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Muscarinic acetylcholine receptor

The muscarinic acetylcholine receptor mediates various cellular responses, including inhibition of adenylate cyclase, breakdown of phosphoinositides and modulation of potassium channels through the action of G proteins. Primary transducing effect is Pi turnover.

AlphaFold DB , UniProt , Accession A0A096NB06, Species PAPAN (Papio anubis, Olive baboon), Gene CHRM1, Length 460 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	43.4	Very low	42	Very low	238 Å²	238	128.8 Å²	128.8	100%	1.172	81%	0.813	S	S	*	*				0	133.6	0	-70.3	165.4	170.7	0	0	107.8
2	N	36.2	Very low	41.6	Very low	167 Å²	167	130.8 Å²	130.8	89%	0.893	81%	0.813	S	S	*	*			trans	-161.8	92.7	161.7	-111.1	-5.1	0	0	0	107.6	S4	N2-S4 PolarHBondContact O-N 3.04Å
3	T	43.2	Very low	42.1	Very low	142 Å²	142	130 Å²	130	87%	0.871	80%	0.798	S	S	*	*			trans	-85.5	86.3	-177.4	45.4	0	0	0	0	110.1	A5	T3-A5 PolarHBondContact O-N 3.17Å; T3-A5 VanDerWaalsContact O-N 3.12Å
4	S	46.2	Very low	42.5	Very low	117 Å²	117	128.4 Å²	128.4	82%	0.818	79%	0.789	S	S	*	*			trans	-64.9	106.6	164.6	53.4	0	0	0	0	109	N2	N2-S4 PolarHBondContact O-N 3.04Å
5	A	43	Very low	43.3	Very low	84 Å²	84	125.1 Å²	125.1	69%	0.694	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-61.2	145.2	174.7	0	0	0	0	0	110.5	T3	T3-A5 PolarHBondContact O-N 3.17Å; T3-A5 VanDerWaalsContact O-N 3.12Å
6	P	47.3	Very low	44.4	Very low	117 Å²	117	120.9 Å²	120.9	76%	0.76	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-62.2	144	171.8	28	-34.3	0	0	0	110	A8	P6-A8 PolarHBondContact O-N 3.21Å
7	P	41.6	Very low	45.7	Very low	120 Å²	120	114.1 Å²	114.1	78%	0.779	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-61.9	137.5	179.7	26.1	-34.1	0	0	0	110.8	V9	P7-V9 PolarHBondContact O-N 3.4Å
8	A	38.3	Very low	46.5	Very low	96 Å²	96	114.6 Å²	114.6	79%	0.793	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-63	125.7	-177.8	0	0	0	0	0	111.2	P6 S10	P6-A8 PolarHBondContact O-N 3.21Å; A8-S10 PolarHBondContact O-N 3.39Å
9	V	42	Very low	47.6	Very low	133 Å²	133	112.8 Å²	112.8	81%	0.806	71%	0.711	S	S	*	*			trans	-70	113.5	177.5	179.2	0	0	0	0	109.4	P7	P7-V9 PolarHBondContact O-N 3.4Å
10	S	35.3	Very low	49.2	Very low	80 Å²	80	109.6 Å²	109.6	56%	0.559	69%	0.686	S	S	*	*			trans	-65	128.2	175	-61.6	0	0	0	0	110.9	A8 N12	A8-S10 PolarHBondContact O-N 3.39Å; S10-N12 PolarHBondContact O-N 2.77Å; S10-N12 VanDerWaalsContact O-N 3.09Å
11	P	45.4	Very low	51	Low	123 Å²	123	104.9 Å²	104.9	80%	0.799	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-5.3	-171.4	29.1	-36.6	0	0	0	114.9
12	N	37.1	Very low	53.1	Low	152 Å²	152	97.5 Å²	97.5	81%	0.813	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	23	-172.3	-69.2	-4.9	0	0	0	114.1	S10 T14	S10-N12 PolarHBondContact O-N 2.77Å; S10-N12 VanDerWaalsContact O-N 3.09Å; N12-T14 PolarHBondContact O-N 3.4Å
13	I	48	Very low	55.7	Low	121 Å²	121	98.2 Å²	98.2	62%	0.621	62%	0.618	S	S	*	*			trans	-86.3	101.8	166.4	-58.5	179.5	0	0	0	107.8	V15	I13-V15 PolarHBondContact O-N 3.31Å; I13-V15 VanDerWaalsContact O-N 3.12Å
14	T	47.8	Very low	57.9	Low	108 Å²	108	95.7 Å²	95.7	66%	0.663	60%	0.597	S	S	*	*			trans	-59.9	114.3	162	45.2	0	0	0	0	108.3	N12 L16	N12-T14 PolarHBondContact O-N 3.4Å; T14-L16 VanDerWaalsContact C-N 3.25Å; T14-L16 PolarHBondContact O-N 3.47Å
15	V	55	Low	60	Low	79 Å²	79	91 Å²	91	48%	0.479	56%	0.563	S	S	.	*			trans	-71.9	81.5	-178.3	-175.4	0	0	0	0	109.7	I13 M88 H90	I13-V15 PolarHBondContact O-N 3.31Å; I13-V15 VanDerWaalsContact O-N 3.12Å; V15-M88 HydrophobicContact CG1-CB 4.31Å; V15-M88 HydrophobicContact CG1-CG 4.33Å; V15-H90 VanDerWaalsContact CG1-NE2 3.3Å; V15-H90 WeakPolarHBondContact CG1-NE2 3.15Å
16	L	60.9	Low	62.4	Low	58 Å²	58	89.3 Å²	89.3	30%	0.304	55%	0.549	S	S	.	.			trans	-118.8	142.4	179.3	-60.5	-177.6	0	0	0	109.1	T14 V25 L87	T14-L16 VanDerWaalsContact C-N 3.25Å; T14-L16 PolarHBondContact O-N 3.47Å; L16-V25 HydrophobicContact CB-CG2 4.39Å; L16-V25 HydrophobicContact CD1-CG2 4.28Å; L16-V25 HydrophobicContact CD2-CB 4.45Å; L16-V25 HydrophobicContact CD2-CG1 3.61Å; L16-V25 HydrophobicContact CD2-CG2 4.18Å; L16-L87 CarbonylContact C-O 3.59Å; L16-L87 WeakPolarHBondContact CA-O 3.49Å
17	A	65.4	Low	64.7	Low	5 Å²	5	90.5 Å²	90.5	4%	0.041	54%	0.543	C	S	.	.			trans	-53.5	126.3	-179.2	0	0	0	0	0	111.1	G19 K20 L87 M88	A17-G19 PolarHBondContact O-N 2.9Å; A17-K20 HydrophobicContact CB-CB 4.44Å; A17-K20 HydrophobicContact CB-CD 3.87Å; A17-K20 HydrophobicContact CB-CG 4.1Å; A17-K20 PolarHBondContact O-N 3.05Å; A17-L87 PolarHBondContact N-O 3.43Å; A17-M88 PolarHBondContact N-O 2.97Å
18	P	61	Low	67.2	Low	122 Å²	122	86.9 Å²	86.9	79%	0.792	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	130.8	-174.5	22.3	-32.9	0	0	0	111
19	G	67.4	Low	69.9	Low	82 Å²	82	83.4 Å²	83.4	85%	0.845	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	88	-11.2	-176.3	0	0	0	0	0	115.9	A17	A17-G19 PolarHBondContact O-N 2.9Å
20	K	79	Confident	72.5	Confident	48 Å²	48	82.2 Å²	82.2	21%	0.209	48%	0.478	C	S	.	.			trans	-91.5	115.4	173.4	-56.8	-170.3	-167.5	176.8	0	110	A17 V25 I28 L86 E401	A17-K20 HydrophobicContact CB-CB 4.44Å; A17-K20 HydrophobicContact CB-CD 3.87Å; A17-K20 HydrophobicContact CB-CG 4.1Å; A17-K20 PolarHBondContact O-N 3.05Å; K20-V25 HydrophobicContact CB-CG2 4.01Å; K20-I28 HydrophobicContact CD-CD1 4.29Å; K20-L86 PolarHBondContact NZ-O 2.98Å; K20-E401 IonicContact NZ-OE1 2.91Å; K20-E401 PolarHBondContact NZ-OE1 3.11Å; K20-E401 IonicContact NZ-OE2 2.66Å; K20-E401 PolarHBondContact NZ-OE2 3.37Å
21	G	87	Confident	75.4	Confident	11 Å²	11	81.6 Å²	81.6	11%	0.113	47%	0.471	C	S	.	.			trans	-69.4	151.4	177.7	0	0	0	0	0	112.5	W23 Q24 V25	G21-W23 PolarHBondContact O-N 3.4Å; G21-Q24 WeakPolarHBondContact O-CA 3.36Å; G21-Q24 WeakPolarHBondContact O-CB 3.49Å; G21-Q24 PolarHBondContact O-N 3.16Å; G21-V25 PolarHBondContact O-N 3.4Å
22	P	88.1	Confident	77.8	Confident	83 Å²	83	76.3 Å²	76.3	54%	0.539	44%	0.436	S	S	.	.	H	α-helix	trans	-55.3	-29.6	-174.7	14.3	-28.9	0	0	0	115.2	A26	P22-A26 WeakPolarHBondContact O-CB 3.33Å; P22-A26 PolarHBondContact O-N 3.21Å
23	W	90.8	Very high	80.7	Confident	181 Å²	181	70.5 Å²	70.5	69%	0.686	41%	0.413	S	S	*	.	H	α-helix	trans	-71.7	-33.9	173.3	57.7	99.2	0	0	0	113	G21 F27	G21-W23 PolarHBondContact O-N 3.4Å; W23-F27 VanDerWaalsContact O-CB 3.25Å; W23-F27 WeakPolarHBondContact O-CB 3.38Å; W23-F27 PolarHBondContact O-N 3.14Å
24	Q	89.8	Confident	83.1	Confident	90 Å²	90	70 Å²	70	42%	0.421	41%	0.41	S	S	.	.	H	α-helix	trans	-70.2	-43.3	173	-63.6	171.3	-52.4	0	0	110.6	G21 F27 I28	G21-Q24 WeakPolarHBondContact O-CA 3.36Å; G21-Q24 WeakPolarHBondContact O-CB 3.49Å; G21-Q24 PolarHBondContact O-N 3.16Å; Q24-F27 PolarHBondContact O-N 3.3Å; Q24-I28 WeakPolarHBondContact O-CB 3.17Å; Q24-I28 VanDerWaalsContact O-CG1 3.25Å; Q24-I28 WeakPolarHBondContact O-CG1 3.37Å; Q24-I28 PolarHBondContact O-N 3Å
25	V	90.7	Very high	85.5	Confident	17 Å²	17	67 Å²	67	10%	0.103	39%	0.39	C	S	.	.	H	α-helix	trans	-56.8	-50.5	173.7	171.2	0	0	0	0	110.5	L16 K20 G21 F27 I28 G29 L87	L16-V25 HydrophobicContact CB-CG2 4.39Å; L16-V25 HydrophobicContact CD1-CG2 4.28Å; L16-V25 HydrophobicContact CD2-CB 4.45Å; L16-V25 HydrophobicContact CD2-CG1 3.61Å; L16-V25 HydrophobicContact CD2-CG2 4.18Å; K20-V25 HydrophobicContact CB-CG2 4.01Å; G21-V25 PolarHBondContact O-N 3.4Å; V25-F27 PolarHBondContact O-N 2.92Å; V25-I28 PolarHBondContact O-N 3.36Å; V25-G29 PolarHBondContact O-N 3.36Å; V25-L87 HydrophobicContact CB-CD2 4.44Å; V25-L87 HydrophobicContact CG1-CD2 3.92Å; V25-L87 WeakPolarHBondContact O-CD2 3.2Å
26	A	93.2	Very high	87.5	Confident	49 Å²	49	63.6 Å²	63.6	41%	0.405	37%	0.37	S	S	.	.	H	α-helix	trans	-61.4	-44.3	177.3	0	0	0	0	0	112.1	P22 G29 I30	P22-A26 WeakPolarHBondContact O-CB 3.33Å; P22-A26 PolarHBondContact O-N 3.21Å; A26-G29 PolarHBondContact O-N 3.43Å; A26-I30 WeakPolarHBondContact O-CB 3.29Å; A26-I30 WeakPolarHBondContact O-CD1 3.45Å; A26-I30 WeakPolarHBondContact O-CG1 3.47Å; A26-I30 PolarHBondContact O-N 3.07Å
27	F	94.6	Very high	89.3	Confident	143 Å²	143	65.8 Å²	65.8	63%	0.627	38%	0.381	S	S	*	.	H	α-helix	trans	-61.5	-45	177.8	177.9	-98.6	0	0	0	112.7	W23 Q24 V25 T31	W23-F27 VanDerWaalsContact O-CB 3.25Å; W23-F27 WeakPolarHBondContact O-CB 3.38Å; W23-F27 PolarHBondContact O-N 3.14Å; Q24-F27 PolarHBondContact O-N 3.3Å; V25-F27 PolarHBondContact O-N 2.92Å; F27-T31 VanDerWaalsContact O-CB 3.26Å; F27-T31 WeakPolarHBondContact O-CB 3.43Å; F27-T31 PolarHBondContact O-N 2.86Å; F27-T31 PolarHBondContact O-OG1 3.26Å
28	I	93.7	Very high	90.8	Very high	43 Å²	43	68 Å²	68	22%	0.221	40%	0.4	C	S	.	.	H	α-helix	trans	-60.5	-56.2	175.4	-67.8	164.2	0	0	0	109.6	K20 Q24 V25 I30 T31 T32 L87	K20-I28 HydrophobicContact CD-CD1 4.29Å; Q24-I28 WeakPolarHBondContact O-CB 3.17Å; Q24-I28 VanDerWaalsContact O-CG1 3.25Å; Q24-I28 WeakPolarHBondContact O-CG1 3.37Å; Q24-I28 PolarHBondContact O-N 3Å; V25-I28 PolarHBondContact O-N 3.36Å; I28-I30 VanDerWaalsContact C-N 3.33Å; I28-I30 PolarHBondContact O-N 2.89Å; I28-T31 PolarHBondContact O-N 3.24Å; I28-T31 VanDerWaalsContact O-N 3.1Å; I28-T32 HydrophobicContact CG2-CG2 4.19Å; I28-T32 WeakPolarHBondContact O-CG2 3.46Å; I28-T32 PolarHBondContact O-N 2.96Å; I28-T32 PolarHBondContact O-OG1 2.8Å; I28-T32 VanDerWaalsContact O-OG1 3.13Å; I28-L87 HydrophobicContact CB-CD2 3.94Å; I28-L87 HydrophobicContact CG2-CD2 3.77Å
29	G	95.5	Very high	92.6	Very high	23 Å²	23	62.2 Å²	62.2	24%	0.237	36%	0.362	C	S	.	.	H	α-helix	trans	-61	-36.6	-176.6	0	0	0	0	0	114.1	V25 A26 G33	V25-G29 PolarHBondContact O-N 3.36Å; A26-G29 PolarHBondContact O-N 3.43Å; G29-G33 PolarHBondContact O-N 2.94Å
30	I	96.4	Very high	94	Very high	108 Å²	108	59.8 Å²	59.8	55%	0.554	33%	0.331	S	S	*	.	H	α-helix	trans	-68.1	-45.1	174	-69.2	166.4	0	0	0	110.6	A26 I28 L34	A26-I30 WeakPolarHBondContact O-CB 3.29Å; A26-I30 WeakPolarHBondContact O-CD1 3.45Å; A26-I30 WeakPolarHBondContact O-CG1 3.47Å; A26-I30 PolarHBondContact O-N 3.07Å; I28-I30 VanDerWaalsContact C-N 3.33Å; I28-I30 PolarHBondContact O-N 2.89Å; I30-L34 HydrophobicContact CG2-CD1 3.87Å; I30-L34 HydrophobicContact CG2-CG 4.46Å; I30-L34 WeakPolarHBondContact O-CB 3.48Å; I30-L34 VanDerWaalsContact O-CG 3.24Å; I30-L34 WeakPolarHBondContact O-CG 3.44Å; I30-L34 PolarHBondContact O-N 3.02Å
31	T	96.7	Very high	94.8	Very high	68 Å²	68	60.5 Å²	60.5	42%	0.417	34%	0.339	S	S	.	.	H	α-helix	trans	-67.4	-45.6	-177	-58.6	0	0	0	0	111.7	F27 I28 L34 L35	F27-T31 VanDerWaalsContact O-CB 3.26Å; F27-T31 WeakPolarHBondContact O-CB 3.43Å; F27-T31 PolarHBondContact O-N 2.86Å; F27-T31 PolarHBondContact O-OG1 3.26Å; I28-T31 PolarHBondContact O-N 3.24Å; I28-T31 VanDerWaalsContact O-N 3.1Å; T31-L34 PolarHBondContact O-N 3.44Å; T31-L35 WeakPolarHBondContact O-CB 3.27Å; T31-L35 PolarHBondContact O-N 3.13Å
32	T	96.7	Very high	95.3	Very high	11 Å²	11	60.6 Å²	60.6	7%	0.067	34%	0.34	C	S	.	.	H	α-helix	trans	-70.4	-37.6	177.7	62.8	0	0	0	0	111.7	I28 L35 S36 T83 W405	I28-T32 HydrophobicContact CG2-CG2 4.19Å; I28-T32 WeakPolarHBondContact O-CG2 3.46Å; I28-T32 PolarHBondContact O-N 2.96Å; I28-T32 PolarHBondContact O-OG1 2.8Å; I28-T32 VanDerWaalsContact O-OG1 3.13Å; T32-L35 PolarHBondContact O-N 3.42Å; T32-S36 WeakPolarHBondContact O-CB 3.39Å; T32-S36 PolarHBondContact O-N 2.83Å; T32-T83 VanDerWaalsContact CB-OG1 3.28Å; T32-T83 WeakPolarHBondContact CB-OG1 3.46Å; T32-T83 WeakPolarHBondContact OG1-CG2 3.28Å; T32-T83 PolarHBondContact OG1-OG1 2.75Å; T32-W405 HydrophobicContact CG2-CD2 4.15Å; T32-W405 HydrophobicContact CG2-CE3 4.43Å; T32-W405 HydrophobicContact CG2-CH2 3.68Å; T32-W405 HydrophobicContact CG2-CZ2 3.34Å; T32-W405 HydrophobicContact CG2-CZ3 4.22Å
33	G	97.4	Very high	95.7	Very high	31 Å²	31	56.6 Å²	56.6	32%	0.32	31%	0.314	S	S	.	.	H	α-helix	trans	-62.6	-41	173.8	0	0	0	0	0	113.2	G29 L37	G29-G33 PolarHBondContact O-N 2.94Å; G33-L37 WeakPolarHBondContact O-CB 3.33Å; G33-L37 PolarHBondContact O-N 3.23Å
34	L	97.9	Very high	96	Very high	110 Å²	110	51.5 Å²	51.5	58%	0.576	30%	0.3	S	S	*	.	H	α-helix	trans	-67.2	-39	173.8	-73.4	171	0	0	0	112.2	I30 T31 L37 A38	I30-L34 HydrophobicContact CG2-CD1 3.87Å; I30-L34 HydrophobicContact CG2-CG 4.46Å; I30-L34 WeakPolarHBondContact O-CB 3.48Å; I30-L34 VanDerWaalsContact O-CG 3.24Å; I30-L34 WeakPolarHBondContact O-CG 3.44Å; I30-L34 PolarHBondContact O-N 3.02Å; T31-L34 PolarHBondContact O-N 3.44Å; L34-L37 PolarHBondContact O-N 2.89Å; L34-A38 WeakPolarHBondContact O-CB 3.43Å; L34-A38 PolarHBondContact O-N 3.21Å
35	L	97.6	Very high	96.2	Very high	44 Å²	44	48.4 Å²	48.4	23%	0.23	29%	0.286	C	S	.	.	H	α-helix	trans	-66.6	-42	176.5	-174	70.4	0	0	0	111.9	T31 T32 A38 T39 W405 V409 T412	T31-L35 WeakPolarHBondContact O-CB 3.27Å; T31-L35 PolarHBondContact O-N 3.13Å; T32-L35 PolarHBondContact O-N 3.42Å; L35-A38 PolarHBondContact O-N 2.73Å; L35-T39 WeakPolarHBondContact O-CB 3.33Å; L35-T39 PolarHBondContact O-N 3.01Å; L35-T39 PolarHBondContact O-OG1 3.27Å; L35-W405 HydrophobicContact CD2-CE3 3.76Å; L35-W405 HydrophobicContact CD2-CZ3 3.8Å; L35-V409 HydrophobicContact CD1-CG2 4.29Å; L35-V409 HydrophobicContact CD2-CG2 3.66Å; L35-T412 HydrophobicContact CD1-CG2 3.81Å
36	S	98.1	Very high	96.4	Very high	9 Å²	9	47.6 Å²	47.6	6%	0.063	28%	0.282	C	S	.	.	H	α-helix	trans	-57.3	-53.6	171.6	169	0	0	0	0	111.2	T32 A38 T39 V40 G75 N80	T32-S36 WeakPolarHBondContact O-CB 3.39Å; T32-S36 PolarHBondContact O-N 2.83Å; S36-A38 VanDerWaalsContact C-N 3.33Å; S36-A38 PolarHBondContact O-N 3.41Å; S36-T39 WeakPolarHBondContact O-CB 3.48Å; S36-T39 PolarHBondContact O-N 3.4Å; S36-T39 VanDerWaalsContact O-N 3.1Å; S36-V40 WeakPolarHBondContact O-CG2 3.46Å; S36-V40 PolarHBondContact O-N 3.42Å; S36-G75 PolarHBondContact OG-O 3Å; S36-G75 VanDerWaalsContact OG-O 3.11Å; S36-N80 VanDerWaalsContact CB-OD1 3.31Å; S36-N80 WeakPolarHBondContact CB-OD1 3.46Å; S36-N80 PolarHBondContact OG-ND2 3.35Å; S36-N80 VanDerWaalsContact OG-ND2 3.15Å; S36-N80 PolarHBondContact OG-OD1 3.33Å
37	L	97.9	Very high	96.5	Very high	104 Å²	104	46.8 Å²	46.8	55%	0.545	27%	0.27	S	S	.	.	H	α-helix	trans	-58.4	-41.6	176.5	179.5	61.8	0	0	0	112.7	G33 L34 T41	G33-L37 WeakPolarHBondContact O-CB 3.33Å; G33-L37 PolarHBondContact O-N 3.23Å; L34-L37 PolarHBondContact O-N 2.89Å; L37-T41 WeakPolarHBondContact O-CB 3.38Å; L37-T41 PolarHBondContact O-N 2.98Å; L37-T41 PolarHBondContact O-OG1 3.04Å
38	A	97.5	Very high	96.5	Very high	52 Å²	52	43.6 Å²	43.6	43%	0.43	26%	0.259	S	S	.	.	H	α-helix	trans	-64.4	-40.2	176.1	0	0	0	0	0	112.2	L34 L35 S36 G42 T412	L34-A38 WeakPolarHBondContact O-CB 3.43Å; L34-A38 PolarHBondContact O-N 3.21Å; L35-A38 PolarHBondContact O-N 2.73Å; S36-A38 VanDerWaalsContact C-N 3.33Å; S36-A38 PolarHBondContact O-N 3.41Å; A38-G42 PolarHBondContact O-N 3.33Å; A38-T412 HydrophobicContact CB-CG2 4.19Å
39	T	97.7	Very high	96.4	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-66	-48.2	178.3	-56.7	0	0	0	0	111.7	L35 S36 N43 M79 T412	L35-T39 WeakPolarHBondContact O-CB 3.33Å; L35-T39 PolarHBondContact O-N 3.01Å; L35-T39 PolarHBondContact O-OG1 3.27Å; S36-T39 WeakPolarHBondContact O-CB 3.48Å; S36-T39 PolarHBondContact O-N 3.4Å; S36-T39 VanDerWaalsContact O-N 3.1Å; T39-N43 WeakPolarHBondContact O-CB 3.46Å; T39-N43 PolarHBondContact O-N 3.07Å; T39-N43 PolarHBondContact O-ND2 2.87Å; T39-M79 HydrophobicContact CG2-CE 3.96Å; T39-M79 HydrophobicContact CG2-SD 4.33Å; T39-M79 WeakPolarHBondContact OG1-CE 3.49Å; T39-T412 WeakPolarHBondContact OG1-CB 3.21Å; T39-T412 WeakPolarHBondContact OG1-CG2 3.21Å; T39-T412 PolarHBondContact OG1-OG1 2.94Å
40	V	98.1	Very high	96.3	Very high	31 Å²	31	41.1 Å²	41.1	19%	0.188	24%	0.24	C	C	.	.	H	α-helix	trans	-60.9	-50.8	175.9	170.8	0	0	0	0	110.3	S36 G42 N43 L44 L72	S36-V40 WeakPolarHBondContact O-CG2 3.46Å; S36-V40 PolarHBondContact O-N 3.42Å; V40-G42 PolarHBondContact O-N 2.95Å; V40-N43 PolarHBondContact O-N 3.11Å; V40-L44 HydrophobicContact CG1-CD1 3.72Å; V40-L44 HydrophobicContact CG1-CG 4.36Å; V40-L44 VanDerWaalsContact O-CB 3.31Å; V40-L44 WeakPolarHBondContact O-CB 3.44Å; V40-L44 VanDerWaalsContact O-CG 3.23Å; V40-L44 WeakPolarHBondContact O-CG 3.13Å; V40-L44 PolarHBondContact O-N 3.15Å; V40-L72 HydrophobicContact CB-CD1 4.22Å; V40-L72 HydrophobicContact CG1-CD1 3.94Å; V40-L72 HydrophobicContact CG2-CD1 4.22Å
41	T	96.5	Very high	96	Very high	62 Å²	62	43.2 Å²	43.2	38%	0.38	25%	0.245	S	C	.	.	H	α-helix	trans	-61.6	-46.1	-179.7	-57.6	0	0	0	0	111.9	L37 L45	L37-T41 WeakPolarHBondContact O-CB 3.38Å; L37-T41 PolarHBondContact O-N 2.98Å; L37-T41 PolarHBondContact O-OG1 3.04Å; T41-L45 HydrophobicContact CG2-CD1 4.16Å; T41-L45 WeakPolarHBondContact O-CB 3.31Å; T41-L45 VanDerWaalsContact O-CG 3.3Å; T41-L45 WeakPolarHBondContact O-CG 3.29Å; T41-L45 PolarHBondContact O-N 2.85Å
42	G	96.3	Very high	95.6	Very high	13 Å²	13	41.9 Å²	41.9	13%	0.134	24%	0.237	C	C	.	.	H	α-helix	trans	-61.3	-46.4	180	0	0	0	0	0	112.5	A38 V40 L45 V46 P415	A38-G42 PolarHBondContact O-N 3.33Å; V40-G42 PolarHBondContact O-N 2.95Å; G42-L45 WeakPolarHBondContact O-CB 3.47Å; G42-L45 PolarHBondContact O-N 3.32Å; G42-V46 PolarHBondContact O-N 3.02Å; G42-P415 VanDerWaalsContact C-CG 3.43Å
43	N	96.9	Very high	95.1	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-74	-37.9	-179.4	-74.1	-65.8	0	0	0	112.5	T39 V40 L45 V46 L47 A68 D71 L72 S411 P415	T39-N43 WeakPolarHBondContact O-CB 3.46Å; T39-N43 PolarHBondContact O-N 3.07Å; T39-N43 PolarHBondContact O-ND2 2.87Å; V40-N43 PolarHBondContact O-N 3.11Å; N43-L45 VanDerWaalsContact C-N 3.28Å; N43-L45 PolarHBondContact O-N 2.92Å; N43-V46 WeakPolarHBondContact O-CA 3.45Å; N43-V46 WeakPolarHBondContact O-CB 3.24Å; N43-V46 PolarHBondContact O-N 2.96Å; N43-L47 WeakPolarHBondContact O-CG 3.42Å; N43-L47 PolarHBondContact O-N 3.3Å; N43-A68 HydrophobicContact CB-CB 4.31Å; N43-A68 WeakPolarHBondContact OD1-CA 3.41Å; N43-D71 WeakPolarHBondContact ND2-CB 3.38Å; N43-L72 HydrophobicContact CB-CB 4.21Å; N43-S411 PolarHBondContact ND2-O 2.98Å; N43-P415 HydrophobicContact CB-CG 4.45Å; N43-P415 WeakPolarHBondContact OD1-CG 3.25Å
44	L	96.7	Very high	94.6	Very high	73 Å²	73	44.8 Å²	44.8	38%	0.382	25%	0.248	S	C	.	.	H	α-helix	trans	-57	-40.7	169.4	-73.7	173.9	0	0	0	111.9	V40 V46 L47 I48 L72	V40-L44 HydrophobicContact CG1-CD1 3.72Å; V40-L44 HydrophobicContact CG1-CG 4.36Å; V40-L44 VanDerWaalsContact O-CB 3.31Å; V40-L44 WeakPolarHBondContact O-CB 3.44Å; V40-L44 VanDerWaalsContact O-CG 3.23Å; V40-L44 WeakPolarHBondContact O-CG 3.13Å; V40-L44 PolarHBondContact O-N 3.15Å; L44-V46 VanDerWaalsContact C-N 3.3Å; L44-V46 PolarHBondContact O-N 2.98Å; L44-L47 PolarHBondContact O-N 2.77Å; L44-I48 WeakPolarHBondContact O-CB 3.39Å; L44-I48 VanDerWaalsContact O-CG1 3.22Å; L44-I48 WeakPolarHBondContact O-CG1 3.32Å; L44-I48 PolarHBondContact O-N 2.81Å; L44-L72 HydrophobicContact CD2-CD1 4.33Å; L44-L72 HydrophobicContact CD2-CD2 3.87Å; L44-L72 HydrophobicContact CG-CD1 4.07Å; L44-L72 HydrophobicContact CG-CD2 4.45Å
45	L	95	Very high	94	Very high	25 Å²	25	43.3 Å²	43.3	13%	0.131	24%	0.239	C	C	.	.	H	α-helix	trans	-62.6	-33.1	174.5	-75.3	167.5	0	0	0	112.8	T41 G42 N43 S49 F429 L432 L433	T41-L45 HydrophobicContact CG2-CD1 4.16Å; T41-L45 WeakPolarHBondContact O-CB 3.31Å; T41-L45 VanDerWaalsContact O-CG 3.3Å; T41-L45 WeakPolarHBondContact O-CG 3.29Å; T41-L45 PolarHBondContact O-N 2.85Å; G42-L45 WeakPolarHBondContact O-CB 3.47Å; G42-L45 PolarHBondContact O-N 3.32Å; N43-L45 VanDerWaalsContact C-N 3.28Å; N43-L45 PolarHBondContact O-N 2.92Å; L45-S49 WeakPolarHBondContact O-CB 3.3Å; L45-S49 PolarHBondContact O-N 3.46Å; L45-S49 PolarHBondContact O-OG 2.9Å; L45-F429 HydrophobicContact CB-CD1 4.4Å; L45-F429 HydrophobicContact CB-CE1 4.08Å; L45-F429 HydrophobicContact CB-CZ 4.13Å; L45-L432 HydrophobicContact CD2-CB 3.99Å; L45-L432 HydrophobicContact CD2-CD1 4.12Å; L45-L433 HydrophobicContact CD1-CD2 3.95Å; L45-L433 HydrophobicContact CD1-CG 4.26Å
46	V	94.8	Very high	93.4	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.006	23%	0.228	C	C	.	.	H	α-helix	trans	-64.5	-51.2	171.5	179.7	0	0	0	0	110.6	G42 N43 L44 S49 F50 A68 P415 Y418 F425 F429	G42-V46 PolarHBondContact O-N 3.02Å; N43-V46 WeakPolarHBondContact O-CA 3.45Å; N43-V46 WeakPolarHBondContact O-CB 3.24Å; N43-V46 PolarHBondContact O-N 2.96Å; L44-V46 VanDerWaalsContact C-N 3.3Å; L44-V46 PolarHBondContact O-N 2.98Å; V46-S49 PolarHBondContact O-N 2.63Å; V46-F50 PolarHBondContact O-N 3.32Å; V46-A68 HydrophobicContact CB-CB 3.91Å; V46-A68 HydrophobicContact CG1-CB 3.78Å; V46-A68 HydrophobicContact CG2-CB 4.49Å; V46-P415 HydrophobicContact CG2-CB 4.23Å; V46-P415 HydrophobicContact CG2-CG 4.36Å; V46-Y418 HydrophobicContact CG1-CD2 4.36Å; V46-Y418 HydrophobicContact CG1-CE2 4.46Å; V46-Y418 HydrophobicContact CG2-CD2 3.68Å; V46-Y418 HydrophobicContact CG2-CE2 4.07Å; V46-F425 HydrophobicContact CG1-CE1 4.08Å; V46-F425 HydrophobicContact CG1-CZ 4.41Å; V46-F429 HydrophobicContact CG2-CE1 4.46Å; V46-F429 HydrophobicContact CG2-CZ 3.85Å
47	L	95.3	Very high	93	Very high	31 Å²	31	45.5 Å²	45.5	16%	0.162	25%	0.245	C	C	.	.	H	α-helix	trans	-60.2	-48.3	-179.1	-58.6	-174	0	0	0	111.4	N43 L44 F50 K51 L65 A68 L72	N43-L47 WeakPolarHBondContact O-CG 3.42Å; N43-L47 PolarHBondContact O-N 3.3Å; L44-L47 PolarHBondContact O-N 2.77Å; L47-F50 PolarHBondContact O-N 2.66Å; L47-K51 VanDerWaalsContact O-CG 3.26Å; L47-K51 WeakPolarHBondContact O-CG 3.42Å; L47-K51 PolarHBondContact O-N 3.35Å; L47-L65 HydrophobicContact CD2-CD1 3.49Å; L47-L65 VanDerWaalsContact CD2-CD1 3.49Å; L47-L65 HydrophobicContact CD2-CG 3.94Å; L47-A68 HydrophobicContact CD2-CB 3.96Å; L47-L72 HydrophobicContact CD1-CD2 3.83Å
48	I	94	Very high	92.5	Very high	77 Å²	77	43.1 Å²	43.1	40%	0.395	24%	0.235	S	C	.	.	H	α-helix	trans	-61.7	-48.4	177.7	-66.2	165.1	0	0	0	110.1	L44 F50 K51 V52 L432	L44-I48 WeakPolarHBondContact O-CB 3.39Å; L44-I48 VanDerWaalsContact O-CG1 3.22Å; L44-I48 WeakPolarHBondContact O-CG1 3.32Å; L44-I48 PolarHBondContact O-N 2.81Å; I48-F50 VanDerWaalsContact C-N 3.3Å; I48-F50 PolarHBondContact O-N 2.96Å; I48-K51 PolarHBondContact O-N 3.29Å; I48-K51 VanDerWaalsContact O-N 3.07Å; I48-V52 HydrophobicContact CG2-CG1 4.15Å; I48-V52 WeakPolarHBondContact O-CG2 3.49Å; I48-V52 PolarHBondContact O-N 3.42Å; I48-L432 HydrophobicContact CB-CD1 4.37Å; I48-L432 HydrophobicContact CG2-CD1 3.78Å; I48-L432 HydrophobicContact CG2-CD2 3.89Å
49	S	92.3	Very high	92	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-54.9	-45.2	178.9	-68.1	0	0	0	0	112.3	L45 V46 N53 T428 F429 L432	L45-S49 WeakPolarHBondContact O-CB 3.3Å; L45-S49 PolarHBondContact O-N 3.46Å; L45-S49 PolarHBondContact O-OG 2.9Å; V46-S49 PolarHBondContact O-N 2.63Å; S49-N53 WeakPolarHBondContact O-CB 3.33Å; S49-N53 PolarHBondContact O-N 2.88Å; S49-T428 WeakPolarHBondContact OG-CG2 3.47Å; S49-F429 VanDerWaalsContact OG-CD1 3.27Å; S49-F429 WeakPolarHBondContact OG-CD1 3.43Å; S49-F429 WeakPolarHBondContact OG-CE1 3.44Å; S49-L432 WeakPolarHBondContact OG-CD1 3.21Å
50	F	91.7	Very high	91.3	Very high	13 Å²	13	43.2 Å²	43.2	6%	0.057	23%	0.229	C	C	.	.	H	α-helix	trans	-66.3	-38.6	177.4	-176.6	-88.4	0	0	0	112.5	V46 L47 I48 L56 K57 N61 Y62 L65	V46-F50 PolarHBondContact O-N 3.32Å; L47-F50 PolarHBondContact O-N 2.66Å; I48-F50 VanDerWaalsContact C-N 3.3Å; I48-F50 PolarHBondContact O-N 2.96Å; F50-L56 WeakPolarHBondContact CD2-O 3.34Å; F50-L56 WeakPolarHBondContact CE2-O 3.46Å; F50-K57 HydrophobicContact CE1-CG 4.33Å; F50-K57 HydrophobicContact CE2-CG 4.45Å; F50-K57 HydrophobicContact CZ-CB 4.49Å; F50-K57 HydrophobicContact CZ-CG 4.24Å; F50-K57 WeakPolarHBondContact O-CE 3.5Å; F50-N61 HydrophobicContact CD2-CB 4.01Å; F50-N61 HydrophobicContact CE2-CB 3.88Å; F50-Y62 HydrophobicContact CE2-CD2 4.3Å; F50-Y62 HydrophobicContact CE2-CE2 4.39Å; F50-Y62 HydrophobicContact CZ-CD1 4.35Å; F50-Y62 AromaticContact CZ-CD2 3.9Å; F50-Y62 HydrophobicContact CZ-CD2 3.9Å; F50-Y62 HydrophobicContact CZ-CE1 4.15Å; F50-Y62 AromaticContact CZ-CE2 3.69Å; F50-Y62 HydrophobicContact CZ-CE2 3.69Å; F50-Y62 HydrophobicContact CZ-CG 4.24Å; F50-Y62 AromaticContact CZ-CZ 3.83Å; F50-L65 HydrophobicContact CB-CD1 3.73Å; F50-L65 HydrophobicContact CD1-CD1 3.79Å; F50-L65 HydrophobicContact CD1-CD2 3.98Å; F50-L65 HydrophobicContact CD1-CG 4.48Å; F50-L65 HydrophobicContact CE1-CD2 3.96Å; F50-L65 HydrophobicContact CG-CD1 3.77Å
51	K	90.8	Very high	90.9	Very high	153 Å²	153	42.1 Å²	42.1	67%	0.665	22%	0.222	S	C	*	.	H	α-helix	trans	-66.2	-44.3	176.7	-66.8	-83.5	-175.8	169	0	111.5	L47 I48 K57	L47-K51 VanDerWaalsContact O-CG 3.26Å; L47-K51 WeakPolarHBondContact O-CG 3.42Å; L47-K51 PolarHBondContact O-N 3.35Å; I48-K51 PolarHBondContact O-N 3.29Å; I48-K51 VanDerWaalsContact O-N 3.07Å; K51-K57 VanDerWaalsContact O-CE 3.3Å; K51-K57 WeakPolarHBondContact O-CE 3.32Å; K51-K57 PolarHBondContact O-NZ 3.02Å
52	V	88.8	Confident	90.7	Very high	39 Å²	39	42.6 Å²	42.6	24%	0.236	22%	0.217	C	C	.	.	H	α-helix	trans	-82.6	-40	-173.7	-56	0	0	0	0	114.5	I48 T428 L432 W437	I48-V52 HydrophobicContact CG2-CG1 4.15Å; I48-V52 WeakPolarHBondContact O-CG2 3.49Å; I48-V52 PolarHBondContact O-N 3.42Å; V52-T428 HydrophobicContact CG2-CG2 4.16Å; V52-L432 HydrophobicContact CG2-CD2 4.47Å; V52-W437 HydrophobicContact CB-CZ2 3.85Å; V52-W437 HydrophobicContact CG2-CD2 4.02Å; V52-W437 HydrophobicContact CG2-CE3 4.43Å; V52-W437 HydrophobicContact CG2-CH2 4.12Å; V52-W437 HydrophobicContact CG2-CZ2 3.64Å; V52-W437 HydrophobicContact CG2-CZ3 4.48Å
53	N	86.6	Confident	90.5	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.005	21%	0.211	C	C	.	.			trans	-96.1	110.4	-174.7	-171	-11.1	0	0	0	111.1	S49 E55 L56 T428 W437	S49-N53 WeakPolarHBondContact O-CB 3.33Å; S49-N53 PolarHBondContact O-N 2.88Å; N53-E55 PolarHBondContact O-N 3.18Å; N53-E55 WeakPolarHBondContact OD1-CB 3.45Å; N53-E55 PolarHBondContact OD1-N 3.49Å; N53-L56 HydrophobicContact CB-CD1 4.02Å; N53-L56 HydrophobicContact CB-CG 4.11Å; N53-L56 PolarHBondContact O-N 2.96Å; N53-L56 VanDerWaalsContact O-N 3.1Å; N53-T428 HydrophobicContact CB-CG2 4.23Å; N53-T428 PolarHBondContact ND2-OG1 2.67Å; N53-W437 HydrophobicContact CB-CH2 3.75Å; N53-W437 HydrophobicContact CB-CZ2 4.35Å
54	T	86.5	Confident	90.2	Very high	102 Å²	102	42.8 Å²	42.8	63%	0.626	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-66	-21.1	179.5	49.6	0	0	0	0	113.8	L56 K57	T54-L56 PolarHBondContact O-N 2.99Å; T54-K57 HydrophobicContact CG2-CD 4.48Å; T54-K57 PolarHBondContact O-N 3.2Å
55	E	85.2	Confident	90.1	Very high	80 Å²	80	40.8 Å²	40.8	37%	0.374	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-71.3	-20.3	174.5	-54.6	-166.4	139	0	0	112.7	N53 K447	N53-E55 PolarHBondContact O-N 3.18Å; N53-E55 WeakPolarHBondContact OD1-CB 3.45Å; N53-E55 PolarHBondContact OD1-N 3.49Å; E55-K447 WeakPolarHBondContact OE1-CD 3.3Å; E55-K447 WeakPolarHBondContact OE1-CE 3.42Å; E55-K447 IonicContact OE1-NZ 2.75Å; E55-K447 PolarHBondContact OE1-NZ 2.98Å
56	L	85.8	Confident	90.2	Very high	2 Å²	2	40 Å²	40	1%	0.01	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-85.4	-8.5	175.5	-63.7	179.3	0	0	0	112.8	F50 N53 T54 T58 N61 A424 F425	F50-L56 WeakPolarHBondContact CD2-O 3.34Å; F50-L56 WeakPolarHBondContact CE2-O 3.46Å; N53-L56 HydrophobicContact CB-CD1 4.02Å; N53-L56 HydrophobicContact CB-CG 4.11Å; N53-L56 PolarHBondContact O-N 2.96Å; N53-L56 VanDerWaalsContact O-N 3.1Å; T54-L56 PolarHBondContact O-N 2.99Å; L56-T58 PolarHBondContact O-N 3.02Å; L56-N61 WeakPolarHBondContact O-CB 3.36Å; L56-N61 PolarHBondContact O-ND2 2.93Å; L56-A424 HydrophobicContact CD2-CB 3.63Å; L56-F425 HydrophobicContact CD1-CD1 3.73Å; L56-F425 HydrophobicContact CD1-CE1 3.78Å; L56-F425 HydrophobicContact CD1-CG 4.15Å; L56-F425 HydrophobicContact CD1-CZ 4.23Å; L56-F425 HydrophobicContact CD2-CD2 3.93Å; L56-F425 HydrophobicContact CD2-CE2 4.03Å; L56-F425 HydrophobicContact CD2-CG 4.17Å; L56-F425 HydrophobicContact CD2-CZ 4.37Å
57	K	87.8	Confident	90.2	Very high	96 Å²	96	40 Å²	40	42%	0.417	20%	0.201	S	C	.	.			trans	-80.9	59.1	-178.9	-61.7	-176.5	-176.9	178	0	112	F50 K51 T54	F50-K57 HydrophobicContact CE1-CG 4.33Å; F50-K57 HydrophobicContact CE2-CG 4.45Å; F50-K57 HydrophobicContact CZ-CB 4.49Å; F50-K57 HydrophobicContact CZ-CG 4.24Å; F50-K57 WeakPolarHBondContact O-CE 3.5Å; K51-K57 VanDerWaalsContact O-CE 3.3Å; K51-K57 WeakPolarHBondContact O-CE 3.32Å; K51-K57 PolarHBondContact O-NZ 3.02Å; T54-K57 HydrophobicContact CG2-CD 4.48Å; T54-K57 PolarHBondContact O-N 3.2Å
58	T	88.4	Confident	90.2	Very high	54 Å²	54	38.5 Å²	38.5	33%	0.331	19%	0.193	S	C	.	.	S	Bend	trans	-110.5	151.6	176.8	72.2	0	0	0	0	110.3	L56 N60 N61	L56-T58 PolarHBondContact O-N 3.02Å; T58-N60 PolarHBondContact O-N 3.38Å; T58-N61 PolarHBondContact O-N 3.38Å; T58-N61 PolarHBondContact OG1-ND2 3.02Å
59	V	86.8	Confident	90.4	Very high	17 Å²	17	37.2 Å²	37.2	10%	0.103	19%	0.19	C	C	.	.	H	α-helix	trans	-55.6	-39.6	-176	-169.2	0	0	0	0	112.3	N61 Y62 R137 P139 A142	V59-N61 PolarHBondContact O-N 3.12Å; V59-Y62 PolarHBondContact O-N 3.44Å; V59-Y62 VanDerWaalsContact O-N 3.13Å; V59-R137 HydrophobicContact CB-CG 4.31Å; V59-R137 HydrophobicContact CG1-CG 3.88Å; V59-P139 HydrophobicContact CG2-CG 4.13Å; V59-A142 HydrophobicContact CG1-CB 3.44Å; V59-A142 VanDerWaalsContact CG1-CB 3.44Å
60	N	83.4	Confident	90.6	Very high	37 Å²	37	37.2 Å²	37.2	20%	0.198	19%	0.19	C	C	.	.	H	α-helix	trans	-43.5	-40.6	171.1	-70	-12.8	0	0	0	113.9	T58 R137	T58-N60 PolarHBondContact O-N 3.38Å; N60-R137 VanDerWaalsContact OD1-CZ 3.25Å; N60-R137 PolarHBondContact OD1-NH1 2.84Å; N60-R137 PolarHBondContact OD1-NH2 3.09Å
61	N	89.9	Confident	90.9	Very high	9 Å²	9	36.6 Å²	36.6	5%	0.048	19%	0.188	C	C	.	.	H	α-helix	trans	-93.6	-6.7	-167.6	-62.3	-8.1	0	0	0	112.3	F50 L56 T58 V59 L64 L65	F50-N61 HydrophobicContact CD2-CB 4.01Å; F50-N61 HydrophobicContact CE2-CB 3.88Å; L56-N61 WeakPolarHBondContact O-CB 3.36Å; L56-N61 PolarHBondContact O-ND2 2.93Å; T58-N61 PolarHBondContact O-N 3.38Å; T58-N61 PolarHBondContact OG1-ND2 3.02Å; V59-N61 PolarHBondContact O-N 3.12Å; N61-L64 PolarHBondContact O-N 2.92Å; N61-L65 WeakPolarHBondContact O-CB 3.34Å; N61-L65 PolarHBondContact O-N 2.62Å
62	Y	92.6	Very high	91.2	Very high	72 Å²	72	30.7 Å²	30.7	28%	0.282	16%	0.164	S	C	.	.	H	α-helix	trans	-68.5	-37.6	169.1	-81.5	-98.6	0	0	0	111.2	F50 V59 L65 S66 P139 I146	F50-Y62 HydrophobicContact CE2-CD2 4.3Å; F50-Y62 HydrophobicContact CE2-CE2 4.39Å; F50-Y62 HydrophobicContact CZ-CD1 4.35Å; F50-Y62 AromaticContact CZ-CD2 3.9Å; F50-Y62 HydrophobicContact CZ-CD2 3.9Å; F50-Y62 HydrophobicContact CZ-CE1 4.15Å; F50-Y62 AromaticContact CZ-CE2 3.69Å; F50-Y62 HydrophobicContact CZ-CE2 3.69Å; F50-Y62 HydrophobicContact CZ-CG 4.24Å; F50-Y62 AromaticContact CZ-CZ 3.83Å; V59-Y62 PolarHBondContact O-N 3.44Å; V59-Y62 VanDerWaalsContact O-N 3.13Å; Y62-L65 WeakPolarHBondContact O-CB 3.31Å; Y62-L65 PolarHBondContact O-N 2.98Å; Y62-S66 PolarHBondContact O-N 3.47Å; Y62-P139 HydrophobicContact CE2-CB 4.19Å; Y62-I146 WeakPolarHBondContact O-CD1 3.32Å
63	F	91.9	Very high	91.7	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.009	16%	0.163	C	C	.	.	H	α-helix	trans	-64.5	-41	172.7	-57.1	-67.8	0	0	0	111.6	L65 S66 L67 L118 I119 D122 A142 M145 I146	F63-L65 VanDerWaalsContact C-N 3.27Å; F63-L65 PolarHBondContact O-N 3.2Å; F63-S66 PolarHBondContact O-N 2.83Å; F63-L67 WeakPolarHBondContact O-CB 3.32Å; F63-L67 PolarHBondContact O-N 3.09Å; F63-L118 HydrophobicContact CD1-CB 4.22Å; F63-L118 HydrophobicContact CE1-CB 4.19Å; F63-L118 HydrophobicContact CE1-CD1 4.35Å; F63-I119 HydrophobicContact CB-CD1 4.02Å; F63-I119 HydrophobicContact CB-CG1 3.52Å; F63-I119 HydrophobicContact CG-CG1 4.23Å; F63-D122 HydrophobicContact CE2-CB 4Å; F63-A142 HydrophobicContact CE1-CB 4.21Å; F63-A142 HydrophobicContact CE2-CB 4.18Å; F63-A142 HydrophobicContact CZ-CB 3.74Å; F63-M145 HydrophobicContact CE1-CB 4.27Å; F63-M145 HydrophobicContact CE1-CE 4.31Å; F63-M145 HydrophobicContact CZ-CE 4Å; F63-M145 HydrophobicContact CZ-SD 4.38Å; F63-I146 HydrophobicContact CD1-CD1 3.9Å; F63-I146 HydrophobicContact CD1-CG1 3.7Å; F63-I146 HydrophobicContact CE1-CD1 4.32Å; F63-I146 HydrophobicContact CE1-CG1 4.02Å
64	L	91	Very high	92.2	Very high	14 Å²	14	31 Å²	31	7%	0.073	16%	0.163	C	C	.	.	H	α-helix	trans	-64.9	-30.9	174	-52.4	-174.3	0	0	0	112.5	N61 A68 I119 Y418 F425	N61-L64 PolarHBondContact O-N 2.92Å; L64-A68 WeakPolarHBondContact O-CB 3.23Å; L64-A68 PolarHBondContact O-N 3.41Å; L64-I119 HydrophobicContact CD2-CD1 3.78Å; L64-Y418 HydrophobicContact CD1-CD1 4.19Å; L64-Y418 HydrophobicContact CD1-CE1 4.34Å; L64-Y418 HydrophobicContact CD2-CD1 4.32Å; L64-Y418 HydrophobicContact CD2-CE1 3.69Å; L64-Y418 HydrophobicContact CG-CE1 4.41Å; L64-F425 HydrophobicContact CD1-CE2 4.13Å
65	L	94.3	Very high	92.8	Very high	31 Å²	31	26.1 Å²	26.1	16%	0.162	13%	0.133	C	C	.	.	H	α-helix	trans	-69.1	-43.8	174	-165.5	80.6	0	0	0	111.3	L47 F50 N61 Y62 F63 A68 C69	L47-L65 HydrophobicContact CD2-CD1 3.49Å; L47-L65 VanDerWaalsContact CD2-CD1 3.49Å; L47-L65 HydrophobicContact CD2-CG 3.94Å; F50-L65 HydrophobicContact CB-CD1 3.73Å; F50-L65 HydrophobicContact CD1-CD1 3.79Å; F50-L65 HydrophobicContact CD1-CD2 3.98Å; F50-L65 HydrophobicContact CD1-CG 4.48Å; F50-L65 HydrophobicContact CE1-CD2 3.96Å; F50-L65 HydrophobicContact CG-CD1 3.77Å; N61-L65 WeakPolarHBondContact O-CB 3.34Å; N61-L65 PolarHBondContact O-N 2.62Å; Y62-L65 WeakPolarHBondContact O-CB 3.31Å; Y62-L65 PolarHBondContact O-N 2.98Å; F63-L65 VanDerWaalsContact C-N 3.27Å; F63-L65 PolarHBondContact O-N 3.2Å; L65-A68 PolarHBondContact O-N 3.49Å; L65-C69 PolarHBondContact O-N 3.05Å; L65-C69 PolarHBondContact O-SG 3.34Å
66	S	96.1	Very high	93.3	Very high	9 Å²	9	25 Å²	25	6%	0.063	13%	0.132	C	C	.	.	H	α-helix	trans	-62.9	-44.2	175.4	180	0	0	0	0	112	Y62 F63 C69 A70 N115 I146 W150	Y62-S66 PolarHBondContact O-N 3.47Å; F63-S66 PolarHBondContact O-N 2.83Å; S66-C69 WeakPolarHBondContact O-CB 3.46Å; S66-C69 PolarHBondContact O-N 2.99Å; S66-C69 VanDerWaalsContact O-N 3.08Å; S66-A70 PolarHBondContact O-N 2.72Å; S66-N115 WeakPolarHBondContact CB-OD1 3.43Å; S66-N115 PolarHBondContact OG-ND2 3.46Å; S66-N115 PolarHBondContact OG-OD1 3.43Å; S66-I146 WeakPolarHBondContact OG-CG2 3.33Å; S66-W150 PolarHBondContact OG-NE1 3.03Å
67	L	94.3	Very high	93.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-59.8	-47.1	175.9	-176.3	46.7	0	0	0	111	F63 C69 A70 D71 S112 N115 L116 I119 Y418	F63-L67 WeakPolarHBondContact O-CB 3.32Å; F63-L67 PolarHBondContact O-N 3.09Å; L67-C69 VanDerWaalsContact C-N 3.25Å; L67-C69 PolarHBondContact O-N 2.9Å; L67-A70 PolarHBondContact O-N 3.37Å; L67-A70 VanDerWaalsContact O-N 3.11Å; L67-D71 WeakPolarHBondContact O-CB 3.5Å; L67-D71 VanDerWaalsContact O-CG 3.24Å; L67-D71 PolarHBondContact O-N 2.88Å; L67-S112 WeakPolarHBondContact CD1-OG 3.5Å; L67-N115 HydrophobicContact CB-CB 4.4Å; L67-L116 HydrophobicContact CD2-CD2 3.59Å; L67-L116 HydrophobicContact CD2-CG 4.19Å; L67-I119 HydrophobicContact CD2-CD1 3.98Å; L67-Y418 WeakPolarHBondContact CD2-OH 3.49Å; L67-Y418 WeakPolarHBondContact CG-OH 3.47Å
68	A	96.2	Very high	94.4	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-64.1	-23	173.7	0	0	0	0	0	114.4	N43 V46 L47 L64 L65 L72	N43-A68 HydrophobicContact CB-CB 4.31Å; N43-A68 WeakPolarHBondContact OD1-CA 3.41Å; V46-A68 HydrophobicContact CB-CB 3.91Å; V46-A68 HydrophobicContact CG1-CB 3.78Å; V46-A68 HydrophobicContact CG2-CB 4.49Å; L47-A68 HydrophobicContact CD2-CB 3.96Å; L64-A68 WeakPolarHBondContact O-CB 3.23Å; L64-A68 PolarHBondContact O-N 3.41Å; L65-A68 PolarHBondContact O-N 3.49Å; A68-L72 WeakPolarHBondContact O-CB 3.46Å; A68-L72 PolarHBondContact O-N 2.73Å; A68-L72 VanDerWaalsContact O-N 3.15Å
69	C	97.7	Very high	94.8	Very high	50 Å²	50	22.6 Å²	22.6	34%	0.338	12%	0.117	S	C	.	.	H	α-helix	trans	-74.1	-41.4	170.4	-69.7	0	0	0	0	112.1	L65 S66 L67 L72 I73	L65-C69 PolarHBondContact O-N 3.05Å; L65-C69 PolarHBondContact O-SG 3.34Å; S66-C69 WeakPolarHBondContact O-CB 3.46Å; S66-C69 PolarHBondContact O-N 2.99Å; S66-C69 VanDerWaalsContact O-N 3.08Å; L67-C69 VanDerWaalsContact C-N 3.25Å; L67-C69 PolarHBondContact O-N 2.9Å; C69-L72 PolarHBondContact O-N 2.88Å; C69-I73 WeakPolarHBondContact O-CG1 3.34Å; C69-I73 PolarHBondContact O-N 2.97Å; C69-I73 VanDerWaalsContact O-N 3.16Å
70	A	97.6	Very high	95.4	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-64.8	-48.2	174.9	0	0	0	0	0	111.4	S66 L67 L72 I73 I74 W150	S66-A70 PolarHBondContact O-N 2.72Å; L67-A70 PolarHBondContact O-N 3.37Å; L67-A70 VanDerWaalsContact O-N 3.11Å; A70-L72 PolarHBondContact O-N 2.87Å; A70-I73 WeakPolarHBondContact O-CB 3.42Å; A70-I73 PolarHBondContact O-N 3.47Å; A70-I74 PolarHBondContact O-N 2.71Å; A70-W150 HydrophobicContact CB-CH2 3.84Å; A70-W150 HydrophobicContact CB-CZ2 3.84Å
71	D	97.3	Very high	96	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-61.6	-31.2	177.9	-66.1	-26	0	0	0	112.3	N43 L67 G75 S112 S411 N414	N43-D71 WeakPolarHBondContact ND2-CB 3.38Å; L67-D71 WeakPolarHBondContact O-CB 3.5Å; L67-D71 VanDerWaalsContact O-CG 3.24Å; L67-D71 PolarHBondContact O-N 2.88Å; D71-G75 PolarHBondContact O-N 2.94Å; D71-S112 PolarHBondContact OD1-OG 3.41Å; D71-S411 WeakPolarHBondContact OD1-CB 3.24Å; D71-S411 PolarHBondContact OD1-OG 2.81Å; D71-N414 WeakPolarHBondContact OD2-CB 3.26Å; D71-N414 PolarHBondContact OD2-ND2 2.73Å
72	L	97.8	Very high	96.4	Very high	30 Å²	30	25.2 Å²	25.2	16%	0.157	13%	0.129	C	C	.	.	H	α-helix	trans	-72	-35.8	173.7	-179.4	62.8	0	0	0	112.7	V40 N43 L44 L47 A68 C69 A70 T76	V40-L72 HydrophobicContact CB-CD1 4.22Å; V40-L72 HydrophobicContact CG1-CD1 3.94Å; V40-L72 HydrophobicContact CG2-CD1 4.22Å; N43-L72 HydrophobicContact CB-CB 4.21Å; L44-L72 HydrophobicContact CD2-CD1 4.33Å; L44-L72 HydrophobicContact CD2-CD2 3.87Å; L44-L72 HydrophobicContact CG-CD1 4.07Å; L44-L72 HydrophobicContact CG-CD2 4.45Å; L47-L72 HydrophobicContact CD1-CD2 3.83Å; A68-L72 WeakPolarHBondContact O-CB 3.46Å; A68-L72 PolarHBondContact O-N 2.73Å; A68-L72 VanDerWaalsContact O-N 3.15Å; C69-L72 PolarHBondContact O-N 2.88Å; A70-L72 PolarHBondContact O-N 2.87Å; L72-T76 VanDerWaalsContact O-CB 3.25Å; L72-T76 WeakPolarHBondContact O-CB 3.16Å; L72-T76 PolarHBondContact O-N 3.27Å; L72-T76 PolarHBondContact O-OG1 2.9Å
73	I	98.3	Very high	96.5	Very high	43 Å²	43	22.5 Å²	22.5	22%	0.221	12%	0.12	C	C	.	.	H	α-helix	trans	-64.9	-47.8	173.9	-71.8	167.2	0	0	0	109.8	C69 A70 G75 T76 F77 L104 A108 W150	C69-I73 WeakPolarHBondContact O-CG1 3.34Å; C69-I73 PolarHBondContact O-N 2.97Å; C69-I73 VanDerWaalsContact O-N 3.16Å; A70-I73 WeakPolarHBondContact O-CB 3.42Å; A70-I73 PolarHBondContact O-N 3.47Å; I73-G75 VanDerWaalsContact C-N 3.35Å; I73-G75 PolarHBondContact O-N 3.19Å; I73-T76 PolarHBondContact O-N 2.89Å; I73-F77 HydrophobicContact CG2-CD2 4.23Å; I73-F77 PolarHBondContact O-N 3.36Å; I73-L104 HydrophobicContact CG2-CD1 3.67Å; I73-L104 HydrophobicContact CG2-CD2 4.09Å; I73-L104 HydrophobicContact CG2-CG 3.75Å; I73-A108 HydrophobicContact CB-CB 4.26Å; I73-A108 HydrophobicContact CG2-CB 3.86Å; I73-W150 HydrophobicContact CD1-CH2 4Å; I73-W150 HydrophobicContact CD1-CZ3 4.39Å
74	I	98.2	Very high	96.6	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.01	14%	0.135	C	C	.	.	I	π-helix	trans	-59.2	-45.6	177	-65.6	167.1	0	0	0	110.7	A70 S78 M79 A108 Y408	A70-I74 PolarHBondContact O-N 2.71Å; I74-S78 WeakPolarHBondContact O-CB 3.4Å; I74-S78 PolarHBondContact O-N 2.77Å; I74-S78 VanDerWaalsContact O-N 3.16Å; I74-M79 PolarHBondContact O-N 2.93Å; I74-A108 HydrophobicContact CD1-CB 4.4Å; I74-A108 HydrophobicContact CG1-CB 4.03Å; I74-Y408 HydrophobicContact CG2-CD1 3.59Å; I74-Y408 HydrophobicContact CG2-CE1 4.07Å; I74-Y408 HydrophobicContact CG2-CG 4.24Å
75	G	97.6	Very high	96.8	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.138	C	C	.	.	I	π-helix	trans	-67.9	-32.5	177.5	0	0	0	0	0	115	S36 D71 I73 N80	S36-G75 PolarHBondContact OG-O 3Å; S36-G75 VanDerWaalsContact OG-O 3.11Å; D71-G75 PolarHBondContact O-N 2.94Å; I73-G75 VanDerWaalsContact C-N 3.35Å; I73-G75 PolarHBondContact O-N 3.19Å; G75-N80 PolarHBondContact O-ND2 3.24Å
76	T	97.4	Very high	96.7	Very high	57 Å²	57	25 Å²	25	35%	0.35	13%	0.133	S	C	.	.	I	π-helix	trans	-86	-36.1	-177.2	-51.9	0	0	0	0	112.3	L72 I73 N80	L72-T76 VanDerWaalsContact O-CB 3.25Å; L72-T76 WeakPolarHBondContact O-CB 3.16Å; L72-T76 PolarHBondContact O-N 3.27Å; L72-T76 PolarHBondContact O-OG1 2.9Å; I73-T76 PolarHBondContact O-N 2.89Å; T76-N80 PolarHBondContact O-ND2 3.41Å
77	F	97.8	Very high	96.5	Very high	101 Å²	101	26.2 Å²	26.2	44%	0.443	14%	0.139	S	C	.	.	I	π-helix	trans	-112	-64.7	-174.4	-60.1	-76.3	0	0	0	111.8	I73 M79 N80 L81 L104	I73-F77 HydrophobicContact CG2-CD2 4.23Å; I73-F77 PolarHBondContact O-N 3.36Å; F77-M79 PolarHBondContact O-N 2.83Å; F77-N80 PolarHBondContact O-N 3.11Å; F77-N80 VanDerWaalsContact O-N 3.14Å; F77-L81 HydrophobicContact CB-CD1 4.33Å; F77-L81 WeakPolarHBondContact O-CB 3.48Å; F77-L81 WeakPolarHBondContact O-CG 3.48Å; F77-L81 PolarHBondContact O-N 3.38Å; F77-L104 HydrophobicContact CB-CD2 3.79Å; F77-L104 HydrophobicContact CD2-CD2 4Å; F77-L104 HydrophobicContact CG-CD2 3.87Å
78	S	97.8	Very high	96.3	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.154	C	C	.	.	I	π-helix	trans	-57.7	-52.1	-170.2	-48.5	0	0	0	0	113.6	I74 N80 L81 Y82 D105	I74-S78 WeakPolarHBondContact O-CB 3.4Å; I74-S78 PolarHBondContact O-N 2.77Å; I74-S78 VanDerWaalsContact O-N 3.16Å; S78-N80 PolarHBondContact O-N 3.11Å; S78-L81 PolarHBondContact O-N 3.07Å; S78-Y82 WeakPolarHBondContact O-CB 3.45Å; S78-Y82 PolarHBondContact O-N 3.45Å; S78-D105 WeakPolarHBondContact CB-OD1 3.36Å; S78-D105 PolarHBondContact OG-OD1 3.4Å
79	M	97.8	Very high	96	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-55.6	-38.7	178.4	-75.4	-175.2	176.6	0	0	112.6	T39 I74 F77 T83 W405 Y408	T39-M79 HydrophobicContact CG2-CE 3.96Å; T39-M79 HydrophobicContact CG2-SD 4.33Å; T39-M79 WeakPolarHBondContact OG1-CE 3.49Å; I74-M79 PolarHBondContact O-N 2.93Å; F77-M79 PolarHBondContact O-N 2.83Å; M79-T83 WeakPolarHBondContact O-CB 3.03Å; M79-T83 PolarHBondContact O-N 3.21Å; M79-T83 PolarHBondContact O-OG1 3.33Å; M79-W405 HydrophobicContact CB-CH2 3.7Å; M79-W405 HydrophobicContact CB-CZ3 3.97Å; M79-W405 HydrophobicContact CG-CH2 3.96Å; M79-W405 HydrophobicContact CG-CZ3 3.69Å; M79-W405 VanDerWaalsContact O-CH2 3.26Å; M79-W405 WeakPolarHBondContact O-CH2 3.36Å; M79-W405 WeakPolarHBondContact O-CZ2 3.49Å; M79-W405 HydrophobicContact SD-CZ3 4.19Å; M79-Y408 WeakPolarHBondContact CE-O 3.23Å; M79-Y408 HydrophobicContact CG-CD2 3.99Å; M79-Y408 HydrophobicContact CG-CG 4.12Å
80	N	97.6	Very high	95.7	Very high	56 Å²	56	32.1 Å²	32.1	30%	0.299	17%	0.171	S	C	.	.	H	α-helix	trans	-83.3	-41.7	-174	-57.3	-50.4	0	0	0	111.5	S36 G75 T76 F77 S78 T83 T84	S36-N80 VanDerWaalsContact CB-OD1 3.31Å; S36-N80 WeakPolarHBondContact CB-OD1 3.46Å; S36-N80 PolarHBondContact OG-ND2 3.35Å; S36-N80 VanDerWaalsContact OG-ND2 3.15Å; S36-N80 PolarHBondContact OG-OD1 3.33Å; G75-N80 PolarHBondContact O-ND2 3.24Å; T76-N80 PolarHBondContact O-ND2 3.41Å; F77-N80 PolarHBondContact O-N 3.11Å; F77-N80 VanDerWaalsContact O-N 3.14Å; S78-N80 PolarHBondContact O-N 3.11Å; N80-T83 WeakPolarHBondContact O-CB 3.06Å; N80-T83 PolarHBondContact O-N 3.22Å; N80-T84 PolarHBondContact O-N 2.94Å; N80-T84 PolarHBondContact O-OG1 3.16Å; N80-T84 VanDerWaalsContact O-OG1 3.14Å
81	L	97.5	Very high	95.6	Very high	47 Å²	47	33 Å²	33	25%	0.246	17%	0.174	C	C	.	.	H	α-helix	trans	-64.8	-41.2	174.4	-70.1	166.5	0	0	0	111.5	F77 S78 T84 Y85 W91 L93 W101	F77-L81 HydrophobicContact CB-CD1 4.33Å; F77-L81 WeakPolarHBondContact O-CB 3.48Å; F77-L81 WeakPolarHBondContact O-CG 3.48Å; F77-L81 PolarHBondContact O-N 3.38Å; S78-L81 PolarHBondContact O-N 3.07Å; L81-T84 WeakPolarHBondContact O-CB 3.31Å; L81-T84 PolarHBondContact O-N 2.94Å; L81-Y85 PolarHBondContact O-N 3.36Å; L81-Y85 VanDerWaalsContact O-N 3.08Å; L81-W91 HydrophobicContact CB-CH2 4.46Å; L81-W91 HydrophobicContact CD2-CH2 4.3Å; L81-L93 HydrophobicContact CD2-CD1 3.91Å; L81-W101 HydrophobicContact CB-CD2 4.28Å; L81-W101 HydrophobicContact CB-CG 4.16Å; L81-W101 HydrophobicContact CD1-CB 4.02Å; L81-W101 HydrophobicContact CD1-CG 3.84Å
82	Y	97.3	Very high	95.4	Very high	15 Å²	15	36 Å²	36	6%	0.059	20%	0.199	C	C	.	.	H	α-helix	trans	-66.3	-40.4	173.9	-164.9	-124.7	0	0	0	111.9	S78 T84 Y85 L86 W101 E401 Y404 W405 Y408	S78-Y82 WeakPolarHBondContact O-CB 3.45Å; S78-Y82 PolarHBondContact O-N 3.45Å; Y82-T84 VanDerWaalsContact C-N 3.33Å; Y82-T84 PolarHBondContact O-N 3.09Å; Y82-Y85 HydrophobicContact CD2-CD1 4.08Å; Y82-Y85 AromaticContact CE2-CD1 3.96Å; Y82-Y85 HydrophobicContact CE2-CD1 3.96Å; Y82-Y85 HydrophobicContact CE2-CE1 4.37Å; Y82-Y85 WeakPolarHBondContact O-CB 3.34Å; Y82-Y85 PolarHBondContact O-N 3.1Å; Y82-L86 HydrophobicContact CD1-CD1 3.89Å; Y82-L86 HydrophobicContact CD1-CG 4.26Å; Y82-L86 HydrophobicContact CE1-CD1 3.68Å; Y82-L86 HydrophobicContact CE1-CD2 4.26Å; Y82-L86 HydrophobicContact CE1-CG 4.11Å; Y82-L86 HydrophobicContact CE2-CD2 4.22Å; Y82-L86 HydrophobicContact CE2-CG 4.47Å; Y82-L86 VanDerWaalsContact O-CG 3.3Å; Y82-L86 WeakPolarHBondContact O-CG 3.33Å; Y82-L86 PolarHBondContact O-N 3.38Å; Y82-W101 AromaticContact CD2-CH2 3.69Å; Y82-W101 HydrophobicContact CD2-CH2 3.69Å; Y82-W101 AromaticContact CD2-CZ2 3.78Å; Y82-W101 HydrophobicContact CD2-CZ2 3.78Å; Y82-W101 HydrophobicContact CE2-CH2 4.4Å; Y82-W101 HydrophobicContact CG-CZ2 4.3Å; Y82-E401 WeakPolarHBondContact OH-CA 3.3Å; Y82-Y404 HydrophobicContact CE1-CD1 4.39Å; Y82-Y404 HydrophobicContact CE1-CG 4.17Å; Y82-Y404 AromaticContact CZ-CG 3.97Å; Y82-Y404 WeakPolarHBondContact OH-CB 3.44Å; Y82-W405 AromaticContact CD1-CE2 3.88Å; Y82-W405 HydrophobicContact CD1-CZ2 4.25Å; Y82-W405 AromaticContact CD1-NE1 3.49Å; Y82-W405 AromaticContact CE1-CD1 3.78Å; Y82-W405 AromaticContact CE1-NE1 3.69Å; Y82-Y408 HydrophobicContact CD1-CD2 4.42Å; Y82-Y408 AromaticContact CD1-CE2 3.75Å; Y82-Y408 HydrophobicContact CD1-CE2 3.75Å; Y82-Y408 AromaticContact CG-CE2 4Å; Y82-Y408 HydrophobicContact CG-CE2 4Å
83	T	95.9	Very high	95.2	Very high	15 Å²	15	39.1 Å²	39.1	9%	0.092	22%	0.215	C	C	.	.	H	α-helix	trans	-53.9	-50.2	170.7	-62.7	0	0	0	0	111	T32 M79 N80 Y85 L86 L87 W405	T32-T83 VanDerWaalsContact CB-OG1 3.28Å; T32-T83 WeakPolarHBondContact CB-OG1 3.46Å; T32-T83 WeakPolarHBondContact OG1-CG2 3.28Å; T32-T83 PolarHBondContact OG1-OG1 2.75Å; M79-T83 WeakPolarHBondContact O-CB 3.03Å; M79-T83 PolarHBondContact O-N 3.21Å; M79-T83 PolarHBondContact O-OG1 3.33Å; N80-T83 WeakPolarHBondContact O-CB 3.06Å; N80-T83 PolarHBondContact O-N 3.22Å; T83-Y85 VanDerWaalsContact C-N 3.33Å; T83-Y85 PolarHBondContact O-N 2.87Å; T83-L86 PolarHBondContact O-N 3.5Å; T83-L87 HydrophobicContact CG2-CD1 3.68Å; T83-L87 HydrophobicContact CG2-CG 4.02Å; T83-L87 VanDerWaalsContact O-CG 3.3Å; T83-L87 WeakPolarHBondContact O-CG 3.31Å; T83-L87 PolarHBondContact O-N 3.43Å; T83-W405 VanDerWaalsContact OG1-CZ2 3.3Å; T83-W405 WeakPolarHBondContact OG1-CZ2 3.21Å
84	T	94.4	Very high	95	Very high	52 Å²	52	39 Å²	39	32%	0.319	22%	0.224	S	C	.	.	H	α-helix	trans	-56.5	-46.2	179.3	-59.4	0	0	0	0	112	N80 L81 Y82 L87 M88	N80-T84 PolarHBondContact O-N 2.94Å; N80-T84 PolarHBondContact O-OG1 3.16Å; N80-T84 VanDerWaalsContact O-OG1 3.14Å; L81-T84 WeakPolarHBondContact O-CB 3.31Å; L81-T84 PolarHBondContact O-N 2.94Å; Y82-T84 VanDerWaalsContact C-N 3.33Å; Y82-T84 PolarHBondContact O-N 3.09Å; T84-L87 PolarHBondContact O-N 3.39Å; T84-M88 HydrophobicContact CG2-CE 3.77Å; T84-M88 HydrophobicContact CG2-CG 4.46Å; T84-M88 HydrophobicContact CG2-SD 3.71Å; T84-M88 WeakPolarHBondContact O-CB 3.33Å; T84-M88 WeakPolarHBondContact O-CG 3.49Å; T84-M88 PolarHBondContact O-N 3.41Å
85	Y	94.3	Very high	94.8	Very high	38 Å²	38	42.9 Å²	42.9	15%	0.149	25%	0.248	C	C	.	.	H	α-helix	trans	-58.3	-47.2	175.4	176.7	-112.4	0	0	0	112.6	L81 Y82 T83 L87 G89 W91 Q177	L81-Y85 PolarHBondContact O-N 3.36Å; L81-Y85 VanDerWaalsContact O-N 3.08Å; Y82-Y85 HydrophobicContact CD2-CD1 4.08Å; Y82-Y85 AromaticContact CE2-CD1 3.96Å; Y82-Y85 HydrophobicContact CE2-CD1 3.96Å; Y82-Y85 HydrophobicContact CE2-CE1 4.37Å; Y82-Y85 WeakPolarHBondContact O-CB 3.34Å; Y82-Y85 PolarHBondContact O-N 3.1Å; T83-Y85 VanDerWaalsContact C-N 3.33Å; T83-Y85 PolarHBondContact O-N 2.87Å; Y85-L87 PolarHBondContact O-N 3.22Å; Y85-G89 WeakPolarHBondContact O-CA 3.45Å; Y85-G89 PolarHBondContact O-N 2.9Å; Y85-W91 HydrophobicContact CD2-CB 4.08Å; Y85-W91 HydrophobicContact CD2-CE3 4.14Å; Y85-W91 HydrophobicContact CE2-CB 4.24Å; Y85-W91 HydrophobicContact CG-CE3 4.47Å; Y85-Q177 PolarHBondContact OH-OE1 3.48Å
86	L	92.1	Very high	94.7	Very high	9 Å²	9	48.5 Å²	48.5	5%	0.047	28%	0.278	C	S	.	.	H	α-helix	trans	-69	-27.9	-179.5	-65.7	-175	0	0	0	114.8	K20 Y82 T83 E401	K20-L86 PolarHBondContact NZ-O 2.98Å; Y82-L86 HydrophobicContact CD1-CD1 3.89Å; Y82-L86 HydrophobicContact CD1-CG 4.26Å; Y82-L86 HydrophobicContact CE1-CD1 3.68Å; Y82-L86 HydrophobicContact CE1-CD2 4.26Å; Y82-L86 HydrophobicContact CE1-CG 4.11Å; Y82-L86 HydrophobicContact CE2-CD2 4.22Å; Y82-L86 HydrophobicContact CE2-CG 4.47Å; Y82-L86 VanDerWaalsContact O-CG 3.3Å; Y82-L86 WeakPolarHBondContact O-CG 3.33Å; Y82-L86 PolarHBondContact O-N 3.38Å; T83-L86 PolarHBondContact O-N 3.5Å; L86-E401 HydrophobicContact CD2-CB 4.27Å; L86-E401 HydrophobicContact CD2-CG 3.6Å
87	L	91.8	Very high	94.6	Very high	35 Å²	35	47.6 Å²	47.6	18%	0.183	28%	0.276	C	S	.	.	H	α-helix	trans	-83.2	-39.3	178.2	-65.5	-176.9	0	0	0	111.9	L16 A17 V25 I28 T83 T84 Y85	L16-L87 CarbonylContact C-O 3.59Å; L16-L87 WeakPolarHBondContact CA-O 3.49Å; A17-L87 PolarHBondContact N-O 3.43Å; V25-L87 HydrophobicContact CB-CD2 4.44Å; V25-L87 HydrophobicContact CG1-CD2 3.92Å; V25-L87 WeakPolarHBondContact O-CD2 3.2Å; I28-L87 HydrophobicContact CB-CD2 3.94Å; I28-L87 HydrophobicContact CG2-CD2 3.77Å; T83-L87 HydrophobicContact CG2-CD1 3.68Å; T83-L87 HydrophobicContact CG2-CG 4.02Å; T83-L87 VanDerWaalsContact O-CG 3.3Å; T83-L87 WeakPolarHBondContact O-CG 3.31Å; T83-L87 PolarHBondContact O-N 3.43Å; T84-L87 PolarHBondContact O-N 3.39Å; Y85-L87 PolarHBondContact O-N 3.22Å
88	M	90.3	Very high	94.6	Very high	67 Å²	67	42.8 Å²	42.8	33%	0.33	26%	0.255	S	S	.	.	H	α-helix	trans	-76	-32	175.4	-68.9	178	173.6	0	0	112.4	V15 A17 T84 H90 A92	V15-M88 HydrophobicContact CG1-CB 4.31Å; V15-M88 HydrophobicContact CG1-CG 4.33Å; A17-M88 PolarHBondContact N-O 2.97Å; T84-M88 HydrophobicContact CG2-CE 3.77Å; T84-M88 HydrophobicContact CG2-CG 4.46Å; T84-M88 HydrophobicContact CG2-SD 3.71Å; T84-M88 WeakPolarHBondContact O-CB 3.33Å; T84-M88 WeakPolarHBondContact O-CG 3.49Å; T84-M88 PolarHBondContact O-N 3.41Å; M88-H90 PolarHBondContact O-N 3.43Å; M88-A92 HydrophobicContact SD-CB 4.31Å
89	G	89.4	Confident	94.6	Very high	32 Å²	32	43.4 Å²	43.4	33%	0.33	26%	0.258	S	S	.	.	S	Bend	trans	76.5	3.9	-173.3	0	0	0	0	0	114.2	Y85	Y85-G89 WeakPolarHBondContact O-CA 3.45Å; Y85-G89 PolarHBondContact O-N 2.9Å
90	H	91.7	Very high	94.6	Very high	75 Å²	75	47.7 Å²	47.7	35%	0.347	28%	0.28	S	S	.	.	S	Bend	trans	-153.9	157.8	173.6	75.8	116.6	0	0	0	110.7	V15 M88 G176	V15-H90 VanDerWaalsContact CG1-NE2 3.3Å; V15-H90 WeakPolarHBondContact CG1-NE2 3.15Å; M88-H90 PolarHBondContact O-N 3.43Å; H90-G176 CarbonylContact C-O 3.59Å; H90-G176 WeakPolarHBondContact CA-O 3.21Å; H90-G176 WeakPolarHBondContact CB-O 3.2Å
91	W	95.1	Very high	94.6	Very high	20 Å²	20	45.5 Å²	45.5	8%	0.076	27%	0.268	C	S	.	.			trans	-88.9	109.9	177	-173.5	-94.3	0	0	0	111.8	L81 Y85 L93 G94 A97 C98 W101 G176 C178	L81-W91 HydrophobicContact CB-CH2 4.46Å; L81-W91 HydrophobicContact CD2-CH2 4.3Å; Y85-W91 HydrophobicContact CD2-CB 4.08Å; Y85-W91 HydrophobicContact CD2-CE3 4.14Å; Y85-W91 HydrophobicContact CE2-CB 4.24Å; Y85-W91 HydrophobicContact CG-CE3 4.47Å; W91-L93 HydrophobicContact CH2-CD1 3.95Å; W91-L93 HydrophobicContact CZ2-CB 3.8Å; W91-L93 HydrophobicContact CZ2-CD1 3.91Å; W91-L93 HydrophobicContact CZ2-CG 4.33Å; W91-G94 PolarHBondContact NE1-O 3.27Å; W91-A97 HydrophobicContact CZ2-CB 3.99Å; W91-C98 HydrophobicContact CD2-CB 4.41Å; W91-C98 HydrophobicContact CZ2-CB 4.25Å; W91-W101 HydrophobicContact CE3-CE3 4.05Å; W91-W101 HydrophobicContact CE3-CZ3 4.03Å; W91-W101 HydrophobicContact CH2-CB 4.24Å; W91-W101 AromaticContact CH2-CD2 3.99Å; W91-W101 HydrophobicContact CH2-CD2 3.99Å; W91-W101 AromaticContact CH2-CE3 3.46Å; W91-W101 HydrophobicContact CH2-CE3 3.46Å; W91-W101 VanDerWaalsContact CH2-CE3 3.46Å; W91-W101 HydrophobicContact CH2-CG 4.3Å; W91-W101 HydrophobicContact CH2-CZ3 4.25Å; W91-W101 HydrophobicContact CZ2-CE3 4.29Å; W91-W101 HydrophobicContact CZ3-CD2 4.09Å; W91-W101 AromaticContact CZ3-CE3 3.32Å; W91-W101 HydrophobicContact CZ3-CE3 3.32Å; W91-W101 AromaticContact CZ3-CZ3 3.64Å; W91-W101 HydrophobicContact CZ3-CZ3 3.64Å; W91-G176 PolarHBondContact N-O 2.64Å; W91-C178 HydrophobicContact CB-CB 3.91Å; W91-C178 HydrophobicContact CD2-CB 3.92Å; W91-C178 HydrophobicContact CE3-CB 4.11Å; W91-C178 HydrophobicContact CG-CB 3.82Å
92	A	93.6	Very high	94.6	Very high	63 Å²	63	43.5 Å²	43.5	52%	0.521	26%	0.258	S	S	.	.			trans	-99.8	-7.9	-177.2	0	0	0	0	0	115.1	M88 G94	M88-A92 HydrophobicContact SD-CB 4.31Å; A92-G94 VanDerWaalsContact C-N 3.29Å; A92-G94 PolarHBondContact O-N 2.86Å
93	L	94.1	Very high	94.7	Very high	95 Å²	95	43 Å²	43	50%	0.497	26%	0.257	S	S	.	.	S	Bend	trans	-85	6.6	-171.2	-59.7	173.9	0	0	0	114.6	L81 W91 A97	L81-L93 HydrophobicContact CD2-CD1 3.91Å; W91-L93 HydrophobicContact CH2-CD1 3.95Å; W91-L93 HydrophobicContact CZ2-CB 3.8Å; W91-L93 HydrophobicContact CZ2-CD1 3.91Å; W91-L93 HydrophobicContact CZ2-CG 4.33Å; L93-A97 HydrophobicContact CB-CB 3.81Å; L93-A97 WeakPolarHBondContact O-CB 3.39Å
94	G	93.9	Very high	94.8	Very high	40 Å²	40	45.5 Å²	45.5	41%	0.412	27%	0.269	S	S	.	.			trans	82.1	165.4	-178.1	0	0	0	0	0	114.5	W91 A92 A97 C98	W91-G94 PolarHBondContact NE1-O 3.27Å; A92-G94 VanDerWaalsContact C-N 3.29Å; A92-G94 PolarHBondContact O-N 2.86Å; G94-A97 PolarHBondContact O-N 3.2Å; G94-C98 PolarHBondContact O-N 2.89Å
95	T	94	Very high	95	Very high	84 Å²	84	43 Å²	43	52%	0.515	25%	0.254	S	S	.	.	H	α-helix	trans	-63.5	-48.9	-172.8	48.2	0	0	0	0	112.9	A97 C98 D99	T95-A97 VanDerWaalsContact C-N 3.26Å; T95-A97 PolarHBondContact O-N 3.08Å; T95-C98 WeakPolarHBondContact O-CA 3.25Å; T95-C98 VanDerWaalsContact O-CB 3.3Å; T95-C98 WeakPolarHBondContact O-CB 3.46Å; T95-C98 PolarHBondContact O-N 2.7Å; T95-D99 VanDerWaalsContact O-CG 3.31Å; T95-D99 PolarHBondContact O-N 3.48Å
96	L	94.6	Very high	95.1	Very high	118 Å²	118	42.8 Å²	42.8	62%	0.618	25%	0.253	S	S	*	.	H	α-helix	trans	-59.1	-36.9	179.8	-179.5	61.4	0	0	0	112.4	L100	L96-L100 HydrophobicContact CD1-CD1 3.89Å; L96-L100 HydrophobicContact CD1-CG 3.99Å; L96-L100 HydrophobicContact CG-CD1 3.85Å; L96-L100 HydrophobicContact CG-CG 4.37Å; L96-L100 VanDerWaalsContact O-CB 3.28Å; L96-L100 WeakPolarHBondContact O-CB 3.33Å; L96-L100 VanDerWaalsContact O-CG 3.23Å; L96-L100 WeakPolarHBondContact O-CG 3.45Å; L96-L100 PolarHBondContact O-N 3.42Å
97	A	96.8	Very high	95.4	Very high	37 Å²	37	43 Å²	43	31%	0.306	26%	0.255	S	S	.	.	H	α-helix	trans	-69.6	-35.3	176.4	0	0	0	0	0	112.3	W91 L93 G94 T95 W101	W91-A97 HydrophobicContact CZ2-CB 3.99Å; L93-A97 HydrophobicContact CB-CB 3.81Å; L93-A97 WeakPolarHBondContact O-CB 3.39Å; G94-A97 PolarHBondContact O-N 3.2Å; T95-A97 VanDerWaalsContact C-N 3.26Å; T95-A97 PolarHBondContact O-N 3.08Å; A97-W101 VanDerWaalsContact O-CB 3.23Å; A97-W101 WeakPolarHBondContact O-CB 3.44Å; A97-W101 PolarHBondContact O-N 2.84Å
98	C	97.4	Very high	95.7	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.007	25%	0.246	C	C	.	.	H	α-helix	trans	-62.3	-53.3	172.7	170.5	0	0	0	0	110.4	W91 G94 T95 L100 W101 L102 C178	W91-C98 HydrophobicContact CD2-CB 4.41Å; W91-C98 HydrophobicContact CZ2-CB 4.25Å; G94-C98 PolarHBondContact O-N 2.89Å; T95-C98 WeakPolarHBondContact O-CA 3.25Å; T95-C98 VanDerWaalsContact O-CB 3.3Å; T95-C98 WeakPolarHBondContact O-CB 3.46Å; T95-C98 PolarHBondContact O-N 2.7Å; C98-L100 PolarHBondContact O-N 3.36Å; C98-W101 PolarHBondContact O-N 2.91Å; C98-L102 WeakPolarHBondContact O-CG 3.28Å; C98-L102 PolarHBondContact O-N 3.14Å; C98-C178 WeakPolarHBondContact CA-SG 3.43Å; C98-C178 HydrophobicContact CB-CB 3.94Å; C98-C178 WeakPolarHBondContact CB-SG 3.35Å; C98-C178 WeakPolarHBondContact SG-CA 3.37Å; C98-C178 WeakPolarHBondContact SG-CB 3.32Å; C98-C178 CovalentContact SG-SG 2.03Å; C98-C178 PolarHBondContact SG-SG 3.29Å
99	D	96.9	Very high	96	Very high	12 Å²	12	38.9 Å²	38.9	6%	0.064	24%	0.236	C	C	.	.	H	α-helix	trans	-66.3	-38.2	-174.3	-55.2	-9.1	0	0	0	111.5	T95 A103 I161 L162 Q165 R171	T95-D99 VanDerWaalsContact O-CG 3.31Å; T95-D99 PolarHBondContact O-N 3.48Å; D99-A103 WeakPolarHBondContact O-CB 3.47Å; D99-A103 PolarHBondContact O-N 3.09Å; D99-I161 WeakPolarHBondContact O-CG2 3.33Å; D99-L162 HydrophobicContact CB-CD2 3.94Å; D99-Q165 PolarHBondContact OD2-NE2 3.18Å; D99-R171 IonicContact OD1-CZ 2.62Å; D99-R171 VanDerWaalsContact OD1-CZ 3.28Å; D99-R171 IonicContact OD1-NH1 2.89Å; D99-R171 PolarHBondContact OD1-NH1 2.95Å; D99-R171 IonicContact OD1-NH2 2.71Å; D99-R171 PolarHBondContact OD1-NH2 3.26Å; D99-R171 IonicContact OD2-CZ 3.98Å; D99-R171 IonicContact OD2-NH1 3Å; D99-R171 PolarHBondContact OD2-NH1 2.87Å; D99-R171 IonicContact OD2-NH2 3.33Å
100	L	97.9	Very high	96.4	Very high	90 Å²	90	38.1 Å²	38.1	47%	0.471	22%	0.224	S	C	.	.	H	α-helix	trans	-68.9	-37.5	173.7	-72.5	173.4	0	0	0	113	L96 C98 L104 L162	L96-L100 HydrophobicContact CD1-CD1 3.89Å; L96-L100 HydrophobicContact CD1-CG 3.99Å; L96-L100 HydrophobicContact CG-CD1 3.85Å; L96-L100 HydrophobicContact CG-CG 4.37Å; L96-L100 VanDerWaalsContact O-CB 3.28Å; L96-L100 WeakPolarHBondContact O-CB 3.33Å; L96-L100 VanDerWaalsContact O-CG 3.23Å; L96-L100 WeakPolarHBondContact O-CG 3.45Å; L96-L100 PolarHBondContact O-N 3.42Å; C98-L100 PolarHBondContact O-N 3.36Å; L100-L104 VanDerWaalsContact O-CB 3.27Å; L100-L104 WeakPolarHBondContact O-CB 3.18Å; L100-L104 PolarHBondContact O-N 3.46Å; L100-L162 HydrophobicContact CD2-CD2 4.14Å
101	W	98.3	Very high	96.6	Very high	10 Å²	10	34.6 Å²	34.6	4%	0.038	21%	0.208	C	C	.	.	H	α-helix	trans	-64.3	-50.6	174.6	163.9	42.5	0	0	0	110.9	L81 Y82 W91 A97 C98 A103 L104 D105 C178	L81-W101 HydrophobicContact CB-CD2 4.28Å; L81-W101 HydrophobicContact CB-CG 4.16Å; L81-W101 HydrophobicContact CD1-CB 4.02Å; L81-W101 HydrophobicContact CD1-CG 3.84Å; Y82-W101 AromaticContact CD2-CH2 3.69Å; Y82-W101 HydrophobicContact CD2-CH2 3.69Å; Y82-W101 AromaticContact CD2-CZ2 3.78Å; Y82-W101 HydrophobicContact CD2-CZ2 3.78Å; Y82-W101 HydrophobicContact CE2-CH2 4.4Å; Y82-W101 HydrophobicContact CG-CZ2 4.3Å; W91-W101 HydrophobicContact CE3-CE3 4.05Å; W91-W101 HydrophobicContact CE3-CZ3 4.03Å; W91-W101 HydrophobicContact CH2-CB 4.24Å; W91-W101 AromaticContact CH2-CD2 3.99Å; W91-W101 HydrophobicContact CH2-CD2 3.99Å; W91-W101 AromaticContact CH2-CE3 3.46Å; W91-W101 HydrophobicContact CH2-CE3 3.46Å; W91-W101 VanDerWaalsContact CH2-CE3 3.46Å; W91-W101 HydrophobicContact CH2-CG 4.3Å; W91-W101 HydrophobicContact CH2-CZ3 4.25Å; W91-W101 HydrophobicContact CZ2-CE3 4.29Å; W91-W101 HydrophobicContact CZ3-CD2 4.09Å; W91-W101 AromaticContact CZ3-CE3 3.32Å; W91-W101 HydrophobicContact CZ3-CE3 3.32Å; W91-W101 AromaticContact CZ3-CZ3 3.64Å; W91-W101 HydrophobicContact CZ3-CZ3 3.64Å; A97-W101 VanDerWaalsContact O-CB 3.23Å; A97-W101 WeakPolarHBondContact O-CB 3.44Å; A97-W101 PolarHBondContact O-N 2.84Å; C98-W101 PolarHBondContact O-N 2.91Å; W101-A103 VanDerWaalsContact C-N 3.34Å; W101-A103 PolarHBondContact O-N 3.09Å; W101-L104 PolarHBondContact O-N 3.29Å; W101-D105 WeakPolarHBondContact O-CB 3.37Å; W101-D105 PolarHBondContact O-N 2.63Å; W101-C178 VanDerWaalsContact CE3-SG 3.52Å; W101-C178 HydrophobicContact CZ3-CB 4.08Å; W101-C178 WeakPolarHBondContact CZ3-SG 3.22Å
102	L	98	Very high	96.6	Very high	5 Å²	5	33.7 Å²	33.7	3%	0.026	20%	0.204	C	C	.	.	H	α-helix	trans	-60.2	-43.8	177.9	-67.8	172.1	0	0	0	111.1	C98 L104 D105 Y106 I161 I180	C98-L102 WeakPolarHBondContact O-CG 3.28Å; C98-L102 PolarHBondContact O-N 3.14Å; L102-L104 PolarHBondContact O-N 2.9Å; L102-D105 PolarHBondContact O-N 3.38Å; L102-Y106 HydrophobicContact CD2-CE2 4.38Å; L102-Y106 WeakPolarHBondContact O-CB 3.49Å; L102-Y106 VanDerWaalsContact O-CD2 3.31Å; L102-Y106 WeakPolarHBondContact O-CD2 3.46Å; L102-Y106 PolarHBondContact O-N 3.21Å; L102-I161 HydrophobicContact CB-CG2 3.98Å; L102-I180 HydrophobicContact CB-CG1 4.22Å; L102-I180 HydrophobicContact CD1-CG1 3.95Å; L102-I180 HydrophobicContact CD2-CG1 4.33Å; L102-I180 HydrophobicContact CG-CG1 4.41Å
103	A	98.3	Very high	96.6	Very high	6 Å²	6	30.9 Å²	30.9	5%	0.05	18%	0.181	C	C	.	.	H	α-helix	trans	-60.8	-45.6	175.1	0	0	0	0	0	112.2	D99 W101 V107 A158 I161 L162	D99-A103 WeakPolarHBondContact O-CB 3.47Å; D99-A103 PolarHBondContact O-N 3.09Å; W101-A103 VanDerWaalsContact C-N 3.34Å; W101-A103 PolarHBondContact O-N 3.09Å; A103-V107 VanDerWaalsContact O-CB 3.25Å; A103-V107 WeakPolarHBondContact O-CB 3.4Å; A103-V107 WeakPolarHBondContact O-CG2 3.35Å; A103-V107 PolarHBondContact O-N 3.24Å; A103-A158 HydrophobicContact CB-CB 4.24Å; A103-I161 HydrophobicContact CB-CB 4.37Å; A103-I161 HydrophobicContact CB-CG2 4.2Å; A103-L162 HydrophobicContact CB-CG 4.42Å
104	L	98.3	Very high	96.7	Very high	66 Å²	66	28.7 Å²	28.7	35%	0.346	17%	0.169	S	C	.	.	H	α-helix	trans	-62.3	-44.7	177.5	-177.8	64.8	0	0	0	111.9	I73 F77 L100 W101 L102 A108	I73-L104 HydrophobicContact CG2-CD1 3.67Å; I73-L104 HydrophobicContact CG2-CD2 4.09Å; I73-L104 HydrophobicContact CG2-CG 3.75Å; F77-L104 HydrophobicContact CB-CD2 3.79Å; F77-L104 HydrophobicContact CD2-CD2 4Å; F77-L104 HydrophobicContact CG-CD2 3.87Å; L100-L104 VanDerWaalsContact O-CB 3.27Å; L100-L104 WeakPolarHBondContact O-CB 3.18Å; L100-L104 PolarHBondContact O-N 3.46Å; W101-L104 PolarHBondContact O-N 3.29Å; L102-L104 PolarHBondContact O-N 2.9Å; L104-A108 VanDerWaalsContact O-CB 3.27Å; L104-A108 WeakPolarHBondContact O-CB 3.06Å; L104-A108 PolarHBondContact O-N 3.18Å
105	D	98.2	Very high	96.7	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-67.8	-48	-175.6	-165.4	30.4	0	0	0	111.9	S78 W101 L102 A108 S109 Y408	S78-D105 WeakPolarHBondContact CB-OD1 3.36Å; S78-D105 PolarHBondContact OG-OD1 3.4Å; W101-D105 WeakPolarHBondContact O-CB 3.37Å; W101-D105 PolarHBondContact O-N 2.63Å; L102-D105 PolarHBondContact O-N 3.38Å; D105-A108 PolarHBondContact O-N 2.88Å; D105-S109 WeakPolarHBondContact O-CB 3.14Å; D105-S109 PolarHBondContact O-N 3.06Å; D105-S109 PolarHBondContact O-OG 3.15Å; D105-Y408 WeakPolarHBondContact OD1-CE1 3.3Å; D105-Y408 WeakPolarHBondContact OD2-CE1 3.32Å; D105-Y408 PolarHBondContact OD2-OH 2.92Å
106	Y	97.4	Very high	96.5	Very high	32 Å²	32	22.9 Å²	22.9	13%	0.125	13%	0.125	C	C	.	.	H	α-helix	trans	-69.1	-37.1	178.8	-81.6	-107.1	0	0	0	112.3	L102 N110 W157 I161 I180 L183 Y404	L102-Y106 HydrophobicContact CD2-CE2 4.38Å; L102-Y106 WeakPolarHBondContact O-CB 3.49Å; L102-Y106 VanDerWaalsContact O-CD2 3.31Å; L102-Y106 WeakPolarHBondContact O-CD2 3.46Å; L102-Y106 PolarHBondContact O-N 3.21Å; Y106-N110 WeakPolarHBondContact O-CB 3.35Å; Y106-N110 PolarHBondContact O-N 2.88Å; Y106-W157 AromaticContact CD1-CD2 3.94Å; Y106-W157 HydrophobicContact CD1-CD2 3.94Å; Y106-W157 AromaticContact CD1-CE3 3.59Å; Y106-W157 HydrophobicContact CD1-CE3 3.59Å; Y106-W157 AromaticContact CD1-CH2 3.75Å; Y106-W157 HydrophobicContact CD1-CH2 3.75Å; Y106-W157 HydrophobicContact CD1-CZ2 4.08Å; Y106-W157 AromaticContact CD1-CZ3 3.48Å; Y106-W157 HydrophobicContact CD1-CZ3 3.48Å; Y106-W157 VanDerWaalsContact CD1-CZ3 3.48Å; Y106-W157 HydrophobicContact CE1-CE3 4.45Å; Y106-W157 HydrophobicContact CE1-CH2 4.07Å; Y106-W157 AromaticContact CE1-CZ3 3.93Å; Y106-W157 HydrophobicContact CE1-CZ3 3.93Å; Y106-W157 HydrophobicContact CG-CD2 4.37Å; Y106-W157 HydrophobicContact CG-CE3 4.11Å; Y106-W157 HydrophobicContact CG-CZ3 4.41Å; Y106-I161 HydrophobicContact CD2-CD1 4.44Å; Y106-I161 HydrophobicContact CG-CD1 4.21Å; Y106-I180 HydrophobicContact CD1-CD1 3.93Å; Y106-I180 HydrophobicContact CD2-CD1 3.62Å; Y106-I180 HydrophobicContact CE1-CD1 3.72Å; Y106-I180 HydrophobicContact CE2-CD1 3.39Å; Y106-I180 HydrophobicContact CE2-CG1 4.33Å; Y106-I180 HydrophobicContact CG-CD1 3.89Å; Y106-I180 VanDerWaalsContact CZ-CD1 3.46Å; Y106-L183 HydrophobicContact CE1-CD1 4.14Å; Y106-Y404 WeakPolarHBondContact CE2-OH 3.38Å; Y106-Y404 PolarHBondContact OH-OH 3.42Å
107	V	98.2	Very high	96.5	Very high	13 Å²	13	18.5 Å²	18.5	8%	0.079	10%	0.102	C	C	.	.	H	α-helix	trans	-66.2	-45.7	175.1	172.2	0	0	0	0	111.4	A103 A111 F154 W157 A158	A103-V107 VanDerWaalsContact O-CB 3.25Å; A103-V107 WeakPolarHBondContact O-CB 3.4Å; A103-V107 WeakPolarHBondContact O-CG2 3.35Å; A103-V107 PolarHBondContact O-N 3.24Å; V107-A111 WeakPolarHBondContact O-CB 3.49Å; V107-A111 PolarHBondContact O-N 3.43Å; V107-F154 HydrophobicContact CG1-CB 4.21Å; V107-F154 HydrophobicContact CG1-CD2 4.5Å; V107-W157 HydrophobicContact CG2-CB 3.84Å; V107-A158 HydrophobicContact CG2-CB 4.01Å
108	A	97.9	Very high	96.3	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.008	10%	0.095	C	C	.	.	H	α-helix	trans	-65.3	-42.8	177.5	0	0	0	0	0	111.6	I73 I74 L104 D105 A111 S112	I73-A108 HydrophobicContact CB-CB 4.26Å; I73-A108 HydrophobicContact CG2-CB 3.86Å; I74-A108 HydrophobicContact CD1-CB 4.4Å; I74-A108 HydrophobicContact CG1-CB 4.03Å; L104-A108 VanDerWaalsContact O-CB 3.27Å; L104-A108 WeakPolarHBondContact O-CB 3.06Å; L104-A108 PolarHBondContact O-N 3.18Å; D105-A108 PolarHBondContact O-N 2.88Å; A108-A111 PolarHBondContact O-N 2.94Å; A108-S112 WeakPolarHBondContact O-CB 3.47Å; A108-S112 PolarHBondContact O-N 3.36Å
109	S	96.7	Very high	96	Very high	15 Å²	15	18.5 Å²	18.5	11%	0.105	10%	0.096	C	C	.	.	H	α-helix	trans	-57.4	-54.3	174.1	-77.5	0	0	0	0	112.5	D105 A111 S112 V113	D105-S109 WeakPolarHBondContact O-CB 3.14Å; D105-S109 PolarHBondContact O-N 3.06Å; D105-S109 PolarHBondContact O-OG 3.15Å; S109-A111 VanDerWaalsContact C-N 3.3Å; S109-A111 PolarHBondContact O-N 2.98Å; S109-S112 WeakPolarHBondContact O-CA 3.27Å; S109-S112 VanDerWaalsContact O-CB 3.22Å; S109-S112 WeakPolarHBondContact O-CB 3.26Å; S109-S112 PolarHBondContact O-N 3.48Å; S109-V113 PolarHBondContact O-N 3.22Å
110	N	96.5	Very high	95.8	Very high	17 Å²	17	18.2 Å²	18.2	9%	0.091	10%	0.096	C	C	.	.	H	α-helix	trans	-64.4	-36.4	179.5	-166.3	97.9	0	0	0	111.6	Y106 S112 V113 M114 S153 W157	Y106-N110 WeakPolarHBondContact O-CB 3.35Å; Y106-N110 PolarHBondContact O-N 2.88Å; N110-S112 VanDerWaalsContact C-N 3.3Å; N110-S112 PolarHBondContact O-N 3.01Å; N110-V113 PolarHBondContact O-N 2.88Å; N110-M114 WeakPolarHBondContact O-CB 3.38Å; N110-M114 VanDerWaalsContact O-CG 3.31Å; N110-M114 WeakPolarHBondContact O-CG 3.04Å; N110-M114 PolarHBondContact O-N 3.43Å; N110-S153 PolarHBondContact ND2-OG 3.38Å; N110-W157 VanDerWaalsContact CG-NE1 3.29Å; N110-W157 PolarHBondContact OD1-NE1 3.48Å
111	A	96.6	Very high	95.5	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-64.8	-34.4	172.6	0	0	0	0	0	112	V107 A108 S109 N115 W150 S153	V107-A111 WeakPolarHBondContact O-CB 3.49Å; V107-A111 PolarHBondContact O-N 3.43Å; A108-A111 PolarHBondContact O-N 2.94Å; S109-A111 VanDerWaalsContact C-N 3.3Å; S109-A111 PolarHBondContact O-N 2.98Å; A111-N115 WeakPolarHBondContact O-CB 2.74Å; A111-N115 PolarHBondContact O-N 2.95Å; A111-N115 PolarHBondContact O-ND2 3.47Å; A111-W150 HydrophobicContact CB-CD2 3.75Å; A111-W150 HydrophobicContact CB-CE3 3.74Å; A111-W150 HydrophobicContact CB-CG 4.35Å; A111-W150 HydrophobicContact CB-CH2 4.1Å; A111-W150 HydrophobicContact CB-CZ2 4.11Å; A111-W150 HydrophobicContact CB-CZ3 3.92Å; A111-S153 WeakPolarHBondContact CA-OG 3.29Å; A111-S153 PolarHBondContact N-OG 2.89Å; A111-S153 VanDerWaalsContact N-OG 3.16Å
112	S	94.9	Very high	95.1	Very high	1 Å²	1	16.7 Å²	16.7	1%	0.007	9%	0.086	C	C	.	.	H	α-helix	trans	-62.6	-51.2	172.8	-169.1	0	0	0	0	111	L67 D71 A108 S109 N110 M114 N115 L116	L67-S112 WeakPolarHBondContact CD1-OG 3.5Å; D71-S112 PolarHBondContact OD1-OG 3.41Å; A108-S112 WeakPolarHBondContact O-CB 3.47Å; A108-S112 PolarHBondContact O-N 3.36Å; S109-S112 WeakPolarHBondContact O-CA 3.27Å; S109-S112 VanDerWaalsContact O-CB 3.22Å; S109-S112 WeakPolarHBondContact O-CB 3.26Å; S109-S112 PolarHBondContact O-N 3.48Å; N110-S112 VanDerWaalsContact C-N 3.3Å; N110-S112 PolarHBondContact O-N 3.01Å; S112-M114 PolarHBondContact O-N 3.1Å; S112-N115 PolarHBondContact O-N 2.92Å; S112-L116 PolarHBondContact O-N 3.47Å
113	V	94.7	Very high	94.6	Very high	4 Å²	4	18.3 Å²	18.3	2%	0.024	9%	0.091	C	C	.	.	H	α-helix	trans	-57.7	-48	175.4	-177.9	0	0	0	0	111.8	S109 N110 N115 L116 L117 P200 F374 W378	S109-V113 PolarHBondContact O-N 3.22Å; N110-V113 PolarHBondContact O-N 2.88Å; V113-N115 VanDerWaalsContact C-N 3.3Å; V113-N115 PolarHBondContact O-N 2.99Å; V113-L116 WeakPolarHBondContact O-CB 3.41Å; V113-L116 PolarHBondContact O-N 2.96Å; V113-L116 VanDerWaalsContact O-N 3.12Å; V113-L117 PolarHBondContact O-N 3.4Å; V113-P200 HydrophobicContact CG1-CB 3.89Å; V113-P200 HydrophobicContact CG1-CG 4.35Å; V113-F374 HydrophobicContact CB-CZ 4.46Å; V113-F374 HydrophobicContact CG1-CZ 4.1Å; V113-F374 HydrophobicContact CG2-CE2 3.82Å; V113-F374 HydrophobicContact CG2-CZ 3.78Å; V113-W378 HydrophobicContact CG2-CZ3 4.37Å
114	M	94.7	Very high	94.2	Very high	50 Å²	50	20.1 Å²	20.1	25%	0.246	10%	0.097	C	C	.	.	H	α-helix	trans	-65.1	-32.8	179.2	-71	-64.6	-76.9	0	0	112.3	N110 S112 L117 L118 A149	N110-M114 WeakPolarHBondContact O-CB 3.38Å; N110-M114 VanDerWaalsContact O-CG 3.31Å; N110-M114 WeakPolarHBondContact O-CG 3.04Å; N110-M114 PolarHBondContact O-N 3.43Å; S112-M114 PolarHBondContact O-N 3.1Å; M114-L117 PolarHBondContact O-N 2.92Å; M114-L117 HydrophobicContact SD-CD2 4.1Å; M114-L118 WeakPolarHBondContact O-CB 3.27Å; M114-L118 VanDerWaalsContact O-CG 3.27Å; M114-L118 WeakPolarHBondContact O-CG 3.31Å; M114-L118 PolarHBondContact O-N 2.92Å; M114-A149 HydrophobicContact CB-CB 3.85Å
115	N	93.6	Very high	93.9	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-68.2	-37.7	171.8	-84.4	-74.9	0	0	0	112.3	S66 L67 A111 S112 V113 L118 I119	S66-N115 WeakPolarHBondContact CB-OD1 3.43Å; S66-N115 PolarHBondContact OG-ND2 3.46Å; S66-N115 PolarHBondContact OG-OD1 3.43Å; L67-N115 HydrophobicContact CB-CB 4.4Å; A111-N115 WeakPolarHBondContact O-CB 2.74Å; A111-N115 PolarHBondContact O-N 2.95Å; A111-N115 PolarHBondContact O-ND2 3.47Å; S112-N115 PolarHBondContact O-N 2.92Å; V113-N115 VanDerWaalsContact C-N 3.3Å; V113-N115 PolarHBondContact O-N 2.99Å; N115-L118 PolarHBondContact O-N 2.89Å; N115-I119 WeakPolarHBondContact O-CB 3.31Å; N115-I119 WeakPolarHBondContact O-CD1 3.31Å; N115-I119 WeakPolarHBondContact O-CG1 3.43Å; N115-I119 PolarHBondContact O-N 2.67Å
116	L	91.6	Very high	93.3	Very high	2 Å²	2	19.5 Å²	19.5	1%	0.01	9%	0.093	C	C	.	.	H	α-helix	trans	-63.8	-38.9	172.5	-68.6	174.1	0	0	0	112.4	L67 S112 V113 I119 S120 M204 I370 F374	L67-L116 HydrophobicContact CD2-CD2 3.59Å; L67-L116 HydrophobicContact CD2-CG 4.19Å; S112-L116 PolarHBondContact O-N 3.47Å; V113-L116 WeakPolarHBondContact O-CB 3.41Å; V113-L116 PolarHBondContact O-N 2.96Å; V113-L116 VanDerWaalsContact O-N 3.12Å; L116-I119 PolarHBondContact O-N 2.86Å; L116-S120 PolarHBondContact O-N 3.19Å; L116-S120 PolarHBondContact O-OG 2.88Å; L116-M204 HydrophobicContact CB-SD 3.76Å; L116-I370 HydrophobicContact CD2-CG2 3.46Å; L116-I370 VanDerWaalsContact CD2-CG2 3.46Å; L116-F374 HydrophobicContact CD1-CB 3.96Å; L116-F374 HydrophobicContact CD1-CD1 4.24Å; L116-F374 HydrophobicContact CD1-CD2 3.53Å; L116-F374 HydrophobicContact CD1-CE2 4.08Å; L116-F374 HydrophobicContact CD1-CG 3.62Å
117	L	93.5	Very high	92.7	Very high	25 Å²	25	18.7 Å²	18.7	13%	0.131	9%	0.091	C	C	.	.	H	α-helix	trans	-65.4	-45.8	174.3	-173.7	63.4	0	0	0	111.5	V113 M114 I119 S120 F121 V203 M204	V113-L117 PolarHBondContact O-N 3.4Å; M114-L117 PolarHBondContact O-N 2.92Å; M114-L117 HydrophobicContact SD-CD2 4.1Å; L117-I119 VanDerWaalsContact C-N 3.35Å; L117-I119 PolarHBondContact O-N 2.76Å; L117-S120 WeakPolarHBondContact O-CB 3.32Å; L117-S120 PolarHBondContact O-N 3.09Å; L117-S120 VanDerWaalsContact O-N 3.1Å; L117-F121 HydrophobicContact CD1-CD2 4.19Å; L117-F121 HydrophobicContact CD1-CE2 3.82Å; L117-F121 HydrophobicContact CD2-CE2 4.48Å; L117-F121 HydrophobicContact CG-CD2 4.07Å; L117-F121 HydrophobicContact CG-CE2 3.92Å; L117-F121 WeakPolarHBondContact O-CD2 3.3Å; L117-F121 PolarHBondContact O-N 3.42Å; L117-V203 HydrophobicContact CD1-CB 3.98Å; L117-V203 HydrophobicContact CD1-CG1 3.69Å; L117-M204 HydrophobicContact CB-SD 4.46Å; L117-M204 HydrophobicContact CD1-CG 3.75Å
118	L	93.3	Very high	92.1	Very high	30 Å²	30	19.8 Å²	19.8	16%	0.157	10%	0.098	C	C	.	.	H	α-helix	trans	-61.6	-39.7	174.5	-73.3	175.9	0	0	0	112.6	F63 M114 N115 S120 F121 D122 M145 A149	F63-L118 HydrophobicContact CD1-CB 4.22Å; F63-L118 HydrophobicContact CE1-CB 4.19Å; F63-L118 HydrophobicContact CE1-CD1 4.35Å; M114-L118 WeakPolarHBondContact O-CB 3.27Å; M114-L118 VanDerWaalsContact O-CG 3.27Å; M114-L118 WeakPolarHBondContact O-CG 3.31Å; M114-L118 PolarHBondContact O-N 2.92Å; N115-L118 PolarHBondContact O-N 2.89Å; L118-S120 VanDerWaalsContact C-N 3.32Å; L118-F121 PolarHBondContact O-N 3.24Å; L118-D122 WeakPolarHBondContact O-CB 3.28Å; L118-D122 PolarHBondContact O-N 3.49Å; L118-M145 HydrophobicContact CD1-CB 4.24Å; L118-M145 WeakPolarHBondContact CD1-O 3.36Å; L118-M145 HydrophobicContact CD2-CB 4.32Å; L118-M145 HydrophobicContact CD2-CE 3.83Å; L118-A149 HydrophobicContact CD1-CB 3.83Å
119	I	91.3	Very high	91.6	Very high	8 Å²	8	26.1 Å²	26.1	4%	0.041	12%	0.122	C	C	.	.	H	α-helix	trans	-59.9	-44.6	172	-72.7	161	0	0	0	109.8	F63 L64 L67 N115 L116 L117 F121 D122 R123 L367	F63-I119 HydrophobicContact CB-CD1 4.02Å; F63-I119 HydrophobicContact CB-CG1 3.52Å; F63-I119 HydrophobicContact CG-CG1 4.23Å; L64-I119 HydrophobicContact CD2-CD1 3.78Å; L67-I119 HydrophobicContact CD2-CD1 3.98Å; N115-I119 WeakPolarHBondContact O-CB 3.31Å; N115-I119 WeakPolarHBondContact O-CD1 3.31Å; N115-I119 WeakPolarHBondContact O-CG1 3.43Å; N115-I119 PolarHBondContact O-N 2.67Å; L116-I119 PolarHBondContact O-N 2.86Å; L117-I119 VanDerWaalsContact C-N 3.35Å; L117-I119 PolarHBondContact O-N 2.76Å; I119-F121 PolarHBondContact O-N 2.95Å; I119-D122 PolarHBondContact O-N 3.47Å; I119-R123 HydrophobicContact CG2-CG 4.42Å; I119-R123 WeakPolarHBondContact O-CB 3.43Å; I119-R123 WeakPolarHBondContact O-CG 3.42Å; I119-R123 PolarHBondContact O-N 3.15Å; I119-R123 VanDerWaalsContact O-N 3.08Å; I119-L367 HydrophobicContact CG2-CD2 3.62Å
120	S	91.6	Very high	90.8	Very high	7 Å²	7	27.6 Å²	27.6	5%	0.049	13%	0.13	C	C	.	.	H	α-helix	trans	-62.3	-44.1	179.3	-60.4	0	0	0	0	112.2	L116 L117 L118 R123 Y124	L116-S120 PolarHBondContact O-N 3.19Å; L116-S120 PolarHBondContact O-OG 2.88Å; L117-S120 WeakPolarHBondContact O-CB 3.32Å; L117-S120 PolarHBondContact O-N 3.09Å; L117-S120 VanDerWaalsContact O-N 3.1Å; L118-S120 VanDerWaalsContact C-N 3.32Å; S120-R123 PolarHBondContact O-N 3.02Å; S120-Y124 WeakPolarHBondContact O-CB 3.5Å; S120-Y124 PolarHBondContact O-N 2.94Å
121	F	91.9	Very high	90	Very high	67 Å²	67	34 Å²	34	29%	0.294	16%	0.164	S	C	.	.	H	α-helix	trans	-66.6	-46.4	175.1	-82.7	-69.5	0	0	0	113.7	L117 L118 I119 R123 Y124 F125 V203 L207	L117-F121 HydrophobicContact CD1-CD2 4.19Å; L117-F121 HydrophobicContact CD1-CE2 3.82Å; L117-F121 HydrophobicContact CD2-CE2 4.48Å; L117-F121 HydrophobicContact CG-CD2 4.07Å; L117-F121 HydrophobicContact CG-CE2 3.92Å; L117-F121 WeakPolarHBondContact O-CD2 3.3Å; L117-F121 PolarHBondContact O-N 3.42Å; L118-F121 PolarHBondContact O-N 3.24Å; I119-F121 PolarHBondContact O-N 2.95Å; F121-R123 PolarHBondContact O-N 3.45Å; F121-Y124 PolarHBondContact O-N 2.88Å; F121-F125 HydrophobicContact CB-CE2 4.34Å; F121-F125 AromaticContact CD1-CE2 3.86Å; F121-F125 HydrophobicContact CD1-CE2 3.86Å; F121-F125 HydrophobicContact CD1-CZ 4.15Å; F121-F125 VanDerWaalsContact O-CD2 3.24Å; F121-F125 WeakPolarHBondContact O-CD2 3.41Å; F121-F125 PolarHBondContact O-N 2.94Å; F121-V203 HydrophobicContact CE2-CG1 3.87Å; F121-V203 HydrophobicContact CZ-CG1 3.67Å; F121-L207 HydrophobicContact CD1-CD1 3.74Å; F121-L207 HydrophobicContact CD1-CD2 4.16Å; F121-L207 HydrophobicContact CD2-CD1 4Å; F121-L207 HydrophobicContact CE1-CD1 3.77Å; F121-L207 HydrophobicContact CE1-CD2 4.03Å; F121-L207 HydrophobicContact CE1-CG 4.46Å; F121-L207 HydrophobicContact CE2-CD1 4.03Å; F121-L207 HydrophobicContact CG-CD1 3.86Å; F121-L207 HydrophobicContact CZ-CD1 3.92Å
122	D	90.2	Very high	89.5	Confident	1 Å²	1	37.2 Å²	37.2	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-54.3	-38.3	175.9	172.1	74.7	0	0	0	111.3	F63 L118 I119 S126 Y133 R137	F63-D122 HydrophobicContact CE2-CB 4Å; L118-D122 WeakPolarHBondContact O-CB 3.28Å; L118-D122 PolarHBondContact O-N 3.49Å; I119-D122 PolarHBondContact O-N 3.47Å; D122-S126 WeakPolarHBondContact O-CA 3.27Å; D122-S126 WeakPolarHBondContact O-CB 3.18Å; D122-S126 PolarHBondContact O-N 3.26Å; D122-S126 PolarHBondContact O-OG 3.47Å; D122-Y133 PolarHBondContact OD1-OH 3.45Å; D122-R137 WeakPolarHBondContact OD1-CD 3.46Å; D122-R137 IonicContact OD1-CZ 3.28Å; D122-R137 IonicContact OD1-NE 2.73Å; D122-R137 IonicContact OD1-NH1 3.96Å; D122-R137 PolarHBondContact OD1-NH1 2.97Å; D122-R137 IonicContact OD2-NH1 3.81Å; D122-R137 PolarHBondContact OD2-NH1 3.28Å
123	R	87.8	Confident	89.1	Confident	38 Å²	38	39.6 Å²	39.6	14%	0.143	20%	0.196	C	C	.	.	H	α-helix	trans	-80.6	-39.6	-178.2	-62	-65.4	175.6	133.8	15.9	112.4	I119 S120 F121 F125 S126 V127 I211 L367	I119-R123 HydrophobicContact CG2-CG 4.42Å; I119-R123 WeakPolarHBondContact O-CB 3.43Å; I119-R123 WeakPolarHBondContact O-CG 3.42Å; I119-R123 PolarHBondContact O-N 3.15Å; I119-R123 VanDerWaalsContact O-N 3.08Å; S120-R123 PolarHBondContact O-N 3.02Å; F121-R123 PolarHBondContact O-N 3.45Å; R123-F125 PolarHBondContact O-N 3.14Å; R123-S126 PolarHBondContact O-N 3.49Å; R123-V127 WeakPolarHBondContact O-CB 3.31Å; R123-V127 WeakPolarHBondContact O-CG2 3.41Å; R123-V127 PolarHBondContact O-N 3Å; R123-I211 HydrophobicContact CB-CD1 4.18Å; R123-L367 HydrophobicContact CB-CD1 3.61Å; R123-L367 HydrophobicContact CG-CD1 3.51Å; R123-L367 HydrophobicContact CG-CD2 3.96Å; R123-L367 HydrophobicContact CG-CG 4.39Å
124	Y	90.1	Very high	88.5	Confident	44 Å²	44	44 Å²	44	17%	0.173	21%	0.212	C	C	.	.	H	α-helix	trans	-56.6	-50.3	171.5	174.8	-114.3	0	0	0	111.3	S120 F121 V127 T128 L207 R210 I211	S120-Y124 WeakPolarHBondContact O-CB 3.5Å; S120-Y124 PolarHBondContact O-N 2.94Å; F121-Y124 PolarHBondContact O-N 2.88Å; Y124-V127 PolarHBondContact O-N 2.98Å; Y124-T128 HydrophobicContact CD2-CG2 3.86Å; Y124-T128 HydrophobicContact CE2-CG2 3.43Å; Y124-T128 VanDerWaalsContact CE2-CG2 3.43Å; Y124-T128 WeakPolarHBondContact O-CB 3.26Å; Y124-T128 WeakPolarHBondContact O-CG2 3.41Å; Y124-T128 PolarHBondContact O-N 2.9Å; Y124-T128 PolarHBondContact O-OG1 2.96Å; Y124-L207 HydrophobicContact CD1-CD2 3.63Å; Y124-L207 HydrophobicContact CD2-CD2 4.18Å; Y124-L207 HydrophobicContact CE1-CD2 4.17Å; Y124-L207 HydrophobicContact CG-CD2 3.63Å; Y124-R210 HydrophobicContact CD2-CB 4.19Å; Y124-R210 HydrophobicContact CE2-CB 3.74Å; Y124-I211 HydrophobicContact CD2-CG1 4.17Å
125	F	90.3	Very high	87.9	Confident	47 Å²	47	45.7 Å²	45.7	21%	0.206	23%	0.233	C	C	.	.	H	α-helix	trans	-72.5	-33.9	177.9	-61.2	-48.2	0	0	0	113.3	F121 R123 V127 R129 Y133	F121-F125 HydrophobicContact CB-CE2 4.34Å; F121-F125 AromaticContact CD1-CE2 3.86Å; F121-F125 HydrophobicContact CD1-CE2 3.86Å; F121-F125 HydrophobicContact CD1-CZ 4.15Å; F121-F125 VanDerWaalsContact O-CD2 3.24Å; F121-F125 WeakPolarHBondContact O-CD2 3.41Å; F121-F125 PolarHBondContact O-N 2.94Å; R123-F125 PolarHBondContact O-N 3.14Å; F125-V127 VanDerWaalsContact C-N 3.28Å; F125-V127 PolarHBondContact O-N 2.9Å; F125-R129 CarbonylContact O-C 3.54Å; F125-R129 WeakPolarHBondContact O-CA 3.44Å; F125-R129 PolarHBondContact O-N 3.3Å; F125-Y133 HydrophobicContact CB-CD1 3.69Å; F125-Y133 HydrophobicContact CB-CD2 3.66Å; F125-Y133 HydrophobicContact CB-CE1 3.89Å; F125-Y133 HydrophobicContact CB-CE2 3.86Å; F125-Y133 HydrophobicContact CB-CG 3.57Å; F125-Y133 HydrophobicContact CD2-CE2 4.14Å; F125-Y133 HydrophobicContact CG-CD2 4.34Å; F125-Y133 HydrophobicContact CG-CE2 4.35Å
126	S	85.6	Confident	87.5	Confident	7 Å²	7	52.7 Å²	52.7	5%	0.049	26%	0.264	C	S	.	.	H	α-helix	trans	-66.4	-26.8	173.3	-70.7	0	0	0	0	113.3	D122 R123 R134 R137	D122-S126 WeakPolarHBondContact O-CA 3.27Å; D122-S126 WeakPolarHBondContact O-CB 3.18Å; D122-S126 PolarHBondContact O-N 3.26Å; D122-S126 PolarHBondContact O-OG 3.47Å; R123-S126 PolarHBondContact O-N 3.49Å; S126-R134 PolarHBondContact O-NE 3.23Å; S126-R134 PolarHBondContact O-NH2 3.01Å; S126-R137 PolarHBondContact OG-NH1 3.48Å
127	V	85.4	Confident	87.2	Confident	16 Å²	16	55.2 Å²	55.2	10%	0.097	27%	0.273	C	S	.	.	H	α-helix	trans	-84.1	-60.1	173.4	172.6	0	0	0	0	109.8	R123 Y124 F125 R129 P130 I211 E214 R218	R123-V127 WeakPolarHBondContact O-CB 3.31Å; R123-V127 WeakPolarHBondContact O-CG2 3.41Å; R123-V127 PolarHBondContact O-N 3Å; Y124-V127 PolarHBondContact O-N 2.98Å; F125-V127 VanDerWaalsContact C-N 3.28Å; F125-V127 PolarHBondContact O-N 2.9Å; V127-R129 PolarHBondContact O-N 3.27Å; V127-P130 WeakPolarHBondContact O-CD 3.23Å; V127-I211 HydrophobicContact CG2-CG2 4.34Å; V127-E214 HydrophobicContact CG1-CB 4.39Å; V127-E214 HydrophobicContact CG1-CG 3.87Å; V127-R218 PolarHBondContact O-NH1 3.04Å; V127-R218 PolarHBondContact O-NH2 3.17Å
128	T	86.4	Confident	87.1	Confident	35 Å²	35	56.7 Å²	56.7	22%	0.215	28%	0.284	C	S	.	.	H	α-helix	trans	-63.9	-41	-173.8	53.2	0	0	0	0	114.1	Y124 P130 E214 R218	Y124-T128 HydrophobicContact CD2-CG2 3.86Å; Y124-T128 HydrophobicContact CE2-CG2 3.43Å; Y124-T128 VanDerWaalsContact CE2-CG2 3.43Å; Y124-T128 WeakPolarHBondContact O-CB 3.26Å; Y124-T128 WeakPolarHBondContact O-CG2 3.41Å; Y124-T128 PolarHBondContact O-N 2.9Å; Y124-T128 PolarHBondContact O-OG1 2.96Å; T128-P130 WeakPolarHBondContact O-CD 3.44Å; T128-E214 HydrophobicContact CG2-CG 4.26Å; T128-R218 PolarHBondContact O-NH2 3.35Å
129	R	86.1	Confident	86.9	Confident	135 Å²	135	58.2 Å²	58.2	51%	0.509	30%	0.295	S	S	.	.	S	Bend	trans	-117.6	61.5	-173.7	-64.1	-164.6	-79.8	-162.3	-1.2	111.9	F125 V127 L131 Y133	F125-R129 CarbonylContact O-C 3.54Å; F125-R129 WeakPolarHBondContact O-CA 3.44Å; F125-R129 PolarHBondContact O-N 3.3Å; V127-R129 PolarHBondContact O-N 3.27Å; R129-L131 VanDerWaalsContact C-N 3.3Å; R129-L131 PolarHBondContact O-N 3.45Å; R129-Y133 VanDerWaalsContact O-CB 3.3Å; R129-Y133 WeakPolarHBondContact O-CB 3.43Å; R129-Y133 PolarHBondContact O-N 3.32Å
130	P	79.9	Confident	86.9	Confident	45 Å²	45	68.3 Å²	68.3	29%	0.292	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-17.3	-163.6	31.1	-37.5	0	0	0	114.6	V127 T128 R134	V127-P130 WeakPolarHBondContact O-CD 3.23Å; T128-P130 WeakPolarHBondContact O-CD 3.44Å; P130-R134 WeakPolarHBondContact O-CB 3.43Å; P130-R134 VanDerWaalsContact O-CD 3.32Å; P130-R134 WeakPolarHBondContact O-CD 3.38Å; P130-R134 WeakPolarHBondContact O-CG 3.34Å
131	L	80.8	Confident	87	Confident	153 Å²	153	74.9 Å²	74.9	80%	0.801	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-49.1	176.5	-63	178.2	0	0	0	111.8	R129 A135	R129-L131 VanDerWaalsContact C-N 3.3Å; R129-L131 PolarHBondContact O-N 3.45Å; L131-A135 WeakPolarHBondContact O-CB 3.39Å
132	S	85.9	Confident	87	Confident	67 Å²	67	71.8 Å²	71.8	47%	0.469	34%	0.343	S	S	.	.	H	α-helix	trans	-79.3	-41	-175.4	52.3	0	0	0	0	113.7	K136	S132-K136 WeakPolarHBondContact O-CG 3.36Å; S132-K136 PolarHBondContact O-N 2.88Å
133	Y	87.4	Confident	87.1	Confident	51 Å²	51	74.1 Å²	74.1	20%	0.2	36%	0.363	C	S	.	.	H	α-helix	trans	-75.8	-49.8	179.9	-175.2	-102.2	0	0	0	111.9	D122 F125 R129 A135 K136 R137	D122-Y133 PolarHBondContact OD1-OH 3.45Å; F125-Y133 HydrophobicContact CB-CD1 3.69Å; F125-Y133 HydrophobicContact CB-CD2 3.66Å; F125-Y133 HydrophobicContact CB-CE1 3.89Å; F125-Y133 HydrophobicContact CB-CE2 3.86Å; F125-Y133 HydrophobicContact CB-CG 3.57Å; F125-Y133 HydrophobicContact CD2-CE2 4.14Å; F125-Y133 HydrophobicContact CG-CD2 4.34Å; F125-Y133 HydrophobicContact CG-CE2 4.35Å; R129-Y133 VanDerWaalsContact O-CB 3.3Å; R129-Y133 WeakPolarHBondContact O-CB 3.43Å; R129-Y133 PolarHBondContact O-N 3.32Å; Y133-A135 PolarHBondContact O-N 3.49Å; Y133-K136 PolarHBondContact O-N 3.43Å; Y133-K136 VanDerWaalsContact O-N 3.1Å; Y133-R137 WeakPolarHBondContact O-CB 3.37Å; Y133-R137 PolarHBondContact O-N 3Å
134	R	80.8	Confident	87.5	Confident	97 Å²	97	78.5 Å²	78.5	37%	0.366	39%	0.388	S	S	.	.	H	α-helix	trans	-59.5	-34.6	-178.5	-63.3	-174.4	-176.4	172.7	-0.4	112.5	S126 P130 E360	S126-R134 PolarHBondContact O-NE 3.23Å; S126-R134 PolarHBondContact O-NH2 3.01Å; P130-R134 WeakPolarHBondContact O-CB 3.43Å; P130-R134 VanDerWaalsContact O-CD 3.32Å; P130-R134 WeakPolarHBondContact O-CD 3.38Å; P130-R134 WeakPolarHBondContact O-CG 3.34Å; R134-E360 IonicContact CZ-OE1 2.77Å; R134-E360 IonicContact NH1-OE1 3.18Å; R134-E360 PolarHBondContact NH1-OE1 3.44Å; R134-E360 IonicContact NH2-OE1 2.7Å; R134-E360 PolarHBondContact NH2-OE1 3.2Å
135	A	82.3	Confident	87.7	Confident	84 Å²	84	79.1 Å²	79.1	69%	0.694	39%	0.393	S	S	*	.	H	α-helix	trans	-72.6	-34.5	176.9	0	0	0	0	0	113.5	L131 Y133 R137	L131-A135 WeakPolarHBondContact O-CB 3.39Å; Y133-A135 PolarHBondContact O-N 3.49Å; A135-R137 VanDerWaalsContact C-N 3.34Å
136	K	85.6	Confident	88	Confident	147 Å²	147	78 Å²	78	64%	0.639	39%	0.389	S	S	*	.	H	α-helix	trans	-85	-2	-179.5	-70.7	-176.4	177	-172.9	0	114.1	S132 Y133 R141	S132-K136 WeakPolarHBondContact O-CG 3.36Å; S132-K136 PolarHBondContact O-N 2.88Å; Y133-K136 PolarHBondContact O-N 3.43Å; Y133-K136 VanDerWaalsContact O-N 3.1Å; K136-R141 PolarHBondContact O-NH1 3.08Å
137	R	85.9	Confident	88.6	Confident	56 Å²	56	79.5 Å²	79.5	21%	0.211	41%	0.406	C	S	.	.			trans	-91.6	111.8	-172.4	-173.3	177.5	69.7	159.5	6.7	112.6	V59 N60 D122 S126 Y133 A135	V59-R137 HydrophobicContact CB-CG 4.31Å; V59-R137 HydrophobicContact CG1-CG 3.88Å; N60-R137 VanDerWaalsContact OD1-CZ 3.25Å; N60-R137 PolarHBondContact OD1-NH1 2.84Å; N60-R137 PolarHBondContact OD1-NH2 3.09Å; D122-R137 WeakPolarHBondContact OD1-CD 3.46Å; D122-R137 IonicContact OD1-CZ 3.28Å; D122-R137 IonicContact OD1-NE 2.73Å; D122-R137 IonicContact OD1-NH1 3.96Å; D122-R137 PolarHBondContact OD1-NH1 2.97Å; D122-R137 IonicContact OD2-NH1 3.81Å; D122-R137 PolarHBondContact OD2-NH1 3.28Å; S126-R137 PolarHBondContact OG-NH1 3.48Å; Y133-R137 WeakPolarHBondContact O-CB 3.37Å; Y133-R137 PolarHBondContact O-N 3Å; A135-R137 VanDerWaalsContact C-N 3.34Å
138	T	91.1	Very high	89.1	Confident	56 Å²	56	83.8 Å²	83.8	34%	0.344	43%	0.428	S	S	.	.			trans	-117.1	156.6	-177.8	66.7	0	0	0	0	112.2	R140 R141 A142	T138-R140 VanDerWaalsContact C-N 3.28Å; T138-R140 PolarHBondContact O-N 2.99Å; T138-R141 PolarHBondContact O-N 3.29Å; T138-R141 PolarHBondContact OG1-N 3.09Å; T138-A142 PolarHBondContact O-N 2.86Å
139	P	89	Confident	89.6	Confident	62 Å²	62	82.3 Å²	82.3	40%	0.403	42%	0.419	S	S	.	.	H	α-helix	trans	-59	-36.7	175.1	-23.6	33.1	0	0	0	113.3	V59 Y62 R141 A142 A143	V59-P139 HydrophobicContact CG2-CG 4.13Å; Y62-P139 HydrophobicContact CE2-CB 4.19Å; P139-R141 PolarHBondContact O-N 3.04Å; P139-A142 PolarHBondContact O-N 3.44Å; P139-A143 WeakPolarHBondContact O-CB 3.48Å; P139-A143 PolarHBondContact O-N 2.86Å
140	R	91.9	Very high	90.2	Very high	220 Å²	220	78.9 Å²	78.9	83%	0.83	41%	0.406	S	S	*	.	H	α-helix	trans	-60.1	-42.3	176.9	-68.3	-175.9	-179.3	170.6	-0.8	112	T138 A143 L144	T138-R140 VanDerWaalsContact C-N 3.28Å; T138-R140 PolarHBondContact O-N 2.99Å; R140-A143 PolarHBondContact O-N 3.46Å; R140-L144 PolarHBondContact O-N 2.91Å
141	R	92.1	Very high	91	Very high	144 Å²	144	81.7 Å²	81.7	54%	0.543	42%	0.418	S	S	.	.	H	α-helix	trans	-67.1	-41.5	176.9	-76.8	178.1	169.2	162.1	-3.7	112.4	K136 T138 P139 L144 M145	K136-R141 PolarHBondContact O-NH1 3.08Å; T138-R141 PolarHBondContact O-N 3.29Å; T138-R141 PolarHBondContact OG1-N 3.09Å; P139-R141 PolarHBondContact O-N 3.04Å; R141-L144 PolarHBondContact O-N 2.9Å; R141-M145 VanDerWaalsContact O-CG 3.27Å; R141-M145 WeakPolarHBondContact O-CG 3.14Å; R141-M145 PolarHBondContact O-N 3.22Å
142	A	91.9	Very high	91.7	Very high	2 Å²	2	77.3 Å²	77.3	2%	0.017	40%	0.398	C	S	.	.	H	α-helix	trans	-65.3	-39.5	175	0	0	0	0	0	112.3	V59 F63 T138 P139 L144 M145 I146	V59-A142 HydrophobicContact CG1-CB 3.44Å; V59-A142 VanDerWaalsContact CG1-CB 3.44Å; F63-A142 HydrophobicContact CE1-CB 4.21Å; F63-A142 HydrophobicContact CE2-CB 4.18Å; F63-A142 HydrophobicContact CZ-CB 3.74Å; T138-A142 PolarHBondContact O-N 2.86Å; P139-A142 PolarHBondContact O-N 3.44Å; A142-L144 VanDerWaalsContact C-N 3.34Å; A142-L144 PolarHBondContact O-N 3.32Å; A142-M145 PolarHBondContact O-N 3.26Å; A142-I146 WeakPolarHBondContact O-CB 3.41Å; A142-I146 WeakPolarHBondContact O-CD1 3.49Å; A142-I146 VanDerWaalsContact O-CG1 3.26Å; A142-I146 WeakPolarHBondContact O-CG1 3.44Å; A142-I146 PolarHBondContact O-N 3.42Å
143	A	93.2	Very high	92.3	Very high	51 Å²	51	74.1 Å²	74.1	42%	0.421	38%	0.376	S	S	.	.	H	α-helix	trans	-62.6	-39.1	174	0	0	0	0	0	112.4	P139 R140 I146 G147	P139-A143 WeakPolarHBondContact O-CB 3.48Å; P139-A143 PolarHBondContact O-N 2.86Å; R140-A143 PolarHBondContact O-N 3.46Å; A143-I146 PolarHBondContact O-N 3.31Å; A143-G147 PolarHBondContact O-N 2.82Å
144	L	95.4	Very high	92.8	Very high	129 Å²	129	77.1 Å²	77.1	68%	0.675	39%	0.39	S	S	*	.	H	α-helix	trans	-64.6	-44.6	173.1	-177.6	66.1	0	0	0	112	R140 R141 A142 I146 G147 L148	R140-L144 PolarHBondContact O-N 2.91Å; R141-L144 PolarHBondContact O-N 2.9Å; A142-L144 VanDerWaalsContact C-N 3.34Å; A142-L144 PolarHBondContact O-N 3.32Å; L144-I146 VanDerWaalsContact C-N 3.32Å; L144-I146 PolarHBondContact O-N 3.22Å; L144-G147 PolarHBondContact O-N 3.35Å; L144-L148 WeakPolarHBondContact O-CB 3.4Å; L144-L148 PolarHBondContact O-N 3.05Å
145	M	94.8	Very high	93.6	Very high	57 Å²	57	76.7 Å²	76.7	28%	0.281	40%	0.398	S	S	.	.	H	α-helix	trans	-61.4	-40.4	176.4	-68.9	162.9	66.2	0	0	111.9	F63 L118 R141 A142 A149	F63-M145 HydrophobicContact CE1-CB 4.27Å; F63-M145 HydrophobicContact CE1-CE 4.31Å; F63-M145 HydrophobicContact CZ-CE 4Å; F63-M145 HydrophobicContact CZ-SD 4.38Å; L118-M145 HydrophobicContact CD1-CB 4.24Å; L118-M145 WeakPolarHBondContact CD1-O 3.36Å; L118-M145 HydrophobicContact CD2-CB 4.32Å; L118-M145 HydrophobicContact CD2-CE 3.83Å; R141-M145 VanDerWaalsContact O-CG 3.27Å; R141-M145 WeakPolarHBondContact O-CG 3.14Å; R141-M145 PolarHBondContact O-N 3.22Å; A142-M145 PolarHBondContact O-N 3.26Å; M145-A149 PolarHBondContact O-N 2.88Å; M145-A149 VanDerWaalsContact O-N 3.08Å
146	I	96.7	Very high	94.1	Very high	23 Å²	23	77 Å²	77	12%	0.118	39%	0.388	C	S	.	.	H	α-helix	trans	-64	-49.7	173.5	-72.6	161.8	0	0	0	110.5	Y62 F63 S66 A142 A143 L144 L148 A149 W150	Y62-I146 WeakPolarHBondContact O-CD1 3.32Å; F63-I146 HydrophobicContact CD1-CD1 3.9Å; F63-I146 HydrophobicContact CD1-CG1 3.7Å; F63-I146 HydrophobicContact CE1-CD1 4.32Å; F63-I146 HydrophobicContact CE1-CG1 4.02Å; S66-I146 WeakPolarHBondContact OG-CG2 3.33Å; A142-I146 WeakPolarHBondContact O-CB 3.41Å; A142-I146 WeakPolarHBondContact O-CD1 3.49Å; A142-I146 VanDerWaalsContact O-CG1 3.26Å; A142-I146 WeakPolarHBondContact O-CG1 3.44Å; A142-I146 PolarHBondContact O-N 3.42Å; A143-I146 PolarHBondContact O-N 3.31Å; L144-I146 VanDerWaalsContact C-N 3.32Å; L144-I146 PolarHBondContact O-N 3.22Å; I146-L148 VanDerWaalsContact C-N 3.3Å; I146-L148 PolarHBondContact O-N 3.14Å; I146-A149 WeakPolarHBondContact O-CB 3.47Å; I146-A149 PolarHBondContact O-N 3.12Å; I146-A149 VanDerWaalsContact O-N 3.1Å; I146-W150 VanDerWaalsContact O-CD1 3.3Å; I146-W150 PolarHBondContact O-N 3.37Å
147	G	97.2	Very high	94.6	Very high	39 Å²	39	70.7 Å²	70.7	40%	0.402	36%	0.359	S	S	.	.	H	α-helix	trans	-58.5	-40.6	178.5	0	0	0	0	0	112.7	A143 L144 W150 L151	A143-G147 PolarHBondContact O-N 2.82Å; L144-G147 PolarHBondContact O-N 3.35Å; G147-W150 PolarHBondContact O-N 2.68Å; G147-L151 VanDerWaalsContact O-CB 3.29Å; G147-L151 WeakPolarHBondContact O-CB 3.39Å; G147-L151 PolarHBondContact O-N 3.01Å
148	L	96.7	Very high	95.2	Very high	107 Å²	107	68.2 Å²	68.2	56%	0.56	35%	0.351	S	S	*	.	H	α-helix	trans	-61.6	-45	173.1	-169.5	80.8	0	0	0	111.8	L144 I146 W150 L151 V152	L144-L148 WeakPolarHBondContact O-CB 3.4Å; L144-L148 PolarHBondContact O-N 3.05Å; I146-L148 VanDerWaalsContact C-N 3.3Å; I146-L148 PolarHBondContact O-N 3.14Å; L148-W150 PolarHBondContact O-N 3.44Å; L148-L151 PolarHBondContact O-N 3.17Å; L148-V152 HydrophobicContact CG-CG2 4.36Å; L148-V152 WeakPolarHBondContact O-CB 3.45Å; L148-V152 VanDerWaalsContact O-CG2 3.31Å; L148-V152 WeakPolarHBondContact O-CG2 3.43Å; L148-V152 PolarHBondContact O-N 3.26Å
149	A	96.3	Very high	95.4	Very high	3 Å²	3	67.8 Å²	67.8	3%	0.025	35%	0.349	C	S	.	.	H	α-helix	trans	-62.5	-40.7	178.2	0	0	0	0	0	112.7	M114 L118 M145 I146 S153	M114-A149 HydrophobicContact CB-CB 3.85Å; L118-A149 HydrophobicContact CD1-CB 3.83Å; M145-A149 PolarHBondContact O-N 2.88Å; M145-A149 VanDerWaalsContact O-N 3.08Å; I146-A149 WeakPolarHBondContact O-CB 3.47Å; I146-A149 PolarHBondContact O-N 3.12Å; I146-A149 VanDerWaalsContact O-N 3.1Å; A149-S153 WeakPolarHBondContact O-CB 3.43Å; A149-S153 PolarHBondContact O-N 2.93Å; A149-S153 VanDerWaalsContact O-N 3.08Å; A149-S153 PolarHBondContact O-OG 3.26Å
150	W	98.4	Very high	95.7	Very high	64 Å²	64	66.3 Å²	66.3	24%	0.242	34%	0.342	C	S	.	.	H	α-helix	trans	-66.9	-43.4	173.1	-79.5	96.2	0	0	0	112.1	S66 A70 I73 A111 I146 G147 L148 S153 F154	S66-W150 PolarHBondContact OG-NE1 3.03Å; A70-W150 HydrophobicContact CB-CH2 3.84Å; A70-W150 HydrophobicContact CB-CZ2 3.84Å; I73-W150 HydrophobicContact CD1-CH2 4Å; I73-W150 HydrophobicContact CD1-CZ3 4.39Å; A111-W150 HydrophobicContact CB-CD2 3.75Å; A111-W150 HydrophobicContact CB-CE3 3.74Å; A111-W150 HydrophobicContact CB-CG 4.35Å; A111-W150 HydrophobicContact CB-CH2 4.1Å; A111-W150 HydrophobicContact CB-CZ2 4.11Å; A111-W150 HydrophobicContact CB-CZ3 3.92Å; I146-W150 VanDerWaalsContact O-CD1 3.3Å; I146-W150 PolarHBondContact O-N 3.37Å; G147-W150 PolarHBondContact O-N 2.68Å; L148-W150 PolarHBondContact O-N 3.44Å; W150-S153 PolarHBondContact O-N 3.13Å; W150-F154 WeakPolarHBondContact O-CB 3.49Å; W150-F154 PolarHBondContact O-N 3.36Å
151	L	97.8	Very high	95.9	Very high	103 Å²	103	56.6 Å²	56.6	54%	0.539	31%	0.307	S	S	.	.	H	α-helix	trans	-62.7	-47.2	178.7	179.6	62.9	0	0	0	112.1	G147 L148 S153 F154 V155	G147-L151 VanDerWaalsContact O-CB 3.29Å; G147-L151 WeakPolarHBondContact O-CB 3.39Å; G147-L151 PolarHBondContact O-N 3.01Å; L148-L151 PolarHBondContact O-N 3.17Å; L151-S153 VanDerWaalsContact C-N 3.34Å; L151-S153 PolarHBondContact O-N 3.05Å; L151-F154 PolarHBondContact O-N 3.16Å; L151-V155 HydrophobicContact CD1-CG2 3.95Å; L151-V155 HydrophobicContact CG-CG2 4.44Å; L151-V155 WeakPolarHBondContact O-CB 3.49Å; L151-V155 WeakPolarHBondContact O-CG2 3.4Å; L151-V155 PolarHBondContact O-N 2.94Å
152	V	96.3	Very high	96.1	Very high	62 Å²	62	51.7 Å²	51.7	38%	0.376	29%	0.291	S	S	.	.	H	α-helix	trans	-62.1	-43.1	176.4	170.1	0	0	0	0	110.7	L148 F154 L156	L148-V152 HydrophobicContact CG-CG2 4.36Å; L148-V152 WeakPolarHBondContact O-CB 3.45Å; L148-V152 VanDerWaalsContact O-CG2 3.31Å; L148-V152 WeakPolarHBondContact O-CG2 3.43Å; L148-V152 PolarHBondContact O-N 3.26Å; V152-F154 PolarHBondContact O-N 3.39Å; V152-L156 WeakPolarHBondContact O-CB 3.44Å; V152-L156 PolarHBondContact O-N 3.09Å
153	S	97.6	Very high	96.3	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-62	-43.5	176.4	-56.6	0	0	0	0	111.9	N110 A111 A149 W150 L151 W157	N110-S153 PolarHBondContact ND2-OG 3.38Å; A111-S153 WeakPolarHBondContact CA-OG 3.29Å; A111-S153 PolarHBondContact N-OG 2.89Å; A111-S153 VanDerWaalsContact N-OG 3.16Å; A149-S153 WeakPolarHBondContact O-CB 3.43Å; A149-S153 PolarHBondContact O-N 2.93Å; A149-S153 VanDerWaalsContact O-N 3.08Å; A149-S153 PolarHBondContact O-OG 3.26Å; W150-S153 PolarHBondContact O-N 3.13Å; L151-S153 VanDerWaalsContact C-N 3.34Å; L151-S153 PolarHBondContact O-N 3.05Å; S153-W157 PolarHBondContact O-N 3.3Å; S153-W157 VanDerWaalsContact O-N 3.16Å
154	F	97.9	Very high	96.4	Very high	113 Å²	113	58.5 Å²	58.5	50%	0.496	31%	0.309	S	S	.	.	H	α-helix	trans	-63.5	-53.3	177.7	-179.3	-96.2	0	0	0	111.9	V107 W150 L151 V152 L156 W157 A158 P159	V107-F154 HydrophobicContact CG1-CB 4.21Å; V107-F154 HydrophobicContact CG1-CD2 4.5Å; W150-F154 WeakPolarHBondContact O-CB 3.49Å; W150-F154 PolarHBondContact O-N 3.36Å; L151-F154 PolarHBondContact O-N 3.16Å; V152-F154 PolarHBondContact O-N 3.39Å; F154-L156 VanDerWaalsContact C-N 3.3Å; F154-L156 PolarHBondContact O-N 2.89Å; F154-W157 PolarHBondContact O-N 2.87Å; F154-A158 HydrophobicContact CD2-CB 3.84Å; F154-A158 HydrophobicContact CE2-CB 3.68Å; F154-A158 HydrophobicContact CG-CB 4.43Å; F154-A158 HydrophobicContact CZ-CB 4.15Å; F154-A158 WeakPolarHBondContact O-CB 3.4Å; F154-A158 PolarHBondContact O-N 3.22Å; F154-P159 WeakPolarHBondContact O-CD 3.39Å
155	V	96.8	Very high	96.3	Very high	89 Å²	89	53.8 Å²	53.8	54%	0.539	28%	0.284	S	S	.	.	H	α-helix	trans	-64.3	-33.3	-177	172.2	0	0	0	0	112.2	L151 P159	L151-V155 HydrophobicContact CD1-CG2 3.95Å; L151-V155 HydrophobicContact CG-CG2 4.44Å; L151-V155 WeakPolarHBondContact O-CB 3.49Å; L151-V155 WeakPolarHBondContact O-CG2 3.4Å; L151-V155 PolarHBondContact O-N 2.94Å; V155-P159 WeakPolarHBondContact O-CD 3.46Å; V155-P159 WeakPolarHBondContact O-CG 3.44Å
156	L	93.4	Very high	96.2	Very high	91 Å²	91	59.3 Å²	59.3	48%	0.476	30%	0.303	S	S	.	.	H	α-helix	trans	-74.6	-44.1	178.8	-166.8	153.1	0	0	0	112.3	V152 F154 A160	V152-L156 WeakPolarHBondContact O-CB 3.44Å; V152-L156 PolarHBondContact O-N 3.09Å; F154-L156 VanDerWaalsContact C-N 3.3Å; F154-L156 PolarHBondContact O-N 2.89Å; L156-A160 WeakPolarHBondContact O-CB 3.27Å
157	W	96.7	Very high	96	Very high	13 Å²	13	64.7 Å²	64.7	5%	0.049	33%	0.331	C	S	.	.	H	α-helix	trans	-98.2	-45.9	-172	-70.6	106.6	0	0	0	114.8	Y106 V107 N110 S153 F154 A160 I161 F182 L183 A196	Y106-W157 AromaticContact CD1-CD2 3.94Å; Y106-W157 HydrophobicContact CD1-CD2 3.94Å; Y106-W157 AromaticContact CD1-CE3 3.59Å; Y106-W157 HydrophobicContact CD1-CE3 3.59Å; Y106-W157 AromaticContact CD1-CH2 3.75Å; Y106-W157 HydrophobicContact CD1-CH2 3.75Å; Y106-W157 HydrophobicContact CD1-CZ2 4.08Å; Y106-W157 AromaticContact CD1-CZ3 3.48Å; Y106-W157 HydrophobicContact CD1-CZ3 3.48Å; Y106-W157 VanDerWaalsContact CD1-CZ3 3.48Å; Y106-W157 HydrophobicContact CE1-CE3 4.45Å; Y106-W157 HydrophobicContact CE1-CH2 4.07Å; Y106-W157 AromaticContact CE1-CZ3 3.93Å; Y106-W157 HydrophobicContact CE1-CZ3 3.93Å; Y106-W157 HydrophobicContact CG-CD2 4.37Å; Y106-W157 HydrophobicContact CG-CE3 4.11Å; Y106-W157 HydrophobicContact CG-CZ3 4.41Å; V107-W157 HydrophobicContact CG2-CB 3.84Å; N110-W157 VanDerWaalsContact CG-NE1 3.29Å; N110-W157 PolarHBondContact OD1-NE1 3.48Å; S153-W157 PolarHBondContact O-N 3.3Å; S153-W157 VanDerWaalsContact O-N 3.16Å; F154-W157 PolarHBondContact O-N 2.87Å; W157-A160 PolarHBondContact O-N 2.9Å; W157-I161 HydrophobicContact CB-CD1 4.31Å; W157-I161 HydrophobicContact CE3-CD1 4.2Å; W157-I161 WeakPolarHBondContact O-CB 3.47Å; W157-I161 VanDerWaalsContact O-CG1 3.27Å; W157-I161 WeakPolarHBondContact O-CG1 3.15Å; W157-I161 PolarHBondContact O-N 3.2Å; W157-F182 HydrophobicContact CE3-CZ 4.02Å; W157-F182 HydrophobicContact CZ3-CE2 4.02Å; W157-F182 AromaticContact CZ3-CZ 3.84Å; W157-F182 HydrophobicContact CZ3-CZ 3.84Å; W157-L183 HydrophobicContact CZ3-CD1 4.46Å; W157-A196 HydrophobicContact CZ2-CB 4.17Å
158	A	97.2	Very high	95.8	Very high	4 Å²	4	66 Å²	66	3%	0.033	33%	0.331	C	S	.	.	H	α-helix	trans	-69	-47.3	-171	0	0	0	0	0	113.5	A103 V107 F154 A160 I161 L162	A103-A158 HydrophobicContact CB-CB 4.24Å; V107-A158 HydrophobicContact CG2-CB 4.01Å; F154-A158 HydrophobicContact CD2-CB 3.84Å; F154-A158 HydrophobicContact CE2-CB 3.68Å; F154-A158 HydrophobicContact CG-CB 4.43Å; F154-A158 HydrophobicContact CZ-CB 4.15Å; F154-A158 WeakPolarHBondContact O-CB 3.4Å; F154-A158 PolarHBondContact O-N 3.22Å; A158-A160 VanDerWaalsContact C-N 3.32Å; A158-A160 PolarHBondContact O-N 3.43Å; A158-I161 PolarHBondContact O-N 3.13Å; A158-L162 WeakPolarHBondContact O-CB 3.35Å; A158-L162 VanDerWaalsContact O-CG 3.24Å; A158-L162 WeakPolarHBondContact O-CG 3.38Å; A158-L162 PolarHBondContact O-N 3.07Å
159	P	96.9	Very high	95.6	Very high	48 Å²	48	64 Å²	64	31%	0.312	34%	0.336	S	S	.	.	H	α-helix	trans	-59.7	-40.8	173.1	-25.2	35	0	0	0	112.8	F154 V155 F163	F154-P159 WeakPolarHBondContact O-CD 3.39Å; V155-P159 WeakPolarHBondContact O-CD 3.46Å; V155-P159 WeakPolarHBondContact O-CG 3.44Å; P159-F163 HydrophobicContact CB-CD2 4.11Å; P159-F163 WeakPolarHBondContact O-CB 3.39Å; P159-F163 WeakPolarHBondContact O-CD2 3.45Å; P159-F163 PolarHBondContact O-N 3.36Å
160	A	95.3	Very high	95.5	Very high	31 Å²	31	69.5 Å²	69.5	26%	0.256	36%	0.362	S	S	.	.	H	α-helix	trans	-64.2	-43.5	179	0	0	0	0	0	111.9	L156 W157 A158 W164 F182	L156-A160 WeakPolarHBondContact O-CB 3.27Å; W157-A160 PolarHBondContact O-N 2.9Å; A158-A160 VanDerWaalsContact C-N 3.32Å; A158-A160 PolarHBondContact O-N 3.43Å; A160-W164 WeakPolarHBondContact O-CB 3.4Å; A160-W164 PolarHBondContact O-N 2.95Å; A160-F182 HydrophobicContact CB-CD1 4.39Å; A160-F182 HydrophobicContact CB-CE1 3.63Å; A160-F182 HydrophobicContact CB-CZ 3.95Å
161	I	96.2	Very high	95.2	Very high	15 Å²	15	69.7 Å²	69.7	8%	0.077	36%	0.362	C	S	.	.	H	α-helix	trans	-71.4	-42.1	-179.8	-68.3	165.3	0	0	0	111.3	D99 L102 A103 Y106 W157 A158 I180 F182	D99-I161 WeakPolarHBondContact O-CG2 3.33Å; L102-I161 HydrophobicContact CB-CG2 3.98Å; A103-I161 HydrophobicContact CB-CB 4.37Å; A103-I161 HydrophobicContact CB-CG2 4.2Å; Y106-I161 HydrophobicContact CD2-CD1 4.44Å; Y106-I161 HydrophobicContact CG-CD1 4.21Å; W157-I161 HydrophobicContact CB-CD1 4.31Å; W157-I161 HydrophobicContact CE3-CD1 4.2Å; W157-I161 WeakPolarHBondContact O-CB 3.47Å; W157-I161 VanDerWaalsContact O-CG1 3.27Å; W157-I161 WeakPolarHBondContact O-CG1 3.15Å; W157-I161 PolarHBondContact O-N 3.2Å; A158-I161 PolarHBondContact O-N 3.13Å; I161-I180 HydrophobicContact CD1-CD1 3.57Å; I161-I180 HydrophobicContact CD1-CG1 4.3Å; I161-I180 HydrophobicContact CG1-CD1 3.81Å; I161-I180 HydrophobicContact CG1-CG1 4.16Å; I161-I180 HydrophobicContact CG1-CG2 4.29Å; I161-F182 HydrophobicContact CG1-CE1 3.87Å; I161-F182 HydrophobicContact CG1-CZ 4.22Å
162	L	96	Very high	94.9	Very high	41 Å²	41	67.7 Å²	67.7	22%	0.215	35%	0.354	C	S	.	.	H	α-helix	trans	-77.9	-42.9	-174.8	-64	169.8	0	0	0	113.1	D99 L100 A103 A158 Q165	D99-L162 HydrophobicContact CB-CD2 3.94Å; L100-L162 HydrophobicContact CD2-CD2 4.14Å; A103-L162 HydrophobicContact CB-CG 4.42Å; A158-L162 WeakPolarHBondContact O-CB 3.35Å; A158-L162 VanDerWaalsContact O-CG 3.24Å; A158-L162 WeakPolarHBondContact O-CG 3.38Å; A158-L162 PolarHBondContact O-N 3.07Å; L162-Q165 PolarHBondContact O-NE2 2.86Å; L162-Q165 VanDerWaalsContact O-NE2 3.12Å
163	F	95.8	Very high	94.8	Very high	131 Å²	131	65.3 Å²	65.3	58%	0.575	34%	0.34	S	S	*	.	H	α-helix	trans	-98.5	-12	-168.7	-60.1	-61.6	0	0	0	115.4	P159 Q165 Y166 L167	P159-F163 HydrophobicContact CB-CD2 4.11Å; P159-F163 WeakPolarHBondContact O-CB 3.39Å; P159-F163 WeakPolarHBondContact O-CD2 3.45Å; P159-F163 PolarHBondContact O-N 3.36Å; F163-Q165 VanDerWaalsContact C-N 3.3Å; F163-Q165 PolarHBondContact O-N 3.43Å; F163-Y166 HydrophobicContact CD1-CD2 4.4Å; F163-Y166 WeakPolarHBondContact O-CA 3.32Å; F163-Y166 WeakPolarHBondContact O-CB 3.38Å; F163-Y166 PolarHBondContact O-N 3.46Å; F163-L167 PolarHBondContact O-N 3.46Å
164	W	94.8	Very high	94.4	Very high	65 Å²	65	70.9 Å²	70.9	25%	0.246	37%	0.369	C	S	.	.	H	α-helix	trans	-58.5	-38.6	-177.1	-175.2	-92.4	0	0	0	113.7	A160 Y166 L167 V168 F182 I188	A160-W164 WeakPolarHBondContact O-CB 3.4Å; A160-W164 PolarHBondContact O-N 2.95Å; W164-Y166 PolarHBondContact O-N 2.86Å; W164-L167 PolarHBondContact O-N 3.27Å; W164-L167 VanDerWaalsContact O-N 3.1Å; W164-V168 HydrophobicContact CD2-CG2 4.34Å; W164-V168 HydrophobicContact CG-CG2 4.39Å; W164-V168 HydrophobicContact CZ2-CG2 4.25Å; W164-V168 WeakPolarHBondContact O-CG2 3.45Å; W164-V168 PolarHBondContact O-N 3.47Å; W164-F182 HydrophobicContact CB-CD1 4.39Å; W164-F182 HydrophobicContact CD2-CB 3.8Å; W164-F182 HydrophobicContact CE3-CB 4.34Å; W164-F182 HydrophobicContact CG-CB 4.08Å; W164-F182 HydrophobicContact CG-CD1 4.33Å; W164-F182 HydrophobicContact CZ2-CB 4.05Å; W164-I188 HydrophobicContact CH2-CD1 4.09Å; W164-I188 HydrophobicContact CZ2-CD1 4.23Å
165	Q	92.9	Very high	94	Very high	30 Å²	30	70.7 Å²	70.7	14%	0.14	39%	0.388	C	S	.	.	H	α-helix	trans	-60.7	-27.8	174.7	65.9	-163.5	-43.5	0	0	113.4	D99 L162 F163 G169 E170 R171	D99-Q165 PolarHBondContact OD2-NE2 3.18Å; L162-Q165 PolarHBondContact O-NE2 2.86Å; L162-Q165 VanDerWaalsContact O-NE2 3.12Å; F163-Q165 VanDerWaalsContact C-N 3.3Å; F163-Q165 PolarHBondContact O-N 3.43Å; Q165-G169 CarbonylContact O-C 3.47Å; Q165-G169 WeakPolarHBondContact O-CA 3.22Å; Q165-G169 PolarHBondContact O-N 3.39Å; Q165-G169 VanDerWaalsContact O-N 3.1Å; Q165-E170 PolarHBondContact O-N 2.78Å; Q165-R171 HydrophobicContact CB-CB 4.31Å
166	Y	93.8	Very high	93.7	Very high	174 Å²	174	67.4 Å²	67.4	68%	0.682	37%	0.373	S	S	*	.	H	α-helix	trans	-86	-26.4	175.2	-59.8	-89.1	0	0	0	112.6	F163 W164	F163-Y166 HydrophobicContact CD1-CD2 4.4Å; F163-Y166 WeakPolarHBondContact O-CA 3.32Å; F163-Y166 WeakPolarHBondContact O-CB 3.38Å; F163-Y166 PolarHBondContact O-N 3.46Å; W164-Y166 PolarHBondContact O-N 2.86Å
167	L	92.2	Very high	93.6	Very high	135 Å²	135	66.8 Å²	66.8	71%	0.707	37%	0.367	S	S	*	.	H	α-helix	trans	-74.1	-40	175.5	-171.3	155.2	0	0	0	111.6	F163 W164	F163-L167 PolarHBondContact O-N 3.46Å; W164-L167 PolarHBondContact O-N 3.27Å; W164-L167 VanDerWaalsContact O-N 3.1Å
168	V	92.9	Very high	93.6	Very high	67 Å²	67	66.5 Å²	66.5	41%	0.406	37%	0.367	S	S	.	.	H	α-helix	trans	-78.5	-25.4	173.1	-176.5	0	0	0	0	111.5	W164 E170	W164-V168 HydrophobicContact CD2-CG2 4.34Å; W164-V168 HydrophobicContact CG-CG2 4.39Å; W164-V168 HydrophobicContact CZ2-CG2 4.25Å; W164-V168 WeakPolarHBondContact O-CG2 3.45Å; W164-V168 PolarHBondContact O-N 3.47Å; V168-E170 VanDerWaalsContact C-N 3.3Å; V168-E170 HydrophobicContact CG1-CG 3.82Å
169	G	93.4	Very high	93.4	Very high	65 Å²	65	70.2 Å²	70.2	67%	0.67	38%	0.381	S	S	*	.	S	Bend	trans	87.2	-7.5	-177.7	0	0	0	0	0	114.5	Q165	Q165-G169 CarbonylContact O-C 3.47Å; Q165-G169 WeakPolarHBondContact O-CA 3.22Å; Q165-G169 PolarHBondContact O-N 3.39Å; Q165-G169 VanDerWaalsContact O-N 3.1Å
170	E	92.8	Very high	93.2	Very high	119 Å²	119	68.5 Å²	68.5	56%	0.556	37%	0.369	S	S	*	.	S	Bend	trans	-137.6	154.1	177.6	54.7	163	-145.5	0	0	112.6	Q165 V168 T172 Q181	Q165-E170 PolarHBondContact O-N 2.78Å; V168-E170 VanDerWaalsContact C-N 3.3Å; V168-E170 HydrophobicContact CG1-CG 3.82Å; E170-T172 WeakPolarHBondContact OE1-CG2 3.42Å; E170-Q181 PolarHBondContact O-NE2 3.29Å
171	R	92.1	Very high	93.1	Very high	68 Å²	68	68 Å²	68	26%	0.257	36%	0.362	S	S	.	.			trans	-104.3	111.1	172.2	-174.6	-172.6	-177.4	93.7	2.7	109.6	D99 Q165 V173	D99-R171 IonicContact OD1-CZ 2.62Å; D99-R171 VanDerWaalsContact OD1-CZ 3.28Å; D99-R171 IonicContact OD1-NH1 2.89Å; D99-R171 PolarHBondContact OD1-NH1 2.95Å; D99-R171 IonicContact OD1-NH2 2.71Å; D99-R171 PolarHBondContact OD1-NH2 3.26Å; D99-R171 IonicContact OD2-CZ 3.98Å; D99-R171 IonicContact OD2-NH1 3Å; D99-R171 PolarHBondContact OD2-NH1 2.87Å; D99-R171 IonicContact OD2-NH2 3.33Å; Q165-R171 HydrophobicContact CB-CB 4.31Å; R171-V173 HydrophobicContact CG-CB 4.23Å
172	T	92.1	Very high	92.9	Very high	60 Å²	60	67.9 Å²	67.9	37%	0.368	36%	0.361	S	S	.	.			trans	-85	-11.4	179.3	65	0	0	0	0	113.6	E170 L174 Y179 Q181	E170-T172 WeakPolarHBondContact OE1-CG2 3.42Å; T172-L174 PolarHBondContact O-N 3.4Å; T172-Y179 PolarHBondContact O-OH 3.44Å; T172-Q181 WeakPolarHBondContact OG1-CG 3.36Å
173	V	93.1	Very high	92.6	Very high	13 Å²	13	67.7 Å²	67.7	8%	0.079	36%	0.36	C	S	.	.	S	Bend	trans	-69.3	111.6	179.2	-174.8	0	0	0	0	110.4	R171 Y179 Q181	R171-V173 HydrophobicContact CG-CB 4.23Å; V173-Y179 HydrophobicContact CG1-CD1 4.16Å; V173-Y179 HydrophobicContact CG1-CE1 4Å; V173-Y179 HydrophobicContact CG2-CD2 4.27Å; V173-Y179 HydrophobicContact CG2-CE2 3.94Å; V173-Q181 HydrophobicContact CG2-CB 3.99Å
174	L	90.9	Very high	92.2	Very high	117 Å²	117	64.8 Å²	64.8	61%	0.613	36%	0.355	S	S	*	.			trans	-57.1	148.8	-177.4	-66.8	171.1	0	0	0	113.6	T172 G176 Q177	T172-L174 PolarHBondContact O-N 3.4Å; L174-G176 PolarHBondContact O-N 2.93Å; L174-Q177 HydrophobicContact CB-CB 4.3Å; L174-Q177 HydrophobicContact CB-CG 4.1Å; L174-Q177 WeakPolarHBondContact O-CB 3.29Å; L174-Q177 PolarHBondContact O-N 3.12Å
175	A	88.6	Confident	91.9	Very high	108 Å²	108	66.8 Å²	66.8	89%	0.893	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	131.9	173	0	0	0	0	0	111	Q177	A175-Q177 VanDerWaalsContact C-N 3.29Å; A175-Q177 PolarHBondContact O-N 3.5Å
176	G	89.8	Confident	91.6	Very high	21 Å²	21	68.4 Å²	68.4	22%	0.216	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	80	0.8	-174.3	0	0	0	0	0	115	H90 W91 L174	H90-G176 CarbonylContact C-O 3.59Å; H90-G176 WeakPolarHBondContact CA-O 3.21Å; H90-G176 WeakPolarHBondContact CB-O 3.2Å; W91-G176 PolarHBondContact N-O 2.64Å; L174-G176 PolarHBondContact O-N 2.93Å
177	Q	92.6	Very high	91.4	Very high	77 Å²	77	67.1 Å²	67.1	36%	0.36	38%	0.384	S	S	.	.			trans	-110.8	155.3	172.8	-62.2	-61	-30.3	0	0	110.9	Y85 L174 A175 Y179	Y85-Q177 PolarHBondContact OH-OE1 3.48Å; L174-Q177 HydrophobicContact CB-CB 4.3Å; L174-Q177 HydrophobicContact CB-CG 4.1Å; L174-Q177 WeakPolarHBondContact O-CB 3.29Å; L174-Q177 PolarHBondContact O-N 3.12Å; A175-Q177 VanDerWaalsContact C-N 3.29Å; A175-Q177 PolarHBondContact O-N 3.5Å; Q177-Y179 HydrophobicContact CB-CD1 4.18Å; Q177-Y179 HydrophobicContact CB-CE1 4.05Å
178	C	95.4	Very high	91.3	Very high	8 Å²	8	63 Å²	63	5%	0.054	36%	0.362	C	S	.	.			trans	-143.4	105	174.4	-176.9	0	0	0	0	111.4	W91 C98 W101	W91-C178 HydrophobicContact CB-CB 3.91Å; W91-C178 HydrophobicContact CD2-CB 3.92Å; W91-C178 HydrophobicContact CE3-CB 4.11Å; W91-C178 HydrophobicContact CG-CB 3.82Å; C98-C178 WeakPolarHBondContact CA-SG 3.43Å; C98-C178 HydrophobicContact CB-CB 3.94Å; C98-C178 WeakPolarHBondContact CB-SG 3.35Å; C98-C178 WeakPolarHBondContact SG-CA 3.37Å; C98-C178 WeakPolarHBondContact SG-CB 3.32Å; C98-C178 CovalentContact SG-SG 2.03Å; C98-C178 PolarHBondContact SG-SG 3.29Å; W101-C178 VanDerWaalsContact CE3-SG 3.52Å; W101-C178 HydrophobicContact CZ3-CB 4.08Å; W101-C178 WeakPolarHBondContact CZ3-SG 3.22Å
179	Y	93.6	Very high	91.3	Very high	81 Å²	81	60.4 Å²	60.4	32%	0.318	35%	0.347	S	S	.	.			trans	-150.3	165.3	177.6	60.7	-98.5	0	0	0	109.9	T172 V173 Q177 Q181 S184	T172-Y179 PolarHBondContact O-OH 3.44Å; V173-Y179 HydrophobicContact CG1-CD1 4.16Å; V173-Y179 HydrophobicContact CG1-CE1 4Å; V173-Y179 HydrophobicContact CG2-CD2 4.27Å; V173-Y179 HydrophobicContact CG2-CE2 3.94Å; Q177-Y179 HydrophobicContact CB-CD1 4.18Å; Q177-Y179 HydrophobicContact CB-CE1 4.05Å; Y179-Q181 PolarHBondContact O-N 3.01Å; Y179-S184 WeakPolarHBondContact CE2-OG 3.06Å
180	I	94.1	Very high	91.1	Very high	12 Å²	12	61.4 Å²	61.4	6%	0.062	33%	0.332	C	S	.	.			trans	-80	117.5	-179.7	-64.1	178.2	0	0	0	110.7	L102 Y106 I161 F182 L183	L102-I180 HydrophobicContact CB-CG1 4.22Å; L102-I180 HydrophobicContact CD1-CG1 3.95Å; L102-I180 HydrophobicContact CD2-CG1 4.33Å; L102-I180 HydrophobicContact CG-CG1 4.41Å; Y106-I180 HydrophobicContact CD1-CD1 3.93Å; Y106-I180 HydrophobicContact CD2-CD1 3.62Å; Y106-I180 HydrophobicContact CE1-CD1 3.72Å; Y106-I180 HydrophobicContact CE2-CD1 3.39Å; Y106-I180 HydrophobicContact CE2-CG1 4.33Å; Y106-I180 HydrophobicContact CG-CD1 3.89Å; Y106-I180 VanDerWaalsContact CZ-CD1 3.46Å; I161-I180 HydrophobicContact CD1-CD1 3.57Å; I161-I180 HydrophobicContact CD1-CG1 4.3Å; I161-I180 HydrophobicContact CG1-CD1 3.81Å; I161-I180 HydrophobicContact CG1-CG1 4.16Å; I161-I180 HydrophobicContact CG1-CG2 4.29Å; I180-F182 HydrophobicContact CG2-CD1 3.47Å; I180-F182 VanDerWaalsContact CG2-CD1 3.47Å; I180-F182 HydrophobicContact CG2-CD2 4.04Å; I180-F182 HydrophobicContact CG2-CE1 3.31Å; I180-F182 HydrophobicContact CG2-CE2 3.92Å; I180-F182 HydrophobicContact CG2-CG 3.83Å; I180-F182 HydrophobicContact CG2-CZ 3.56Å; I180-F182 PolarHBondContact O-N 3.23Å; I180-L183 HydrophobicContact CB-CB 4.26Å; I180-L183 HydrophobicContact CB-CD1 4.02Å; I180-L183 HydrophobicContact CB-CG 4.1Å; I180-L183 HydrophobicContact CD1-CD1 3.97Å; I180-L183 HydrophobicContact CG2-CB 4.27Å; I180-L183 HydrophobicContact CG2-CD1 4.15Å; I180-L183 HydrophobicContact CG2-CG 3.83Å; I180-L183 PolarHBondContact O-N 3.1Å; I180-L183 VanDerWaalsContact O-N 3.12Å
181	Q	93	Very high	91.1	Very high	22 Å²	22	57.4 Å²	57.4	10%	0.103	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-55.1	-43.5	-177.2	179.4	162.2	-23.5	0	0	114.5	E170 T172 V173 Y179 L183 S184	E170-Q181 PolarHBondContact O-NE2 3.29Å; T172-Q181 WeakPolarHBondContact OG1-CG 3.36Å; V173-Q181 HydrophobicContact CG2-CB 3.99Å; Y179-Q181 PolarHBondContact O-N 3.01Å; Q181-L183 VanDerWaalsContact C-N 3.3Å; Q181-L183 PolarHBondContact O-N 2.65Å; Q181-S184 WeakPolarHBondContact O-CB 3.44Å; Q181-S184 PolarHBondContact O-N 3Å; Q181-S184 PolarHBondContact O-OG 3.26Å
182	F	91.2	Very high	91.1	Very high	12 Å²	12	55.8 Å²	55.8	5%	0.053	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-73.8	-20.4	-178.9	64.9	-102.9	0	0	0	113.5	W157 A160 I161 W164 I180 S184 Q185 I188	W157-F182 HydrophobicContact CE3-CZ 4.02Å; W157-F182 HydrophobicContact CZ3-CE2 4.02Å; W157-F182 AromaticContact CZ3-CZ 3.84Å; W157-F182 HydrophobicContact CZ3-CZ 3.84Å; A160-F182 HydrophobicContact CB-CD1 4.39Å; A160-F182 HydrophobicContact CB-CE1 3.63Å; A160-F182 HydrophobicContact CB-CZ 3.95Å; I161-F182 HydrophobicContact CG1-CE1 3.87Å; I161-F182 HydrophobicContact CG1-CZ 4.22Å; W164-F182 HydrophobicContact CB-CD1 4.39Å; W164-F182 HydrophobicContact CD2-CB 3.8Å; W164-F182 HydrophobicContact CE3-CB 4.34Å; W164-F182 HydrophobicContact CG-CB 4.08Å; W164-F182 HydrophobicContact CG-CD1 4.33Å; W164-F182 HydrophobicContact CZ2-CB 4.05Å; I180-F182 HydrophobicContact CG2-CD1 3.47Å; I180-F182 VanDerWaalsContact CG2-CD1 3.47Å; I180-F182 HydrophobicContact CG2-CD2 4.04Å; I180-F182 HydrophobicContact CG2-CE1 3.31Å; I180-F182 HydrophobicContact CG2-CE2 3.92Å; I180-F182 HydrophobicContact CG2-CG 3.83Å; I180-F182 HydrophobicContact CG2-CZ 3.56Å; I180-F182 PolarHBondContact O-N 3.23Å; F182-S184 PolarHBondContact O-N 3.11Å; F182-Q185 PolarHBondContact O-N 2.98Å; F182-I188 HydrophobicContact CD2-CG2 3.84Å
183	L	90	Very high	91.1	Very high	37 Å²	37	53.3 Å²	53.3	19%	0.194	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-80.2	1.6	174.8	-63.3	-177.9	0	0	0	113.1	Y106 W157 I180 Q181 T189 T192	Y106-L183 HydrophobicContact CE1-CD1 4.14Å; W157-L183 HydrophobicContact CZ3-CD1 4.46Å; I180-L183 HydrophobicContact CB-CB 4.26Å; I180-L183 HydrophobicContact CB-CD1 4.02Å; I180-L183 HydrophobicContact CB-CG 4.1Å; I180-L183 HydrophobicContact CD1-CD1 3.97Å; I180-L183 HydrophobicContact CG2-CB 4.27Å; I180-L183 HydrophobicContact CG2-CD1 4.15Å; I180-L183 HydrophobicContact CG2-CG 3.83Å; I180-L183 PolarHBondContact O-N 3.1Å; I180-L183 VanDerWaalsContact O-N 3.12Å; Q181-L183 VanDerWaalsContact C-N 3.3Å; Q181-L183 PolarHBondContact O-N 2.65Å; L183-T189 WeakPolarHBondContact CA-OG1 3.35Å; L183-T189 PolarHBondContact O-OG1 3.09Å; L183-T192 HydrophobicContact CD2-CG2 4.36Å; L183-T192 WeakPolarHBondContact CD2-OG1 3.35Å
184	S	86.7	Confident	91.2	Very high	70 Å²	70	55.3 Å²	55.3	49%	0.49	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-74.7	-11.4	165.1	-53.9	0	0	0	0	113.2	Y179 Q181 F182	Y179-S184 WeakPolarHBondContact CE2-OG 3.06Å; Q181-S184 WeakPolarHBondContact O-CB 3.44Å; Q181-S184 PolarHBondContact O-N 3Å; Q181-S184 PolarHBondContact O-OG 3.26Å; F182-S184 PolarHBondContact O-N 3.11Å
185	Q	87.9	Confident	91.2	Very high	106 Å²	106	52.7 Å²	52.7	50%	0.495	31%	0.311	S	S	.	.	S	Bend	trans	-97.4	114.7	177.4	-65.4	-167.2	6	0	0	111.5	F182 I187 I188 T189	F182-Q185 PolarHBondContact O-N 2.98Å; Q185-I187 VanDerWaalsContact C-N 3.27Å; Q185-I187 PolarHBondContact O-N 3.36Å; Q185-I187 VanDerWaalsContact O-N 3.09Å; Q185-I188 HydrophobicContact CB-CB 4.33Å; Q185-I188 HydrophobicContact CB-CD1 4.09Å; Q185-I188 HydrophobicContact CB-CG1 4.09Å; Q185-I188 HydrophobicContact CG-CD1 4.44Å; Q185-I188 PolarHBondContact O-N 3.33Å; Q185-I188 VanDerWaalsContact O-N 3.09Å; Q185-I188 VanDerWaalsContact OE1-CD1 3.29Å; Q185-T189 PolarHBondContact O-N 3.31Å; Q185-T189 PolarHBondContact O-OG1 3.44Å; Q185-T189 VanDerWaalsContact O-OG1 3.13Å
186	P	87.8	Confident	91.3	Very high	64 Å²	64	48.8 Å²	48.8	42%	0.416	28%	0.279	S	S	.	.	H	α-helix	trans	-51.8	-37.8	-175.3	-33	38.1	0	0	0	115.6	T189 F190 T389	P186-T189 PolarHBondContact O-N 2.94Å; P186-F190 VanDerWaalsContact O-CB 3.28Å; P186-F190 WeakPolarHBondContact O-CB 3Å; P186-F190 PolarHBondContact O-N 3.33Å; P186-T389 HydrophobicContact CB-CG2 4.31Å; P186-T389 VanDerWaalsContact O-CG2 3.31Å; P186-T389 WeakPolarHBondContact O-CG2 3.22Å
187	I	89.3	Confident	91.4	Very high	147 Å²	147	48 Å²	48	75%	0.754	27%	0.27	S	S	*	.	H	α-helix	trans	-67.9	-43.9	-178.8	-59	174.1	0	0	0	111.2	Q185 G191	Q185-I187 VanDerWaalsContact C-N 3.27Å; Q185-I187 PolarHBondContact O-N 3.36Å; Q185-I187 VanDerWaalsContact O-N 3.09Å; I187-G191 PolarHBondContact O-N 2.96Å
188	I	91.1	Very high	91.5	Very high	49 Å²	49	46.9 Å²	46.9	25%	0.251	26%	0.262	S	S	.	.	H	α-helix	trans	-67	-43.4	176.8	-56.4	-177.6	0	0	0	109.6	W164 F182 Q185 G191 T192	W164-I188 HydrophobicContact CH2-CD1 4.09Å; W164-I188 HydrophobicContact CZ2-CD1 4.23Å; F182-I188 HydrophobicContact CD2-CG2 3.84Å; Q185-I188 HydrophobicContact CB-CB 4.33Å; Q185-I188 HydrophobicContact CB-CD1 4.09Å; Q185-I188 HydrophobicContact CB-CG1 4.09Å; Q185-I188 HydrophobicContact CG-CD1 4.44Å; Q185-I188 PolarHBondContact O-N 3.33Å; Q185-I188 VanDerWaalsContact O-N 3.09Å; Q185-I188 VanDerWaalsContact OE1-CD1 3.29Å; I188-G191 PolarHBondContact O-N 3.02Å; I188-T192 HydrophobicContact CG2-CG2 4.15Å; I188-T192 WeakPolarHBondContact O-CB 3.44Å; I188-T192 VanDerWaalsContact O-CG2 3.3Å; I188-T192 WeakPolarHBondContact O-CG2 3.48Å; I188-T192 PolarHBondContact O-N 3.32Å; I188-T192 PolarHBondContact O-OG1 3.21Å
189	T	90.9	Very high	91.5	Very high	13 Å²	13	51.5 Å²	51.5	8%	0.08	29%	0.286	C	S	.	.	H	α-helix	trans	-61.9	-43.9	178.2	-61.1	0	0	0	0	112.7	L183 Q185 P186 T192 A193 V385 T389	L183-T189 WeakPolarHBondContact CA-OG1 3.35Å; L183-T189 PolarHBondContact O-OG1 3.09Å; Q185-T189 PolarHBondContact O-N 3.31Å; Q185-T189 PolarHBondContact O-OG1 3.44Å; Q185-T189 VanDerWaalsContact O-OG1 3.13Å; P186-T189 PolarHBondContact O-N 2.94Å; T189-T192 PolarHBondContact O-OG1 2.64Å; T189-T192 VanDerWaalsContact O-OG1 3.08Å; T189-A193 WeakPolarHBondContact O-CB 3.39Å; T189-A193 PolarHBondContact O-N 3.18Å; T189-V385 HydrophobicContact CG2-CG1 3.45Å; T189-V385 VanDerWaalsContact CG2-CG1 3.45Å; T189-T389 HydrophobicContact CG2-CG2 4.03Å
190	F	91.1	Very high	91.6	Very high	85 Å²	85	48.1 Å²	48.1	37%	0.373	27%	0.274	S	S	.	.	H	α-helix	trans	-60.5	-52.4	171.6	-180	-92.7	0	0	0	111.6	P186 T192 A193 M194 L386 T389	P186-F190 VanDerWaalsContact O-CB 3.28Å; P186-F190 WeakPolarHBondContact O-CB 3Å; P186-F190 PolarHBondContact O-N 3.33Å; F190-T192 PolarHBondContact O-N 3.13Å; F190-A193 PolarHBondContact O-N 2.89Å; F190-M194 HydrophobicContact CD1-CG 4.12Å; F190-M194 HydrophobicContact CD2-CE 4.21Å; F190-M194 HydrophobicContact CE1-CG 3.74Å; F190-M194 HydrophobicContact CE2-CE 3.79Å; F190-M194 HydrophobicContact CE2-CG 4.31Å; F190-M194 HydrophobicContact CE2-SD 4.48Å; F190-M194 HydrophobicContact CZ-CE 4.13Å; F190-M194 HydrophobicContact CZ-CG 3.85Å; F190-M194 HydrophobicContact CZ-SD 4.22Å; F190-M194 WeakPolarHBondContact O-CG 3.35Å; F190-M194 PolarHBondContact O-N 3.37Å; F190-L386 HydrophobicContact CD2-CD1 3.72Å; F190-L386 HydrophobicContact CE2-CD1 3.62Å; F190-T389 HydrophobicContact CB-CG2 4.02Å
191	G	92.9	Very high	91.6	Very high	36 Å²	36	48.5 Å²	48.5	37%	0.371	28%	0.277	S	S	.	.	H	α-helix	trans	-60.5	-44.2	-177.6	0	0	0	0	0	113.4	I187 I188 M194 A195	I187-G191 PolarHBondContact O-N 2.96Å; I188-G191 PolarHBondContact O-N 3.02Å; G191-M194 PolarHBondContact O-N 3.48Å; G191-A195 WeakPolarHBondContact O-CB 3.37Å; G191-A195 PolarHBondContact O-N 2.85Å
192	T	92.1	Very high	91.7	Very high	33 Å²	33	51.3 Å²	51.3	20%	0.202	30%	0.295	C	S	.	.	H	α-helix	trans	-65.3	-43	175.6	54.1	0	0	0	0	112.3	L183 I188 T189 F190 M194 A195 A196	L183-T192 HydrophobicContact CD2-CG2 4.36Å; L183-T192 WeakPolarHBondContact CD2-OG1 3.35Å; I188-T192 HydrophobicContact CG2-CG2 4.15Å; I188-T192 WeakPolarHBondContact O-CB 3.44Å; I188-T192 VanDerWaalsContact O-CG2 3.3Å; I188-T192 WeakPolarHBondContact O-CG2 3.48Å; I188-T192 PolarHBondContact O-N 3.32Å; I188-T192 PolarHBondContact O-OG1 3.21Å; T189-T192 PolarHBondContact O-OG1 2.64Å; T189-T192 VanDerWaalsContact O-OG1 3.08Å; F190-T192 PolarHBondContact O-N 3.13Å; T192-M194 PolarHBondContact O-N 3.49Å; T192-A195 PolarHBondContact O-N 3.3Å; T192-A196 WeakPolarHBondContact O-CB 3.3Å; T192-A196 PolarHBondContact O-N 2.88Å
193	A	92.1	Very high	91.9	Very high	8 Å²	8	52.6 Å²	52.6	7%	0.066	30%	0.304	C	S	.	.	H	α-helix	trans	-61.1	-43.3	174.8	0	0	0	0	0	112	T189 F190 F197 Y198 V385	T189-A193 WeakPolarHBondContact O-CB 3.39Å; T189-A193 PolarHBondContact O-N 3.18Å; F190-A193 PolarHBondContact O-N 2.89Å; A193-F197 WeakPolarHBondContact O-CB 3.45Å; A193-F197 PolarHBondContact O-N 3.02Å; A193-Y198 HydrophobicContact CB-CD2 4.5Å; A193-Y198 HydrophobicContact CB-CE2 4.36Å; A193-Y198 WeakPolarHBondContact O-CD2 3.47Å; A193-Y198 PolarHBondContact O-N 3.28Å; A193-V385 HydrophobicContact CB-CG1 3.96Å
194	M	93.8	Very high	92.1	Very high	55 Å²	55	51 Å²	51	27%	0.271	30%	0.296	S	S	.	.	I	π-helix	trans	-60.3	-47.7	176.3	-69.5	-56.1	125.1	0	0	112	F190 G191 T192 Y198 L199 L386	F190-M194 HydrophobicContact CD1-CG 4.12Å; F190-M194 HydrophobicContact CD2-CE 4.21Å; F190-M194 HydrophobicContact CE1-CG 3.74Å; F190-M194 HydrophobicContact CE2-CE 3.79Å; F190-M194 HydrophobicContact CE2-CG 4.31Å; F190-M194 HydrophobicContact CE2-SD 4.48Å; F190-M194 HydrophobicContact CZ-CE 4.13Å; F190-M194 HydrophobicContact CZ-CG 3.85Å; F190-M194 HydrophobicContact CZ-SD 4.22Å; F190-M194 WeakPolarHBondContact O-CG 3.35Å; F190-M194 PolarHBondContact O-N 3.37Å; G191-M194 PolarHBondContact O-N 3.48Å; T192-M194 PolarHBondContact O-N 3.49Å; M194-Y198 HydrophobicContact CE-CD2 3.37Å; M194-Y198 HydrophobicContact CE-CE2 3.57Å; M194-Y198 HydrophobicContact CE-CG 3.95Å; M194-Y198 PolarHBondContact O-N 3.35Å; M194-Y198 HydrophobicContact SD-CD2 3.89Å; M194-Y198 HydrophobicContact SD-CG 4.02Å; M194-L199 VanDerWaalsContact O-CB 3.31Å; M194-L199 WeakPolarHBondContact O-CB 3.47Å; M194-L199 PolarHBondContact O-N 3.08Å; M194-L386 HydrophobicContact CE-CD1 4.02Å
195	A	91.8	Very high	92.4	Very high	63 Å²	63	50.5 Å²	50.5	52%	0.521	29%	0.292	S	S	.	.	I	π-helix	trans	-73	-41.2	-177.8	0	0	0	0	0	113.7	G191 T192 P200	G191-A195 WeakPolarHBondContact O-CB 3.37Å; G191-A195 PolarHBondContact O-N 2.85Å; T192-A195 PolarHBondContact O-N 3.3Å; A195-P200 WeakPolarHBondContact O-CD 2.89Å
196	A	90.3	Very high	92.8	Very high	25 Å²	25	48.9 Å²	48.9	21%	0.207	29%	0.289	C	S	.	.	I	π-helix	trans	-88	-24.6	-173.3	0	0	0	0	0	114	W157 T192	W157-A196 HydrophobicContact CZ2-CB 4.17Å; T192-A196 WeakPolarHBondContact O-CB 3.3Å; T192-A196 PolarHBondContact O-N 2.88Å
197	F	92.4	Very high	93	Very high	5 Å²	5	46.4 Å²	46.4	2%	0.022	27%	0.272	C	S	.	.	I	π-helix	trans	-122.3	-63.2	-178.5	-178.5	-108.8	0	0	0	113.9	A193 L199 P200 V201 F374 W378 N382	A193-F197 WeakPolarHBondContact O-CB 3.45Å; A193-F197 PolarHBondContact O-N 3.02Å; F197-L199 PolarHBondContact O-N 3.08Å; F197-P200 WeakPolarHBondContact O-CD 3.48Å; F197-V201 HydrophobicContact CD1-CG2 4.47Å; F197-V201 HydrophobicContact CD2-CG2 3.87Å; F197-V201 HydrophobicContact CE1-CG2 4.17Å; F197-V201 HydrophobicContact CE2-CG2 3.48Å; F197-V201 VanDerWaalsContact CE2-CG2 3.48Å; F197-V201 HydrophobicContact CG-CG2 4.35Å; F197-V201 HydrophobicContact CZ-CG2 3.67Å; F197-V201 WeakPolarHBondContact O-CB 3.32Å; F197-V201 WeakPolarHBondContact O-CG2 3.45Å; F197-V201 PolarHBondContact O-N 2.86Å; F197-F374 HydrophobicContact CD2-CE1 4.3Å; F197-F374 AromaticContact CD2-CZ 3.97Å; F197-F374 HydrophobicContact CD2-CZ 3.97Å; F197-F374 AromaticContact CE2-CE1 3.88Å; F197-F374 HydrophobicContact CE2-CE1 3.88Å; F197-F374 AromaticContact CE2-CZ 3.83Å; F197-F374 HydrophobicContact CE2-CZ 3.83Å; F197-W378 HydrophobicContact CD2-CB 4.13Å; F197-W378 HydrophobicContact CD2-CE3 4.37Å; F197-W378 HydrophobicContact CE2-CB 3.35Å; F197-W378 HydrophobicContact CE2-CG 4.3Å; F197-W378 HydrophobicContact CZ-CB 3.89Å; F197-N382 VanDerWaalsContact CB-OD1 3.23Å; F197-N382 WeakPolarHBondContact CB-OD1 3.5Å; F197-N382 HydrophobicContact CD1-CB 3.42Å; F197-N382 VanDerWaalsContact CD1-CB 3.42Å; F197-N382 HydrophobicContact CE1-CB 3.62Å; F197-N382 HydrophobicContact CG-CB 4.09Å; F197-N382 VanDerWaalsContact CG-CG 3.41Å; F197-N382 WeakPolarHBondContact CG-OD1 3.18Å; F197-N382 HydrophobicContact CZ-CB 4.44Å
198	Y	95.1	Very high	93	Very high	53 Å²	53	41.7 Å²	41.7	21%	0.208	25%	0.245	C	C	.	.	I	π-helix	trans	-66	-40.3	-167.9	-70.6	-88.1	0	0	0	113.2	A193 M194 T202 N382	A193-Y198 HydrophobicContact CB-CD2 4.5Å; A193-Y198 HydrophobicContact CB-CE2 4.36Å; A193-Y198 WeakPolarHBondContact O-CD2 3.47Å; A193-Y198 PolarHBondContact O-N 3.28Å; M194-Y198 HydrophobicContact CE-CD2 3.37Å; M194-Y198 HydrophobicContact CE-CE2 3.57Å; M194-Y198 HydrophobicContact CE-CG 3.95Å; M194-Y198 PolarHBondContact O-N 3.35Å; M194-Y198 HydrophobicContact SD-CD2 3.89Å; M194-Y198 HydrophobicContact SD-CG 4.02Å; Y198-T202 WeakPolarHBondContact O-CB 3.09Å; Y198-T202 PolarHBondContact O-N 2.88Å; Y198-T202 PolarHBondContact O-OG1 2.87Å; Y198-N382 HydrophobicContact CE2-CB 4.04Å; Y198-N382 VanDerWaalsContact OH-C 3.3Å; Y198-N382 PolarHBondContact OH-O 3.1Å; Y198-N382 VanDerWaalsContact OH-O 3.09Å
199	L	95	Very high	93	Very high	106 Å²	106	47.6 Å²	47.6	56%	0.555	27%	0.265	S	S	*	.	H	α-helix	trans	-65.1	-52.6	174.6	172.1	64.7	0	0	0	111.7	M194 F197 V201 T202 V203	M194-L199 VanDerWaalsContact O-CB 3.31Å; M194-L199 WeakPolarHBondContact O-CB 3.47Å; M194-L199 PolarHBondContact O-N 3.08Å; F197-L199 PolarHBondContact O-N 3.08Å; L199-V201 PolarHBondContact O-N 3.47Å; L199-T202 PolarHBondContact O-N 3.43Å; L199-T202 VanDerWaalsContact O-N 3.16Å; L199-V203 HydrophobicContact CD1-CG2 4.13Å; L199-V203 WeakPolarHBondContact O-CG2 3.35Å; L199-V203 PolarHBondContact O-N 3.46Å
200	P	94.3	Very high	93.1	Very high	9 Å²	9	54.1 Å²	54.1	6%	0.058	29%	0.288	C	S	.	.	H	α-helix	trans	-52.9	-44.2	171.6	-32.3	37.5	0	0	0	114.5	V113 A195 F197 V203 M204	V113-P200 HydrophobicContact CG1-CB 3.89Å; V113-P200 HydrophobicContact CG1-CG 4.35Å; A195-P200 WeakPolarHBondContact O-CD 2.89Å; F197-P200 WeakPolarHBondContact O-CD 3.48Å; P200-V203 PolarHBondContact O-N 3.13Å; P200-M204 HydrophobicContact CB-CE 4.35Å; P200-M204 WeakPolarHBondContact O-CB 3.33Å; P200-M204 VanDerWaalsContact O-CG 3.28Å; P200-M204 WeakPolarHBondContact O-CG 3.39Å; P200-M204 PolarHBondContact O-N 3.34Å
201	V	94.6	Very high	93	Very high	20 Å²	20	50.2 Å²	50.2	12%	0.121	27%	0.271	C	S	.	.	H	α-helix	trans	-60.5	-47	175.5	168.2	0	0	0	0	111.1	F197 L199 V203 M204 C205 F374 I375	F197-V201 HydrophobicContact CD1-CG2 4.47Å; F197-V201 HydrophobicContact CD2-CG2 3.87Å; F197-V201 HydrophobicContact CE1-CG2 4.17Å; F197-V201 HydrophobicContact CE2-CG2 3.48Å; F197-V201 VanDerWaalsContact CE2-CG2 3.48Å; F197-V201 HydrophobicContact CG-CG2 4.35Å; F197-V201 HydrophobicContact CZ-CG2 3.67Å; F197-V201 WeakPolarHBondContact O-CB 3.32Å; F197-V201 WeakPolarHBondContact O-CG2 3.45Å; F197-V201 PolarHBondContact O-N 2.86Å; L199-V201 PolarHBondContact O-N 3.47Å; V201-V203 VanDerWaalsContact C-N 3.34Å; V201-V203 PolarHBondContact O-N 2.7Å; V201-M204 PolarHBondContact O-N 3.37Å; V201-C205 WeakPolarHBondContact O-CB 3.49Å; V201-C205 PolarHBondContact O-N 3.37Å; V201-C205 PolarHBondContact O-SG 2.94Å; V201-C205 VanDerWaalsContact O-SG 3.36Å; V201-F374 HydrophobicContact CG2-CE1 3.78Å; V201-I375 HydrophobicContact CG1-CD1 4.37Å; V201-I375 HydrophobicContact CG1-CG1 4.25Å
202	T	95.9	Very high	92.8	Very high	81 Å²	81	54.3 Å²	54.3	50%	0.497	28%	0.276	S	S	.	.	H	α-helix	trans	-61.3	-42	179.5	-58.9	0	0	0	0	111.6	Y198 L199 T206	Y198-T202 WeakPolarHBondContact O-CB 3.09Å; Y198-T202 PolarHBondContact O-N 2.88Å; Y198-T202 PolarHBondContact O-OG1 2.87Å; L199-T202 PolarHBondContact O-N 3.43Å; L199-T202 VanDerWaalsContact O-N 3.16Å; T202-T206 WeakPolarHBondContact O-CB 3.12Å; T202-T206 WeakPolarHBondContact O-CG2 3.39Å; T202-T206 PolarHBondContact O-N 2.89Å; T202-T206 PolarHBondContact O-OG1 2.95Å
203	V	95.9	Very high	92.7	Very high	40 Å²	40	60.7 Å²	60.7	24%	0.242	30%	0.296	C	S	.	.	H	α-helix	trans	-66.6	-44	174.9	177.9	0	0	0	0	111.2	L117 F121 L199 P200 V201 C205 T206 L207	L117-V203 HydrophobicContact CD1-CB 3.98Å; L117-V203 HydrophobicContact CD1-CG1 3.69Å; F121-V203 HydrophobicContact CE2-CG1 3.87Å; F121-V203 HydrophobicContact CZ-CG1 3.67Å; L199-V203 HydrophobicContact CD1-CG2 4.13Å; L199-V203 WeakPolarHBondContact O-CG2 3.35Å; L199-V203 PolarHBondContact O-N 3.46Å; P200-V203 PolarHBondContact O-N 3.13Å; V201-V203 VanDerWaalsContact C-N 3.34Å; V201-V203 PolarHBondContact O-N 2.7Å; V203-C205 PolarHBondContact O-N 2.99Å; V203-T206 WeakPolarHBondContact CA-OG1 3.33Å; V203-T206 PolarHBondContact O-N 2.65Å; V203-T206 PolarHBondContact O-OG1 3.01Å; V203-T206 VanDerWaalsContact O-OG1 3.09Å; V203-L207 HydrophobicContact CG1-CD1 3.77Å; V203-L207 HydrophobicContact CG1-CG 4.17Å; V203-L207 VanDerWaalsContact O-CB 3.3Å; V203-L207 WeakPolarHBondContact O-CB 3.44Å; V203-L207 WeakPolarHBondContact O-CG 3.4Å; V203-L207 PolarHBondContact O-N 2.85Å
204	M	93.4	Very high	92.5	Very high	4 Å²	4	62.8 Å²	62.8	2%	0.02	31%	0.305	C	S	.	.	H	α-helix	trans	-63.2	-42.6	177.5	-72.1	-171.9	-72.8	0	0	112.5	L116 L117 P200 V201 Y208 L371 F374	L116-M204 HydrophobicContact CB-SD 3.76Å; L117-M204 HydrophobicContact CB-SD 4.46Å; L117-M204 HydrophobicContact CD1-CG 3.75Å; P200-M204 HydrophobicContact CB-CE 4.35Å; P200-M204 WeakPolarHBondContact O-CB 3.33Å; P200-M204 VanDerWaalsContact O-CG 3.28Å; P200-M204 WeakPolarHBondContact O-CG 3.39Å; P200-M204 PolarHBondContact O-N 3.34Å; V201-M204 PolarHBondContact O-N 3.37Å; M204-Y208 VanDerWaalsContact O-CB 3.31Å; M204-Y208 WeakPolarHBondContact O-CB 3.35Å; M204-Y208 PolarHBondContact O-N 3.03Å; M204-L371 HydrophobicContact CB-CD2 4.01Å; M204-L371 HydrophobicContact CG-CD2 4.21Å; M204-L371 HydrophobicContact SD-CD2 3.54Å; M204-L371 VanDerWaalsContact SD-CD2 3.54Å; M204-F374 HydrophobicContact CE-CD1 3.95Å; M204-F374 HydrophobicContact CE-CE1 3.58Å; M204-F374 HydrophobicContact CE-CZ 4.46Å
205	C	93.8	Very high	92.2	Very high	58 Å²	58	60.4 Å²	60.4	39%	0.392	29%	0.293	S	S	.	.	H	α-helix	trans	-64.1	-46.9	176.7	-74.3	0	0	0	0	112.3	V201 V203 Y208 W209	V201-C205 WeakPolarHBondContact O-CB 3.49Å; V201-C205 PolarHBondContact O-N 3.37Å; V201-C205 PolarHBondContact O-SG 2.94Å; V201-C205 VanDerWaalsContact O-SG 3.36Å; V203-C205 PolarHBondContact O-N 2.99Å; C205-Y208 PolarHBondContact O-N 3.39Å; C205-W209 WeakPolarHBondContact O-CB 3.35Å; C205-W209 PolarHBondContact O-N 2.76Å
206	T	94.4	Very high	92	Very high	73 Å²	73	60 Å²	60	45%	0.448	28%	0.281	S	S	.	.	H	α-helix	trans	-67.4	-39.3	178.8	52.5	0	0	0	0	112.4	T202 V203 R210	T202-T206 WeakPolarHBondContact O-CB 3.12Å; T202-T206 WeakPolarHBondContact O-CG2 3.39Å; T202-T206 PolarHBondContact O-N 2.89Å; T202-T206 PolarHBondContact O-OG1 2.95Å; V203-T206 WeakPolarHBondContact CA-OG1 3.33Å; V203-T206 PolarHBondContact O-N 2.65Å; V203-T206 PolarHBondContact O-OG1 3.01Å; V203-T206 VanDerWaalsContact O-OG1 3.09Å; T206-R210 WeakPolarHBondContact O-CG 3.36Å; T206-R210 PolarHBondContact O-N 3.16Å
207	L	93.1	Very high	91.8	Very high	12 Å²	12	61.9 Å²	61.9	6%	0.063	29%	0.287	C	S	.	.	H	α-helix	trans	-61.7	-43.7	170.9	-71.1	173.9	0	0	0	111.4	F121 Y124 V203 R210 I211	F121-L207 HydrophobicContact CD1-CD1 3.74Å; F121-L207 HydrophobicContact CD1-CD2 4.16Å; F121-L207 HydrophobicContact CD2-CD1 4Å; F121-L207 HydrophobicContact CE1-CD1 3.77Å; F121-L207 HydrophobicContact CE1-CD2 4.03Å; F121-L207 HydrophobicContact CE1-CG 4.46Å; F121-L207 HydrophobicContact CE2-CD1 4.03Å; F121-L207 HydrophobicContact CG-CD1 3.86Å; F121-L207 HydrophobicContact CZ-CD1 3.92Å; Y124-L207 HydrophobicContact CD1-CD2 3.63Å; Y124-L207 HydrophobicContact CD2-CD2 4.18Å; Y124-L207 HydrophobicContact CE1-CD2 4.17Å; Y124-L207 HydrophobicContact CG-CD2 3.63Å; V203-L207 HydrophobicContact CG1-CD1 3.77Å; V203-L207 HydrophobicContact CG1-CG 4.17Å; V203-L207 VanDerWaalsContact O-CB 3.3Å; V203-L207 WeakPolarHBondContact O-CB 3.44Å; V203-L207 WeakPolarHBondContact O-CG 3.4Å; V203-L207 PolarHBondContact O-N 2.85Å; L207-R210 PolarHBondContact O-N 2.98Å; L207-I211 VanDerWaalsContact O-CG1 3.32Å; L207-I211 WeakPolarHBondContact O-CG1 3.5Å; L207-I211 PolarHBondContact O-N 3.08Å
208	Y	89.6	Confident	91.5	Very high	47 Å²	47	63.4 Å²	63.4	18%	0.184	29%	0.293	C	S	.	.	H	α-helix	trans	-67.7	-40.2	180	-169.4	-95.8	0	0	0	112.6	M204 C205 R210 I211 Y212 A364 L367 S368 L371	M204-Y208 VanDerWaalsContact O-CB 3.31Å; M204-Y208 WeakPolarHBondContact O-CB 3.35Å; M204-Y208 PolarHBondContact O-N 3.03Å; C205-Y208 PolarHBondContact O-N 3.39Å; Y208-R210 VanDerWaalsContact C-N 3.34Å; Y208-R210 PolarHBondContact O-N 3.06Å; Y208-I211 WeakPolarHBondContact O-CB 3.32Å; Y208-I211 PolarHBondContact O-N 2.97Å; Y208-Y212 PolarHBondContact O-N 3.49Å; Y208-A364 WeakPolarHBondContact CE2-O 3.35Å; Y208-A364 PolarHBondContact OH-O 3.45Å; Y208-L367 HydrophobicContact CD2-CB 4.5Å; Y208-L367 HydrophobicContact CE2-CB 4.22Å; Y208-S368 WeakPolarHBondContact OH-CB 3.42Å; Y208-S368 PolarHBondContact OH-OG 2.88Å; Y208-L371 HydrophobicContact CD2-CD1 4.09Å; Y208-L371 HydrophobicContact CG-CD1 4.18Å
209	W	90.9	Very high	91	Very high	173 Å²	173	61.8 Å²	61.8	66%	0.655	29%	0.29	S	S	*	.	H	α-helix	trans	-58.5	-44.3	171.8	-178.4	-109.9	0	0	0	111.8	C205 Y212 R213	C205-W209 WeakPolarHBondContact O-CB 3.35Å; C205-W209 PolarHBondContact O-N 2.76Å; W209-Y212 PolarHBondContact O-N 3.39Å; W209-R213 PolarHBondContact O-N 2.94Å
210	R	92	Very high	90.7	Very high	150 Å²	150	65.2 Å²	65.2	57%	0.566	30%	0.296	S	S	*	.	H	α-helix	trans	-63.6	-39.5	174.2	-70.2	176.9	178.5	-154.3	0.5	112.3	Y124 T206 L207 Y208 E214	Y124-R210 HydrophobicContact CD2-CB 4.19Å; Y124-R210 HydrophobicContact CE2-CB 3.74Å; T206-R210 WeakPolarHBondContact O-CG 3.36Å; T206-R210 PolarHBondContact O-N 3.16Å; L207-R210 PolarHBondContact O-N 2.98Å; Y208-R210 VanDerWaalsContact C-N 3.34Å; Y208-R210 PolarHBondContact O-N 3.06Å; R210-E214 VanDerWaalsContact O-CB 3.31Å; R210-E214 WeakPolarHBondContact O-CB 3.37Å; R210-E214 PolarHBondContact O-N 3.11Å
211	I	89.9	Confident	90.3	Very high	4 Å²	4	70.4 Å²	70.4	2%	0.021	32%	0.319	C	S	.	.	H	α-helix	trans	-60.9	-45.6	173.3	-71.3	165.4	0	0	0	111	R123 Y124 V127 L207 Y208 T215 A364	R123-I211 HydrophobicContact CB-CD1 4.18Å; Y124-I211 HydrophobicContact CD2-CG1 4.17Å; V127-I211 HydrophobicContact CG2-CG2 4.34Å; L207-I211 VanDerWaalsContact O-CG1 3.32Å; L207-I211 WeakPolarHBondContact O-CG1 3.5Å; L207-I211 PolarHBondContact O-N 3.08Å; Y208-I211 WeakPolarHBondContact O-CB 3.32Å; Y208-I211 PolarHBondContact O-N 2.97Å; I211-T215 VanDerWaalsContact O-CB 3.32Å; I211-T215 WeakPolarHBondContact O-CB 3.27Å; I211-T215 PolarHBondContact O-N 3.21Å; I211-T215 PolarHBondContact O-OG1 2.9Å; I211-A364 HydrophobicContact CG2-CB 4.23Å
212	Y	87.8	Confident	89.8	Confident	122 Å²	122	70.3 Å²	70.3	48%	0.478	32%	0.318	S	S	.	.	H	α-helix	trans	-61.9	-52	179.4	176	-102.7	0	0	0	111.4	Y208 W209 E214 T215 E216	Y208-Y212 PolarHBondContact O-N 3.49Å; W209-Y212 PolarHBondContact O-N 3.39Å; Y212-E214 PolarHBondContact O-N 3.25Å; Y212-T215 PolarHBondContact O-N 2.85Å; Y212-E216 PolarHBondContact O-N 2.76Å
213	R	89.8	Confident	89.3	Confident	167 Å²	167	69.2 Å²	69.2	63%	0.63	32%	0.317	S	S	*	.	H	α-helix	trans	-56.2	-48.3	177.4	-177.1	177.6	175.1	-170.2	-3.1	112.1	W209 T215 E216 N217	W209-R213 PolarHBondContact O-N 2.94Å; R213-T215 VanDerWaalsContact C-N 3.33Å; R213-T215 PolarHBondContact O-N 3.41Å; R213-E216 PolarHBondContact O-N 3.02Å; R213-N217 VanDerWaalsContact O-CG 3.27Å; R213-N217 PolarHBondContact O-N 2.89Å; R213-N217 PolarHBondContact O-OD1 3.07Å
214	E	89.1	Confident	88.7	Confident	52 Å²	52	70.5 Å²	70.5	24%	0.243	33%	0.332	C	S	.	.	H	α-helix	trans	-63.1	-38.5	178.8	178.7	61.5	-173.6	0	0	112.5	V127 T128 R210 Y212 E216 R218	V127-E214 HydrophobicContact CG1-CB 4.39Å; V127-E214 HydrophobicContact CG1-CG 3.87Å; T128-E214 HydrophobicContact CG2-CG 4.26Å; R210-E214 VanDerWaalsContact O-CB 3.31Å; R210-E214 WeakPolarHBondContact O-CB 3.37Å; R210-E214 PolarHBondContact O-N 3.11Å; Y212-E214 PolarHBondContact O-N 3.25Å; E214-E216 VanDerWaalsContact C-N 3.32Å; E214-E216 PolarHBondContact O-N 3.02Å; E214-R218 WeakPolarHBondContact O-CG 3.41Å; E214-R218 PolarHBondContact O-N 3.26Å; E214-R218 IonicContact OE1-CZ 3.81Å; E214-R218 IonicContact OE1-NE 3.83Å; E214-R218 PolarHBondContact OE1-NE 2.95Å; E214-R218 IonicContact OE1-NH2 2.65Å; E214-R218 PolarHBondContact OE1-NH2 3.05Å
215	T	86.6	Confident	88.1	Confident	5 Å²	5	74.7 Å²	74.7	3%	0.031	35%	0.354	C	S	.	.	H	α-helix	trans	-69.9	-30.7	178.3	-53.9	0	0	0	0	111.8	I211 Y212 R213 A219 K361	I211-T215 VanDerWaalsContact O-CB 3.32Å; I211-T215 WeakPolarHBondContact O-CB 3.27Å; I211-T215 PolarHBondContact O-N 3.21Å; I211-T215 PolarHBondContact O-OG1 2.9Å; Y212-T215 PolarHBondContact O-N 2.85Å; R213-T215 VanDerWaalsContact C-N 3.33Å; R213-T215 PolarHBondContact O-N 3.41Å; T215-A219 PolarHBondContact O-N 3.23Å; T215-K361 HydrophobicContact CG2-CB 4.34Å; T215-K361 HydrophobicContact CG2-CD 4.39Å; T215-K361 HydrophobicContact CG2-CG 3.35Å
216	E	87.3	Confident	87.3	Confident	54 Å²	54	76 Å²	76	25%	0.252	35%	0.354	S	S	.	.	H	α-helix	trans	-80.1	-39.7	176.3	-162.1	56.2	-139.6	0	0	112.6	Y212 R213 E214 R218 A219 R220 K361	Y212-E216 PolarHBondContact O-N 2.76Å; R213-E216 PolarHBondContact O-N 3.02Å; E214-E216 VanDerWaalsContact C-N 3.32Å; E214-E216 PolarHBondContact O-N 3.02Å; E216-R218 VanDerWaalsContact C-N 3.34Å; E216-R218 PolarHBondContact O-N 3.26Å; E216-A219 WeakPolarHBondContact O-CA 3.49Å; E216-A219 WeakPolarHBondContact O-CB 3.46Å; E216-A219 PolarHBondContact O-N 2.97Å; E216-R220 WeakPolarHBondContact O-CG 3.38Å; E216-R220 PolarHBondContact O-N 2.9Å; E216-K361 IonicContact OE1-NZ 3.63Å; E216-K361 VanDerWaalsContact OE2-CE 3.24Å; E216-K361 WeakPolarHBondContact OE2-CE 3.48Å; E216-K361 IonicContact OE2-NZ 2.63Å; E216-K361 PolarHBondContact OE2-NZ 2.98Å
217	N	87.8	Confident	85.8	Confident	65 Å²	65	74.9 Å²	74.9	35%	0.348	36%	0.357	S	S	.	.	H	α-helix	trans	-52.3	-52.5	171.8	-74.1	-6.7	0	0	0	111	R213 A219 R220 E221	R213-N217 VanDerWaalsContact O-CG 3.27Å; R213-N217 PolarHBondContact O-N 2.89Å; R213-N217 PolarHBondContact O-OD1 3.07Å; N217-A219 PolarHBondContact O-N 2.83Å; N217-R220 WeakPolarHBondContact O-CB 3.4Å; N217-R220 PolarHBondContact O-N 3.27Å; N217-R220 VanDerWaalsContact O-N 3.07Å; N217-E221 PolarHBondContact O-N 3.45Å
218	R	84.4	Confident	84.1	Confident	37 Å²	37	78.8 Å²	78.8	14%	0.14	39%	0.385	C	S	.	.	H	α-helix	trans	-62.1	-30.5	177.2	-68.6	175.1	-174.5	-173.3	2.5	113.3	V127 T128 E214 E216 L222 L357 E360	V127-R218 PolarHBondContact O-NH1 3.04Å; V127-R218 PolarHBondContact O-NH2 3.17Å; T128-R218 PolarHBondContact O-NH2 3.35Å; E214-R218 WeakPolarHBondContact O-CG 3.41Å; E214-R218 PolarHBondContact O-N 3.26Å; E214-R218 IonicContact OE1-CZ 3.81Å; E214-R218 IonicContact OE1-NE 3.83Å; E214-R218 PolarHBondContact OE1-NE 2.95Å; E214-R218 IonicContact OE1-NH2 2.65Å; E214-R218 PolarHBondContact OE1-NH2 3.05Å; E216-R218 VanDerWaalsContact C-N 3.34Å; E216-R218 PolarHBondContact O-N 3.26Å; R218-L222 WeakPolarHBondContact O-CB 3.44Å; R218-L222 PolarHBondContact O-N 3.45Å; R218-L222 VanDerWaalsContact O-N 3.07Å; R218-L357 HydrophobicContact CB-CD2 3.89Å; R218-E360 IonicContact NH1-OE2 3.51Å
219	A	85.5	Confident	82.4	Confident	18 Å²	18	80.7 Å²	80.7	15%	0.149	40%	0.396	C	S	.	.	H	α-helix	trans	-68.5	-39.6	174.4	0	0	0	0	0	111.7	T215 E216 N217 L222 A223 L357	T215-A219 PolarHBondContact O-N 3.23Å; E216-A219 WeakPolarHBondContact O-CA 3.49Å; E216-A219 WeakPolarHBondContact O-CB 3.46Å; E216-A219 PolarHBondContact O-N 2.97Å; N217-A219 PolarHBondContact O-N 2.83Å; A219-L222 PolarHBondContact O-N 3.21Å; A219-A223 WeakPolarHBondContact O-CB 3.33Å; A219-A223 PolarHBondContact O-N 2.78Å; A219-L357 HydrophobicContact CB-CD1 4.1Å
220	R	87.6	Confident	80.1	Confident	178 Å²	178	78 Å²	78	67%	0.672	40%	0.399	S	S	*	.	H	α-helix	trans	-66.3	-45.3	173.9	-64.7	175.7	-177.6	-151.8	-0.2	111.8	E216 N217 L222 A223 A224	E216-R220 WeakPolarHBondContact O-CG 3.38Å; E216-R220 PolarHBondContact O-N 2.9Å; N217-R220 WeakPolarHBondContact O-CB 3.4Å; N217-R220 PolarHBondContact O-N 3.27Å; N217-R220 VanDerWaalsContact O-N 3.07Å; R220-L222 VanDerWaalsContact C-N 3.3Å; R220-L222 PolarHBondContact O-N 3.08Å; R220-A223 PolarHBondContact O-N 3.33Å; R220-A224 WeakPolarHBondContact O-CB 3.32Å; R220-A224 PolarHBondContact O-N 3.05Å
221	E	87.1	Confident	77.8	Confident	119 Å²	119	75.5 Å²	75.5	56%	0.556	40%	0.402	S	S	*	.	H	α-helix	trans	-54.5	-45.6	172.8	-71.5	173.9	-166.7	0	0	112.2	N217 A224 L225	N217-E221 PolarHBondContact O-N 3.45Å; E221-A224 PolarHBondContact O-N 3.34Å; E221-L225 WeakPolarHBondContact O-CG 3.5Å; E221-L225 PolarHBondContact O-N 3.08Å
222	L	84.4	Confident	75.5	Confident	18 Å²	18	79.1 Å²	79.1	9%	0.094	44%	0.44	C	S	.	.	H	α-helix	trans	-75.4	-25.3	-178.3	-88.6	156.1	0	0	0	114	R218 A219 R220 L225 Q226 K353 L357	R218-L222 WeakPolarHBondContact O-CB 3.44Å; R218-L222 PolarHBondContact O-N 3.45Å; R218-L222 VanDerWaalsContact O-N 3.07Å; A219-L222 PolarHBondContact O-N 3.21Å; R220-L222 VanDerWaalsContact C-N 3.3Å; R220-L222 PolarHBondContact O-N 3.08Å; L222-L225 HydrophobicContact CD2-CD1 4.43Å; L222-Q226 VanDerWaalsContact O-CG 3.29Å; L222-Q226 WeakPolarHBondContact O-CG 3.47Å; L222-K353 HydrophobicContact CD1-CB 3.83Å; L222-K353 HydrophobicContact CD1-CD 4.44Å; L222-K353 HydrophobicContact CD2-CB 3.49Å; L222-K353 VanDerWaalsContact CD2-CB 3.49Å; L222-K353 HydrophobicContact CD2-CD 3.75Å; L222-K353 HydrophobicContact CD2-CG 4.29Å; L222-K353 HydrophobicContact CG-CB 4.31Å; L222-K353 HydrophobicContact CG-CD 4.5Å; L222-L357 HydrophobicContact CB-CD1 4.04Å; L222-L357 HydrophobicContact CD1-CD1 3.44Å; L222-L357 VanDerWaalsContact CD1-CD1 3.44Å; L222-L357 HydrophobicContact CD1-CG 3.86Å; L222-L357 HydrophobicContact CG-CD1 4.35Å
223	A	84.7	Confident	73.1	Confident	58 Å²	58	83.3 Å²	83.3	48%	0.479	46%	0.461	S	S	.	.	H	α-helix	trans	-70.6	-44.3	167.2	0	0	0	0	0	111.3	A219 R220 L225 Q226 G227	A219-A223 WeakPolarHBondContact O-CB 3.33Å; A219-A223 PolarHBondContact O-N 2.78Å; R220-A223 PolarHBondContact O-N 3.33Å; A223-L225 PolarHBondContact O-N 3.31Å; A223-Q226 PolarHBondContact O-N 3.1Å; A223-G227 PolarHBondContact O-N 2.92Å
224	A	83.8	Confident	71	Confident	66 Å²	66	79.3 Å²	79.3	55%	0.545	47%	0.471	S	S	.	.	H	α-helix	trans	-59.7	-45.3	177.7	0	0	0	0	0	112	R220 E221 Q226 G227 S228	R220-A224 WeakPolarHBondContact O-CB 3.32Å; R220-A224 PolarHBondContact O-N 3.05Å; E221-A224 PolarHBondContact O-N 3.34Å; A224-Q226 PolarHBondContact O-N 3.08Å; A224-Q226 VanDerWaalsContact O-N 3.14Å; A224-G227 PolarHBondContact O-N 3.14Å; A224-S228 PolarHBondContact O-N 3.04Å; A224-S228 VanDerWaalsContact O-N 3.16Å; A224-S228 PolarHBondContact O-OG 2.79Å
225	L	81.1	Confident	68.3	Low	92 Å²	92	80.5 Å²	80.5	48%	0.482	50%	0.498	S	S	.	.	H	α-helix	trans	-62.8	-15.1	174.4	-72.1	171.2	0	0	0	114.4	E221 L222 A223 S228	E221-L225 WeakPolarHBondContact O-CG 3.5Å; E221-L225 PolarHBondContact O-N 3.08Å; L222-L225 HydrophobicContact CD2-CD1 4.43Å; A223-L225 PolarHBondContact O-N 3.31Å; L225-S228 PolarHBondContact O-OG 3.34Å
226	Q	76.1	Confident	65.7	Low	85 Å²	85	83.9 Å²	83.9	40%	0.397	53%	0.533	S	S	.	.	H	α-helix	trans	-100.5	-35.6	176.6	-72	175.4	-1.8	0	0	111.7	L222 A223 A224 S228 E229 T354	L222-Q226 VanDerWaalsContact O-CG 3.29Å; L222-Q226 WeakPolarHBondContact O-CG 3.47Å; A223-Q226 PolarHBondContact O-N 3.1Å; A224-Q226 PolarHBondContact O-N 3.08Å; A224-Q226 VanDerWaalsContact O-N 3.14Å; Q226-S228 VanDerWaalsContact C-N 3.27Å; Q226-S228 PolarHBondContact O-N 3.08Å; Q226-E229 PolarHBondContact O-N 3.34Å; Q226-T354 PolarHBondContact NE2-OG1 2.98Å
227	G	62.5	Low	63.4	Low	50 Å²	50	87.4 Å²	87.4	52%	0.515	56%	0.564	S	S	.	*	H	α-helix	trans	-63.6	-30.5	173.4	0	0	0	0	0	113.4	A223 A224 E229 T230	A223-G227 PolarHBondContact O-N 2.92Å; A224-G227 PolarHBondContact O-N 3.14Å; G227-E229 PolarHBondContact O-N 2.94Å; G227-T230 PolarHBondContact O-OG1 2.91Å
228	S	57.7	Low	60.7	Low	94 Å²	94	89.9 Å²	89.9	66%	0.657	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	-2.4	176.1	60.7	0	0	0	0	115.3	A224 L225 Q226	A224-S228 PolarHBondContact O-N 3.04Å; A224-S228 VanDerWaalsContact O-N 3.16Å; A224-S228 PolarHBondContact O-OG 2.79Å; L225-S228 PolarHBondContact O-OG 3.34Å; Q226-S228 VanDerWaalsContact C-N 3.27Å; Q226-S228 PolarHBondContact O-N 3.08Å
229	E	54.3	Low	58.4	Low	87 Å²	87	93.8 Å²	93.8	41%	0.407	62%	0.62	S	S	.	*	T	Hydrogen-bonded Turn	trans	-105	15.4	179.3	-66.4	-158.6	146.7	0	0	114.2	Q226 G227 P231	Q226-E229 PolarHBondContact O-N 3.34Å; G227-E229 PolarHBondContact O-N 2.94Å; E229-P231 WeakPolarHBondContact O-CD 3.13Å
230	T	41.7	Very low	55.8	Low	116 Å²	116	98.8 Å²	98.8	71%	0.712	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-68.3	119.8	172.6	-34.2	0	0	0	0	110.4	G227 G232	G227-T230 PolarHBondContact O-OG1 2.91Å; T230-G232 PolarHBondContact O-N 3.11Å
231	P	45.7	Very low	53.1	Low	99 Å²	99	95.7 Å²	95.7	64%	0.643	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-70	128.7	172.8	-12.2	28	0	0	0	109.2	E229 K233	E229-P231 WeakPolarHBondContact O-CD 3.13Å; P231-K233 PolarHBondContact O-N 3.1Å
232	G	39.6	Very low	50.4	Low	79 Å²	79	98.9 Å²	98.9	81%	0.814	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-58.3	122.5	173	0	0	0	0	0	110.6	T230 G234	T230-G232 PolarHBondContact O-N 3.11Å; G232-G234 PolarHBondContact O-N 2.91Å
233	K	39.2	Very low	47.7	Very low	211 Å²	211	109.2 Å²	109.2	92%	0.917	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-65	125.5	161.1	-82.4	-175.5	171.8	-177.3	0	107.1	P231	P231-K233 PolarHBondContact O-N 3.1Å
234	G	44.3	Very low	45	Very low	82 Å²	82	112.4 Å²	112.4	85%	0.845	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-66	147	172	0	0	0	0	0	111	G232	G232-G234 PolarHBondContact O-N 2.91Å
235	G	33.5	Very low	42.5	Very low	77 Å²	77	118.1 Å²	118.1	79%	0.794	75%	0.746	S	S	*	*			trans	-159.4	131.3	174.4	0	0	0	0	0	110.9
236	G	32.3	Very low	40.5	Very low	76 Å²	76	120 Å²	120	78%	0.784	76%	0.764	S	S	*	*			trans	61.4	95.4	159.1	0	0	0	0	0	117.7
237	S	38.9	Very low	38.2	Very low	129 Å²	129	118.9 Å²	118.9	90%	0.902	78%	0.775	S	S	*	*			trans	-72.2	125.9	144.7	52.2	0	0	0	0	109.3
238	S	30.8	Very low	36.6	Very low	117 Å²	117	121.1 Å²	121.1	82%	0.818	79%	0.789	S	S	*	*			trans	-140.8	118	161	46.5	0	0	0	0	110
239	S	36.1	Very low	35.2	Very low	119 Å²	119	126 Å²	126	83%	0.832	80%	0.801	S	S	*	*			trans	-113.9	113.7	175.6	54.1	0	0	0	0	109
240	S	30.2	Very low	33.9	Very low	122 Å²	122	125.6 Å²	125.6	85%	0.853	82%	0.82	S	S	*	*			trans	-136.6	140.9	169.1	-61	0	0	0	0	108.9
241	S	31.6	Very low	33.2	Very low	114 Å²	114	125.7 Å²	125.7	80%	0.797	83%	0.826	S	S	*	*			trans	-88.3	154.5	-176.7	-55	0	0	0	0	112.1
242	E	29.4	Very low	33.2	Very low	186 Å²	186	126.5 Å²	126.5	87%	0.869	83%	0.831	S	S	*	*				169.5	107.4	125.5	-91.1	176.1	142.3	0	0	108
243	R	27.6	Very low	32.8	Very low	235 Å²	235	132 Å²	132	89%	0.887	84%	0.835	S	S	*	*				76.7	98.7	74	-168.8	-178.1	-168.2	-164.4	2.5	113.4
244	S	28.2	Very low	32.4	Very low	125 Å²	125	128 Å²	128	87%	0.874	83%	0.829	S	S	*	*			trans	-161.8	132.6	141.2	-84.1	0	0	0	0	111.5
245	Q	31.9	Very low	32.7	Very low	185 Å²	185	129.6 Å²	129.6	86%	0.864	82%	0.824	S	S	*	*			trans	-143.3	144.4	166.8	-111.3	-172.1	-0.9	0	0	104.9
246	P	38.7	Very low	33.4	Very low	133 Å²	133	131.8 Å²	131.8	86%	0.864	82%	0.824	S	S	*	*				-134.6	178.7	75.5	26.7	-6	0	0	0	112.8
247	G	27.6	Very low	33.4	Very low	60 Å²	60	132 Å²	132	62%	0.619	83%	0.826	S	S	*	*			cis	173.3	-170.3	-2.8	0	0	0	0	0	111.2
248	A	29.8	Very low	33.2	Very low	98 Å²	98	137.8 Å²	137.8	81%	0.81	83%	0.829	S	S	*	*			trans	63	153.1	-177.2	0	0	0	0	0	116.1
249	E	27.4	Very low	33.1	Very low	196 Å²	196	138.4 Å²	138.4	92%	0.916	83%	0.831	S	S	*	*			cis	-168.4	146.2	-44.9	-118.5	174.5	155	0	0	106.2
250	G	28.3	Very low	33.1	Very low	79 Å²	79	138.2 Å²	138.2	81%	0.814	83%	0.829	S	S	*	*			trans	147.8	95.3	179.5	0	0	0	0	0	115
251	S	27.2	Very low	33.3	Very low	118 Å²	118	144.4 Å²	144.4	83%	0.825	83%	0.833	S	S	*	*			trans	-118.5	175.7	175.5	-66.6	0	0	0	0	109.4
252	P	45.7	Very low	33.3	Very low	115 Å²	115	144.3 Å²	144.3	75%	0.747	83%	0.832	S	S	*	*			cis	-132.6	171.9	-47.4	37.7	-24.2	0	0	0	111.9
253	E	30.1	Very low	33.4	Very low	194 Å²	194	141 Å²	141	91%	0.907	83%	0.827	S	S	*	*			trans	-163.2	159.7	144.7	-120.9	171.4	-157.7	0	0	113.8
254	T	30.6	Very low	33.6	Very low	127 Å²	127	141.6 Å²	141.6	78%	0.779	83%	0.83	S	S	*	*			trans	-159.2	179.1	-171.7	61.5	0	0	0	0	110.7
255	P	51.4	Low	33.9	Very low	116 Å²	116	139.9 Å²	139.9	75%	0.753	82%	0.823	S	S	*	*				-113.8	-138.4	-63.1	40.2	-23.6	0	0	0	107.3
256	P	48.2	Very low	34.1	Very low	123 Å²	123	136.7 Å²	136.7	80%	0.799	82%	0.819	S	S	*	*			cis	-125.5	165.8	-27.9	39	-23.9	0	0	0	114.3
257	G	30.9	Very low	33.9	Very low	80 Å²	80	141.9 Å²	141.9	83%	0.825	82%	0.821	S	S	*	*			trans	-153.6	128.8	169.9	0	0	0	0	0	113.3
258	R	35.3	Very low	34.2	Very low	252 Å²	252	146.8 Å²	146.8	95%	0.951	83%	0.832	S	S	*	*			trans	-106.9	138.5	176.7	-49	175.6	-155	-124.3	-0.3	109.7
259	C	29.9	Very low	34.4	Very low	129 Å²	129	149.8 Å²	149.8	87%	0.872	83%	0.834	S	S	*	*				168.9	152.3	107.9	-161.5	0	0	0	0	111.2
260	C	35.2	Very low	34.6	Very low	116 Å²	116	149.1 Å²	149.1	78%	0.784	83%	0.831	S	S	*	*			trans	-107.5	135.7	174.7	-55.2	0	0	0	0	110.9
261	R	34.2	Very low	34.6	Very low	251 Å²	251	149.7 Å²	149.7	95%	0.947	83%	0.827	S	S	*	*				-172	155.9	122.8	-107.8	171.7	-177.8	-129.6	-2.8	115
262	C	32.6	Very low	34.6	Very low	113 Å²	113	154.8 Å²	154.8	76%	0.764	83%	0.83	S	S	*	*			trans	-75.9	147.9	-179.8	-41.6	0	0	0	0	112.4
263	C	31.1	Very low	33.5	Very low	115 Å²	115	154.6 Å²	154.6	78%	0.777	83%	0.832	S	S	*	*				163.8	109.5	107.5	-89.8	0	0	0	0	113.8
264	R	30.6	Very low	33.3	Very low	248 Å²	248	156.3 Å²	156.3	94%	0.936	83%	0.83	S	S	*	*				178.6	146.7	117.8	-95.7	163.2	-170.4	-137.1	2.3	113.2
265	A	34.5	Very low	32.9	Very low	89 Å²	89	157.8 Å²	157.8	74%	0.736	83%	0.825	S	S	*	*			trans	-8.8	132.5	173.5	0	0	0	0	0	120.5	R267	A265-R267 PolarHBondContact O-N 3.38Å
266	P	37.7	Very low	31.8	Very low	119 Å²	119	161 Å²	161	77%	0.773	83%	0.83	S	S	*	*			trans	-70.3	123.4	155.1	-5	21.9	0	0	0	110.1
267	R	34.2	Very low	30.7	Very low	242 Å²	242	161.1 Å²	161.1	91%	0.913	82%	0.824	S	S	*	*			trans	-73.2	132.1	141	-68	-178.4	178.2	-169.4	0.8	106	A265	A265-R267 PolarHBondContact O-N 3.38Å
268	L	34.2	Very low	30.7	Very low	163 Å²	163	166.2 Å²	166.2	85%	0.853	83%	0.827	S	S	*	*			trans	-111.1	117.7	162.5	-87.5	170.5	0	0	0	108.2	Q270	L268-Q270 PolarHBondContact O-N 3.36Å
269	L	33.2	Very low	30.3	Very low	160 Å²	160	163.7 Å²	163.7	84%	0.838	83%	0.826	S	S	*	*			trans	-75.1	110.5	173.3	-86.6	158.5	0	0	0	108.9	A271	L269-A271 PolarHBondContact O-N 3.49Å
270	Q	31.9	Very low	30.1	Very low	183 Å²	183	167.2 Å²	167.2	86%	0.855	83%	0.829	S	S	*	*			trans	10.8	104.7	131.6	-176.5	171	-12	0	0	115.7	L268	L268-Q270 PolarHBondContact O-N 3.36Å
271	A	28.6	Very low	29.6	Very low	90 Å²	90	169.1 Å²	169.1	74%	0.744	83%	0.832	S	S	*	*			trans	-134.6	104.2	159.7	0	0	0	0	0	108.1	L269	L269-A271 PolarHBondContact O-N 3.49Å
272	Y	26.6	Very low	29.1	Very low	225 Å²	225	166.3 Å²	166.3	88%	0.882	83%	0.83	S	S	*	*			trans	-149.8	125.1	160.7	-108.9	-78.5	0	0	0	107.5
273	S	22	Very low	28.7	Very low	111 Å²	111	164.4 Å²	164.4	78%	0.776	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-69.9	142.2	-177.6	-152.5	0	0	0	0	110.6
274	W	25.4	Very low	28.2	Very low	230 Å²	230	164.7 Å²	164.7	87%	0.871	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-87.3	154.2	147	-63.3	94.5	0	0	0	108
275	K	23.5	Very low	27.8	Very low	158 Å²	158	161.8 Å²	161.8	69%	0.687	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-99.8	131.4	152.4	-96.4	179.6	120.8	-88.1	0	105.5	D277	K275-D277 IonicContact NZ-OD1 2.77Å; K275-D277 PolarHBondContact NZ-OD1 3.4Å; K275-D277 IonicContact NZ-OD2 3.39Å; K275-D277 PolarHBondContact NZ-OD2 3.37Å
276	E	27.1	Very low	27.3	Very low	183 Å²	183	165.9 Å²	165.9	86%	0.855	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-87.8	137.7	154.7	-70.7	151.8	152.6	0	0	105.8
277	D	26.9	Very low	26.5	Very low	126 Å²	126	164.5 Å²	164.5	67%	0.674	83%	0.829	S	S	*	*			trans	-131.9	136.3	162.9	-65	-63.6	0	0	0	103.4	K275	K275-D277 IonicContact NZ-OD1 2.77Å; K275-D277 PolarHBondContact NZ-OD1 3.4Å; K275-D277 IonicContact NZ-OD2 3.39Å; K275-D277 PolarHBondContact NZ-OD2 3.37Å
278	E	29.3	Very low	26	Very low	188 Å²	188	160.2 Å²	160.2	88%	0.879	82%	0.823	S	S	*	*			trans	-87.1	152.8	-154	-65.7	144.3	135.1	0	0	114.5
279	E	26.6	Very low	25.4	Very low	198 Å²	198	157.8 Å²	157.8	93%	0.925	82%	0.815	S	S	*	*			trans	-111.5	123.2	158.8	-73.3	-175.8	148.3	0	0	107.3
280	E	26.8	Very low	24.9	Very low	203 Å²	203	155.5 Å²	155.5	95%	0.949	81%	0.812	S	S	*	*			trans	-78.3	148.3	179.1	-67	180	129.2	0	0	111.5
281	D	23.9	Very low	24.4	Very low	156 Å²	156	151.3 Å²	151.3	83%	0.834	80%	0.804	S	S	*	*			trans	-119.1	133.2	-177.2	-173	21.2	0	0	0	110.2
282	E	25	Very low	24.2	Very low	193 Å²	193	155.8 Å²	155.8	90%	0.902	81%	0.809	S	S	*	*			trans	-161.5	124.8	179.9	-107.3	-76.2	134.5	0	0	108.4
283	G	23.5	Very low	24	Very low	73 Å²	73	148.5 Å²	148.5	75%	0.753	80%	0.802	S	S	*	*			trans	140.8	44.3	177.6	0	0	0	0	0	116.9
284	S	21	Very low	24.1	Very low	120 Å²	120	152.7 Å²	152.7	84%	0.839	81%	0.809	S	S	*	*			trans	-75	149.5	179.9	53.8	0	0	0	0	114.1
285	M	22.7	Very low	24	Very low	187 Å²	187	149.8 Å²	149.8	92%	0.921	81%	0.805	S	S	*	*			trans	-152.1	146.8	140.9	-158	137.1	80.5	0	0	113.3
286	E	23.4	Very low	24.6	Very low	176 Å²	176	148 Å²	148	82%	0.822	81%	0.81	S	S	*	*			trans	-77.6	179.4	178.3	-63.8	177.5	122.3	0	0	112.8
287	S	21.5	Very low	24.4	Very low	90 Å²	90	141.9 Å²	141.9	63%	0.629	80%	0.796	S	S	*	*			cis	-171	-150	-34.8	68.4	0	0	0	0	107.1
288	L	23.5	Very low	24.4	Very low	152 Å²	152	142.1 Å²	142.1	80%	0.796	81%	0.808	S	S	*	*			trans	72	154.9	172.8	-49.9	177.7	0	0	0	117.9
289	T	21.8	Very low	24.1	Very low	111 Å²	111	141.3 Å²	141.3	68%	0.681	80%	0.804	S	S	*	*				-171	147.1	-65.3	29.2	0	0	0	0	110.1
290	S	20.9	Very low	24.1	Very low	112 Å²	112	139 Å²	139	78%	0.783	80%	0.803	S	S	*	*			trans	60.8	161.6	165.6	39.5	0	0	0	0	117
291	S	22.8	Very low	24	Very low	96 Å²	96	134.6 Å²	134.6	67%	0.671	79%	0.79	S	S	*	*			cis	-170.8	170.6	-11.2	45.1	0	0	0	0	108
292	E	23.8	Very low	24.1	Very low	184 Å²	184	134.4 Å²	134.4	86%	0.86	79%	0.787	S	S	*	*			cis	-163.3	170.7	-22.4	-103.4	163.1	80.9	0	0	109
293	G	21.9	Very low	24	Very low	71 Å²	71	134.7 Å²	134.7	73%	0.732	79%	0.786	S	S	*	*			trans	87.2	149.5	174.3	0	0	0	0	0	115.9
294	E	24.6	Very low	24.4	Very low	200 Å²	200	139.6 Å²	139.6	94%	0.935	79%	0.791	S	S	*	*			cis	-153.6	154.9	-9.4	-132	176.3	136.4	0	0	110.2
295	E	23.6	Very low	24.8	Very low	168 Å²	168	139.7 Å²	139.7	79%	0.785	79%	0.788	S	S	*	*			trans	-97.2	-178.1	179.4	-93.6	-87	142.5	0	0	110.1	G297	E295-G297 PolarHBondContact OE2-N 2.92Å
296	P	36.4	Very low	24.8	Very low	120 Å²	120	139.8 Å²	139.8	78%	0.779	79%	0.789	S	S	*	*			cis	-137.6	172.5	10.4	39.3	-20.3	0	0	0	118.9
297	G	22.1	Very low	25	Very low	56 Å²	56	137.4 Å²	137.4	58%	0.577	79%	0.786	S	S	*	*				132.3	89.9	122.5	0	0	0	0	0	120.1	E295	E295-G297 PolarHBondContact OE2-N 2.92Å
298	S	26.4	Very low	25.2	Very low	130 Å²	130	140.8 Å²	140.8	91%	0.909	80%	0.797	S	S	*	*				164.2	114.8	110.2	47.5	0	0	0	0	113.4
299	E	24.3	Very low	25.9	Very low	172 Å²	172	138.7 Å²	138.7	80%	0.804	79%	0.793	S	S	*	*			trans	-90.3	157	170.7	-76.8	-162.6	108.3	0	0	113	V301	E299-V301 HydrophobicContact CB-CG2 4.41Å
300	V	25.5	Very low	26.1	Very low	148 Å²	148	142.9 Å²	142.9	90%	0.897	81%	0.805	S	S	*	*			trans	-131.8	111.4	155.7	179.7	0	0	0	0	109
301	V	25.7	Very low	26.4	Very low	111 Å²	111	142 Å²	142	67%	0.673	80%	0.804	S	S	*	*			trans	-87.3	146.2	-170.1	175.3	0	0	0	0	112.9	E299	E299-V301 HydrophobicContact CB-CG2 4.41Å
302	I	26.5	Very low	26.5	Very low	152 Å²	152	146.9 Å²	146.9	78%	0.779	82%	0.816	S	S	*	*			trans	-92.6	128.1	176.4	-59.4	167.4	0	0	0	110.9
303	K	23	Very low	26.6	Very low	200 Å²	200	142.6 Å²	142.6	87%	0.87	81%	0.812	S	S	*	*			trans	-170.6	156.4	138.7	-109.7	158	-172.5	172.1	0	115.3
304	M	30	Very low	27.5	Very low	175 Å²	175	144.5 Å²	144.5	86%	0.862	81%	0.812	S	S	*	*			trans	-90.7	146.5	164.4	-60.4	158.9	57.8	0	0	109.8
305	P	29.6	Very low	27.5	Very low	122 Å²	122	140.8 Å²	140.8	79%	0.792	80%	0.803	S	S	*	*			trans	-95.9	178.1	159.2	36	-30.5	0	0	0	112.2
306	M	24.1	Very low	27.7	Very low	190 Å²	190	142.1 Å²	142.1	94%	0.936	81%	0.806	S	S	*	*			trans	-112.4	-177.4	-172.5	-64.5	-172.6	-67.2	0	0	113.1
307	V	27.2	Very low	27.1	Very low	126 Å²	126	145.2 Å²	145.2	76%	0.764	81%	0.81	S	S	*	*			trans	-73.9	149.2	174.4	172.1	0	0	0	0	111.2
308	D	25.9	Very low	27.8	Very low	160 Å²	160	148 Å²	148	86%	0.856	82%	0.818	S	S	*	*			trans	-156.1	166.3	136.8	-105.3	-19.6	0	0	0	111.6
309	P	38.4	Very low	28.5	Very low	109 Å²	109	146.8 Å²	146.8	71%	0.708	81%	0.807	S	S	*	*			trans	-112.6	170.9	-160.6	42.1	-36.4	0	0	0	115.4
310	E	25.4	Very low	28.5	Very low	198 Å²	198	149.9 Å²	149.9	93%	0.925	81%	0.811	S	S	*	*			trans	-140.1	159.5	159.6	-116.3	-177.3	136	0	0	111.7
311	A	26.7	Very low	28.5	Very low	93 Å²	93	148 Å²	148	77%	0.769	81%	0.805	S	S	*	*			trans	-139	149.9	-168.8	0	0	0	0	0	112.6
312	Q	25.6	Very low	28.5	Very low	199 Å²	199	148.1 Å²	148.1	93%	0.93	81%	0.811	S	S	*	*			trans	-151.3	144.1	171.3	-110.7	170	53.3	0	0	113.7
313	A	26.2	Very low	29.1	Very low	94 Å²	94	146.3 Å²	146.3	78%	0.777	81%	0.809	S	S	*	*			trans	-165.1	179	175.9	0	0	0	0	0	106.6
314	P	40.7	Very low	29.4	Very low	111 Å²	111	144.6 Å²	144.6	72%	0.721	81%	0.809	S	S	*	*			cis	-135.1	-175.8	-0.1	43.4	-26.9	0	0	0	114.4
315	T	24.9	Very low	29.3	Very low	123 Å²	123	142.3 Å²	142.3	76%	0.755	81%	0.805	S	S	*	*			trans	162	152	144.3	36.8	0	0	0	0	108.5
316	K	27.1	Very low	29.3	Very low	196 Å²	196	143.8 Å²	143.8	85%	0.852	81%	0.812	S	S	*	*			cis	-149.7	166.6	-10.6	-114.9	164.9	-175.6	177.3	0	108.4
317	Q	23.6	Very low	29.5	Very low	185 Å²	185	144.1 Å²	144.1	86%	0.864	81%	0.808	S	S	*	*			trans	-103	-167.8	-176.7	-46	178.7	-18.3	0	0	111.8
318	P	37.3	Very low	29.5	Very low	113 Å²	113	148.3 Å²	148.3	73%	0.734	81%	0.81	S	S	*	*			cis	-131.6	-125.9	-5.1	29.1	-0.9	0	0	0	114.9
319	P	41.3	Very low	29.8	Very low	106 Å²	106	146.5 Å²	146.5	69%	0.688	81%	0.807	S	S	*	*				-134.5	175.5	-113.3	43.7	-25.6	0	0	0	117.6
320	R	23.9	Very low	29.4	Very low	236 Å²	236	146.1 Å²	146.1	89%	0.891	80%	0.803	S	S	*	*				-178.8	141.6	128.8	-104.6	170.8	-176.3	-167.3	0.6	117.6
321	S	25.4	Very low	29.7	Very low	110 Å²	110	146.7 Å²	146.7	77%	0.769	80%	0.802	S	S	*	*			trans	39	120.8	147.2	60.8	0	0	0	0	123.3
322	S	25	Very low	29.9	Very low	113 Å²	113	152.7 Å²	152.7	79%	0.79	81%	0.811	S	S	*	*			trans	-81.1	-174.9	143.8	-39.7	0	0	0	0	110.5
323	P	40	Very low	30.1	Very low	114 Å²	114	146.7 Å²	146.7	74%	0.74	80%	0.803	S	S	*	*			cis	-131.9	-179.1	-6.3	42.6	-27.3	0	0	0	114.4
324	N	28.6	Very low	30.2	Very low	164 Å²	164	153.2 Å²	153.2	88%	0.877	81%	0.807	S	S	*	*			trans	-159.5	152.8	143	-121.6	-38.9	0	0	0	114.1
325	T	28.2	Very low	29.8	Very low	126 Å²	126	156 Å²	156	77%	0.773	82%	0.816	S	S	*	*			trans	-111.7	138.3	-171.8	50.2	0	0	0	0	113.9
326	V	30.7	Very low	30.2	Very low	153 Å²	153	160.9 Å²	160.9	93%	0.927	82%	0.821	S	S	*	*			trans	-135.1	153.6	162.8	-175.2	0	0	0	0	111.6
327	K	27.6	Very low	30.5	Very low	197 Å²	197	156.4 Å²	156.4	86%	0.857	82%	0.82	S	S	*	*			trans	-83.4	157.5	-156.1	-62.4	164.9	-178.6	171.5	0	115.8
328	R	26.5	Very low	30.9	Very low	215 Å²	215	151.1 Å²	151.1	81%	0.811	82%	0.815	S	S	*	*			trans	-70.4	142.7	168	175	-164.6	-168.5	-160.9	8.4	112.7	T330	R328-T330 HydrophobicContact CG-CG2 4.45Å; R328-T330 VanDerWaalsContact CZ-CG2 3.42Å
329	P	32.3	Very low	30.8	Very low	122 Å²	122	155.5 Å²	155.5	79%	0.792	82%	0.823	S	S	*	*			trans	-107.9	135.4	153	34.5	-27.7	0	0	0	112
330	T	30.1	Very low	30.7	Very low	101 Å²	101	154 Å²	154	62%	0.62	83%	0.826	S	S	*	*			trans	-96	134.3	175.4	46.4	0	0	0	0	112	R328	R328-T330 HydrophobicContact CG-CG2 4.45Å; R328-T330 VanDerWaalsContact CZ-CG2 3.42Å
331	K	33.2	Very low	31.5	Very low	209 Å²	209	151.8 Å²	151.8	91%	0.909	83%	0.826	S	S	*	*			trans	-112.8	114.8	162.6	-75.8	-173	174.3	-179.5	0	110.7
332	K	30.8	Very low	32.5	Very low	219 Å²	219	153.2 Å²	153.2	95%	0.952	82%	0.819	S	S	*	*			trans	-70.3	144	158.9	-76.8	-178.4	173.4	179.5	0	108.3
333	G	29	Very low	33.6	Very low	74 Å²	74	151.3 Å²	151.3	76%	0.763	80%	0.804	S	S	*	*			trans	-162.8	42.2	-163.2	0	0	0	0	0	118.8
334	R	29.2	Very low	34.3	Very low	230 Å²	230	155.5 Å²	155.5	87%	0.868	81%	0.805	S	S	*	*			trans	58.2	96.7	154	-163.1	179.6	-159.8	163	5.9	116.8	R336	R334-R336 PolarHBondContact O-N 3.42Å
335	D	31.1	Very low	35.8	Very low	169 Å²	169	150.1 Å²	150.1	90%	0.904	79%	0.788	S	S	*	*			trans	-53.6	118.7	168.8	-60.2	-81.8	0	0	0	112
336	R	32.9	Very low	37.3	Very low	226 Å²	226	150.5 Å²	150.5	85%	0.853	78%	0.779	S	S	*	*			trans	-103	114.4	164.5	-89.5	-176.3	162.8	175.9	-3.8	108.1	R334 G338	R334-R336 PolarHBondContact O-N 3.42Å; R336-G338 PolarHBondContact O-N 2.95Å
337	A	35	Very low	38.9	Very low	102 Å²	102	146.7 Å²	146.7	84%	0.843	75%	0.751	S	S	*	*			trans	-51.2	115.1	173	0	0	0	0	0	110.2	K339	A337-K339 PolarHBondContact O-N 3.05Å
338	G	31.6	Very low	40.8	Very low	74 Å²	74	143.7 Å²	143.7	76%	0.763	74%	0.74	S	S	*	*			trans	-69.2	99.2	-178.6	0	0	0	0	0	110.5	R336 G340	R336-G338 PolarHBondContact O-N 2.95Å; G338-G340 PolarHBondContact O-N 3.17Å
339	K	35	Very low	43	Very low	205 Å²	205	138 Å²	138	89%	0.891	73%	0.725	S	S	*	*			trans	-54.2	107.6	163.5	-82.8	-172.1	174.7	-178.8	0	107.6	A337 Q341	A337-K339 PolarHBondContact O-N 3.05Å; K339-Q341 PolarHBondContact O-N 3.21Å
340	G	38.8	Very low	44.7	Very low	74 Å²	74	133.1 Å²	133.1	76%	0.763	70%	0.695	S	S	*	*			trans	-54.6	115.2	-173.7	0	0	0	0	0	110.7	G338 K342	G338-G340 PolarHBondContact O-N 3.17Å; G340-K342 PolarHBondContact O-N 3.43Å
341	Q	41.3	Very low	46.6	Very low	190 Å²	190	134.4 Å²	134.4	89%	0.888	69%	0.692	S	S	*	*			trans	-64.8	108.9	171	-70.4	-170.6	6.6	0	0	107.5	K339	K339-Q341 PolarHBondContact O-N 3.21Å
342	K	44.8	Very low	48.6	Very low	140 Å²	140	133.8 Å²	133.8	61%	0.609	68%	0.684	S	S	*	*			trans	-47.3	133	164.9	-81.5	-163.8	172.5	-162.2	0	107.9	G340 R344	G340-K342 PolarHBondContact O-N 3.43Å; K342-R344 VanDerWaalsContact C-N 3.27Å; K342-R344 PolarHBondContact O-N 3.38Å
343	P	49.5	Very low	50.7	Low	74 Å²	74	128 Å²	128	48%	0.481	66%	0.659	S	S	.	*			trans	-69.3	86.1	-177.7	28.1	-34.7	0	0	0	109.7	G345 K346	P343-G345 PolarHBondContact O-N 2.92Å; P343-K346 HydrophobicContact CB-CB 4.44Å; P343-K346 HydrophobicContact CB-CD 4.41Å; P343-K346 HydrophobicContact CB-CG 4.18Å; P343-K346 HydrophobicContact CG-CB 4.21Å; P343-K346 HydrophobicContact CG-CD 3.88Å; P343-K346 HydrophobicContact CG-CG 4.08Å; P343-K346 PolarHBondContact O-N 3.4Å
344	R	53.7	Low	52.8	Low	202 Å²	202	126.7 Å²	126.7	76%	0.762	64%	0.636	S	S	*	*	H	α-helix	trans	-47.4	-32.3	-178.2	-86.5	178	156.3	-179.8	-6.6	112.9	K342 Q348	K342-R344 VanDerWaalsContact C-N 3.27Å; K342-R344 PolarHBondContact O-N 3.38Å; R344-Q348 WeakPolarHBondContact O-CB 3.27Å; R344-Q348 VanDerWaalsContact O-CG 3.28Å; R344-Q348 WeakPolarHBondContact O-CG 3.04Å; R344-Q348 PolarHBondContact O-N 3.29Å
345	G	59.8	Low	54.8	Low	51 Å²	51	121.7 Å²	121.7	53%	0.526	62%	0.621	S	S	.	*	H	α-helix	trans	-64.1	-36.4	174.6	0	0	0	0	0	114.8	P343 L349	P343-G345 PolarHBondContact O-N 2.92Å; G345-L349 WeakPolarHBondContact O-CB 3.44Å; G345-L349 PolarHBondContact O-N 3.43Å
346	K	61.2	Low	56.8	Low	134 Å²	134	116 Å²	116	58%	0.583	59%	0.594	S	S	*	*	H	α-helix	trans	-67.5	-49.8	176	-72.7	-167.7	178.9	-175	0	111	P343 Q348 L349 A350	P343-K346 HydrophobicContact CB-CB 4.44Å; P343-K346 HydrophobicContact CB-CD 4.41Å; P343-K346 HydrophobicContact CB-CG 4.18Å; P343-K346 HydrophobicContact CG-CB 4.21Å; P343-K346 HydrophobicContact CG-CD 3.88Å; P343-K346 HydrophobicContact CG-CG 4.08Å; P343-K346 PolarHBondContact O-N 3.4Å; K346-Q348 VanDerWaalsContact C-N 3.35Å; K346-Q348 PolarHBondContact O-N 3.42Å; K346-L349 PolarHBondContact O-N 2.9Å; K346-L349 VanDerWaalsContact O-N 3.13Å; K346-A350 WeakPolarHBondContact O-CB 3.43Å; K346-A350 PolarHBondContact O-N 3.43Å
347	E	63.8	Low	58.7	Low	73 Å²	73	106 Å²	106	34%	0.341	56%	0.558	S	S	.	*	H	α-helix	trans	-62.1	-41.2	179.7	-161.7	-162	126.6	0	0	111.8	K351	E347-K351 WeakPolarHBondContact O-CB 3.39Å; E347-K351 WeakPolarHBondContact O-CG 3.47Å; E347-K351 PolarHBondContact O-N 2.88Å; E347-K351 IonicContact OE1-NZ 2.67Å; E347-K351 PolarHBondContact OE1-NZ 3.16Å
348	Q	68.2	Low	60.5	Low	134 Å²	134	105.6 Å²	105.6	63%	0.626	54%	0.544	S	S	*	.	H	α-helix	trans	-66.4	-38.7	173.1	-75.3	-178.7	-8.1	0	0	112.7	R344 K346 R352	R344-Q348 WeakPolarHBondContact O-CB 3.27Å; R344-Q348 VanDerWaalsContact O-CG 3.28Å; R344-Q348 WeakPolarHBondContact O-CG 3.04Å; R344-Q348 PolarHBondContact O-N 3.29Å; K346-Q348 VanDerWaalsContact C-N 3.35Å; K346-Q348 PolarHBondContact O-N 3.42Å; Q348-R352 VanDerWaalsContact O-CB 3.27Å; Q348-R352 WeakPolarHBondContact O-CB 3.38Å; Q348-R352 PolarHBondContact O-N 3.3Å
349	L	70.9	Confident	62.4	Low	95 Å²	95	108 Å²	108	50%	0.497	53%	0.534	S	S	.	.	H	α-helix	trans	-66.3	-42.4	176	-179	62.1	0	0	0	111.4	G345 K346 R352 K353	G345-L349 WeakPolarHBondContact O-CB 3.44Å; G345-L349 PolarHBondContact O-N 3.43Å; K346-L349 PolarHBondContact O-N 2.9Å; K346-L349 VanDerWaalsContact O-N 3.13Å; L349-R352 PolarHBondContact O-N 3.12Å; L349-K353 WeakPolarHBondContact O-CB 3.1Å; L349-K353 WeakPolarHBondContact O-CG 3.05Å; L349-K353 PolarHBondContact O-N 3.34Å
350	A	69.4	Low	64.1	Low	19 Å²	19	99.5 Å²	99.5	16%	0.157	50%	0.498	C	S	.	.	H	α-helix	trans	-59.8	-52	174.3	0	0	0	0	0	110.8	K346 R352 K353 T354	K346-A350 WeakPolarHBondContact O-CB 3.43Å; K346-A350 PolarHBondContact O-N 3.43Å; A350-R352 VanDerWaalsContact C-N 3.3Å; A350-R352 PolarHBondContact O-N 3.06Å; A350-K353 PolarHBondContact O-N 2.99Å; A350-K353 VanDerWaalsContact O-N 3.11Å; A350-T354 PolarHBondContact O-N 2.86Å; A350-T354 PolarHBondContact O-OG1 2.99Å
351	K	69.9	Low	65.7	Low	129 Å²	129	100 Å²	100	56%	0.561	48%	0.479	S	S	*	.	H	α-helix	trans	-57	-39.8	175.3	-75.5	170.9	174.4	173.6	0	112.5	E347 F355	E347-K351 WeakPolarHBondContact O-CB 3.39Å; E347-K351 WeakPolarHBondContact O-CG 3.47Å; E347-K351 PolarHBondContact O-N 2.88Å; E347-K351 IonicContact OE1-NZ 2.67Å; E347-K351 PolarHBondContact OE1-NZ 3.16Å; K351-F355 WeakPolarHBondContact O-CB 3.31Å; K351-F355 PolarHBondContact O-N 3.3Å
352	R	74.2	Confident	67.1	Low	196 Å²	196	96.4 Å²	96.4	74%	0.74	46%	0.46	S	S	*	.	H	α-helix	trans	-67.2	-40.2	175.5	-173.3	175.6	179.3	178.3	-0.7	112.6	Q348 L349 A350 S356	Q348-R352 VanDerWaalsContact O-CB 3.27Å; Q348-R352 WeakPolarHBondContact O-CB 3.38Å; Q348-R352 PolarHBondContact O-N 3.3Å; L349-R352 PolarHBondContact O-N 3.12Å; A350-R352 VanDerWaalsContact C-N 3.3Å; A350-R352 PolarHBondContact O-N 3.06Å; R352-S356 PolarHBondContact O-N 2.65Å; R352-S356 VanDerWaalsContact O-N 3.12Å
353	K	75.4	Confident	68.2	Low	97 Å²	97	91.1 Å²	91.1	42%	0.422	44%	0.442	S	S	.	.	H	α-helix	trans	-65.7	-47.9	174.7	-77.8	-172	176.4	-169.9	0	111.4	L222 L349 A350 F355 S356 L357	L222-K353 HydrophobicContact CD1-CB 3.83Å; L222-K353 HydrophobicContact CD1-CD 4.44Å; L222-K353 HydrophobicContact CD2-CB 3.49Å; L222-K353 VanDerWaalsContact CD2-CB 3.49Å; L222-K353 HydrophobicContact CD2-CD 3.75Å; L222-K353 HydrophobicContact CD2-CG 4.29Å; L222-K353 HydrophobicContact CG-CB 4.31Å; L222-K353 HydrophobicContact CG-CD 4.5Å; L349-K353 WeakPolarHBondContact O-CB 3.1Å; L349-K353 WeakPolarHBondContact O-CG 3.05Å; L349-K353 PolarHBondContact O-N 3.34Å; A350-K353 PolarHBondContact O-N 2.99Å; A350-K353 VanDerWaalsContact O-N 3.11Å; K353-F355 VanDerWaalsContact C-N 3.33Å; K353-F355 PolarHBondContact O-N 3.49Å; K353-S356 WeakPolarHBondContact O-CA 3.25Å; K353-S356 VanDerWaalsContact O-CB 3.29Å; K353-S356 WeakPolarHBondContact O-CB 3.48Å; K353-S356 PolarHBondContact O-N 2.6Å; K353-L357 PolarHBondContact O-N 3.28Å
354	T	73.3	Confident	69.3	Low	46 Å²	46	88 Å²	88	28%	0.282	42%	0.423	S	S	.	.	H	α-helix	trans	-58.3	-42.3	175.5	-55.2	0	0	0	0	111.9	Q226 A350 S356 L357 V358	Q226-T354 PolarHBondContact NE2-OG1 2.98Å; A350-T354 PolarHBondContact O-N 2.86Å; A350-T354 PolarHBondContact O-OG1 2.99Å; T354-S356 VanDerWaalsContact C-N 3.29Å; T354-S356 PolarHBondContact O-N 3.04Å; T354-L357 WeakPolarHBondContact O-CB 3.37Å; T354-L357 PolarHBondContact O-N 3.46Å; T354-V358 WeakPolarHBondContact O-CG2 3.43Å; T354-V358 PolarHBondContact O-N 3.15Å
355	F	71.6	Confident	70.2	Confident	126 Å²	126	87.8 Å²	87.8	55%	0.553	42%	0.422	S	S	*	.	H	α-helix	trans	-65	-30	175	-176.1	-120.3	0	0	0	113.3	K351 K353 K359	K351-F355 WeakPolarHBondContact O-CB 3.31Å; K351-F355 PolarHBondContact O-N 3.3Å; K353-F355 VanDerWaalsContact C-N 3.33Å; K353-F355 PolarHBondContact O-N 3.49Å; F355-K359 HydrophobicContact CE1-CD 4.5Å; F355-K359 VanDerWaalsContact CE1-CE 3.46Å; F355-K359 VanDerWaalsContact CZ-CE 3.48Å; F355-K359 PolarHBondContact O-N 3.16Å
356	S	72.1	Confident	70.7	Confident	49 Å²	49	86.5 Å²	86.5	34%	0.343	40%	0.404	S	S	.	.	H	α-helix	trans	-68	-46.3	170.5	-157.3	0	0	0	0	111.2	R352 K353 T354 V358 K359 E360	R352-S356 PolarHBondContact O-N 2.65Å; R352-S356 VanDerWaalsContact O-N 3.12Å; K353-S356 WeakPolarHBondContact O-CA 3.25Å; K353-S356 VanDerWaalsContact O-CB 3.29Å; K353-S356 WeakPolarHBondContact O-CB 3.48Å; K353-S356 PolarHBondContact O-N 2.6Å; T354-S356 VanDerWaalsContact C-N 3.29Å; T354-S356 PolarHBondContact O-N 3.04Å; S356-V358 PolarHBondContact O-N 3.06Å; S356-K359 WeakPolarHBondContact O-CB 3.45Å; S356-K359 PolarHBondContact O-N 3.41Å; S356-K359 VanDerWaalsContact O-N 3.11Å; S356-E360 WeakPolarHBondContact O-CG 3.06Å; S356-E360 PolarHBondContact O-N 2.83Å
357	L	73.9	Confident	71.3	Confident	17 Å²	17	80.8 Å²	80.8	9%	0.089	38%	0.38	C	S	.	.	H	α-helix	trans	-58.6	-42.5	175.2	-92.3	-174.1	0	0	0	113.1	R218 A219 L222 K353 T354 K359 E360 K361	R218-L357 HydrophobicContact CB-CD2 3.89Å; A219-L357 HydrophobicContact CB-CD1 4.1Å; L222-L357 HydrophobicContact CB-CD1 4.04Å; L222-L357 HydrophobicContact CD1-CD1 3.44Å; L222-L357 VanDerWaalsContact CD1-CD1 3.44Å; L222-L357 HydrophobicContact CD1-CG 3.86Å; L222-L357 HydrophobicContact CG-CD1 4.35Å; K353-L357 PolarHBondContact O-N 3.28Å; T354-L357 WeakPolarHBondContact O-CB 3.37Å; T354-L357 PolarHBondContact O-N 3.46Å; L357-K359 PolarHBondContact O-N 3.05Å; L357-E360 CarbonylContact O-C 3.43Å; L357-E360 PolarHBondContact O-N 3.07Å; L357-E360 VanDerWaalsContact O-N 3.07Å; L357-K361 WeakPolarHBondContact O-CB 3.27Å; L357-K361 PolarHBondContact O-N 3.39Å
358	V	73	Confident	72	Confident	92 Å²	92	79 Å²	79	56%	0.558	38%	0.376	S	S	*	.	H	α-helix	trans	-62.2	-34.4	177.7	171	0	0	0	0	111.2	T354 S356 K362	T354-V358 WeakPolarHBondContact O-CG2 3.43Å; T354-V358 PolarHBondContact O-N 3.15Å; S356-V358 PolarHBondContact O-N 3.06Å; V358-K362 VanDerWaalsContact O-CB 3.23Å; V358-K362 WeakPolarHBondContact O-CB 3.46Å; V358-K362 PolarHBondContact O-N 2.92Å; V358-K362 VanDerWaalsContact O-N 3.09Å
359	K	70.1	Confident	72.7	Confident	126 Å²	126	74.5 Å²	74.5	55%	0.548	36%	0.361	S	S	.	.	H	α-helix	trans	-70.2	-38.6	171.5	-71.6	176.5	175.9	-179.5	0	112.5	F355 S356 L357 A363	F355-K359 HydrophobicContact CE1-CD 4.5Å; F355-K359 VanDerWaalsContact CE1-CE 3.46Å; F355-K359 VanDerWaalsContact CZ-CE 3.48Å; F355-K359 PolarHBondContact O-N 3.16Å; S356-K359 WeakPolarHBondContact O-CB 3.45Å; S356-K359 PolarHBondContact O-N 3.41Å; S356-K359 VanDerWaalsContact O-N 3.11Å; L357-K359 PolarHBondContact O-N 3.05Å; K359-A363 WeakPolarHBondContact O-CB 3.46Å; K359-A363 PolarHBondContact O-N 3.05Å
360	E	71.3	Confident	73.3	Confident	26 Å²	26	70.4 Å²	70.4	12%	0.121	34%	0.34	C	S	.	.	H	α-helix	trans	-74.1	-45.7	-178.5	-71.3	175.7	177.3	0	0	111.9	R134 R218 S356 L357 K362 A363 A364	R134-E360 IonicContact CZ-OE1 2.77Å; R134-E360 IonicContact NH1-OE1 3.18Å; R134-E360 PolarHBondContact NH1-OE1 3.44Å; R134-E360 IonicContact NH2-OE1 2.7Å; R134-E360 PolarHBondContact NH2-OE1 3.2Å; R218-E360 IonicContact NH1-OE2 3.51Å; S356-E360 WeakPolarHBondContact O-CG 3.06Å; S356-E360 PolarHBondContact O-N 2.83Å; L357-E360 CarbonylContact O-C 3.43Å; L357-E360 PolarHBondContact O-N 3.07Å; L357-E360 VanDerWaalsContact O-N 3.07Å; E360-K362 VanDerWaalsContact C-N 3.31Å; E360-K362 PolarHBondContact O-N 3.2Å; E360-A363 PolarHBondContact O-N 2.82Å; E360-A363 VanDerWaalsContact O-N 3.11Å; E360-A364 PolarHBondContact O-N 3.35Å
361	K	73.4	Confident	74.2	Confident	85 Å²	85	70.3 Å²	70.3	37%	0.37	34%	0.337	S	S	.	.	H	α-helix	trans	-57.2	-41.1	168	-80.8	-168.3	169.1	-172.6	0	111.9	T215 E216 L357 R365	T215-K361 HydrophobicContact CG2-CB 4.34Å; T215-K361 HydrophobicContact CG2-CD 4.39Å; T215-K361 HydrophobicContact CG2-CG 3.35Å; E216-K361 IonicContact OE1-NZ 3.63Å; E216-K361 VanDerWaalsContact OE2-CE 3.24Å; E216-K361 WeakPolarHBondContact OE2-CE 3.48Å; E216-K361 IonicContact OE2-NZ 2.63Å; E216-K361 PolarHBondContact OE2-NZ 2.98Å; L357-K361 WeakPolarHBondContact O-CB 3.27Å; L357-K361 PolarHBondContact O-N 3.39Å; K361-R365 PolarHBondContact O-N 3.38Å
362	K	70.6	Confident	75.1	Confident	113 Å²	113	69 Å²	69	49%	0.491	34%	0.335	S	S	.	.	H	α-helix	trans	-62.1	-47.7	173.2	-178.9	165.6	-178.9	166.8	0	111.3	V358 E360 R365 T366 C421	V358-K362 VanDerWaalsContact O-CB 3.23Å; V358-K362 WeakPolarHBondContact O-CB 3.46Å; V358-K362 PolarHBondContact O-N 2.92Å; V358-K362 VanDerWaalsContact O-N 3.09Å; E360-K362 VanDerWaalsContact C-N 3.31Å; E360-K362 PolarHBondContact O-N 3.2Å; K362-R365 WeakPolarHBondContact O-CB 3.39Å; K362-R365 PolarHBondContact O-N 3.34Å; K362-T366 VanDerWaalsContact O-CG2 3.31Å; K362-T366 WeakPolarHBondContact O-CG2 3.16Å; K362-T366 PolarHBondContact O-N 2.99Å; K362-C421 WeakPolarHBondContact CE-O 3.45Å
363	A	67.5	Low	75.9	Confident	29 Å²	29	60.3 Å²	60.3	24%	0.24	31%	0.305	C	S	.	.	H	α-helix	trans	-63	-40.6	179.9	0	0	0	0	0	112.7	K359 E360 R365 T366 L367	K359-A363 WeakPolarHBondContact O-CB 3.46Å; K359-A363 PolarHBondContact O-N 3.05Å; E360-A363 PolarHBondContact O-N 2.82Å; E360-A363 VanDerWaalsContact O-N 3.11Å; A363-R365 PolarHBondContact O-N 3.37Å; A363-T366 WeakPolarHBondContact O-CB 3.26Å; A363-T366 PolarHBondContact O-N 2.91Å; A363-T366 VanDerWaalsContact O-N 3.09Å; A363-T366 PolarHBondContact O-OG1 3.02Å; A363-L367 WeakPolarHBondContact O-CG 3.48Å; A363-L367 PolarHBondContact O-N 3.04Å
364	A	72	Confident	76.8	Confident	10 Å²	10	55.7 Å²	55.7	8%	0.083	29%	0.285	C	S	.	.	H	α-helix	trans	-56.2	-49.4	173.3	0	0	0	0	0	111.1	Y208 I211 E360 T366 L367 S368	Y208-A364 WeakPolarHBondContact CE2-O 3.35Å; Y208-A364 PolarHBondContact OH-O 3.45Å; I211-A364 HydrophobicContact CG2-CB 4.23Å; E360-A364 PolarHBondContact O-N 3.35Å; A364-T366 PolarHBondContact O-N 3.24Å; A364-T366 VanDerWaalsContact O-N 3.09Å; A364-L367 WeakPolarHBondContact O-CB 3.48Å; A364-L367 PolarHBondContact O-N 3.45Å; A364-S368 PolarHBondContact O-N 2.86Å; A364-S368 VanDerWaalsContact O-N 3.14Å
365	R	72	Confident	77.8	Confident	197 Å²	197	55.7 Å²	55.7	74%	0.743	28%	0.283	S	S	*	.	H	α-helix	trans	-56.5	-28.7	176.3	-161.9	178	-166.9	168.2	6	113.6	K361 K362 A363 S368 A369	K361-R365 PolarHBondContact O-N 3.38Å; K362-R365 WeakPolarHBondContact O-CB 3.39Å; K362-R365 PolarHBondContact O-N 3.34Å; A363-R365 PolarHBondContact O-N 3.37Å; R365-S368 WeakPolarHBondContact CA-OG 3.4Å; R365-S368 PolarHBondContact O-OG 2.66Å; R365-S368 VanDerWaalsContact O-OG 3.06Å; R365-A369 PolarHBondContact O-N 2.9Å
366	T	70.9	Confident	78.9	Confident	24 Å²	24	55 Å²	55	15%	0.147	29%	0.285	C	S	.	.	H	α-helix	trans	-71.4	-31.5	175.4	72.3	0	0	0	0	113.3	K362 A363 A364 I370 C421	K362-T366 VanDerWaalsContact O-CG2 3.31Å; K362-T366 WeakPolarHBondContact O-CG2 3.16Å; K362-T366 PolarHBondContact O-N 2.99Å; A363-T366 WeakPolarHBondContact O-CB 3.26Å; A363-T366 PolarHBondContact O-N 2.91Å; A363-T366 VanDerWaalsContact O-N 3.09Å; A363-T366 PolarHBondContact O-OG1 3.02Å; A364-T366 PolarHBondContact O-N 3.24Å; A364-T366 VanDerWaalsContact O-N 3.09Å; T366-I370 WeakPolarHBondContact O-CG1 3.22Å; T366-C421 WeakPolarHBondContact CA-SG 3.45Å; T366-C421 WeakPolarHBondContact CB-SG 3.46Å; T366-C421 HydrophobicContact CG2-CB 3.32Å
367	L	74.6	Confident	80	Confident	14 Å²	14	53 Å²	53	7%	0.073	27%	0.27	C	S	.	.	H	α-helix	trans	-81.2	-41.7	-177.2	-60.4	162.7	0	0	0	110.3	I119 R123 Y208 A363 A364 A369 I370 L371	I119-L367 HydrophobicContact CG2-CD2 3.62Å; R123-L367 HydrophobicContact CB-CD1 3.61Å; R123-L367 HydrophobicContact CG-CD1 3.51Å; R123-L367 HydrophobicContact CG-CD2 3.96Å; R123-L367 HydrophobicContact CG-CG 4.39Å; Y208-L367 HydrophobicContact CD2-CB 4.5Å; Y208-L367 HydrophobicContact CE2-CB 4.22Å; A363-L367 WeakPolarHBondContact O-CG 3.48Å; A363-L367 PolarHBondContact O-N 3.04Å; A364-L367 WeakPolarHBondContact O-CB 3.48Å; A364-L367 PolarHBondContact O-N 3.45Å; L367-A369 PolarHBondContact O-N 2.95Å; L367-I370 PolarHBondContact O-N 3.09Å; L367-I370 VanDerWaalsContact O-N 3.14Å; L367-L371 WeakPolarHBondContact O-CG 3.42Å; L367-L371 PolarHBondContact O-N 2.71Å
368	S	78.2	Confident	81.1	Confident	36 Å²	36	53.6 Å²	53.6	25%	0.252	27%	0.271	S	S	.	.	H	α-helix	trans	-59.8	-30.6	171.9	49.2	0	0	0	0	113.2	Y208 A364 R365 L372	Y208-S368 WeakPolarHBondContact OH-CB 3.42Å; Y208-S368 PolarHBondContact OH-OG 2.88Å; A364-S368 PolarHBondContact O-N 2.86Å; A364-S368 VanDerWaalsContact O-N 3.14Å; R365-S368 WeakPolarHBondContact CA-OG 3.4Å; R365-S368 PolarHBondContact O-OG 2.66Å; R365-S368 VanDerWaalsContact O-OG 3.06Å; S368-L372 WeakPolarHBondContact O-CB 3.49Å; S368-L372 PolarHBondContact O-N 3.24Å
369	A	81.9	Confident	82.2	Confident	39 Å²	39	51 Å²	51	32%	0.322	26%	0.256	S	S	.	.	H	α-helix	trans	-66.9	-40.1	176	0	0	0	0	0	112.1	R365 L367 A373	R365-A369 PolarHBondContact O-N 2.9Å; L367-A369 PolarHBondContact O-N 2.95Å; A369-A373 WeakPolarHBondContact O-CB 3.44Å; A369-A373 PolarHBondContact O-N 2.85Å; A369-A373 VanDerWaalsContact O-N 3.15Å
370	I	84.9	Confident	83.4	Confident	9 Å²	9	47.5 Å²	47.5	5%	0.046	25%	0.246	C	C	.	.	H	α-helix	trans	-72.6	-47	177.5	-60.4	161.3	0	0	0	110.2	L116 T366 L367 L372 A373 F374 C417 Y418	L116-I370 HydrophobicContact CD2-CG2 3.46Å; L116-I370 VanDerWaalsContact CD2-CG2 3.46Å; T366-I370 WeakPolarHBondContact O-CG1 3.22Å; L367-I370 PolarHBondContact O-N 3.09Å; L367-I370 VanDerWaalsContact O-N 3.14Å; I370-L372 PolarHBondContact O-N 2.93Å; I370-A373 PolarHBondContact O-N 3.1Å; I370-F374 WeakPolarHBondContact O-CB 3.39Å; I370-F374 PolarHBondContact O-N 2.71Å; I370-C417 HydrophobicContact CG1-CB 3.68Å; I370-Y418 HydrophobicContact CD1-CD1 4.17Å; I370-Y418 HydrophobicContact CD1-CE1 3.87Å
371	L	87.3	Confident	84.6	Confident	16 Å²	16	48 Å²	48	8%	0.084	25%	0.247	C	C	.	.	H	α-helix	trans	-63.8	-39	179.3	-68	176.9	0	0	0	112.5	M204 Y208 L367 F374 I375	M204-L371 HydrophobicContact CB-CD2 4.01Å; M204-L371 HydrophobicContact CG-CD2 4.21Å; M204-L371 HydrophobicContact SD-CD2 3.54Å; M204-L371 VanDerWaalsContact SD-CD2 3.54Å; Y208-L371 HydrophobicContact CD2-CD1 4.09Å; Y208-L371 HydrophobicContact CG-CD1 4.18Å; L367-L371 WeakPolarHBondContact O-CG 3.42Å; L367-L371 PolarHBondContact O-N 2.71Å; L371-F374 PolarHBondContact O-N 3.39Å; L371-I375 WeakPolarHBondContact O-CD1 3.44Å; L371-I375 VanDerWaalsContact O-CG1 3.27Å; L371-I375 WeakPolarHBondContact O-CG1 3.4Å; L371-I375 PolarHBondContact O-N 2.98Å
372	L	89.5	Confident	85.6	Confident	101 Å²	101	44.5 Å²	44.5	53%	0.529	23%	0.232	S	C	.	.	H	α-helix	trans	-67.8	-41	175.3	-178.5	62.6	0	0	0	111.6	S368 I370 I375 L376	S368-L372 WeakPolarHBondContact O-CB 3.49Å; S368-L372 PolarHBondContact O-N 3.24Å; I370-L372 PolarHBondContact O-N 2.93Å; L372-I375 PolarHBondContact O-N 3.31Å; L372-L376 HydrophobicContact CD1-CD1 3.89Å; L372-L376 HydrophobicContact CD1-CG 3.96Å; L372-L376 HydrophobicContact CG-CD1 3.82Å; L372-L376 HydrophobicContact CG-CG 4.3Å; L372-L376 WeakPolarHBondContact O-CB 3.47Å; L372-L376 VanDerWaalsContact O-CG 3.26Å; L372-L376 WeakPolarHBondContact O-CG 3.22Å; L372-L376 PolarHBondContact O-N 2.86Å
373	A	91.4	Very high	86.8	Confident	14 Å²	14	43.1 Å²	43.1	12%	0.116	23%	0.23	C	C	.	.	H	α-helix	trans	-59.7	-47.3	174.4	0	0	0	0	0	111.3	A369 I370 L376 T377 I413	A369-A373 WeakPolarHBondContact O-CB 3.44Å; A369-A373 PolarHBondContact O-N 2.85Å; A369-A373 VanDerWaalsContact O-N 3.15Å; I370-A373 PolarHBondContact O-N 3.1Å; A373-L376 PolarHBondContact O-N 3.25Å; A373-T377 WeakPolarHBondContact O-CB 3.3Å; A373-T377 WeakPolarHBondContact O-CG2 3.41Å; A373-T377 PolarHBondContact O-N 3.16Å; A373-T377 PolarHBondContact O-OG1 2.84Å; A373-I413 HydrophobicContact CB-CG2 3.8Å
374	F	93	Very high	88	Confident	1 Å²	1	42.8 Å²	42.8	0%	0.004	22%	0.223	C	C	.	.	H	α-helix	trans	-58.1	-51.2	176.2	174.9	-107.8	0	0	0	112.5	V113 L116 F197 V201 M204 I370 L371 L376 T377 W378 N410	V113-F374 HydrophobicContact CB-CZ 4.46Å; V113-F374 HydrophobicContact CG1-CZ 4.1Å; V113-F374 HydrophobicContact CG2-CE2 3.82Å; V113-F374 HydrophobicContact CG2-CZ 3.78Å; L116-F374 HydrophobicContact CD1-CB 3.96Å; L116-F374 HydrophobicContact CD1-CD1 4.24Å; L116-F374 HydrophobicContact CD1-CD2 3.53Å; L116-F374 HydrophobicContact CD1-CE2 4.08Å; L116-F374 HydrophobicContact CD1-CG 3.62Å; F197-F374 HydrophobicContact CD2-CE1 4.3Å; F197-F374 AromaticContact CD2-CZ 3.97Å; F197-F374 HydrophobicContact CD2-CZ 3.97Å; F197-F374 AromaticContact CE2-CE1 3.88Å; F197-F374 HydrophobicContact CE2-CE1 3.88Å; F197-F374 AromaticContact CE2-CZ 3.83Å; F197-F374 HydrophobicContact CE2-CZ 3.83Å; V201-F374 HydrophobicContact CG2-CE1 3.78Å; M204-F374 HydrophobicContact CE-CD1 3.95Å; M204-F374 HydrophobicContact CE-CE1 3.58Å; M204-F374 HydrophobicContact CE-CZ 4.46Å; I370-F374 WeakPolarHBondContact O-CB 3.39Å; I370-F374 PolarHBondContact O-N 2.71Å; L371-F374 PolarHBondContact O-N 3.39Å; F374-L376 PolarHBondContact O-N 3.41Å; F374-T377 PolarHBondContact O-N 3.3Å; F374-T377 PolarHBondContact O-OG1 3.4Å; F374-T377 VanDerWaalsContact O-OG1 3.12Å; F374-W378 AromaticContact CD2-CD1 3.42Å; F374-W378 VanDerWaalsContact CD2-CD1 3.42Å; F374-W378 HydrophobicContact CD2-CD2 4.25Å; F374-W378 AromaticContact CD2-CG 3.82Å; F374-W378 HydrophobicContact CD2-CG 3.82Å; F374-W378 AromaticContact CD2-NE1 3.7Å; F374-W378 HydrophobicContact CE2-CB 4.2Å; F374-W378 AromaticContact CE2-CD1 3.52Å; F374-W378 AromaticContact CE2-CD2 3.54Å; F374-W378 HydrophobicContact CE2-CD2 3.54Å; F374-W378 AromaticContact CE2-CE2 3.73Å; F374-W378 HydrophobicContact CE2-CE3 4.21Å; F374-W378 AromaticContact CE2-CG 3.47Å; F374-W378 HydrophobicContact CE2-CG 3.47Å; F374-W378 VanDerWaalsContact CE2-CG 3.47Å; F374-W378 AromaticContact CE2-NE1 3.68Å; F374-W378 HydrophobicContact CZ-CB 4.41Å; F374-W378 HydrophobicContact CZ-CD2 4.19Å; F374-W378 HydrophobicContact CZ-CG 4.09Å; F374-W378 WeakPolarHBondContact O-CB 3.33Å; F374-W378 PolarHBondContact O-N 3.1Å; F374-N410 WeakPolarHBondContact CA-OD1 3.44Å
375	I	93.9	Very high	89	Confident	46 Å²	46	43 Å²	43	24%	0.236	22%	0.223	C	C	.	.	H	α-helix	trans	-60.5	-50	179.4	-68.7	164.8	0	0	0	110.6	V201 L371 L372 T377 W378 T379	V201-I375 HydrophobicContact CG1-CD1 4.37Å; V201-I375 HydrophobicContact CG1-CG1 4.25Å; L371-I375 WeakPolarHBondContact O-CD1 3.44Å; L371-I375 VanDerWaalsContact O-CG1 3.27Å; L371-I375 WeakPolarHBondContact O-CG1 3.4Å; L371-I375 PolarHBondContact O-N 2.98Å; L372-I375 PolarHBondContact O-N 3.31Å; I375-T377 PolarHBondContact O-N 2.81Å; I375-W378 PolarHBondContact O-N 2.78Å; I375-T379 WeakPolarHBondContact O-CB 3.36Å; I375-T379 PolarHBondContact O-N 3.3Å; I375-T379 PolarHBondContact O-OG1 3.25Å
376	L	94.9	Very high	89.9	Confident	111 Å²	111	36 Å²	36	58%	0.581	20%	0.2	S	C	*	.	H	α-helix	trans	-62.5	-29.5	-179.1	-70.6	174.3	0	0	0	113.5	L372 A373 F374 P380	L372-L376 HydrophobicContact CD1-CD1 3.89Å; L372-L376 HydrophobicContact CD1-CG 3.96Å; L372-L376 HydrophobicContact CG-CD1 3.82Å; L372-L376 HydrophobicContact CG-CG 4.3Å; L372-L376 WeakPolarHBondContact O-CB 3.47Å; L372-L376 VanDerWaalsContact O-CG 3.26Å; L372-L376 WeakPolarHBondContact O-CG 3.22Å; L372-L376 PolarHBondContact O-N 2.86Å; A373-L376 PolarHBondContact O-N 3.25Å; F374-L376 PolarHBondContact O-N 3.41Å; L376-P380 WeakPolarHBondContact O-CD 3.36Å
377	T	95.9	Very high	90.9	Very high	7 Å²	7	38 Å²	38	4%	0.043	21%	0.212	C	C	.	.	H	α-helix	trans	-87.1	-34.5	-179.6	44.7	0	0	0	0	113.6	A373 F374 I375 L406 V409 N410 I413	A373-T377 WeakPolarHBondContact O-CB 3.3Å; A373-T377 WeakPolarHBondContact O-CG2 3.41Å; A373-T377 PolarHBondContact O-N 3.16Å; A373-T377 PolarHBondContact O-OG1 2.84Å; F374-T377 PolarHBondContact O-N 3.3Å; F374-T377 PolarHBondContact O-OG1 3.4Å; F374-T377 VanDerWaalsContact O-OG1 3.12Å; I375-T377 PolarHBondContact O-N 2.81Å; T377-L406 VanDerWaalsContact CB-O 3.29Å; T377-L406 WeakPolarHBondContact CB-O 3.49Å; T377-L406 HydrophobicContact CG2-CD1 4.31Å; T377-L406 HydrophobicContact CG2-CG 4.3Å; T377-L406 WeakPolarHBondContact O-CD2 3.41Å; T377-L406 WeakPolarHBondContact O-CG 3.49Å; T377-V409 HydrophobicContact CG2-CG1 4.33Å; T377-N410 HydrophobicContact CG2-CB 4.44Å; T377-N410 WeakPolarHBondContact OG1-CB 3.44Å; T377-N410 PolarHBondContact OG1-OD1 3.3Å; T377-I413 HydrophobicContact CG2-CD1 4.26Å
378	W	96.4	Very high	91.6	Very high	29 Å²	29	39.1 Å²	39.1	11%	0.11	22%	0.222	C	C	.	.	H	α-helix	trans	-95.1	-28	-175	-75.4	64.4	0	0	0	114.3	V113 F197 F374 I375 Y381 N382 C407 N410	V113-W378 HydrophobicContact CG2-CZ3 4.37Å; F197-W378 HydrophobicContact CD2-CB 4.13Å; F197-W378 HydrophobicContact CD2-CE3 4.37Å; F197-W378 HydrophobicContact CE2-CB 3.35Å; F197-W378 HydrophobicContact CE2-CG 4.3Å; F197-W378 HydrophobicContact CZ-CB 3.89Å; F374-W378 AromaticContact CD2-CD1 3.42Å; F374-W378 VanDerWaalsContact CD2-CD1 3.42Å; F374-W378 HydrophobicContact CD2-CD2 4.25Å; F374-W378 AromaticContact CD2-CG 3.82Å; F374-W378 HydrophobicContact CD2-CG 3.82Å; F374-W378 AromaticContact CD2-NE1 3.7Å; F374-W378 HydrophobicContact CE2-CB 4.2Å; F374-W378 AromaticContact CE2-CD1 3.52Å; F374-W378 AromaticContact CE2-CD2 3.54Å; F374-W378 HydrophobicContact CE2-CD2 3.54Å; F374-W378 AromaticContact CE2-CE2 3.73Å; F374-W378 HydrophobicContact CE2-CE3 4.21Å; F374-W378 AromaticContact CE2-CG 3.47Å; F374-W378 HydrophobicContact CE2-CG 3.47Å; F374-W378 VanDerWaalsContact CE2-CG 3.47Å; F374-W378 AromaticContact CE2-NE1 3.68Å; F374-W378 HydrophobicContact CZ-CB 4.41Å; F374-W378 HydrophobicContact CZ-CD2 4.19Å; F374-W378 HydrophobicContact CZ-CG 4.09Å; F374-W378 WeakPolarHBondContact O-CB 3.33Å; F374-W378 PolarHBondContact O-N 3.1Å; I375-W378 PolarHBondContact O-N 2.78Å; W378-Y381 PolarHBondContact O-N 2.95Å; W378-N382 PolarHBondContact O-N 2.94Å; W378-N382 PolarHBondContact O-ND2 2.88Å; W378-C407 HydrophobicContact CD2-CB 4.41Å; W378-C407 HydrophobicContact CZ2-CB 4.25Å; W378-N410 PolarHBondContact NE1-ND2 3.1Å
379	T	95.9	Very high	92.1	Very high	39 Å²	39	38.5 Å²	38.5	24%	0.239	22%	0.216	C	C	.	.	H	α-helix	trans	-59.6	-42.1	-177.9	-73	0	0	0	0	113.4	I375 Y381 N382 I383	I375-T379 WeakPolarHBondContact O-CB 3.36Å; I375-T379 PolarHBondContact O-N 3.3Å; I375-T379 PolarHBondContact O-OG1 3.25Å; T379-Y381 PolarHBondContact O-N 3.07Å; T379-N382 PolarHBondContact O-N 3.26Å; T379-I383 HydrophobicContact CG2-CD1 3.47Å; T379-I383 VanDerWaalsContact CG2-CD1 3.47Å; T379-I383 HydrophobicContact CG2-CG1 3.99Å; T379-I383 WeakPolarHBondContact O-CB 3.28Å; T379-I383 WeakPolarHBondContact O-CG1 3.3Å; T379-I383 PolarHBondContact O-N 2.92Å
380	P	96.6	Very high	92.4	Very high	52 Å²	52	44.3 Å²	44.3	34%	0.338	24%	0.235	S	C	.	.	H	α-helix	trans	-60.9	-44	-179.8	-28.6	39.5	0	0	0	113.6	L376 I383 M384 L406	L376-P380 WeakPolarHBondContact O-CD 3.36Å; P380-I383 PolarHBondContact O-N 2.98Å; P380-M384 WeakPolarHBondContact O-CG 3.49Å; P380-M384 PolarHBondContact O-N 3.5Å; P380-M384 VanDerWaalsContact O-N 3.13Å; P380-L406 HydrophobicContact CB-CD2 4.05Å; P380-L406 HydrophobicContact CG-CD2 3.63Å
381	Y	95.6	Very high	92.6	Very high	37 Å²	37	47 Å²	47	15%	0.145	25%	0.253	C	S	.	.	H	α-helix	trans	-60.2	-49.3	174.3	178.7	-100.5	0	0	0	111.5	W378 T379 I383 M384 V385 W400 Y404 C407	W378-Y381 PolarHBondContact O-N 2.95Å; T379-Y381 PolarHBondContact O-N 3.07Å; Y381-I383 VanDerWaalsContact C-N 3.32Å; Y381-I383 PolarHBondContact O-N 3.19Å; Y381-M384 WeakPolarHBondContact O-CB 3.46Å; Y381-M384 PolarHBondContact O-N 3.44Å; Y381-M384 VanDerWaalsContact O-N 3.07Å; Y381-V385 HydrophobicContact CD1-CG2 4.07Å; Y381-V385 HydrophobicContact CE1-CG2 3.62Å; Y381-V385 HydrophobicContact CE2-CG2 4.34Å; Y381-V385 WeakPolarHBondContact O-CG2 3.21Å; Y381-V385 PolarHBondContact O-N 3.44Å; Y381-W400 HydrophobicContact CD2-CE3 4.02Å; Y381-W400 AromaticContact CD2-CZ3 3.99Å; Y381-W400 HydrophobicContact CD2-CZ3 3.99Å; Y381-W400 AromaticContact CE2-CE3 3.69Å; Y381-W400 HydrophobicContact CE2-CE3 3.69Å; Y381-W400 AromaticContact CE2-CZ3 3.63Å; Y381-W400 HydrophobicContact CE2-CZ3 3.63Å; Y381-Y404 HydrophobicContact CD2-CD2 4.28Å; Y381-Y404 AromaticContact CE2-CD2 3.63Å; Y381-Y404 HydrophobicContact CE2-CD2 3.63Å; Y381-Y404 AromaticContact CE2-CE2 3.85Å; Y381-Y404 HydrophobicContact CE2-CE2 3.85Å; Y381-Y404 AromaticContact CZ-CE2 3.98Å; Y381-C407 VanDerWaalsContact CB-SG 3.53Å
382	N	94.8	Very high	92.5	Very high	11 Å²	11	54.7 Å²	54.7	6%	0.059	29%	0.286	C	S	.	.	H	α-helix	trans	-67.4	-30.3	-177.9	-74.9	-91.5	0	0	0	113.1	F197 Y198 W378 T379 V385 L386	F197-N382 VanDerWaalsContact CB-OD1 3.23Å; F197-N382 WeakPolarHBondContact CB-OD1 3.5Å; F197-N382 HydrophobicContact CD1-CB 3.42Å; F197-N382 VanDerWaalsContact CD1-CB 3.42Å; F197-N382 HydrophobicContact CE1-CB 3.62Å; F197-N382 HydrophobicContact CG-CB 4.09Å; F197-N382 VanDerWaalsContact CG-CG 3.41Å; F197-N382 WeakPolarHBondContact CG-OD1 3.18Å; F197-N382 HydrophobicContact CZ-CB 4.44Å; Y198-N382 HydrophobicContact CE2-CB 4.04Å; Y198-N382 VanDerWaalsContact OH-C 3.3Å; Y198-N382 PolarHBondContact OH-O 3.1Å; Y198-N382 VanDerWaalsContact OH-O 3.09Å; W378-N382 PolarHBondContact O-N 2.94Å; W378-N382 PolarHBondContact O-ND2 2.88Å; T379-N382 PolarHBondContact O-N 3.26Å; N382-V385 PolarHBondContact O-N 3.39Å; N382-L386 WeakPolarHBondContact O-CB 3.46Å; N382-L386 PolarHBondContact O-N 2.92Å
383	I	94.9	Very high	92.2	Very high	84 Å²	84	57.6 Å²	57.6	43%	0.431	30%	0.302	S	S	.	.	H	α-helix	trans	-65.3	-41.4	170.1	-73.7	174.6	0	0	0	111	T379 P380 Y381 L386 V387	T379-I383 HydrophobicContact CG2-CD1 3.47Å; T379-I383 VanDerWaalsContact CG2-CD1 3.47Å; T379-I383 HydrophobicContact CG2-CG1 3.99Å; T379-I383 WeakPolarHBondContact O-CB 3.28Å; T379-I383 WeakPolarHBondContact O-CG1 3.3Å; T379-I383 PolarHBondContact O-N 2.92Å; P380-I383 PolarHBondContact O-N 2.98Å; Y381-I383 VanDerWaalsContact C-N 3.32Å; Y381-I383 PolarHBondContact O-N 3.19Å; I383-L386 WeakPolarHBondContact O-CB 3.5Å; I383-L386 PolarHBondContact O-N 2.87Å; I383-V387 HydrophobicContact CG2-CG2 4.37Å; I383-V387 WeakPolarHBondContact O-CG2 3.45Å; I383-V387 PolarHBondContact O-N 2.93Å
384	M	93.5	Very high	92.2	Very high	22 Å²	22	59.6 Å²	59.6	11%	0.108	32%	0.315	C	S	.	.	H	α-helix	trans	-65.6	-39.3	175.5	-68.3	-178.2	-60.4	0	0	111.9	P380 Y381 L386 V387 S388 V395 L399 W400	P380-M384 WeakPolarHBondContact O-CG 3.49Å; P380-M384 PolarHBondContact O-N 3.5Å; P380-M384 VanDerWaalsContact O-N 3.13Å; Y381-M384 WeakPolarHBondContact O-CB 3.46Å; Y381-M384 PolarHBondContact O-N 3.44Å; Y381-M384 VanDerWaalsContact O-N 3.07Å; M384-L386 VanDerWaalsContact C-N 3.33Å; M384-L386 PolarHBondContact O-N 3.22Å; M384-V387 PolarHBondContact O-N 2.93Å; M384-S388 WeakPolarHBondContact O-CB 3.4Å; M384-S388 PolarHBondContact O-N 3.16Å; M384-S388 PolarHBondContact O-OG 2.93Å; M384-V395 HydrophobicContact CB-CG1 4.16Å; M384-V395 HydrophobicContact CB-CG2 4.3Å; M384-V395 HydrophobicContact CG-CG1 4.03Å; M384-V395 HydrophobicContact CG-CG2 4.44Å; M384-V395 HydrophobicContact SD-CG1 3.69Å; M384-L399 VanDerWaalsContact CE-O 3.32Å; M384-L399 WeakPolarHBondContact CE-O 3.27Å; M384-L399 HydrophobicContact SD-CB 3.66Å; M384-W400 VanDerWaalsContact C-CH2 3.48Å; M384-W400 HydrophobicContact CB-CE3 4.24Å; M384-W400 HydrophobicContact CB-CH2 3.76Å; M384-W400 HydrophobicContact CB-CZ2 4.3Å; M384-W400 HydrophobicContact CB-CZ3 3.71Å; M384-W400 HydrophobicContact CE-CE3 4.27Å
385	V	91.9	Very high	92.1	Very high	13 Å²	13	60.4 Å²	60.4	8%	0.079	32%	0.32	C	S	.	.	H	α-helix	trans	-58.7	-43.2	170.8	176.6	0	0	0	0	111.2	T189 A193 Y381 N382 S388 T389 W400	T189-V385 HydrophobicContact CG2-CG1 3.45Å; T189-V385 VanDerWaalsContact CG2-CG1 3.45Å; A193-V385 HydrophobicContact CB-CG1 3.96Å; Y381-V385 HydrophobicContact CD1-CG2 4.07Å; Y381-V385 HydrophobicContact CE1-CG2 3.62Å; Y381-V385 HydrophobicContact CE2-CG2 4.34Å; Y381-V385 WeakPolarHBondContact O-CG2 3.21Å; Y381-V385 PolarHBondContact O-N 3.44Å; N382-V385 PolarHBondContact O-N 3.39Å; V385-S388 PolarHBondContact O-OG 3.5Å; V385-S388 VanDerWaalsContact O-OG 3.14Å; V385-T389 WeakPolarHBondContact O-CG2 3.35Å; V385-T389 PolarHBondContact O-N 2.89Å; V385-W400 HydrophobicContact CG2-CH2 3.92Å; V385-W400 HydrophobicContact CG2-CZ3 3.8Å
386	L	91.4	Very high	92	Very high	51 Å²	51	61.7 Å²	61.7	27%	0.267	33%	0.331	S	S	.	.	H	α-helix	trans	-64.8	-45.6	176	-176.9	61.8	0	0	0	111.8	F190 M194 N382 I383 M384 T389 F390	F190-L386 HydrophobicContact CD2-CD1 3.72Å; F190-L386 HydrophobicContact CE2-CD1 3.62Å; M194-L386 HydrophobicContact CE-CD1 4.02Å; N382-L386 WeakPolarHBondContact O-CB 3.46Å; N382-L386 PolarHBondContact O-N 2.92Å; I383-L386 WeakPolarHBondContact O-CB 3.5Å; I383-L386 PolarHBondContact O-N 2.87Å; M384-L386 VanDerWaalsContact C-N 3.33Å; M384-L386 PolarHBondContact O-N 3.22Å; L386-T389 PolarHBondContact O-N 3.25Å; L386-T389 PolarHBondContact O-OG1 2.68Å; L386-F390 HydrophobicContact CD1-CE2 3.79Å; L386-F390 HydrophobicContact CG-CE2 4.26Å; L386-F390 VanDerWaalsContact O-CD2 3.25Å; L386-F390 WeakPolarHBondContact O-CD2 3.46Å
387	V	92.4	Very high	91.7	Very high	65 Å²	65	62.8 Å²	62.8	39%	0.394	33%	0.333	S	S	.	.	H	α-helix	trans	-63.4	-42.3	179.7	169.1	0	0	0	0	111.7	I383 M384 T389 F390 C391 V395	I383-V387 HydrophobicContact CG2-CG2 4.37Å; I383-V387 WeakPolarHBondContact O-CG2 3.45Å; I383-V387 PolarHBondContact O-N 2.93Å; M384-V387 PolarHBondContact O-N 2.93Å; V387-T389 PolarHBondContact O-N 3.44Å; V387-F390 PolarHBondContact O-N 2.91Å; V387-C391 PolarHBondContact O-N 3.31Å; V387-C391 VanDerWaalsContact O-N 3.09Å; V387-V395 HydrophobicContact CG1-CG2 4.23Å
388	S	88.8	Confident	91.5	Very high	39 Å²	39	66.6 Å²	66.6	27%	0.273	36%	0.356	S	S	.	.	H	α-helix	trans	-68.3	-15.7	179.3	66	0	0	0	0	114	M384 V385 F390 C391	M384-S388 WeakPolarHBondContact O-CB 3.4Å; M384-S388 PolarHBondContact O-N 3.16Å; M384-S388 PolarHBondContact O-OG 2.93Å; V385-S388 PolarHBondContact O-OG 3.5Å; V385-S388 VanDerWaalsContact O-OG 3.14Å; S388-F390 VanDerWaalsContact C-N 3.33Å; S388-C391 WeakPolarHBondContact CA-O 3.24Å
389	T	88.6	Confident	91.3	Very high	23 Å²	23	69.2 Å²	69.2	14%	0.141	37%	0.372	C	S	.	.	H	α-helix	trans	-74.8	-21.3	170.9	65	0	0	0	0	113.6	P186 T189 F190 V385 L386 V387	P186-T389 HydrophobicContact CB-CG2 4.31Å; P186-T389 VanDerWaalsContact O-CG2 3.31Å; P186-T389 WeakPolarHBondContact O-CG2 3.22Å; T189-T389 HydrophobicContact CG2-CG2 4.03Å; F190-T389 HydrophobicContact CB-CG2 4.02Å; V385-T389 WeakPolarHBondContact O-CG2 3.35Å; V385-T389 PolarHBondContact O-N 2.89Å; L386-T389 PolarHBondContact O-N 3.25Å; L386-T389 PolarHBondContact O-OG1 2.68Å; V387-T389 PolarHBondContact O-N 3.44Å
390	F	89.6	Confident	91.2	Very high	161 Å²	161	69.6 Å²	69.6	71%	0.706	37%	0.37	S	S	*	.	H	α-helix	trans	-105.4	-20.7	179.3	-60.9	-68.4	0	0	0	113.7	L386 V387 S388	L386-F390 HydrophobicContact CD1-CE2 3.79Å; L386-F390 HydrophobicContact CG-CE2 4.26Å; L386-F390 VanDerWaalsContact O-CD2 3.25Å; L386-F390 WeakPolarHBondContact O-CD2 3.46Å; V387-F390 PolarHBondContact O-N 2.91Å; S388-F390 VanDerWaalsContact C-N 3.33Å
391	C	88.3	Confident	91	Very high	65 Å²	65	69.2 Å²	69.2	44%	0.439	36%	0.363	S	S	.	.	S	Bend	trans	-143.5	128.3	-178.5	-168.7	0	0	0	0	111.7	V387 S388 C394	V387-C391 PolarHBondContact O-N 3.31Å; V387-C391 VanDerWaalsContact O-N 3.09Å; S388-C391 WeakPolarHBondContact CA-O 3.24Å; C391-C394 HydrophobicContact CB-CB 4.18Å; C391-C394 PolarHBondContact O-SG 3.25Å
392	K	85.1	Confident	91	Very high	177 Å²	177	72.6 Å²	72.6	77%	0.77	38%	0.383	S	S	*	.	S	Bend	trans	-77.9	146.3	177	-61.2	-176.6	-179.8	-177.8	0	110.4	C394	K392-C394 PolarHBondContact O-N 3.03Å
393	D	83.6	Confident	91	Very high	163 Å²	163	72.2 Å²	72.2	87%	0.872	38%	0.382	S	S	*	.	S	Bend	trans	56.9	14.8	168.2	-43.8	-43.2	0	0	0	116.1
394	C	90.6	Very high	91.1	Very high	55 Å²	55	69.8 Å²	69.8	37%	0.372	37%	0.368	S	S	.	.			trans	-87.7	-17.9	-177.4	65.8	0	0	0	0	114.5	C391 K392 P396	C391-C394 HydrophobicContact CB-CB 4.18Å; C391-C394 PolarHBondContact O-SG 3.25Å; K392-C394 PolarHBondContact O-N 3.03Å; C394-P396 WeakPolarHBondContact O-CD 3.35Å
395	V	91.3	Very high	91.3	Very high	18 Å²	18	70 Å²	70	11%	0.109	37%	0.367	C	S	.	.	S	Bend	trans	-101.9	107.7	175.4	-178.5	0	0	0	0	107.8	M384 V387 L399 W400	M384-V395 HydrophobicContact CB-CG1 4.16Å; M384-V395 HydrophobicContact CB-CG2 4.3Å; M384-V395 HydrophobicContact CG-CG1 4.03Å; M384-V395 HydrophobicContact CG-CG2 4.44Å; M384-V395 HydrophobicContact SD-CG1 3.69Å; V387-V395 HydrophobicContact CG1-CG2 4.23Å; V395-L399 HydrophobicContact CG1-CB 4.09Å; V395-W400 HydrophobicContact CB-CZ2 4.22Å; V395-W400 HydrophobicContact CG1-CD2 4.09Å; V395-W400 HydrophobicContact CG1-CG 4.25Å; V395-W400 HydrophobicContact CG1-CZ2 4.17Å; V395-W400 HydrophobicContact CG2-CZ2 4.49Å
396	P	92.4	Very high	91.5	Very high	74 Å²	74	72.1 Å²	72.1	48%	0.481	38%	0.378	S	S	.	.			trans	-66.9	145.4	178.8	27	-35.5	0	0	0	111.6	C394 T398 L399	C394-P396 WeakPolarHBondContact O-CD 3.35Å; P396-T398 PolarHBondContact O-N 3.4Å; P396-L399 HydrophobicContact CG-CD1 4.05Å; P396-L399 HydrophobicContact CG-CG 4.09Å; P396-L399 WeakPolarHBondContact O-CB 3.35Å; P396-L399 PolarHBondContact O-N 2.96Å
397	E	88.8	Confident	91.8	Very high	133 Å²	133	70.1 Å²	70.1	62%	0.621	37%	0.368	S	S	*	.	H	α-helix	trans	-48.9	-38.4	-177	-68	-54.9	134.2	0	0	114.2	L399 W400 E401	E397-L399 PolarHBondContact O-N 2.9Å; E397-W400 CarbonylContact O-C 3.58Å; E397-W400 WeakPolarHBondContact O-CA 3.46Å; E397-W400 WeakPolarHBondContact O-CB 3.43Å; E397-W400 PolarHBondContact O-N 3.45Å; E397-E401 WeakPolarHBondContact O-CG 3.46Å; E397-E401 PolarHBondContact O-N 3.22Å
398	T	90.6	Very high	92	Very high	87 Å²	87	67.2 Å²	67.2	53%	0.534	35%	0.35	S	S	.	.	H	α-helix	trans	-60.4	-29.5	177.7	-47	0	0	0	0	113.3	P396 L402	P396-T398 PolarHBondContact O-N 3.4Å; T398-L402 HydrophobicContact CG2-CD1 4.32Å; T398-L402 WeakPolarHBondContact O-CB 3.49Å; T398-L402 WeakPolarHBondContact O-CD1 3.38Å; T398-L402 VanDerWaalsContact O-CG 3.22Å; T398-L402 WeakPolarHBondContact O-CG 3.21Å; T398-L402 PolarHBondContact O-N 2.71Å; T398-L402 VanDerWaalsContact O-N 3.09Å
399	L	93.5	Very high	92.4	Very high	85 Å²	85	67.2 Å²	67.2	45%	0.445	35%	0.348	S	S	.	.	H	α-helix	trans	-75.3	-34.8	172.2	-69.1	-176.5	0	0	0	111.7	M384 V395 P396 E397 L402 G403	M384-L399 VanDerWaalsContact CE-O 3.32Å; M384-L399 WeakPolarHBondContact CE-O 3.27Å; M384-L399 HydrophobicContact SD-CB 3.66Å; V395-L399 HydrophobicContact CG1-CB 4.09Å; P396-L399 HydrophobicContact CG-CD1 4.05Å; P396-L399 HydrophobicContact CG-CG 4.09Å; P396-L399 WeakPolarHBondContact O-CB 3.35Å; P396-L399 PolarHBondContact O-N 2.96Å; E397-L399 PolarHBondContact O-N 2.9Å; L399-L402 PolarHBondContact O-N 2.93Å; L399-G403 PolarHBondContact O-N 3.47Å
400	W	92.7	Very high	92.7	Very high	47 Å²	47	66.1 Å²	66.1	18%	0.178	34%	0.342	C	S	.	.	H	α-helix	trans	-61.4	-48.1	168.5	-69.3	124	0	0	0	111.7	Y381 M384 V385 V395 E397 L402 G403 Y404	Y381-W400 HydrophobicContact CD2-CE3 4.02Å; Y381-W400 AromaticContact CD2-CZ3 3.99Å; Y381-W400 HydrophobicContact CD2-CZ3 3.99Å; Y381-W400 AromaticContact CE2-CE3 3.69Å; Y381-W400 HydrophobicContact CE2-CE3 3.69Å; Y381-W400 AromaticContact CE2-CZ3 3.63Å; Y381-W400 HydrophobicContact CE2-CZ3 3.63Å; M384-W400 VanDerWaalsContact C-CH2 3.48Å; M384-W400 HydrophobicContact CB-CE3 4.24Å; M384-W400 HydrophobicContact CB-CH2 3.76Å; M384-W400 HydrophobicContact CB-CZ2 4.3Å; M384-W400 HydrophobicContact CB-CZ3 3.71Å; M384-W400 HydrophobicContact CE-CE3 4.27Å; V385-W400 HydrophobicContact CG2-CH2 3.92Å; V385-W400 HydrophobicContact CG2-CZ3 3.8Å; V395-W400 HydrophobicContact CB-CZ2 4.22Å; V395-W400 HydrophobicContact CG1-CD2 4.09Å; V395-W400 HydrophobicContact CG1-CG 4.25Å; V395-W400 HydrophobicContact CG1-CZ2 4.17Å; V395-W400 HydrophobicContact CG2-CZ2 4.49Å; E397-W400 CarbonylContact O-C 3.58Å; E397-W400 WeakPolarHBondContact O-CA 3.46Å; E397-W400 WeakPolarHBondContact O-CB 3.43Å; E397-W400 PolarHBondContact O-N 3.45Å; W400-L402 VanDerWaalsContact C-N 3.32Å; W400-L402 PolarHBondContact O-N 3.04Å; W400-G403 PolarHBondContact O-N 2.7Å; W400-Y404 WeakPolarHBondContact O-CB 3.25Å; W400-Y404 PolarHBondContact O-N 3.18Å
401	E	93.2	Very high	92.9	Very high	44 Å²	44	58.5 Å²	58.5	21%	0.206	31%	0.309	C	S	.	.	H	α-helix	trans	-51.2	-50.7	174.8	-63.2	-168	166.3	0	0	110.9	K20 Y82 L86 E397 W405	K20-E401 IonicContact NZ-OE1 2.91Å; K20-E401 PolarHBondContact NZ-OE1 3.11Å; K20-E401 IonicContact NZ-OE2 2.66Å; K20-E401 PolarHBondContact NZ-OE2 3.37Å; Y82-E401 WeakPolarHBondContact OH-CA 3.3Å; L86-E401 HydrophobicContact CD2-CB 4.27Å; L86-E401 HydrophobicContact CD2-CG 3.6Å; E397-E401 WeakPolarHBondContact O-CG 3.46Å; E397-E401 PolarHBondContact O-N 3.22Å; E401-W405 VanDerWaalsContact O-CD1 3.29Å; E401-W405 PolarHBondContact O-N 3.13Å
402	L	94.5	Very high	93.3	Very high	107 Å²	107	56.6 Å²	56.6	56%	0.56	30%	0.295	S	S	*	.	H	α-helix	trans	-70.5	-38.8	-178.3	-70.8	170	0	0	0	113.1	T398 L399 W400 W405 L406	T398-L402 HydrophobicContact CG2-CD1 4.32Å; T398-L402 WeakPolarHBondContact O-CB 3.49Å; T398-L402 WeakPolarHBondContact O-CD1 3.38Å; T398-L402 VanDerWaalsContact O-CG 3.22Å; T398-L402 WeakPolarHBondContact O-CG 3.21Å; T398-L402 PolarHBondContact O-N 2.71Å; T398-L402 VanDerWaalsContact O-N 3.09Å; L399-L402 PolarHBondContact O-N 2.93Å; W400-L402 VanDerWaalsContact C-N 3.32Å; W400-L402 PolarHBondContact O-N 3.04Å; L402-W405 PolarHBondContact O-N 3.29Å; L402-L406 WeakPolarHBondContact O-CB 3.26Å; L402-L406 PolarHBondContact O-N 2.83Å
403	G	96.3	Very high	93.7	Very high	4 Å²	4	51 Å²	51	4%	0.041	27%	0.273	C	S	.	.	H	α-helix	trans	-65.5	-41.7	178.1	0	0	0	0	0	112.6	L399 W400 L406 C407	L399-G403 PolarHBondContact O-N 3.47Å; W400-G403 PolarHBondContact O-N 2.7Å; G403-L406 PolarHBondContact O-N 3.21Å; G403-C407 PolarHBondContact O-N 2.94Å; G403-C407 VanDerWaalsContact O-N 3.07Å
404	Y	96	Very high	94	Very high	32 Å²	32	43.2 Å²	43.2	13%	0.125	23%	0.231	C	C	.	.	H	α-helix	trans	-62.7	-45.7	175	-125.7	-78.6	0	0	0	111.6	Y82 Y106 Y381 W400 L406 C407 Y408	Y82-Y404 HydrophobicContact CE1-CD1 4.39Å; Y82-Y404 HydrophobicContact CE1-CG 4.17Å; Y82-Y404 AromaticContact CZ-CG 3.97Å; Y82-Y404 WeakPolarHBondContact OH-CB 3.44Å; Y106-Y404 WeakPolarHBondContact CE2-OH 3.38Å; Y106-Y404 PolarHBondContact OH-OH 3.42Å; Y381-Y404 HydrophobicContact CD2-CD2 4.28Å; Y381-Y404 AromaticContact CE2-CD2 3.63Å; Y381-Y404 HydrophobicContact CE2-CD2 3.63Å; Y381-Y404 AromaticContact CE2-CE2 3.85Å; Y381-Y404 HydrophobicContact CE2-CE2 3.85Å; Y381-Y404 AromaticContact CZ-CE2 3.98Å; W400-Y404 WeakPolarHBondContact O-CB 3.25Å; W400-Y404 PolarHBondContact O-N 3.18Å; Y404-L406 VanDerWaalsContact C-N 3.29Å; Y404-L406 PolarHBondContact O-N 2.89Å; Y404-C407 WeakPolarHBondContact O-CB 3.42Å; Y404-C407 PolarHBondContact O-N 3.5Å; Y404-Y408 HydrophobicContact CD1-CE1 4.04Å; Y404-Y408 HydrophobicContact CD1-CE2 4.05Å; Y404-Y408 AromaticContact CD1-CZ 3.66Å; Y404-Y408 HydrophobicContact CE1-CE1 4.11Å; Y404-Y408 AromaticContact CE1-CZ 3.84Å; Y404-Y408 WeakPolarHBondContact CE1-OH 3.28Å; Y404-Y408 PolarHBondContact O-N 2.91Å; Y404-Y408 VanDerWaalsContact O-N 3.08Å
405	W	97.3	Very high	94.1	Very high	26 Å²	26	40.8 Å²	40.8	10%	0.098	22%	0.215	C	C	.	.	H	α-helix	trans	-62.2	-35.5	174.2	-89.5	108.2	0	0	0	113.3	T32 L35 M79 Y82 T83 E401 L402 Y408 V409	T32-W405 HydrophobicContact CG2-CD2 4.15Å; T32-W405 HydrophobicContact CG2-CE3 4.43Å; T32-W405 HydrophobicContact CG2-CH2 3.68Å; T32-W405 HydrophobicContact CG2-CZ2 3.34Å; T32-W405 HydrophobicContact CG2-CZ3 4.22Å; L35-W405 HydrophobicContact CD2-CE3 3.76Å; L35-W405 HydrophobicContact CD2-CZ3 3.8Å; M79-W405 HydrophobicContact CB-CH2 3.7Å; M79-W405 HydrophobicContact CB-CZ3 3.97Å; M79-W405 HydrophobicContact CG-CH2 3.96Å; M79-W405 HydrophobicContact CG-CZ3 3.69Å; M79-W405 VanDerWaalsContact O-CH2 3.26Å; M79-W405 WeakPolarHBondContact O-CH2 3.36Å; M79-W405 WeakPolarHBondContact O-CZ2 3.49Å; M79-W405 HydrophobicContact SD-CZ3 4.19Å; Y82-W405 AromaticContact CD1-CE2 3.88Å; Y82-W405 HydrophobicContact CD1-CZ2 4.25Å; Y82-W405 AromaticContact CD1-NE1 3.49Å; Y82-W405 AromaticContact CE1-CD1 3.78Å; Y82-W405 AromaticContact CE1-NE1 3.69Å; T83-W405 VanDerWaalsContact OG1-CZ2 3.3Å; T83-W405 WeakPolarHBondContact OG1-CZ2 3.21Å; E401-W405 VanDerWaalsContact O-CD1 3.29Å; E401-W405 PolarHBondContact O-N 3.13Å; L402-W405 PolarHBondContact O-N 3.29Å; W405-Y408 HydrophobicContact CD2-CD2 4.2Å; W405-Y408 AromaticContact CE3-CD2 3.93Å; W405-Y408 HydrophobicContact CE3-CD2 3.93Å; W405-Y408 HydrophobicContact CH2-CD2 4.37Å; W405-Y408 HydrophobicContact CZ3-CD2 4.04Å; W405-Y408 WeakPolarHBondContact O-CB 3.42Å; W405-Y408 PolarHBondContact O-N 3.34Å; W405-V409 WeakPolarHBondContact O-CG2 3.45Å; W405-V409 PolarHBondContact O-N 3.31Å
406	L	96.8	Very high	94	Very high	59 Å²	59	45.8 Å²	45.8	31%	0.309	24%	0.238	S	C	.	.	H	α-helix	trans	-66.1	-40.4	176.8	-166.5	69.8	0	0	0	111.6	T377 P380 L402 G403 Y404 Y408 V409	T377-L406 VanDerWaalsContact CB-O 3.29Å; T377-L406 WeakPolarHBondContact CB-O 3.49Å; T377-L406 HydrophobicContact CG2-CD1 4.31Å; T377-L406 HydrophobicContact CG2-CG 4.3Å; T377-L406 WeakPolarHBondContact O-CD2 3.41Å; T377-L406 WeakPolarHBondContact O-CG 3.49Å; P380-L406 HydrophobicContact CB-CD2 4.05Å; P380-L406 HydrophobicContact CG-CD2 3.63Å; L402-L406 WeakPolarHBondContact O-CB 3.26Å; L402-L406 PolarHBondContact O-N 2.83Å; G403-L406 PolarHBondContact O-N 3.21Å; Y404-L406 VanDerWaalsContact C-N 3.29Å; Y404-L406 PolarHBondContact O-N 2.89Å; L406-Y408 VanDerWaalsContact C-N 3.32Å; L406-Y408 PolarHBondContact O-N 2.73Å; L406-V409 WeakPolarHBondContact O-CB 3.39Å; L406-V409 PolarHBondContact O-N 2.86Å
407	C	96.9	Very high	93.8	Very high	9 Å²	9	42.8 Å²	42.8	6%	0.061	22%	0.219	C	C	.	.	H	α-helix	trans	-58.9	-41.8	170.2	-70.4	0	0	0	0	111.9	W378 Y381 G403 Y404 N410	W378-C407 HydrophobicContact CD2-CB 4.41Å; W378-C407 HydrophobicContact CZ2-CB 4.25Å; Y381-C407 VanDerWaalsContact CB-SG 3.53Å; G403-C407 PolarHBondContact O-N 2.94Å; G403-C407 VanDerWaalsContact O-N 3.07Å; Y404-C407 WeakPolarHBondContact O-CB 3.42Å; Y404-C407 PolarHBondContact O-N 3.5Å; C407-N410 WeakPolarHBondContact O-CB 3.18Å; C407-N410 PolarHBondContact O-N 3.1Å
408	Y	97.6	Very high	93.6	Very high	4 Å²	4	36.8 Å²	36.8	2%	0.016	19%	0.191	C	C	.	.	H	α-helix	trans	-65.5	-35.9	175.3	-67.7	-20.2	0	0	0	113.3	I74 M79 Y82 D105 Y404 W405 L406 N410 S411	I74-Y408 HydrophobicContact CG2-CD1 3.59Å; I74-Y408 HydrophobicContact CG2-CE1 4.07Å; I74-Y408 HydrophobicContact CG2-CG 4.24Å; M79-Y408 WeakPolarHBondContact CE-O 3.23Å; M79-Y408 HydrophobicContact CG-CD2 3.99Å; M79-Y408 HydrophobicContact CG-CG 4.12Å; Y82-Y408 HydrophobicContact CD1-CD2 4.42Å; Y82-Y408 AromaticContact CD1-CE2 3.75Å; Y82-Y408 HydrophobicContact CD1-CE2 3.75Å; Y82-Y408 AromaticContact CG-CE2 4Å; Y82-Y408 HydrophobicContact CG-CE2 4Å; D105-Y408 WeakPolarHBondContact OD1-CE1 3.3Å; D105-Y408 WeakPolarHBondContact OD2-CE1 3.32Å; D105-Y408 PolarHBondContact OD2-OH 2.92Å; Y404-Y408 HydrophobicContact CD1-CE1 4.04Å; Y404-Y408 HydrophobicContact CD1-CE2 4.05Å; Y404-Y408 AromaticContact CD1-CZ 3.66Å; Y404-Y408 HydrophobicContact CE1-CE1 4.11Å; Y404-Y408 AromaticContact CE1-CZ 3.84Å; Y404-Y408 WeakPolarHBondContact CE1-OH 3.28Å; Y404-Y408 PolarHBondContact O-N 2.91Å; Y404-Y408 VanDerWaalsContact O-N 3.08Å; W405-Y408 HydrophobicContact CD2-CD2 4.2Å; W405-Y408 AromaticContact CE3-CD2 3.93Å; W405-Y408 HydrophobicContact CE3-CD2 3.93Å; W405-Y408 HydrophobicContact CH2-CD2 4.37Å; W405-Y408 HydrophobicContact CZ3-CD2 4.04Å; W405-Y408 WeakPolarHBondContact O-CB 3.42Å; W405-Y408 PolarHBondContact O-N 3.34Å; L406-Y408 VanDerWaalsContact C-N 3.32Å; L406-Y408 PolarHBondContact O-N 2.73Å; Y408-N410 PolarHBondContact O-N 3.42Å; Y408-S411 WeakPolarHBondContact O-CB 3.31Å; Y408-S411 PolarHBondContact O-N 2.92Å; Y408-S411 VanDerWaalsContact O-N 3.08Å
409	V	96.4	Very high	93.4	Very high	38 Å²	38	33.2 Å²	33.2	23%	0.23	17%	0.17	C	C	.	.	H	α-helix	trans	-58.6	-27	176.4	164.2	0	0	0	0	112.7	L35 T377 W405 L406 S411 T412 I413	L35-V409 HydrophobicContact CD1-CG2 4.29Å; L35-V409 HydrophobicContact CD2-CG2 3.66Å; T377-V409 HydrophobicContact CG2-CG1 4.33Å; W405-V409 WeakPolarHBondContact O-CG2 3.45Å; W405-V409 PolarHBondContact O-N 3.31Å; L406-V409 WeakPolarHBondContact O-CB 3.39Å; L406-V409 PolarHBondContact O-N 2.86Å; V409-S411 VanDerWaalsContact C-N 3.29Å; V409-S411 PolarHBondContact O-N 2.99Å; V409-T412 WeakPolarHBondContact O-CB 3.36Å; V409-T412 PolarHBondContact O-N 3.04Å; V409-T412 VanDerWaalsContact O-N 3.1Å; V409-I413 HydrophobicContact CG1-CD1 3.67Å; V409-I413 HydrophobicContact CG1-CG1 4.16Å; V409-I413 WeakPolarHBondContact O-CG1 3.47Å; V409-I413 PolarHBondContact O-N 3.04Å; V409-I413 VanDerWaalsContact O-N 3.08Å
410	N	94.7	Very high	92.9	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-52.4	-46.7	172.2	-176.4	57.7	0	0	0	112.3	F374 T377 W378 C407 Y408 T412 I413 N414	F374-N410 WeakPolarHBondContact CA-OD1 3.44Å; T377-N410 HydrophobicContact CG2-CB 4.44Å; T377-N410 WeakPolarHBondContact OG1-CB 3.44Å; T377-N410 PolarHBondContact OG1-OD1 3.3Å; W378-N410 PolarHBondContact NE1-ND2 3.1Å; C407-N410 WeakPolarHBondContact O-CB 3.18Å; C407-N410 PolarHBondContact O-N 3.1Å; Y408-N410 PolarHBondContact O-N 3.42Å; N410-T412 VanDerWaalsContact C-N 3.25Å; N410-T412 PolarHBondContact O-N 3.49Å; N410-I413 PolarHBondContact O-N 2.88Å; N410-I413 VanDerWaalsContact O-N 3.08Å; N410-N414 PolarHBondContact O-N 2.75Å; N410-N414 VanDerWaalsContact O-N 3.14Å
411	S	94.9	Very high	92.1	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.014	18%	0.178	C	C	.	.	H	α-helix	trans	-66.9	-25.4	-179.3	-65.6	0	0	0	0	112.9	N43 D71 Y408 V409	N43-S411 PolarHBondContact ND2-O 2.98Å; D71-S411 WeakPolarHBondContact OD1-CB 3.24Å; D71-S411 PolarHBondContact OD1-OG 2.81Å; Y408-S411 WeakPolarHBondContact O-CB 3.31Å; Y408-S411 PolarHBondContact O-N 2.92Å; Y408-S411 VanDerWaalsContact O-N 3.08Å; V409-S411 VanDerWaalsContact C-N 3.29Å; V409-S411 PolarHBondContact O-N 2.99Å
412	T	95.6	Very high	91.6	Very high	25 Å²	25	34.4 Å²	34.4	15%	0.153	18%	0.183	C	C	.	.	H	α-helix	trans	-73.9	-38	170.2	-38.1	0	0	0	0	112.3	L35 A38 T39 V409 N410	L35-T412 HydrophobicContact CD1-CG2 3.81Å; A38-T412 HydrophobicContact CB-CG2 4.19Å; T39-T412 WeakPolarHBondContact OG1-CB 3.21Å; T39-T412 WeakPolarHBondContact OG1-CG2 3.21Å; T39-T412 PolarHBondContact OG1-OG1 2.94Å; V409-T412 WeakPolarHBondContact O-CB 3.36Å; V409-T412 PolarHBondContact O-N 3.04Å; V409-T412 VanDerWaalsContact O-N 3.1Å; N410-T412 VanDerWaalsContact C-N 3.25Å; N410-T412 PolarHBondContact O-N 3.49Å
413	I	94.1	Very high	91	Very high	59 Å²	59	35.3 Å²	35.3	30%	0.303	18%	0.182	S	C	.	.	H	α-helix	trans	-74.1	-34	-174.9	-69.5	170.1	0	0	0	112	A373 T377 V409 N410 M416 C417	A373-I413 HydrophobicContact CB-CG2 3.8Å; T377-I413 HydrophobicContact CG2-CD1 4.26Å; V409-I413 HydrophobicContact CG1-CD1 3.67Å; V409-I413 HydrophobicContact CG1-CG1 4.16Å; V409-I413 WeakPolarHBondContact O-CG1 3.47Å; V409-I413 PolarHBondContact O-N 3.04Å; V409-I413 VanDerWaalsContact O-N 3.08Å; N410-I413 PolarHBondContact O-N 2.88Å; N410-I413 VanDerWaalsContact O-N 3.08Å; I413-M416 WeakPolarHBondContact O-CA 3.47Å; I413-M416 WeakPolarHBondContact O-CB 3.25Å; I413-M416 PolarHBondContact O-N 2.94Å; I413-C417 PolarHBondContact O-N 2.75Å
414	N	90.8	Very high	90.4	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-49.8	-51.4	-176.2	-82.9	-24.4	0	0	0	114.7	D71 N410 M416 C417 Y418	D71-N414 WeakPolarHBondContact OD2-CB 3.26Å; D71-N414 PolarHBondContact OD2-ND2 2.73Å; N410-N414 PolarHBondContact O-N 2.75Å; N410-N414 VanDerWaalsContact O-N 3.14Å; N414-M416 VanDerWaalsContact C-N 3.3Å; N414-M416 PolarHBondContact O-N 3.21Å; N414-C417 WeakPolarHBondContact O-CB 3.24Å; N414-C417 PolarHBondContact O-N 3.12Å; N414-Y418 HydrophobicContact CB-CE2 4.26Å; N414-Y418 VanDerWaalsContact O-CD2 3.27Å; N414-Y418 WeakPolarHBondContact O-CD2 3.38Å; N414-Y418 WeakPolarHBondContact O-CE2 3.49Å; N414-Y418 VanDerWaalsContact O-CG 3.31Å; N414-Y418 PolarHBondContact O-N 2.84Å; N414-Y418 VanDerWaalsContact O-N 3.11Å
415	P	91.9	Very high	90	Very high	4 Å²	4	34.8 Å²	34.8	3%	0.026	18%	0.184	C	C	.	.	H	α-helix	trans	-53.9	-39.7	172.6	-30.2	36.2	0	0	0	115	G42 N43 V46 Y418 A419	G42-P415 VanDerWaalsContact C-CG 3.43Å; N43-P415 HydrophobicContact CB-CG 4.45Å; N43-P415 WeakPolarHBondContact OD1-CG 3.25Å; V46-P415 HydrophobicContact CG2-CB 4.23Å; V46-P415 HydrophobicContact CG2-CG 4.36Å; P415-Y418 PolarHBondContact O-N 2.91Å; P415-A419 PolarHBondContact O-N 3.03Å; P415-A419 VanDerWaalsContact O-N 3.09Å
416	M	89.2	Confident	89.5	Confident	122 Å²	122	37.3 Å²	37.3	60%	0.601	19%	0.193	S	C	*	.	H	α-helix	trans	-70.7	-39.8	-179.7	-67.3	-62.4	-76.3	0	0	111.2	I413 N414 Y418 A419 L420	I413-M416 WeakPolarHBondContact O-CA 3.47Å; I413-M416 WeakPolarHBondContact O-CB 3.25Å; I413-M416 PolarHBondContact O-N 2.94Å; N414-M416 VanDerWaalsContact C-N 3.3Å; N414-M416 PolarHBondContact O-N 3.21Å; M416-Y418 VanDerWaalsContact C-N 3.35Å; M416-Y418 PolarHBondContact O-N 3.25Å; M416-A419 PolarHBondContact O-N 2.97Å; M416-L420 WeakPolarHBondContact O-CG 3.3Å; M416-L420 PolarHBondContact O-N 3.4Å
417	C	87.2	Confident	89.1	Confident	12 Å²	12	36.3 Å²	36.3	8%	0.081	19%	0.189	C	C	.	.	H	α-helix	trans	-53.6	-51.6	168.9	-70.1	0	0	0	0	110.6	I370 I413 N414 A419 L420 C421	I370-C417 HydrophobicContact CG1-CB 3.68Å; I413-C417 PolarHBondContact O-N 2.75Å; N414-C417 WeakPolarHBondContact O-CB 3.24Å; N414-C417 PolarHBondContact O-N 3.12Å; C417-A419 VanDerWaalsContact C-N 3.34Å; C417-A419 PolarHBondContact O-N 2.98Å; C417-L420 PolarHBondContact O-N 3.4Å; C417-C421 WeakPolarHBondContact O-CB 3.28Å; C417-C421 PolarHBondContact O-N 3.01Å; C417-C421 PolarHBondContact O-SG 3.18Å
418	Y	85.9	Confident	88.6	Confident	6 Å²	6	35.9 Å²	35.9	2%	0.024	19%	0.186	C	C	.	.	H	α-helix	trans	-59.5	-41.3	-179.2	-50	-34.8	0	0	0	113.1	V46 L64 L67 I370 N414 P415 M416 C421 N422	V46-Y418 HydrophobicContact CG1-CD2 4.36Å; V46-Y418 HydrophobicContact CG1-CE2 4.46Å; V46-Y418 HydrophobicContact CG2-CD2 3.68Å; V46-Y418 HydrophobicContact CG2-CE2 4.07Å; L64-Y418 HydrophobicContact CD1-CD1 4.19Å; L64-Y418 HydrophobicContact CD1-CE1 4.34Å; L64-Y418 HydrophobicContact CD2-CD1 4.32Å; L64-Y418 HydrophobicContact CD2-CE1 3.69Å; L64-Y418 HydrophobicContact CG-CE1 4.41Å; L67-Y418 WeakPolarHBondContact CD2-OH 3.49Å; L67-Y418 WeakPolarHBondContact CG-OH 3.47Å; I370-Y418 HydrophobicContact CD1-CD1 4.17Å; I370-Y418 HydrophobicContact CD1-CE1 3.87Å; N414-Y418 HydrophobicContact CB-CE2 4.26Å; N414-Y418 VanDerWaalsContact O-CD2 3.27Å; N414-Y418 WeakPolarHBondContact O-CD2 3.38Å; N414-Y418 WeakPolarHBondContact O-CE2 3.49Å; N414-Y418 VanDerWaalsContact O-CG 3.31Å; N414-Y418 PolarHBondContact O-N 2.84Å; N414-Y418 VanDerWaalsContact O-N 3.11Å; P415-Y418 PolarHBondContact O-N 2.91Å; M416-Y418 VanDerWaalsContact C-N 3.35Å; M416-Y418 PolarHBondContact O-N 3.25Å; Y418-C421 PolarHBondContact O-N 2.03Å; Y418-N422 PolarHBondContact O-N 3Å
419	A	85.9	Confident	88.3	Confident	13 Å²	13	36.6 Å²	36.6	11%	0.107	19%	0.189	C	C	.	.	H	α-helix	trans	-69.7	-40.8	179.8	0	0	0	0	0	113.3	P415 M416 C417 C421 R426 F429	P415-A419 PolarHBondContact O-N 3.03Å; P415-A419 VanDerWaalsContact O-N 3.09Å; M416-A419 PolarHBondContact O-N 2.97Å; C417-A419 VanDerWaalsContact C-N 3.34Å; C417-A419 PolarHBondContact O-N 2.98Å; A419-C421 VanDerWaalsContact C-N 3.31Å; A419-R426 VanDerWaalsContact O-CB 3.32Å; A419-R426 WeakPolarHBondContact O-CB 3.49Å; A419-R426 WeakPolarHBondContact O-CD 3.23Å; A419-F429 HydrophobicContact CB-CD2 3.83Å; A419-F429 HydrophobicContact CB-CE2 3.9Å
420	L	82.1	Confident	87.9	Confident	124 Å²	124	41.7 Å²	41.7	65%	0.649	20%	0.204	S	C	*	.	H	α-helix	trans	-65.2	-40.5	174.8	-68.3	171.6	0	0	0	111.1	M416 C417	M416-L420 WeakPolarHBondContact O-CG 3.3Å; M416-L420 PolarHBondContact O-N 3.4Å; C417-L420 PolarHBondContact O-N 3.4Å
421	C	77.1	Confident	87.5	Confident	21 Å²	21	43.7 Å²	43.7	14%	0.142	21%	0.214	C	C	.	.	H	α-helix	trans	-76.7	-50.9	-171.6	-74.6	0	0	0	0	114.6	K362 T366 C417 Y418 A419	K362-C421 WeakPolarHBondContact CE-O 3.45Å; T366-C421 WeakPolarHBondContact CA-SG 3.45Å; T366-C421 WeakPolarHBondContact CB-SG 3.46Å; T366-C421 HydrophobicContact CG2-CB 3.32Å; C417-C421 WeakPolarHBondContact O-CB 3.28Å; C417-C421 PolarHBondContact O-N 3.01Å; C417-C421 PolarHBondContact O-SG 3.18Å; Y418-C421 PolarHBondContact O-N 2.03Å; A419-C421 VanDerWaalsContact C-N 3.31Å
422	N	81.8	Confident	87.2	Confident	56 Å²	56	45 Å²	45	30%	0.299	22%	0.221	S	C	.	.			trans	-110	113.6	-171.2	-175.2	-8.5	0	0	0	111.3	Y418 A424 F425 R426	Y418-N422 PolarHBondContact O-N 3Å; N422-A424 PolarHBondContact O-N 3.22Å; N422-A424 PolarHBondContact OD1-N 3.5Å; N422-F425 HydrophobicContact CB-CB 4.34Å; N422-F425 HydrophobicContact CB-CD2 3.99Å; N422-F425 WeakPolarHBondContact ND2-CD2 3.44Å; N422-F425 PolarHBondContact O-N 3.43Å; N422-F425 VanDerWaalsContact O-N 3.13Å; N422-R426 PolarHBondContact O-N 3.17Å
423	K	82.6	Confident	86.8	Confident	125 Å²	125	49.5 Å²	49.5	54%	0.543	24%	0.243	S	C	.	.	H	α-helix	trans	-55.9	-37	178.6	178.7	172	175.1	175.2	0	112.5	R426 D427	K423-R426 PolarHBondContact O-N 3.44Å; K423-D427 WeakPolarHBondContact CE-OD2 3.45Å; K423-D427 VanDerWaalsContact CG-OD2 3.31Å; K423-D427 WeakPolarHBondContact CG-OD2 3Å; K423-D427 IonicContact NZ-OD2 3.07Å; K423-D427 WeakPolarHBondContact O-CB 3.5Å; K423-D427 VanDerWaalsContact O-CG 3.24Å; K423-D427 PolarHBondContact O-N 2.79Å
424	A	84.3	Confident	86.6	Confident	24 Å²	24	51.7 Å²	51.7	20%	0.198	26%	0.255	C	S	.	.	H	α-helix	trans	-68	-37.1	-179.3	0	0	0	0	0	112.3	L56 N422 T428	L56-A424 HydrophobicContact CD2-CB 3.63Å; N422-A424 PolarHBondContact O-N 3.22Å; N422-A424 PolarHBondContact OD1-N 3.5Å; A424-T428 WeakPolarHBondContact O-CB 3.47Å; A424-T428 PolarHBondContact O-N 2.9Å; A424-T428 PolarHBondContact O-OG1 3.14Å
425	F	85.9	Confident	86.3	Confident	1 Å²	1	57.4 Å²	57.4	0%	0.004	29%	0.294	C	S	.	.	H	α-helix	trans	-65.2	-50.1	170	-88.3	-71	0	0	0	110.5	V46 L56 L64 N422 D427 T428 F429	V46-F425 HydrophobicContact CG1-CE1 4.08Å; V46-F425 HydrophobicContact CG1-CZ 4.41Å; L56-F425 HydrophobicContact CD1-CD1 3.73Å; L56-F425 HydrophobicContact CD1-CE1 3.78Å; L56-F425 HydrophobicContact CD1-CG 4.15Å; L56-F425 HydrophobicContact CD1-CZ 4.23Å; L56-F425 HydrophobicContact CD2-CD2 3.93Å; L56-F425 HydrophobicContact CD2-CE2 4.03Å; L56-F425 HydrophobicContact CD2-CG 4.17Å; L56-F425 HydrophobicContact CD2-CZ 4.37Å; L64-F425 HydrophobicContact CD1-CE2 4.13Å; N422-F425 HydrophobicContact CB-CB 4.34Å; N422-F425 HydrophobicContact CB-CD2 3.99Å; N422-F425 WeakPolarHBondContact ND2-CD2 3.44Å; N422-F425 PolarHBondContact O-N 3.43Å; N422-F425 VanDerWaalsContact O-N 3.13Å; F425-D427 PolarHBondContact O-N 3.42Å; F425-T428 CarbonylContact O-C 3.54Å; F425-T428 WeakPolarHBondContact O-CB 3.04Å; F425-T428 PolarHBondContact O-N 2.85Å; F425-T428 VanDerWaalsContact O-N 3.11Å; F425-F429 AromaticContact CD1-CE1 3.89Å; F425-F429 HydrophobicContact CD1-CE1 3.89Å; F425-F429 WeakPolarHBondContact O-CB 3.22Å; F425-F429 WeakPolarHBondContact O-CD1 3.47Å; F425-F429 PolarHBondContact O-N 3.14Å
426	R	88.7	Confident	85.8	Confident	79 Å²	79	65.6 Å²	65.6	30%	0.298	32%	0.324	S	S	.	.	H	α-helix	trans	-57.2	-44.3	-178.7	-164.7	168.7	59.4	-154.6	11.2	114.4	A419 N422 K423 T428 R430	A419-R426 VanDerWaalsContact O-CB 3.32Å; A419-R426 WeakPolarHBondContact O-CB 3.49Å; A419-R426 WeakPolarHBondContact O-CD 3.23Å; N422-R426 PolarHBondContact O-N 3.17Å; K423-R426 PolarHBondContact O-N 3.44Å; R426-T428 VanDerWaalsContact C-N 3.33Å; R426-R430 WeakPolarHBondContact O-CG 3.31Å; R426-R430 PolarHBondContact O-N 2.69Å
427	D	86.6	Confident	85.2	Confident	39 Å²	39	62 Å²	62	21%	0.209	30%	0.304	C	S	.	.	H	α-helix	trans	-72.8	-31.3	-179.3	-64.9	-4.4	0	0	0	110.5	K423 F425 L431 W442	K423-D427 WeakPolarHBondContact CE-OD2 3.45Å; K423-D427 VanDerWaalsContact CG-OD2 3.31Å; K423-D427 WeakPolarHBondContact CG-OD2 3Å; K423-D427 IonicContact NZ-OD2 3.07Å; K423-D427 WeakPolarHBondContact O-CB 3.5Å; K423-D427 VanDerWaalsContact O-CG 3.24Å; K423-D427 PolarHBondContact O-N 2.79Å; F425-D427 PolarHBondContact O-N 3.42Å; D427-L431 WeakPolarHBondContact O-CG 3.23Å; D427-L431 PolarHBondContact O-N 2.99Å; D427-W442 HydrophobicContact CB-CH2 4.26Å
428	T	87.4	Confident	84.5	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-68.8	-46.9	171.2	-52.4	0	0	0	0	111.3	S49 V52 N53 A424 F425 R426 R430 L431 L432 W437	S49-T428 WeakPolarHBondContact OG-CG2 3.47Å; V52-T428 HydrophobicContact CG2-CG2 4.16Å; N53-T428 HydrophobicContact CB-CG2 4.23Å; N53-T428 PolarHBondContact ND2-OG1 2.67Å; A424-T428 WeakPolarHBondContact O-CB 3.47Å; A424-T428 PolarHBondContact O-N 2.9Å; A424-T428 PolarHBondContact O-OG1 3.14Å; F425-T428 CarbonylContact O-C 3.54Å; F425-T428 WeakPolarHBondContact O-CB 3.04Å; F425-T428 PolarHBondContact O-N 2.85Å; F425-T428 VanDerWaalsContact O-N 3.11Å; R426-T428 VanDerWaalsContact C-N 3.33Å; T428-R430 VanDerWaalsContact C-N 3.33Å; T428-R430 PolarHBondContact O-N 3.39Å; T428-L431 PolarHBondContact O-N 3.08Å; T428-L431 VanDerWaalsContact O-N 3.1Å; T428-L432 HydrophobicContact CG2-CD1 4.03Å; T428-L432 HydrophobicContact CG2-CG 4.37Å; T428-L432 WeakPolarHBondContact O-CG 3.38Å; T428-L432 PolarHBondContact O-N 3.37Å; T428-W437 HydrophobicContact CG2-CE3 4.21Å; T428-W437 HydrophobicContact CG2-CH2 4.43Å; T428-W437 HydrophobicContact CG2-CZ3 3.84Å
429	F	90.3	Very high	83.4	Confident	19 Å²	19	70.9 Å²	70.9	8%	0.083	35%	0.345	C	S	.	.	H	α-helix	trans	-55.4	-47.4	176.6	-82	23.8	0	0	0	111.1	L45 V46 S49 A419 F425 L431 L432 L433	L45-F429 HydrophobicContact CB-CD1 4.4Å; L45-F429 HydrophobicContact CB-CE1 4.08Å; L45-F429 HydrophobicContact CB-CZ 4.13Å; V46-F429 HydrophobicContact CG2-CE1 4.46Å; V46-F429 HydrophobicContact CG2-CZ 3.85Å; S49-F429 VanDerWaalsContact OG-CD1 3.27Å; S49-F429 WeakPolarHBondContact OG-CD1 3.43Å; S49-F429 WeakPolarHBondContact OG-CE1 3.44Å; A419-F429 HydrophobicContact CB-CD2 3.83Å; A419-F429 HydrophobicContact CB-CE2 3.9Å; F425-F429 AromaticContact CD1-CE1 3.89Å; F425-F429 HydrophobicContact CD1-CE1 3.89Å; F425-F429 WeakPolarHBondContact O-CB 3.22Å; F425-F429 WeakPolarHBondContact O-CD1 3.47Å; F425-F429 PolarHBondContact O-N 3.14Å; F429-L431 VanDerWaalsContact C-N 3.33Å; F429-L431 PolarHBondContact O-N 3.29Å; F429-L432 PolarHBondContact O-N 3Å; F429-L433 WeakPolarHBondContact O-CB 3.43Å; F429-L433 WeakPolarHBondContact O-CG 3.4Å; F429-L433 PolarHBondContact O-N 3.3Å
430	R	87.9	Confident	82	Confident	144 Å²	144	79.8 Å²	79.8	54%	0.543	38%	0.376	S	S	.	.	H	α-helix	trans	-61.6	-37.5	176.7	-74.5	168.7	171.4	-179.5	-9.1	113	R426 T428 L434	R426-R430 WeakPolarHBondContact O-CG 3.31Å; R426-R430 PolarHBondContact O-N 2.69Å; T428-R430 VanDerWaalsContact C-N 3.33Å; T428-R430 PolarHBondContact O-N 3.39Å; R430-L434 VanDerWaalsContact O-CB 3.28Å; R430-L434 WeakPolarHBondContact O-CB 3.41Å; R430-L434 WeakPolarHBondContact O-CD1 3.49Å; R430-L434 WeakPolarHBondContact O-CG 3.43Å; R430-L434 PolarHBondContact O-N 2.96Å; R430-L434 VanDerWaalsContact O-N 3.16Å
431	L	86.9	Confident	80.8	Confident	42 Å²	42	82.8 Å²	82.8	22%	0.22	38%	0.378	C	S	.	.	H	α-helix	trans	-73.4	-32.8	176.6	-74	173.7	0	0	0	113	D427 T428 F429 C435 R436 W437 W442	D427-L431 WeakPolarHBondContact O-CG 3.23Å; D427-L431 PolarHBondContact O-N 2.99Å; T428-L431 PolarHBondContact O-N 3.08Å; T428-L431 VanDerWaalsContact O-N 3.1Å; F429-L431 VanDerWaalsContact C-N 3.33Å; F429-L431 PolarHBondContact O-N 3.29Å; L431-C435 PolarHBondContact O-N 2.81Å; L431-R436 HydrophobicContact CD2-CB 3.92Å; L431-R436 PolarHBondContact O-N 3.15Å; L431-W437 HydrophobicContact CB-CE3 3.94Å; L431-W437 HydrophobicContact CD1-CE3 3.99Å; L431-W437 HydrophobicContact CD1-CZ3 4.12Å; L431-W437 PolarHBondContact O-N 3.01Å; L431-W442 HydrophobicContact CD1-CD2 4.48Å; L431-W442 HydrophobicContact CD1-CE3 3.37Å; L431-W442 HydrophobicContact CD1-CZ3 3.41Å; L431-W442 VanDerWaalsContact CD1-CZ3 3.41Å
432	L	88.5	Confident	80.1	Confident	30 Å²	30	83.9 Å²	83.9	16%	0.157	38%	0.379	C	S	.	.	H	α-helix	trans	-71	-51.3	174.5	-69.4	172.1	0	0	0	111.2	L45 I48 S49 V52 T428 F429 L434 C435 W437	L45-L432 HydrophobicContact CD2-CB 3.99Å; L45-L432 HydrophobicContact CD2-CD1 4.12Å; I48-L432 HydrophobicContact CB-CD1 4.37Å; I48-L432 HydrophobicContact CG2-CD1 3.78Å; I48-L432 HydrophobicContact CG2-CD2 3.89Å; S49-L432 WeakPolarHBondContact OG-CD1 3.21Å; V52-L432 HydrophobicContact CG2-CD2 4.47Å; T428-L432 HydrophobicContact CG2-CD1 4.03Å; T428-L432 HydrophobicContact CG2-CG 4.37Å; T428-L432 WeakPolarHBondContact O-CG 3.38Å; T428-L432 PolarHBondContact O-N 3.37Å; F429-L432 PolarHBondContact O-N 3Å; L432-L434 VanDerWaalsContact C-N 3.27Å; L432-L434 PolarHBondContact O-N 3.01Å; L432-C435 WeakPolarHBondContact O-CA 3.3Å; L432-C435 PolarHBondContact O-N 3.3Å; L432-W437 HydrophobicContact CD2-CB 4.11Å; L432-W437 HydrophobicContact CD2-CG 4.21Å
433	L	88.3	Confident	78.9	Confident	119 Å²	119	91.2 Å²	91.2	62%	0.623	40%	0.403	S	S	*	.	H	α-helix	trans	-62.5	-30.1	179.7	-72.9	169.3	0	0	0	113.6	L45 F429 C435	L45-L433 HydrophobicContact CD1-CD2 3.95Å; L45-L433 HydrophobicContact CD1-CG 4.26Å; F429-L433 WeakPolarHBondContact O-CB 3.43Å; F429-L433 WeakPolarHBondContact O-CG 3.4Å; F429-L433 PolarHBondContact O-N 3.3Å; L433-C435 VanDerWaalsContact C-N 3.33Å
434	L	89.2	Confident	77.5	Confident	106 Å²	106	93.7 Å²	93.7	56%	0.555	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	5.8	174	-64.1	173.8	0	0	0	113.3	R430 L432 R436	R430-L434 VanDerWaalsContact O-CB 3.28Å; R430-L434 WeakPolarHBondContact O-CB 3.41Å; R430-L434 WeakPolarHBondContact O-CD1 3.49Å; R430-L434 WeakPolarHBondContact O-CG 3.43Å; R430-L434 PolarHBondContact O-N 2.96Å; R430-L434 VanDerWaalsContact O-N 3.16Å; L432-L434 VanDerWaalsContact C-N 3.27Å; L432-L434 PolarHBondContact O-N 3.01Å; L434-R436 HydrophobicContact CB-CB 4.42Å; L434-R436 HydrophobicContact CB-CG 4.22Å; L434-R436 WeakPolarHBondContact O-CG 3.36Å; L434-R436 PolarHBondContact O-N 2.96Å
435	C	83.9	Confident	76.2	Confident	120 Å²	120	96.4 Å²	96.4	81%	0.811	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	24.3	-173.6	-63.6	0	0	0	0	114.8	L431 L432 L433	L431-C435 PolarHBondContact O-N 2.81Å; L432-C435 WeakPolarHBondContact O-CA 3.3Å; L432-C435 PolarHBondContact O-N 3.3Å; L433-C435 VanDerWaalsContact C-N 3.33Å
436	R	83.1	Confident	74.3	Confident	175 Å²	175	102 Å²	102	66%	0.66	46%	0.46	S	S	*	.			trans	-96.6	16	-175.9	-76.4	168.9	-169	-158.4	0.2	113.4	L431 L434 D438	L431-R436 HydrophobicContact CD2-CB 3.92Å; L431-R436 PolarHBondContact O-N 3.15Å; L434-R436 HydrophobicContact CB-CB 4.42Å; L434-R436 HydrophobicContact CB-CG 4.22Å; L434-R436 WeakPolarHBondContact O-CG 3.36Å; L434-R436 PolarHBondContact O-N 2.96Å; R436-D438 PolarHBondContact O-N 3.46Å
437	W	75.4	Confident	72.7	Confident	47 Å²	47	104.5 Å²	104.5	18%	0.178	47%	0.473	C	S	.	.			trans	-75.6	84.3	-179	-176.1	-94.4	0	0	0	112.8	V52 N53 T428 L431 L432 W442	V52-W437 HydrophobicContact CB-CZ2 3.85Å; V52-W437 HydrophobicContact CG2-CD2 4.02Å; V52-W437 HydrophobicContact CG2-CE3 4.43Å; V52-W437 HydrophobicContact CG2-CH2 4.12Å; V52-W437 HydrophobicContact CG2-CZ2 3.64Å; V52-W437 HydrophobicContact CG2-CZ3 4.48Å; N53-W437 HydrophobicContact CB-CH2 3.75Å; N53-W437 HydrophobicContact CB-CZ2 4.35Å; T428-W437 HydrophobicContact CG2-CE3 4.21Å; T428-W437 HydrophobicContact CG2-CH2 4.43Å; T428-W437 HydrophobicContact CG2-CZ3 3.84Å; L431-W437 HydrophobicContact CB-CE3 3.94Å; L431-W437 HydrophobicContact CD1-CE3 3.99Å; L431-W437 HydrophobicContact CD1-CZ3 4.12Å; L431-W437 PolarHBondContact O-N 3.01Å; L432-W437 HydrophobicContact CD2-CB 4.11Å; L432-W437 HydrophobicContact CD2-CG 4.21Å; W437-W442 HydrophobicContact CH2-CD2 4.2Å; W437-W442 HydrophobicContact CH2-CG 4.03Å; W437-W442 HydrophobicContact CZ3-CD2 4.16Å; W437-W442 HydrophobicContact CZ3-CE3 4.35Å; W437-W442 HydrophobicContact CZ3-CG 4.36Å
438	D	73.1	Confident	70.4	Confident	71 Å²	71	114 Å²	114	38%	0.38	51%	0.507	S	S	.	.			trans	-97.5	118	166.4	175	24.4	0	0	0	111.8	R436 R440 R441 W442	R436-D438 PolarHBondContact O-N 3.46Å; D438-R440 PolarHBondContact O-N 2.94Å; D438-R440 WeakPolarHBondContact OD1-CB 3.43Å; D438-R440 PolarHBondContact OD1-N 3.5Å; D438-R440 WeakPolarHBondContact OD2-CB 3.45Å; D438-R441 HydrophobicContact CB-CB 3.9Å; D438-R441 PolarHBondContact O-N 2.93Å; D438-R441 VanDerWaalsContact OD2-CB 3.3Å; D438-R441 WeakPolarHBondContact OD2-CB 3.21Å; D438-R441 PolarHBondContact OD2-N 2.84Å; D438-W442 PolarHBondContact O-N 2.95Å
439	K	61.4	Low	68.4	Low	133 Å²	133	119.4 Å²	119.4	58%	0.578	54%	0.542	S	S	*	.	H	α-helix	trans	-60.3	-28.2	173.8	-67.9	174.6	-178.8	167.7	0	112.7	R443	K439-R443 WeakPolarHBondContact O-CG 3.33Å
440	R	57.1	Low	66.3	Low	201 Å²	201	122.8 Å²	122.8	76%	0.758	58%	0.581	S	S	*	*	H	α-helix	trans	-76.7	-45.7	176.8	-57.5	177.9	176.2	-174.1	-1	110.5	D438 R443 K444	D438-R440 PolarHBondContact O-N 2.94Å; D438-R440 WeakPolarHBondContact OD1-CB 3.43Å; D438-R440 PolarHBondContact OD1-N 3.5Å; D438-R440 WeakPolarHBondContact OD2-CB 3.45Å; R440-R443 PolarHBondContact O-N 3.42Å; R440-K444 PolarHBondContact O-N 3.36Å
441	R	58.1	Low	64	Low	187 Å²	187	119.5 Å²	119.5	71%	0.706	58%	0.58	S	S	*	*	H	α-helix	trans	-64.3	-43.3	175.4	-150.8	170.6	-165.8	171.3	4.7	112.6	D438 R443 K444 I445	D438-R441 HydrophobicContact CB-CB 3.9Å; D438-R441 PolarHBondContact O-N 2.93Å; D438-R441 VanDerWaalsContact OD2-CB 3.3Å; D438-R441 WeakPolarHBondContact OD2-CB 3.21Å; D438-R441 PolarHBondContact OD2-N 2.84Å; R441-R443 VanDerWaalsContact C-N 3.32Å; R441-R443 PolarHBondContact O-N 3.32Å; R441-K444 CarbonylContact O-C 3.6Å; R441-K444 WeakPolarHBondContact O-CA 3.2Å; R441-K444 WeakPolarHBondContact O-CB 3.34Å; R441-K444 PolarHBondContact O-N 2.87Å; R441-I445 PolarHBondContact O-N 2.83Å; R441-I445 VanDerWaalsContact O-N 3.17Å
442	W	60.7	Low	61.7	Low	43 Å²	43	124.2 Å²	124.2	16%	0.163	61%	0.611	C	S	.	*	H	α-helix	trans	-61.6	-36.8	178.6	-170.1	-103.2	0	0	0	112.9	D427 L431 W437 D438 K444 I445	D427-W442 HydrophobicContact CB-CH2 4.26Å; L431-W442 HydrophobicContact CD1-CD2 4.48Å; L431-W442 HydrophobicContact CD1-CE3 3.37Å; L431-W442 HydrophobicContact CD1-CZ3 3.41Å; L431-W442 VanDerWaalsContact CD1-CZ3 3.41Å; W437-W442 HydrophobicContact CH2-CD2 4.2Å; W437-W442 HydrophobicContact CH2-CG 4.03Å; W437-W442 HydrophobicContact CZ3-CD2 4.16Å; W437-W442 HydrophobicContact CZ3-CE3 4.35Å; W437-W442 HydrophobicContact CZ3-CG 4.36Å; D438-W442 PolarHBondContact O-N 2.95Å; W442-K444 VanDerWaalsContact C-N 3.25Å; W442-K444 PolarHBondContact O-N 3.05Å; W442-I445 HydrophobicContact CD2-CD1 4.24Å; W442-I445 HydrophobicContact CE3-CD1 3.46Å; W442-I445 VanDerWaalsContact CE3-CD1 3.46Å; W442-I445 HydrophobicContact CZ3-CD1 3.78Å; W442-I445 PolarHBondContact O-N 2.87Å
443	R	56.7	Low	59.1	Low	210 Å²	210	131 Å²	131	79%	0.792	64%	0.641	S	S	*	*	H	α-helix	trans	-64.9	-26.4	172	-71	177.1	-166.7	-171.4	4.4	113.4	K439 R440 R441	K439-R443 WeakPolarHBondContact O-CG 3.33Å; R440-R443 PolarHBondContact O-N 3.42Å; R441-R443 VanDerWaalsContact C-N 3.32Å; R441-R443 PolarHBondContact O-N 3.32Å
444	K	53.9	Low	56.9	Low	177 Å²	177	136.5 Å²	136.5	77%	0.77	65%	0.654	S	S	*	*	H	α-helix	trans	-89.8	-9.6	-179.7	-69.9	-177	176.5	-171.5	0	113.9	R440 R441 W442 P446	R440-K444 PolarHBondContact O-N 3.36Å; R441-K444 CarbonylContact O-C 3.6Å; R441-K444 WeakPolarHBondContact O-CA 3.2Å; R441-K444 WeakPolarHBondContact O-CB 3.34Å; R441-K444 PolarHBondContact O-N 2.87Å; W442-K444 VanDerWaalsContact C-N 3.25Å; W442-K444 PolarHBondContact O-N 3.05Å; K444-P446 WeakPolarHBondContact O-CD 3.3Å
445	I	58.2	Low	54.4	Low	82 Å²	82	137.6 Å²	137.6	42%	0.421	67%	0.665	S	S	.	*	S	Bend	trans	-66.5	125.8	174.2	-67.2	174.9	0	0	0	108.7	R441 W442 K447	R441-I445 PolarHBondContact O-N 2.83Å; R441-I445 VanDerWaalsContact O-N 3.17Å; W442-I445 HydrophobicContact CD2-CD1 4.24Å; W442-I445 HydrophobicContact CE3-CD1 3.46Å; W442-I445 VanDerWaalsContact CE3-CD1 3.46Å; W442-I445 HydrophobicContact CZ3-CD1 3.78Å; W442-I445 PolarHBondContact O-N 2.87Å; I445-K447 PolarHBondContact O-N 3.12Å
446	P	44.7	Very low	52.6	Low	117 Å²	117	137.5 Å²	137.5	76%	0.76	66%	0.663	S	S	*	*			trans	-62.7	101.5	178.5	-24.8	35.6	0	0	0	112	K444 R448	K444-P446 WeakPolarHBondContact O-CD 3.3Å; P446-R448 PolarHBondContact O-N 3.42Å
447	K	55.7	Low	50.2	Low	132 Å²	132	134 Å²	134	57%	0.574	67%	0.665	S	S	*	*			trans	-64	107.3	168.8	-56.2	-170.3	-173.6	-163.2	0	107.5	E55 I445 P449	E55-K447 WeakPolarHBondContact OE1-CD 3.3Å; E55-K447 WeakPolarHBondContact OE1-CE 3.42Å; E55-K447 IonicContact OE1-NZ 2.75Å; E55-K447 PolarHBondContact OE1-NZ 2.98Å; I445-K447 PolarHBondContact O-N 3.12Å; K447-P449 WeakPolarHBondContact O-CD 3.41Å; K447-P449 VanDerWaalsContact O-N 3.07Å
448	R	38.8	Very low	48.4	Very low	240 Å²	240	143.4 Å²	143.4	91%	0.906	70%	0.701	S	S	*	*			trans	-45.3	116.9	-174.7	-77.2	-171.9	174.2	-166.6	-2.5	110.5	P446 G450	P446-R448 PolarHBondContact O-N 3.42Å; R448-G450 PolarHBondContact O-N 3.09Å
449	P	44.6	Very low	46.7	Very low	113 Å²	113	148.2 Å²	148.2	73%	0.734	72%	0.721	S	S	*	*			trans	-70.2	103.5	-171.8	25.5	-33.5	0	0	0	111	K447 S451	K447-P449 WeakPolarHBondContact O-CD 3.41Å; K447-P449 VanDerWaalsContact O-N 3.07Å; P449-S451 PolarHBondContact O-N 3.47Å
450	G	46.9	Very low	45.5	Very low	89 Å²	89	151.7 Å²	151.7	92%	0.918	76%	0.76	S	S	*	*			trans	-82.8	14.8	168.1	0	0	0	0	0	113.5	R448	R448-G450 PolarHBondContact O-N 3.09Å
451	S	38.9	Very low	44.9	Very low	75 Å²	75	149.3 Å²	149.3	52%	0.524	76%	0.76	S	S	.	*	S	Bend	trans	-143.7	120.5	-174.3	53.1	0	0	0	0	109.3	P449 H453	P449-S451 PolarHBondContact O-N 3.47Å; S451-H453 PolarHBondContact O-N 3.32Å; S451-H453 VanDerWaalsContact O-N 3.15Å
452	V	39.5	Very low	44.2	Very low	142 Å²	142	147.3 Å²	147.3	86%	0.861	76%	0.763	S	S	*	*			trans	-64.2	112.4	173.6	178.4	0	0	0	0	108.6
453	H	33.9	Very low	43.3	Very low	172 Å²	172	153.1 Å²	153.1	80%	0.796	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-73.7	124.6	159.8	-86.9	8.6	0	0	0	108.3	S451	S451-H453 PolarHBondContact O-N 3.32Å; S451-H453 VanDerWaalsContact O-N 3.15Å
454	R	40.6	Very low	42.5	Very low	235 Å²	235	149.7 Å²	149.7	89%	0.887	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-65.9	130.4	163.3	-72.6	178.1	170.9	176.3	-4.9	107.6
455	T	38	Very low	41.8	Very low	128 Å²	128	148 Å²	148	79%	0.785	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-64.2	132.7	160.9	35.5	0	0	0	0	108.9	S457	T455-S457 PolarHBondContact O-N 3.21Å
456	P	44.4	Very low	40.7	Very low	118 Å²	118	152.4 Å²	152.4	77%	0.766	82%	0.823	S	S	*	*			trans	-75	110.6	162	29.9	-29.1	0	0	0	107.8	R458	P456-R458 PolarHBondContact O-N 3.21Å
457	S	34.1	Very low	40.4	Very low	102 Å²	102	154.9 Å²	154.9	71%	0.713	83%	0.827	S	S	*	*			trans	-66.7	110.8	167.4	47.8	0	0	0	0	109	T455 Q459	T455-S457 PolarHBondContact O-N 3.21Å; S457-Q459 PolarHBondContact O-N 3.12Å
458	R	38	Very low	39.2	Very low	244 Å²	244	156.7 Å²	156.7	92%	0.921	85%	0.847	S	S	*	*			trans	-73.9	119.5	161.7	-78.9	-170.7	171.8	-166.5	-3.7	108.5	P456	P456-R458 PolarHBondContact O-N 3.21Å
459	Q	36.5	Very low	39.3	Very low	173 Å²	173	149.8 Å²	149.8	81%	0.808	84%	0.842	S	S	*	*			trans	-127.9	151.7	158.3	-74.5	-176.8	-67.5	0	0	106.1	S457	S457-Q459 PolarHBondContact O-N 3.12Å
460	C	35.6	Very low	38.8	Very low	206 Å²	206	153.1 Å²	153.1	100%	1.392	85%	0.852	S	S	*	*			trans	66.9	0	-158.7	-55.9	0	0	0	0	111.6

Retrieved 460 of 460 residues in 188.1 ms (Link to these results)

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