	97.5	Very high	95.8	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-63.2	-41.5	-179.5	-53.6	0	0	0	0	111.8	T200 Y204 F288 Y289 A290 F295 L296	T200-T292 HydrophobicContact CG2-CG2 3.59Å; Y204-T292 HydrophobicContact CD2-CG2 4.18Å; Y204-T292 HydrophobicContact CE2-CG2 3.78Å; Y204-T292 WeakPolarHBondContact CE2-OG1 3.42Å; Y204-T292 PolarHBondContact OH-OG1 3.48Å; F288-T292 WeakPolarHBondContact O-CB 3.21Å; F288-T292 PolarHBondContact O-N 2.61Å; F288-T292 PolarHBondContact O-OG1 3.09Å; Y289-T292 PolarHBondContact O-N 3.44Å; A290-T292 VanDerWaalsContact C-N 3.33Å; A290-T292 PolarHBondContact O-N 3.2Å; T292-F295 WeakPolarHBondContact O-CB 3.26Å; T292-F295 PolarHBondContact O-N 2.97Å; T292-L296 PolarHBondContact O-N 3.02Å; T292-L296 VanDerWaalsContact O-N 3.11Å
293	L	96.9	Very high	95.8	Very high	65 Å²	65	34.7 Å²	34.7	34%	0.34	17%	0.173	S	C	.	.	H	α-helix	trans	-67.9	-42.8	179	-175.1	65.5	0	0	0	111.1	Y289 A290 I291 F295 L296 L297	Y289-L293 WeakPolarHBondContact O-CB 3.33Å; Y289-L293 PolarHBondContact O-N 2.95Å; A290-L293 PolarHBondContact O-N 3.44Å; I291-L293 PolarHBondContact O-N 3.32Å; L293-F295 VanDerWaalsContact C-N 3.32Å; L293-F295 PolarHBondContact O-N 3.22Å; L293-L296 PolarHBondContact O-N 3.43Å; L293-L297 HydrophobicContact CG-CD1 4.12Å; L293-L297 HydrophobicContact CG-CG 4.48Å; L293-L297 VanDerWaalsContact O-CG 3.3Å; L293-L297 WeakPolarHBondContact O-CG 3.1Å; L293-L297 PolarHBondContact O-N 3.22Å
294	L	97.4	Very high	95.8	Very high	63 Å²	63	36.4 Å²	36.4	33%	0.33	19%	0.186	S	C	.	.	H	α-helix	trans	-65.4	-36	175.9	-75.6	168.5	0	0	0	112.2	A290 I291 L297 L298 V335 V339	A290-L294 WeakPolarHBondContact O-CB 3.44Å; A290-L294 WeakPolarHBondContact O-CG 3.48Å; A290-L294 PolarHBondContact O-N 3.45Å; I291-L294 PolarHBondContact O-N 2.95Å; L294-L297 HydrophobicContact CD2-CD1 4.47Å; L294-L297 PolarHBondContact O-N 2.92Å; L294-L298 VanDerWaalsContact O-CB 3.32Å; L294-L298 WeakPolarHBondContact O-CB 3.48Å; L294-L298 WeakPolarHBondContact O-CG 3.5Å; L294-L298 PolarHBondContact O-N 3.38Å; L294-V335 HydrophobicContact CB-CG1 3.8Å; L294-V335 HydrophobicContact CB-CG2 4.44Å; L294-V335 HydrophobicContact CD1-CG1 3.74Å; L294-V335 HydrophobicContact CG-CG1 4.44Å; L294-V339 HydrophobicContact CD1-CG2 3.47Å; L294-V339 VanDerWaalsContact CD1-CG2 3.47Å
295	F	96.4	Very high	95.6	Very high	3 Å²	3	36 Å²	36	1%	0.013	18%	0.184	C	C	.	.	H	α-helix	trans	-56.5	-50.4	169.8	-175.7	-82.3	0	0	0	111	A110 A111 L114 M197 I291 T292 L293 L297 W299 Q332	A110-F295 HydrophobicContact CB-CD2 4.31Å; A110-F295 HydrophobicContact CB-CE2 3.63Å; A110-F295 HydrophobicContact CB-CZ 4.33Å; A111-F295 HydrophobicContact CB-CE1 4.49Å; A111-F295 HydrophobicContact CB-CZ 4.38Å; L114-F295 HydrophobicContact CD1-CB 3.77Å; L114-F295 HydrophobicContact CD1-CD1 4.2Å; L114-F295 HydrophobicContact CD1-CD2 3.88Å; L114-F295 HydrophobicContact CD1-CG 3.68Å; M197-F295 HydrophobicContact CE-CD1 3.59Å; M197-F295 HydrophobicContact CE-CE1 4.1Å; M197-F295 HydrophobicContact SD-CD1 3.69Å; M197-F295 HydrophobicContact SD-CE1 3.59Å; M197-F295 VanDerWaalsContact SD-CE1 3.59Å; I291-F295 PolarHBondContact O-N 2.85Å; T292-F295 WeakPolarHBondContact O-CB 3.26Å; T292-F295 PolarHBondContact O-N 2.97Å; L293-F295 VanDerWaalsContact C-N 3.32Å; L293-F295 PolarHBondContact O-N 3.22Å; F295-L297 PolarHBondContact O-N 2.96Å; F295-W299 AromaticContact CD1-CD1 3.98Å; F295-W299 AromaticContact CD2-CD1 3.74Å; F295-W299 AromaticContact CD2-NE1 3.77Å; F295-W299 AromaticContact CE1-CD1 3.89Å; F295-W299 HydrophobicContact CE1-CG 4.21Å; F295-W299 AromaticContact CE2-CD1 3.63Å; F295-W299 AromaticContact CE2-NE1 3.35Å; F295-W299 AromaticContact CG-CD1 3.92Å; F295-W299 AromaticContact CZ-CD1 3.71Å; F295-W299 HydrophobicContact CZ-CD2 4.47Å; F295-W299 HydrophobicContact CZ-CG 4.2Å; F295-W299 AromaticContact CZ-NE1 3.67Å; F295-W299 VanDerWaalsContact O-CB 3.31Å; F295-W299 WeakPolarHBondContact O-CB 3.23Å; F295-W299 VanDerWaalsContact O-CD1 3.24Å; F295-W299 PolarHBondContact O-N 2.51Å; F295-Q332 HydrophobicContact CD2-CG 3.81Å; F295-Q332 HydrophobicContact CE2-CG 4.36Å
296	L	95.7	Very high	95.4	Very high	53 Å²	53	35.8 Å²	35.8	28%	0.277	18%	0.182	S	C	.	.	H	α-helix	trans	-60.7	-47.6	176.7	-178.4	63.1	0	0	0	111.7	M197 H201 T292 L293 L298 W299 S300	M197-L296 HydrophobicContact CB-CD1 4.47Å; M197-L296 HydrophobicContact CE-CB 3.63Å; M197-L296 HydrophobicContact CE-CD1 3.85Å; M197-L296 HydrophobicContact CE-CG 4.28Å; H201-L296 WeakPolarHBondContact NE2-CD2 3.26Å; T292-L296 PolarHBondContact O-N 3.02Å; T292-L296 VanDerWaalsContact O-N 3.11Å; L293-L296 PolarHBondContact O-N 3.43Å; L296-L298 PolarHBondContact O-N 2.7Å; L296-W299 PolarHBondContact O-N 3.07Å; L296-S300 WeakPolarHBondContact O-CA 3.37Å; L296-S300 WeakPolarHBondContact O-CB 3.01Å; L296-S300 PolarHBondContact O-N 2.95Å; L296-S300 PolarHBondContact O-OG 2.86Å
297	L	96.5	Very high	95.1	Very high	96 Å²	96	31.4 Å²	31.4	50%	0.503	17%	0.166	S	C	.	.	H	α-helix	trans	-62.4	-44.3	-176.2	-71.4	172.5	0	0	0	111.9	L293 L294 F295 S300 P301	L293-L297 HydrophobicContact CG-CD1 4.12Å; L293-L297 HydrophobicContact CG-CG 4.48Å; L293-L297 VanDerWaalsContact O-CG 3.3Å; L293-L297 WeakPolarHBondContact O-CG 3.1Å; L293-L297 PolarHBondContact O-N 3.22Å; L294-L297 HydrophobicContact CD2-CD1 4.47Å; L294-L297 PolarHBondContact O-N 2.92Å; F295-L297 PolarHBondContact O-N 2.96Å; L297-S300 PolarHBondContact O-OG 3.4Å; L297-P301 WeakPolarHBondContact O-CD 3.41Å
298	L	96.8	Very high	94.8	Very high	33 Å²	33	37 Å²	37	17%	0.173	19%	0.187	C	C	.	.	H	α-helix	trans	-75.4	-30.9	-178.8	-71.2	174.9	0	0	0	113.2	L294 L296 M328 Q332 V335	L294-L298 VanDerWaalsContact O-CB 3.32Å; L294-L298 WeakPolarHBondContact O-CB 3.48Å; L294-L298 WeakPolarHBondContact O-CG 3.5Å; L294-L298 PolarHBondContact O-N 3.38Å; L296-L298 PolarHBondContact O-N 2.7Å; L298-M328 HydrophobicContact CD2-CB 4Å; L298-M328 HydrophobicContact CD2-CG 4.26Å; L298-M328 WeakPolarHBondContact O-CB 3.39Å; L298-Q332 HydrophobicContact CD1-CB 4.26Å; L298-V335 HydrophobicContact CD1-CG2 3.51Å
299	W	95.3	Very high	94.3	Very high	24 Å²	24	40 Å²	40	9%	0.091	20%	0.198	C	C	.	.	H	α-helix	trans	-84.6	-22.9	175.1	-79.3	88.9	0	0	0	113.6	C107 F295 L296 Y302 I303	C107-W299 HydrophobicContact CB-CH2 3.7Å; C107-W299 HydrophobicContact CB-CZ2 3.92Å; C107-W299 HydrophobicContact CB-CZ3 4.43Å; C107-W299 WeakPolarHBondContact SG-CH2 3.36Å; C107-W299 VanDerWaalsContact SG-CZ2 3.56Å; C107-W299 VanDerWaalsContact SG-CZ3 3.58Å; F295-W299 AromaticContact CD1-CD1 3.98Å; F295-W299 AromaticContact CD2-CD1 3.74Å; F295-W299 AromaticContact CD2-NE1 3.77Å; F295-W299 AromaticContact CE1-CD1 3.89Å; F295-W299 HydrophobicContact CE1-CG 4.21Å; F295-W299 AromaticContact CE2-CD1 3.63Å; F295-W299 AromaticContact CE2-NE1 3.35Å; F295-W299 AromaticContact CG-CD1 3.92Å; F295-W299 AromaticContact CZ-CD1 3.71Å; F295-W299 HydrophobicContact CZ-CD2 4.47Å; F295-W299 HydrophobicContact CZ-CG 4.2Å; F295-W299 AromaticContact CZ-NE1 3.67Å; F295-W299 VanDerWaalsContact O-CB 3.31Å; F295-W299 WeakPolarHBondContact O-CB 3.23Å; F295-W299 VanDerWaalsContact O-CD1 3.24Å; F295-W299 PolarHBondContact O-N 2.51Å; L296-W299 PolarHBondContact O-N 3.07Å; W299-Y302 AromaticContact CE3-CD1 3.89Å; W299-Y302 HydrophobicContact CE3-CD1 3.89Å; W299-Y302 AromaticContact CZ3-CD1 3.8Å; W299-Y302 HydrophobicContact CZ3-CD1 3.8Å; W299-Y302 HydrophobicContact CZ3-CE1 4.07Å; W299-Y302 PolarHBondContact O-N 3.21Å; W299-Y302 VanDerWaalsContact O-N 3.14Å; W299-I303 HydrophobicContact CB-CD1 4.02Å; W299-I303 WeakPolarHBondContact O-CG1 3.36Å; W299-I303 PolarHBondContact O-N 3.23Å
300	S	94.3	Very high	93.8	Very high	43 Å²	43	36.6 Å²	36.6	30%	0.301	19%	0.185	S	C	.	.	H	α-helix	trans	-56.5	-43.1	-173.7	64.8	0	0	0	0	114.4	L296 L297 Y302 I303 V304	L296-S300 WeakPolarHBondContact O-CA 3.37Å; L296-S300 WeakPolarHBondContact O-CB 3.01Å; L296-S300 PolarHBondContact O-N 2.95Å; L296-S300 PolarHBondContact O-OG 2.86Å; L297-S300 PolarHBondContact O-OG 3.4Å; S300-Y302 VanDerWaalsContact C-N 3.29Å; S300-Y302 PolarHBondContact O-N 3.15Å; S300-I303 PolarHBondContact O-N 3.42Å; S300-V304 VanDerWaalsContact O-CG2 3.3Å; S300-V304 WeakPolarHBondContact O-CG2 3.4Å; S300-V304 PolarHBondContact O-N 3.18Å
301	P	95.5	Very high	93.3	Very high	24 Å²	24	40.7 Å²	40.7	16%	0.156	20%	0.199	C	C	.	.	H	α-helix	trans	-68	-33.5	-179.1	-20.4	37	0	0	0	111.7	L297 A305 Y321 A325 M328	L297-P301 WeakPolarHBondContact O-CD 3.41Å; P301-A305 WeakPolarHBondContact O-CB 3.4Å; P301-A305 PolarHBondContact O-N 3.28Å; P301-Y321 WeakPolarHBondContact CA-OH 3.4Å; P301-Y321 PolarHBondContact O-OH 2.88Å; P301-A325 HydrophobicContact CB-CB 3.83Å; P301-M328 HydrophobicContact CG-SD 3.75Å
302	Y	93.5	Very high	92.7	Very high	11 Å²	11	43.2 Å²	43.2	4%	0.043	21%	0.214	C	C	.	.	H	α-helix	trans	-70	-44.4	175.5	-176.7	-101	0	0	0	111	E171 I175 W299 S300 V304 A305 C306 V326	E171-Y302 WeakPolarHBondContact OE2-CE2 3.46Å; E171-Y302 PolarHBondContact OE2-OH 3.35Å; I175-Y302 WeakPolarHBondContact CD1-OH 3.45Å; W299-Y302 AromaticContact CE3-CD1 3.89Å; W299-Y302 HydrophobicContact CE3-CD1 3.89Å; W299-Y302 AromaticContact CZ3-CD1 3.8Å; W299-Y302 HydrophobicContact CZ3-CD1 3.8Å; W299-Y302 HydrophobicContact CZ3-CE1 4.07Å; W299-Y302 PolarHBondContact O-N 3.21Å; W299-Y302 VanDerWaalsContact O-N 3.14Å; S300-Y302 VanDerWaalsContact C-N 3.29Å; S300-Y302 PolarHBondContact O-N 3.15Å; Y302-V304 VanDerWaalsContact C-N 3.3Å; Y302-V304 PolarHBondContact O-N 3.06Å; Y302-A305 WeakPolarHBondContact O-CA 3.36Å; Y302-A305 WeakPolarHBondContact O-CB 3.38Å; Y302-A305 PolarHBondContact O-N 2.89Å; Y302-A305 VanDerWaalsContact O-N 3.08Å; Y302-C306 WeakPolarHBondContact CE1-SG 3.11Å; Y302-C306 PolarHBondContact O-N 2.85Å; Y302-C306 PolarHBondContact O-SG 3.33Å; Y302-V326 HydrophobicContact CD2-CG2 3.91Å; Y302-V326 HydrophobicContact CE2-CG2 3.92Å
303	I	91.7	Very high	91.5	Very high	23 Å²	23	51.4 Å²	51.4	12%	0.118	25%	0.249	C	C	.	.	H	α-helix	trans	-58.4	-43.7	174.2	-68.2	168.2	0	0	0	110.7	M190 L193 W299 S300 C306 Y307	M190-I303 HydrophobicContact CE-CB 4.47Å; M190-I303 HydrophobicContact CE-CG2 3.93Å; M190-I303 WeakPolarHBondContact CE-O 3.46Å; L193-I303 HydrophobicContact CD2-CD1 4.17Å; L193-I303 HydrophobicContact CD2-CG1 4.29Å; W299-I303 HydrophobicContact CB-CD1 4.02Å; W299-I303 WeakPolarHBondContact O-CG1 3.36Å; W299-I303 PolarHBondContact O-N 3.23Å; S300-I303 PolarHBondContact O-N 3.42Å; I303-C306 WeakPolarHBondContact O-CB 3.27Å; I303-C306 PolarHBondContact O-N 2.86Å; I303-Y307 HydrophobicContact CG2-CD2 3.72Å; I303-Y307 HydrophobicContact CG2-CE2 3.64Å; I303-Y307 VanDerWaalsContact O-CD2 3.27Å; I303-Y307 WeakPolarHBondContact O-CD2 3.48Å; I303-Y307 PolarHBondContact O-N 2.83Å
304	V	92.4	Very high	90.2	Very high	73 Å²	73	53 Å²	53	44%	0.442	27%	0.272	S	S	.	.	H	α-helix	trans	-62.6	-42.2	174.6	171	0	0	0	0	111.3	S300 Y302 C306 Y307 W308 Y321	S300-V304 VanDerWaalsContact O-CG2 3.3Å; S300-V304 WeakPolarHBondContact O-CG2 3.4Å; S300-V304 PolarHBondContact O-N 3.18Å; Y302-V304 VanDerWaalsContact C-N 3.3Å; Y302-V304 PolarHBondContact O-N 3.06Å; V304-C306 VanDerWaalsContact C-N 3.33Å; V304-C306 PolarHBondContact O-N 3.39Å; V304-Y307 PolarHBondContact O-N 3.47Å; V304-W308 WeakPolarHBondContact O-CB 3.35Å; V304-W308 PolarHBondContact O-N 3.04Å; V304-Y321 WeakPolarHBondContact CB-OH 3.11Å; V304-Y321 WeakPolarHBondContact CG1-OH 3.41Å
305	A	91.4	Very high	89	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.008	28%	0.279	C	S	.	.	H	α-helix	trans	-60	-43.2	175.2	0	0	0	0	0	111.9	P301 Y302 W308 R309 V317 Y321 L322	P301-A305 WeakPolarHBondContact O-CB 3.4Å; P301-A305 PolarHBondContact O-N 3.28Å; Y302-A305 WeakPolarHBondContact O-CA 3.36Å; Y302-A305 WeakPolarHBondContact O-CB 3.38Å; Y302-A305 PolarHBondContact O-N 2.89Å; Y302-A305 VanDerWaalsContact O-N 3.08Å; A305-W308 WeakPolarHBondContact O-CB 3.36Å; A305-W308 PolarHBondContact O-N 3.49Å; A305-R309 WeakPolarHBondContact O-CG 3.31Å; A305-R309 PolarHBondContact O-N 3.47Å; A305-V317 HydrophobicContact CB-CG1 4.41Å; A305-Y321 HydrophobicContact CB-CD1 4.43Å; A305-Y321 HydrophobicContact CB-CE1 3.87Å; A305-L322 HydrophobicContact CB-CD1 4.15Å
306	C	89.8	Confident	88.2	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.007	32%	0.315	C	S	.	.	H	α-helix	trans	-63.3	-47.2	176.9	-68.2	0	0	0	0	111.4	H178 M190 Y302 I303 V304 W308 R309 V310	H178-C306 PolarHBondContact CE1-SG 3.08Å; M190-C306 HydrophobicContact CE-CB 3.23Å; M190-C306 HydrophobicContact SD-CB 3.6Å; Y302-C306 WeakPolarHBondContact CE1-SG 3.11Å; Y302-C306 PolarHBondContact O-N 2.85Å; Y302-C306 PolarHBondContact O-SG 3.33Å; I303-C306 WeakPolarHBondContact O-CB 3.27Å; I303-C306 PolarHBondContact O-N 2.86Å; V304-C306 VanDerWaalsContact C-N 3.33Å; V304-C306 PolarHBondContact O-N 3.39Å; C306-W308 VanDerWaalsContact C-N 3.3Å; C306-W308 PolarHBondContact O-N 2.87Å; C306-R309 PolarHBondContact O-N 3.24Å; C306-V310 WeakPolarHBondContact O-CG2 3.46Å; C306-V310 PolarHBondContact O-N 3.45Å
307	Y	89.8	Confident	87.8	Confident	49 Å²	49	55.9 Å²	55.9	19%	0.192	31%	0.307	C	S	.	.	H	α-helix	trans	-62.1	-37.9	174.7	-83.4	-64.4	0	0	0	112.6	L187 M190 I303 V304 V310 F311	L187-Y307 HydrophobicContact CD1-CE1 4.29Å; M190-Y307 HydrophobicContact CB-CE1 4.04Å; M190-Y307 HydrophobicContact CE-CD2 3.66Å; M190-Y307 HydrophobicContact CE-CE2 3.69Å; M190-Y307 HydrophobicContact CE-CG 4.13Å; M190-Y307 PolarHBondContact O-OH 3.35Å; I303-Y307 HydrophobicContact CG2-CD2 3.72Å; I303-Y307 HydrophobicContact CG2-CE2 3.64Å; I303-Y307 VanDerWaalsContact O-CD2 3.27Å; I303-Y307 WeakPolarHBondContact O-CD2 3.48Å; I303-Y307 PolarHBondContact O-N 2.83Å; V304-Y307 PolarHBondContact O-N 3.47Å; Y307-V310 PolarHBondContact O-N 3.46Å; Y307-F311 HydrophobicContact CD1-CD2 4.08Å; Y307-F311 AromaticContact CD1-CE2 3.49Å; Y307-F311 HydrophobicContact CD1-CE2 3.49Å; Y307-F311 VanDerWaalsContact CD1-CE2 3.49Å; Y307-F311 HydrophobicContact CD1-CZ 4.43Å; Y307-F311 HydrophobicContact CE1-CE2 4.11Å; Y307-F311 HydrophobicContact CG-CE2 4.42Å; Y307-F311 VanDerWaalsContact O-CD2 3.29Å; Y307-F311 WeakPolarHBondContact O-CD2 3.1Å; Y307-F311 PolarHBondContact O-N 3.5Å
308	W	89.8	Confident	87.5	Confident	118 Å²	118	55.1 Å²	55.1	45%	0.447	31%	0.307	S	S	.	.	H	α-helix	trans	-58.6	-48.3	174	-168.3	-62.3	0	0	0	111.1	V304 A305 C306 V310 F311 V312 V317	V304-W308 WeakPolarHBondContact O-CB 3.35Å; V304-W308 PolarHBondContact O-N 3.04Å; A305-W308 WeakPolarHBondContact O-CB 3.36Å; A305-W308 PolarHBondContact O-N 3.49Å; C306-W308 VanDerWaalsContact C-N 3.3Å; C306-W308 PolarHBondContact O-N 2.87Å; W308-V310 VanDerWaalsContact C-N 3.3Å; W308-V310 PolarHBondContact O-N 2.75Å; W308-F311 PolarHBondContact O-N 2.89Å; W308-V312 HydrophobicContact CG-CG2 4.35Å; W308-V312 WeakPolarHBondContact O-CA 3.37Å; W308-V312 VanDerWaalsContact O-CB 3.28Å; W308-V312 WeakPolarHBondContact O-CB 3.15Å; W308-V312 PolarHBondContact O-N 3.21Å; W308-V317 HydrophobicContact CB-CG2 4.04Å; W308-V317 HydrophobicContact CG-CG2 3.94Å
309	R	87	Confident	87.1	Confident	63 Å²	63	58.2 Å²	58.2	24%	0.238	32%	0.321	C	S	.	.	H	α-helix	trans	-61.1	-36.1	176.6	-69.2	-176.8	-171.7	-128.1	17.5	112.8	E171 A305 C306 V317	E171-R309 IonicContact OE1-CZ 3.48Å; E171-R309 IonicContact OE1-NH2 2.75Å; E171-R309 PolarHBondContact OE1-NH2 3.35Å; A305-R309 WeakPolarHBondContact O-CG 3.31Å; A305-R309 PolarHBondContact O-N 3.47Å; C306-R309 PolarHBondContact O-N 3.24Å; R309-V317 HydrophobicContact CG-CG2 3.81Å
310	V	86.3	Confident	86.8	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-72	-41.8	-179	172.4	0	0	0	0	112.1	H178 Y180 F181 L187 C306 Y307 W308	H178-V310 HydrophobicContact CB-CG2 4.02Å; Y180-V310 WeakPolarHBondContact CD2-O 3.35Å; F181-V310 HydrophobicContact CB-CG1 3.82Å; F181-V310 PolarHBondContact N-O 3.17Å; F181-V310 VanDerWaalsContact N-O 3.08Å; L187-V310 HydrophobicContact CD1-CG1 4.28Å; C306-V310 WeakPolarHBondContact O-CG2 3.46Å; C306-V310 PolarHBondContact O-N 3.45Å; Y307-V310 PolarHBondContact O-N 3.46Å; W308-V310 VanDerWaalsContact C-N 3.3Å; W308-V310 PolarHBondContact O-N 2.75Å
311	F	86.8	Confident	86.7	Confident	111 Å²	111	69.6 Å²	69.6	49%	0.487	36%	0.357	S	S	.	.	H	α-helix	trans	-96.1	-25.8	-173.5	-68.8	-60.7	0	0	0	114.4	L187 Y307 W308	L187-F311 HydrophobicContact CD1-CE1 4.47Å; L187-F311 HydrophobicContact CD1-CZ 3.85Å; Y307-F311 HydrophobicContact CD1-CD2 4.08Å; Y307-F311 AromaticContact CD1-CE2 3.49Å; Y307-F311 HydrophobicContact CD1-CE2 3.49Å; Y307-F311 VanDerWaalsContact CD1-CE2 3.49Å; Y307-F311 HydrophobicContact CD1-CZ 4.43Å; Y307-F311 HydrophobicContact CE1-CE2 4.11Å; Y307-F311 HydrophobicContact CG-CE2 4.42Å; Y307-F311 VanDerWaalsContact O-CD2 3.29Å; Y307-F311 WeakPolarHBondContact O-CD2 3.1Å; Y307-F311 PolarHBondContact O-N 3.5Å; W308-F311 PolarHBondContact O-N 2.89Å
312	V	85	Confident	86.6	Confident	53 Å²	53	68.6 Å²	68.6	32%	0.321	35%	0.351	S	S	.	.			trans	-110.3	95.2	-175.9	-171.6	0	0	0	0	109.9	W308 C315	W308-V312 HydrophobicContact CG-CG2 4.35Å; W308-V312 WeakPolarHBondContact O-CA 3.37Å; W308-V312 VanDerWaalsContact O-CB 3.28Å; W308-V312 WeakPolarHBondContact O-CB 3.15Å; W308-V312 PolarHBondContact O-N 3.21Å; V312-C315 HydrophobicContact CG1-CB 3.86Å
313	K	73	Confident	86.4	Confident	173 Å²	173	68.8 Å²	68.8	75%	0.752	36%	0.355	S	S	*	.	S	Bend	trans	-67.3	-37.3	177.8	-170.7	178.9	178.3	-175.1	0	113	Y180	Y180-K313 HydrophobicContact CD2-CB 3.81Å; Y180-K313 HydrophobicContact CD2-CG 4.43Å; Y180-K313 HydrophobicContact CE2-CB 3.68Å; Y180-K313 HydrophobicContact CG-CB 4.49Å
314	A	69.3	Low	86.4	Confident	98 Å²	98	71.2 Å²	71.2	81%	0.81	37%	0.371	S	S	*	.	S	Bend	trans	-83.1	-20.8	-164.9	0	0	0	0	0	114.5
315	C	71.9	Confident	86.6	Confident	70 Å²	70	67.8 Å²	67.8	47%	0.473	35%	0.35	S	S	.	.			trans	-120.7	116.5	-175.3	-61.8	0	0	0	0	110.3	V312	V312-C315 HydrophobicContact CG1-CB 3.86Å
316	A	80	Confident	86.8	Confident	95 Å²	95	67.9 Å²	67.9	79%	0.785	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-61.1	138.3	164.8	0	0	0	0	0	109.3
317	V	86.5	Confident	86.9	Confident	15 Å²	15	69.3 Å²	69.3	9%	0.091	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-58.2	129.7	172.9	179.3	0	0	0	0	108.1	A305 W308 R309 H319 Y321 L322	A305-V317 HydrophobicContact CB-CG1 4.41Å; W308-V317 HydrophobicContact CB-CG2 4.04Å; W308-V317 HydrophobicContact CG-CG2 3.94Å; R309-V317 HydrophobicContact CG-CG2 3.81Å; V317-H319 PolarHBondContact O-N 3.38Å; V317-Y321 HydrophobicContact CG1-CD1 3.58Å; V317-Y321 HydrophobicContact CG1-CE1 4.32Å; V317-Y321 HydrophobicContact CG1-CG 4.48Å; V317-L322 HydrophobicContact CG1-CB 3.97Å
318	P	91.4	Very high	87.1	Confident	80 Å²	80	70.5 Å²	70.5	52%	0.519	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-53.2	130.1	179.1	-27.1	34.4	0	0	0	111.4	R320 Y321 L322	P318-R320 PolarHBondContact O-N 3.23Å; P318-R320 VanDerWaalsContact O-N 3.12Å; P318-Y321 WeakPolarHBondContact O-CB 3.43Å; P318-Y321 PolarHBondContact O-N 3.09Å; P318-L322 PolarHBondContact O-N 3.23Å
319	H	88	Confident	87.4	Confident	97 Å²	97	65.1 Å²	65.1	45%	0.449	34%	0.344	S	S	.	.	H	α-helix	trans	-54.6	-39.2	-172.6	-177.3	68.2	0	0	0	113.1	V317 L322 A323	V317-H319 PolarHBondContact O-N 3.38Å; H319-L322 PolarHBondContact O-N 3.42Å; H319-A323 VanDerWaalsContact O-CB 3.28Å; H319-A323 WeakPolarHBondContact O-CB 3.29Å; H319-A323 PolarHBondContact O-N 3.24Å
320	R	88.7	Confident	87.9	Confident	216 Å²	216	62.5 Å²	62.5	82%	0.815	34%	0.335	S	S	*	.	H	α-helix	trans	-63.1	-43.9	177.7	-62.9	-177	-177.5	-176.7	1	112.4	P318 T324	P318-R320 PolarHBondContact O-N 3.23Å; P318-R320 VanDerWaalsContact O-N 3.12Å; R320-T324 PolarHBondContact O-N 2.98Å; R320-T324 PolarHBondContact O-OG1 3.43Å; R320-T324 VanDerWaalsContact O-OG1 3.06Å
321	Y	93.3	Very high	88.3	Confident	90 Å²	90	64 Å²	64	35%	0.353	35%	0.347	S	S	.	.	H	α-helix	trans	-64.6	-48.5	178.9	177.2	-90.6	0	0	0	110.7	P301 V304 A305 V317 P318 A323 T324 A325	P301-Y321 WeakPolarHBondContact CA-OH 3.4Å; P301-Y321 PolarHBondContact O-OH 2.88Å; V304-Y321 WeakPolarHBondContact CB-OH 3.11Å; V304-Y321 WeakPolarHBondContact CG1-OH 3.41Å; A305-Y321 HydrophobicContact CB-CD1 4.43Å; A305-Y321 HydrophobicContact CB-CE1 3.87Å; V317-Y321 HydrophobicContact CG1-CD1 3.58Å; V317-Y321 HydrophobicContact CG1-CE1 4.32Å; V317-Y321 HydrophobicContact CG1-CG 4.48Å; P318-Y321 WeakPolarHBondContact O-CB 3.43Å; P318-Y321 PolarHBondContact O-N 3.09Å; Y321-A323 PolarHBondContact O-N 3.02Å; Y321-T324 PolarHBondContact O-N 3.06Å; Y321-A325 VanDerWaalsContact O-CB 3.32Å; Y321-A325 WeakPolarHBondContact O-CB 3.44Å; Y321-A325 PolarHBondContact O-N 2.92Å
322	L	92	Very high	88.8	Confident	4 Å²	4	58.9 Å²	58.9	2%	0.021	32%	0.324	C	S	.	.	H	α-helix	trans	-60.7	-46.5	179	178.3	66.9	0	0	0	111.7	E170 E171 A305 V317 P318 H319 A325 V326	E170-L322 HydrophobicContact CB-CD2 3.52Å; E170-L322 HydrophobicContact CG-CD2 4.44Å; E171-L322 HydrophobicContact CG-CD1 4.19Å; E171-L322 HydrophobicContact CG-CD2 4.01Å; E171-L322 HydrophobicContact CG-CG 4.17Å; A305-L322 HydrophobicContact CB-CD1 4.15Å; V317-L322 HydrophobicContact CG1-CB 3.97Å; P318-L322 PolarHBondContact O-N 3.23Å; H319-L322 PolarHBondContact O-N 3.42Å; L322-A325 WeakPolarHBondContact O-CB 3.2Å; L322-A325 PolarHBondContact O-N 3.33Å; L322-V326 HydrophobicContact CD1-CG2 4.31Å; L322-V326 WeakPolarHBondContact O-CG2 3.32Å; L322-V326 PolarHBondContact O-N 3.34Å
323	A	90.7	Very high	89.3	Confident	14 Å²	14	56.3 Å²	56.3	12%	0.116	31%	0.309	C	S	.	.	H	α-helix	trans	-54.9	-59.2	175.8	0	0	0	0	0	109.5	H319 Y321 A325 V326 W327	H319-A323 VanDerWaalsContact O-CB 3.28Å; H319-A323 WeakPolarHBondContact O-CB 3.29Å; H319-A323 PolarHBondContact O-N 3.24Å; Y321-A323 PolarHBondContact O-N 3.02Å; A323-A325 PolarHBondContact O-N 2.9Å; A323-V326 PolarHBondContact O-N 3.49Å; A323-W327 PolarHBondContact O-N 3.35Å
324	T	92.1	Very high	90.4	Very high	75 Å²	75	48.5 Å²	48.5	46%	0.46	28%	0.277	S	S	.	.	H	α-helix	trans	-53.5	-41.2	-179.9	-60.1	0	0	0	0	112.7	R320 Y321 W327 M328	R320-T324 PolarHBondContact O-N 2.98Å; R320-T324 PolarHBondContact O-OG1 3.43Å; R320-T324 VanDerWaalsContact O-OG1 3.06Å; Y321-T324 PolarHBondContact O-N 3.06Å; T324-W327 PolarHBondContact O-N 3.05Å; T324-M328 HydrophobicContact CG2-CE 3.84Å; T324-M328 HydrophobicContact CG2-SD 4.5Å; T324-M328 WeakPolarHBondContact O-CG 3.32Å; T324-M328 PolarHBondContact O-N 3.46Å
325	A	95.7	Very high	91.7	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.008	24%	0.241	C	C	.	.	H	α-helix	trans	-62.4	-43.7	177.3	0	0	0	0	0	113.1	P301 Y321 L322 A323 M328 S329	P301-A325 HydrophobicContact CB-CB 3.83Å; Y321-A325 VanDerWaalsContact O-CB 3.32Å; Y321-A325 WeakPolarHBondContact O-CB 3.44Å; Y321-A325 PolarHBondContact O-N 2.92Å; L322-A325 WeakPolarHBondContact O-CB 3.2Å; L322-A325 PolarHBondContact O-N 3.33Å; A323-A325 PolarHBondContact O-N 2.9Å; A325-M328 PolarHBondContact O-N 2.9Å; A325-S329 PolarHBondContact O-N 3.35Å
326	V	94.6	Very high	92.9	Very high	3 Å²	3	41.1 Å²	41.1	2%	0.018	22%	0.219	C	C	.	.	H	α-helix	trans	-64.7	-42.1	175.1	170.3	0	0	0	0	111.2	E171 Y302 L322 A323 M328 S329 F330	E171-V326 HydrophobicContact CB-CG2 3.99Å; E171-V326 HydrophobicContact CG-CG2 3.77Å; Y302-V326 HydrophobicContact CD2-CG2 3.91Å; Y302-V326 HydrophobicContact CE2-CG2 3.92Å; L322-V326 HydrophobicContact CD1-CG2 4.31Å; L322-V326 WeakPolarHBondContact O-CG2 3.32Å; L322-V326 PolarHBondContact O-N 3.34Å; A323-V326 PolarHBondContact O-N 3.49Å; V326-M328 VanDerWaalsContact C-N 3.31Å; V326-M328 PolarHBondContact O-N 3.42Å; V326-S329 PolarHBondContact O-N 2.94Å; V326-S329 PolarHBondContact O-OG 3.4Å; V326-F330 HydrophobicContact CG1-CD2 4.08Å; V326-F330 HydrophobicContact CG1-CE1 4.48Å; V326-F330 HydrophobicContact CG1-CE2 3.43Å; V326-F330 VanDerWaalsContact CG1-CE2 3.43Å; V326-F330 HydrophobicContact CG1-CZ 3.67Å; V326-F330 PolarHBondContact O-N 2.81Å; V326-F330 VanDerWaalsContact O-N 3.1Å
327	W	92.3	Very high	93.6	Very high	31 Å²	31	36.8 Å²	36.8	12%	0.117	18%	0.183	C	C	.	.	H	α-helix	trans	-63.1	-37.2	177.6	-73.6	101.9	0	0	0	112.6	K25 L28 L29 I32 A323 T324 F330 A331	K25-W327 VanDerWaalsContact C-CH2 3.49Å; K25-W327 VanDerWaalsContact CA-CH2 3.43Å; K25-W327 HydrophobicContact CB-CH2 3.54Å; K25-W327 HydrophobicContact CB-CZ2 3.34Å; K25-W327 HydrophobicContact CD-CZ2 3.82Å; K25-W327 HydrophobicContact CG-CH2 4.02Å; K25-W327 HydrophobicContact CG-CZ2 3.31Å; K25-W327 WeakPolarHBondContact O-CH2 3.39Å; K25-W327 WeakPolarHBondContact O-CZ3 3.48Å; L28-W327 HydrophobicContact CB-CE3 4.32Å; L28-W327 HydrophobicContact CB-CZ3 3.99Å; L28-W327 HydrophobicContact CD2-CD2 4.37Å; L28-W327 HydrophobicContact CD2-CE3 3.73Å; L28-W327 HydrophobicContact CD2-CZ3 4.24Å; L28-W327 HydrophobicContact CG-CE3 4Å; L28-W327 HydrophobicContact CG-CZ3 4.13Å; L29-W327 HydrophobicContact CB-CH2 3.68Å; L29-W327 HydrophobicContact CB-CZ3 3.55Å; L29-W327 HydrophobicContact CD1-CZ3 4.34Å; L29-W327 HydrophobicContact CG-CZ3 4.44Å; I32-W327 HydrophobicContact CD1-CE3 4.49Å; A323-W327 PolarHBondContact O-N 3.35Å; T324-W327 PolarHBondContact O-N 3.05Å; W327-F330 PolarHBondContact O-N 3.33Å; W327-A331 PolarHBondContact O-N 2.89Å; W327-A331 VanDerWaalsContact O-N 3.08Å
328	M	95.6	Very high	94	Very high	73 Å²	73	40.2 Å²	40.2	36%	0.36	20%	0.2	S	C	.	.	H	α-helix	trans	-64.2	-40.7	173.7	-72.3	-177.8	177.9	0	0	112	L298 P301 T324 A325 V326 F330 A331 Q332	L298-M328 HydrophobicContact CD2-CB 4Å; L298-M328 HydrophobicContact CD2-CG 4.26Å; L298-M328 WeakPolarHBondContact O-CB 3.39Å; P301-M328 HydrophobicContact CG-SD 3.75Å; T324-M328 HydrophobicContact CG2-CE 3.84Å; T324-M328 HydrophobicContact CG2-SD 4.5Å; T324-M328 WeakPolarHBondContact O-CG 3.32Å; T324-M328 PolarHBondContact O-N 3.46Å; A325-M328 PolarHBondContact O-N 2.9Å; V326-M328 VanDerWaalsContact C-N 3.31Å; V326-M328 PolarHBondContact O-N 3.42Å; M328-F330 VanDerWaalsContact C-N 3.32Å; M328-F330 PolarHBondContact O-N 3.13Å; M328-A331 WeakPolarHBondContact O-CB 3.18Å; M328-A331 PolarHBondContact O-N 2.91Å; M328-Q332 PolarHBondContact O-N 3.49Å
329	S	95.7	Very high	94.3	Very high	5 Å²	5	36.8 Å²	36.8	4%	0.035	18%	0.178	C	C	.	.	H	α-helix	trans	-67	-32.2	177.6	76.7	0	0	0	0	112.7	A325 V326 Q332	A325-S329 PolarHBondContact O-N 3.35Å; V326-S329 PolarHBondContact O-N 2.94Å; V326-S329 PolarHBondContact O-OG 3.4Å; S329-Q332 WeakPolarHBondContact O-CB 3.18Å; S329-Q332 PolarHBondContact O-N 3.48Å
330	F	96.3	Very high	94.6	Very high	8 Å²	8	32.2 Å²	32.2	4%	0.035	16%	0.156	C	C	.	.	H	α-helix	trans	-66.7	-43.1	170.6	-64.4	-34.9	0	0	0	112.5	L29 F76 V79 Q173 V326 W327 M328 Q332 A333	L29-F330 HydrophobicContact CD1-CB 4.43Å; L29-F330 HydrophobicContact CD1-CD2 4.06Å; L29-F330 HydrophobicContact CD1-CG 4.32Å; F76-F330 HydrophobicContact CD1-CD1 4.24Å; F76-F330 HydrophobicContact CE1-CB 4.32Å; F76-F330 AromaticContact CE1-CD1 3.56Å; F76-F330 HydrophobicContact CE1-CD1 3.56Å; F76-F330 HydrophobicContact CE1-CE1 4.19Å; F76-F330 HydrophobicContact CE1-CG 4.19Å; F76-F330 HydrophobicContact CZ-CB 4.11Å; F76-F330 HydrophobicContact CZ-CD1 4.18Å; F76-F330 HydrophobicContact CZ-CG 4.48Å; V79-F330 HydrophobicContact CG1-CE2 3.92Å; V79-F330 HydrophobicContact CG1-CZ 3.88Å; V79-F330 HydrophobicContact CG2-CE1 4.48Å; V79-F330 HydrophobicContact CG2-CZ 4.06Å; Q173-F330 VanDerWaalsContact NE2-CZ 3.33Å; Q173-F330 VanDerWaalsContact OE1-CE1 3.3Å; V326-F330 HydrophobicContact CG1-CD2 4.08Å; V326-F330 HydrophobicContact CG1-CE1 4.48Å; V326-F330 HydrophobicContact CG1-CE2 3.43Å; V326-F330 VanDerWaalsContact CG1-CE2 3.43Å; V326-F330 HydrophobicContact CG1-CZ 3.67Å; V326-F330 PolarHBondContact O-N 2.81Å; V326-F330 VanDerWaalsContact O-N 3.1Å; W327-F330 PolarHBondContact O-N 3.33Å; M328-F330 VanDerWaalsContact C-N 3.32Å; M328-F330 PolarHBondContact O-N 3.13Å; F330-Q332 PolarHBondContact O-N 3.49Å; F330-Q332 VanDerWaalsContact O-N 3.08Å; F330-A333 WeakPolarHBondContact O-CB 3.25Å; F330-A333 PolarHBondContact O-N 2.94Å; F330-A333 VanDerWaalsContact O-N 3.08Å
331	A	96.1	Very high	94.8	Very high	31 Å²	31	24 Å²	24	26%	0.256	13%	0.127	S	C	.	.	H	α-helix	trans	-58.2	-24.4	179.5	0	0	0	0	0	113.1	I32 W327 M328 A333 A334	I32-A331 HydrophobicContact CD1-CB 4.22Å; W327-A331 PolarHBondContact O-N 2.89Å; W327-A331 VanDerWaalsContact O-N 3.08Å; M328-A331 WeakPolarHBondContact O-CB 3.18Å; M328-A331 PolarHBondContact O-N 2.91Å; A331-A333 PolarHBondContact O-N 3.46Å; A331-A333 VanDerWaalsContact O-N 3.11Å; A331-A334 PolarHBondContact O-N 3.49Å; A331-A334 VanDerWaalsContact O-N 3.1Å
332	Q	96.7	Very high	94.8	Very high	4 Å²	4	25 Å²	25	2%	0.019	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-52.9	-32.4	174.7	178.3	56.1	32.4	0	0	113.1	F295 L298 M328 S329 F330 A334 V335	F295-Q332 HydrophobicContact CD2-CG 3.81Å; F295-Q332 HydrophobicContact CE2-CG 4.36Å; L298-Q332 HydrophobicContact CD1-CB 4.26Å; M328-Q332 PolarHBondContact O-N 3.49Å; S329-Q332 WeakPolarHBondContact O-CB 3.18Å; S329-Q332 PolarHBondContact O-N 3.48Å; F330-Q332 PolarHBondContact O-N 3.49Å; F330-Q332 VanDerWaalsContact O-N 3.08Å; Q332-A334 PolarHBondContact O-N 3.23Å; Q332-V335 WeakPolarHBondContact O-CB 3.43Å; Q332-V335 PolarHBondContact O-N 2.88Å; Q332-V335 VanDerWaalsContact O-N 3.09Å
333	A	96.1	Very high	94.8	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-60.5	-30.1	-178.5	0	0	0	0	0	113.4	S36 N40 R71 S72 F76 F330 A331	S36-A333 VanDerWaalsContact OG-CB 3.31Å; S36-A333 WeakPolarHBondContact OG-CB 3.28Å; S36-A333 PolarHBondContact OG-O 2.82Å; N40-A333 PolarHBondContact ND2-O 3.41Å; R71-A333 VanDerWaalsContact NH2-N 3.13Å; S72-A333 WeakPolarHBondContact OG-CB 3.46Å; F76-A333 HydrophobicContact CE2-CB 3.85Å; F76-A333 HydrophobicContact CZ-CB 3.81Å; F330-A333 WeakPolarHBondContact O-CB 3.25Å; F330-A333 PolarHBondContact O-N 2.94Å; F330-A333 VanDerWaalsContact O-N 3.08Å; A331-A333 PolarHBondContact O-N 3.46Å; A331-A333 VanDerWaalsContact O-N 3.11Å
334	A	96	Very high	94.9	Very high	8 Å²	8	28 Å²	28	7%	0.066	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-88.6	-6.1	-179	0	0	0	0	0	113.3	V35 A331 Q332 P337 I338	V35-A334 HydrophobicContact CB-CB 4.35Å; V35-A334 HydrophobicContact CG1-CB 3.81Å; A331-A334 PolarHBondContact O-N 3.49Å; A331-A334 VanDerWaalsContact O-N 3.1Å; Q332-A334 PolarHBondContact O-N 3.23Å; A334-P337 WeakPolarHBondContact O-CD 3.41Å; A334-P337 WeakPolarHBondContact O-CG 3.45Å; A334-I338 HydrophobicContact CB-CD1 4.27Å; A334-I338 VanDerWaalsContact O-CD1 3.3Å; A334-I338 WeakPolarHBondContact O-CD1 3.48Å; A334-I338 VanDerWaalsContact O-CG1 3.25Å; A334-I338 WeakPolarHBondContact O-CG1 3.49Å
335	V	96.6	Very high	94.7	Very high	11 Å²	11	31.2 Å²	31.2	7%	0.067	16%	0.159	C	C	.	.	H	α-helix	trans	-67.3	-44.3	-172.1	168.6	0	0	0	0	112.5	L294 L298 Q332 I338 V339	L294-V335 HydrophobicContact CB-CG1 3.8Å; L294-V335 HydrophobicContact CB-CG2 4.44Å; L294-V335 HydrophobicContact CD1-CG1 3.74Å; L294-V335 HydrophobicContact CG-CG1 4.44Å; L298-V335 HydrophobicContact CD1-CG2 3.51Å; Q332-V335 WeakPolarHBondContact O-CB 3.43Å; Q332-V335 PolarHBondContact O-N 2.88Å; Q332-V335 VanDerWaalsContact O-N 3.09Å; V335-I338 PolarHBondContact O-N 3.37Å; V335-V339 HydrophobicContact CG1-CG2 3.74Å; V335-V339 WeakPolarHBondContact O-CG2 3.31Å; V335-V339 PolarHBondContact O-N 2.72Å
336	N	95.7	Very high	94.4	Very high	2 Å²	2	35 Å²	35	1%	0.011	18%	0.179	C	C	.	.	H	α-helix	trans	-54.3	-55.2	-175.2	-59	-19.2	0	0	0	112.6	D68 I291 I338 V339 C340	D68-N336 PolarHBondContact OD2-ND2 2.78Å; I291-N336 WeakPolarHBondContact CG2-OD1 3.02Å; N336-I338 PolarHBondContact O-N 3.38Å; N336-V339 PolarHBondContact O-N 2.93Å; N336-C340 WeakPolarHBondContact O-CB 3.35Å; N336-C340 PolarHBondContact O-N 2.98Å; N336-C340 PolarHBondContact O-SG 3.09Å
337	P	95.5	Very high	94.2	Very high	5 Å²	5	34.9 Å²	34.9	3%	0.032	18%	0.178	C	C	.	.	H	α-helix	trans	-60.2	-43.9	177.3	22	-32.2	0	0	0	112.9	L43 A334 V339 C340 F341	L43-P337 VanDerWaalsContact CD1-CA 3.42Å; L43-P337 HydrophobicContact CD1-CB 3.93Å; L43-P337 HydrophobicContact CG-CB 4.24Å; A334-P337 WeakPolarHBondContact O-CD 3.41Å; A334-P337 WeakPolarHBondContact O-CG 3.45Å; P337-V339 PolarHBondContact O-N 2.87Å; P337-C340 PolarHBondContact O-N 3.39Å; P337-F341 HydrophobicContact CB-CD2 4.17Å; P337-F341 HydrophobicContact CB-CE2 4.07Å; P337-F341 WeakPolarHBondContact O-CB 3.05Å; P337-F341 WeakPolarHBondContact O-CD2 3.08Å; P337-F341 WeakPolarHBondContact O-CG 3.37Å; P337-F341 PolarHBondContact O-N 3.16Å
338	I	95.2	Very high	94.2	Very high	87 Å²	87	36.7 Å²	36.7	45%	0.446	19%	0.187	S	C	.	.	H	α-helix	trans	-59.1	-51.7	-179.7	-64.7	170.3	0	0	0	110.2	A334 V335 N336 L342	A334-I338 HydrophobicContact CB-CD1 4.27Å; A334-I338 VanDerWaalsContact O-CD1 3.3Å; A334-I338 WeakPolarHBondContact O-CD1 3.48Å; A334-I338 VanDerWaalsContact O-CG1 3.25Å; A334-I338 WeakPolarHBondContact O-CG1 3.49Å; V335-I338 PolarHBondContact O-N 3.37Å; N336-I338 PolarHBondContact O-N 3.38Å; I338-L342 HydrophobicContact CG2-CD1 3.88Å; I338-L342 WeakPolarHBondContact O-CB 3.17Å; I338-L342 WeakPolarHBondContact O-CD1 3.39Å; I338-L342 WeakPolarHBondContact O-CG 3.28Å; I338-L342 PolarHBondContact O-N 2.85Å; I338-L342 VanDerWaalsContact O-N 3.08Å
339	V	96.6	Very high	93.9	Very high	8 Å²	8	40.3 Å²	40.3	5%	0.048	20%	0.201	C	C	.	.	H	α-helix	trans	-67.5	-43.5	-177.9	177.6	0	0	0	0	111.6	M287 A290 I291 L294 V335 N336 P337 L342 L343	M287-V339 HydrophobicContact CG-CG1 4.2Å; A290-V339 HydrophobicContact CB-CG1 3.91Å; I291-V339 HydrophobicContact CD1-CG1 4.46Å; I291-V339 HydrophobicContact CG1-CB 3.86Å; I291-V339 HydrophobicContact CG1-CG1 3.71Å; I291-V339 HydrophobicContact CG1-CG2 4.28Å; L294-V339 HydrophobicContact CD1-CG2 3.47Å; L294-V339 VanDerWaalsContact CD1-CG2 3.47Å; V335-V339 HydrophobicContact CG1-CG2 3.74Å; V335-V339 WeakPolarHBondContact O-CG2 3.31Å; V335-V339 PolarHBondContact O-N 2.72Å; N336-V339 PolarHBondContact O-N 2.93Å; P337-V339 PolarHBondContact O-N 2.87Å; V339-L342 PolarHBondContact O-N 3.11Å; V339-L342 VanDerWaalsContact O-N 3.14Å; V339-L343 HydrophobicContact CG1-CD1 3.79Å; V339-L343 HydrophobicContact CG1-CG 4.31Å; V339-L343 PolarHBondContact O-N 2.85Å
340	C	95.1	Very high	93.6	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-62.7	-46.6	-179.3	-70.9	0	0	0	0	111.4	L43 L61 M287 N336 P337 L342 N344 L347	L43-C340 HydrophobicContact CD1-CB 3.97Å; L43-C340 HydrophobicContact CD2-CB 3.91Å; L61-C340 VanDerWaalsContact CD1-SG 3.58Å; M287-C340 HydrophobicContact SD-CB 4.3Å; N336-C340 WeakPolarHBondContact O-CB 3.35Å; N336-C340 PolarHBondContact O-N 2.98Å; N336-C340 PolarHBondContact O-SG 3.09Å; P337-C340 PolarHBondContact O-N 3.39Å; C340-L342 PolarHBondContact O-N 2.69Å; C340-N344 WeakPolarHBondContact O-CB 3.31Å; C340-N344 PolarHBondContact O-N 3.44Å; C340-L347 HydrophobicContact CB-CD1 3.81Å
341	F	92.9	Very high	93.3	Very high	44 Å²	44	42.5 Å²	42.5	19%	0.193	21%	0.213	C	C	.	.	H	α-helix	trans	-73.5	-8.9	176.5	-66.6	-51.4	0	0	0	113.9	I42 L43 L46 P337 K348 L351	I42-F341 HydrophobicContact CG2-CE2 4.09Å; I42-F341 HydrophobicContact CG2-CZ 3.54Å; L43-F341 HydrophobicContact CD2-CD1 4.39Å; L43-F341 HydrophobicContact CD2-CE1 3.72Å; L43-F341 HydrophobicContact CD2-CE2 3.86Å; L43-F341 HydrophobicContact CD2-CZ 3.39Å; L43-F341 HydrophobicContact CG-CE2 3.95Å; L43-F341 HydrophobicContact CG-CZ 3.85Å; L46-F341 HydrophobicContact CD1-CE1 3.77Å; L46-F341 HydrophobicContact CD1-CZ 4.01Å; P337-F341 HydrophobicContact CB-CD2 4.17Å; P337-F341 HydrophobicContact CB-CE2 4.07Å; P337-F341 WeakPolarHBondContact O-CB 3.05Å; P337-F341 WeakPolarHBondContact O-CD2 3.08Å; P337-F341 WeakPolarHBondContact O-CG 3.37Å; P337-F341 PolarHBondContact O-N 3.16Å; F341-K348 WeakPolarHBondContact O-CE 3.02Å; F341-L351 HydrophobicContact CD1-CD2 3.85Å; F341-L351 HydrophobicContact CE1-CB 4.21Å; F341-L351 HydrophobicContact CE1-CD1 4.4Å; F341-L351 HydrophobicContact CE1-CD2 3.76Å; F341-L351 HydrophobicContact CE1-CG 4.34Å; F341-L351 HydrophobicContact CZ-CD2 4.35Å
342	L	93	Very high	92.9	Very high	110 Å²	110	50.3 Å²	50.3	58%	0.576	24%	0.236	S	C	*	.	H	α-helix	trans	-93.7	-41.8	171.6	-72.9	173.5	0	0	0	112.4	I338 V339 C340 K348	I338-L342 HydrophobicContact CG2-CD1 3.88Å; I338-L342 WeakPolarHBondContact O-CB 3.17Å; I338-L342 WeakPolarHBondContact O-CD1 3.39Å; I338-L342 WeakPolarHBondContact O-CG 3.28Å; I338-L342 PolarHBondContact O-N 2.85Å; I338-L342 VanDerWaalsContact O-N 3.08Å; V339-L342 PolarHBondContact O-N 3.11Å; V339-L342 VanDerWaalsContact O-N 3.14Å; C340-L342 PolarHBondContact O-N 2.69Å; L342-K348 WeakPolarHBondContact O-CE 3.18Å; L342-K348 PolarHBondContact O-NZ 2.61Å
343	L	92.9	Very high	92.4	Very high	80 Å²	80	54.2 Å²	54.2	42%	0.419	26%	0.26	S	S	.	.	H	α-helix	trans	-104.5	-22.7	-168.4	-57.6	-176.6	0	0	0	114.3	Q283 M287 A290 V339	Q283-L343 PolarHBondContact NE2-O 3.38Å; M287-L343 HydrophobicContact CB-CB 4.33Å; M287-L343 HydrophobicContact CG-CB 4.41Å; A290-L343 HydrophobicContact CB-CD1 3.74Å; V339-L343 HydrophobicContact CG1-CD1 3.79Å; V339-L343 HydrophobicContact CG1-CG 4.31Å; V339-L343 PolarHBondContact O-N 2.85Å
344	N	91.7	Very high	91.8	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.011	27%	0.265	C	S	.	.			trans	-96.8	112	-176.7	-166.1	-34.2	0	0	0	112.2	Y58 M287 C340 D346 L347 K348	Y58-N344 WeakPolarHBondContact CE1-ND2 3.35Å; Y58-N344 PolarHBondContact OH-ND2 3.07Å; Y58-N344 VanDerWaalsContact OH-ND2 3.13Å; M287-N344 HydrophobicContact SD-CB 3.63Å; C340-N344 WeakPolarHBondContact O-CB 3.31Å; C340-N344 PolarHBondContact O-N 3.44Å; N344-D346 WeakPolarHBondContact OD1-CB 3.29Å; N344-D346 PolarHBondContact OD1-N 2.66Å; N344-L347 HydrophobicContact CB-CB 4.04Å; N344-L347 HydrophobicContact CB-CD1 3.86Å; N344-L347 HydrophobicContact CB-CG 4.19Å; N344-L347 PolarHBondContact OD1-N 3.25Å; N344-L347 VanDerWaalsContact OD1-N 3.15Å; N344-K348 VanDerWaalsContact O-CG 3.31Å; N344-K348 WeakPolarHBondContact O-CG 3.43Å; N344-K348 PolarHBondContact O-N 2.88Å; N344-K348 VanDerWaalsContact O-N 3.15Å
345	K	89.2	Confident	90.9	Very high	143 Å²	143	57 Å²	57	62%	0.622	28%	0.28	S	S	*	.	H	α-helix	trans	-71.8	-33.8	-179.6	-73.3	175.8	-177.4	-172.9	0	112.5	K348 K349	K345-K348 PolarHBondContact O-N 2.95Å; K345-K349 WeakPolarHBondContact O-CB 3.38Å; K345-K349 PolarHBondContact O-N 3.16Å
346	D	88.6	Confident	89.7	Confident	80 Å²	80	60.3 Å²	60.3	43%	0.428	30%	0.301	S	S	.	.	H	α-helix	trans	-68	-47.7	-179.9	-59.2	-25	0	0	0	109.6	L53 Y58 N344 K348 K349 C350	L53-D346 HydrophobicContact CD2-CB 4.19Å; Y58-D346 PolarHBondContact OH-OD2 3.41Å; N344-D346 WeakPolarHBondContact OD1-CB 3.29Å; N344-D346 PolarHBondContact OD1-N 2.66Å; D346-K348 VanDerWaalsContact C-N 3.35Å; D346-K348 PolarHBondContact O-N 3.34Å; D346-K349 WeakPolarHBondContact O-CB 3Å; D346-K349 PolarHBondContact O-N 2.69Å; D346-K349 VanDerWaalsContact O-N 3.1Å; D346-C350 PolarHBondContact O-N 2.03Å; D346-C350 PolarHBondContact O-SG 3.48Å
347	L	90.8	Very high	88.1	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-60.9	-41.6	175.3	-72.6	171.9	0	0	0	112.2	L43 V47 L53 Y58 L61 C340 N344 K349 C350 L351	L43-L347 HydrophobicContact CD2-CD1 4.08Å; L43-L347 HydrophobicContact CD2-CD2 4.44Å; V47-L347 HydrophobicContact CG2-CD2 4.31Å; L53-L347 HydrophobicContact CD1-CD2 3.62Å; L53-L347 HydrophobicContact CD2-CD2 4.45Å; Y58-L347 HydrophobicContact CE1-CD1 4.2Å; Y58-L347 HydrophobicContact CE1-CD2 4.35Å; Y58-L347 HydrophobicContact CE1-CG 4.09Å; L61-L347 HydrophobicContact CD2-CD1 3.88Å; C340-L347 HydrophobicContact CB-CD1 3.81Å; N344-L347 HydrophobicContact CB-CB 4.04Å; N344-L347 HydrophobicContact CB-CD1 3.86Å; N344-L347 HydrophobicContact CB-CG 4.19Å; N344-L347 PolarHBondContact OD1-N 3.25Å; N344-L347 VanDerWaalsContact OD1-N 3.15Å; L347-K349 VanDerWaalsContact C-N 3.32Å; L347-K349 PolarHBondContact O-N 3.13Å; L347-C350 PolarHBondContact O-N 2.91Å; L347-L351 WeakPolarHBondContact O-CB 3.18Å; L347-L351 PolarHBondContact O-N 3.48Å
348	K	91.3	Very high	86.3	Confident	70 Å²	70	68.1 Å²	68.1	30%	0.304	34%	0.338	S	S	.	.	H	α-helix	trans	-59.5	-42.1	173.2	-77.7	175.9	178.2	-178.9	0	112.3	F341 L342 N344 K345 D346 L351 R352	F341-K348 WeakPolarHBondContact O-CE 3.02Å; L342-K348 WeakPolarHBondContact O-CE 3.18Å; L342-K348 PolarHBondContact O-NZ 2.61Å; N344-K348 VanDerWaalsContact O-CG 3.31Å; N344-K348 WeakPolarHBondContact O-CG 3.43Å; N344-K348 PolarHBondContact O-N 2.88Å; N344-K348 VanDerWaalsContact O-N 3.15Å; K345-K348 PolarHBondContact O-N 2.95Å; D346-K348 VanDerWaalsContact C-N 3.35Å; D346-K348 PolarHBondContact O-N 3.34Å; K348-L351 PolarHBondContact O-N 3.16Å; K348-R352 WeakPolarHBondContact O-CG 3.2Å; K348-R352 PolarHBondContact O-N 2.7Å
349	K	90.5	Very high	84.3	Confident	148 Å²	148	67 Å²	67	64%	0.643	35%	0.348	S	S	*	.	H	α-helix	trans	-63.8	-49.2	178.4	-173.9	-179.6	178.3	-178.2	0	110.1	K345 D346 L347 L351 R352 T353	K345-K349 WeakPolarHBondContact O-CB 3.38Å; K345-K349 PolarHBondContact O-N 3.16Å; D346-K349 WeakPolarHBondContact O-CB 3Å; D346-K349 PolarHBondContact O-N 2.69Å; D346-K349 VanDerWaalsContact O-N 3.1Å; L347-K349 VanDerWaalsContact C-N 3.32Å; L347-K349 PolarHBondContact O-N 3.13Å; K349-L351 VanDerWaalsContact C-N 3.33Å; K349-L351 PolarHBondContact O-N 3.25Å; K349-R352 PolarHBondContact O-N 2.99Å; K349-T353 PolarHBondContact O-N 3.19Å; K349-T353 PolarHBondContact O-OG1 3.09Å; K349-T353 VanDerWaalsContact O-OG1 3.08Å
350	C	89.5	Confident	81.6	Confident	13 Å²	13	71.4 Å²	71.4	9%	0.088	38%	0.375	C	S	.	.	H	α-helix	trans	-60.1	-41.9	177	-61	0	0	0	0	112.2	L46 L53 D346 L347 T353 H354	L46-C350 HydrophobicContact CD2-CB 4.26Å; L53-C350 HydrophobicContact CD1-CB 4.48Å; D346-C350 PolarHBondContact O-N 2.03Å; D346-C350 PolarHBondContact O-SG 3.48Å; L347-C350 PolarHBondContact O-N 2.91Å; C350-T353 PolarHBondContact O-N 3.32Å; C350-H354 PolarHBondContact O-CD2 2.59Å; C350-H354 PolarHBondContact O-N 2.67Å
351	L	89.4	Confident	79	Confident	47 Å²	47	76 Å²	76	25%	0.246	42%	0.423	C	S	.	.	H	α-helix	trans	-59.6	-47.4	175.3	-179.3	67.1	0	0	0	111.1	I42 L46 F341 L347 K348 K349 T353 H354 A355 W358	I42-L351 HydrophobicContact CG2-CD1 3.97Å; L46-L351 HydrophobicContact CD1-CB 3.97Å; L46-L351 HydrophobicContact CD1-CD1 4.1Å; F341-L351 HydrophobicContact CD1-CD2 3.85Å; F341-L351 HydrophobicContact CE1-CB 4.21Å; F341-L351 HydrophobicContact CE1-CD1 4.4Å; F341-L351 HydrophobicContact CE1-CD2 3.76Å; F341-L351 HydrophobicContact CE1-CG 4.34Å; F341-L351 HydrophobicContact CZ-CD2 4.35Å; L347-L351 WeakPolarHBondContact O-CB 3.18Å; L347-L351 PolarHBondContact O-N 3.48Å; K348-L351 PolarHBondContact O-N 3.16Å; K349-L351 VanDerWaalsContact C-N 3.33Å; K349-L351 PolarHBondContact O-N 3.25Å; L351-T353 VanDerWaalsContact C-N 3.28Å; L351-T353 PolarHBondContact O-N 3.27Å; L351-H354 PolarHBondContact O-N 3.29Å; L351-A355 WeakPolarHBondContact O-CB 3.48Å; L351-A355 PolarHBondContact O-N 3.29Å; L351-W358 HydrophobicContact CD1-CH2 4.14Å; L351-W358 HydrophobicContact CD1-CZ3 3.63Å
352	R	88.2	Confident	76.1	Confident	194 Å²	194	76.1 Å²	76.1	73%	0.732	44%	0.436	S	S	*	.	H	α-helix	trans	-63.4	-34.1	177.6	-71.7	175.8	-175	-178.3	-1.1	112.9	K348 K349 P356	K348-R352 WeakPolarHBondContact O-CG 3.2Å; K348-R352 PolarHBondContact O-N 2.7Å; K349-R352 PolarHBondContact O-N 2.99Å; R352-P356 WeakPolarHBondContact O-CD 3.17Å
353	T	86.3	Confident	73.6	Confident	86 Å²	86	75.3 Å²	75.3	53%	0.528	45%	0.445	S	S	.	.	H	α-helix	trans	-73	-34	177.1	-57.1	0	0	0	0	112.3	K349 C350 L351	K349-T353 PolarHBondContact O-N 3.19Å; K349-T353 PolarHBondContact O-OG1 3.09Å; K349-T353 VanDerWaalsContact O-OG1 3.08Å; C350-T353 PolarHBondContact O-N 3.32Å; L351-T353 VanDerWaalsContact C-N 3.28Å; L351-T353 PolarHBondContact O-N 3.27Å
354	H	82.7	Confident	71.1	Confident	21 Å²	21	76.9 Å²	76.9	10%	0.097	46%	0.46	C	S	.	.	H	α-helix	trans	-94.9	-20.7	-178.7	-73.3	-48.4	0	0	0	115.1	L46 K49 C350 L351 P356 C357 W358	L46-H354 HydrophobicContact CD2-CB 4.16Å; K49-H354 VanDerWaalsContact CE-CE1 3.44Å; K49-H354 WeakPolarHBondContact CE-CE1 3.38Å; C350-H354 PolarHBondContact O-CD2 2.59Å; C350-H354 PolarHBondContact O-N 2.67Å; L351-H354 PolarHBondContact O-N 3.29Å; H354-P356 VanDerWaalsContact C-CD 3.46Å; H354-P356 VanDerWaalsContact C-N 3.35Å; H354-C357 WeakPolarHBondContact O-CB 3.41Å; H354-C357 PolarHBondContact O-N 3.3Å; H354-W358 PolarHBondContact O-N 3.02Å
355	A	78.1	Confident	68.8	Low	46 Å²	46	81 Å²	81	38%	0.38	50%	0.495	S	S	.	.	H	α-helix	trans	-55	-40.8	178.3	0	0	0	0	0	113.6	L351 C357 W358 G359	L351-A355 WeakPolarHBondContact O-CB 3.48Å; L351-A355 PolarHBondContact O-N 3.29Å; A355-C357 VanDerWaalsContact C-N 3.31Å; A355-C357 PolarHBondContact O-N 3.42Å; A355-W358 PolarHBondContact O-N 3.35Å; A355-G359 PolarHBondContact O-N 3.17Å
356	P	70.3	Confident	66.4	Low	81 Å²	81	80.1 Å²	80.1	53%	0.526	50%	0.503	S	S	.	.	H	α-helix	trans	-60.7	-39.1	174.7	-23.1	33.7	0	0	0	112.7	R352 H354 W358 G359 T360	R352-P356 WeakPolarHBondContact O-CD 3.17Å; H354-P356 VanDerWaalsContact C-CD 3.46Å; H354-P356 VanDerWaalsContact C-N 3.35Å; P356-W358 PolarHBondContact O-N 3.39Å; P356-G359 PolarHBondContact O-N 3.29Å; P356-G359 VanDerWaalsContact O-N 3.17Å; P356-T360 PolarHBondContact O-N 3.18Å
357	C	61.7	Low	64.4	Low	55 Å²	55	86.5 Å²	86.5	37%	0.372	52%	0.521	S	S	.	.	H	α-helix	trans	-71.1	-15.5	179	-59	0	0	0	0	113.7	H354 A355	H354-C357 WeakPolarHBondContact O-CB 3.41Å; H354-C357 PolarHBondContact O-N 3.3Å; A355-C357 VanDerWaalsContact C-N 3.31Å; A355-C357 PolarHBondContact O-N 3.42Å
358	W	58.8	Low	61.9	Low	116 Å²	116	95.3 Å²	95.3	44%	0.439	56%	0.563	S	S	.	*	H	α-helix	trans	-86.7	-18.7	173.3	-68.8	-22.2	0	0	0	112.7	I42 L45 L46 L351 H354 A355 P356	I42-W358 HydrophobicContact CB-CH2 4.17Å; I42-W358 HydrophobicContact CB-CZ3 4.46Å; I42-W358 HydrophobicContact CD1-CZ3 4.46Å; I42-W358 HydrophobicContact CG1-CH2 4.11Å; I42-W358 HydrophobicContact CG1-CZ3 4.08Å; I42-W358 HydrophobicContact CG2-CH2 3.57Å; I42-W358 HydrophobicContact CG2-CZ3 3.76Å; L45-W358 HydrophobicContact CB-CZ2 4.44Å; L46-W358 HydrophobicContact CD2-CH2 4.17Å; L46-W358 HydrophobicContact CD2-CZ2 4.45Å; L46-W358 HydrophobicContact CG-CH2 4.26Å; L351-W358 HydrophobicContact CD1-CH2 4.14Å; L351-W358 HydrophobicContact CD1-CZ3 3.63Å; H354-W358 PolarHBondContact O-N 3.02Å; A355-W358 PolarHBondContact O-N 3.35Å; P356-W358 PolarHBondContact O-N 3.39Å
359	G	51.9	Low	59.8	Low	64 Å²	64	97.2 Å²	97.2	66%	0.66	58%	0.582	S	S	*	*	H	α-helix	trans	-94.6	-31.3	179.6	0	0	0	0	0	114.5	A355 P356	A355-G359 PolarHBondContact O-N 3.17Å; P356-G359 PolarHBondContact O-N 3.29Å; P356-G359 VanDerWaalsContact O-N 3.17Å
360	T	40	Very low	57.9	Low	100 Å²	100	99.6 Å²	99.6	61%	0.613	59%	0.589	S	S	*	*			trans	-147.7	140.2	-178.9	53.2	0	0	0	0	110.6	P356 G362	P356-T360 PolarHBondContact O-N 3.18Å; T360-G362 PolarHBondContact O-N 3.12Å
361	G	40.9	Very low	55.6	Low	97 Å²	97	104.2 Å²	104.2	100%	1	62%	0.62	S	S	*	*			trans	-68.5	41.7	174.4	0	0	0	0	0	114.1
362	G	33	Very low	53.3	Low	45 Å²	45	107.7 Å²	107.7	46%	0.464	64%	0.642	S	S	.	*	P	Polyproline II helix	trans	-90.8	131.6	178.9	0	0	0	0	0	111.9	T360	T360-G362 PolarHBondContact O-N 3.12Å
363	A	39.6	Very low	51.4	Low	93 Å²	93	110 Å²	110	77%	0.769	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-48.9	147.4	-177.7	0	0	0	0	0	114	A365	A363-A365 PolarHBondContact O-N 3.12Å
364	P	41.6	Very low	49.6	Very low	113 Å²	113	111.2 Å²	111.2	73%	0.734	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-63.2	130.4	-179.2	24.5	-31.4	0	0	0	111.1
365	A	42.1	Very low	47.9	Very low	90 Å²	90	115.9 Å²	115.9	74%	0.744	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-56.8	134.5	170.3	0	0	0	0	0	109.9	A363 R367	A363-A365 PolarHBondContact O-N 3.12Å; A365-R367 PolarHBondContact O-N 3.13Å
366	P	39.7	Very low	46.2	Very low	124 Å²	124	119.8 Å²	119.8	81%	0.805	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-64.6	132.9	-175.8	25	-32	0	0	0	110.4	E368	P366-E368 PolarHBondContact O-N 2.84Å
367	R	46.2	Very low	44.8	Very low	213 Å²	213	122.1 Å²	122.1	80%	0.804	73%	0.731	S	S	*	*			trans	-65	114.1	170.6	-73.8	-179.5	171.1	-174.5	-5.4	107.7	A365 P369	A365-R367 PolarHBondContact O-N 3.13Å; R367-P369 WeakPolarHBondContact O-CD 3.17Å
368	E	38.9	Very low	43.7	Very low	186 Å²	186	126.3 Å²	126.3	87%	0.869	75%	0.753	S	S	*	*			trans	-53.9	120.7	167.4	-82.9	177.6	153.7	0	0	108.9	P366 Y370	P366-E368 PolarHBondContact O-N 2.84Å; E368-Y370 PolarHBondContact O-N 3.25Å
369	P	46.4	Very low	42.7	Very low	110 Å²	110	126.9 Å²	126.9	71%	0.714	77%	0.774	S	S	*	*			trans	-68.3	128.7	173.6	27.3	-29.6	0	0	0	108	R367 C371	R367-P369 WeakPolarHBondContact O-CD 3.17Å; P369-C371 PolarHBondContact O-N 3.18Å
370	Y	50.5	Low	42.1	Very low	198 Å²	198	131.4 Å²	131.4	78%	0.776	78%	0.782	S	S	*	*			trans	-47	110.4	166.9	46.6	-82.5	0	0	0	108.9	E368 V372	E368-Y370 PolarHBondContact O-N 3.25Å; Y370-V372 HydrophobicContact CD2-CG2 3.73Å; Y370-V372 HydrophobicContact CE2-CG2 4.21Å; Y370-V372 PolarHBondContact O-N 3.04Å; Y370-V372 VanDerWaalsContact O-N 3.1Å
371	C	42.2	Very low	42.2	Very low	110 Å²	110	133.8 Å²	133.8	74%	0.743	80%	0.795	S	S	*	*			trans	-72.9	102.1	168.5	-157.3	0	0	0	0	106.4	P369 M373	P369-C371 PolarHBondContact O-N 3.18Å; C371-M373 PolarHBondContact O-N 3.17Å
372	V	39.5	Very low	42.3	Very low	119 Å²	119	136.9 Å²	136.9	72%	0.721	78%	0.778	S	S	*	*			trans	-76.5	107.7	163.3	-171	0	0	0	0	105.5	Y370	Y370-V372 HydrophobicContact CD2-CG2 3.73Å; Y370-V372 HydrophobicContact CE2-CG2 4.21Å; Y370-V372 PolarHBondContact O-N 3.04Å; Y370-V372 VanDerWaalsContact O-N 3.1Å
373	M	48.3	Very low	43.2	Very low	242 Å²	242	145.3 Å²	145.3	100%	1.192	81%	0.807	S	S	*	*			trans	-99.3	0	154.1	-75	-160	-158.5	0	0	108.9	C371	C371-M373 PolarHBondContact O-N 3.17Å

Retrieved 373 of 373 residues in 69.5 ms (Link to these results)

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