A0A5K4F2G9_SCHMA Loading...

CDK5RAP3-like protein

AlphaFold DB , UniProt , Accession A0A5K4F2G9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 560 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	32.8	Very low	55	Low	234 Å²	234	140.5 Å²	140.5	100%	1.153	69%	0.694	S	S	*	*				0	57.8	0	-64.1	175	87.4	0	0	110.6
2	K	42.8	Very low	57.5	Low	187 Å²	187	131.3 Å²	131.3	81%	0.813	65%	0.649	S	S	*	*			trans	-127.3	8.3	179.2	-99.7	-172.2	178	-177.5	0	114.5
3	D	47.1	Very low	59.7	Low	143 Å²	143	129.5 Å²	129.5	77%	0.765	64%	0.642	S	S	*	*	S	Bend	trans	-110.4	8.9	-173.2	-65.9	-33.8	0	0	0	114.8
4	T	47.6	Very low	61.6	Low	100 Å²	100	120.4 Å²	120.4	61%	0.613	60%	0.597	S	S	*	*	S	Bend	trans	-106.5	-17	178.4	41.6	0	0	0	0	115
5	D	50.1	Low	63.3	Low	126 Å²	126	118.5 Å²	118.5	67%	0.674	59%	0.586	S	S	*	*	S	Bend	trans	-85.5	-16.7	-173.4	-71.3	-22.9	0	0	0	114.2
6	Q	49	Very low	64.6	Low	133 Å²	133	111.1 Å²	111.1	62%	0.621	55%	0.55	S	S	*	.	G	3₁₀ helix	trans	-77	-20.1	178.2	-70.9	-177.2	-15.2	0	0	113.3	R8	Q6-R8 PolarHBondContact O-N 2.87Å
7	Q	50.8	Low	65.9	Low	173 Å²	173	108.5 Å²	108.5	81%	0.808	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-74.5	-6.2	177.9	-72.8	-177	-11.3	0	0	114.3
8	R	55.7	Low	67.2	Low	226 Å²	226	112.7 Å²	112.7	85%	0.853	55%	0.553	S	S	*	*	G	3₁₀ helix	trans	-104.7	0.7	-179.8	-71.7	-169.6	-177.3	-171.5	2.3	115.4	Q6	Q6-R8 PolarHBondContact O-N 2.87Å
9	L	70.7	Confident	68.4	Low	95 Å²	95	106.8 Å²	106.8	50%	0.497	52%	0.524	S	S	.	.	S	Bend	trans	-76	134.3	177.4	-70.6	169.2	0	0	0	110.2
10	P	77.6	Confident	69.5	Low	86 Å²	86	102.6 Å²	102.6	56%	0.558	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-59.6	150.8	178.3	23.5	-32.1	0	0	0	110.8	R549	P10-R549 PolarHBondContact O-NE 3.4Å; P10-R549 PolarHBondContact O-NH2 2.94Å
11	P	81	Confident	70.5	Confident	42 Å²	42	99.7 Å²	99.7	27%	0.273	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-61.6	146.3	179.7	25.4	-33.4	0	0	0	111.3	L13 Q550 Q552	P11-L13 PolarHBondContact O-N 2.8Å; P11-Q550 CarbonylContact C-O 3.51Å; P11-Q550 VanDerWaalsContact CA-O 3.26Å; P11-Q550 WeakPolarHBondContact CA-O 3.05Å; P11-Q550 HydrophobicContact CB-CB 4.34Å; P11-Q550 HydrophobicContact CB-CG 4.2Å; P11-Q552 HydrophobicContact CB-CB 4.39Å; P11-Q552 HydrophobicContact CB-CG 4.01Å
12	L	84.6	Confident	73.3	Confident	30 Å²	30	90.4 Å²	90.4	16%	0.157	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	112	170.4	-78	166	0	0	0	108.6	Y547 R549 Q550 V551 Q552	L12-Y547 HydrophobicContact CD1-CG 4.41Å; L12-R549 HydrophobicContact CD1-CB 4.48Å; L12-R549 HydrophobicContact CD1-CG 4.29Å; L12-R549 HydrophobicContact CG-CG 4.41Å; L12-Q550 PolarHBondContact N-O 3.29Å; L12-V551 HydrophobicContact CB-CG2 4.1Å; L12-V551 HydrophobicContact CD1-CG2 4.21Å; L12-V551 WeakPolarHBondContact O-CA 3.23Å; L12-Q552 PolarHBondContact O-N 3.26Å
13	L	86.2	Confident	75.6	Confident	108 Å²	108	81.5 Å²	81.5	57%	0.565	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.4	123.4	179	-59.4	173.9	0	0	0	110.5	P11 Q552 T554	P11-L13 PolarHBondContact O-N 2.8Å; L13-Q552 CarbonylContact C-O 3.24Å; L13-Q552 VanDerWaalsContact CA-O 3.32Å; L13-Q552 WeakPolarHBondContact CA-O 2.99Å; L13-Q552 HydrophobicContact CD2-CB 3.92Å; L13-T554 HydrophobicContact CD2-CG2 3.91Å
14	I	87.1	Confident	77.7	Confident	2 Å²	2	77.3 Å²	77.3	1%	0.01	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	125.1	176.4	-57.6	176.9	0	0	0	108.5	S16 I19 W22 L543 V551 Q552 I553 T554	I14-S16 PolarHBondContact O-N 2.75Å; I14-I19 HydrophobicContact CG2-CG1 4.14Å; I14-W22 HydrophobicContact CD1-CD2 3.67Å; I14-W22 HydrophobicContact CD1-CE3 3.7Å; I14-W22 HydrophobicContact CD1-CG 4.33Å; I14-W22 HydrophobicContact CD1-CH2 3.73Å; I14-W22 HydrophobicContact CD1-CZ2 3.76Å; I14-W22 HydrophobicContact CD1-CZ3 3.72Å; I14-W22 HydrophobicContact CG1-CD2 4.09Å; I14-W22 HydrophobicContact CG1-CG 4.33Å; I14-W22 HydrophobicContact CG1-CZ2 4.22Å; I14-W22 HydrophobicContact CG2-CB 4.23Å; I14-W22 HydrophobicContact CG2-CG 4.21Å; I14-L543 HydrophobicContact CD1-CD1 3.55Å; I14-V551 HydrophobicContact CD1-CG1 3.41Å; I14-V551 VanDerWaalsContact CD1-CG1 3.41Å; I14-V551 HydrophobicContact CG1-CG1 3.99Å; I14-Q552 PolarHBondContact N-O 2.91Å; I14-I553 CarbonylContact O-C 3.52Å; I14-I553 WeakPolarHBondContact O-CA 3.36Å; I14-T554 PolarHBondContact O-N 3.24Å; I14-T554 PolarHBondContact O-OG1 3.4Å
15	Q	86.2	Confident	79.7	Confident	93 Å²	93	76.6 Å²	76.6	44%	0.435	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	129.7	172.4	-66.3	-73	-51	0	0	109.7	S17 R18 I19 T554	Q15-S17 PolarHBondContact O-N 2.91Å; Q15-R18 HydrophobicContact CB-CB 4.31Å; Q15-R18 HydrophobicContact CB-CG 4.39Å; Q15-R18 CarbonylContact O-C 3.56Å; Q15-R18 WeakPolarHBondContact O-CA 3.35Å; Q15-R18 PolarHBondContact O-N 2.82Å; Q15-I19 PolarHBondContact O-N 3.47Å; Q15-T554 CarbonylContact C-O 3.28Å; Q15-T554 WeakPolarHBondContact CA-O 3.35Å; Q15-T554 PolarHBondContact NE2-OG1 3.04Å
16	S	84.5	Confident	81.5	Confident	0 Å²	0	76.1 Å²	76.1	0%	0	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-48.1	-53	179.3	37.2	0	0	0	0	112.6	I14 R18 I19 N117 T554 Q556	I14-S16 PolarHBondContact O-N 2.75Å; S16-R18 PolarHBondContact O-N 3.01Å; S16-I19 WeakPolarHBondContact O-CD1 3.05Å; S16-I19 WeakPolarHBondContact O-CG1 3.48Å; S16-I19 PolarHBondContact O-N 2.72Å; S16-N117 PolarHBondContact O-OD1 2.81Å; S16-T554 PolarHBondContact N-O 2.93Å; S16-T554 PolarHBondContact OG-O 2.84Å; S16-T554 VanDerWaalsContact OG-O 3.09Å; S16-Q556 PolarHBondContact OG-N 2.92Å; S16-Q556 VanDerWaalsContact OG-N 3.11Å
17	S	86.1	Confident	83.3	Confident	67 Å²	67	78.8 Å²	78.8	47%	0.469	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-59.8	-12.7	177.3	60.3	0	0	0	0	115	Q15	Q15-S17 PolarHBondContact O-N 2.91Å
18	R	89.4	Confident	85.1	Confident	184 Å²	184	71.4 Å²	71.4	69%	0.694	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-116.6	11.9	-179.1	-60	-171.9	179.8	-174.9	0.6	113.4	Q15 S16 I20 G21 W22	Q15-R18 HydrophobicContact CB-CB 4.31Å; Q15-R18 HydrophobicContact CB-CG 4.39Å; Q15-R18 CarbonylContact O-C 3.56Å; Q15-R18 WeakPolarHBondContact O-CA 3.35Å; Q15-R18 PolarHBondContact O-N 2.82Å; S16-R18 PolarHBondContact O-N 3.01Å; R18-I20 PolarHBondContact O-N 2.97Å; R18-G21 PolarHBondContact O-N 2.74Å; R18-W22 WeakPolarHBondContact O-CB 3.16Å; R18-W22 PolarHBondContact O-N 2.95Å
19	I	90.4	Very high	86.7	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-51.4	-54.7	179.9	-71.4	161.5	0	0	0	110.8	I14 Q15 S16 G21 W22 L23 I116 L539 I553	I14-I19 HydrophobicContact CG2-CG1 4.14Å; Q15-I19 PolarHBondContact O-N 3.47Å; S16-I19 WeakPolarHBondContact O-CD1 3.05Å; S16-I19 WeakPolarHBondContact O-CG1 3.48Å; S16-I19 PolarHBondContact O-N 2.72Å; I19-G21 PolarHBondContact O-N 3.44Å; I19-W22 WeakPolarHBondContact O-CB 3.07Å; I19-W22 PolarHBondContact O-N 3.14Å; I19-W22 VanDerWaalsContact O-N 3.16Å; I19-L23 HydrophobicContact CG2-CD1 3.99Å; I19-L23 HydrophobicContact CG2-CG 4.35Å; I19-L23 VanDerWaalsContact O-CG 3.31Å; I19-L23 WeakPolarHBondContact O-CG 3.34Å; I19-L23 PolarHBondContact O-N 3.43Å; I19-I116 HydrophobicContact CD1-CB 4.44Å; I19-I116 HydrophobicContact CD1-CD1 4.28Å; I19-I116 HydrophobicContact CD1-CG2 4.12Å; I19-L539 HydrophobicContact CG2-CD1 4.14Å; I19-L539 HydrophobicContact CG2-CD2 4.47Å; I19-I553 HydrophobicContact CD1-CD1 4.27Å; I19-I553 HydrophobicContact CD1-CG2 4.22Å
20	I	91.5	Very high	87.6	Confident	21 Å²	21	61.1 Å²	61.1	11%	0.108	31%	0.314	C	S	.	.	H	α-helix	trans	-60.6	-46.8	-178.9	-57.3	-55.5	0	0	0	112.1	R18 W22 L23 L24 I29 Y33 A110 D114	R18-I20 PolarHBondContact O-N 2.97Å; I20-W22 VanDerWaalsContact C-N 3.25Å; I20-W22 PolarHBondContact O-N 3.15Å; I20-L23 HydrophobicContact CD1-CD1 4.43Å; I20-L23 PolarHBondContact O-N 2.79Å; I20-L24 HydrophobicContact CG2-CD1 4.06Å; I20-L24 WeakPolarHBondContact O-CG 3.25Å; I20-L24 PolarHBondContact O-N 3.02Å; I20-I29 HydrophobicContact CG2-CD1 4.38Å; I20-Y33 HydrophobicContact CG2-CE1 3.68Å; I20-Y33 WeakPolarHBondContact CG2-OH 3.43Å; I20-A110 HydrophobicContact CD1-CB 4.24Å; I20-A110 WeakPolarHBondContact CD1-O 3.36Å; I20-D114 WeakPolarHBondContact CD1-OD1 3.33Å; I20-D114 VanDerWaalsContact CG1-OD1 3.24Å; I20-D114 WeakPolarHBondContact CG1-OD1 3.49Å
21	G	89.8	Confident	88.2	Confident	43 Å²	43	63 Å²	63	44%	0.443	32%	0.324	S	S	.	.	H	α-helix	trans	-60.8	-37.5	178	0	0	0	0	0	112.1	R18 I19 S25	R18-G21 PolarHBondContact O-N 2.74Å; I19-G21 PolarHBondContact O-N 3.44Å; G21-S25 WeakPolarHBondContact O-CB 3.39Å; G21-S25 PolarHBondContact O-N 2.71Å; G21-S25 PolarHBondContact O-OG 2.94Å
22	W	90.9	Very high	88.7	Confident	38 Å²	38	64 Å²	64	14%	0.144	33%	0.327	C	S	.	.	H	α-helix	trans	-66.5	-46.8	175.3	-171.5	94.7	0	0	0	111.5	I14 R18 I19 I20 L24 S25 R26 I28 L543 Y547	I14-W22 HydrophobicContact CD1-CD2 3.67Å; I14-W22 HydrophobicContact CD1-CE3 3.7Å; I14-W22 HydrophobicContact CD1-CG 4.33Å; I14-W22 HydrophobicContact CD1-CH2 3.73Å; I14-W22 HydrophobicContact CD1-CZ2 3.76Å; I14-W22 HydrophobicContact CD1-CZ3 3.72Å; I14-W22 HydrophobicContact CG1-CD2 4.09Å; I14-W22 HydrophobicContact CG1-CG 4.33Å; I14-W22 HydrophobicContact CG1-CZ2 4.22Å; I14-W22 HydrophobicContact CG2-CB 4.23Å; I14-W22 HydrophobicContact CG2-CG 4.21Å; R18-W22 WeakPolarHBondContact O-CB 3.16Å; R18-W22 PolarHBondContact O-N 2.95Å; I19-W22 WeakPolarHBondContact O-CB 3.07Å; I19-W22 PolarHBondContact O-N 3.14Å; I19-W22 VanDerWaalsContact O-N 3.16Å; I20-W22 VanDerWaalsContact C-N 3.25Å; I20-W22 PolarHBondContact O-N 3.15Å; W22-L24 VanDerWaalsContact C-N 3.32Å; W22-L24 PolarHBondContact O-N 3.48Å; W22-S25 PolarHBondContact O-N 2.84Å; W22-S25 PolarHBondContact O-OG 3.39Å; W22-R26 HydrophobicContact CD2-CG 4.31Å; W22-R26 HydrophobicContact CZ2-CG 4.3Å; W22-R26 PolarHBondContact O-N 3.45Å; W22-R26 VanDerWaalsContact O-N 3.14Å; W22-I28 HydrophobicContact CE3-CD1 4.13Å; W22-I28 HydrophobicContact CH2-CD1 4.22Å; W22-I28 HydrophobicContact CZ3-CD1 3.49Å; W22-I28 VanDerWaalsContact CZ3-CD1 3.49Å; W22-L543 HydrophobicContact CH2-CD1 4.44Å; W22-L543 HydrophobicContact CZ3-CD1 3.9Å; W22-L543 HydrophobicContact CZ3-CD2 4.02Å; W22-Y547 AromaticContact CH2-CD2 3.92Å; W22-Y547 HydrophobicContact CH2-CD2 3.92Å; W22-Y547 AromaticContact CH2-CE2 3.27Å; W22-Y547 HydrophobicContact CH2-CE2 3.27Å; W22-Y547 AromaticContact CH2-CZ 3.82Å; W22-Y547 HydrophobicContact CZ2-CE2 4.22Å; W22-Y547 AromaticContact CZ3-CE2 3.88Å; W22-Y547 HydrophobicContact CZ3-CE2 3.88Å
23	L	91.2	Very high	89.1	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-58.4	-41.9	176.7	-66.3	174.5	0	0	0	112	I19 I20 K27 I28 I29 L109 L543	I19-L23 HydrophobicContact CG2-CD1 3.99Å; I19-L23 HydrophobicContact CG2-CG 4.35Å; I19-L23 VanDerWaalsContact O-CG 3.31Å; I19-L23 WeakPolarHBondContact O-CG 3.34Å; I19-L23 PolarHBondContact O-N 3.43Å; I20-L23 HydrophobicContact CD1-CD1 4.43Å; I20-L23 PolarHBondContact O-N 2.79Å; L23-K27 PolarHBondContact O-N 2.88Å; L23-I28 HydrophobicContact CD2-CB 4.23Å; L23-I28 HydrophobicContact CD2-CD1 3.75Å; L23-I28 HydrophobicContact CD2-CG2 4.09Å; L23-I28 PolarHBondContact O-N 3.41Å; L23-I29 HydrophobicContact CB-CD1 3.6Å; L23-I29 HydrophobicContact CB-CG1 3.74Å; L23-I29 HydrophobicContact CB-CG2 4.41Å; L23-I29 HydrophobicContact CD1-CD1 4.06Å; L23-L109 HydrophobicContact CD1-CB 4.08Å; L23-L109 HydrophobicContact CD2-CB 4.44Å; L23-L109 HydrophobicContact CD2-CD1 4.39Å; L23-L543 HydrophobicContact CD2-CD2 3.96Å
24	L	91.3	Very high	89.3	Confident	55 Å²	55	61.4 Å²	61.4	29%	0.288	32%	0.315	S	S	.	.	H	α-helix	trans	-66.5	-46	175.7	-73.9	168.4	0	0	0	112.2	I20 W22 R26 K27 I29 T31 Y33	I20-L24 HydrophobicContact CG2-CD1 4.06Å; I20-L24 WeakPolarHBondContact O-CG 3.25Å; I20-L24 PolarHBondContact O-N 3.02Å; W22-L24 VanDerWaalsContact C-N 3.32Å; W22-L24 PolarHBondContact O-N 3.48Å; L24-R26 PolarHBondContact O-N 3.01Å; L24-K27 PolarHBondContact O-N 2.79Å; L24-I29 HydrophobicContact CD2-CD1 4.23Å; L24-I29 HydrophobicContact CD2-CG1 3.77Å; L24-I29 HydrophobicContact CG-CD1 4.07Å; L24-I29 HydrophobicContact CG-CG1 3.95Å; L24-T31 HydrophobicContact CD2-CG2 4.11Å; L24-Y33 HydrophobicContact CD2-CD1 4.49Å
25	S	89.3	Confident	89.6	Confident	85 Å²	85	68.7 Å²	68.7	59%	0.594	35%	0.347	S	S	*	.	H	α-helix	trans	-60.4	-30.7	-178.9	74.3	0	0	0	0	112.8	G21 W22	G21-S25 WeakPolarHBondContact O-CB 3.39Å; G21-S25 PolarHBondContact O-N 2.71Å; G21-S25 PolarHBondContact O-OG 2.94Å; W22-S25 PolarHBondContact O-N 2.84Å; W22-S25 PolarHBondContact O-OG 3.39Å
26	R	88.1	Confident	89.9	Confident	117 Å²	117	66.2 Å²	66.2	44%	0.442	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	3.3	177.8	-64.3	-59.8	-175.4	98.2	-6.1	113.7	W22 L24 I28 Y547	W22-R26 HydrophobicContact CD2-CG 4.31Å; W22-R26 HydrophobicContact CZ2-CG 4.3Å; W22-R26 PolarHBondContact O-N 3.45Å; W22-R26 VanDerWaalsContact O-N 3.14Å; L24-R26 PolarHBondContact O-N 3.01Å; R26-I28 HydrophobicContact CB-CD1 3.97Å; R26-I28 HydrophobicContact CB-CG1 3.93Å; R26-I28 PolarHBondContact O-N 3.28Å; R26-Y547 VanDerWaalsContact CB-OH 3.29Å; R26-Y547 WeakPolarHBondContact CB-OH 3.45Å; R26-Y547 WeakPolarHBondContact CG-OH 3.35Å
27	K	88.2	Confident	90.2	Very high	188 Å²	188	66.8 Å²	66.8	82%	0.817	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	27.9	-177.5	-55.5	-179.9	178.4	179.6	0	113.6	L23 L24 I29	L23-K27 PolarHBondContact O-N 2.88Å; L24-K27 PolarHBondContact O-N 2.79Å; K27-I29 VanDerWaalsContact C-N 3.31Å
28	I	87.2	Confident	90.6	Very high	18 Å²	18	70.6 Å²	70.6	9%	0.092	35%	0.345	C	S	.	.	S	Bend	trans	-71	-37.6	174.9	-61.5	168.3	0	0	0	109.6	W22 L23 R26 N106 L109 L543 Y547	W22-I28 HydrophobicContact CE3-CD1 4.13Å; W22-I28 HydrophobicContact CH2-CD1 4.22Å; W22-I28 HydrophobicContact CZ3-CD1 3.49Å; W22-I28 VanDerWaalsContact CZ3-CD1 3.49Å; L23-I28 HydrophobicContact CD2-CB 4.23Å; L23-I28 HydrophobicContact CD2-CD1 3.75Å; L23-I28 HydrophobicContact CD2-CG2 4.09Å; L23-I28 PolarHBondContact O-N 3.41Å; R26-I28 HydrophobicContact CB-CD1 3.97Å; R26-I28 HydrophobicContact CB-CG1 3.93Å; R26-I28 PolarHBondContact O-N 3.28Å; I28-N106 HydrophobicContact CG2-CB 4.02Å; I28-N106 PolarHBondContact O-ND2 2.91Å; I28-L109 HydrophobicContact CG2-CD1 3.84Å; I28-L543 HydrophobicContact CD1-CD2 4.34Å; I28-Y547 HydrophobicContact CD1-CE2 3.74Å
29	I	90	Very high	90.7	Very high	5 Å²	5	67.8 Å²	67.8	3%	0.026	34%	0.34	C	S	.	.	S	Bend	trans	-121.8	159.7	173.4	68.5	179.9	0	0	0	109.7	I20 L23 L24 K27 Y33 N106 A110	I20-I29 HydrophobicContact CG2-CD1 4.38Å; L23-I29 HydrophobicContact CB-CD1 3.6Å; L23-I29 HydrophobicContact CB-CG1 3.74Å; L23-I29 HydrophobicContact CB-CG2 4.41Å; L23-I29 HydrophobicContact CD1-CD1 4.06Å; L24-I29 HydrophobicContact CD2-CD1 4.23Å; L24-I29 HydrophobicContact CD2-CG1 3.77Å; L24-I29 HydrophobicContact CG-CD1 4.07Å; L24-I29 HydrophobicContact CG-CG1 3.95Å; K27-I29 VanDerWaalsContact C-N 3.31Å; I29-Y33 HydrophobicContact CD1-CD1 3.93Å; I29-Y33 HydrophobicContact CD1-CE1 4.31Å; I29-Y33 HydrophobicContact CD1-CG 4.16Å; I29-N106 HydrophobicContact CG2-CB 4.39Å; I29-A110 HydrophobicContact CD1-CB 3.83Å; I29-A110 HydrophobicContact CG2-CB 4.34Å
30	Q	90.3	Very high	90.8	Very high	100 Å²	100	68.1 Å²	68.1	47%	0.467	34%	0.342	S	S	.	.			trans	-96.9	160	177.9	-68.2	-179	-25.7	0	0	111.1	D32 Y33	Q30-D32 WeakPolarHBondContact CB-OD1 3.4Å; Q30-D32 PolarHBondContact O-N 3.49Å; Q30-D32 PolarHBondContact OE1-OD1 3.01Å; Q30-Y33 WeakPolarHBondContact O-CB 3.47Å; Q30-Y33 WeakPolarHBondContact O-CD1 3.35Å; Q30-Y33 PolarHBondContact O-N 2.97Å; Q30-Y33 VanDerWaalsContact O-N 3.12Å
31	T	89.3	Confident	90.7	Very high	127 Å²	127	69.8 Å²	69.8	78%	0.779	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-18.2	-179.7	49.6	0	0	0	0	113.8	L24 Y33	L24-T31 HydrophobicContact CD2-CG2 4.11Å; T31-Y33 VanDerWaalsContact C-N 3.32Å
32	D	91.3	Very high	90.8	Very high	62 Å²	62	71.3 Å²	71.3	33%	0.332	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	6.4	176.4	68.9	-15.3	0	0	0	113.6	Q30 P34 K35 K36	Q30-D32 WeakPolarHBondContact CB-OD1 3.4Å; Q30-D32 PolarHBondContact O-N 3.49Å; Q30-D32 PolarHBondContact OE1-OD1 3.01Å; D32-P34 VanDerWaalsContact C-N 3.31Å; D32-K35 PolarHBondContact O-N 3.32Å; D32-K35 VanDerWaalsContact O-N 3.14Å; D32-K36 PolarHBondContact O-N 3.33Å; D32-K36 IonicContact OD1-NZ 3.83Å; D32-K36 PolarHBondContact OD1-NZ 3.05Å; D32-K36 WeakPolarHBondContact OD2-CE 3.46Å; D32-K36 IonicContact OD2-NZ 3.83Å; D32-K36 PolarHBondContact OD2-NZ 3.47Å
33	Y	92.3	Very high	90.7	Very high	28 Å²	28	73.7 Å²	73.7	11%	0.11	37%	0.366	C	S	.	.	H	α-helix	trans	-50.1	-39	178.4	89.7	-91.3	0	0	0	114.4	I20 L24 I29 Q30 T31 K35 K36 L37 A110 D114	I20-Y33 HydrophobicContact CG2-CE1 3.68Å; I20-Y33 WeakPolarHBondContact CG2-OH 3.43Å; L24-Y33 HydrophobicContact CD2-CD1 4.49Å; I29-Y33 HydrophobicContact CD1-CD1 3.93Å; I29-Y33 HydrophobicContact CD1-CE1 4.31Å; I29-Y33 HydrophobicContact CD1-CG 4.16Å; Q30-Y33 WeakPolarHBondContact O-CB 3.47Å; Q30-Y33 WeakPolarHBondContact O-CD1 3.35Å; Q30-Y33 PolarHBondContact O-N 2.97Å; Q30-Y33 VanDerWaalsContact O-N 3.12Å; T31-Y33 VanDerWaalsContact C-N 3.32Å; Y33-K35 VanDerWaalsContact C-N 3.31Å; Y33-K35 PolarHBondContact O-N 3.22Å; Y33-K36 PolarHBondContact O-N 3.35Å; Y33-L37 HydrophobicContact CD2-CD1 3.62Å; Y33-L37 HydrophobicContact CD2-CG 4.25Å; Y33-L37 HydrophobicContact CE2-CD1 3.85Å; Y33-L37 WeakPolarHBondContact O-CG 3.28Å; Y33-L37 PolarHBondContact O-N 3.09Å; Y33-A110 HydrophobicContact CD2-CB 3.47Å; Y33-A110 VanDerWaalsContact CD2-CB 3.47Å; Y33-A110 HydrophobicContact CE2-CB 3.76Å; Y33-A110 HydrophobicContact CG-CB 4.14Å; Y33-D114 WeakPolarHBondContact CE2-OD2 3.33Å; Y33-D114 PolarHBondContact OH-OD2 3.5Å
34	P	91.5	Very high	90.6	Very high	55 Å²	55	73.7 Å²	73.7	36%	0.357	37%	0.366	S	S	.	.	H	α-helix	trans	-68.3	-32.6	-176.5	-18	32.8	0	0	0	112.2	D32 K38	D32-P34 VanDerWaalsContact C-N 3.31Å; P34-K38 WeakPolarHBondContact O-CG 3.13Å; P34-K38 PolarHBondContact O-N 3.15Å; P34-K38 VanDerWaalsContact O-N 3.15Å
35	K	93.4	Very high	90.4	Very high	156 Å²	156	74.7 Å²	74.7	68%	0.678	37%	0.371	S	S	*	.	H	α-helix	trans	-68.7	-44	175.8	-66.6	-175.1	179.9	-178	0	110.3	D32 Y33 K38 E39	D32-K35 PolarHBondContact O-N 3.32Å; D32-K35 VanDerWaalsContact O-N 3.14Å; Y33-K35 VanDerWaalsContact C-N 3.31Å; Y33-K35 PolarHBondContact O-N 3.22Å; K35-K38 PolarHBondContact O-N 2.95Å; K35-E39 WeakPolarHBondContact O-CG 3.33Å; K35-E39 PolarHBondContact O-N 2.7Å; K35-E39 VanDerWaalsContact O-N 3.07Å
36	K	92.1	Very high	90.4	Very high	40 Å²	40	74.7 Å²	74.7	17%	0.174	36%	0.364	C	S	.	.	H	α-helix	trans	-64.8	-38.5	177.4	-67.4	175.2	175.3	151.1	0	112.4	D32 Y33 E39 I40 L107	D32-K36 PolarHBondContact O-N 3.33Å; D32-K36 IonicContact OD1-NZ 3.83Å; D32-K36 PolarHBondContact OD1-NZ 3.05Å; D32-K36 WeakPolarHBondContact OD2-CE 3.46Å; D32-K36 IonicContact OD2-NZ 3.83Å; D32-K36 PolarHBondContact OD2-NZ 3.47Å; Y33-K36 PolarHBondContact O-N 3.35Å; K36-E39 PolarHBondContact O-N 2.6Å; K36-I40 WeakPolarHBondContact O-CG1 3.36Å; K36-I40 PolarHBondContact O-N 2.8Å; K36-I40 VanDerWaalsContact O-N 3.14Å; K36-L107 HydrophobicContact CB-CD1 3.62Å; K36-L107 HydrophobicContact CB-CD2 4.14Å; K36-L107 HydrophobicContact CD-CD1 4.18Å; K36-L107 HydrophobicContact CD-CD2 4.33Å
37	L	91.7	Very high	90.2	Very high	13 Å²	13	69.9 Å²	69.9	7%	0.068	35%	0.349	C	S	.	.	H	α-helix	trans	-62.5	-46.5	174.1	-75.5	-178.9	0	0	0	111.3	Y33 E39 I40 D41 F102 L107 A110 E111	Y33-L37 HydrophobicContact CD2-CD1 3.62Å; Y33-L37 HydrophobicContact CD2-CG 4.25Å; Y33-L37 HydrophobicContact CE2-CD1 3.85Å; Y33-L37 WeakPolarHBondContact O-CG 3.28Å; Y33-L37 PolarHBondContact O-N 3.09Å; L37-E39 VanDerWaalsContact C-N 3.29Å; L37-E39 PolarHBondContact O-N 3.38Å; L37-I40 CarbonylContact O-C 3.35Å; L37-I40 WeakPolarHBondContact O-CA 3.39Å; L37-I40 WeakPolarHBondContact O-CB 3.37Å; L37-I40 PolarHBondContact O-N 2.88Å; L37-D41 VanDerWaalsContact O-CG 3.31Å; L37-D41 PolarHBondContact O-N 3.31Å; L37-F102 HydrophobicContact CD2-CD1 4.34Å; L37-F102 HydrophobicContact CD2-CE1 4.12Å; L37-L107 HydrophobicContact CD2-CB 3.93Å; L37-A110 HydrophobicContact CD1-CB 4.35Å; L37-E111 HydrophobicContact CD1-CB 4.16Å; L37-E111 HydrophobicContact CD2-CB 3.93Å
38	K	92.5	Very high	90.1	Very high	146 Å²	146	62.5 Å²	62.5	64%	0.635	32%	0.319	S	S	*	.	H	α-helix	trans	-58.7	-37.7	175.3	-73.6	-179.6	179.1	-170.7	0	113.5	P34 K35 I40 D41 C42	P34-K38 WeakPolarHBondContact O-CG 3.13Å; P34-K38 PolarHBondContact O-N 3.15Å; P34-K38 VanDerWaalsContact O-N 3.15Å; K35-K38 PolarHBondContact O-N 2.95Å; K38-I40 VanDerWaalsContact C-N 3.31Å; K38-D41 PolarHBondContact O-N 2.83Å; K38-C42 PolarHBondContact O-N 3.25Å; K38-C42 PolarHBondContact O-SG 3.35Å
39	E	93	Very high	90	Very high	125 Å²	125	67.5 Å²	67.5	58%	0.584	35%	0.346	S	S	*	.	H	α-helix	trans	-62.7	-38.7	173.7	-72.4	172.4	-165.2	0	0	111.7	K35 K36 L37 K43	K35-E39 WeakPolarHBondContact O-CG 3.33Å; K35-E39 PolarHBondContact O-N 2.7Å; K35-E39 VanDerWaalsContact O-N 3.07Å; K36-E39 PolarHBondContact O-N 2.6Å; L37-E39 VanDerWaalsContact C-N 3.29Å; L37-E39 PolarHBondContact O-N 3.38Å; E39-K43 WeakPolarHBondContact O-CG 3.04Å; E39-K43 PolarHBondContact O-N 3.4Å; E39-K43 VanDerWaalsContact O-N 3.12Å
40	I	91.1	Very high	89.6	Confident	8 Å²	8	74 Å²	74	4%	0.041	37%	0.374	C	S	.	.	H	α-helix	trans	-69.2	-43.5	176.1	-63.3	166	0	0	0	110.6	K36 L37 K38 C42 K43 V44 I98 F102 L107	K36-I40 WeakPolarHBondContact O-CG1 3.36Å; K36-I40 PolarHBondContact O-N 2.8Å; K36-I40 VanDerWaalsContact O-N 3.14Å; L37-I40 CarbonylContact O-C 3.35Å; L37-I40 WeakPolarHBondContact O-CA 3.39Å; L37-I40 WeakPolarHBondContact O-CB 3.37Å; L37-I40 PolarHBondContact O-N 2.88Å; K38-I40 VanDerWaalsContact C-N 3.31Å; I40-C42 VanDerWaalsContact C-N 3.27Å; I40-C42 PolarHBondContact O-N 2.94Å; I40-K43 WeakPolarHBondContact O-CB 3.38Å; I40-K43 PolarHBondContact O-N 3.3Å; I40-V44 HydrophobicContact CG2-CG2 4.3Å; I40-V44 WeakPolarHBondContact O-CG2 3.35Å; I40-V44 PolarHBondContact O-N 2.64Å; I40-I98 HydrophobicContact CG2-CG2 4.34Å; I40-F102 HydrophobicContact CB-CZ 4.44Å; I40-F102 HydrophobicContact CD1-CD1 4.18Å; I40-F102 HydrophobicContact CD1-CG 4.33Å; I40-F102 HydrophobicContact CG2-CD1 4.3Å; I40-F102 HydrophobicContact CG2-CD2 3.73Å; I40-F102 HydrophobicContact CG2-CE1 3.9Å; I40-F102 HydrophobicContact CG2-CE2 3.29Å; I40-F102 HydrophobicContact CG2-CG 4.21Å; I40-F102 HydrophobicContact CG2-CZ 3.38Å; I40-L107 HydrophobicContact CD1-CD1 3.8Å
41	D	90.2	Very high	89	Confident	57 Å²	57	73.3 Å²	73.3	31%	0.305	37%	0.368	S	S	.	.	H	α-helix	trans	-56.5	-42.9	176.3	-61.3	-24.9	0	0	0	111.4	L37 K38 V44 N45 L64	L37-D41 VanDerWaalsContact O-CG 3.31Å; L37-D41 PolarHBondContact O-N 3.31Å; K38-D41 PolarHBondContact O-N 2.83Å; D41-V44 PolarHBondContact O-N 3.41Å; D41-N45 PolarHBondContact O-N 3.24Å; D41-N45 PolarHBondContact O-ND2 3.37Å; D41-L64 WeakPolarHBondContact OD1-CD2 3.44Å
42	C	91.2	Very high	88.2	Confident	74 Å²	74	72.4 Å²	72.4	50%	0.5	36%	0.364	S	S	.	.	H	α-helix	trans	-62.8	-45.2	175	-64.6	0	0	0	0	111.7	K38 I40 V44 N45 D46	K38-C42 PolarHBondContact O-N 3.25Å; K38-C42 PolarHBondContact O-SG 3.35Å; I40-C42 VanDerWaalsContact C-N 3.27Å; I40-C42 PolarHBondContact O-N 2.94Å; C42-V44 VanDerWaalsContact C-N 3.3Å; C42-V44 PolarHBondContact O-N 3.34Å; C42-N45 PolarHBondContact O-N 2.87Å; C42-D46 WeakPolarHBondContact O-CB 2.96Å; C42-D46 VanDerWaalsContact O-CG 3.27Å; C42-D46 PolarHBondContact O-N 3.13Å
43	K	90.2	Very high	87	Confident	89 Å²	89	78.7 Å²	78.7	39%	0.387	39%	0.391	S	S	.	.	H	α-helix	trans	-60.8	-38	176.2	-74.3	-178.7	180	-168	0	112.6	E39 I40 C47	E39-K43 WeakPolarHBondContact O-CG 3.04Å; E39-K43 PolarHBondContact O-N 3.4Å; E39-K43 VanDerWaalsContact O-N 3.12Å; I40-K43 WeakPolarHBondContact O-CB 3.38Å; I40-K43 PolarHBondContact O-N 3.3Å; K43-C47 WeakPolarHBondContact O-CB 3.47Å; K43-C47 PolarHBondContact O-N 2.96Å; K43-C47 PolarHBondContact O-SG 3.28Å
44	V	88.2	Confident	85.7	Confident	0 Å²	0	79.8 Å²	79.8	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-64.2	-51.1	176.6	172.7	0	0	0	0	109.9	I40 D41 C42 D46 C47 V48 L64 W95 I98	I40-V44 HydrophobicContact CG2-CG2 4.3Å; I40-V44 WeakPolarHBondContact O-CG2 3.35Å; I40-V44 PolarHBondContact O-N 2.64Å; D41-V44 PolarHBondContact O-N 3.41Å; C42-V44 VanDerWaalsContact C-N 3.3Å; C42-V44 PolarHBondContact O-N 3.34Å; V44-D46 VanDerWaalsContact C-N 3.32Å; V44-D46 PolarHBondContact O-N 3.48Å; V44-C47 PolarHBondContact O-N 2.91Å; V44-C47 VanDerWaalsContact O-N 3.08Å; V44-V48 HydrophobicContact CG1-CG2 4.44Å; V44-V48 WeakPolarHBondContact O-CG2 3.42Å; V44-V48 PolarHBondContact O-N 3.14Å; V44-L64 HydrophobicContact CG1-CD1 4.15Å; V44-L64 HydrophobicContact CG2-CD2 4.28Å; V44-W95 HydrophobicContact CG1-CH2 4.04Å; V44-W95 HydrophobicContact CG1-CZ3 4.13Å; V44-I98 HydrophobicContact CG2-CD1 4.26Å; V44-I98 HydrophobicContact CG2-CG2 3.68Å
45	N	88.2	Confident	84.4	Confident	75 Å²	75	86 Å²	86	40%	0.401	43%	0.425	S	S	.	.	H	α-helix	trans	-59.8	-40.8	178.1	-71.2	-31	0	0	0	112.3	D41 C42 C47 V48 N49	D41-N45 PolarHBondContact O-N 3.24Å; D41-N45 PolarHBondContact O-ND2 3.37Å; C42-N45 PolarHBondContact O-N 2.87Å; N45-C47 VanDerWaalsContact C-N 3.32Å; N45-C47 PolarHBondContact O-N 3.2Å; N45-V48 PolarHBondContact O-N 2.84Å; N45-N49 WeakPolarHBondContact O-CB 3.32Å; N45-N49 VanDerWaalsContact O-CG 3.25Å; N45-N49 PolarHBondContact O-N 3.32Å; N45-N49 PolarHBondContact O-ND2 3.47Å
46	D	88.4	Confident	83	Confident	85 Å²	85	79.9 Å²	79.9	46%	0.455	40%	0.401	S	S	.	.	H	α-helix	trans	-61.9	-38.8	174.8	-73.4	-16	0	0	0	112.2	C42 V44 K50	C42-D46 WeakPolarHBondContact O-CB 2.96Å; C42-D46 VanDerWaalsContact O-CG 3.27Å; C42-D46 PolarHBondContact O-N 3.13Å; V44-D46 VanDerWaalsContact C-N 3.32Å; V44-D46 PolarHBondContact O-N 3.48Å; D46-K50 WeakPolarHBondContact O-CB 3.44Å; D46-K50 WeakPolarHBondContact O-CD 3.42Å; D46-K50 WeakPolarHBondContact O-CG 3.35Å; D46-K50 PolarHBondContact O-N 3.41Å; D46-K50 VanDerWaalsContact O-N 3.12Å
47	C	84.6	Confident	81.9	Confident	17 Å²	17	81.3 Å²	81.3	12%	0.115	41%	0.414	C	S	.	.	H	α-helix	trans	-72.3	-38.2	178.2	-70.6	0	0	0	0	112.3	K43 V44 N45 K50 Y51 W95 I98	K43-C47 WeakPolarHBondContact O-CB 3.47Å; K43-C47 PolarHBondContact O-N 2.96Å; K43-C47 PolarHBondContact O-SG 3.28Å; V44-C47 PolarHBondContact O-N 2.91Å; V44-C47 VanDerWaalsContact O-N 3.08Å; N45-C47 VanDerWaalsContact C-N 3.32Å; N45-C47 PolarHBondContact O-N 3.2Å; C47-K50 PolarHBondContact O-N 3.46Å; C47-Y51 WeakPolarHBondContact O-CD2 3.38Å; C47-Y51 PolarHBondContact O-N 2.89Å; C47-W95 HydrophobicContact CB-CZ2 4.24Å; C47-I98 HydrophobicContact CB-CD1 3.98Å
48	V	85.2	Confident	81.2	Confident	32 Å²	32	80.8 Å²	80.8	19%	0.194	41%	0.411	C	S	.	.	H	α-helix	trans	-62.4	-47.6	173.7	173.3	0	0	0	0	110.5	V44 N45 K50 Y51 F59 W95	V44-V48 HydrophobicContact CG1-CG2 4.44Å; V44-V48 WeakPolarHBondContact O-CG2 3.42Å; V44-V48 PolarHBondContact O-N 3.14Å; N45-V48 PolarHBondContact O-N 2.84Å; V48-K50 VanDerWaalsContact C-N 3.28Å; V48-K50 PolarHBondContact O-N 3.35Å; V48-Y51 CarbonylContact O-C 3.5Å; V48-Y51 PolarHBondContact O-N 3.43Å; V48-F59 HydrophobicContact CG1-CE2 4.43Å; V48-F59 HydrophobicContact CG2-CE2 4.22Å; V48-F59 HydrophobicContact CG2-CZ 4.34Å; V48-W95 HydrophobicContact CG2-CH2 3.96Å; V48-W95 HydrophobicContact CG2-CZ2 4.15Å
49	N	84.3	Confident	80.5	Confident	123 Å²	123	79.7 Å²	79.7	66%	0.658	41%	0.407	S	S	*	.	H	α-helix	trans	-64.8	-29.4	179.7	-71.6	-27.6	0	0	0	113.6	N45 Y51	N45-N49 WeakPolarHBondContact O-CB 3.32Å; N45-N49 VanDerWaalsContact O-CG 3.25Å; N45-N49 PolarHBondContact O-N 3.32Å; N45-N49 PolarHBondContact O-ND2 3.47Å; N49-Y51 VanDerWaalsContact C-N 3.31Å
50	K	82.9	Confident	79.7	Confident	141 Å²	141	81.7 Å²	81.7	61%	0.613	42%	0.416	S	S	*	.	H	α-helix	trans	-72.3	-24	177.4	-79.1	168.5	-172.7	171.7	0	113.2	D46 C47 V48	D46-K50 WeakPolarHBondContact O-CB 3.44Å; D46-K50 WeakPolarHBondContact O-CD 3.42Å; D46-K50 WeakPolarHBondContact O-CG 3.35Å; D46-K50 PolarHBondContact O-N 3.41Å; D46-K50 VanDerWaalsContact O-N 3.12Å; C47-K50 PolarHBondContact O-N 3.46Å; V48-K50 VanDerWaalsContact C-N 3.28Å; V48-K50 PolarHBondContact O-N 3.35Å
51	Y	77	Confident	79.3	Confident	87 Å²	87	83.4 Å²	83.4	34%	0.341	43%	0.429	S	S	.	.			trans	-132.8	66.3	-175.6	-56.8	-73.6	0	0	0	111.2	C47 V48 N49 E53 V54 L91	C47-Y51 WeakPolarHBondContact O-CD2 3.38Å; C47-Y51 PolarHBondContact O-N 2.89Å; V48-Y51 CarbonylContact O-C 3.5Å; V48-Y51 PolarHBondContact O-N 3.43Å; N49-Y51 VanDerWaalsContact C-N 3.31Å; Y51-E53 PolarHBondContact O-N 2.71Å; Y51-V54 PolarHBondContact O-N 3.29Å; Y51-L91 HydrophobicContact CD1-CD1 4.1Å; Y51-L91 HydrophobicContact CD2-CD1 4.16Å; Y51-L91 HydrophobicContact CD2-CG 4.46Å; Y51-L91 HydrophobicContact CG-CD1 3.85Å
52	P	73	Confident	79	Confident	107 Å²	107	82.7 Å²	82.7	70%	0.695	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-14.4	-176.7	29.7	-36.2	0	0	0	113.7	V54	P52-V54 PolarHBondContact O-N 3.02Å
53	E	66.1	Low	78.8	Confident	194 Å²	194	79.3 Å²	79.3	91%	0.907	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-14.2	-179.3	-62.4	-176.8	-177.8	0	0	113.7	Y51	Y51-E53 PolarHBondContact O-N 2.71Å
54	V	65.2	Low	78.7	Confident	51 Å²	51	76.4 Å²	76.4	31%	0.309	39%	0.393	S	S	.	.	S	Bend	trans	-98.7	117.3	177.8	-166.3	0	0	0	0	108.3	Y51 P52 V56 F71 L91	Y51-V54 PolarHBondContact O-N 3.29Å; P52-V54 PolarHBondContact O-N 3.02Å; V54-V56 HydrophobicContact CB-CG2 3.96Å; V54-V56 HydrophobicContact CG1-CG2 4.02Å; V54-V56 WeakPolarHBondContact O-CG2 3.34Å; V54-V56 PolarHBondContact O-N 3.38Å; V54-V56 VanDerWaalsContact O-N 3.07Å; V54-F71 HydrophobicContact CB-CZ 4.34Å; V54-F71 HydrophobicContact CG1-CE2 3.64Å; V54-F71 HydrophobicContact CG1-CZ 3.57Å; V54-L91 HydrophobicContact CG2-CD1 4.06Å
55	E	64.8	Low	78.9	Confident	187 Å²	187	76.7 Å²	76.7	87%	0.874	39%	0.394	S	S	*	.			trans	-65.8	109.1	166.7	-76.3	-176.6	174.8	0	0	108	P57	E55-P57 WeakPolarHBondContact O-CD 3.47Å
56	V	64.4	Low	79	Confident	26 Å²	26	75 Å²	75	16%	0.158	39%	0.385	C	S	.	.			trans	-108.3	95.5	-172.6	-176.8	0	0	0	0	109	V54 I58 F71	V54-V56 HydrophobicContact CB-CG2 3.96Å; V54-V56 HydrophobicContact CG1-CG2 4.02Å; V54-V56 WeakPolarHBondContact O-CG2 3.34Å; V54-V56 PolarHBondContact O-N 3.38Å; V54-V56 VanDerWaalsContact O-N 3.07Å; V56-I58 HydrophobicContact CG1-CB 3.74Å; V56-I58 HydrophobicContact CG1-CD1 3.09Å; V56-I58 HydrophobicContact CG1-CG1 3.19Å; V56-I58 PolarHBondContact O-N 3.44Å; V56-F71 HydrophobicContact CB-CE2 4.33Å; V56-F71 HydrophobicContact CB-CZ 4.33Å; V56-F71 HydrophobicContact CG1-CD1 4.09Å; V56-F71 HydrophobicContact CG1-CD2 4.1Å; V56-F71 HydrophobicContact CG1-CE1 4.04Å; V56-F71 HydrophobicContact CG1-CE2 4.11Å; V56-F71 HydrophobicContact CG1-CG 4.09Å; V56-F71 HydrophobicContact CG1-CZ 4.07Å; V56-F71 HydrophobicContact CG2-CE1 4.03Å; V56-F71 HydrophobicContact CG2-CE2 3.85Å; V56-F71 HydrophobicContact CG2-CZ 3.5Å; V56-F71 VanDerWaalsContact CG2-CZ 3.5Å
57	P	68.9	Low	79	Confident	71 Å²	71	71.1 Å²	71.1	46%	0.461	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-75.1	32	177.9	33	-36.6	0	0	0	112.4	E55 F59 E60	E55-P57 WeakPolarHBondContact O-CD 3.47Å; P57-F59 VanDerWaalsContact C-N 3.31Å; P57-F59 PolarHBondContact O-N 2.89Å; P57-E60 HydrophobicContact CB-CG 4.25Å; P57-E60 PolarHBondContact O-N 3.48Å
58	I	75.7	Confident	79.2	Confident	2 Å²	2	70.3 Å²	70.3	1%	0.01	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-63.3	-41.4	177.8	-73.1	173	0	0	0	110.2	V56 E60 S61 L64 F71 W95	V56-I58 HydrophobicContact CG1-CB 3.74Å; V56-I58 HydrophobicContact CG1-CD1 3.09Å; V56-I58 HydrophobicContact CG1-CG1 3.19Å; V56-I58 PolarHBondContact O-N 3.44Å; I58-E60 PolarHBondContact O-N 3.04Å; I58-S61 VanDerWaalsContact O-CB 3.32Å; I58-S61 WeakPolarHBondContact O-CB 3.12Å; I58-S61 PolarHBondContact O-N 3.34Å; I58-S61 VanDerWaalsContact O-N 3.15Å; I58-L64 HydrophobicContact CG2-CD1 3.65Å; I58-F71 HydrophobicContact CD1-CB 3.94Å; I58-F71 HydrophobicContact CD1-CD1 3.77Å; I58-F71 HydrophobicContact CD1-CE1 4.49Å; I58-F71 HydrophobicContact CD1-CG 4.01Å; I58-F71 HydrophobicContact CG1-CB 3.71Å; I58-F71 HydrophobicContact CG1-CD1 4.38Å; I58-F71 HydrophobicContact CG1-CG 4.11Å; I58-W95 HydrophobicContact CD1-CE3 4.12Å; I58-W95 HydrophobicContact CD1-CH2 3.13Å; I58-W95 HydrophobicContact CD1-CZ2 3.85Å; I58-W95 HydrophobicContact CD1-CZ3 3.31Å
59	F	77.7	Confident	79.4	Confident	122 Å²	122	73.3 Å²	73.3	54%	0.535	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-75	-11.4	-176.9	-58.5	-70.2	0	0	0	113.8	V48 P57 S61 L64	V48-F59 HydrophobicContact CG1-CE2 4.43Å; V48-F59 HydrophobicContact CG2-CE2 4.22Å; V48-F59 HydrophobicContact CG2-CZ 4.34Å; P57-F59 VanDerWaalsContact C-N 3.31Å; P57-F59 PolarHBondContact O-N 2.89Å; F59-S61 VanDerWaalsContact C-N 3.29Å; F59-L64 HydrophobicContact CE1-CD1 4.32Å
60	E	76.7	Confident	79.5	Confident	168 Å²	168	69.1 Å²	69.1	79%	0.785	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-79.4	-18.5	171.5	-59.1	-175.2	170	0	0	112	P57 I58	P57-E60 HydrophobicContact CB-CG 4.25Å; P57-E60 PolarHBondContact O-N 3.48Å; I58-E60 PolarHBondContact O-N 3.04Å
61	S	82.3	Confident	79.7	Confident	44 Å²	44	63.4 Å²	63.4	31%	0.308	33%	0.328	S	S	.	.	S	Bend	trans	-74.6	142.6	178	-64.9	0	0	0	0	110.7	I58 F59 S63 G67	I58-S61 VanDerWaalsContact O-CB 3.32Å; I58-S61 WeakPolarHBondContact O-CB 3.12Å; I58-S61 PolarHBondContact O-N 3.34Å; I58-S61 VanDerWaalsContact O-N 3.15Å; F59-S61 VanDerWaalsContact C-N 3.29Å; S61-S63 PolarHBondContact O-N 2.78Å; S61-S63 VanDerWaalsContact O-N 3.13Å; S61-G67 VanDerWaalsContact CB-CA 3.48Å; S61-G67 VanDerWaalsContact OG-CA 3.3Å; S61-G67 WeakPolarHBondContact OG-CA 3.38Å
62	P	83.9	Confident	80.1	Confident	42 Å²	42	60.3 Å²	60.3	27%	0.273	32%	0.318	S	S	.	.	S	Bend	trans	-70.1	-11.3	-176.8	29.7	-36.6	0	0	0	113.9	S115 L119 L535	P62-S115 WeakPolarHBondContact O-CB 3.22Å; P62-L119 HydrophobicContact CB-CD1 4.11Å; P62-L535 HydrophobicContact CB-CD1 4.12Å; P62-L535 HydrophobicContact CB-CD2 4.47Å; P62-L535 HydrophobicContact CB-CG 4.27Å; P62-L535 HydrophobicContact CG-CD2 4.02Å; P62-L535 HydrophobicContact CG-CG 4.16Å
63	S	87.9	Confident	80.8	Confident	2 Å²	2	59.6 Å²	59.6	1%	0.014	31%	0.305	C	S	.	.	S	Bend	trans	-138	142	170.6	72	0	0	0	0	110	S61 F65 L66 G67 E111	S61-S63 PolarHBondContact O-N 2.78Å; S61-S63 VanDerWaalsContact O-N 3.13Å; S63-F65 VanDerWaalsContact C-N 3.25Å; S63-F65 PolarHBondContact O-N 2.66Å; S63-L66 PolarHBondContact O-N 2.89Å; S63-L66 WeakPolarHBondContact OG-CB 3.35Å; S63-L66 WeakPolarHBondContact OG-CD1 3.3Å; S63-L66 WeakPolarHBondContact OG-CG 3.3Å; S63-L66 PolarHBondContact OG-N 2.92Å; S63-G67 PolarHBondContact O-N 2.93Å; S63-E111 VanDerWaalsContact CA-OE1 3.3Å; S63-E111 WeakPolarHBondContact CA-OE1 3.27Å; S63-E111 WeakPolarHBondContact CB-OE1 3.38Å; S63-E111 WeakPolarHBondContact CB-OE2 3.45Å
64	L	88	Confident	81.6	Confident	28 Å²	28	55.1 Å²	55.1	15%	0.147	28%	0.284	C	S	.	.	H	α-helix	trans	-64	-38.2	-177.3	-172.5	61.8	0	0	0	110.4	D41 V44 I58 F59 G67 C68 F102 E111	D41-L64 WeakPolarHBondContact OD1-CD2 3.44Å; V44-L64 HydrophobicContact CG1-CD1 4.15Å; V44-L64 HydrophobicContact CG2-CD2 4.28Å; I58-L64 HydrophobicContact CG2-CD1 3.65Å; F59-L64 HydrophobicContact CE1-CD1 4.32Å; L64-G67 PolarHBondContact O-N 3.28Å; L64-C68 WeakPolarHBondContact O-CB 3.35Å; L64-C68 PolarHBondContact O-N 3.5Å; L64-C68 PolarHBondContact O-SG 2.93Å; L64-F102 HydrophobicContact CB-CZ 4.31Å; L64-F102 HydrophobicContact CD2-CZ 3.99Å; L64-F102 HydrophobicContact CG-CZ 4.04Å; L64-E111 PolarHBondContact N-OE1 3.27Å
65	F	91.4	Very high	82.5	Confident	6 Å²	6	53.5 Å²	53.5	3%	0.026	27%	0.274	C	S	.	.	H	α-helix	trans	-61.4	-47.9	176.4	170.5	-103.5	0	0	0	112.5	S63 G67 C68 R69 L99 F102 Y108 E111 F538	S63-F65 VanDerWaalsContact C-N 3.25Å; S63-F65 PolarHBondContact O-N 2.66Å; F65-G67 VanDerWaalsContact C-N 3.33Å; F65-G67 PolarHBondContact O-N 3.42Å; F65-C68 PolarHBondContact O-N 3.49Å; F65-R69 WeakPolarHBondContact O-CB 3.36Å; F65-R69 PolarHBondContact O-N 3.08Å; F65-L99 HydrophobicContact CD2-CD2 3.98Å; F65-L99 HydrophobicContact CE2-CD2 3.93Å; F65-F102 HydrophobicContact CB-CD1 4.22Å; F65-F102 HydrophobicContact CB-CE1 4.29Å; F65-F102 HydrophobicContact CB-CG 4.43Å; F65-F102 HydrophobicContact CD2-CB 3.65Å; F65-F102 HydrophobicContact CD2-CD1 4.32Å; F65-F102 HydrophobicContact CD2-CD2 4.15Å; F65-F102 AromaticContact CD2-CG 3.82Å; F65-F102 HydrophobicContact CD2-CG 3.82Å; F65-F102 HydrophobicContact CE2-CB 4.1Å; F65-Y108 HydrophobicContact CD1-CD2 4.41Å; F65-Y108 HydrophobicContact CE1-CD2 4.05Å; F65-Y108 HydrophobicContact CE1-CG 4.36Å; F65-Y108 HydrophobicContact CE2-CG 4.31Å; F65-Y108 HydrophobicContact CZ-CD2 4.22Å; F65-Y108 HydrophobicContact CZ-CG 4.21Å; F65-E111 VanDerWaalsContact CB-OE2 3.31Å; F65-E111 WeakPolarHBondContact CB-OE2 3.41Å; F65-E111 PolarHBondContact N-OE2 3.15Å; F65-F538 HydrophobicContact CD1-CE1 4.33Å; F65-F538 HydrophobicContact CD1-CZ 4.26Å; F65-F538 HydrophobicContact CE1-CE1 4.08Å; F65-F538 HydrophobicContact CE1-CE2 4.42Å; F65-F538 AromaticContact CE1-CZ 3.59Å; F65-F538 HydrophobicContact CE1-CZ 3.59Å
66	L	90.1	Very high	83.4	Confident	41 Å²	41	48.8 Å²	48.8	22%	0.215	26%	0.257	C	S	.	.	H	α-helix	trans	-69	-34.4	-179.4	-68.3	179.3	0	0	0	111.6	S63 R69 G70 L535 F538	S63-L66 PolarHBondContact O-N 2.89Å; S63-L66 WeakPolarHBondContact OG-CB 3.35Å; S63-L66 WeakPolarHBondContact OG-CD1 3.3Å; S63-L66 WeakPolarHBondContact OG-CG 3.3Å; S63-L66 PolarHBondContact OG-N 2.92Å; L66-R69 PolarHBondContact O-N 3.37Å; L66-G70 PolarHBondContact O-N 3.42Å; L66-L535 HydrophobicContact CD1-CD2 3.4Å; L66-L535 VanDerWaalsContact CD1-CD2 3.4Å; L66-L535 HydrophobicContact CG-CD2 4.48Å; L66-F538 HydrophobicContact CD2-CD1 4.39Å; L66-F538 HydrophobicContact CD2-CD2 4.03Å; L66-F538 HydrophobicContact CD2-CE1 4.34Å; L66-F538 HydrophobicContact CD2-CE2 3.99Å; L66-F538 HydrophobicContact CD2-CG 4.25Å; L66-F538 HydrophobicContact CD2-CZ 4.16Å
67	G	88.5	Confident	84.2	Confident	2 Å²	2	54.5 Å²	54.5	2%	0.021	28%	0.28	C	S	.	.	H	α-helix	trans	-61	-52.3	172	0	0	0	0	0	111.6	S61 S63 L64 F65 R69 G70 F71	S61-G67 VanDerWaalsContact CB-CA 3.48Å; S61-G67 VanDerWaalsContact OG-CA 3.3Å; S61-G67 WeakPolarHBondContact OG-CA 3.38Å; S63-G67 PolarHBondContact O-N 2.93Å; L64-G67 PolarHBondContact O-N 3.28Å; F65-G67 VanDerWaalsContact C-N 3.33Å; F65-G67 PolarHBondContact O-N 3.42Å; G67-R69 PolarHBondContact O-N 3.44Å; G67-G70 PolarHBondContact O-N 2.92Å; G67-F71 WeakPolarHBondContact O-CB 3.15Å; G67-F71 PolarHBondContact O-N 3.03Å
68	C	89.2	Confident	84.6	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-58.1	-38.9	177	-66	0	0	0	0	111.9	L64 F65 L72 W95 L99	L64-C68 WeakPolarHBondContact O-CB 3.35Å; L64-C68 PolarHBondContact O-N 3.5Å; L64-C68 PolarHBondContact O-SG 2.93Å; F65-C68 PolarHBondContact O-N 3.49Å; C68-L72 WeakPolarHBondContact O-CB 3.41Å; C68-L72 PolarHBondContact O-N 3.23Å; C68-W95 HydrophobicContact CB-CE3 4.33Å; C68-W95 HydrophobicContact CB-CZ3 4.3Å; C68-L99 HydrophobicContact CB-CD2 3.68Å; C68-L99 HydrophobicContact CB-CG 4.49Å
69	R	89.3	Confident	84.4	Confident	95 Å²	95	57 Å²	57	36%	0.358	29%	0.292	S	S	.	.	H	α-helix	trans	-67.5	-50.3	178.5	-180	-178.4	169.3	174	0.3	111.7	F65 L66 G67 F71 L72 E73 L99	F65-R69 WeakPolarHBondContact O-CB 3.36Å; F65-R69 PolarHBondContact O-N 3.08Å; L66-R69 PolarHBondContact O-N 3.37Å; G67-R69 PolarHBondContact O-N 3.44Å; R69-F71 VanDerWaalsContact C-N 3.31Å; R69-F71 PolarHBondContact O-N 3.26Å; R69-L72 PolarHBondContact O-N 3.38Å; R69-E73 IonicContact CZ-OE1 3.61Å; R69-E73 IonicContact NE-OE1 3.01Å; R69-E73 PolarHBondContact NE-OE1 3.23Å; R69-E73 IonicContact NH2-OE1 2.81Å; R69-E73 WeakPolarHBondContact O-CG 3.47Å; R69-E73 PolarHBondContact O-N 3.49Å; R69-L99 HydrophobicContact CB-CD1 4.34Å; R69-L99 HydrophobicContact CB-CD2 4.21Å
70	G	86.4	Confident	83.9	Confident	36 Å²	36	58.6 Å²	58.6	37%	0.371	31%	0.307	S	S	.	.	H	α-helix	trans	-61.7	-40.4	178.8	0	0	0	0	0	112	L66 G67 E73 E74	L66-G70 PolarHBondContact O-N 3.42Å; G67-G70 PolarHBondContact O-N 2.92Å; G70-E73 PolarHBondContact O-N 2.93Å; G70-E74 PolarHBondContact O-N 3.33Å
71	F	86.7	Confident	83.3	Confident	20 Å²	20	58.4 Å²	58.4	9%	0.088	30%	0.303	C	S	.	.	H	α-helix	trans	-64.3	-43.8	175.2	-177.8	-118.6	0	0	0	112.4	V54 V56 I58 G67 R69 E73 E74 L75 W95	V54-F71 HydrophobicContact CB-CZ 4.34Å; V54-F71 HydrophobicContact CG1-CE2 3.64Å; V54-F71 HydrophobicContact CG1-CZ 3.57Å; V56-F71 HydrophobicContact CB-CE2 4.33Å; V56-F71 HydrophobicContact CB-CZ 4.33Å; V56-F71 HydrophobicContact CG1-CD1 4.09Å; V56-F71 HydrophobicContact CG1-CD2 4.1Å; V56-F71 HydrophobicContact CG1-CE1 4.04Å; V56-F71 HydrophobicContact CG1-CE2 4.11Å; V56-F71 HydrophobicContact CG1-CG 4.09Å; V56-F71 HydrophobicContact CG1-CZ 4.07Å; V56-F71 HydrophobicContact CG2-CE1 4.03Å; V56-F71 HydrophobicContact CG2-CE2 3.85Å; V56-F71 HydrophobicContact CG2-CZ 3.5Å; V56-F71 VanDerWaalsContact CG2-CZ 3.5Å; I58-F71 HydrophobicContact CD1-CB 3.94Å; I58-F71 HydrophobicContact CD1-CD1 3.77Å; I58-F71 HydrophobicContact CD1-CE1 4.49Å; I58-F71 HydrophobicContact CD1-CG 4.01Å; I58-F71 HydrophobicContact CG1-CB 3.71Å; I58-F71 HydrophobicContact CG1-CD1 4.38Å; I58-F71 HydrophobicContact CG1-CG 4.11Å; G67-F71 WeakPolarHBondContact O-CB 3.15Å; G67-F71 PolarHBondContact O-N 3.03Å; R69-F71 VanDerWaalsContact C-N 3.31Å; R69-F71 PolarHBondContact O-N 3.26Å; F71-E73 VanDerWaalsContact C-N 3.32Å; F71-E73 PolarHBondContact O-N 3.26Å; F71-E74 PolarHBondContact O-N 3.35Å; F71-L75 HydrophobicContact CD1-CD1 3.51Å; F71-L75 HydrophobicContact CD1-CG 4.13Å; F71-L75 HydrophobicContact CD2-CG 4.26Å; F71-L75 HydrophobicContact CE1-CD1 3.27Å; F71-L75 HydrophobicContact CE1-CD2 4.26Å; F71-L75 HydrophobicContact CE1-CG 3.88Å; F71-L75 HydrophobicContact CE2-CD1 4.29Å; F71-L75 HydrophobicContact CE2-CD2 4.05Å; F71-L75 HydrophobicContact CE2-CG 3.98Å; F71-L75 HydrophobicContact CG-CD1 4.17Å; F71-L75 HydrophobicContact CG-CG 4.34Å; F71-L75 HydrophobicContact CZ-CD1 3.69Å; F71-L75 HydrophobicContact CZ-CD2 3.76Å; F71-L75 HydrophobicContact CZ-CG 3.78Å; F71-L75 WeakPolarHBondContact O-CB 3.28Å; F71-L75 VanDerWaalsContact O-CG 3.25Å; F71-L75 WeakPolarHBondContact O-CG 3.34Å; F71-L75 PolarHBondContact O-N 2.95Å; F71-W95 AromaticContact CD1-CD2 3.97Å; F71-W95 HydrophobicContact CD1-CD2 3.97Å; F71-W95 AromaticContact CD1-CE2 3.81Å; F71-W95 HydrophobicContact CD1-CE3 4.43Å; F71-W95 HydrophobicContact CD1-CG 4.3Å; F71-W95 HydrophobicContact CD1-CZ2 4.13Å; F71-W95 AromaticContact CE1-CD1 3.91Å; F71-W95 HydrophobicContact CE1-CD2 4.12Å; F71-W95 AromaticContact CE1-CE2 3.54Å; F71-W95 HydrophobicContact CE1-CG 4.35Å; F71-W95 AromaticContact CE1-CZ2 3.87Å; F71-W95 HydrophobicContact CE1-CZ2 3.87Å; F71-W95 AromaticContact CE1-NE1 3.45Å
72	L	86.3	Confident	82.4	Confident	22 Å²	22	61 Å²	61	12%	0.115	32%	0.318	C	S	.	.	H	α-helix	trans	-60.9	-42.2	174.1	-179.3	68.2	0	0	0	111.8	C68 R69 E74 L75 V76 V92 W95 T96 L99	C68-L72 WeakPolarHBondContact O-CB 3.41Å; C68-L72 PolarHBondContact O-N 3.23Å; R69-L72 PolarHBondContact O-N 3.38Å; L72-E74 VanDerWaalsContact C-N 3.26Å; L72-E74 PolarHBondContact O-N 2.81Å; L72-L75 PolarHBondContact O-N 2.89Å; L72-V76 HydrophobicContact CD1-CG2 4.14Å; L72-V76 HydrophobicContact CG-CG2 4.29Å; L72-V76 WeakPolarHBondContact O-CB 3.21Å; L72-V76 VanDerWaalsContact O-CG2 3.23Å; L72-V76 WeakPolarHBondContact O-CG2 3.35Å; L72-V76 PolarHBondContact O-N 3.41Å; L72-V92 HydrophobicContact CD1-CG1 4Å; L72-W95 HydrophobicContact CD1-CB 3.98Å; L72-T96 HydrophobicContact CD1-CG2 3.85Å; L72-T96 HydrophobicContact CD2-CG2 3.75Å; L72-T96 HydrophobicContact CG-CG2 4.45Å; L72-L99 HydrophobicContact CB-CD1 4.02Å; L72-L99 HydrophobicContact CD2-CD1 3.34Å; L72-L99 HydrophobicContact CD2-CG 4.45Å; L72-L99 HydrophobicContact CG-CD1 4.31Å
73	E	87	Confident	81.5	Confident	93 Å²	93	61.9 Å²	61.9	44%	0.435	32%	0.32	S	S	.	.	H	α-helix	trans	-61.2	-35.5	176.9	-73.3	174.7	-167.9	0	0	111.8	R69 G70 F71 K77	R69-E73 IonicContact CZ-OE1 3.61Å; R69-E73 IonicContact NE-OE1 3.01Å; R69-E73 PolarHBondContact NE-OE1 3.23Å; R69-E73 IonicContact NH2-OE1 2.81Å; R69-E73 WeakPolarHBondContact O-CG 3.47Å; R69-E73 PolarHBondContact O-N 3.49Å; G70-E73 PolarHBondContact O-N 2.93Å; F71-E73 VanDerWaalsContact C-N 3.32Å; F71-E73 PolarHBondContact O-N 3.26Å; E73-K77 WeakPolarHBondContact O-CG 3.14Å; E73-K77 PolarHBondContact O-N 3.05Å
74	E	83.4	Confident	80.5	Confident	99 Å²	99	71.2 Å²	71.2	46%	0.463	36%	0.361	S	S	.	.	H	α-helix	trans	-76.8	-40.9	176.4	-164.4	58	-155.4	0	0	112.8	G70 F71 L72 V76 K77 T78	G70-E74 PolarHBondContact O-N 3.33Å; F71-E74 PolarHBondContact O-N 3.35Å; L72-E74 VanDerWaalsContact C-N 3.26Å; L72-E74 PolarHBondContact O-N 2.81Å; E74-V76 VanDerWaalsContact C-N 3.33Å; E74-V76 PolarHBondContact O-N 3.26Å; E74-K77 PolarHBondContact O-N 3.28Å; E74-K77 IonicContact OE2-NZ 3.99Å; E74-K77 PolarHBondContact OE2-NZ 2.81Å; E74-T78 WeakPolarHBondContact O-CG2 3.31Å; E74-T78 PolarHBondContact O-N 3.19Å; E74-T78 PolarHBondContact O-OG1 2.86Å
75	L	83.4	Confident	79.8	Confident	17 Å²	17	77.5 Å²	77.5	9%	0.089	39%	0.387	C	S	.	.	H	α-helix	trans	-58.3	-45.2	172.8	-75.9	171.8	0	0	0	111.4	F71 L72 K77 T78 D79 L91 V92 W95	F71-L75 HydrophobicContact CD1-CD1 3.51Å; F71-L75 HydrophobicContact CD1-CG 4.13Å; F71-L75 HydrophobicContact CD2-CG 4.26Å; F71-L75 HydrophobicContact CE1-CD1 3.27Å; F71-L75 HydrophobicContact CE1-CD2 4.26Å; F71-L75 HydrophobicContact CE1-CG 3.88Å; F71-L75 HydrophobicContact CE2-CD1 4.29Å; F71-L75 HydrophobicContact CE2-CD2 4.05Å; F71-L75 HydrophobicContact CE2-CG 3.98Å; F71-L75 HydrophobicContact CG-CD1 4.17Å; F71-L75 HydrophobicContact CG-CG 4.34Å; F71-L75 HydrophobicContact CZ-CD1 3.69Å; F71-L75 HydrophobicContact CZ-CD2 3.76Å; F71-L75 HydrophobicContact CZ-CG 3.78Å; F71-L75 WeakPolarHBondContact O-CB 3.28Å; F71-L75 VanDerWaalsContact O-CG 3.25Å; F71-L75 WeakPolarHBondContact O-CG 3.34Å; F71-L75 PolarHBondContact O-N 2.95Å; L72-L75 PolarHBondContact O-N 2.89Å; L75-K77 PolarHBondContact O-N 3.35Å; L75-T78 WeakPolarHBondContact CA-OG1 3.19Å; L75-T78 PolarHBondContact O-N 3.09Å; L75-T78 PolarHBondContact O-OG1 3.16Å; L75-D79 WeakPolarHBondContact O-CA 3.47Å; L75-D79 WeakPolarHBondContact O-CB 3.42Å; L75-D79 PolarHBondContact O-N 3.4Å; L75-L91 HydrophobicContact CD1-CD2 3.24Å; L75-L91 HydrophobicContact CD2-CD2 3.44Å; L75-L91 VanDerWaalsContact CD2-CD2 3.44Å; L75-L91 HydrophobicContact CG-CD2 3.92Å; L75-V92 HydrophobicContact CB-CG2 4.21Å; L75-W95 HydrophobicContact CD1-CG 4.26Å
76	V	84	Confident	78.8	Confident	88 Å²	88	80.1 Å²	80.1	53%	0.533	42%	0.415	S	S	.	.	H	α-helix	trans	-63.4	-30	179.9	169.3	0	0	0	0	112.1	L72 E74 V92	L72-V76 HydrophobicContact CD1-CG2 4.14Å; L72-V76 HydrophobicContact CG-CG2 4.29Å; L72-V76 WeakPolarHBondContact O-CB 3.21Å; L72-V76 VanDerWaalsContact O-CG2 3.23Å; L72-V76 WeakPolarHBondContact O-CG2 3.35Å; L72-V76 PolarHBondContact O-N 3.41Å; E74-V76 VanDerWaalsContact C-N 3.33Å; E74-V76 PolarHBondContact O-N 3.26Å; V76-V92 HydrophobicContact CG2-CG1 4.13Å
77	K	81	Confident	78.2	Confident	147 Å²	147	85.9 Å²	85.9	64%	0.639	43%	0.434	S	S	*	.	H	α-helix	trans	-77.2	-35.6	175.5	-68.5	171.7	-163.8	161.7	0	113.1	E73 E74 L75	E73-K77 WeakPolarHBondContact O-CG 3.14Å; E73-K77 PolarHBondContact O-N 3.05Å; E74-K77 PolarHBondContact O-N 3.28Å; E74-K77 IonicContact OE2-NZ 3.99Å; E74-K77 PolarHBondContact OE2-NZ 2.81Å; L75-K77 PolarHBondContact O-N 3.35Å
78	T	77.9	Confident	77.6	Confident	82 Å²	82	88.7 Å²	88.7	50%	0.503	45%	0.454	S	S	.	.	H	α-helix	trans	-90.3	-23.1	-174.7	51.3	0	0	0	0	112.8	E74 L75 N80	E74-T78 WeakPolarHBondContact O-CG2 3.31Å; E74-T78 PolarHBondContact O-N 3.19Å; E74-T78 PolarHBondContact O-OG1 2.86Å; L75-T78 WeakPolarHBondContact CA-OG1 3.19Å; L75-T78 PolarHBondContact O-N 3.09Å; L75-T78 PolarHBondContact O-OG1 3.16Å; T78-N80 PolarHBondContact O-N 3.09Å; T78-N80 VanDerWaalsContact O-N 3.1Å
79	D	72.1	Confident	77.2	Confident	42 Å²	42	89.3 Å²	89.3	23%	0.225	46%	0.458	C	S	.	.			trans	-76.5	99.1	-175.9	-171.3	17	0	0	0	111.7	L75 K81 S89 V92	L75-D79 WeakPolarHBondContact O-CA 3.47Å; L75-D79 WeakPolarHBondContact O-CB 3.42Å; L75-D79 PolarHBondContact O-N 3.4Å; D79-K81 VanDerWaalsContact C-N 3.31Å; D79-K81 WeakPolarHBondContact OD1-CA 3.38Å; D79-K81 WeakPolarHBondContact OD1-CB 3.29Å; D79-K81 PolarHBondContact OD1-N 3.31Å; D79-S89 WeakPolarHBondContact OD2-CB 3.41Å; D79-S89 PolarHBondContact OD2-OG 3.26Å; D79-V92 HydrophobicContact CB-CG2 4.19Å; D79-V92 VanDerWaalsContact OD2-CG2 3.23Å; D79-V92 WeakPolarHBondContact OD2-CG2 3.46Å
80	N	66.7	Low	76.9	Confident	156 Å²	156	87.7 Å²	87.7	83%	0.834	46%	0.46	S	S	*	.			trans	-86.5	1.4	169.8	-65.3	-31.3	0	0	0	112.8	T78	T78-N80 PolarHBondContact O-N 3.09Å; T78-N80 VanDerWaalsContact O-N 3.1Å
81	K	63.6	Low	76.7	Confident	164 Å²	164	87.2 Å²	87.2	71%	0.713	45%	0.449	S	S	*	.			trans	-100	105.3	-174.6	-62.6	178.8	-178.7	173.6	0	110	D79 S89	D79-K81 VanDerWaalsContact C-N 3.31Å; D79-K81 WeakPolarHBondContact OD1-CA 3.38Å; D79-K81 WeakPolarHBondContact OD1-CB 3.29Å; D79-K81 PolarHBondContact OD1-N 3.31Å; K81-S89 PolarHBondContact O-N 3.38Å
82	T	64.3	Low	76.6	Confident	99 Å²	99	86.5 Å²	86.5	61%	0.607	45%	0.446	S	S	*	.	B	Isolated β-bridge	trans	-99.6	139.5	163.3	52.3	0	0	0	0	109.1	R87	T82-R87 CarbonylContact C-O 3.55Å; T82-R87 VanDerWaalsContact CA-O 3.29Å; T82-R87 WeakPolarHBondContact CA-O 3.24Å
83	D	63.8	Low	76.6	Confident	61 Å²	61	90.2 Å²	90.2	33%	0.326	46%	0.458	S	S	.	.			trans	-62.1	163.8	172	-72.9	-28	0	0	0	110.3	F85 G86 R87 R93	D83-F85 PolarHBondContact O-N 3Å; D83-G86 PolarHBondContact O-N 3.37Å; D83-R87 HydrophobicContact CB-CB 4.48Å; D83-R87 PolarHBondContact N-O 3.04Å; D83-R93 IonicContact OD2-CZ 3.74Å; D83-R93 IonicContact OD2-NE 2.97Å; D83-R93 IonicContact OD2-NH2 2.6Å; D83-R93 PolarHBondContact OD2-NH2 2.98Å
84	F	68	Low	76.6	Confident	197 Å²	197	86.8 Å²	86.8	86%	0.864	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.8	-24.6	177.8	-176.6	-97.6	0	0	0	115
85	F	73.6	Confident	76.8	Confident	161 Å²	161	82.3 Å²	82.3	71%	0.706	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	15.9	177.2	-68.2	-77.6	0	0	0	114.7	D83 R87	D83-F85 PolarHBondContact O-N 3Å; F85-R87 HydrophobicContact CB-CG 4.34Å; F85-R87 PolarHBondContact O-N 3.3Å
86	G	70.5	Confident	77.2	Confident	60 Å²	60	84.5 Å²	84.5	62%	0.619	44%	0.439	S	S	*	.	S	Bend	trans	68.7	17.5	-178.7	0	0	0	0	0	113.9	D83	D83-G86 PolarHBondContact O-N 3.37Å
87	R	76.4	Confident	77.5	Confident	163 Å²	163	85.9 Å²	85.9	62%	0.615	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-84.7	147.9	176.2	-61.7	-178.3	-177.5	-179.4	0.4	109.5	T82 D83 F85	T82-R87 CarbonylContact C-O 3.55Å; T82-R87 VanDerWaalsContact CA-O 3.29Å; T82-R87 WeakPolarHBondContact CA-O 3.24Å; D83-R87 HydrophobicContact CB-CB 4.48Å; D83-R87 PolarHBondContact N-O 3.04Å; F85-R87 HydrophobicContact CB-CG 4.34Å; F85-R87 PolarHBondContact O-N 3.3Å
88	S	76.7	Confident	78	Confident	61 Å²	61	79.1 Å²	79.1	43%	0.427	41%	0.411	S	S	.	.	B	Isolated β-bridge	trans	-55.4	154.4	170.8	-48.3	0	0	0	0	111.1	R93	S88-R93 PolarHBondContact O-NE 2.89Å
89	S	80.9	Confident	78.5	Confident	13 Å²	13	76 Å²	76	9%	0.091	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-52.6	154.9	179.7	66.4	0	0	0	0	112.7	D79 K81 L91 V92 R93	D79-S89 WeakPolarHBondContact OD2-CB 3.41Å; D79-S89 PolarHBondContact OD2-OG 3.26Å; K81-S89 PolarHBondContact O-N 3.38Å; S89-L91 PolarHBondContact O-N 2.98Å; S89-L91 VanDerWaalsContact O-N 3.12Å; S89-V92 PolarHBondContact O-N 3.46Å; S89-V92 WeakPolarHBondContact OG-CG2 3.36Å; S89-V92 PolarHBondContact OG-N 2.96Å; S89-R93 PolarHBondContact O-N 2.99Å
90	P	81.4	Confident	79.5	Confident	60 Å²	60	76.7 Å²	76.7	39%	0.39	40%	0.399	S	S	.	.	H	α-helix	trans	-51.1	-34.8	174.6	-25.5	31.6	0	0	0	113.7	A94	P90-A94 PolarHBondContact O-N 3.19Å
91	L	82.7	Confident	80.6	Confident	27 Å²	27	70.3 Å²	70.3	14%	0.141	37%	0.366	C	S	.	.	H	α-helix	trans	-70.7	-50.3	179.8	-169.8	150	0	0	0	110.9	Y51 V54 L75 S89 R93 A94 W95	Y51-L91 HydrophobicContact CD1-CD1 4.1Å; Y51-L91 HydrophobicContact CD2-CD1 4.16Å; Y51-L91 HydrophobicContact CD2-CG 4.46Å; Y51-L91 HydrophobicContact CG-CD1 3.85Å; V54-L91 HydrophobicContact CG2-CD1 4.06Å; L75-L91 HydrophobicContact CD1-CD2 3.24Å; L75-L91 HydrophobicContact CD2-CD2 3.44Å; L75-L91 VanDerWaalsContact CD2-CD2 3.44Å; L75-L91 HydrophobicContact CG-CD2 3.92Å; S89-L91 PolarHBondContact O-N 2.98Å; S89-L91 VanDerWaalsContact O-N 3.12Å; L91-R93 VanDerWaalsContact C-N 3.27Å; L91-R93 PolarHBondContact O-N 3.36Å; L91-A94 PolarHBondContact O-N 3.49Å; L91-W95 PolarHBondContact O-N 3.26Å; L91-W95 VanDerWaalsContact O-N 3.12Å
92	V	85.1	Confident	82	Confident	5 Å²	5	62.5 Å²	62.5	3%	0.03	33%	0.333	C	S	.	.	H	α-helix	trans	-56.6	-42.7	174.1	171.1	0	0	0	0	110.8	L72 L75 V76 D79 S89 A94 W95 T96	L72-V92 HydrophobicContact CD1-CG1 4Å; L75-V92 HydrophobicContact CB-CG2 4.21Å; V76-V92 HydrophobicContact CG2-CG1 4.13Å; D79-V92 HydrophobicContact CB-CG2 4.19Å; D79-V92 VanDerWaalsContact OD2-CG2 3.23Å; D79-V92 WeakPolarHBondContact OD2-CG2 3.46Å; S89-V92 PolarHBondContact O-N 3.46Å; S89-V92 WeakPolarHBondContact OG-CG2 3.36Å; S89-V92 PolarHBondContact OG-N 2.96Å; V92-A94 PolarHBondContact O-N 2.86Å; V92-W95 PolarHBondContact O-N 3.49Å; V92-T96 HydrophobicContact CG1-CG2 4.21Å; V92-T96 VanDerWaalsContact O-CG2 3.25Å; V92-T96 WeakPolarHBondContact O-CG2 3.48Å; V92-T96 PolarHBondContact O-N 2.83Å; V92-T96 PolarHBondContact O-OG1 3.13Å
93	R	86.8	Confident	83.2	Confident	99 Å²	99	63.2 Å²	63.2	37%	0.374	33%	0.329	S	S	.	.	H	α-helix	trans	-60.8	-46.3	177	-75.7	-174.9	-82.6	106.9	-9.6	112.7	D83 S88 S89 L91 W95 T96 E97	D83-R93 IonicContact OD2-CZ 3.74Å; D83-R93 IonicContact OD2-NE 2.97Å; D83-R93 IonicContact OD2-NH2 2.6Å; D83-R93 PolarHBondContact OD2-NH2 2.98Å; S88-R93 PolarHBondContact O-NE 2.89Å; S89-R93 PolarHBondContact O-N 2.99Å; L91-R93 VanDerWaalsContact C-N 3.27Å; L91-R93 PolarHBondContact O-N 3.36Å; R93-W95 VanDerWaalsContact C-N 3.34Å; R93-W95 PolarHBondContact O-N 2.92Å; R93-T96 WeakPolarHBondContact CA-OG1 3.39Å; R93-T96 PolarHBondContact O-N 2.87Å; R93-T96 PolarHBondContact O-OG1 3.38Å; R93-E97 PolarHBondContact O-N 3.34Å
94	A	87.1	Confident	84.5	Confident	22 Å²	22	67.2 Å²	67.2	18%	0.182	34%	0.343	C	S	.	.	H	α-helix	trans	-58.1	-45.3	177.8	0	0	0	0	0	112	P90 L91 V92 E97 I98	P90-A94 PolarHBondContact O-N 3.19Å; L91-A94 PolarHBondContact O-N 3.49Å; V92-A94 PolarHBondContact O-N 2.86Å; A94-E97 PolarHBondContact O-N 3.36Å; A94-I98 WeakPolarHBondContact O-CG1 3.31Å; A94-I98 PolarHBondContact O-N 2.81Å; A94-I98 VanDerWaalsContact O-N 3.1Å
95	W	87.7	Confident	85.3	Confident	4 Å²	4	60.8 Å²	60.8	2%	0.015	32%	0.318	C	S	.	.	H	α-helix	trans	-71.4	-35.1	178.7	-71.6	104	0	0	0	113.5	V44 C47 V48 I58 C68 F71 L72 L75 L91 V92 R93 E97 I98 L99	V44-W95 HydrophobicContact CG1-CH2 4.04Å; V44-W95 HydrophobicContact CG1-CZ3 4.13Å; C47-W95 HydrophobicContact CB-CZ2 4.24Å; V48-W95 HydrophobicContact CG2-CH2 3.96Å; V48-W95 HydrophobicContact CG2-CZ2 4.15Å; I58-W95 HydrophobicContact CD1-CE3 4.12Å; I58-W95 HydrophobicContact CD1-CH2 3.13Å; I58-W95 HydrophobicContact CD1-CZ2 3.85Å; I58-W95 HydrophobicContact CD1-CZ3 3.31Å; C68-W95 HydrophobicContact CB-CE3 4.33Å; C68-W95 HydrophobicContact CB-CZ3 4.3Å; F71-W95 AromaticContact CD1-CD2 3.97Å; F71-W95 HydrophobicContact CD1-CD2 3.97Å; F71-W95 AromaticContact CD1-CE2 3.81Å; F71-W95 HydrophobicContact CD1-CE3 4.43Å; F71-W95 HydrophobicContact CD1-CG 4.3Å; F71-W95 HydrophobicContact CD1-CZ2 4.13Å; F71-W95 AromaticContact CE1-CD1 3.91Å; F71-W95 HydrophobicContact CE1-CD2 4.12Å; F71-W95 AromaticContact CE1-CE2 3.54Å; F71-W95 HydrophobicContact CE1-CG 4.35Å; F71-W95 AromaticContact CE1-CZ2 3.87Å; F71-W95 HydrophobicContact CE1-CZ2 3.87Å; F71-W95 AromaticContact CE1-NE1 3.45Å; L72-W95 HydrophobicContact CD1-CB 3.98Å; L75-W95 HydrophobicContact CD1-CG 4.26Å; L91-W95 PolarHBondContact O-N 3.26Å; L91-W95 VanDerWaalsContact O-N 3.12Å; V92-W95 PolarHBondContact O-N 3.49Å; R93-W95 VanDerWaalsContact C-N 3.34Å; R93-W95 PolarHBondContact O-N 2.92Å; W95-E97 VanDerWaalsContact C-N 3.29Å; W95-E97 PolarHBondContact O-N 2.92Å; W95-I98 HydrophobicContact CD2-CD1 4.24Å; W95-I98 HydrophobicContact CE3-CD1 3.78Å; W95-I98 HydrophobicContact CZ3-CD1 3.96Å; W95-I98 PolarHBondContact O-N 3.36Å; W95-L99 PolarHBondContact O-N 2.66Å
96	T	90.6	Very high	86.1	Confident	64 Å²	64	55.7 Å²	55.7	39%	0.393	30%	0.298	S	S	.	.	H	α-helix	trans	-61.9	-37.2	171	58.7	0	0	0	0	112.1	L72 V92 R93 L99 S100	L72-T96 HydrophobicContact CD1-CG2 3.85Å; L72-T96 HydrophobicContact CD2-CG2 3.75Å; L72-T96 HydrophobicContact CG-CG2 4.45Å; V92-T96 HydrophobicContact CG1-CG2 4.21Å; V92-T96 VanDerWaalsContact O-CG2 3.25Å; V92-T96 WeakPolarHBondContact O-CG2 3.48Å; V92-T96 PolarHBondContact O-N 2.83Å; V92-T96 PolarHBondContact O-OG1 3.13Å; R93-T96 WeakPolarHBondContact CA-OG1 3.39Å; R93-T96 PolarHBondContact O-N 2.87Å; R93-T96 PolarHBondContact O-OG1 3.38Å; T96-L99 PolarHBondContact O-N 2.93Å; T96-S100 WeakPolarHBondContact O-CB 3.05Å; T96-S100 PolarHBondContact O-N 3.4Å
97	E	91.2	Very high	87.1	Confident	117 Å²	117	53.1 Å²	53.1	55%	0.547	27%	0.271	S	S	.	.	H	α-helix	trans	-68	-40.5	176.9	-170.7	-175.1	158.7	0	0	111.5	R93 A94 W95 S100 S101	R93-E97 PolarHBondContact O-N 3.34Å; A94-E97 PolarHBondContact O-N 3.36Å; W95-E97 VanDerWaalsContact C-N 3.29Å; W95-E97 PolarHBondContact O-N 2.92Å; E97-S100 WeakPolarHBondContact CA-OG 3.2Å; E97-S100 PolarHBondContact O-N 2.91Å; E97-S100 PolarHBondContact O-OG 3.38Å; E97-S101 PolarHBondContact O-N 2.92Å; E97-S101 PolarHBondContact O-OG 2.86Å
98	I	90.3	Very high	87.9	Confident	5 Å²	5	46.4 Å²	46.4	3%	0.026	25%	0.245	C	C	.	.	H	α-helix	trans	-59.1	-49.9	173.6	-70.8	168.9	0	0	0	110.7	I40 V44 C47 A94 W95 S100 S101 F102	I40-I98 HydrophobicContact CG2-CG2 4.34Å; V44-I98 HydrophobicContact CG2-CD1 4.26Å; V44-I98 HydrophobicContact CG2-CG2 3.68Å; C47-I98 HydrophobicContact CB-CD1 3.98Å; A94-I98 WeakPolarHBondContact O-CG1 3.31Å; A94-I98 PolarHBondContact O-N 2.81Å; A94-I98 VanDerWaalsContact O-N 3.1Å; W95-I98 HydrophobicContact CD2-CD1 4.24Å; W95-I98 HydrophobicContact CE3-CD1 3.78Å; W95-I98 HydrophobicContact CZ3-CD1 3.96Å; W95-I98 PolarHBondContact O-N 3.36Å; I98-S100 VanDerWaalsContact C-N 3.3Å; I98-S100 PolarHBondContact O-N 2.97Å; I98-S101 WeakPolarHBondContact O-CA 3.34Å; I98-S101 VanDerWaalsContact O-CB 3.28Å; I98-S101 WeakPolarHBondContact O-CB 3.47Å; I98-S101 PolarHBondContact O-N 3.2Å; I98-F102 HydrophobicContact CG2-CD2 4.05Å; I98-F102 HydrophobicContact CG2-CE2 3.93Å; I98-F102 PolarHBondContact O-N 3.32Å
99	L	90	Very high	88.7	Confident	15 Å²	15	43.5 Å²	43.5	8%	0.079	23%	0.225	C	C	.	.	H	α-helix	trans	-63	-37.3	177.5	-71.4	-176.4	0	0	0	112.4	F65 C68 R69 L72 W95 T96 S101 F102 Q103	F65-L99 HydrophobicContact CD2-CD2 3.98Å; F65-L99 HydrophobicContact CE2-CD2 3.93Å; C68-L99 HydrophobicContact CB-CD2 3.68Å; C68-L99 HydrophobicContact CB-CG 4.49Å; R69-L99 HydrophobicContact CB-CD1 4.34Å; R69-L99 HydrophobicContact CB-CD2 4.21Å; L72-L99 HydrophobicContact CB-CD1 4.02Å; L72-L99 HydrophobicContact CD2-CD1 3.34Å; L72-L99 HydrophobicContact CD2-CG 4.45Å; L72-L99 HydrophobicContact CG-CD1 4.31Å; W95-L99 PolarHBondContact O-N 2.66Å; T96-L99 PolarHBondContact O-N 2.93Å; L99-S101 PolarHBondContact O-N 3.02Å; L99-F102 WeakPolarHBondContact O-CB 3.26Å; L99-F102 PolarHBondContact O-N 3.21Å; L99-Q103 WeakPolarHBondContact O-CG 3.49Å; L99-Q103 PolarHBondContact O-N 3.31Å
100	S	91.6	Very high	89.2	Confident	58 Å²	58	42.9 Å²	42.9	41%	0.406	22%	0.22	S	C	.	.	H	α-helix	trans	-62.8	-33.1	174.1	81.4	0	0	0	0	111.9	T96 E97 I98 Q103 K104	T96-S100 WeakPolarHBondContact O-CB 3.05Å; T96-S100 PolarHBondContact O-N 3.4Å; E97-S100 WeakPolarHBondContact CA-OG 3.2Å; E97-S100 PolarHBondContact O-N 2.91Å; E97-S100 PolarHBondContact O-OG 3.38Å; I98-S100 VanDerWaalsContact C-N 3.3Å; I98-S100 PolarHBondContact O-N 2.97Å; S100-Q103 PolarHBondContact O-N 3.42Å; S100-K104 WeakPolarHBondContact O-CB 3.47Å; S100-K104 PolarHBondContact O-N 2.83Å
101	S	90.8	Very high	89.7	Confident	21 Å²	21	40.8 Å²	40.8	15%	0.147	21%	0.206	C	C	.	.	H	α-helix	trans	-69	-40.2	174.9	-57.9	0	0	0	0	111.7	E97 I98 L99	E97-S101 PolarHBondContact O-N 2.92Å; E97-S101 PolarHBondContact O-OG 2.86Å; I98-S101 WeakPolarHBondContact O-CA 3.34Å; I98-S101 VanDerWaalsContact O-CB 3.28Å; I98-S101 WeakPolarHBondContact O-CB 3.47Å; I98-S101 PolarHBondContact O-N 3.2Å; L99-S101 PolarHBondContact O-N 3.02Å
102	F	91.7	Very high	90.2	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-64.2	-39.6	172.3	-86	-69.6	0	0	0	112.9	L37 I40 L64 F65 I98 L99 L107 Y108 E111	L37-F102 HydrophobicContact CD2-CD1 4.34Å; L37-F102 HydrophobicContact CD2-CE1 4.12Å; I40-F102 HydrophobicContact CB-CZ 4.44Å; I40-F102 HydrophobicContact CD1-CD1 4.18Å; I40-F102 HydrophobicContact CD1-CG 4.33Å; I40-F102 HydrophobicContact CG2-CD1 4.3Å; I40-F102 HydrophobicContact CG2-CD2 3.73Å; I40-F102 HydrophobicContact CG2-CE1 3.9Å; I40-F102 HydrophobicContact CG2-CE2 3.29Å; I40-F102 HydrophobicContact CG2-CG 4.21Å; I40-F102 HydrophobicContact CG2-CZ 3.38Å; L64-F102 HydrophobicContact CB-CZ 4.31Å; L64-F102 HydrophobicContact CD2-CZ 3.99Å; L64-F102 HydrophobicContact CG-CZ 4.04Å; F65-F102 HydrophobicContact CB-CD1 4.22Å; F65-F102 HydrophobicContact CB-CE1 4.29Å; F65-F102 HydrophobicContact CB-CG 4.43Å; F65-F102 HydrophobicContact CD2-CB 3.65Å; F65-F102 HydrophobicContact CD2-CD1 4.32Å; F65-F102 HydrophobicContact CD2-CD2 4.15Å; F65-F102 AromaticContact CD2-CG 3.82Å; F65-F102 HydrophobicContact CD2-CG 3.82Å; F65-F102 HydrophobicContact CE2-CB 4.1Å; I98-F102 HydrophobicContact CG2-CD2 4.05Å; I98-F102 HydrophobicContact CG2-CE2 3.93Å; I98-F102 PolarHBondContact O-N 3.32Å; L99-F102 WeakPolarHBondContact O-CB 3.26Å; L99-F102 PolarHBondContact O-N 3.21Å; F102-L107 WeakPolarHBondContact O-CA 3.32Å; F102-L107 WeakPolarHBondContact O-CB 3.39Å; F102-L107 PolarHBondContact O-N 2.71Å; F102-Y108 PolarHBondContact O-N 3.39Å; F102-E111 HydrophobicContact CE1-CB 4.4Å; F102-E111 HydrophobicContact CE1-CG 4.29Å
103	Q	91.1	Very high	90.5	Very high	114 Å²	114	39.3 Å²	39.3	53%	0.533	20%	0.198	S	C	.	.	H	α-helix	trans	-72.7	-31.4	-179.8	-72.2	175.7	-12.7	0	0	112.6	L99 S100 N105 N106	L99-Q103 WeakPolarHBondContact O-CG 3.49Å; L99-Q103 PolarHBondContact O-N 3.31Å; S100-Q103 PolarHBondContact O-N 3.42Å; Q103-N105 PolarHBondContact O-N 2.75Å; Q103-N106 PolarHBondContact O-N 2.65Å
104	K	89.7	Confident	90.8	Very high	145 Å²	145	37.4 Å²	37.4	63%	0.63	20%	0.195	S	C	*	.	G	3₁₀ helix	trans	-58.6	125.9	176.3	-171.4	177.2	-177.5	178.9	0	110.3	S100 N106 L107	S100-K104 WeakPolarHBondContact O-CB 3.47Å; S100-K104 PolarHBondContact O-N 2.83Å; K104-N106 PolarHBondContact O-N 3.26Å; K104-L107 WeakPolarHBondContact O-CG 3.43Å
105	N	86	Confident	91	Very high	63 Å²	63	37.5 Å²	37.5	34%	0.337	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	57	25.3	-175.9	-52	-39.6	0	0	0	114.4	Q103 L107	Q103-N105 PolarHBondContact O-N 2.75Å; N105-L107 VanDerWaalsContact C-N 3.26Å; N105-L107 PolarHBondContact O-N 3.34Å
106	N	90.4	Very high	91.2	Very high	53 Å²	53	37.3 Å²	37.3	28%	0.283	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	55.1	33.7	178.3	-53.1	-52.4	0	0	0	114.9	I28 I29 Q103 K104 Y108 L109	I28-N106 HydrophobicContact CG2-CB 4.02Å; I28-N106 PolarHBondContact O-ND2 2.91Å; I29-N106 HydrophobicContact CG2-CB 4.39Å; Q103-N106 PolarHBondContact O-N 2.65Å; K104-N106 PolarHBondContact O-N 3.26Å; N106-Y108 HydrophobicContact CB-CE1 4.14Å; N106-Y108 PolarHBondContact O-N 3.14Å; N106-L109 HydrophobicContact CB-CD1 4Å; N106-L109 HydrophobicContact CB-CG 4.41Å; N106-L109 WeakPolarHBondContact O-CB 3.43Å; N106-L109 PolarHBondContact O-N 3.46Å; N106-L109 VanDerWaalsContact O-N 3.12Å
107	L	92	Very high	91.2	Very high	7 Å²	7	35.8 Å²	35.8	4%	0.037	18%	0.183	C	C	.	.	H	α-helix	trans	-62.2	-29.7	-177.9	-65.4	171.9	0	0	0	113	K36 L37 I40 F102 K104 N105 L109 A110 E111	K36-L107 HydrophobicContact CB-CD1 3.62Å; K36-L107 HydrophobicContact CB-CD2 4.14Å; K36-L107 HydrophobicContact CD-CD1 4.18Å; K36-L107 HydrophobicContact CD-CD2 4.33Å; L37-L107 HydrophobicContact CD2-CB 3.93Å; I40-L107 HydrophobicContact CD1-CD1 3.8Å; F102-L107 WeakPolarHBondContact O-CA 3.32Å; F102-L107 WeakPolarHBondContact O-CB 3.39Å; F102-L107 PolarHBondContact O-N 2.71Å; K104-L107 WeakPolarHBondContact O-CG 3.43Å; N105-L107 VanDerWaalsContact C-N 3.26Å; N105-L107 PolarHBondContact O-N 3.34Å; L107-L109 PolarHBondContact O-N 2.92Å; L107-A110 WeakPolarHBondContact O-CB 3.24Å; L107-A110 PolarHBondContact O-N 3.47Å; L107-E111 PolarHBondContact O-N 2.96Å
108	Y	92.9	Very high	91.2	Very high	21 Å²	21	34.5 Å²	34.5	8%	0.082	18%	0.177	C	C	.	.	H	α-helix	trans	-56.8	-34.2	174	71.5	-81.6	0	0	0	113.4	F65 F102 N106 A110 V112 F538 E542	F65-Y108 HydrophobicContact CD1-CD2 4.41Å; F65-Y108 HydrophobicContact CE1-CD2 4.05Å; F65-Y108 HydrophobicContact CE1-CG 4.36Å; F65-Y108 HydrophobicContact CE2-CG 4.31Å; F65-Y108 HydrophobicContact CZ-CD2 4.22Å; F65-Y108 HydrophobicContact CZ-CG 4.21Å; F102-Y108 PolarHBondContact O-N 3.39Å; N106-Y108 HydrophobicContact CB-CE1 4.14Å; N106-Y108 PolarHBondContact O-N 3.14Å; Y108-A110 VanDerWaalsContact C-N 3.33Å; Y108-V112 WeakPolarHBondContact O-CB 3.38Å; Y108-V112 VanDerWaalsContact O-CG2 3.29Å; Y108-V112 WeakPolarHBondContact O-CG2 3.46Å; Y108-V112 PolarHBondContact O-N 2.93Å; Y108-F538 HydrophobicContact CD2-CE1 4.12Å; Y108-F538 HydrophobicContact CD2-CZ 4.21Å; Y108-F538 HydrophobicContact CE2-CE1 4.39Å; Y108-F538 HydrophobicContact CE2-CZ 4.31Å; Y108-E542 HydrophobicContact CE2-CB 4.39Å; Y108-E542 HydrophobicContact CE2-CG 4.18Å
109	L	92.4	Very high	91.2	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-68.8	-35.3	176.4	-64.9	177.8	0	0	0	111.6	L23 I28 N106 L107 G113 E542 L543 I546	L23-L109 HydrophobicContact CD1-CB 4.08Å; L23-L109 HydrophobicContact CD2-CB 4.44Å; L23-L109 HydrophobicContact CD2-CD1 4.39Å; I28-L109 HydrophobicContact CG2-CD1 3.84Å; N106-L109 HydrophobicContact CB-CD1 4Å; N106-L109 HydrophobicContact CB-CG 4.41Å; N106-L109 WeakPolarHBondContact O-CB 3.43Å; N106-L109 PolarHBondContact O-N 3.46Å; N106-L109 VanDerWaalsContact O-N 3.12Å; L107-L109 PolarHBondContact O-N 2.92Å; L109-G113 PolarHBondContact O-N 3.42Å; L109-E542 HydrophobicContact CD2-CB 3.98Å; L109-L543 HydrophobicContact CD1-CD2 3.94Å; L109-I546 HydrophobicContact CD1-CD1 3.67Å
110	A	92.1	Very high	91.2	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-69.6	-46.1	176.1	0	0	0	0	0	110.9	I20 I29 Y33 L37 L107 Y108 G113 D114	I20-A110 HydrophobicContact CD1-CB 4.24Å; I20-A110 WeakPolarHBondContact CD1-O 3.36Å; I29-A110 HydrophobicContact CD1-CB 3.83Å; I29-A110 HydrophobicContact CG2-CB 4.34Å; Y33-A110 HydrophobicContact CD2-CB 3.47Å; Y33-A110 VanDerWaalsContact CD2-CB 3.47Å; Y33-A110 HydrophobicContact CE2-CB 3.76Å; Y33-A110 HydrophobicContact CG-CB 4.14Å; L37-A110 HydrophobicContact CD1-CB 4.35Å; L107-A110 WeakPolarHBondContact O-CB 3.24Å; L107-A110 PolarHBondContact O-N 3.47Å; Y108-A110 VanDerWaalsContact C-N 3.33Å; A110-G113 PolarHBondContact O-N 3.24Å; A110-D114 WeakPolarHBondContact O-CB 3.32Å; A110-D114 PolarHBondContact O-N 2.84Å
111	E	92.8	Very high	91.1	Very high	17 Å²	17	33.7 Å²	33.7	8%	0.079	18%	0.175	C	C	.	.	H	α-helix	trans	-62.3	-46.7	177.6	-174	-84.1	142.4	0	0	111.8	L37 S63 L64 F65 F102 L107 G113 D114 S115	L37-E111 HydrophobicContact CD1-CB 4.16Å; L37-E111 HydrophobicContact CD2-CB 3.93Å; S63-E111 VanDerWaalsContact CA-OE1 3.3Å; S63-E111 WeakPolarHBondContact CA-OE1 3.27Å; S63-E111 WeakPolarHBondContact CB-OE1 3.38Å; S63-E111 WeakPolarHBondContact CB-OE2 3.45Å; L64-E111 PolarHBondContact N-OE1 3.27Å; F65-E111 VanDerWaalsContact CB-OE2 3.31Å; F65-E111 WeakPolarHBondContact CB-OE2 3.41Å; F65-E111 PolarHBondContact N-OE2 3.15Å; F102-E111 HydrophobicContact CE1-CB 4.4Å; F102-E111 HydrophobicContact CE1-CG 4.29Å; L107-E111 PolarHBondContact O-N 2.96Å; E111-G113 VanDerWaalsContact C-N 3.29Å; E111-G113 PolarHBondContact O-N 3.47Å; E111-D114 PolarHBondContact O-N 3.04Å; E111-S115 WeakPolarHBondContact O-CB 3.38Å; E111-S115 PolarHBondContact O-N 3.06Å; E111-S115 PolarHBondContact O-OG 2.85Å; E111-S115 PolarHBondContact OE1-OG 2.96Å
112	V	92.7	Very high	91.1	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.3	-39	175.1	172.6	0	0	0	0	111.3	Y108 S115 I116 L535 F538 L539	Y108-V112 WeakPolarHBondContact O-CB 3.38Å; Y108-V112 VanDerWaalsContact O-CG2 3.29Å; Y108-V112 WeakPolarHBondContact O-CG2 3.46Å; Y108-V112 PolarHBondContact O-N 2.93Å; V112-S115 PolarHBondContact O-N 3.33Å; V112-I116 HydrophobicContact CG1-CD1 3.99Å; V112-I116 HydrophobicContact CG1-CG1 4.43Å; V112-I116 VanDerWaalsContact O-CG1 3.27Å; V112-I116 WeakPolarHBondContact O-CG1 3.29Å; V112-I116 PolarHBondContact O-N 2.99Å; V112-L535 HydrophobicContact CG1-CB 4.09Å; V112-L535 HydrophobicContact CG1-CD2 4.16Å; V112-F538 HydrophobicContact CG1-CD1 4.23Å; V112-F538 HydrophobicContact CG2-CD1 4.16Å; V112-F538 HydrophobicContact CG2-CE1 4.09Å; V112-L539 HydrophobicContact CB-CD1 4.26Å; V112-L539 HydrophobicContact CG1-CB 4.21Å; V112-L539 HydrophobicContact CG1-CD1 3.85Å
113	G	91.7	Very high	91.1	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-63.3	-42.7	175.6	0	0	0	0	0	113.4	L109 A110 E111 I116 N117	L109-G113 PolarHBondContact O-N 3.42Å; A110-G113 PolarHBondContact O-N 3.24Å; E111-G113 VanDerWaalsContact C-N 3.29Å; E111-G113 PolarHBondContact O-N 3.47Å; G113-I116 PolarHBondContact O-N 3.4Å; G113-N117 PolarHBondContact O-N 3.43Å; G113-N117 VanDerWaalsContact O-N 3.12Å; G113-N117 PolarHBondContact O-ND2 2.8Å
114	D	91.9	Very high	91.1	Very high	59 Å²	59	34 Å²	34	32%	0.316	18%	0.179	S	C	.	.	H	α-helix	trans	-64.5	-43.9	174.3	-77.5	-24.3	0	0	0	110.6	I20 Y33 A110 E111 I116 N117 E118	I20-D114 WeakPolarHBondContact CD1-OD1 3.33Å; I20-D114 VanDerWaalsContact CG1-OD1 3.24Å; I20-D114 WeakPolarHBondContact CG1-OD1 3.49Å; Y33-D114 WeakPolarHBondContact CE2-OD2 3.33Å; Y33-D114 PolarHBondContact OH-OD2 3.5Å; A110-D114 WeakPolarHBondContact O-CB 3.32Å; A110-D114 PolarHBondContact O-N 2.84Å; E111-D114 PolarHBondContact O-N 3.04Å; D114-I116 PolarHBondContact O-N 3.11Å; D114-N117 PolarHBondContact O-N 3.28Å; D114-N117 VanDerWaalsContact O-N 3.15Å; D114-E118 PolarHBondContact O-N 3.44Å
115	S	91.6	Very high	91.3	Very high	24 Å²	24	29.8 Å²	29.8	17%	0.168	17%	0.166	C	C	.	.	H	α-helix	trans	-62.9	-39.1	176.6	-70.3	0	0	0	0	112.9	P62 E111 V112 L119	P62-S115 WeakPolarHBondContact O-CB 3.22Å; E111-S115 WeakPolarHBondContact O-CB 3.38Å; E111-S115 PolarHBondContact O-N 3.06Å; E111-S115 PolarHBondContact O-OG 2.85Å; E111-S115 PolarHBondContact OE1-OG 2.96Å; V112-S115 PolarHBondContact O-N 3.33Å; S115-L119 WeakPolarHBondContact O-CB 3.29Å; S115-L119 VanDerWaalsContact O-CG 3.25Å; S115-L119 WeakPolarHBondContact O-CG 3.48Å; S115-L119 PolarHBondContact O-N 3.25Å
116	I	91.4	Very high	91.6	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.5	-45.5	171.8	-71.5	165.3	0	0	0	110.7	I19 V112 G113 D114 L119 A120 L535 V536 L539 I553	I19-I116 HydrophobicContact CD1-CB 4.44Å; I19-I116 HydrophobicContact CD1-CD1 4.28Å; I19-I116 HydrophobicContact CD1-CG2 4.12Å; V112-I116 HydrophobicContact CG1-CD1 3.99Å; V112-I116 HydrophobicContact CG1-CG1 4.43Å; V112-I116 VanDerWaalsContact O-CG1 3.27Å; V112-I116 WeakPolarHBondContact O-CG1 3.29Å; V112-I116 PolarHBondContact O-N 2.99Å; G113-I116 PolarHBondContact O-N 3.4Å; D114-I116 PolarHBondContact O-N 3.11Å; I116-L119 PolarHBondContact O-N 2.99Å; I116-A120 VanDerWaalsContact O-CB 3.24Å; I116-A120 WeakPolarHBondContact O-CB 3.28Å; I116-A120 PolarHBondContact O-N 3.29Å; I116-L535 HydrophobicContact CD1-CB 3.93Å; I116-L535 HydrophobicContact CG1-CB 3.5Å; I116-L535 VanDerWaalsContact CG1-CB 3.5Å; I116-L535 HydrophobicContact CG1-CD1 3.99Å; I116-L535 HydrophobicContact CG1-CG 4.42Å; I116-V536 HydrophobicContact CD1-CG2 4.05Å; I116-V536 HydrophobicContact CG1-CG2 4.36Å; I116-V536 HydrophobicContact CG2-CG2 4.22Å; I116-L539 HydrophobicContact CD1-CB 4.27Å; I116-L539 HydrophobicContact CD1-CD1 4.07Å; I116-I553 HydrophobicContact CD1-CD1 4.46Å
117	N	90.8	Very high	91.7	Very high	32 Å²	32	32.2 Å²	32.2	17%	0.171	17%	0.168	C	C	.	.	H	α-helix	trans	-64.8	-43.5	-179.7	-76	-34.4	0	0	0	111.7	S16 G113 D114 A120 A121	S16-N117 PolarHBondContact O-OD1 2.81Å; G113-N117 PolarHBondContact O-N 3.43Å; G113-N117 VanDerWaalsContact O-N 3.12Å; G113-N117 PolarHBondContact O-ND2 2.8Å; D114-N117 PolarHBondContact O-N 3.28Å; D114-N117 VanDerWaalsContact O-N 3.15Å; N117-A120 PolarHBondContact O-N 3.43Å; N117-A121 WeakPolarHBondContact O-CA 3.37Å; N117-A121 WeakPolarHBondContact O-CB 3.41Å; N117-A121 PolarHBondContact O-N 2.91Å
118	E	90.7	Very high	91.8	Very high	91 Å²	91	35.6 Å²	35.6	43%	0.425	18%	0.182	S	C	.	.	H	α-helix	trans	-61.1	-45.8	176	-178.1	60.1	-157.9	0	0	111.4	D114 V122 Q123	D114-E118 PolarHBondContact O-N 3.44Å; E118-V122 WeakPolarHBondContact O-CA 3.48Å; E118-V122 VanDerWaalsContact O-CB 3.31Å; E118-V122 WeakPolarHBondContact O-CB 3.46Å; E118-V122 PolarHBondContact O-N 2.76Å; E118-Q123 HydrophobicContact CG-CG 4.38Å; E118-Q123 PolarHBondContact O-N 2.98Å
119	L	91.2	Very high	91.9	Very high	8 Å²	8	39.6 Å²	39.6	4%	0.042	20%	0.203	C	C	.	.	I	π-helix	trans	-62.6	-51	177.2	-73.4	170.3	0	0	0	112.2	P62 S115 I116 V124 L528 C532 L535	P62-L119 HydrophobicContact CB-CD1 4.11Å; S115-L119 WeakPolarHBondContact O-CB 3.29Å; S115-L119 VanDerWaalsContact O-CG 3.25Å; S115-L119 WeakPolarHBondContact O-CG 3.48Å; S115-L119 PolarHBondContact O-N 3.25Å; I116-L119 PolarHBondContact O-N 2.99Å; L119-V124 WeakPolarHBondContact O-CB 3.43Å; L119-V124 WeakPolarHBondContact O-CG2 3.28Å; L119-V124 PolarHBondContact O-N 3.28Å; L119-L528 HydrophobicContact CD2-CD2 3.61Å; L119-C532 HydrophobicContact CB-CB 4.42Å; L119-C532 HydrophobicContact CD1-CB 4.43Å; L119-L535 HydrophobicContact CD1-CD1 3.77Å
120	A	89.9	Confident	92	Very high	5 Å²	5	43.5 Å²	43.5	4%	0.041	22%	0.22	C	C	.	.	I	π-helix	trans	-76.3	-38	-172.6	0	0	0	0	0	113.2	I116 N117 P125	I116-A120 VanDerWaalsContact O-CB 3.24Å; I116-A120 WeakPolarHBondContact O-CB 3.28Å; I116-A120 PolarHBondContact O-N 3.29Å; N117-A120 PolarHBondContact O-N 3.43Å; A120-P125 VanDerWaalsContact O-CD 3.22Å; A120-P125 WeakPolarHBondContact O-CD 3.46Å; A120-P125 WeakPolarHBondContact O-CG 3.41Å
121	A	89.1	Confident	92.2	Very high	47 Å²	47	44.2 Å²	44.2	39%	0.388	22%	0.224	S	C	.	.	I	π-helix	trans	-94.4	-24.5	-174.2	0	0	0	0	0	113.7	N117 P125	N117-A121 WeakPolarHBondContact O-CA 3.37Å; N117-A121 WeakPolarHBondContact O-CB 3.41Å; N117-A121 PolarHBondContact O-N 2.91Å; A121-P125 WeakPolarHBondContact O-CG 3.38Å
122	V	91	Very high	92.3	Very high	65 Å²	65	46.6 Å²	46.6	39%	0.394	24%	0.242	S	C	.	.	I	π-helix	trans	-117.6	-61.9	-175	-174.9	0	0	0	0	111.5	E118 R126	E118-V122 WeakPolarHBondContact O-CA 3.48Å; E118-V122 VanDerWaalsContact O-CB 3.31Å; E118-V122 WeakPolarHBondContact O-CB 3.46Å; E118-V122 PolarHBondContact O-N 2.76Å; V122-R126 WeakPolarHBondContact O-CB 3.34Å; V122-R126 PolarHBondContact O-N 3.3Å
123	Q	91.4	Very high	92.4	Very high	74 Å²	74	50.7 Å²	50.7	35%	0.346	26%	0.264	S	S	.	.	I	π-helix	trans	-69.6	-45.6	-168.7	-59.8	-172.3	20.8	0	0	113	E118 R126 C127 L528	E118-Q123 HydrophobicContact CG-CG 4.38Å; E118-Q123 PolarHBondContact O-N 2.98Å; Q123-R126 PolarHBondContact O-N 3.02Å; Q123-C127 WeakPolarHBondContact O-CB 3.43Å; Q123-C127 PolarHBondContact O-N 2.99Å; Q123-L528 HydrophobicContact CB-CD1 4.18Å; Q123-L528 HydrophobicContact CB-CD2 4.45Å; Q123-L528 VanDerWaalsContact OE1-CD2 3.25Å
124	V	92.4	Very high	92.5	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.012	28%	0.281	C	S	.	.	H	α-helix	trans	-65.5	-49.9	178.2	169.3	0	0	0	0	111.6	L119 R126 C127 K128 L525 L528 L560	L119-V124 WeakPolarHBondContact O-CB 3.43Å; L119-V124 WeakPolarHBondContact O-CG2 3.28Å; L119-V124 PolarHBondContact O-N 3.28Å; V124-R126 VanDerWaalsContact C-N 3.3Å; V124-R126 PolarHBondContact O-N 3.34Å; V124-C127 PolarHBondContact O-N 2.75Å; V124-C127 VanDerWaalsContact O-N 3.17Å; V124-K128 HydrophobicContact CG1-CD 4.01Å; V124-K128 HydrophobicContact CG1-CG 4.19Å; V124-K128 WeakPolarHBondContact O-CG 3.36Å; V124-K128 PolarHBondContact O-N 2.74Å; V124-L525 HydrophobicContact CB-CD1 4.35Å; V124-L525 HydrophobicContact CG1-CD1 3.61Å; V124-L525 HydrophobicContact CG2-CD1 4.35Å; V124-L528 HydrophobicContact CG2-CB 3.9Å; V124-L560 HydrophobicContact CB-CD2 3.62Å; V124-L560 HydrophobicContact CG1-CD2 3.26Å; V124-L560 HydrophobicContact CG2-CD2 3.69Å
125	P	92.1	Very high	92.7	Very high	57 Å²	57	56.9 Å²	56.9	37%	0.37	29%	0.287	S	S	.	.	H	α-helix	trans	-57.2	-42.4	175.4	-29.8	39.2	0	0	0	112.8	A120 A121 C127 K128 M129	A120-P125 VanDerWaalsContact O-CD 3.22Å; A120-P125 WeakPolarHBondContact O-CD 3.46Å; A120-P125 WeakPolarHBondContact O-CG 3.41Å; A121-P125 WeakPolarHBondContact O-CG 3.38Å; P125-C127 PolarHBondContact O-N 2.75Å; P125-K128 PolarHBondContact O-N 2.94Å; P125-M129 WeakPolarHBondContact O-CB 3.43Å; P125-M129 PolarHBondContact O-N 3.33Å
126	R	93.1	Very high	92.9	Very high	160 Å²	160	62.6 Å²	62.6	60%	0.604	31%	0.309	S	S	*	.	H	α-helix	trans	-59.9	-45.1	175.3	-175.9	177	-174.8	-173.2	-0.4	111.7	V122 Q123 V124 M129 F130	V122-R126 WeakPolarHBondContact O-CB 3.34Å; V122-R126 PolarHBondContact O-N 3.3Å; Q123-R126 PolarHBondContact O-N 3.02Å; V124-R126 VanDerWaalsContact C-N 3.3Å; V124-R126 PolarHBondContact O-N 3.34Å; R126-M129 PolarHBondContact O-N 3.49Å; R126-F130 HydrophobicContact CG-CD2 4Å; R126-F130 HydrophobicContact CG-CE2 3.7Å; R126-F130 WeakPolarHBondContact O-CD2 3.41Å; R126-F130 PolarHBondContact O-N 3.48Å
127	C	93.3	Very high	93.1	Very high	8 Å²	8	65.4 Å²	65.4	5%	0.054	32%	0.324	C	S	.	.	H	α-helix	trans	-65.7	-42.7	177.6	-164.8	0	0	0	0	112.1	Q123 V124 P125 M129 F130 I131 K521 L525 L528	Q123-C127 WeakPolarHBondContact O-CB 3.43Å; Q123-C127 PolarHBondContact O-N 2.99Å; V124-C127 PolarHBondContact O-N 2.75Å; V124-C127 VanDerWaalsContact O-N 3.17Å; P125-C127 PolarHBondContact O-N 2.75Å; C127-M129 VanDerWaalsContact C-N 3.32Å; C127-M129 PolarHBondContact O-N 3.49Å; C127-F130 PolarHBondContact O-N 3.15Å; C127-I131 WeakPolarHBondContact O-CG1 3.31Å; C127-I131 PolarHBondContact O-N 3.02Å; C127-K521 PolarHBondContact SG-O 3.27Å; C127-K521 VanDerWaalsContact SG-O 3.33Å; C127-L525 HydrophobicContact CB-CD1 4.3Å; C127-L528 HydrophobicContact CB-CD1 4.27Å
128	K	94.2	Very high	93.4	Very high	78 Å²	78	64 Å²	64	34%	0.339	32%	0.317	S	S	.	.	H	α-helix	trans	-58.3	-43.5	173.7	-75.4	-179.3	176.9	-178.7	0	111.3	V124 P125 I131 S132 L525 D559 L560	V124-K128 HydrophobicContact CG1-CD 4.01Å; V124-K128 HydrophobicContact CG1-CG 4.19Å; V124-K128 WeakPolarHBondContact O-CG 3.36Å; V124-K128 PolarHBondContact O-N 2.74Å; P125-K128 PolarHBondContact O-N 2.94Å; K128-I131 PolarHBondContact O-N 3.33Å; K128-S132 WeakPolarHBondContact O-CB 3.41Å; K128-S132 PolarHBondContact O-N 3.45Å; K128-L525 HydrophobicContact CG-CD1 4.05Å; K128-L525 HydrophobicContact CG-CD2 4.1Å; K128-D559 PolarHBondContact NZ-O 3.21Å; K128-D559 VanDerWaalsContact NZ-O 3.12Å; K128-L560 WeakPolarHBondContact CE-OXT 3.31Å; K128-L560 PolarHBondContact NZ-OXT 3.14Å
129	M	95	Very high	93.7	Very high	104 Å²	104	65 Å²	65	51%	0.512	33%	0.325	S	S	.	.	H	α-helix	trans	-60.8	-49.4	176.3	-173.4	-175.9	75.2	0	0	111.4	P125 R126 C127 I131 S132 D133	P125-M129 WeakPolarHBondContact O-CB 3.43Å; P125-M129 PolarHBondContact O-N 3.33Å; R126-M129 PolarHBondContact O-N 3.49Å; C127-M129 VanDerWaalsContact C-N 3.32Å; C127-M129 PolarHBondContact O-N 3.49Å; M129-I131 VanDerWaalsContact C-N 3.3Å; M129-I131 PolarHBondContact O-N 3.46Å; M129-S132 WeakPolarHBondContact O-CB 3.41Å; M129-S132 PolarHBondContact O-N 3.02Å; M129-S132 VanDerWaalsContact O-N 3.11Å; M129-D133 PolarHBondContact O-N 3.31Å
130	F	94.1	Very high	94	Very high	83 Å²	83	68.5 Å²	68.5	36%	0.364	34%	0.343	S	S	.	.	H	α-helix	trans	-57.1	-42	175.8	-83	-66.5	0	0	0	113.1	R126 C127 R134	R126-F130 HydrophobicContact CG-CD2 4Å; R126-F130 HydrophobicContact CG-CE2 3.7Å; R126-F130 WeakPolarHBondContact O-CD2 3.41Å; R126-F130 PolarHBondContact O-N 3.48Å; C127-F130 PolarHBondContact O-N 3.15Å; F130-R134 WeakPolarHBondContact O-CB 3.24Å; F130-R134 VanDerWaalsContact O-CG 3.26Å; F130-R134 WeakPolarHBondContact O-CG 3.31Å; F130-R134 PolarHBondContact O-N 2.87Å
131	I	95	Very high	94.3	Very high	15 Å²	15	68.8 Å²	68.8	8%	0.077	34%	0.344	C	S	.	.	H	α-helix	trans	-64.1	-44.7	176.8	-67.7	164	0	0	0	110.4	C127 K128 M129 R134 Q135 Q518 K521 L525	C127-I131 WeakPolarHBondContact O-CG1 3.31Å; C127-I131 PolarHBondContact O-N 3.02Å; K128-I131 PolarHBondContact O-N 3.33Å; M129-I131 VanDerWaalsContact C-N 3.3Å; M129-I131 PolarHBondContact O-N 3.46Å; I131-R134 PolarHBondContact O-N 3.24Å; I131-Q135 HydrophobicContact CG2-CG 4.39Å; I131-Q135 WeakPolarHBondContact O-CB 3.47Å; I131-Q135 VanDerWaalsContact O-CG 3.27Å; I131-Q135 WeakPolarHBondContact O-CG 3.42Å; I131-Q135 PolarHBondContact O-N 3.34Å; I131-Q518 HydrophobicContact CG2-CG 4.47Å; I131-K521 HydrophobicContact CD1-CB 4.42Å; I131-K521 HydrophobicContact CG1-CB 3.84Å; I131-L525 HydrophobicContact CD1-CB 3.95Å; I131-L525 HydrophobicContact CD1-CD2 3.64Å; I131-L525 HydrophobicContact CD1-CG 4.4Å
132	S	95.6	Very high	94.8	Very high	67 Å²	67	72 Å²	72	47%	0.469	35%	0.346	S	S	.	.	H	α-helix	trans	-61.6	-45	177.9	-176.7	0	0	0	0	112.2	K128 M129 R134 Q135 K136	K128-S132 WeakPolarHBondContact O-CB 3.41Å; K128-S132 PolarHBondContact O-N 3.45Å; M129-S132 WeakPolarHBondContact O-CB 3.41Å; M129-S132 PolarHBondContact O-N 3.02Å; M129-S132 VanDerWaalsContact O-N 3.11Å; S132-R134 VanDerWaalsContact C-N 3.33Å; S132-R134 PolarHBondContact O-N 3.1Å; S132-Q135 WeakPolarHBondContact O-CB 3.31Å; S132-Q135 PolarHBondContact O-N 3.06Å; S132-K136 PolarHBondContact O-N 3.33Å
133	D	95.4	Very high	95.1	Very high	86 Å²	86	74.2 Å²	74.2	46%	0.46	35%	0.352	S	S	.	.	H	α-helix	trans	-62.8	-42	178.2	-68.5	-20.8	0	0	0	111.2	M129 K136 N137	M129-D133 PolarHBondContact O-N 3.31Å; D133-K136 PolarHBondContact O-N 3.34Å; D133-N137 PolarHBondContact O-N 2.91Å
134	R	94	Very high	95.3	Very high	95 Å²	95	76.9 Å²	76.9	36%	0.358	36%	0.359	S	S	.	.	H	α-helix	trans	-68	-36.4	175.7	-69.3	-69.1	168.6	173.3	-7.2	112.4	F130 I131 S132 K136 N137 L138 E517	F130-R134 WeakPolarHBondContact O-CB 3.24Å; F130-R134 VanDerWaalsContact O-CG 3.26Å; F130-R134 WeakPolarHBondContact O-CG 3.31Å; F130-R134 PolarHBondContact O-N 2.87Å; I131-R134 PolarHBondContact O-N 3.24Å; S132-R134 VanDerWaalsContact C-N 3.33Å; S132-R134 PolarHBondContact O-N 3.1Å; R134-K136 VanDerWaalsContact C-N 3.33Å; R134-K136 PolarHBondContact O-N 3.37Å; R134-N137 PolarHBondContact O-N 3.16Å; R134-L138 WeakPolarHBondContact O-CB 3.46Å; R134-L138 WeakPolarHBondContact O-CG 3.32Å; R134-L138 PolarHBondContact O-N 2.89Å; R134-E517 IonicContact CZ-OE2 3.52Å; R134-E517 IonicContact NE-OE2 3.69Å; R134-E517 IonicContact NH1-OE2 3.06Å; R134-E517 PolarHBondContact NH1-OE2 3.34Å; R134-E517 IonicContact NH2-OE2 2.91Å
135	Q	95.7	Very high	95.6	Very high	94 Å²	94	78.3 Å²	78.3	44%	0.439	37%	0.366	S	S	.	.	H	α-helix	trans	-60.7	-43	172.6	-78.7	173.7	-15.8	0	0	111.6	I131 S132 L138 L139	I131-Q135 HydrophobicContact CG2-CG 4.39Å; I131-Q135 WeakPolarHBondContact O-CB 3.47Å; I131-Q135 VanDerWaalsContact O-CG 3.27Å; I131-Q135 WeakPolarHBondContact O-CG 3.42Å; I131-Q135 PolarHBondContact O-N 3.34Å; S132-Q135 WeakPolarHBondContact O-CB 3.31Å; S132-Q135 PolarHBondContact O-N 3.06Å; Q135-L138 PolarHBondContact O-N 2.9Å; Q135-L139 WeakPolarHBondContact O-CG 3.19Å; Q135-L139 PolarHBondContact O-N 3.15Å; Q135-L139 VanDerWaalsContact O-N 3.09Å
136	K	95.9	Very high	95.8	Very high	143 Å²	143	82.5 Å²	82.5	62%	0.622	38%	0.379	S	S	*	.	H	α-helix	trans	-62.3	-50	175.1	-173.9	-178.9	175.7	-175.6	0	111.4	S132 D133 R134 L138 L139 D140	S132-K136 PolarHBondContact O-N 3.33Å; D133-K136 PolarHBondContact O-N 3.34Å; R134-K136 VanDerWaalsContact C-N 3.33Å; R134-K136 PolarHBondContact O-N 3.37Å; K136-L138 VanDerWaalsContact C-N 3.27Å; K136-L138 PolarHBondContact O-N 3.28Å; K136-L139 WeakPolarHBondContact O-CB 3.47Å; K136-L139 PolarHBondContact O-N 3.43Å; K136-D140 PolarHBondContact O-N 3.1Å; K136-D140 VanDerWaalsContact O-N 3.12Å
137	N	95.4	Very high	96	Very high	60 Å²	60	80.2 Å²	80.2	32%	0.321	38%	0.375	S	S	.	.	H	α-helix	trans	-56.6	-40.7	176.4	-175.9	27	0	0	0	112.2	D133 R134 L139 D140 L141	D133-N137 PolarHBondContact O-N 2.91Å; R134-N137 PolarHBondContact O-N 3.16Å; N137-L139 VanDerWaalsContact C-N 3.34Å; N137-L139 PolarHBondContact O-N 3.26Å; N137-D140 PolarHBondContact O-N 3.45Å; N137-L141 WeakPolarHBondContact O-CB 3.29Å; N137-L141 WeakPolarHBondContact O-CG 3.26Å; N137-L141 PolarHBondContact O-N 2.91Å
138	L	97.2	Very high	96.2	Very high	3 Å²	3	82 Å²	82	2%	0.016	38%	0.382	C	S	.	.	H	α-helix	trans	-64.3	-35.9	176.3	-81.8	169.1	0	0	0	113.2	R134 Q135 K136 R142 I511 A514 L515 Q518	R134-L138 WeakPolarHBondContact O-CB 3.46Å; R134-L138 WeakPolarHBondContact O-CG 3.32Å; R134-L138 PolarHBondContact O-N 2.89Å; Q135-L138 PolarHBondContact O-N 2.9Å; K136-L138 VanDerWaalsContact C-N 3.27Å; K136-L138 PolarHBondContact O-N 3.28Å; L138-R142 VanDerWaalsContact O-CB 3.3Å; L138-R142 WeakPolarHBondContact O-CB 3.39Å; L138-R142 WeakPolarHBondContact O-CD 3.47Å; L138-R142 WeakPolarHBondContact O-CG 3.27Å; L138-R142 PolarHBondContact O-N 3.08Å; L138-I511 HydrophobicContact CD2-CG2 4.13Å; L138-A514 HydrophobicContact CD2-CB 3.6Å; L138-A514 HydrophobicContact CG-CB 4.03Å; L138-L515 HydrophobicContact CD1-CD2 3.77Å; L138-L515 HydrophobicContact CD1-CG 4.36Å; L138-L515 HydrophobicContact CD2-CD2 4.15Å; L138-L515 HydrophobicContact CD2-CG 3.96Å; L138-Q518 HydrophobicContact CD1-CB 4.49Å
139	L	96.9	Very high	96.4	Very high	112 Å²	112	80.2 Å²	80.2	59%	0.586	38%	0.38	S	S	*	.	H	α-helix	trans	-64.5	-45	174.1	-69.2	173.2	0	0	0	110.8	Q135 K136 N137 R142 Q143	Q135-L139 WeakPolarHBondContact O-CG 3.19Å; Q135-L139 PolarHBondContact O-N 3.15Å; Q135-L139 VanDerWaalsContact O-N 3.09Å; K136-L139 WeakPolarHBondContact O-CB 3.47Å; K136-L139 PolarHBondContact O-N 3.43Å; N137-L139 VanDerWaalsContact C-N 3.34Å; N137-L139 PolarHBondContact O-N 3.26Å; L139-R142 PolarHBondContact O-N 3.27Å; L139-Q143 PolarHBondContact O-N 3.44Å
140	D	96.8	Very high	96.5	Very high	80 Å²	80	79.4 Å²	79.4	43%	0.428	38%	0.377	S	S	.	.	H	α-helix	trans	-63	-45.3	178.5	-60.9	-22.6	0	0	0	111.2	K136 N137 R142 Q143 R144	K136-D140 PolarHBondContact O-N 3.1Å; K136-D140 VanDerWaalsContact O-N 3.12Å; N137-D140 PolarHBondContact O-N 3.45Å; D140-R142 PolarHBondContact O-N 3.15Å; D140-Q143 PolarHBondContact O-N 3.13Å; D140-R144 WeakPolarHBondContact O-CB 3.25Å; D140-R144 PolarHBondContact O-N 2.63Å
141	L	97.7	Very high	96.6	Very high	12 Å²	12	78.3 Å²	78.3	6%	0.063	38%	0.375	C	S	.	.	H	α-helix	trans	-63.2	-40	175.9	-72.1	173.7	0	0	0	112.3	N137 R144 L145 L510 I511 A514	N137-L141 WeakPolarHBondContact O-CB 3.29Å; N137-L141 WeakPolarHBondContact O-CG 3.26Å; N137-L141 PolarHBondContact O-N 2.91Å; L141-R144 PolarHBondContact O-N 2.9Å; L141-L145 WeakPolarHBondContact O-CB 3.43Å; L141-L145 PolarHBondContact O-N 2.96Å; L141-L510 HydrophobicContact CD1-CB 4.43Å; L141-I511 HydrophobicContact CB-CD1 4.23Å; L141-I511 HydrophobicContact CB-CG1 3.65Å; L141-I511 HydrophobicContact CD1-CG1 4.31Å; L141-A514 HydrophobicContact CD1-CB 4.41Å
142	R	97.9	Very high	96.7	Very high	114 Å²	114	78.6 Å²	78.6	43%	0.43	38%	0.377	S	S	.	.	H	α-helix	trans	-66.8	-37.4	176.3	-77.7	171.6	178.6	173.1	0.9	112.1	L138 L139 D140 K146 I511	L138-R142 VanDerWaalsContact O-CB 3.3Å; L138-R142 WeakPolarHBondContact O-CB 3.39Å; L138-R142 WeakPolarHBondContact O-CD 3.47Å; L138-R142 WeakPolarHBondContact O-CG 3.27Å; L138-R142 PolarHBondContact O-N 3.08Å; L139-R142 PolarHBondContact O-N 3.27Å; D140-R142 PolarHBondContact O-N 3.15Å; R142-K146 WeakPolarHBondContact O-CG 3.45Å; R142-K146 PolarHBondContact O-N 3.02Å; R142-K146 VanDerWaalsContact O-N 3.15Å; R142-I511 HydrophobicContact CG-CD1 4.28Å
143	Q	97.2	Very high	96.8	Very high	112 Å²	112	79.2 Å²	79.2	52%	0.523	37%	0.374	S	S	.	.	H	α-helix	trans	-63.6	-48.9	173.2	179.4	175.5	-8.2	0	0	110.4	L139 D140 L145 K146 E147	L139-Q143 PolarHBondContact O-N 3.44Å; D140-Q143 PolarHBondContact O-N 3.13Å; Q143-L145 VanDerWaalsContact C-N 3.29Å; Q143-L145 PolarHBondContact O-N 3.41Å; Q143-K146 WeakPolarHBondContact O-CB 3.3Å; Q143-K146 PolarHBondContact O-N 3.21Å; Q143-K146 VanDerWaalsContact O-N 3.09Å; Q143-E147 WeakPolarHBondContact CG-OE1 3.36Å; Q143-E147 PolarHBondContact NE2-OE1 3.11Å; Q143-E147 VanDerWaalsContact NE2-OE1 3.08Å; Q143-E147 PolarHBondContact O-N 2.94Å; Q143-E147 VanDerWaalsContact O-N 3.09Å
144	R	97.1	Very high	96.8	Very high	130 Å²	130	82.2 Å²	82.2	49%	0.491	38%	0.379	S	S	.	.	H	α-helix	trans	-55.7	-43.6	175.6	-175.4	-177.8	-63.5	-179.8	-0.5	112.2	D140 L141 K146 E147 Q148 T507	D140-R144 WeakPolarHBondContact O-CB 3.25Å; D140-R144 PolarHBondContact O-N 2.63Å; L141-R144 PolarHBondContact O-N 2.9Å; R144-K146 VanDerWaalsContact C-N 3.33Å; R144-K146 PolarHBondContact O-N 3.43Å; R144-E147 PolarHBondContact O-N 3.42Å; R144-Q148 HydrophobicContact CG-CG 4.41Å; R144-Q148 WeakPolarHBondContact O-CB 3.44Å; R144-Q148 VanDerWaalsContact O-CG 3.3Å; R144-Q148 WeakPolarHBondContact O-CG 3.41Å; R144-Q148 PolarHBondContact O-N 3.28Å; R144-T507 HydrophobicContact CG-CG2 4.49Å
145	L	98	Very high	96.9	Very high	32 Å²	32	79.7 Å²	79.7	17%	0.168	37%	0.37	C	S	.	.	H	α-helix	trans	-60.2	-42.3	177.1	-176.9	72	0	0	0	111.8	L141 Q143 Q148 S149 V504 T507 Q508 I511	L141-L145 WeakPolarHBondContact O-CB 3.43Å; L141-L145 PolarHBondContact O-N 2.96Å; Q143-L145 VanDerWaalsContact C-N 3.29Å; Q143-L145 PolarHBondContact O-N 3.41Å; L145-Q148 PolarHBondContact O-N 2.76Å; L145-S149 WeakPolarHBondContact O-CB 3.37Å; L145-S149 PolarHBondContact O-N 2.85Å; L145-S149 PolarHBondContact O-OG 3.49Å; L145-V504 HydrophobicContact CD1-CG1 3.95Å; L145-T507 HydrophobicContact CB-CG2 3.98Å; L145-T507 HydrophobicContact CD1-CG2 4.16Å; L145-Q508 HydrophobicContact CD1-CB 4.41Å; L145-I511 HydrophobicContact CB-CD1 3.94Å; L145-I511 HydrophobicContact CD2-CD1 3.75Å; L145-I511 HydrophobicContact CG-CD1 4.32Å
146	K	97.4	Very high	96.9	Very high	144 Å²	144	78.1 Å²	78.1	63%	0.626	36%	0.363	S	S	*	.	H	α-helix	trans	-63.5	-42.9	177.7	-72	174.2	-179.9	-176.4	0	112	R142 Q143 R144 S149 L150	R142-K146 WeakPolarHBondContact O-CG 3.45Å; R142-K146 PolarHBondContact O-N 3.02Å; R142-K146 VanDerWaalsContact O-N 3.15Å; Q143-K146 WeakPolarHBondContact O-CB 3.3Å; Q143-K146 PolarHBondContact O-N 3.21Å; Q143-K146 VanDerWaalsContact O-N 3.09Å; R144-K146 VanDerWaalsContact C-N 3.33Å; R144-K146 PolarHBondContact O-N 3.43Å; K146-S149 PolarHBondContact O-N 3.37Å; K146-S149 PolarHBondContact O-OG 3.49Å; K146-L150 WeakPolarHBondContact O-CB 3.48Å; K146-L150 VanDerWaalsContact O-CG 3.28Å; K146-L150 WeakPolarHBondContact O-CG 3.49Å; K146-L150 PolarHBondContact O-N 2.99Å
147	E	96.7	Very high	97	Very high	113 Å²	113	76.9 Å²	76.9	53%	0.528	36%	0.359	S	S	.	.	H	α-helix	trans	-65.9	-43.1	178.3	-69.5	167.8	-168.1	0	0	111	Q143 R144 L150 N151	Q143-E147 WeakPolarHBondContact CG-OE1 3.36Å; Q143-E147 PolarHBondContact NE2-OE1 3.11Å; Q143-E147 VanDerWaalsContact NE2-OE1 3.08Å; Q143-E147 PolarHBondContact O-N 2.94Å; Q143-E147 VanDerWaalsContact O-N 3.09Å; R144-E147 PolarHBondContact O-N 3.42Å; E147-L150 PolarHBondContact O-N 3.2Å; E147-N151 PolarHBondContact O-N 3.49Å
148	Q	96.9	Very high	96.9	Very high	45 Å²	45	75.5 Å²	75.5	21%	0.21	35%	0.352	C	S	.	.	H	α-helix	trans	-66.6	-38.3	176.3	-71.6	178.7	-13.5	0	0	112.8	R144 L145 N151 L152 R503 V504 T507	R144-Q148 HydrophobicContact CG-CG 4.41Å; R144-Q148 WeakPolarHBondContact O-CB 3.44Å; R144-Q148 VanDerWaalsContact O-CG 3.3Å; R144-Q148 WeakPolarHBondContact O-CG 3.41Å; R144-Q148 PolarHBondContact O-N 3.28Å; L145-Q148 PolarHBondContact O-N 2.76Å; Q148-N151 WeakPolarHBondContact O-CB 3.22Å; Q148-N151 PolarHBondContact O-N 2.95Å; Q148-L152 WeakPolarHBondContact O-CB 3.16Å; Q148-L152 PolarHBondContact O-N 3.32Å; Q148-R503 PolarHBondContact OE1-O 2.96Å; Q148-V504 HydrophobicContact CB-CG2 3.81Å; Q148-T507 PolarHBondContact OE1-OG1 2.88Å
149	S	97.6	Very high	96.8	Very high	40 Å²	40	75.5 Å²	75.5	28%	0.28	35%	0.352	S	S	.	.	H	α-helix	trans	-69	-38	177.4	68	0	0	0	0	111.9	L145 K146 L152 I153	L145-S149 WeakPolarHBondContact O-CB 3.37Å; L145-S149 PolarHBondContact O-N 2.85Å; L145-S149 PolarHBondContact O-OG 3.49Å; K146-S149 PolarHBondContact O-N 3.37Å; K146-S149 PolarHBondContact O-OG 3.49Å; S149-L152 WeakPolarHBondContact O-CB 3.16Å; S149-L152 PolarHBondContact O-N 3.01Å; S149-I153 WeakPolarHBondContact O-CG1 3.3Å; S149-I153 PolarHBondContact O-N 3.42Å
150	L	97.3	Very high	96.7	Very high	87 Å²	87	76 Å²	76	46%	0.455	35%	0.351	S	S	.	.	H	α-helix	trans	-65.2	-38	171	-70.6	173.5	0	0	0	111.9	K146 E147 L152 R154	K146-L150 WeakPolarHBondContact O-CB 3.48Å; K146-L150 VanDerWaalsContact O-CG 3.28Å; K146-L150 WeakPolarHBondContact O-CG 3.49Å; K146-L150 PolarHBondContact O-N 2.99Å; E147-L150 PolarHBondContact O-N 3.2Å; L150-L152 VanDerWaalsContact C-N 3.33Å; L150-R154 WeakPolarHBondContact O-CG 3.25Å; L150-R154 PolarHBondContact O-N 3.09Å; L150-R154 PolarHBondContact O-NH1 3.48Å
151	N	96.2	Very high	96.5	Very high	60 Å²	60	78.8 Å²	78.8	32%	0.321	36%	0.359	S	S	.	.	H	α-helix	trans	-63.3	-40.8	173.1	-174.4	-102.4	0	0	0	111.8	E147 Q148 K155	E147-N151 PolarHBondContact O-N 3.49Å; Q148-N151 WeakPolarHBondContact O-CB 3.22Å; Q148-N151 PolarHBondContact O-N 2.95Å; N151-K155 WeakPolarHBondContact O-CG 3.15Å; N151-K155 PolarHBondContact O-N 3.24Å; N151-K155 VanDerWaalsContact O-N 3.16Å; N151-K155 VanDerWaalsContact OD1-CE 3.3Å; N151-K155 WeakPolarHBondContact OD1-CE 3.35Å; N151-K155 PolarHBondContact OD1-NZ 2.92Å
152	L	97.8	Very high	96.3	Very high	22 Å²	22	79 Å²	79	12%	0.115	36%	0.361	C	S	.	.	H	α-helix	trans	-60.7	-52.4	176.4	171.5	60.1	0	0	0	111.5	Q148 S149 L150 R154 K155 E156 A500 R501 V504	Q148-L152 WeakPolarHBondContact O-CB 3.16Å; Q148-L152 PolarHBondContact O-N 3.32Å; S149-L152 WeakPolarHBondContact O-CB 3.16Å; S149-L152 PolarHBondContact O-N 3.01Å; L150-L152 VanDerWaalsContact C-N 3.33Å; L152-R154 VanDerWaalsContact C-N 3.31Å; L152-R154 PolarHBondContact O-N 3.32Å; L152-K155 PolarHBondContact O-N 3.28Å; L152-E156 HydrophobicContact CD1-CG 3.77Å; L152-E156 HydrophobicContact CG-CG 4.33Å; L152-E156 WeakPolarHBondContact O-CG 3.4Å; L152-E156 PolarHBondContact O-N 3.25Å; L152-A500 HydrophobicContact CB-CB 4.24Å; L152-A500 HydrophobicContact CD1-CB 3.94Å; L152-R501 HydrophobicContact CD1-CB 4.32Å; L152-R501 HydrophobicContact CD1-CG 3.35Å; L152-R501 HydrophobicContact CD2-CG 3.97Å; L152-R501 HydrophobicContact CG-CG 4.3Å; L152-V504 HydrophobicContact CB-CG2 4.24Å; L152-V504 HydrophobicContact CD2-CB 4.49Å; L152-V504 HydrophobicContact CD2-CG2 4.14Å
153	I	97.2	Very high	96.1	Very high	79 Å²	79	73.7 Å²	73.7	41%	0.405	34%	0.341	S	S	.	.	H	α-helix	trans	-55.2	-48	-179.3	-68.5	164.3	0	0	0	110.6	S149 K155 E156 E157	S149-I153 WeakPolarHBondContact O-CG1 3.3Å; S149-I153 PolarHBondContact O-N 3.42Å; I153-K155 VanDerWaalsContact C-N 3.29Å; I153-K155 PolarHBondContact O-N 3.01Å; I153-E156 PolarHBondContact O-N 3.25Å; I153-E157 HydrophobicContact CG2-CG 4.26Å; I153-E157 WeakPolarHBondContact CG2-OE1 3.46Å; I153-E157 WeakPolarHBondContact O-CB 3.3Å; I153-E157 WeakPolarHBondContact O-CG 3.29Å; I153-E157 PolarHBondContact O-N 2.97Å
154	R	96.9	Very high	95.9	Very high	150 Å²	150	75.7 Å²	75.7	57%	0.566	35%	0.348	S	S	*	.	H	α-helix	trans	-58.9	-40	178.4	-69.5	179.5	-168.3	111.6	-6.2	112.8	L150 L152 L158	L150-R154 WeakPolarHBondContact O-CG 3.25Å; L150-R154 PolarHBondContact O-N 3.09Å; L150-R154 PolarHBondContact O-NH1 3.48Å; L152-R154 VanDerWaalsContact C-N 3.31Å; L152-R154 PolarHBondContact O-N 3.32Å; R154-L158 WeakPolarHBondContact O-CB 3.48Å; R154-L158 PolarHBondContact O-N 2.95Å
155	K	95.5	Very high	95.6	Very high	41 Å²	41	72.2 Å²	72.2	18%	0.178	34%	0.337	C	S	.	.	H	α-helix	trans	-70.5	-37.8	178.1	-76.4	175.2	169.5	170.6	0	112.2	N151 L152 I153 L159 Q496 A497 A500	N151-K155 WeakPolarHBondContact O-CG 3.15Å; N151-K155 PolarHBondContact O-N 3.24Å; N151-K155 VanDerWaalsContact O-N 3.16Å; N151-K155 VanDerWaalsContact OD1-CE 3.3Å; N151-K155 WeakPolarHBondContact OD1-CE 3.35Å; N151-K155 PolarHBondContact OD1-NZ 2.92Å; L152-K155 PolarHBondContact O-N 3.28Å; I153-K155 VanDerWaalsContact C-N 3.29Å; I153-K155 PolarHBondContact O-N 3.01Å; K155-L159 VanDerWaalsContact O-CB 3.24Å; K155-L159 WeakPolarHBondContact O-CB 3.44Å; K155-L159 PolarHBondContact O-N 3.06Å; K155-Q496 HydrophobicContact CD-CB 4.5Å; K155-A497 HydrophobicContact CB-CB 4.39Å; K155-A500 HydrophobicContact CD-CB 3.82Å
156	E	96.3	Very high	95.2	Very high	61 Å²	61	70.8 Å²	70.8	29%	0.285	33%	0.33	S	S	.	.	H	α-helix	trans	-67.5	-42.7	175.7	-70.2	-178.1	143	0	0	111.8	L152 I153 L159 E160 R501	L152-E156 HydrophobicContact CD1-CG 3.77Å; L152-E156 HydrophobicContact CG-CG 4.33Å; L152-E156 WeakPolarHBondContact O-CG 3.4Å; L152-E156 PolarHBondContact O-N 3.25Å; I153-E156 PolarHBondContact O-N 3.25Å; E156-L159 WeakPolarHBondContact O-CB 3.47Å; E156-L159 PolarHBondContact O-N 3.47Å; E156-E160 WeakPolarHBondContact O-CB 3.47Å; E156-E160 PolarHBondContact O-N 3.39Å; E156-R501 IonicContact OE1-CZ 2.75Å; E156-R501 IonicContact OE1-NE 3.82Å; E156-R501 PolarHBondContact OE1-NE 3.39Å; E156-R501 IonicContact OE1-NH2 3.71Å; E156-R501 PolarHBondContact OE1-NH2 3.27Å
157	E	96.1	Very high	94.8	Very high	117 Å²	117	69.4 Å²	69.4	55%	0.547	33%	0.326	S	S	.	.	H	α-helix	trans	-61.9	-43.3	174.7	-72.4	172.4	169.5	0	0	111.7	I153 E160 K161	I153-E157 HydrophobicContact CG2-CG 4.26Å; I153-E157 WeakPolarHBondContact CG2-OE1 3.46Å; I153-E157 WeakPolarHBondContact O-CB 3.3Å; I153-E157 WeakPolarHBondContact O-CG 3.29Å; I153-E157 PolarHBondContact O-N 2.97Å; E157-E160 PolarHBondContact O-N 2.9Å; E157-K161 VanDerWaalsContact O-CB 3.28Å; E157-K161 WeakPolarHBondContact O-CB 2.99Å; E157-K161 PolarHBondContact O-N 3.35Å
158	L	94.4	Very high	94.4	Very high	32 Å²	32	64.5 Å²	64.5	17%	0.168	30%	0.303	C	S	.	.	H	α-helix	trans	-63.7	-45.7	175.7	-177.9	62.4	0	0	0	111.3	R154 K161 V162 V317 Y493	R154-L158 WeakPolarHBondContact O-CB 3.48Å; R154-L158 PolarHBondContact O-N 2.95Å; L158-K161 PolarHBondContact O-N 3.02Å; L158-V162 HydrophobicContact CD1-CG2 4.1Å; L158-V162 HydrophobicContact CG-CG2 4.49Å; L158-V162 VanDerWaalsContact O-CG2 3.3Å; L158-V162 WeakPolarHBondContact O-CG2 3.38Å; L158-V162 PolarHBondContact O-N 3.45Å; L158-V317 HydrophobicContact CD1-CG1 3.94Å; L158-V317 HydrophobicContact CD1-CG2 4.02Å; L158-V317 HydrophobicContact CD2-CG2 3.9Å; L158-Y493 HydrophobicContact CD2-CD1 3.96Å; L158-Y493 HydrophobicContact CD2-CE1 3.57Å; L158-Y493 HydrophobicContact CG-CD1 4.35Å; L158-Y493 HydrophobicContact CG-CE1 4.15Å
159	L	95.1	Very high	93.9	Very high	3 Å²	3	66.9 Å²	66.9	2%	0.016	32%	0.318	C	S	.	.	H	α-helix	trans	-57.3	-50.6	176.5	179.2	67.7	0	0	0	111	K155 E156 K161 V162 Y163 V170 R494 A497	K155-L159 VanDerWaalsContact O-CB 3.24Å; K155-L159 WeakPolarHBondContact O-CB 3.44Å; K155-L159 PolarHBondContact O-N 3.06Å; E156-L159 WeakPolarHBondContact O-CB 3.47Å; E156-L159 PolarHBondContact O-N 3.47Å; L159-K161 PolarHBondContact O-N 2.91Å; L159-V162 PolarHBondContact O-N 3.11Å; L159-Y163 HydrophobicContact CD1-CD2 3.47Å; L159-Y163 VanDerWaalsContact CD1-CD2 3.47Å; L159-Y163 HydrophobicContact CD1-CE2 3.21Å; L159-Y163 HydrophobicContact CD1-CG 4.4Å; L159-Y163 HydrophobicContact CG-CD2 4.18Å; L159-Y163 HydrophobicContact CG-CE2 4.3Å; L159-Y163 VanDerWaalsContact O-CB 3.31Å; L159-Y163 WeakPolarHBondContact O-CB 3.32Å; L159-Y163 VanDerWaalsContact O-CD2 3.32Å; L159-Y163 WeakPolarHBondContact O-CD2 3.32Å; L159-Y163 PolarHBondContact O-N 2.95Å; L159-V170 HydrophobicContact CD2-CG1 3.77Å; L159-V170 HydrophobicContact CG-CG1 4.38Å; L159-R494 HydrophobicContact CD1-CB 4.09Å; L159-A497 HydrophobicContact CD2-CB 4Å
160	E	94.7	Very high	93.3	Very high	123 Å²	123	67.2 Å²	67.2	58%	0.575	32%	0.318	S	S	*	.	H	α-helix	trans	-61.7	-43.6	179.6	-174.6	177.5	176.8	0	0	111.5	E156 E157 K164	E156-E160 WeakPolarHBondContact O-CB 3.47Å; E156-E160 PolarHBondContact O-N 3.39Å; E157-E160 PolarHBondContact O-N 2.9Å; E160-K164 WeakPolarHBondContact O-CB 3.44Å; E160-K164 PolarHBondContact O-N 2.85Å
161	K	93.5	Very high	92.7	Very high	137 Å²	137	71.5 Å²	71.5	60%	0.596	33%	0.333	S	S	*	.	H	α-helix	trans	-58.8	-50.9	177.7	-176.8	-175.3	176.4	-170.8	0	111.5	E157 L158 L159 E165	E157-K161 VanDerWaalsContact O-CB 3.28Å; E157-K161 WeakPolarHBondContact O-CB 2.99Å; E157-K161 PolarHBondContact O-N 3.35Å; L158-K161 PolarHBondContact O-N 3.02Å; L159-K161 PolarHBondContact O-N 2.91Å; K161-E165 PolarHBondContact O-N 3.06Å; K161-E165 VanDerWaalsContact O-N 3.12Å
162	V	91.9	Very high	92.2	Very high	18 Å²	18	71.5 Å²	71.5	11%	0.109	33%	0.331	C	S	.	.	H	α-helix	trans	-69.4	-41.2	-177.1	178.8	0	0	0	0	110.9	L158 L159 E165 F166 L490 Y493	L158-V162 HydrophobicContact CD1-CG2 4.1Å; L158-V162 HydrophobicContact CG-CG2 4.49Å; L158-V162 VanDerWaalsContact O-CG2 3.3Å; L158-V162 WeakPolarHBondContact O-CG2 3.38Å; L158-V162 PolarHBondContact O-N 3.45Å; L159-V162 PolarHBondContact O-N 3.11Å; V162-E165 WeakPolarHBondContact O-CB 3.4Å; V162-E165 PolarHBondContact O-N 3.44Å; V162-F166 HydrophobicContact CG1-CD2 4.36Å; V162-F166 HydrophobicContact CG1-CE2 4.11Å; V162-F166 WeakPolarHBondContact O-CD2 3.45Å; V162-L490 HydrophobicContact CG1-CD2 3.33Å; V162-Y493 HydrophobicContact CG1-CD2 4.29Å; V162-Y493 HydrophobicContact CG1-CE2 4.22Å; V162-Y493 HydrophobicContact CG2-CE2 4.27Å
163	Y	94.2	Very high	91.7	Very high	1 Å²	1	77.9 Å²	77.9	0%	0.004	36%	0.36	C	S	.	.	H	α-helix	trans	-66	-40.3	178.1	-90.4	-118.6	0	0	0	112.4	L159 E165 F166 H167 V168 D169 V170 V175 L490	L159-Y163 HydrophobicContact CD1-CD2 3.47Å; L159-Y163 VanDerWaalsContact CD1-CD2 3.47Å; L159-Y163 HydrophobicContact CD1-CE2 3.21Å; L159-Y163 HydrophobicContact CD1-CG 4.4Å; L159-Y163 HydrophobicContact CG-CD2 4.18Å; L159-Y163 HydrophobicContact CG-CE2 4.3Å; L159-Y163 VanDerWaalsContact O-CB 3.31Å; L159-Y163 WeakPolarHBondContact O-CB 3.32Å; L159-Y163 VanDerWaalsContact O-CD2 3.32Å; L159-Y163 WeakPolarHBondContact O-CD2 3.32Å; L159-Y163 PolarHBondContact O-N 2.95Å; Y163-E165 VanDerWaalsContact C-N 3.3Å; Y163-E165 PolarHBondContact O-N 3.31Å; Y163-F166 PolarHBondContact O-N 3.5Å; Y163-H167 PolarHBondContact O-N 3.39Å; Y163-V168 CarbonylContact C-O 3.45Å; Y163-V168 WeakPolarHBondContact CB-O 3.3Å; Y163-V168 HydrophobicContact CD1-CB 3.88Å; Y163-V168 HydrophobicContact CD1-CG1 3.61Å; Y163-V168 HydrophobicContact CE1-CB 4.48Å; Y163-V168 HydrophobicContact CE1-CG1 3.78Å; Y163-V168 HydrophobicContact CG-CB 4.47Å; Y163-V168 PolarHBondContact O-N 3.28Å; Y163-D169 WeakPolarHBondContact CD1-O 3.32Å; Y163-V170 HydrophobicContact CD1-CG2 4.41Å; Y163-V170 HydrophobicContact CG-CG2 4.46Å; Y163-V175 HydrophobicContact CE1-CG2 4.38Å; Y163-L490 HydrophobicContact CD2-CD2 4.23Å; Y163-L490 HydrophobicContact CE2-CB 4Å; Y163-L490 HydrophobicContact CE2-CD2 4.12Å; Y163-L490 PolarHBondContact OH-O 3.22Å
164	K	93.1	Very high	91.4	Very high	155 Å²	155	76.7 Å²	76.7	67%	0.674	35%	0.354	S	S	*	.	H	α-helix	trans	-63.5	-36	175.9	-175.4	177.1	-179.6	178.2	0	112.3	E160 F166 H167	E160-K164 WeakPolarHBondContact O-CB 3.44Å; E160-K164 PolarHBondContact O-N 2.85Å; K164-F166 PolarHBondContact O-N 3.28Å; K164-H167 PolarHBondContact O-N 3.1Å; K164-H167 VanDerWaalsContact O-N 3.17Å
165	E	89.9	Confident	91.2	Very high	56 Å²	56	69.7 Å²	69.7	26%	0.262	33%	0.328	S	S	.	.	H	α-helix	trans	-59.2	-32.2	176.2	179.5	175.6	177.8	0	0	112.6	K161 V162 Y163 S468 S469	K161-E165 PolarHBondContact O-N 3.06Å; K161-E165 VanDerWaalsContact O-N 3.12Å; V162-E165 WeakPolarHBondContact O-CB 3.4Å; V162-E165 PolarHBondContact O-N 3.44Å; Y163-E165 VanDerWaalsContact C-N 3.3Å; Y163-E165 PolarHBondContact O-N 3.31Å; E165-S468 WeakPolarHBondContact OE1-CB 3.41Å; E165-S468 PolarHBondContact OE1-OG 3.3Å; E165-S469 WeakPolarHBondContact O-CB 3.32Å; E165-S469 PolarHBondContact OE1-N 2.93Å; E165-S469 VanDerWaalsContact OE1-N 3.07Å
166	F	90.2	Very high	91.1	Very high	2 Å²	2	69.7 Å²	69.7	1%	0.009	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101	9.4	177.8	-64.1	-70.4	0	0	0	114.2	V162 Y163 K164 V168 L179 Q472 L473 L486 L490	V162-F166 HydrophobicContact CG1-CD2 4.36Å; V162-F166 HydrophobicContact CG1-CE2 4.11Å; V162-F166 WeakPolarHBondContact O-CD2 3.45Å; Y163-F166 PolarHBondContact O-N 3.5Å; K164-F166 PolarHBondContact O-N 3.28Å; F166-V168 HydrophobicContact CB-CG2 3.75Å; F166-V168 PolarHBondContact O-N 3.07Å; F166-L179 HydrophobicContact CB-CD2 4Å; F166-L179 HydrophobicContact CD1-CD2 3.95Å; F166-L179 HydrophobicContact CG-CD2 3.97Å; F166-Q472 HydrophobicContact CE1-CB 3.94Å; F166-Q472 HydrophobicContact CZ-CB 4.07Å; F166-Q472 HydrophobicContact CZ-CG 4.4Å; F166-Q472 VanDerWaalsContact CZ-OE1 3.28Å; F166-L473 HydrophobicContact CD1-CD2 4.32Å; F166-L486 HydrophobicContact CE1-CD2 4.07Å; F166-L486 HydrophobicContact CE2-CD1 4.37Å; F166-L486 HydrophobicContact CZ-CD1 4.26Å; F166-L486 HydrophobicContact CZ-CD2 4.2Å; F166-L490 HydrophobicContact CD2-CD1 4.34Å; F166-L490 HydrophobicContact CD2-CD2 4.17Å; F166-L490 HydrophobicContact CE2-CD2 4.4Å
167	H	88.3	Confident	90.9	Very high	116 Å²	116	68 Å²	68	54%	0.537	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.2	36.8	-175.2	-57	-68.2	0	0	0	113.5	Y163 K164 R178 E182	Y163-H167 PolarHBondContact O-N 3.39Å; K164-H167 PolarHBondContact O-N 3.1Å; K164-H167 VanDerWaalsContact O-N 3.17Å; H167-R178 PolarHBondContact O-NE 2.7Å; H167-R178 PolarHBondContact O-NH2 3.3Å; H167-E182 IonicContact CD2-OE1 2.8Å; H167-E182 PolarHBondContact CD2-OE1 3.29Å
168	V	88.5	Confident	90.8	Very high	9 Å²	9	65.8 Å²	65.8	6%	0.055	31%	0.307	C	S	.	.			trans	-102.4	132.6	175.8	-173	0	0	0	0	108.2	Y163 F166 E172 V175 R178	Y163-V168 CarbonylContact C-O 3.45Å; Y163-V168 WeakPolarHBondContact CB-O 3.3Å; Y163-V168 HydrophobicContact CD1-CB 3.88Å; Y163-V168 HydrophobicContact CD1-CG1 3.61Å; Y163-V168 HydrophobicContact CE1-CB 4.48Å; Y163-V168 HydrophobicContact CE1-CG1 3.78Å; Y163-V168 HydrophobicContact CG-CB 4.47Å; Y163-V168 PolarHBondContact O-N 3.28Å; F166-V168 HydrophobicContact CB-CG2 3.75Å; F166-V168 PolarHBondContact O-N 3.07Å; V168-E172 HydrophobicContact CG1-CB 3.68Å; V168-E172 HydrophobicContact CG1-CG 3.99Å; V168-V175 HydrophobicContact CG1-CG2 4.41Å; V168-R178 HydrophobicContact CB-CG 4.36Å; V168-R178 HydrophobicContact CG1-CG 4.43Å; V168-R178 HydrophobicContact CG2-CB 4.3Å; V168-R178 HydrophobicContact CG2-CG 3.76Å
169	D	88.2	Confident	90.8	Very high	96 Å²	96	64.3 Å²	64.3	51%	0.513	30%	0.299	S	S	.	.			trans	-74	142.2	169.1	-170.1	-22.1	0	0	0	109.1	Y163 K171 E172	Y163-D169 WeakPolarHBondContact CD1-O 3.32Å; D169-K171 PolarHBondContact O-N 3Å; D169-K171 VanDerWaalsContact O-N 3.1Å; D169-K171 PolarHBondContact OD1-N 3.09Å; D169-E172 WeakPolarHBondContact O-CB 3.42Å; D169-E172 PolarHBondContact O-N 3.37Å
170	V	84.2	Confident	90.7	Very high	46 Å²	46	64.1 Å²	64.1	28%	0.279	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-28.1	173.1	-179.5	0	0	0	0	111.7	L159 Y163	L159-V170 HydrophobicContact CD2-CG1 3.77Å; L159-V170 HydrophobicContact CG-CG1 4.38Å; Y163-V170 HydrophobicContact CD1-CG2 4.41Å; Y163-V170 HydrophobicContact CG-CG2 4.46Å
171	K	85	Confident	90.7	Very high	178 Å²	178	60.8 Å²	60.8	77%	0.774	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-1.9	176.4	-63.4	-178.2	-178.2	176.3	0	114.7	D169 E173	D169-K171 PolarHBondContact O-N 3Å; D169-K171 VanDerWaalsContact O-N 3.1Å; D169-K171 PolarHBondContact OD1-N 3.09Å; K171-E173 PolarHBondContact O-N 2.6Å
172	E	85.7	Confident	90.7	Very high	60 Å²	60	55.7 Å²	55.7	28%	0.28	26%	0.26	S	S	.	.			trans	-61.9	124	-179.5	-175.8	55.5	-120.9	0	0	110.6	V168 D169 N174 R178 R494	V168-E172 HydrophobicContact CG1-CB 3.68Å; V168-E172 HydrophobicContact CG1-CG 3.99Å; D169-E172 WeakPolarHBondContact O-CB 3.42Å; D169-E172 PolarHBondContact O-N 3.37Å; E172-N174 PolarHBondContact OE1-N 3.46Å; E172-R178 HydrophobicContact CG-CB 4.32Å; E172-R494 PolarHBondContact O-NH1 3.35Å
173	E	86	Confident	90.8	Very high	156 Å²	156	54.8 Å²	54.8	73%	0.729	26%	0.255	S	S	*	.	S	Bend	trans	-78.7	-40	176.8	-66.7	-177.3	177.8	0	0	110.2	K171 V175	K171-E173 PolarHBondContact O-N 2.6Å; E173-V175 PolarHBondContact O-N 2.91Å
174	N	91	Very high	90.8	Very high	53 Å²	53	59 Å²	59	28%	0.283	28%	0.275	S	S	.	.			trans	-104.1	62.5	-173.9	-62.9	-61.5	0	0	0	111.7	E172 R176 L177 R178 V276	E172-N174 PolarHBondContact OE1-N 3.46Å; N174-R176 PolarHBondContact O-N 2.69Å; N174-R176 VanDerWaalsContact O-N 3.14Å; N174-L177 HydrophobicContact CB-CB 3.93Å; N174-L177 WeakPolarHBondContact O-CB 3.33Å; N174-L177 PolarHBondContact O-N 2.91Å; N174-R178 PolarHBondContact O-N 3.35Å; N174-R178 VanDerWaalsContact O-N 3.12Å; N174-V276 HydrophobicContact CB-CG2 4.36Å
175	V	92.5	Very high	90.8	Very high	3 Å²	3	55.8 Å²	55.8	2%	0.018	26%	0.261	C	S	.	.	H	α-helix	trans	-50.8	-41.8	179	178.3	0	0	0	0	111.7	Y163 V168 E173 L177 R178 L179 L490 L491	Y163-V175 HydrophobicContact CE1-CG2 4.38Å; V168-V175 HydrophobicContact CG1-CG2 4.41Å; E173-V175 PolarHBondContact O-N 2.91Å; V175-L177 PolarHBondContact O-N 2.83Å; V175-R178 PolarHBondContact O-N 3.07Å; V175-L179 HydrophobicContact CG1-CD1 4.3Å; V175-L179 HydrophobicContact CG1-CG 4.47Å; V175-L179 WeakPolarHBondContact O-CG 3.38Å; V175-L179 PolarHBondContact O-N 3.37Å; V175-L490 HydrophobicContact CG1-CB 3.99Å; V175-L490 HydrophobicContact CG1-CD1 3.54Å; V175-L490 HydrophobicContact CG1-CG 4.41Å; V175-L491 HydrophobicContact CG2-CD2 4.04Å
176	R	93.8	Very high	91	Very high	41 Å²	41	53.4 Å²	53.4	16%	0.155	25%	0.25	C	S	.	.	H	α-helix	trans	-59.2	-47.1	177.9	-177.2	-177.4	171.5	79.2	-3.4	113	N174 R178 L179 L180 E272 L483 D484 T487	N174-R176 PolarHBondContact O-N 2.69Å; N174-R176 VanDerWaalsContact O-N 3.14Å; R176-R178 VanDerWaalsContact C-N 3.29Å; R176-R178 PolarHBondContact O-N 2.97Å; R176-L179 PolarHBondContact O-N 3.46Å; R176-L180 HydrophobicContact CG-CD1 4.49Å; R176-L180 PolarHBondContact O-N 3.35Å; R176-L180 VanDerWaalsContact O-N 3.15Å; R176-E272 HydrophobicContact CG-CG 4.32Å; R176-E272 IonicContact NE-OE1 3.34Å; R176-E272 IonicContact NE-OE2 3.59Å; R176-E272 PolarHBondContact NE-OE2 3.41Å; R176-L483 HydrophobicContact CG-CD1 4.5Å; R176-L483 HydrophobicContact CG-CD2 4.27Å; R176-L483 HydrophobicContact CG-CG 4.36Å; R176-L483 VanDerWaalsContact CZ-CD2 3.45Å; R176-L483 VanDerWaalsContact NH1-CD2 3.26Å; R176-L483 VanDerWaalsContact NH1-CG 3.34Å; R176-D484 IonicContact CZ-OD1 3.76Å; R176-D484 IonicContact NH1-OD1 2.73Å; R176-D484 PolarHBondContact NH1-OD1 3.23Å; R176-D484 IonicContact NH2-OD1 3.84Å; R176-T487 HydrophobicContact CB-CG2 4Å
177	L	93.1	Very high	91.1	Very high	26 Å²	26	54.3 Å²	54.3	14%	0.136	26%	0.256	C	S	.	.	H	α-helix	trans	-61.5	-43.9	178.8	176	63.6	0	0	0	109.8	N174 V175 L179 L180 E181 L269 E272 K273 V276	N174-L177 HydrophobicContact CB-CB 3.93Å; N174-L177 WeakPolarHBondContact O-CB 3.33Å; N174-L177 PolarHBondContact O-N 2.91Å; V175-L177 PolarHBondContact O-N 2.83Å; L177-L179 PolarHBondContact O-N 3.15Å; L177-L180 WeakPolarHBondContact O-CB 3.08Å; L177-L180 PolarHBondContact O-N 2.85Å; L177-L180 VanDerWaalsContact O-N 3.16Å; L177-E181 WeakPolarHBondContact O-CG 3.17Å; L177-E181 PolarHBondContact O-N 2.87Å; L177-L269 HydrophobicContact CD1-CD1 3.65Å; L177-E272 HydrophobicContact CB-CG 4.38Å; L177-E272 HydrophobicContact CD1-CB 4.34Å; L177-K273 HydrophobicContact CD1-CG 3.68Å; L177-V276 HydrophobicContact CD2-CG2 4.28Å
178	R	92.6	Very high	91.3	Very high	71 Å²	71	55 Å²	55	27%	0.268	26%	0.261	S	S	.	.	H	α-helix	trans	-63.6	-41.3	-179.5	-172.3	58.1	-178.9	172	-1.5	112.9	H167 V168 E172 N174 V175 R176 L180 E181 E182	H167-R178 PolarHBondContact O-NE 2.7Å; H167-R178 PolarHBondContact O-NH2 3.3Å; V168-R178 HydrophobicContact CB-CG 4.36Å; V168-R178 HydrophobicContact CG1-CG 4.43Å; V168-R178 HydrophobicContact CG2-CB 4.3Å; V168-R178 HydrophobicContact CG2-CG 3.76Å; E172-R178 HydrophobicContact CG-CB 4.32Å; N174-R178 PolarHBondContact O-N 3.35Å; N174-R178 VanDerWaalsContact O-N 3.12Å; V175-R178 PolarHBondContact O-N 3.07Å; R176-R178 VanDerWaalsContact C-N 3.29Å; R176-R178 PolarHBondContact O-N 2.97Å; R178-L180 VanDerWaalsContact C-N 3.31Å; R178-L180 PolarHBondContact O-N 2.98Å; R178-E181 IonicContact CZ-OE2 3.47Å; R178-E181 IonicContact NH1-OE2 2.65Å; R178-E181 PolarHBondContact NH1-OE2 2.86Å; R178-E181 PolarHBondContact O-N 3.45Å; R178-E182 PolarHBondContact O-N 2.98Å; R178-E182 VanDerWaalsContact O-N 3.08Å
179	L	94.4	Very high	91.6	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-61.1	-38.9	173.8	-72.8	175.9	0	0	0	112.3	F166 V175 R176 L177 E182 A183 I476 L483 L486 L490	F166-L179 HydrophobicContact CB-CD2 4Å; F166-L179 HydrophobicContact CD1-CD2 3.95Å; F166-L179 HydrophobicContact CG-CD2 3.97Å; V175-L179 HydrophobicContact CG1-CD1 4.3Å; V175-L179 HydrophobicContact CG1-CG 4.47Å; V175-L179 WeakPolarHBondContact O-CG 3.38Å; V175-L179 PolarHBondContact O-N 3.37Å; R176-L179 PolarHBondContact O-N 3.46Å; L177-L179 PolarHBondContact O-N 3.15Å; L179-E182 PolarHBondContact O-N 3.49Å; L179-A183 VanDerWaalsContact O-CB 3.3Å; L179-A183 WeakPolarHBondContact O-CB 3.48Å; L179-A183 PolarHBondContact O-N 3.42Å; L179-I476 HydrophobicContact CB-CD1 4.23Å; L179-L483 HydrophobicContact CB-CD1 3.86Å; L179-L483 HydrophobicContact CD1-CD1 4.15Å; L179-L486 HydrophobicContact CD1-CB 4.39Å; L179-L486 HydrophobicContact CD1-CD2 3.97Å; L179-L486 HydrophobicContact CD1-CG 3.97Å; L179-L486 HydrophobicContact CD2-CD2 3.9Å; L179-L490 HydrophobicContact CD1-CD1 3.99Å; L179-L490 HydrophobicContact CD2-CD1 4.07Å; L179-L490 HydrophobicContact CG-CD1 4.3Å
180	L	94.6	Very high	92	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-67.2	-41.3	176.5	-76.9	166.5	0	0	0	112.3	R176 L177 R178 E182 A183 E184 V265 L268 L269 E272 L483	R176-L180 HydrophobicContact CG-CD1 4.49Å; R176-L180 PolarHBondContact O-N 3.35Å; R176-L180 VanDerWaalsContact O-N 3.15Å; L177-L180 WeakPolarHBondContact O-CB 3.08Å; L177-L180 PolarHBondContact O-N 2.85Å; L177-L180 VanDerWaalsContact O-N 3.16Å; R178-L180 VanDerWaalsContact C-N 3.31Å; R178-L180 PolarHBondContact O-N 2.98Å; L180-E182 VanDerWaalsContact C-N 3.28Å; L180-E182 PolarHBondContact O-N 3.32Å; L180-A183 PolarHBondContact O-N 2.83Å; L180-E184 WeakPolarHBondContact O-CB 3.44Å; L180-E184 PolarHBondContact O-N 3.18Å; L180-V265 HydrophobicContact CD2-CG1 4.22Å; L180-L268 HydrophobicContact CD1-CB 4.24Å; L180-L268 HydrophobicContact CD2-CB 3.85Å; L180-L269 HydrophobicContact CB-CB 4.33Å; L180-L269 HydrophobicContact CB-CD1 3.72Å; L180-E272 HydrophobicContact CD1-CB 3.95Å; L180-E272 HydrophobicContact CD1-CG 4.31Å; L180-L483 HydrophobicContact CD1-CD2 3.94Å; L180-L483 HydrophobicContact CD2-CD2 3.6Å; L180-L483 HydrophobicContact CG-CD1 4.29Å; L180-L483 HydrophobicContact CG-CD2 3.71Å
181	E	94.3	Very high	92.5	Very high	52 Å²	52	54.6 Å²	54.6	24%	0.243	26%	0.255	C	S	.	.	H	α-helix	trans	-61.8	-37.5	174.9	-70	-179.3	163.4	0	0	112.2	L177 R178 K185 L269	L177-E181 WeakPolarHBondContact O-CG 3.17Å; L177-E181 PolarHBondContact O-N 2.87Å; R178-E181 IonicContact CZ-OE2 3.47Å; R178-E181 IonicContact NH1-OE2 2.65Å; R178-E181 PolarHBondContact NH1-OE2 2.86Å; R178-E181 PolarHBondContact O-N 3.45Å; E181-K185 WeakPolarHBondContact O-CE 3.06Å; E181-K185 WeakPolarHBondContact O-CG 3.42Å; E181-L269 HydrophobicContact CG-CD1 3.93Å
182	E	93.2	Very high	93	Very high	30 Å²	30	52.4 Å²	52.4	14%	0.14	25%	0.248	C	C	.	.	H	α-helix	trans	-74.5	-37.5	177.4	-158.2	59.4	-159	0	0	111.5	H167 R178 L179 L180 E184 K185 V186 L473	H167-E182 IonicContact CD2-OE1 2.8Å; H167-E182 PolarHBondContact CD2-OE1 3.29Å; R178-E182 PolarHBondContact O-N 2.98Å; R178-E182 VanDerWaalsContact O-N 3.08Å; L179-E182 PolarHBondContact O-N 3.49Å; L180-E182 VanDerWaalsContact C-N 3.28Å; L180-E182 PolarHBondContact O-N 3.32Å; E182-E184 VanDerWaalsContact C-N 3.28Å; E182-E184 PolarHBondContact O-N 3.28Å; E182-K185 PolarHBondContact O-N 3.07Å; E182-K185 IonicContact OE2-NZ 2.75Å; E182-K185 PolarHBondContact OE2-NZ 3.31Å; E182-V186 VanDerWaalsContact O-CG2 3.32Å; E182-V186 WeakPolarHBondContact O-CG2 3.31Å; E182-L473 HydrophobicContact CB-CD1 4.46Å; E182-L473 HydrophobicContact CB-CD2 4Å; E182-L473 HydrophobicContact CG-CD1 3.76Å; E182-L473 HydrophobicContact CG-CD2 4.15Å
183	A	93.3	Very high	93.5	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-65.6	-27.5	173.5	0	0	0	0	0	113.2	L179 L180 V265 L473 I476 R477	L179-A183 VanDerWaalsContact O-CB 3.3Å; L179-A183 WeakPolarHBondContact O-CB 3.48Å; L179-A183 PolarHBondContact O-N 3.42Å; L180-A183 PolarHBondContact O-N 2.83Å; A183-V265 HydrophobicContact CB-CG1 4.17Å; A183-V265 HydrophobicContact CB-CG2 4.37Å; A183-L473 HydrophobicContact CB-CD2 4.39Å; A183-I476 HydrophobicContact CB-CB 4.37Å; A183-I476 HydrophobicContact CB-CG2 3.98Å; A183-R477 WeakPolarHBondContact O-CD 3.38Å; A183-R477 PolarHBondContact O-NH1 3.2Å
184	E	94.2	Very high	94	Very high	89 Å²	89	42.6 Å²	42.6	42%	0.416	20%	0.202	S	C	.	.	H	α-helix	trans	-69.2	-32.9	175.6	-177	179	-140.3	0	0	112.2	L180 E182 V186 P187 V265 L269	L180-E184 WeakPolarHBondContact O-CB 3.44Å; L180-E184 PolarHBondContact O-N 3.18Å; E182-E184 VanDerWaalsContact C-N 3.28Å; E182-E184 PolarHBondContact O-N 3.28Å; E184-V186 VanDerWaalsContact C-N 3.34Å; E184-V186 PolarHBondContact O-N 3.16Å; E184-P187 WeakPolarHBondContact O-CD 3.23Å; E184-V265 HydrophobicContact CB-CG1 4.27Å; E184-L269 HydrophobicContact CB-CD2 4.25Å; E184-L269 HydrophobicContact CG-CD2 4.3Å; E184-L269 WeakPolarHBondContact OE2-CD2 3.12Å
185	K	93.1	Very high	94.2	Very high	88 Å²	88	46.5 Å²	46.5	38%	0.383	22%	0.218	S	C	.	.	H	α-helix	trans	-79.3	-16	-177.3	-64.1	171.4	-156.6	156.6	0	113.8	E181 E182 M188 F189	E181-K185 WeakPolarHBondContact O-CE 3.06Å; E181-K185 WeakPolarHBondContact O-CG 3.42Å; E182-K185 PolarHBondContact O-N 3.07Å; E182-K185 IonicContact OE2-NZ 2.75Å; E182-K185 PolarHBondContact OE2-NZ 3.31Å; K185-M188 WeakPolarHBondContact O-CB 3.49Å; K185-M188 PolarHBondContact O-N 3.14Å; K185-M188 VanDerWaalsContact O-N 3.1Å; K185-F189 PolarHBondContact O-N 3.46Å
186	V	93.7	Very high	94.4	Very high	6 Å²	6	47.7 Å²	47.7	4%	0.036	23%	0.227	C	C	.	.	H	α-helix	trans	-62.3	-41	-169.5	-160.9	0	0	0	0	114.1	E182 E184 M188 F189 L190 L470 L473 M474	E182-V186 VanDerWaalsContact O-CG2 3.32Å; E182-V186 WeakPolarHBondContact O-CG2 3.31Å; E184-V186 VanDerWaalsContact C-N 3.34Å; E184-V186 PolarHBondContact O-N 3.16Å; V186-M188 PolarHBondContact O-N 3.03Å; V186-F189 WeakPolarHBondContact O-CB 3.37Å; V186-F189 PolarHBondContact O-N 3.34Å; V186-F189 VanDerWaalsContact O-N 3.15Å; V186-L190 HydrophobicContact CG1-CD1 4.34Å; V186-L190 HydrophobicContact CG1-CG 4.26Å; V186-L190 WeakPolarHBondContact O-CG 3.37Å; V186-L190 PolarHBondContact O-N 3.01Å; V186-L470 HydrophobicContact CG1-CD1 3.26Å; V186-L473 HydrophobicContact CG2-CB 3.86Å; V186-L473 HydrophobicContact CG2-CD1 4.12Å; V186-M474 HydrophobicContact CB-CE 3.52Å; V186-M474 HydrophobicContact CG1-CE 3.02Å; V186-M474 HydrophobicContact CG2-CE 4.35Å
187	P	92.6	Very high	94.5	Very high	21 Å²	21	45.8 Å²	45.8	14%	0.136	22%	0.22	C	C	.	.	H	α-helix	trans	-59.5	-34.6	175.4	-26	36.5	0	0	0	113.1	E184 T191 R477	E184-P187 WeakPolarHBondContact O-CD 3.23Å; P187-T191 WeakPolarHBondContact O-CB 3.33Å; P187-T191 PolarHBondContact O-N 2.62Å; P187-T191 PolarHBondContact O-OG1 3.21Å; P187-R477 VanDerWaalsContact CG-NH2 3.3Å
188	M	93.9	Very high	94.7	Very high	129 Å²	129	47.1 Å²	47.1	64%	0.635	23%	0.229	S	C	*	.	H	α-helix	trans	-66.9	-48.1	174.3	-65.5	-178.5	58.5	0	0	110.7	K185 V186 L190 T191 E192	K185-M188 WeakPolarHBondContact O-CB 3.49Å; K185-M188 PolarHBondContact O-N 3.14Å; K185-M188 VanDerWaalsContact O-N 3.1Å; V186-M188 PolarHBondContact O-N 3.03Å; M188-L190 VanDerWaalsContact C-N 3.31Å; M188-L190 PolarHBondContact O-N 3.45Å; M188-T191 WeakPolarHBondContact O-CB 3.49Å; M188-T191 PolarHBondContact O-N 3.49Å; M188-T191 VanDerWaalsContact O-N 3.09Å; M188-E192 PolarHBondContact O-N 3.31Å
189	F	94.4	Very high	94.8	Very high	87 Å²	87	51.4 Å²	51.4	38%	0.382	25%	0.246	S	C	.	.	H	α-helix	trans	-56.6	-43.6	175.1	171.1	-96.4	0	0	0	112.3	K185 V186 T191 E192 F193 L470	K185-F189 PolarHBondContact O-N 3.46Å; V186-F189 WeakPolarHBondContact O-CB 3.37Å; V186-F189 PolarHBondContact O-N 3.34Å; V186-F189 VanDerWaalsContact O-N 3.15Å; F189-T191 VanDerWaalsContact C-N 3.31Å; F189-T191 PolarHBondContact O-N 3.12Å; F189-E192 PolarHBondContact O-N 3.48Å; F189-F193 WeakPolarHBondContact O-CB 3.31Å; F189-F193 PolarHBondContact O-N 3.47Å; F189-L470 HydrophobicContact CD1-CD1 4.1Å; F189-L470 HydrophobicContact CE1-CD1 4.13Å; F189-L470 HydrophobicContact CE1-CD2 4.14Å
190	L	95.3	Very high	94.9	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-66.1	-34	177.1	-72.7	176.7	0	0	0	112.4	V186 M188 F193 V194 L373 D374 L465 L470 M474	V186-L190 HydrophobicContact CG1-CD1 4.34Å; V186-L190 HydrophobicContact CG1-CG 4.26Å; V186-L190 WeakPolarHBondContact O-CG 3.37Å; V186-L190 PolarHBondContact O-N 3.01Å; M188-L190 VanDerWaalsContact C-N 3.31Å; M188-L190 PolarHBondContact O-N 3.45Å; L190-F193 WeakPolarHBondContact O-CB 3.41Å; L190-F193 PolarHBondContact O-N 3.47Å; L190-V194 WeakPolarHBondContact O-CG2 3.35Å; L190-V194 PolarHBondContact O-N 3.27Å; L190-L373 HydrophobicContact CB-CB 4.42Å; L190-L373 HydrophobicContact CD1-CB 3.94Å; L190-L373 HydrophobicContact CD2-CB 4.28Å; L190-L373 HydrophobicContact CD2-CD1 4.41Å; L190-L373 HydrophobicContact CG-CB 4.46Å; L190-D374 WeakPolarHBondContact CD1-OD1 3.28Å; L190-L465 HydrophobicContact CD2-CD1 4.31Å; L190-L470 HydrophobicContact CD2-CD1 4.33Å; L190-L470 HydrophobicContact CD2-CD2 4.31Å; L190-M474 HydrophobicContact CD1-CE 3.52Å; L190-M474 HydrophobicContact CD1-SD 4.38Å; L190-M474 HydrophobicContact CG-CE 4.49Å
191	T	95.3	Very high	94.9	Very high	57 Å²	57	57.1 Å²	57.1	35%	0.35	27%	0.272	S	S	.	.	H	α-helix	trans	-67.4	-42.6	175.6	-56.8	0	0	0	0	111.4	P187 M188 F189 F193 V194 H195 H243	P187-T191 WeakPolarHBondContact O-CB 3.33Å; P187-T191 PolarHBondContact O-N 2.62Å; P187-T191 PolarHBondContact O-OG1 3.21Å; M188-T191 WeakPolarHBondContact O-CB 3.49Å; M188-T191 PolarHBondContact O-N 3.49Å; M188-T191 VanDerWaalsContact O-N 3.09Å; F189-T191 VanDerWaalsContact C-N 3.31Å; F189-T191 PolarHBondContact O-N 3.12Å; T191-F193 VanDerWaalsContact C-N 3.32Å; T191-V194 PolarHBondContact O-N 3Å; T191-H195 PolarHBondContact O-N 2.87Å; T191-H195 VanDerWaalsContact O-N 3.1Å; T191-H243 HydrophobicContact CG2-CB 4.21Å; T191-H243 PolarHBondContact OG1-ND1 3.46Å
192	E	96	Very high	94.9	Very high	131 Å²	131	58.2 Å²	58.2	61%	0.612	28%	0.282	S	S	*	.	H	α-helix	trans	-63.2	-39.6	172.3	-68.5	176.3	-173	0	0	111.6	M188 F189 H195 S196	M188-E192 PolarHBondContact O-N 3.31Å; F189-E192 PolarHBondContact O-N 3.48Å; E192-H195 WeakPolarHBondContact O-CB 3.36Å; E192-H195 PolarHBondContact O-N 2.83Å; E192-S196 PolarHBondContact O-N 3.49Å
193	F	96	Very high	94.9	Very high	8 Å²	8	56.9 Å²	56.9	4%	0.035	28%	0.276	C	S	.	.	H	α-helix	trans	-60.8	-45.8	173.8	171.7	-102.9	0	0	0	112	F189 L190 T191 H195 S196 L197 L373 L382 A461 K464 L465	F189-F193 WeakPolarHBondContact O-CB 3.31Å; F189-F193 PolarHBondContact O-N 3.47Å; L190-F193 WeakPolarHBondContact O-CB 3.41Å; L190-F193 PolarHBondContact O-N 3.47Å; T191-F193 VanDerWaalsContact C-N 3.32Å; F193-H195 VanDerWaalsContact C-N 3.26Å; F193-H195 PolarHBondContact O-N 3.38Å; F193-S196 WeakPolarHBondContact O-CA 3.42Å; F193-S196 WeakPolarHBondContact O-CB 3.41Å; F193-S196 PolarHBondContact O-N 3.37Å; F193-S196 PolarHBondContact O-OG 2.84Å; F193-L197 HydrophobicContact CE1-CD1 4.24Å; F193-L197 HydrophobicContact CE1-CD2 4.05Å; F193-L197 HydrophobicContact CE1-CG 4.31Å; F193-L197 HydrophobicContact CE2-CD2 4.32Å; F193-L197 HydrophobicContact CZ-CD2 3.79Å; F193-L197 HydrophobicContact CZ-CG 4.48Å; F193-L197 PolarHBondContact O-N 3.07Å; F193-L197 VanDerWaalsContact O-N 3.16Å; F193-L373 HydrophobicContact CD1-CD1 3.87Å; F193-L373 HydrophobicContact CE1-CD1 4.11Å; F193-L382 HydrophobicContact CE1-CD2 3.9Å; F193-A461 HydrophobicContact CE2-CB 4.2Å; F193-A461 WeakPolarHBondContact CE2-O 3.35Å; F193-A461 HydrophobicContact CZ-CB 4.3Å; F193-K464 HydrophobicContact CD2-CB 3.99Å; F193-K464 HydrophobicContact CD2-CD 4.22Å; F193-K464 HydrophobicContact CE2-CB 3.8Å; F193-K464 HydrophobicContact CE2-CD 4.38Å; F193-L465 HydrophobicContact CE1-CB 4.44Å; F193-L465 HydrophobicContact CE1-CD1 4.03Å; F193-L465 HydrophobicContact CZ-CB 4.04Å; F193-L465 HydrophobicContact CZ-CD1 4.47Å
194	V	96.8	Very high	95	Very high	3 Å²	3	57.3 Å²	57.3	2%	0.018	28%	0.278	C	S	.	.	H	α-helix	trans	-58.7	-40.5	175.4	170.5	0	0	0	0	111.2	L190 T191 S196 L197 L238 H243 L373	L190-V194 WeakPolarHBondContact O-CG2 3.35Å; L190-V194 PolarHBondContact O-N 3.27Å; T191-V194 PolarHBondContact O-N 3Å; V194-S196 VanDerWaalsContact C-N 3.26Å; V194-S196 PolarHBondContact O-N 2.65Å; V194-L197 HydrophobicContact CG2-CD1 4.48Å; V194-L197 VanDerWaalsContact O-CB 3.31Å; V194-L197 WeakPolarHBondContact O-CB 3.5Å; V194-L197 PolarHBondContact O-N 3.31Å; V194-L238 HydrophobicContact CG1-CB 4.14Å; V194-L238 HydrophobicContact CG1-CD2 4.12Å; V194-L238 HydrophobicContact CG2-CD2 4.12Å; V194-H243 HydrophobicContact CB-CB 4.16Å; V194-H243 HydrophobicContact CG1-CB 4.15Å; V194-H243 HydrophobicContact CG2-CB 4.12Å; V194-L373 HydrophobicContact CG2-CD1 3.42Å; V194-L373 VanDerWaalsContact CG2-CD1 3.42Å; V194-L373 HydrophobicContact CG2-CG 4.23Å
195	H	95.9	Very high	94.9	Very high	134 Å²	134	57.2 Å²	57.2	62%	0.62	28%	0.278	S	S	*	.	H	α-helix	trans	-60.7	-37.2	174.4	-170.7	64.8	0	0	0	112.1	T191 E192 F193 L197 T198	T191-H195 PolarHBondContact O-N 2.87Å; T191-H195 VanDerWaalsContact O-N 3.1Å; E192-H195 WeakPolarHBondContact O-CB 3.36Å; E192-H195 PolarHBondContact O-N 2.83Å; F193-H195 VanDerWaalsContact C-N 3.26Å; F193-H195 PolarHBondContact O-N 3.38Å; H195-L197 VanDerWaalsContact C-N 3.28Å; H195-L197 PolarHBondContact O-N 2.94Å; H195-T198 WeakPolarHBondContact O-CB 3.36Å; H195-T198 VanDerWaalsContact O-CG2 3.31Å; H195-T198 WeakPolarHBondContact O-CG2 3.2Å; H195-T198 PolarHBondContact O-N 3.25Å; H195-T198 PolarHBondContact O-OG1 2.87Å
196	S	95.9	Very high	94.9	Very high	28 Å²	28	53 Å²	53	20%	0.196	26%	0.259	C	S	.	.	H	α-helix	trans	-68.2	-21.7	175.2	80.5	0	0	0	0	114.1	E192 F193 V194 T198 Y199	E192-S196 PolarHBondContact O-N 3.49Å; F193-S196 WeakPolarHBondContact O-CA 3.42Å; F193-S196 WeakPolarHBondContact O-CB 3.41Å; F193-S196 PolarHBondContact O-N 3.37Å; F193-S196 PolarHBondContact O-OG 2.84Å; V194-S196 VanDerWaalsContact C-N 3.26Å; V194-S196 PolarHBondContact O-N 2.65Å; S196-T198 PolarHBondContact O-N 2.82Å; S196-T198 VanDerWaalsContact O-N 3.15Å; S196-Y199 WeakPolarHBondContact O-CD2 3.49Å; S196-Y199 PolarHBondContact O-N 3.39Å
197	L	96.4	Very high	94.8	Very high	2 Å²	2	54.6 Å²	54.6	1%	0.01	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-63.8	-19.6	175.3	-61.9	175.8	0	0	0	112.5	F193 V194 H195 Y199 L200 L235 L238 I239 L382 A461	F193-L197 HydrophobicContact CE1-CD1 4.24Å; F193-L197 HydrophobicContact CE1-CD2 4.05Å; F193-L197 HydrophobicContact CE1-CG 4.31Å; F193-L197 HydrophobicContact CE2-CD2 4.32Å; F193-L197 HydrophobicContact CZ-CD2 3.79Å; F193-L197 HydrophobicContact CZ-CG 4.48Å; F193-L197 PolarHBondContact O-N 3.07Å; F193-L197 VanDerWaalsContact O-N 3.16Å; V194-L197 HydrophobicContact CG2-CD1 4.48Å; V194-L197 VanDerWaalsContact O-CB 3.31Å; V194-L197 WeakPolarHBondContact O-CB 3.5Å; V194-L197 PolarHBondContact O-N 3.31Å; H195-L197 VanDerWaalsContact C-N 3.28Å; H195-L197 PolarHBondContact O-N 2.94Å; L197-Y199 PolarHBondContact O-N 3.49Å; L197-Y199 VanDerWaalsContact O-N 3.15Å; L197-L200 HydrophobicContact CD2-CD1 4.09Å; L197-L200 VanDerWaalsContact O-CB 3.31Å; L197-L200 WeakPolarHBondContact O-CB 3.44Å; L197-L200 PolarHBondContact O-N 3.23Å; L197-L235 HydrophobicContact CB-CD1 4.19Å; L197-L235 HydrophobicContact CD1-CD1 4.16Å; L197-L235 HydrophobicContact CD2-CD1 4.22Å; L197-L235 HydrophobicContact CG-CD1 4.43Å; L197-L238 HydrophobicContact CD1-CB 4.2Å; L197-L238 HydrophobicContact CD1-CD1 4.05Å; L197-I239 HydrophobicContact CB-CG1 4.22Å; L197-I239 WeakPolarHBondContact O-CD1 3Å; L197-L382 HydrophobicContact CD1-CD1 4.26Å; L197-L382 HydrophobicContact CD1-CD2 3.95Å; L197-A461 HydrophobicContact CD2-CB 4.15Å
198	T	95.7	Very high	94.7	Very high	54 Å²	54	55 Å²	55	33%	0.331	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-59.2	-25.2	175.9	61.1	0	0	0	0	113.1	H195 S196 L200 K201	H195-T198 WeakPolarHBondContact O-CB 3.36Å; H195-T198 VanDerWaalsContact O-CG2 3.31Å; H195-T198 WeakPolarHBondContact O-CG2 3.2Å; H195-T198 PolarHBondContact O-N 3.25Å; H195-T198 PolarHBondContact O-OG1 2.87Å; S196-T198 PolarHBondContact O-N 2.82Å; S196-T198 VanDerWaalsContact O-N 3.15Å; T198-L200 PolarHBondContact O-N 2.98Å; T198-K201 WeakPolarHBondContact O-CB 3.5Å; T198-K201 PolarHBondContact O-N 3.46Å; T198-K201 VanDerWaalsContact O-N 3.13Å
199	Y	95.3	Very high	94.4	Very high	160 Å²	160	51.4 Å²	51.4	63%	0.627	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-65.8	-20.1	173.2	-60.5	-56.8	0	0	0	113.3	S196 L197 K201	S196-Y199 WeakPolarHBondContact O-CD2 3.49Å; S196-Y199 PolarHBondContact O-N 3.39Å; L197-Y199 PolarHBondContact O-N 3.49Å; L197-Y199 VanDerWaalsContact O-N 3.15Å; Y199-K201 VanDerWaalsContact C-N 3.31Å
200	L	96.2	Very high	94.1	Very high	4 Å²	4	48.4 Å²	48.4	2%	0.021	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-84.9	-2.2	176.1	-60.6	177.8	0	0	0	113.2	L197 T198 T202 A203 L204 L235 I239 L386 L457 V458 A461	L197-L200 HydrophobicContact CD2-CD1 4.09Å; L197-L200 VanDerWaalsContact O-CB 3.31Å; L197-L200 WeakPolarHBondContact O-CB 3.44Å; L197-L200 PolarHBondContact O-N 3.23Å; T198-L200 PolarHBondContact O-N 2.98Å; L200-T202 VanDerWaalsContact C-N 3.31Å; L200-T202 PolarHBondContact O-N 3.46Å; L200-A203 WeakPolarHBondContact O-CB 3.4Å; L200-A203 PolarHBondContact O-N 3.26Å; L200-A203 VanDerWaalsContact O-N 3.08Å; L200-L204 PolarHBondContact O-N 2.97Å; L200-L235 HydrophobicContact CD1-CD1 4.35Å; L200-I239 HydrophobicContact CB-CD1 4.44Å; L200-L386 HydrophobicContact CD1-CD2 3.6Å; L200-L457 HydrophobicContact CD2-CB 3.56Å; L200-V458 HydrophobicContact CD1-CG2 4.37Å; L200-V458 HydrophobicContact CD2-CB 4.43Å; L200-V458 HydrophobicContact CD2-CG2 3.57Å; L200-A461 HydrophobicContact CD1-CB 4.12Å
201	K	95.1	Very high	93.6	Very high	117 Å²	117	50.5 Å²	50.5	51%	0.509	25%	0.245	S	C	.	.	H	α-helix	trans	-55.2	-43.5	-177.1	-176.5	170.1	-176.1	163	0	112.9	T198 Y199 L204 Q205 I239	T198-K201 WeakPolarHBondContact O-CB 3.5Å; T198-K201 PolarHBondContact O-N 3.46Å; T198-K201 VanDerWaalsContact O-N 3.13Å; Y199-K201 VanDerWaalsContact C-N 3.31Å; K201-L204 PolarHBondContact O-N 3.33Å; K201-Q205 WeakPolarHBondContact O-CB 3.34Å; K201-Q205 PolarHBondContact O-N 2.91Å; K201-I239 HydrophobicContact CB-CG2 4.18Å; K201-I239 HydrophobicContact CD-CG2 4.22Å; K201-I239 HydrophobicContact CG-CG2 4.24Å
202	T	93.8	Very high	93.1	Very high	75 Å²	75	52.4 Å²	52.4	46%	0.46	25%	0.253	S	S	.	.	H	α-helix	trans	-66	-39.9	178.6	-48.4	0	0	0	0	111.9	L200 Q205 L206 Y446 M454	L200-T202 VanDerWaalsContact C-N 3.31Å; L200-T202 PolarHBondContact O-N 3.46Å; T202-Q205 PolarHBondContact O-N 3.01Å; T202-L206 PolarHBondContact O-N 3.5Å; T202-Y446 HydrophobicContact CG2-CE1 4.14Å; T202-M454 HydrophobicContact CG2-CE 3.66Å
203	A	94.2	Very high	92.5	Very high	2 Å²	2	48.4 Å²	48.4	2%	0.017	23%	0.234	C	C	.	.	H	α-helix	trans	-66.4	-42.4	177.8	0	0	0	0	0	111.6	L200 L206 Y207 L389 L393 M454	L200-A203 WeakPolarHBondContact O-CB 3.4Å; L200-A203 PolarHBondContact O-N 3.26Å; L200-A203 VanDerWaalsContact O-N 3.08Å; A203-L206 PolarHBondContact O-N 2.63Å; A203-Y207 PolarHBondContact O-N 3.13Å; A203-Y207 VanDerWaalsContact O-N 3.14Å; A203-L389 HydrophobicContact CB-CD1 4.48Å; A203-L389 HydrophobicContact CB-CD2 4.28Å; A203-L393 HydrophobicContact CB-CD1 4.18Å; A203-L393 HydrophobicContact CB-CD2 4.44Å; A203-M454 HydrophobicContact CB-CB 3.97Å; A203-M454 HydrophobicContact CB-CG 3.94Å; A203-M454 HydrophobicContact CB-SD 3.83Å
204	L	94.8	Very high	91.8	Very high	9 Å²	9	49.9 Å²	49.9	5%	0.047	24%	0.243	C	C	.	.	H	α-helix	trans	-63.2	-42.9	174.8	179.6	61.1	0	0	0	111.4	L200 K201 Y207 I208 C232 L235 K236 I239	L200-L204 PolarHBondContact O-N 2.97Å; K201-L204 PolarHBondContact O-N 3.33Å; L204-Y207 PolarHBondContact O-N 2.96Å; L204-I208 HydrophobicContact CD1-CD1 4.24Å; L204-I208 HydrophobicContact CD1-CG1 4.48Å; L204-I208 HydrophobicContact CG-CD1 3.98Å; L204-I208 WeakPolarHBondContact O-CG1 3.43Å; L204-I208 PolarHBondContact O-N 3.24Å; L204-C232 HydrophobicContact CD1-CB 3.78Å; L204-L235 HydrophobicContact CD1-CD2 4.5Å; L204-L235 HydrophobicContact CD2-CG 4.43Å; L204-K236 HydrophobicContact CD2-CB 3.9Å; L204-K236 HydrophobicContact CD2-CG 4.26Å; L204-I239 HydrophobicContact CD2-CD1 3.97Å
205	Q	92.9	Very high	90.9	Very high	86 Å²	86	51.8 Å²	51.8	40%	0.402	25%	0.253	S	S	.	.	H	α-helix	trans	-62.4	-44.2	177.6	-170.7	61.4	50.8	0	0	111.5	K201 T202 Y207 I208 D209	K201-Q205 WeakPolarHBondContact O-CB 3.34Å; K201-Q205 PolarHBondContact O-N 2.91Å; T202-Q205 PolarHBondContact O-N 3.01Å; Q205-Y207 VanDerWaalsContact C-N 3.26Å; Q205-Y207 PolarHBondContact O-N 3.12Å; Q205-I208 PolarHBondContact O-N 3.42Å; Q205-D209 PolarHBondContact NE2-OD1 3.44Å; Q205-D209 WeakPolarHBondContact O-CB 3.12Å; Q205-D209 PolarHBondContact O-N 3.26Å
206	L	91.7	Very high	89.7	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-54.8	-43.4	173.9	170.8	61.8	0	0	0	111.7	T202 A203 F210 F392 L393 F396 L443 Y446 I451 M454	T202-L206 PolarHBondContact O-N 3.5Å; A203-L206 PolarHBondContact O-N 2.63Å; L206-F210 VanDerWaalsContact O-CB 3.27Å; L206-F210 WeakPolarHBondContact O-CB 3.17Å; L206-F210 PolarHBondContact O-N 3.31Å; L206-F392 HydrophobicContact CD2-CE1 4.36Å; L206-F392 HydrophobicContact CG-CE1 4.05Å; L206-F392 HydrophobicContact CG-CZ 4.21Å; L206-L393 HydrophobicContact CD2-CD2 4.13Å; L206-F396 HydrophobicContact CD1-CE1 4.5Å; L206-F396 HydrophobicContact CD1-CZ 4.17Å; L206-F396 HydrophobicContact CD2-CD1 4.4Å; L206-F396 HydrophobicContact CD2-CE1 4.29Å; L206-L443 HydrophobicContact CD1-CD2 3.53Å; L206-Y446 HydrophobicContact CB-CE2 4.49Å; L206-Y446 HydrophobicContact CD1-CD2 3.77Å; L206-Y446 HydrophobicContact CD1-CE2 3.66Å; L206-Y446 HydrophobicContact CD2-CD2 4.43Å; L206-Y446 HydrophobicContact CG-CE2 4.46Å; L206-I451 HydrophobicContact CD2-CD1 3.35Å; L206-M454 HydrophobicContact CD2-SD 4.1Å
207	Y	92.6	Very high	88.2	Confident	39 Å²	39	49.1 Å²	49.1	15%	0.153	27%	0.266	C	S	.	.	H	α-helix	trans	-66.2	-43.9	179	-176.3	-147.2	0	0	0	112.6	A203 L204 Q205 F210 K211 C231 E388 L389 F392	A203-Y207 PolarHBondContact O-N 3.13Å; A203-Y207 VanDerWaalsContact O-N 3.14Å; L204-Y207 PolarHBondContact O-N 2.96Å; Q205-Y207 VanDerWaalsContact C-N 3.26Å; Q205-Y207 PolarHBondContact O-N 3.12Å; Y207-F210 PolarHBondContact O-N 2.77Å; Y207-K211 WeakPolarHBondContact O-CB 3.2Å; Y207-K211 PolarHBondContact O-N 2.84Å; Y207-C231 HydrophobicContact CD1-CB 3.61Å; Y207-C231 HydrophobicContact CE1-CB 3.56Å; Y207-C231 WeakPolarHBondContact CE1-SG 3.4Å; Y207-C231 HydrophobicContact CG-CB 4.5Å; Y207-C231 VanDerWaalsContact CZ-SG 3.57Å; Y207-E388 HydrophobicContact CE1-CG 4.11Å; Y207-E388 VanDerWaalsContact CE1-OE1 3.3Å; Y207-E388 WeakPolarHBondContact CE1-OE1 3.41Å; Y207-E388 PolarHBondContact OH-OE1 2.93Å; Y207-L389 HydrophobicContact CD1-CD1 4.38Å; Y207-F392 VanDerWaalsContact CA-CE1 3.49Å; Y207-F392 HydrophobicContact CD2-CB 3.98Å; Y207-F392 AromaticContact CD2-CD1 3.56Å; Y207-F392 HydrophobicContact CD2-CD1 3.56Å; Y207-F392 AromaticContact CD2-CD2 3.4Å; Y207-F392 HydrophobicContact CD2-CD2 3.4Å; Y207-F392 VanDerWaalsContact CD2-CD2 3.4Å; Y207-F392 AromaticContact CD2-CE1 3.86Å; Y207-F392 HydrophobicContact CD2-CE1 3.86Å; Y207-F392 AromaticContact CD2-CE2 3.72Å; Y207-F392 HydrophobicContact CD2-CE2 3.72Å; Y207-F392 AromaticContact CD2-CG 3.32Å; Y207-F392 HydrophobicContact CD2-CG 3.32Å; Y207-F392 AromaticContact CD2-CZ 3.93Å; Y207-F392 HydrophobicContact CD2-CZ 3.93Å; Y207-F392 HydrophobicContact CE2-CB 4.01Å; Y207-F392 HydrophobicContact CE2-CD1 4.42Å; Y207-F392 AromaticContact CE2-CD2 3.7Å; Y207-F392 HydrophobicContact CE2-CD2 3.7Å; Y207-F392 HydrophobicContact CE2-CE2 4.32Å; Y207-F392 AromaticContact CE2-CG 3.75Å; Y207-F392 HydrophobicContact CE2-CG 3.75Å; Y207-F392 HydrophobicContact CG-CB 4.42Å; Y207-F392 AromaticContact CG-CD1 3.71Å; Y207-F392 HydrophobicContact CG-CD1 3.71Å; Y207-F392 HydrophobicContact CG-CD2 4.37Å; Y207-F392 HydrophobicContact CG-CE1 4.05Å; Y207-F392 AromaticContact CG-CG 3.88Å; Y207-F392 HydrophobicContact CG-CG 3.88Å
208	I	90.7	Very high	86.3	Confident	30 Å²	30	56 Å²	56	15%	0.154	30%	0.296	C	S	.	.	H	α-helix	trans	-60.5	-47.8	176.4	-68.1	167	0	0	0	110.5	L204 Q205 F210 K211 N212 C231	L204-I208 HydrophobicContact CD1-CD1 4.24Å; L204-I208 HydrophobicContact CD1-CG1 4.48Å; L204-I208 HydrophobicContact CG-CD1 3.98Å; L204-I208 WeakPolarHBondContact O-CG1 3.43Å; L204-I208 PolarHBondContact O-N 3.24Å; Q205-I208 PolarHBondContact O-N 3.42Å; I208-F210 PolarHBondContact O-N 2.64Å; I208-K211 PolarHBondContact O-N 2.94Å; I208-N212 WeakPolarHBondContact O-CB 3.19Å; I208-N212 PolarHBondContact O-N 2.94Å; I208-N212 PolarHBondContact O-ND2 3.28Å; I208-C231 HydrophobicContact CG1-CB 4.15Å
209	D	88	Confident	84.4	Confident	54 Å²	54	59.6 Å²	59.6	29%	0.289	31%	0.31	S	S	.	.	H	α-helix	trans	-63.5	-43	-179.4	-66.7	-18.4	0	0	0	111.2	Q205 N212 F213 L443	Q205-D209 PolarHBondContact NE2-OD1 3.44Å; Q205-D209 WeakPolarHBondContact O-CB 3.12Å; Q205-D209 PolarHBondContact O-N 3.26Å; D209-N212 PolarHBondContact O-N 3.12Å; D209-F213 WeakPolarHBondContact O-CB 3.45Å; D209-F213 PolarHBondContact O-N 2.95Å; D209-L443 HydrophobicContact CB-CD2 3.82Å
210	F	87.3	Confident	82.5	Confident	24 Å²	24	57.3 Å²	57.3	11%	0.105	31%	0.308	C	S	.	.	H	α-helix	trans	-63.3	-46	176.8	-175	-94.4	0	0	0	111.9	L206 Y207 I208 N212 F213 V214 F392 F396 I436 L443	L206-F210 VanDerWaalsContact O-CB 3.27Å; L206-F210 WeakPolarHBondContact O-CB 3.17Å; L206-F210 PolarHBondContact O-N 3.31Å; Y207-F210 PolarHBondContact O-N 2.77Å; I208-F210 PolarHBondContact O-N 2.64Å; F210-N212 PolarHBondContact O-N 3.07Å; F210-F213 WeakPolarHBondContact O-CB 3.45Å; F210-F213 PolarHBondContact O-N 2.88Å; F210-V214 HydrophobicContact CD1-CG2 4.03Å; F210-V214 HydrophobicContact CE1-CG2 3.64Å; F210-V214 HydrophobicContact CE2-CG2 4.4Å; F210-V214 HydrophobicContact CZ-CG2 3.84Å; F210-V214 WeakPolarHBondContact O-CG2 3.48Å; F210-V214 PolarHBondContact O-N 3.16Å; F210-F392 HydrophobicContact CB-CE2 4.03Å; F210-F392 HydrophobicContact CB-CZ 3.88Å; F210-F392 HydrophobicContact CD1-CD2 4.46Å; F210-F392 AromaticContact CD1-CE2 3.55Å; F210-F392 HydrophobicContact CD1-CE2 3.55Å; F210-F392 HydrophobicContact CD1-CZ 4.28Å; F210-F392 HydrophobicContact CE1-CE2 4.14Å; F210-F392 AromaticContact CG-CE2 3.8Å; F210-F392 HydrophobicContact CG-CE2 3.8Å; F210-F392 HydrophobicContact CG-CZ 4.08Å; F210-F396 HydrophobicContact CD2-CD2 4.14Å; F210-F396 AromaticContact CD2-CE2 3.76Å; F210-F396 HydrophobicContact CD2-CE2 3.76Å; F210-F396 HydrophobicContact CE2-CD2 4.19Å; F210-F396 AromaticContact CE2-CE2 3.97Å; F210-F396 HydrophobicContact CE2-CE2 3.97Å; F210-I436 HydrophobicContact CE2-CB 4.32Å; F210-I436 HydrophobicContact CE2-CG1 4.08Å; F210-I436 HydrophobicContact CZ-CG1 4.45Å; F210-L443 HydrophobicContact CB-CD1 4.46Å; F210-L443 HydrophobicContact CB-CD2 4.3Å; F210-L443 HydrophobicContact CD2-CD1 4.21Å
211	K	85.6	Confident	80.7	Confident	44 Å²	44	65.9 Å²	65.9	19%	0.191	35%	0.348	C	S	.	.	H	α-helix	trans	-61.5	-45.6	176.9	174.6	176.2	176.7	175.3	0	111.9	Y207 I208 F213 V214 L215 Y229 C231	Y207-K211 WeakPolarHBondContact O-CB 3.2Å; Y207-K211 PolarHBondContact O-N 2.84Å; I208-K211 PolarHBondContact O-N 2.94Å; K211-F213 VanDerWaalsContact C-N 3.27Å; K211-F213 PolarHBondContact O-N 3.34Å; K211-V214 PolarHBondContact O-N 2.98Å; K211-L215 HydrophobicContact CD-CD1 4.22Å; K211-L215 HydrophobicContact CG-CD1 3.56Å; K211-L215 HydrophobicContact CG-CG 4.2Å; K211-L215 WeakPolarHBondContact O-CB 3.46Å; K211-L215 WeakPolarHBondContact O-CG 3.46Å; K211-L215 PolarHBondContact O-N 3.45Å; K211-Y229 PolarHBondContact NZ-O 3.34Å; K211-C231 WeakPolarHBondContact CD-SG 3.38Å; K211-C231 PolarHBondContact NZ-SG 3.15Å; K211-C231 VanDerWaalsContact NZ-SG 3.38Å
212	N	85.1	Confident	78.9	Confident	96 Å²	96	70.1 Å²	70.1	51%	0.513	36%	0.362	S	S	.	.	H	α-helix	trans	-62.3	-37.8	178	-72.3	-22.9	0	0	0	111.5	I208 D209 F210 G216	I208-N212 WeakPolarHBondContact O-CB 3.19Å; I208-N212 PolarHBondContact O-N 2.94Å; I208-N212 PolarHBondContact O-ND2 3.28Å; D209-N212 PolarHBondContact O-N 3.12Å; F210-N212 PolarHBondContact O-N 3.07Å; N212-G216 WeakPolarHBondContact O-CA 3.28Å; N212-G216 PolarHBondContact O-N 3.11Å
213	F	82.5	Confident	76.9	Confident	47 Å²	47	73.4 Å²	73.4	21%	0.206	37%	0.372	C	S	.	.	H	α-helix	trans	-63.4	-50.5	174.1	167.4	-111.4	0	0	0	112	D209 F210 K211 G217 I435 N438 A439 P440 L443	D209-F213 WeakPolarHBondContact O-CB 3.45Å; D209-F213 PolarHBondContact O-N 2.95Å; F210-F213 WeakPolarHBondContact O-CB 3.45Å; F210-F213 PolarHBondContact O-N 2.88Å; K211-F213 VanDerWaalsContact C-N 3.27Å; K211-F213 PolarHBondContact O-N 3.34Å; F213-G217 PolarHBondContact O-N 2.82Å; F213-I435 HydrophobicContact CD1-CG2 4.44Å; F213-I435 HydrophobicContact CE1-CG2 3.63Å; F213-I435 VanDerWaalsContact CE1-O 3.28Å; F213-I435 WeakPolarHBondContact CE1-O 3.27Å; F213-I435 HydrophobicContact CZ-CG2 4.3Å; F213-I435 WeakPolarHBondContact CZ-O 3.42Å; F213-N438 WeakPolarHBondContact CE2-O 3.37Å; F213-N438 VanDerWaalsContact CZ-C 3.43Å; F213-N438 HydrophobicContact CZ-CB 4.14Å; F213-N438 WeakPolarHBondContact CZ-O 3.43Å; F213-A439 HydrophobicContact CD1-CB 4.27Å; F213-A439 HydrophobicContact CE1-CB 3.87Å; F213-A439 VanDerWaalsContact CZ-CA 3.44Å; F213-A439 HydrophobicContact CZ-CB 4.09Å; F213-P440 VanDerWaalsContact CD2-CD 3.46Å; F213-P440 HydrophobicContact CD2-CG 4.3Å; F213-L443 HydrophobicContact CB-CD1 3.97Å; F213-L443 HydrophobicContact CD1-CD1 4.14Å; F213-L443 HydrophobicContact CG-CD1 4.15Å
214	V	81.1	Confident	74.9	Confident	39 Å²	39	76.2 Å²	76.2	24%	0.236	40%	0.401	C	S	.	.	H	α-helix	trans	-62.9	-48	-179.4	174.7	0	0	0	0	110.8	F210 K211 F218 I435	F210-V214 HydrophobicContact CD1-CG2 4.03Å; F210-V214 HydrophobicContact CE1-CG2 3.64Å; F210-V214 HydrophobicContact CE2-CG2 4.4Å; F210-V214 HydrophobicContact CZ-CG2 3.84Å; F210-V214 WeakPolarHBondContact O-CG2 3.48Å; F210-V214 PolarHBondContact O-N 3.16Å; K211-V214 PolarHBondContact O-N 2.98Å; V214-F218 HydrophobicContact CG1-CE2 4.16Å; V214-F218 WeakPolarHBondContact O-CD2 3.44Å; V214-F218 WeakPolarHBondContact O-CE2 3.48Å; V214-I435 HydrophobicContact CG2-CG2 4.13Å
215	L	78.7	Confident	73	Confident	43 Å²	43	81.3 Å²	81.3	23%	0.225	44%	0.435	C	S	.	.	H	α-helix	trans	-74.1	-34.5	-178.3	-66.2	175.9	0	0	0	113.1	K211 G217 F218 Q219 F228	K211-L215 HydrophobicContact CD-CD1 4.22Å; K211-L215 HydrophobicContact CG-CD1 3.56Å; K211-L215 HydrophobicContact CG-CG 4.2Å; K211-L215 WeakPolarHBondContact O-CB 3.46Å; K211-L215 WeakPolarHBondContact O-CG 3.46Å; K211-L215 PolarHBondContact O-N 3.45Å; L215-G217 PolarHBondContact O-N 3.36Å; L215-F218 PolarHBondContact O-N 2.87Å; L215-Q219 PolarHBondContact O-N 2.92Å; L215-F228 HydrophobicContact CB-CZ 4.31Å; L215-F228 HydrophobicContact CD1-CB 4.41Å; L215-F228 HydrophobicContact CD1-CD1 3.48Å; L215-F228 VanDerWaalsContact CD1-CD1 3.48Å; L215-F228 HydrophobicContact CD1-CD2 4.19Å; L215-F228 HydrophobicContact CD1-CE1 3.67Å; L215-F228 HydrophobicContact CD1-CE2 4.35Å; L215-F228 HydrophobicContact CD1-CG 3.76Å; L215-F228 HydrophobicContact CD1-CZ 4.1Å; L215-F228 HydrophobicContact CD2-CD1 4.24Å; L215-F228 HydrophobicContact CD2-CE1 3.64Å; L215-F228 HydrophobicContact CD2-CZ 4.04Å; L215-F228 HydrophobicContact CG-CD1 4.44Å; L215-F228 HydrophobicContact CG-CE1 4.16Å; L215-F228 HydrophobicContact CG-CZ 4.39Å
216	G	70.8	Confident	71.1	Confident	39 Å²	39	83.7 Å²	83.7	40%	0.402	45%	0.446	S	S	.	.	H	α-helix	trans	-60.5	-29.5	176.1	0	0	0	0	0	112.7	N212 F218	N212-G216 WeakPolarHBondContact O-CA 3.28Å; N212-G216 PolarHBondContact O-N 3.11Å; G216-F218 VanDerWaalsContact C-N 3.27Å; G216-F218 PolarHBondContact O-N 2.75Å
217	G	63.4	Low	69.4	Low	67 Å²	67	92.6 Å²	92.6	69%	0.691	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-17.9	173.3	0	0	0	0	0	115	F213 L215	F213-G217 PolarHBondContact O-N 2.82Å; L215-G217 PolarHBondContact O-N 3.36Å
218	F	57.5	Low	68.1	Low	146 Å²	146	94.9 Å²	94.9	64%	0.64	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.5	7.3	-179.4	-63	-73.9	0	0	0	113.7	V214 L215 G216 D220	V214-F218 HydrophobicContact CG1-CE2 4.16Å; V214-F218 WeakPolarHBondContact O-CD2 3.44Å; V214-F218 WeakPolarHBondContact O-CE2 3.48Å; L215-F218 PolarHBondContact O-N 2.87Å; G216-F218 VanDerWaalsContact C-N 3.27Å; G216-F218 PolarHBondContact O-N 2.75Å; F218-D220 PolarHBondContact O-N 2.7Å
219	Q	55.7	Low	67.1	Low	131 Å²	131	103.3 Å²	103.3	61%	0.612	53%	0.527	S	S	*	.			trans	-70.8	96.6	175	-68.9	-177.3	9.8	0	0	109.6	L215 E221	L215-Q219 PolarHBondContact O-N 2.92Å; Q219-E221 PolarHBondContact O-N 3.36Å
220	D	54.7	Low	66.8	Low	112 Å²	112	105.8 Å²	105.8	60%	0.599	54%	0.54	S	S	*	.			trans	-63	127.4	163.6	-77	-27.5	0	0	0	108.5	F218 Y222 H223	F218-D220 PolarHBondContact O-N 2.7Å; D220-Y222 PolarHBondContact O-N 2.78Å; D220-H223 PolarHBondContact O-N 3.47Å; D220-H223 VanDerWaalsContact O-N 3.15Å
221	E	58.4	Low	66.7	Low	183 Å²	183	104.9 Å²	104.9	86%	0.855	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-11.3	178.2	-64.6	-177.4	160.2	0	0	114.1	Q219	Q219-E221 PolarHBondContact O-N 3.36Å
222	Y	58.1	Low	67.1	Low	207 Å²	207	102.8 Å²	102.8	81%	0.812	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	-12.6	-173.1	-64.7	-83.1	0	0	0	115.1	D220	D220-Y222 PolarHBondContact O-N 2.78Å
223	H	50.6	Low	67.5	Low	144 Å²	144	101.2 Å²	101.2	67%	0.667	52%	0.523	S	S	*	.	S	Bend	trans	-112.4	114.7	174.8	-73.6	-66.9	0	0	0	109.1	D220	D220-H223 PolarHBondContact O-N 3.47Å; D220-H223 VanDerWaalsContact O-N 3.15Å
224	G	53.1	Low	68.1	Low	61 Å²	61	99.2 Å²	99.2	63%	0.629	51%	0.514	S	S	*	.			trans	-52.2	155.7	174	0	0	0	0	0	111	E226	G224-E226 PolarHBondContact O-N 3.01Å
225	P	53.9	Low	68.9	Low	116 Å²	116	97.3 Å²	97.3	75%	0.753	50%	0.503	S	S	*	.			trans	-51.2	114.8	-168.6	22.5	-33.4	0	0	0	109.4	K227	P225-K227 PolarHBondContact O-N 3.3Å
226	E	54.8	Low	69.6	Low	135 Å²	135	98.4 Å²	98.4	63%	0.631	51%	0.506	S	S	*	.			trans	-53.7	142.6	170.9	-72.4	-173	157.3	0	0	107.8	G224 F228	G224-E226 PolarHBondContact O-N 3.01Å; E226-F228 HydrophobicContact CB-CE1 4.2Å; E226-F228 HydrophobicContact CB-CE2 4.04Å; E226-F228 HydrophobicContact CB-CZ 3.87Å; E226-F228 WeakPolarHBondContact O-CD2 3.48Å; E226-F228 PolarHBondContact O-N 3.17Å
227	K	55.9	Low	70.8	Confident	187 Å²	187	99 Å²	99	81%	0.813	50%	0.5	S	S	*	.			trans	-66.9	82	177	-69.5	-175.5	178.9	-177.3	0	108.7	P225 Y229	P225-K227 PolarHBondContact O-N 3.3Å; K227-Y229 PolarHBondContact O-N 3.39Å
228	F	64.2	Low	72.3	Confident	87 Å²	87	95.9 Å²	95.9	38%	0.382	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-70.2	124.8	173.3	-64.3	-66.2	0	0	0	108.3	L215 E226	L215-F228 HydrophobicContact CB-CZ 4.31Å; L215-F228 HydrophobicContact CD1-CB 4.41Å; L215-F228 HydrophobicContact CD1-CD1 3.48Å; L215-F228 VanDerWaalsContact CD1-CD1 3.48Å; L215-F228 HydrophobicContact CD1-CD2 4.19Å; L215-F228 HydrophobicContact CD1-CE1 3.67Å; L215-F228 HydrophobicContact CD1-CE2 4.35Å; L215-F228 HydrophobicContact CD1-CG 3.76Å; L215-F228 HydrophobicContact CD1-CZ 4.1Å; L215-F228 HydrophobicContact CD2-CD1 4.24Å; L215-F228 HydrophobicContact CD2-CE1 3.64Å; L215-F228 HydrophobicContact CD2-CZ 4.04Å; L215-F228 HydrophobicContact CG-CD1 4.44Å; L215-F228 HydrophobicContact CG-CE1 4.16Å; L215-F228 HydrophobicContact CG-CZ 4.39Å; E226-F228 HydrophobicContact CB-CE1 4.2Å; E226-F228 HydrophobicContact CB-CE2 4.04Å; E226-F228 HydrophobicContact CB-CZ 3.87Å; E226-F228 WeakPolarHBondContact O-CD2 3.48Å; E226-F228 PolarHBondContact O-N 3.17Å
229	Y	69.8	Low	74.1	Confident	207 Å²	207	89.9 Å²	89.9	81%	0.812	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-58.1	141.7	170.2	-64.4	-83	0	0	0	109.4	K211 K227	K211-Y229 PolarHBondContact NZ-O 3.34Å; K227-Y229 PolarHBondContact O-N 3.39Å
230	D	81.3	Confident	75.9	Confident	107 Å²	107	88.6 Å²	88.6	57%	0.572	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-61.5	149	172.5	-88.2	-41.2	0	0	0	111	P233 K236	D230-P233 HydrophobicContact CB-CB 4.32Å; D230-K236 IonicContact OD1-NZ 3.4Å
231	C	86.5	Confident	77.7	Confident	4 Å²	4	87.1 Å²	87.1	3%	0.027	44%	0.437	C	S	.	.	S	Bend	trans	-75.8	130.6	169.2	-75.6	0	0	0	0	110.2	Y207 I208 K211	Y207-C231 HydrophobicContact CD1-CB 3.61Å; Y207-C231 HydrophobicContact CE1-CB 3.56Å; Y207-C231 WeakPolarHBondContact CE1-SG 3.4Å; Y207-C231 HydrophobicContact CG-CB 4.5Å; Y207-C231 VanDerWaalsContact CZ-SG 3.57Å; I208-C231 HydrophobicContact CG1-CB 4.15Å; K211-C231 WeakPolarHBondContact CD-SG 3.38Å; K211-C231 PolarHBondContact NZ-SG 3.15Å; K211-C231 VanDerWaalsContact NZ-SG 3.38Å
232	C	93.4	Very high	79.4	Confident	0 Å²	0	79.8 Å²	79.8	0%	0	41%	0.411	C	S	.	.	S	Bend	trans	45.1	57.6	172.6	-49.7	0	0	0	0	112.9	L204 T234 L235 K236 D385	L204-C232 HydrophobicContact CD1-CB 3.78Å; C232-T234 VanDerWaalsContact C-N 3.31Å; C232-T234 PolarHBondContact O-N 2.87Å; C232-L235 HydrophobicContact CB-CB 4.03Å; C232-L235 HydrophobicContact CB-CD2 4.31Å; C232-L235 PolarHBondContact O-N 3.48Å; C232-K236 WeakPolarHBondContact O-CB 3.21Å; C232-K236 PolarHBondContact O-N 3.36Å; C232-D385 VanDerWaalsContact CA-CG 3.41Å; C232-D385 WeakPolarHBondContact CA-OD2 3.48Å; C232-D385 HydrophobicContact CB-CB 3.83Å; C232-D385 PolarHBondContact SG-O 2.85Å; C232-D385 VanDerWaalsContact SG-O 3.39Å
233	P	94	Very high	81.1	Confident	64 Å²	64	71.1 Å²	71.1	42%	0.416	38%	0.377	S	S	.	.	H	α-helix	trans	-62.3	-34.7	-167	25.1	-35.6	0	0	0	113.8	D230 L237	D230-P233 HydrophobicContact CB-CB 4.32Å; P233-L237 WeakPolarHBondContact O-CB 3.41Å; P233-L237 PolarHBondContact O-N 2.93Å
234	T	95	Very high	83.1	Confident	4 Å²	4	65.1 Å²	65.1	3%	0.025	35%	0.351	C	S	.	.	H	α-helix	trans	-73.5	-43.7	178.9	-51	0	0	0	0	110.7	C232 K236 L237 L238 W249 L372 A381 L382 D385	C232-T234 VanDerWaalsContact C-N 3.31Å; C232-T234 PolarHBondContact O-N 2.87Å; T234-K236 VanDerWaalsContact C-N 3.34Å; T234-K236 PolarHBondContact O-N 3.12Å; T234-L237 PolarHBondContact O-N 3.32Å; T234-L238 HydrophobicContact CG2-CD1 4.21Å; T234-L238 WeakPolarHBondContact O-CB 3.29Å; T234-L238 VanDerWaalsContact O-CG 3.31Å; T234-L238 WeakPolarHBondContact O-CG 3.23Å; T234-L238 PolarHBondContact O-N 2.98Å; T234-W249 PolarHBondContact OG1-NE1 2.96Å; T234-L372 HydrophobicContact CG2-CD2 3.81Å; T234-A381 HydrophobicContact CG2-CB 4.3Å; T234-A381 WeakPolarHBondContact OG1-CB 3.48Å; T234-L382 HydrophobicContact CG2-CB 4.18Å; T234-D385 WeakPolarHBondContact CA-OD2 3.31Å; T234-D385 WeakPolarHBondContact CB-OD2 3.32Å; T234-D385 PolarHBondContact N-OD2 3.18Å
235	L	96.3	Very high	85	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-59.9	-45.6	174.2	178.2	62.6	0	0	0	111.1	L197 L200 L204 C232 L238 I239 L382 D385 L386 L389	L197-L235 HydrophobicContact CB-CD1 4.19Å; L197-L235 HydrophobicContact CD1-CD1 4.16Å; L197-L235 HydrophobicContact CD2-CD1 4.22Å; L197-L235 HydrophobicContact CG-CD1 4.43Å; L200-L235 HydrophobicContact CD1-CD1 4.35Å; L204-L235 HydrophobicContact CD1-CD2 4.5Å; L204-L235 HydrophobicContact CD2-CG 4.43Å; C232-L235 HydrophobicContact CB-CB 4.03Å; C232-L235 HydrophobicContact CB-CD2 4.31Å; C232-L235 PolarHBondContact O-N 3.48Å; L235-L238 PolarHBondContact O-N 3.16Å; L235-I239 HydrophobicContact CD1-CD1 3.89Å; L235-I239 HydrophobicContact CD1-CG1 4.22Å; L235-I239 HydrophobicContact CG-CD1 3.9Å; L235-I239 WeakPolarHBondContact O-CG1 3.38Å; L235-I239 PolarHBondContact O-N 3.45Å; L235-L382 HydrophobicContact CB-CD1 4Å; L235-L382 HydrophobicContact CD1-CD1 3.98Å; L235-D385 HydrophobicContact CB-CB 4.04Å; L235-D385 PolarHBondContact N-OD2 3Å; L235-L386 HydrophobicContact CD1-CD2 4.2Å; L235-L386 HydrophobicContact CD2-CD2 4.22Å; L235-L389 HydrophobicContact CD2-CD2 3.71Å
236	K	95	Very high	86.8	Confident	66 Å²	66	58 Å²	58	29%	0.287	29%	0.292	S	S	.	.	H	α-helix	trans	-58.7	-49.5	177	-172.7	178	176.4	-174.4	0	111.5	L204 D230 C232 T234 L238 I239 D240	L204-K236 HydrophobicContact CD2-CB 3.9Å; L204-K236 HydrophobicContact CD2-CG 4.26Å; D230-K236 IonicContact OD1-NZ 3.4Å; C232-K236 WeakPolarHBondContact O-CB 3.21Å; C232-K236 PolarHBondContact O-N 3.36Å; T234-K236 VanDerWaalsContact C-N 3.34Å; T234-K236 PolarHBondContact O-N 3.12Å; K236-L238 VanDerWaalsContact C-N 3.32Å; K236-L238 PolarHBondContact O-N 3.15Å; K236-I239 PolarHBondContact O-N 3.48Å; K236-D240 WeakPolarHBondContact O-CB 3.36Å; K236-D240 PolarHBondContact O-N 3.12Å
237	L	94.5	Very high	88.4	Confident	52 Å²	52	52.6 Å²	52.6	27%	0.272	27%	0.266	S	S	.	.	H	α-helix	trans	-57.4	-44	177.4	-178.5	67	0	0	0	112.2	P233 T234 D240 S241 V244 W249	P233-L237 WeakPolarHBondContact O-CB 3.41Å; P233-L237 PolarHBondContact O-N 2.93Å; T234-L237 PolarHBondContact O-N 3.32Å; L237-D240 PolarHBondContact O-N 3.08Å; L237-S241 WeakPolarHBondContact O-CB 3.4Å; L237-S241 PolarHBondContact O-N 3.2Å; L237-V244 HydrophobicContact CD2-CG2 3.84Å; L237-V244 HydrophobicContact CG-CG1 4.41Å; L237-V244 HydrophobicContact CG-CG2 4.24Å; L237-W249 HydrophobicContact CD2-CB 4.3Å; L237-W249 HydrophobicContact CD2-CG 4.4Å
238	L	96	Very high	90.1	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-69.4	-34.9	-179.6	-71.7	173.4	0	0	0	112.9	V194 L197 T234 L235 K236 G242 V244 L372 L373 L382	V194-L238 HydrophobicContact CG1-CB 4.14Å; V194-L238 HydrophobicContact CG1-CD2 4.12Å; V194-L238 HydrophobicContact CG2-CD2 4.12Å; L197-L238 HydrophobicContact CD1-CB 4.2Å; L197-L238 HydrophobicContact CD1-CD1 4.05Å; T234-L238 HydrophobicContact CG2-CD1 4.21Å; T234-L238 WeakPolarHBondContact O-CB 3.29Å; T234-L238 VanDerWaalsContact O-CG 3.31Å; T234-L238 WeakPolarHBondContact O-CG 3.23Å; T234-L238 PolarHBondContact O-N 2.98Å; L235-L238 PolarHBondContact O-N 3.16Å; K236-L238 VanDerWaalsContact C-N 3.32Å; K236-L238 PolarHBondContact O-N 3.15Å; L238-G242 WeakPolarHBondContact CD2-O 3.43Å; L238-G242 VanDerWaalsContact O-CA 3.24Å; L238-G242 WeakPolarHBondContact O-CA 3.46Å; L238-G242 PolarHBondContact O-N 3.27Å; L238-V244 HydrophobicContact CD2-CG2 4.29Å; L238-L372 HydrophobicContact CD2-CD2 4.13Å; L238-L372 HydrophobicContact CG-CD2 4.4Å; L238-L373 HydrophobicContact CD1-CD2 4.06Å; L238-L373 HydrophobicContact CD1-CG 4.47Å; L238-L382 HydrophobicContact CD1-CD1 4Å; L238-L382 HydrophobicContact CD1-CD2 3.82Å; L238-L382 HydrophobicContact CD1-CG 4.35Å
239	I	95.2	Very high	91.4	Very high	19 Å²	19	43.8 Å²	43.8	10%	0.097	23%	0.227	C	C	.	.	H	α-helix	trans	-68.8	-41.5	175.2	-71.5	173.2	0	0	0	111	L197 L200 K201 L204 L235 K236	L197-I239 HydrophobicContact CB-CG1 4.22Å; L197-I239 WeakPolarHBondContact O-CD1 3Å; L200-I239 HydrophobicContact CB-CD1 4.44Å; K201-I239 HydrophobicContact CB-CG2 4.18Å; K201-I239 HydrophobicContact CD-CG2 4.22Å; K201-I239 HydrophobicContact CG-CG2 4.24Å; L204-I239 HydrophobicContact CD2-CD1 3.97Å; L235-I239 HydrophobicContact CD1-CD1 3.89Å; L235-I239 HydrophobicContact CD1-CG1 4.22Å; L235-I239 HydrophobicContact CG-CD1 3.9Å; L235-I239 WeakPolarHBondContact O-CG1 3.38Å; L235-I239 PolarHBondContact O-N 3.45Å; K236-I239 PolarHBondContact O-N 3.48Å
240	D	93.9	Very high	92.4	Very high	104 Å²	104	39.6 Å²	39.6	56%	0.556	21%	0.213	S	C	*	.	H	α-helix	trans	-81.3	-39.4	-174.2	-70.2	-21.8	0	0	0	112.8	K236 L237	K236-D240 WeakPolarHBondContact O-CB 3.36Å; K236-D240 PolarHBondContact O-N 3.12Å; L237-D240 PolarHBondContact O-N 3.08Å
241	S	92.8	Very high	92.7	Very high	81 Å²	81	39.1 Å²	39.1	57%	0.566	21%	0.211	S	C	*	.	H	α-helix	trans	-111.2	-5.2	-171.8	-54.2	0	0	0	0	114.2	L237	L237-S241 WeakPolarHBondContact O-CB 3.4Å; L237-S241 PolarHBondContact O-N 3.2Å
242	G	93.5	Very high	92.6	Very high	29 Å²	29	42.1 Å²	42.1	30%	0.299	24%	0.243	S	C	.	.			trans	76.1	-156.8	-175.6	0	0	0	0	0	113.2	L238 V244	L238-G242 WeakPolarHBondContact CD2-O 3.43Å; L238-G242 VanDerWaalsContact O-CA 3.24Å; L238-G242 WeakPolarHBondContact O-CA 3.46Å; L238-G242 PolarHBondContact O-N 3.27Å; G242-V244 WeakPolarHBondContact O-CG1 3.43Å; G242-V244 PolarHBondContact O-N 3Å
243	H	93.7	Very high	92.1	Very high	25 Å²	25	46 Å²	46	12%	0.116	27%	0.269	C	S	.	.	S	Bend	trans	-77.8	89.7	-175.6	-162.1	-172.1	0	0	0	111.1	T191 V194 Y371 L373	T191-H243 HydrophobicContact CG2-CB 4.21Å; T191-H243 PolarHBondContact OG1-ND1 3.46Å; V194-H243 HydrophobicContact CB-CB 4.16Å; V194-H243 HydrophobicContact CG1-CB 4.15Å; V194-H243 HydrophobicContact CG2-CB 4.12Å; H243-Y371 HydrophobicContact CB-CD1 4.35Å; H243-Y371 VanDerWaalsContact CE1-CB 3.42Å; H243-Y371 WeakPolarHBondContact CE1-CB 3.41Å; H243-Y371 AromaticContact CE1-CG 3.79Å; H243-Y371 AromaticContact CG-CD1 3.83Å; H243-Y371 AromaticContact ND1-CD1 3.8Å; H243-Y371 AromaticContact ND1-CG 3.81Å; H243-Y371 WeakPolarHBondContact NE2-CB 3.35Å; H243-Y371 WeakPolarHBondContact O-CD1 3.44Å; H243-Y371 WeakPolarHBondContact O-CE1 3.49Å; H243-L373 PolarHBondContact NE2-N 3.19Å
244	V	93.2	Very high	91.6	Very high	18 Å²	18	50.9 Å²	50.9	11%	0.109	29%	0.286	C	S	.	.			trans	-78.9	165.8	-177.1	-55.7	0	0	0	0	112.5	L237 L238 G242 T248 W249 L372	L237-V244 HydrophobicContact CD2-CG2 3.84Å; L237-V244 HydrophobicContact CG-CG1 4.41Å; L237-V244 HydrophobicContact CG-CG2 4.24Å; L238-V244 HydrophobicContact CD2-CG2 4.29Å; G242-V244 WeakPolarHBondContact O-CG1 3.43Å; G242-V244 PolarHBondContact O-N 3Å; V244-T248 VanDerWaalsContact CB-OG1 3.32Å; V244-T248 WeakPolarHBondContact CB-OG1 3.43Å; V244-W249 HydrophobicContact CG2-CB 4.46Å; V244-L372 HydrophobicContact CG2-CB 4.14Å; V244-L372 HydrophobicContact CG2-CD2 3.9Å; V244-L372 VanDerWaalsContact O-CB 3.29Å; V244-L372 WeakPolarHBondContact O-CB 3.3Å; V244-L372 PolarHBondContact O-N 3.02Å
245	M	91.7	Very high	91	Very high	26 Å²	26	51.9 Å²	51.9	13%	0.128	29%	0.293	C	S	.	.	B	Isolated β-bridge	trans	-83.4	159.7	176.9	-58	-73.2	-85.3	0	0	111.2	F247 T248 W249 I258 A369 R370 Y371	M245-F247 HydrophobicContact CB-CB 4.47Å; M245-F247 PolarHBondContact O-N 3.08Å; M245-T248 HydrophobicContact CB-CG2 4.29Å; M245-T248 PolarHBondContact N-OG1 2.81Å; M245-T248 VanDerWaalsContact N-OG1 3.14Å; M245-T248 PolarHBondContact O-N 2.99Å; M245-T248 PolarHBondContact O-OG1 3.39Å; M245-W249 PolarHBondContact O-N 3.24Å; M245-W249 VanDerWaalsContact O-N 3.09Å; M245-I258 HydrophobicContact CE-CD1 4.32Å; M245-A369 HydrophobicContact CE-CB 4.49Å; M245-A369 WeakPolarHBondContact CE-O 3.31Å; M245-R370 WeakPolarHBondContact CA-O 3.48Å; M245-Y371 HydrophobicContact SD-CD1 3.88Å; M245-Y371 HydrophobicContact SD-CE1 4.07Å; M245-Y371 HydrophobicContact SD-CG 4.3Å
246	V	91.6	Very high	90.2	Very high	3 Å²	3	59 Å²	59	2%	0.018	33%	0.326	C	S	.	.	H	α-helix	trans	-59	-36.4	171.9	176.7	0	0	0	0	110.9	W249 K250 R370	V246-W249 PolarHBondContact O-N 3.5Å; V246-K250 HydrophobicContact CG1-CD 4.12Å; V246-K250 HydrophobicContact CG1-CG 4.45Å; V246-K250 WeakPolarHBondContact O-CG 3.47Å; V246-K250 PolarHBondContact O-N 3.42Å; V246-R370 PolarHBondContact N-O 3.16Å
247	F	89.6	Confident	89.4	Confident	20 Å²	20	61.2 Å²	61.2	9%	0.088	34%	0.337	C	S	.	.	H	α-helix	trans	-56.7	-50.4	175.1	-175.1	-87.7	0	0	0	112.7	M245 W249 K250 N251 P255 I362 A364 S368	M245-F247 HydrophobicContact CB-CB 4.47Å; M245-F247 PolarHBondContact O-N 3.08Å; F247-W249 VanDerWaalsContact C-N 3.34Å; F247-K250 PolarHBondContact O-N 3.43Å; F247-N251 WeakPolarHBondContact CD2-ND2 3.31Å; F247-N251 HydrophobicContact CE1-CB 4.26Å; F247-N251 WeakPolarHBondContact CE1-ND2 3.45Å; F247-N251 WeakPolarHBondContact CE2-ND2 3.36Å; F247-N251 HydrophobicContact CZ-CB 4.49Å; F247-N251 WeakPolarHBondContact CZ-ND2 3.41Å; F247-N251 WeakPolarHBondContact O-CB 3.46Å; F247-N251 PolarHBondContact O-N 3.34Å; F247-N251 PolarHBondContact O-ND2 3.4Å; F247-P255 HydrophobicContact CD1-CB 3.81Å; F247-P255 HydrophobicContact CD1-CG 4.26Å; F247-P255 HydrophobicContact CE1-CB 4.03Å; F247-P255 HydrophobicContact CG-CB 4.29Å; F247-I362 HydrophobicContact CE1-CG2 3.5Å; F247-I362 VanDerWaalsContact CE1-CG2 3.5Å; F247-I362 HydrophobicContact CE2-CG2 4.45Å; F247-I362 HydrophobicContact CZ-CB 4.49Å; F247-I362 HydrophobicContact CZ-CG2 3.28Å; F247-A364 HydrophobicContact CB-CB 3.8Å; F247-A364 HydrophobicContact CD2-CB 3.93Å; F247-A364 HydrophobicContact CG-CB 3.9Å; F247-S368 WeakPolarHBondContact CB-O 3.32Å; F247-S368 PolarHBondContact N-O 2.93Å
248	T	90.7	Very high	88.7	Confident	18 Å²	18	63.3 Å²	63.3	11%	0.11	35%	0.348	C	S	.	.	H	α-helix	trans	-70.1	-34.9	-176.4	58.3	0	0	0	0	111.6	V244 M245 G252 C253 E254 P255	V244-T248 VanDerWaalsContact CB-OG1 3.32Å; V244-T248 WeakPolarHBondContact CB-OG1 3.43Å; M245-T248 HydrophobicContact CB-CG2 4.29Å; M245-T248 PolarHBondContact N-OG1 2.81Å; M245-T248 VanDerWaalsContact N-OG1 3.14Å; M245-T248 PolarHBondContact O-N 2.99Å; M245-T248 PolarHBondContact O-OG1 3.39Å; T248-G252 VanDerWaalsContact O-CA 3.28Å; T248-G252 WeakPolarHBondContact O-CA 3.43Å; T248-G252 PolarHBondContact O-N 3.49Å; T248-C253 WeakPolarHBondContact CA-O 3.32Å; T248-C253 WeakPolarHBondContact CG2-O 3.28Å; T248-E254 HydrophobicContact CG2-CB 4.43Å; T248-E254 HydrophobicContact CG2-CG 4.24Å; T248-P255 VanDerWaalsContact CG2-CD 3.49Å
249	W	91.9	Very high	88.1	Confident	71 Å²	71	68 Å²	68	27%	0.269	37%	0.37	S	S	.	.	H	α-helix	trans	-64.2	-40.3	174	178.3	66.5	0	0	0	112.7	T234 L237 V244 M245 V246 F247 L372 D377 A381	T234-W249 PolarHBondContact OG1-NE1 2.96Å; L237-W249 HydrophobicContact CD2-CB 4.3Å; L237-W249 HydrophobicContact CD2-CG 4.4Å; V244-W249 HydrophobicContact CG2-CB 4.46Å; M245-W249 PolarHBondContact O-N 3.24Å; M245-W249 VanDerWaalsContact O-N 3.09Å; V246-W249 PolarHBondContact O-N 3.5Å; F247-W249 VanDerWaalsContact C-N 3.34Å; W249-L372 HydrophobicContact CB-CD1 3.68Å; W249-L372 HydrophobicContact CB-CD2 4Å; W249-L372 HydrophobicContact CB-CG 4.39Å; W249-L372 HydrophobicContact CD2-CD1 3.35Å; W249-L372 HydrophobicContact CD2-CD2 4.31Å; W249-L372 HydrophobicContact CD2-CG 4.48Å; W249-L372 HydrophobicContact CE3-CD1 3.47Å; W249-L372 VanDerWaalsContact CE3-CD1 3.47Å; W249-L372 HydrophobicContact CG-CD1 3.45Å; W249-L372 VanDerWaalsContact CG-CD1 3.45Å; W249-L372 HydrophobicContact CG-CD2 3.73Å; W249-L372 HydrophobicContact CG-CG 4.25Å; W249-L372 HydrophobicContact CZ3-CD1 4.22Å; W249-D377 HydrophobicContact CH2-CB 4.16Å; W249-D377 HydrophobicContact CZ3-CB 4.08Å; W249-A381 HydrophobicContact CH2-CB 4.24Å; W249-A381 HydrophobicContact CZ2-CB 3.63Å
250	K	90	Very high	87.2	Confident	120 Å²	120	70.1 Å²	70.1	52%	0.522	40%	0.396	S	S	.	.	H	α-helix	trans	-77	-36.7	178.9	-70.6	-174.7	177.9	-176	0	113.4	V246 F247 D377	V246-K250 HydrophobicContact CG1-CD 4.12Å; V246-K250 HydrophobicContact CG1-CG 4.45Å; V246-K250 WeakPolarHBondContact O-CG 3.47Å; V246-K250 PolarHBondContact O-N 3.42Å; F247-K250 PolarHBondContact O-N 3.43Å; K250-D377 IonicContact NZ-OD2 3.96Å
251	N	88.3	Confident	86.5	Confident	96 Å²	96	68 Å²	68	51%	0.513	39%	0.39	S	S	.	.	H	α-helix	trans	-104.9	-14.1	-169.9	-61.7	-25.7	0	0	0	114.3	F247 C253	F247-N251 WeakPolarHBondContact CD2-ND2 3.31Å; F247-N251 HydrophobicContact CE1-CB 4.26Å; F247-N251 WeakPolarHBondContact CE1-ND2 3.45Å; F247-N251 WeakPolarHBondContact CE2-ND2 3.36Å; F247-N251 HydrophobicContact CZ-CB 4.49Å; F247-N251 WeakPolarHBondContact CZ-ND2 3.41Å; F247-N251 WeakPolarHBondContact O-CB 3.46Å; F247-N251 PolarHBondContact O-N 3.34Å; F247-N251 PolarHBondContact O-ND2 3.4Å; N251-C253 VanDerWaalsContact C-N 3.26Å; N251-C253 PolarHBondContact O-N 3.3Å
252	G	83.4	Confident	86	Confident	68 Å²	68	66.5 Å²	66.5	70%	0.701	38%	0.375	S	S	*	.	S	Bend	trans	73.2	8.3	-178.3	0	0	0	0	0	115.3	T248	T248-G252 VanDerWaalsContact O-CA 3.28Å; T248-G252 WeakPolarHBondContact O-CA 3.43Å; T248-G252 PolarHBondContact O-N 3.49Å
253	C	84	Confident	85.6	Confident	81 Å²	81	66.6 Å²	66.6	55%	0.547	37%	0.369	S	S	.	.	S	Bend	trans	-138.8	148.4	-179.6	-68.1	0	0	0	0	111.1	T248 N251	T248-C253 WeakPolarHBondContact CA-O 3.32Å; T248-C253 WeakPolarHBondContact CG2-O 3.28Å; N251-C253 VanDerWaalsContact C-N 3.26Å; N251-C253 PolarHBondContact O-N 3.3Å
254	E	82.9	Confident	85.4	Confident	166 Å²	166	70.1 Å²	70.1	78%	0.776	38%	0.384	S	S	*	.			trans	-67.1	142.1	175.7	-66.9	-169	162.6	0	0	112.3	T248	T248-E254 HydrophobicContact CG2-CB 4.43Å; T248-E254 HydrophobicContact CG2-CG 4.24Å
255	P	82.5	Confident	85.2	Confident	26 Å²	26	69.3 Å²	69.3	17%	0.169	38%	0.379	C	S	.	.			trans	-71.2	141.1	176.1	30.5	-34.4	0	0	0	111	F247 T248 I258 A364	F247-P255 HydrophobicContact CD1-CB 3.81Å; F247-P255 HydrophobicContact CD1-CG 4.26Å; F247-P255 HydrophobicContact CE1-CB 4.03Å; F247-P255 HydrophobicContact CG-CB 4.29Å; T248-P255 VanDerWaalsContact CG2-CD 3.49Å; P255-I258 HydrophobicContact CG-CG1 4.16Å; P255-A364 HydrophobicContact CB-CB 3.83Å; P255-A364 HydrophobicContact CG-CB 4.13Å
256	E	80.2	Confident	85.1	Confident	150 Å²	150	71.1 Å²	71.1	70%	0.701	39%	0.392	S	S	*	.	S	Bend	trans	-75.6	-30.3	174.9	-69.1	-179.6	165.5	0	0	111.8	I362	E256-I362 HydrophobicContact CB-CB 4.47Å; E256-I362 HydrophobicContact CG-CB 4.17Å; E256-I362 PolarHBondContact N-O 2.88Å
257	H	78.7	Confident	85.1	Confident	111 Å²	111	77.4 Å²	77.4	51%	0.514	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	142	177.7	-169.4	62.4	0	0	0	111	I362 V363 A364	H257-I362 PolarHBondContact N-O 2.93Å; H257-V363 HydrophobicContact CB-CG1 4.42Å; H257-V363 HydrophobicContact CB-CG2 4.19Å; H257-V363 WeakPolarHBondContact O-CA 3.48Å; H257-A364 PolarHBondContact O-N 2.89Å
258	I	79.6	Confident	85.1	Confident	96 Å²	96	77 Å²	77	49%	0.492	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	114.9	176.2	-58.8	170.6	0	0	0	107.5	M245 P255 A369	M245-I258 HydrophobicContact CE-CD1 4.32Å; P255-I258 HydrophobicContact CG-CG1 4.16Å; I258-A369 HydrophobicContact CG2-CB 4.03Å
259	E	81.9	Confident	85.2	Confident	101 Å²	101	76.2 Å²	76.2	47%	0.472	41%	0.414	S	S	.	.			trans	-83.3	179.3	170.8	-86	177.5	-170.3	0	0	111.4	S261 V363 A364 S365	E259-S261 PolarHBondContact O-N 2.74Å; E259-V363 HydrophobicContact CB-CG1 3.98Å; E259-V363 HydrophobicContact CG-CG1 3.49Å; E259-V363 VanDerWaalsContact CG-CG1 3.49Å; E259-A364 PolarHBondContact N-O 2.65Å; E259-S365 VanDerWaalsContact OE2-CB 3.25Å; E259-S365 WeakPolarHBondContact OE2-CB 3.44Å
260	G	76.2	Confident	85.3	Confident	63 Å²	63	78.3 Å²	78.3	65%	0.649	43%	0.426	S	S	*	.			trans	-52.9	130.2	179.7	0	0	0	0	0	113.1	G366	G260-G366 PolarHBondContact O-N 3.16Å; G260-G366 VanDerWaalsContact O-N 3.13Å
261	S	80.5	Confident	85.4	Confident	60 Å²	60	76.4 Å²	76.4	42%	0.42	42%	0.419	S	S	.	.			trans	-71.4	147.1	170.4	176.9	0	0	0	0	110.3	E259 D263	E259-S261 PolarHBondContact O-N 2.74Å; S261-D263 PolarHBondContact O-N 3.06Å; S261-D263 PolarHBondContact OG-N 3.41Å
262	D	82.8	Confident	85.5	Confident	49 Å²	49	72.9 Å²	72.9	26%	0.262	40%	0.4	S	S	.	.			trans	-81.2	13.6	171.2	64.6	-27.8	0	0	0	112.4	F264 G366 A367 R370	D262-F264 VanDerWaalsContact O-CD2 3.31Å; D262-F264 WeakPolarHBondContact O-CD2 3.3Å; D262-F264 WeakPolarHBondContact O-CE2 3.4Å; D262-F264 WeakPolarHBondContact O-CZ 3.42Å; D262-F264 PolarHBondContact O-N 2.74Å; D262-G366 VanDerWaalsContact OD1-C 3.28Å; D262-A367 PolarHBondContact OD1-N 3.31Å; D262-R370 VanDerWaalsContact C-NH2 3.26Å; D262-R370 VanDerWaalsContact CG-NH2 3.31Å; D262-R370 PolarHBondContact O-NH2 2.72Å; D262-R370 IonicContact OD1-CZ 2.76Å; D262-R370 VanDerWaalsContact OD1-CZ 3.31Å; D262-R370 IonicContact OD1-NE 3.15Å; D262-R370 PolarHBondContact OD1-NE 2.59Å; D262-R370 IonicContact OD1-NH2 2.89Å; D262-R370 PolarHBondContact OD1-NH2 3.07Å; D262-R370 IonicContact OD2-CZ 3.74Å; D262-R370 IonicContact OD2-NE 3.93Å; D262-R370 IonicContact OD2-NH2 2.65Å; D262-R370 PolarHBondContact OD2-NH2 3.06Å
263	D	84.9	Confident	85.9	Confident	31 Å²	31	73.6 Å²	73.6	17%	0.166	38%	0.384	C	S	.	.			trans	-72.7	110	173.9	-175.8	13.1	0	0	0	111.6	S261 V265 R477	S261-D263 PolarHBondContact O-N 3.06Å; S261-D263 PolarHBondContact OG-N 3.41Å; D263-V265 WeakPolarHBondContact OD1-CB 3.29Å; D263-V265 PolarHBondContact OD1-N 2.87Å; D263-R477 VanDerWaalsContact CG-NH2 3.33Å; D263-R477 IonicContact OD1-CZ 2.72Å; D263-R477 IonicContact OD1-NH1 2.75Å; D263-R477 PolarHBondContact OD1-NH1 2.78Å; D263-R477 IonicContact OD1-NH2 3.74Å; D263-R477 IonicContact OD2-CZ 2.87Å; D263-R477 IonicContact OD2-NH1 3.8Å; D263-R477 PolarHBondContact OD2-NH1 2.95Å; D263-R477 IonicContact OD2-NH2 3.92Å; D263-R477 PolarHBondContact OD2-NH2 3.48Å
264	F	88.3	Confident	86.3	Confident	98 Å²	98	74.5 Å²	74.5	43%	0.43	38%	0.381	S	S	.	.			trans	-82.1	-14.3	-179.7	-45.3	-76.4	0	0	0	113.3	D262 F267 L268	D262-F264 VanDerWaalsContact O-CD2 3.31Å; D262-F264 WeakPolarHBondContact O-CD2 3.3Å; D262-F264 WeakPolarHBondContact O-CE2 3.4Å; D262-F264 WeakPolarHBondContact O-CZ 3.42Å; D262-F264 PolarHBondContact O-N 2.74Å; F264-F267 PolarHBondContact O-N 2.79Å; F264-L268 HydrophobicContact CB-CD1 4.23Å; F264-L268 WeakPolarHBondContact O-CG 3.45Å; F264-L268 PolarHBondContact O-N 2.84Å
265	V	90.4	Very high	86.7	Confident	1 Å²	1	70.3 Å²	70.3	1%	0.006	36%	0.36	C	S	.	.	H	α-helix	trans	-60.6	-46.7	-172.1	172.5	0	0	0	0	113.1	L180 A183 E184 D263 F267 L268 L269 I476 R477	L180-V265 HydrophobicContact CD2-CG1 4.22Å; A183-V265 HydrophobicContact CB-CG1 4.17Å; A183-V265 HydrophobicContact CB-CG2 4.37Å; E184-V265 HydrophobicContact CB-CG1 4.27Å; D263-V265 WeakPolarHBondContact OD1-CB 3.29Å; D263-V265 PolarHBondContact OD1-N 2.87Å; V265-F267 VanDerWaalsContact C-N 3.29Å; V265-F267 PolarHBondContact O-N 3.22Å; V265-L268 PolarHBondContact O-N 3.06Å; V265-L269 VanDerWaalsContact O-CB 3.29Å; V265-L269 WeakPolarHBondContact O-CB 3.21Å; V265-L269 PolarHBondContact O-N 3.02Å; V265-I476 HydrophobicContact CG2-CG2 4.24Å; V265-R477 HydrophobicContact CG2-CB 4.42Å; V265-R477 HydrophobicContact CG2-CG 3.78Å
266	P	88.9	Confident	87	Confident	64 Å²	64	70 Å²	70	42%	0.416	36%	0.358	S	S	.	.	H	α-helix	trans	-58.4	-40.2	178.6	-26.3	35.7	0	0	0	113.1	Q270	P266-Q270 PolarHBondContact O-N 3.1Å; P266-Q270 VanDerWaalsContact O-N 3.11Å
267	F	90.7	Very high	87.4	Confident	135 Å²	135	67.4 Å²	67.4	59%	0.592	35%	0.349	S	S	*	.	H	α-helix	trans	-67	-48	177.3	173.7	-96.9	0	0	0	111.9	F264 V265 L269 Q270 Q271	F264-F267 PolarHBondContact O-N 2.79Å; V265-F267 VanDerWaalsContact C-N 3.29Å; V265-F267 PolarHBondContact O-N 3.22Å; F267-L269 VanDerWaalsContact C-N 3.31Å; F267-L269 PolarHBondContact O-N 3.17Å; F267-Q270 PolarHBondContact O-N 3.26Å; F267-Q271 PolarHBondContact O-N 2.96Å
268	L	91	Very high	87.8	Confident	11 Å²	11	67.7 Å²	67.7	6%	0.058	35%	0.35	C	S	.	.	H	α-helix	trans	-62.4	-39.6	178.5	-69.9	174.2	0	0	0	111.9	L180 F264 V265 Q271 E272 I480	L180-L268 HydrophobicContact CD1-CB 4.24Å; L180-L268 HydrophobicContact CD2-CB 3.85Å; F264-L268 HydrophobicContact CB-CD1 4.23Å; F264-L268 WeakPolarHBondContact O-CG 3.45Å; F264-L268 PolarHBondContact O-N 2.84Å; V265-L268 PolarHBondContact O-N 3.06Å; L268-Q271 PolarHBondContact O-N 3.5Å; L268-E272 WeakPolarHBondContact O-CB 3.4Å; L268-E272 PolarHBondContact O-N 3.17Å; L268-I480 HydrophobicContact CD1-CD1 3.94Å; L268-I480 HydrophobicContact CD1-CG1 3.91Å; L268-I480 HydrophobicContact CD2-CD1 4.07Å; L268-I480 HydrophobicContact CG-CD1 4.44Å
269	L	92.4	Very high	87.9	Confident	3 Å²	3	67.8 Å²	67.8	2%	0.016	35%	0.352	C	S	.	.	H	α-helix	trans	-62.6	-44.7	176.6	-178.6	62.8	0	0	0	111.7	L177 L180 E181 E184 V265 F267 E272 K273	L177-L269 HydrophobicContact CD1-CD1 3.65Å; L180-L269 HydrophobicContact CB-CB 4.33Å; L180-L269 HydrophobicContact CB-CD1 3.72Å; E181-L269 HydrophobicContact CG-CD1 3.93Å; E184-L269 HydrophobicContact CB-CD2 4.25Å; E184-L269 HydrophobicContact CG-CD2 4.3Å; E184-L269 WeakPolarHBondContact OE2-CD2 3.12Å; V265-L269 VanDerWaalsContact O-CB 3.29Å; V265-L269 WeakPolarHBondContact O-CB 3.21Å; V265-L269 PolarHBondContact O-N 3.02Å; F267-L269 VanDerWaalsContact C-N 3.31Å; F267-L269 PolarHBondContact O-N 3.17Å; L269-E272 PolarHBondContact O-N 3.02Å; L269-K273 HydrophobicContact CD1-CD 4.33Å; L269-K273 HydrophobicContact CD1-CG 4.43Å; L269-K273 HydrophobicContact CG-CD 4.18Å; L269-K273 WeakPolarHBondContact O-CB 3.31Å; L269-K273 VanDerWaalsContact O-CG 3.3Å; L269-K273 WeakPolarHBondContact O-CG 3.46Å; L269-K273 PolarHBondContact O-N 3.11Å
270	Q	92.9	Very high	87.9	Confident	114 Å²	114	65.8 Å²	65.8	53%	0.533	35%	0.349	S	S	.	.	H	α-helix	trans	-62.4	-44.5	176	-175.2	177.4	15.2	0	0	111.6	P266 F267 E272 K273 M274	P266-Q270 PolarHBondContact O-N 3.1Å; P266-Q270 VanDerWaalsContact O-N 3.11Å; F267-Q270 PolarHBondContact O-N 3.26Å; Q270-E272 VanDerWaalsContact C-N 3.34Å; Q270-E272 PolarHBondContact O-N 3.32Å; Q270-K273 PolarHBondContact O-N 2.98Å; Q270-M274 HydrophobicContact CG-CE 3.87Å; Q270-M274 WeakPolarHBondContact O-CG 3.11Å; Q270-M274 PolarHBondContact O-N 3.48Å
271	Q	92.5	Very high	88.1	Confident	80 Å²	80	68.5 Å²	68.5	37%	0.374	35%	0.346	S	S	.	.	H	α-helix	trans	-60.4	-44.3	177.8	-170.7	-174.5	32.5	0	0	111.4	F267 L268 M274 K275	F267-Q271 PolarHBondContact O-N 2.96Å; L268-Q271 PolarHBondContact O-N 3.5Å; Q271-M274 PolarHBondContact O-N 3.02Å; Q271-K275 WeakPolarHBondContact O-CG 3.49Å; Q271-K275 PolarHBondContact O-N 3.49Å; Q271-K275 VanDerWaalsContact O-N 3.12Å
272	E	90.5	Very high	88.1	Confident	23 Å²	23	70.9 Å²	70.9	11%	0.107	35%	0.35	C	S	.	.	H	α-helix	trans	-70.6	-39.5	-178.2	-153	61.2	-151	0	0	111.9	R176 L177 L180 L268 L269 Q270 M274 K275 V276	R176-E272 HydrophobicContact CG-CG 4.32Å; R176-E272 IonicContact NE-OE1 3.34Å; R176-E272 IonicContact NE-OE2 3.59Å; R176-E272 PolarHBondContact NE-OE2 3.41Å; L177-E272 HydrophobicContact CB-CG 4.38Å; L177-E272 HydrophobicContact CD1-CB 4.34Å; L180-E272 HydrophobicContact CD1-CB 3.95Å; L180-E272 HydrophobicContact CD1-CG 4.31Å; L268-E272 WeakPolarHBondContact O-CB 3.4Å; L268-E272 PolarHBondContact O-N 3.17Å; L269-E272 PolarHBondContact O-N 3.02Å; Q270-E272 VanDerWaalsContact C-N 3.34Å; Q270-E272 PolarHBondContact O-N 3.32Å; E272-M274 VanDerWaalsContact C-N 3.28Å; E272-M274 PolarHBondContact O-N 2.99Å; E272-K275 PolarHBondContact O-N 3.43Å; E272-K275 IonicContact OE2-NZ 3.92Å; E272-K275 PolarHBondContact OE2-NZ 3.11Å; E272-V276 WeakPolarHBondContact O-CG2 3.42Å; E272-V276 PolarHBondContact O-N 3.03Å
273	K	92.9	Very high	87.4	Confident	82 Å²	82	74.9 Å²	74.9	36%	0.357	37%	0.369	S	S	.	.	H	α-helix	trans	-57.5	-40.8	171.4	-76.1	174.6	175.1	167.3	0	111.9	L177 L269 Q270 N277	L177-K273 HydrophobicContact CD1-CG 3.68Å; L269-K273 HydrophobicContact CD1-CD 4.33Å; L269-K273 HydrophobicContact CD1-CG 4.43Å; L269-K273 HydrophobicContact CG-CD 4.18Å; L269-K273 WeakPolarHBondContact O-CB 3.31Å; L269-K273 VanDerWaalsContact O-CG 3.3Å; L269-K273 WeakPolarHBondContact O-CG 3.46Å; L269-K273 PolarHBondContact O-N 3.11Å; Q270-K273 PolarHBondContact O-N 2.98Å; K273-N277 WeakPolarHBondContact O-CB 3.49Å; K273-N277 PolarHBondContact O-N 3.43Å; K273-N277 VanDerWaalsContact O-N 3.08Å; K273-N277 PolarHBondContact O-ND2 2.98Å
274	M	92.4	Very high	86.7	Confident	100 Å²	100	78.4 Å²	78.4	49%	0.493	39%	0.388	S	S	.	.	H	α-helix	trans	-64.4	-43.3	176.2	-71.8	178.6	179.1	0	0	112.2	Q270 Q271 E272 N277 Q278	Q270-M274 HydrophobicContact CG-CE 3.87Å; Q270-M274 WeakPolarHBondContact O-CG 3.11Å; Q270-M274 PolarHBondContact O-N 3.48Å; Q271-M274 PolarHBondContact O-N 3.02Å; E272-M274 VanDerWaalsContact C-N 3.28Å; E272-M274 PolarHBondContact O-N 2.99Å; M274-N277 PolarHBondContact O-N 3.4Å; M274-Q278 VanDerWaalsContact O-CG 3.27Å; M274-Q278 WeakPolarHBondContact O-CG 3.47Å; M274-Q278 PolarHBondContact O-N 3.2Å
275	K	90.6	Very high	85.5	Confident	79 Å²	79	80.4 Å²	80.4	34%	0.343	40%	0.399	S	S	.	.	H	α-helix	trans	-62.5	-48	177.5	-68.8	176.8	-167.2	160.1	0	112.1	Q271 E272 N277 Q278 L279	Q271-K275 WeakPolarHBondContact O-CG 3.49Å; Q271-K275 PolarHBondContact O-N 3.49Å; Q271-K275 VanDerWaalsContact O-N 3.12Å; E272-K275 PolarHBondContact O-N 3.43Å; E272-K275 IonicContact OE2-NZ 3.92Å; E272-K275 PolarHBondContact OE2-NZ 3.11Å; K275-N277 VanDerWaalsContact C-N 3.32Å; K275-N277 PolarHBondContact O-N 2.89Å; K275-Q278 PolarHBondContact O-N 3.33Å; K275-L279 WeakPolarHBondContact O-CG 3.32Å; K275-L279 PolarHBondContact O-N 2.76Å
276	V	88.1	Confident	83.8	Confident	20 Å²	20	85.7 Å²	85.7	12%	0.121	43%	0.427	C	S	.	.	H	α-helix	trans	-61.8	-42.3	-179.9	173.7	0	0	0	0	110.9	N174 L177 E272 Q278 L279 S280	N174-V276 HydrophobicContact CB-CG2 4.36Å; L177-V276 HydrophobicContact CD2-CG2 4.28Å; E272-V276 WeakPolarHBondContact O-CG2 3.42Å; E272-V276 PolarHBondContact O-N 3.03Å; V276-Q278 PolarHBondContact O-N 2.98Å; V276-L279 PolarHBondContact O-N 2.79Å; V276-S280 PolarHBondContact O-N 3.21Å; V276-S280 PolarHBondContact O-OG 3.14Å; V276-S280 VanDerWaalsContact O-OG 3.11Å
277	N	88.6	Confident	81.9	Confident	95 Å²	95	92.3 Å²	92.3	51%	0.508	44%	0.444	S	S	.	.	H	α-helix	trans	-63.2	-40.9	175.8	-72.9	-20.2	0	0	0	112.5	K273 M274 K275 S280 M281	K273-N277 WeakPolarHBondContact O-CB 3.49Å; K273-N277 PolarHBondContact O-N 3.43Å; K273-N277 VanDerWaalsContact O-N 3.08Å; K273-N277 PolarHBondContact O-ND2 2.98Å; M274-N277 PolarHBondContact O-N 3.4Å; K275-N277 VanDerWaalsContact C-N 3.32Å; K275-N277 PolarHBondContact O-N 2.89Å; N277-S280 PolarHBondContact O-N 2.98Å; N277-M281 VanDerWaalsContact O-CG 3.31Å; N277-M281 WeakPolarHBondContact O-CG 3.24Å; N277-M281 PolarHBondContact O-N 2.9Å
278	Q	87.6	Confident	79.9	Confident	116 Å²	116	95.1 Å²	95.1	54%	0.542	46%	0.456	S	S	.	.	H	α-helix	trans	-62.3	-47.4	176.3	-75.2	169.8	11.4	0	0	111.4	M274 K275 V276 S280 M281 E282	M274-Q278 VanDerWaalsContact O-CG 3.27Å; M274-Q278 WeakPolarHBondContact O-CG 3.47Å; M274-Q278 PolarHBondContact O-N 3.2Å; K275-Q278 PolarHBondContact O-N 3.33Å; V276-Q278 PolarHBondContact O-N 2.98Å; Q278-S280 VanDerWaalsContact C-N 3.33Å; Q278-S280 PolarHBondContact O-N 2.72Å; Q278-M281 PolarHBondContact O-N 3.35Å; Q278-E282 WeakPolarHBondContact O-CG 3.41Å; Q278-E282 PolarHBondContact O-N 3.14Å
279	L	82.6	Confident	77.5	Confident	99 Å²	99	99.1 Å²	99.1	52%	0.518	48%	0.481	S	S	.	.	H	α-helix	trans	-61.3	-40.8	177.7	-69.3	171.8	0	0	0	112.1	K275 V276 M281 E282 M283	K275-L279 WeakPolarHBondContact O-CG 3.32Å; K275-L279 PolarHBondContact O-N 2.76Å; V276-L279 PolarHBondContact O-N 2.79Å; L279-M281 PolarHBondContact O-N 3.22Å; L279-E282 PolarHBondContact O-N 3.3Å; L279-M283 WeakPolarHBondContact O-CG 3.49Å; L279-M283 PolarHBondContact O-N 3.43Å
280	S	81	Confident	74.8	Confident	59 Å²	59	106.1 Å²	106.1	41%	0.413	52%	0.518	S	S	.	.	H	α-helix	trans	-63.2	-41.5	175.2	-65.3	0	0	0	0	112.2	V276 N277 Q278 E282 M283 D284	V276-S280 PolarHBondContact O-N 3.21Å; V276-S280 PolarHBondContact O-OG 3.14Å; V276-S280 VanDerWaalsContact O-OG 3.11Å; N277-S280 PolarHBondContact O-N 2.98Å; Q278-S280 VanDerWaalsContact C-N 3.33Å; Q278-S280 PolarHBondContact O-N 2.72Å; S280-E282 PolarHBondContact O-N 3.41Å; S280-M283 PolarHBondContact O-N 3.23Å; S280-D284 PolarHBondContact O-N 3.21Å; S280-D284 VanDerWaalsContact O-N 3.14Å
281	M	80	Confident	72.3	Confident	120 Å²	120	105.4 Å²	105.4	59%	0.591	53%	0.526	S	S	*	.	H	α-helix	trans	-64.4	-37.7	176	-72	179.5	-175.8	0	0	112.6	N277 Q278 L279 Q285	N277-M281 VanDerWaalsContact O-CG 3.31Å; N277-M281 WeakPolarHBondContact O-CG 3.24Å; N277-M281 PolarHBondContact O-N 2.9Å; Q278-M281 PolarHBondContact O-N 3.35Å; L279-M281 PolarHBondContact O-N 3.22Å; M281-Q285 VanDerWaalsContact O-CG 3.29Å; M281-Q285 WeakPolarHBondContact O-CG 3.47Å; M281-Q285 PolarHBondContact O-N 3.32Å
282	E	80.2	Confident	69.8	Low	110 Å²	110	109 Å²	109	51%	0.514	55%	0.548	S	S	.	.	H	α-helix	trans	-68.1	-38.4	176.5	-71.7	175.8	-175.3	0	0	112.2	Q278 L279 S280 Q285 N286	Q278-E282 WeakPolarHBondContact O-CG 3.41Å; Q278-E282 PolarHBondContact O-N 3.14Å; L279-E282 PolarHBondContact O-N 3.3Å; S280-E282 PolarHBondContact O-N 3.41Å; E282-Q285 PolarHBondContact O-N 3.43Å; E282-N286 WeakPolarHBondContact O-CB 3.3Å; E282-N286 PolarHBondContact O-N 2.92Å
283	M	69	Low	67.2	Low	133 Å²	133	113.8 Å²	113.8	66%	0.655	58%	0.578	S	S	*	*	H	α-helix	trans	-65.1	-39.2	175.8	-72.1	-177.9	72.7	0	0	112.6	L279 S280 N286 R287	L279-M283 WeakPolarHBondContact O-CG 3.49Å; L279-M283 PolarHBondContact O-N 3.43Å; S280-M283 PolarHBondContact O-N 3.23Å; M283-N286 PolarHBondContact O-N 2.81Å; M283-R287 PolarHBondContact O-N 3.17Å
284	D	70.1	Confident	64.5	Low	105 Å²	105	114.7 Å²	114.7	56%	0.561	59%	0.593	S	S	*	*	H	α-helix	trans	-70	-32.6	176.8	-77.9	-24	0	0	0	112.4	S280	S280-D284 PolarHBondContact O-N 3.21Å; S280-D284 VanDerWaalsContact O-N 3.14Å
285	Q	63.1	Low	61.9	Low	140 Å²	140	115.7 Å²	115.7	65%	0.654	61%	0.606	S	S	*	*	H	α-helix	trans	-72.3	-36.3	175.1	-71.6	174.1	36.2	0	0	112.4	M281 E282 R287 F288	M281-Q285 VanDerWaalsContact O-CG 3.29Å; M281-Q285 WeakPolarHBondContact O-CG 3.47Å; M281-Q285 PolarHBondContact O-N 3.32Å; E282-Q285 PolarHBondContact O-N 3.43Å; Q285-R287 VanDerWaalsContact C-N 3.29Å; Q285-R287 PolarHBondContact O-N 3.32Å; Q285-F288 PolarHBondContact O-N 3.12Å
286	N	53.6	Low	59.3	Low	111 Å²	111	119.1 Å²	119.1	59%	0.594	62%	0.624	S	S	*	*	H	α-helix	trans	-77.7	-5.4	179.8	-79.8	-13.7	0	0	0	114.6	E282 M283 F288 T289	E282-N286 WeakPolarHBondContact O-CB 3.3Å; E282-N286 PolarHBondContact O-N 2.92Å; M283-N286 PolarHBondContact O-N 2.81Å; N286-F288 PolarHBondContact O-N 3.43Å; N286-F288 VanDerWaalsContact O-N 3.16Å; N286-T289 PolarHBondContact O-N 3.42Å
287	R	49.3	Very low	57	Low	204 Å²	204	123.8 Å²	123.8	77%	0.77	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-9.8	169.3	-72.8	-162.4	-161.1	-159.7	5.9	113.8	M283 Q285	M283-R287 PolarHBondContact O-N 3.17Å; Q285-R287 VanDerWaalsContact C-N 3.29Å; Q285-R287 PolarHBondContact O-N 3.32Å
288	F	48.9	Very low	54.5	Low	193 Å²	193	126.7 Å²	126.7	85%	0.846	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.3	8.2	-179.8	-90.2	-80.8	0	0	0	115.5	Q285 N286	Q285-F288 PolarHBondContact O-N 3.12Å; N286-F288 PolarHBondContact O-N 3.43Å; N286-F288 VanDerWaalsContact O-N 3.16Å
289	T	41.8	Very low	52.1	Low	96 Å²	96	128.9 Å²	128.9	59%	0.589	68%	0.68	S	S	*	*			trans	-119.7	98	174.4	56.3	0	0	0	0	110.5	N286	N286-T289 PolarHBondContact O-N 3.42Å
290	D	34.4	Very low	50	Low	149 Å²	149	129.9 Å²	129.9	80%	0.797	69%	0.685	S	S	*	*			trans	-43.4	140.9	164.3	-161.2	-6.9	0	0	0	112.2
291	S	41.5	Very low	47.7	Very low	99 Å²	99	134.3 Å²	134.3	69%	0.692	70%	0.703	S	S	*	*			trans	57.2	68.8	157.4	-62.4	0	0	0	0	117.2
292	N	38.6	Very low	46	Very low	157 Å²	157	138.1 Å²	138.1	84%	0.84	71%	0.711	S	S	*	*			trans	-134.8	89.9	145.2	-123.7	-4.4	0	0	0	108.2	P294	N292-P294 WeakPolarHBondContact O-CD 3.43Å; N292-P294 VanDerWaalsContact O-N 3.1Å
293	V	35.9	Very low	43.8	Very low	122 Å²	122	137.2 Å²	137.2	74%	0.739	71%	0.709	S	S	*	*			trans	-54.4	113	168	177.5	0	0	0	0	106
294	P	38	Very low	42.6	Very low	102 Å²	102	139 Å²	139	66%	0.662	72%	0.716	S	S	*	*			trans	-56.8	137.8	169	-14.4	28.3	0	0	0	106.3	N292 E296	N292-P294 WeakPolarHBondContact O-CD 3.43Å; N292-P294 VanDerWaalsContact O-N 3.1Å; P294-E296 PolarHBondContact O-N 3.17Å
295	P	37.6	Very low	41.4	Very low	120 Å²	120	141 Å²	141	78%	0.779	73%	0.727	S	S	*	*			trans	-54.1	125.7	177	25.5	-31.3	0	0	0	106.4	P297	P295-P297 VanDerWaalsContact O-N 3.08Å
296	E	34.8	Very low	40.1	Very low	152 Å²	152	142.2 Å²	142.2	71%	0.71	73%	0.733	S	S	*	*			trans	-40.3	123	176.6	-70.9	176.8	160.8	0	0	107.1	P294 N298	P294-E296 PolarHBondContact O-N 3.17Å; E296-N298 PolarHBondContact O-N 2.9Å
297	P	40.3	Very low	39.6	Very low	118 Å²	118	142.2 Å²	142.2	77%	0.766	74%	0.737	S	S	*	*			trans	-57	111.3	179	23.2	-29.7	0	0	0	104.4	P295 E299	P295-P297 VanDerWaalsContact O-N 3.08Å; P297-E299 VanDerWaalsContact C-N 3.28Å; P297-E299 WeakPolarHBondContact O-CA 3.36Å; P297-E299 PolarHBondContact O-N 3.3Å
298	N	36	Very low	39	Very low	155 Å²	155	135.1 Å²	135.1	83%	0.829	73%	0.726	S	S	*	*			trans	-28.5	98.8	-174.1	-83.2	-21.3	0	0	0	107.5	E296 I300	E296-N298 PolarHBondContact O-N 2.9Å; N298-I300 PolarHBondContact O-N 3.35Å
299	E	36.6	Very low	38.7	Very low	163 Å²	163	130.2 Å²	130.2	76%	0.762	72%	0.722	S	S	*	*			trans	-62.1	104.2	176.6	-82.5	-170.6	160.3	0	0	101.2	P297 L301	P297-E299 VanDerWaalsContact C-N 3.28Å; P297-E299 WeakPolarHBondContact O-CA 3.36Å; P297-E299 PolarHBondContact O-N 3.3Å; E299-L301 PolarHBondContact O-N 2.99Å
300	I	38.6	Very low	38.6	Very low	120 Å²	120	131.7 Å²	131.7	62%	0.615	73%	0.725	S	S	*	*			trans	-58.9	97.5	164.3	-65.7	173.1	0	0	0	100.8	N298 W302	N298-I300 PolarHBondContact O-N 3.35Å; I300-W302 HydrophobicContact CG2-CD2 4.19Å; I300-W302 HydrophobicContact CG2-CG 4.38Å; I300-W302 HydrophobicContact CG2-CZ2 4.39Å; I300-W302 PolarHBondContact O-N 2.75Å; I300-W302 PolarHBondContact O-NE1 3.4Å
301	L	33.8	Very low	39.2	Very low	152 Å²	152	131.3 Å²	131.3	80%	0.796	72%	0.723	S	S	*	*			trans	-63.4	89.1	170.8	-177.1	75	0	0	0	102.8	E299 D303	E299-L301 PolarHBondContact O-N 2.99Å; L301-D303 PolarHBondContact O-N 2.85Å
302	W	43	Very low	39	Very low	200 Å²	200	133.5 Å²	133.5	76%	0.758	72%	0.72	S	S	*	*			trans	-60.3	97	168.3	-61.5	88.2	0	0	0	103.8	I300 E304	I300-W302 HydrophobicContact CG2-CD2 4.19Å; I300-W302 HydrophobicContact CG2-CG 4.38Å; I300-W302 HydrophobicContact CG2-CZ2 4.39Å; I300-W302 PolarHBondContact O-N 2.75Å; I300-W302 PolarHBondContact O-NE1 3.4Å; W302-E304 PolarHBondContact O-N 2.91Å
303	D	35	Very low	38.9	Very low	90 Å²	90	127.5 Å²	127.5	48%	0.481	70%	0.695	S	S	.	*			trans	-48	119.9	176.2	-177.2	-10.6	0	0	0	106.6	L301 N305 E306	L301-D303 PolarHBondContact O-N 2.85Å; D303-N305 PolarHBondContact O-N 3.16Å; D303-N305 PolarHBondContact OD1-N 2.93Å; D303-N305 VanDerWaalsContact OD1-N 3.14Å; D303-E306 HydrophobicContact CB-CB 4.4Å; D303-E306 PolarHBondContact O-N 3.07Å
304	E	44.1	Very low	38.9	Very low	170 Å²	170	127.4 Å²	127.4	79%	0.794	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.7	-16.3	-176	-67.7	-152.6	156.9	0	0	111.9	W302	W302-E304 PolarHBondContact O-N 2.91Å
305	N	44.3	Very low	38.9	Very low	149 Å²	149	127.8 Å²	127.8	80%	0.797	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	-10.1	179.1	-65.9	-22.9	0	0	0	114.9	D303	D303-N305 PolarHBondContact O-N 3.16Å; D303-N305 PolarHBondContact OD1-N 2.93Å; D303-N305 VanDerWaalsContact OD1-N 3.14Å
306	E	36.7	Very low	38.8	Very low	164 Å²	164	126.3 Å²	126.3	77%	0.766	67%	0.674	S	S	*	*			trans	-107.9	24.7	176.4	-141.8	174.5	-151.4	0	0	112.8	D303 G308	D303-E306 HydrophobicContact CB-CB 4.4Å; D303-E306 PolarHBondContact O-N 3.07Å; E306-G308 PolarHBondContact O-N 3.48Å
307	V	42.2	Very low	39.1	Very low	112 Å²	112	122.4 Å²	122.4	68%	0.679	66%	0.66	S	S	*	*			trans	-73.5	52.3	153.3	-160.8	0	0	0	0	108.9	A309	V307-A309 VanDerWaalsContact C-N 3.27Å; V307-A309 PolarHBondContact O-N 2.99Å
308	G	38	Very low	38.7	Very low	54 Å²	54	125.2 Å²	125.2	56%	0.557	66%	0.663	S	S	*	*			trans	-59.5	101.2	156.1	0	0	0	0	0	105.7	E306 I310	E306-G308 PolarHBondContact O-N 3.48Å; G308-I310 VanDerWaalsContact C-N 3.32Å; G308-I310 PolarHBondContact O-N 3.49Å
309	A	41.9	Very low	38.5	Very low	91 Å²	91	120.8 Å²	120.8	75%	0.752	64%	0.644	S	S	*	*			trans	1.4	76.9	159.9	0	0	0	0	0	114.7	V307 D311	V307-A309 VanDerWaalsContact C-N 3.27Å; V307-A309 PolarHBondContact O-N 2.99Å; A309-D311 PolarHBondContact O-N 3.37Å; A309-D311 VanDerWaalsContact O-N 3.16Å
310	I	40.1	Very low	38.5	Very low	126 Å²	126	117.6 Å²	117.6	65%	0.646	64%	0.636	S	S	*	*			trans	-86.4	79.5	152.7	-48.3	-176.8	0	0	0	104.6	G308 F312	G308-I310 VanDerWaalsContact C-N 3.32Å; G308-I310 PolarHBondContact O-N 3.49Å; I310-F312 HydrophobicContact CB-CD2 4.34Å; I310-F312 HydrophobicContact CB-CE2 3.99Å; I310-F312 HydrophobicContact CG2-CD2 3.65Å; I310-F312 HydrophobicContact CG2-CE1 4.17Å; I310-F312 HydrophobicContact CG2-CE2 3.19Å; I310-F312 HydrophobicContact CG2-CG 4.32Å; I310-F312 HydrophobicContact CG2-CZ 3.49Å; I310-F312 VanDerWaalsContact CG2-CZ 3.49Å; I310-F312 PolarHBondContact O-N 3.17Å
311	D	46	Very low	38.1	Very low	141 Å²	141	119.2 Å²	119.2	75%	0.754	64%	0.641	S	S	*	*			trans	-63.2	82.6	165.3	-177.7	26.3	0	0	0	107.9	A309 G313	A309-D311 PolarHBondContact O-N 3.37Å; A309-D311 VanDerWaalsContact O-N 3.16Å; D311-G313 PolarHBondContact O-N 3.36Å; D311-G313 WeakPolarHBondContact OD1-CA 3.28Å; D311-G313 PolarHBondContact OD1-N 3.43Å; D311-G313 VanDerWaalsContact OD1-N 3.07Å
312	F	38.1	Very low	37.8	Very low	146 Å²	146	119.1 Å²	119.1	64%	0.64	64%	0.641	S	S	*	*			trans	-72.5	74.7	151.6	-60.3	-81.7	0	0	0	105.7	I310 F315	I310-F312 HydrophobicContact CB-CD2 4.34Å; I310-F312 HydrophobicContact CB-CE2 3.99Å; I310-F312 HydrophobicContact CG2-CD2 3.65Å; I310-F312 HydrophobicContact CG2-CE1 4.17Å; I310-F312 HydrophobicContact CG2-CE2 3.19Å; I310-F312 HydrophobicContact CG2-CG 4.32Å; I310-F312 HydrophobicContact CG2-CZ 3.49Å; I310-F312 VanDerWaalsContact CG2-CZ 3.49Å; I310-F312 PolarHBondContact O-N 3.17Å; F312-F315 HydrophobicContact CD1-CE2 4.43Å
313	G	35.6	Very low	37.4	Very low	30 Å²	30	113.9 Å²	113.9	31%	0.309	63%	0.627	S	S	.	*			trans	-44.9	153.6	161.3	0	0	0	0	0	108.3	D311 F315	D311-G313 PolarHBondContact O-N 3.36Å; D311-G313 WeakPolarHBondContact OD1-CA 3.28Å; D311-G313 PolarHBondContact OD1-N 3.43Å; D311-G313 VanDerWaalsContact OD1-N 3.07Å; G313-F315 PolarHBondContact O-N 3.37Å
314	P	36.5	Very low	36.9	Very low	121 Å²	121	117.6 Å²	117.6	79%	0.786	64%	0.642	S	S	*	*			trans	-44.9	117.2	-170.1	21.9	-32.6	0	0	0	107.8	D316	P314-D316 VanDerWaalsContact C-N 3.26Å; P314-D316 WeakPolarHBondContact O-CA 3.35Å; P314-D316 PolarHBondContact O-N 3.03Å
315	F	38.5	Very low	36.2	Very low	110 Å²	110	115.4 Å²	115.4	48%	0.482	63%	0.634	S	S	.	*			trans	-45.7	111.8	163.1	-96.8	-82.7	0	0	0	103.3	F312 G313 V317	F312-F315 HydrophobicContact CD1-CE2 4.43Å; G313-F315 PolarHBondContact O-N 3.37Å; F315-V317 VanDerWaalsContact C-N 3.32Å; F315-V317 VanDerWaalsContact O-CG2 3.31Å; F315-V317 WeakPolarHBondContact O-CG2 3.5Å; F315-V317 PolarHBondContact O-N 3.14Å
316	D	33.9	Very low	35.4	Very low	88 Å²	88	114.1 Å²	114.1	47%	0.471	62%	0.623	S	S	.	*			trans	-59.1	107.1	-165.8	-173.8	7.2	0	0	0	104.8	P314 E318 S319	P314-D316 VanDerWaalsContact C-N 3.26Å; P314-D316 WeakPolarHBondContact O-CA 3.35Å; P314-D316 PolarHBondContact O-N 3.03Å; D316-E318 PolarHBondContact O-N 3.27Å; D316-E318 WeakPolarHBondContact OD1-CB 3.47Å; D316-E318 PolarHBondContact OD1-N 2.68Å; D316-E318 VanDerWaalsContact OD1-N 3.17Å; D316-S319 WeakPolarHBondContact CB-OG 3.46Å; D316-S319 CarbonylContact O-C 3.37Å; D316-S319 VanDerWaalsContact O-C 3.28Å; D316-S319 WeakPolarHBondContact O-CA 3.42Å; D316-S319 WeakPolarHBondContact O-CB 3.39Å; D316-S319 PolarHBondContact O-N 3.23Å; D316-S319 PolarHBondContact O-OG 2.9Å
317	V	41.3	Very low	35.2	Very low	70 Å²	70	117 Å²	117	42%	0.424	63%	0.627	S	S	.	*	G	3₁₀ helix	trans	-71.2	-10.2	-179.7	-174	0	0	0	0	108	L158 F315 V320	L158-V317 HydrophobicContact CD1-CG1 3.94Å; L158-V317 HydrophobicContact CD1-CG2 4.02Å; L158-V317 HydrophobicContact CD2-CG2 3.9Å; F315-V317 VanDerWaalsContact C-N 3.32Å; F315-V317 VanDerWaalsContact O-CG2 3.31Å; F315-V317 WeakPolarHBondContact O-CG2 3.5Å; F315-V317 PolarHBondContact O-N 3.14Å; V317-V320 WeakPolarHBondContact O-CG2 3.25Å; V317-V320 PolarHBondContact O-N 3.1Å
318	E	32.1	Very low	34.5	Very low	177 Å²	177	118.7 Å²	118.7	83%	0.827	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-82.9	-15.8	165	-54.7	-173.4	167.4	0	0	112.3	D316 V320	D316-E318 PolarHBondContact O-N 3.27Å; D316-E318 WeakPolarHBondContact OD1-CB 3.47Å; D316-E318 PolarHBondContact OD1-N 2.68Å; D316-E318 VanDerWaalsContact OD1-N 3.17Å; E318-V320 PolarHBondContact O-N 3.03Å
319	S	32.7	Very low	33.9	Very low	62 Å²	62	123 Å²	123	43%	0.434	64%	0.638	S	S	.	*	G	3₁₀ helix	trans	-86.9	42.3	157.7	78.1	0	0	0	0	111.6	D316 E321	D316-S319 WeakPolarHBondContact CB-OG 3.46Å; D316-S319 CarbonylContact O-C 3.37Å; D316-S319 VanDerWaalsContact O-C 3.28Å; D316-S319 WeakPolarHBondContact O-CA 3.42Å; D316-S319 WeakPolarHBondContact O-CB 3.39Å; D316-S319 PolarHBondContact O-N 3.23Å; D316-S319 PolarHBondContact O-OG 2.9Å; S319-E321 PolarHBondContact O-N 2.69Å
320	V	35.5	Very low	33.4	Very low	97 Å²	97	125 Å²	125	59%	0.588	63%	0.634	S	S	*	*	S	Bend		-58.2	82.8	125.9	-177.9	0	0	0	0	103.5	V317 E318 N322	V317-V320 WeakPolarHBondContact O-CG2 3.25Å; V317-V320 PolarHBondContact O-N 3.1Å; E318-V320 PolarHBondContact O-N 3.03Å; V320-N322 PolarHBondContact O-N 2.81Å
321	E	31.5	Very low	32.7	Very low	153 Å²	153	124.7 Å²	124.7	72%	0.715	64%	0.638	S	S	*	*			trans	-37.4	120	168	-75.9	175.1	155.2	0	0	103.4	S319 I323	S319-E321 PolarHBondContact O-N 2.69Å; E321-I323 WeakPolarHBondContact O-CA 3.39Å; E321-I323 WeakPolarHBondContact O-CG1 3.45Å; E321-I323 PolarHBondContact O-N 2.76Å
322	N	27.7	Very low	32	Very low	150 Å²	150	122.7 Å²	122.7	80%	0.802	64%	0.635	S	S	*	*			trans	-39.8	101.2	156.3	-69.8	-36.1	0	0	0	103.3	V320 E324	V320-N322 PolarHBondContact O-N 2.81Å; N322-E324 PolarHBondContact O-N 3.4Å
323	I	33	Very low	31.4	Very low	90 Å²	90	121.3 Å²	121.3	46%	0.462	64%	0.639	S	S	.	*			trans	-61.8	100.5	-176.5	-69.9	171.8	0	0	0	99.8	E321 I325	E321-I323 WeakPolarHBondContact O-CA 3.39Å; E321-I323 WeakPolarHBondContact O-CG1 3.45Å; E321-I323 PolarHBondContact O-N 2.76Å; I323-I325 PolarHBondContact O-N 2.87Å
324	E	24.3	Very low	30.9	Very low	169 Å²	169	125.7 Å²	125.7	79%	0.79	67%	0.665	S	S	*	*			trans	-56.1	106.1	174.9	-78.1	-174.4	159.1	0	0	101.3	N322 E326	N322-E324 PolarHBondContact O-N 3.4Å; E324-E326 PolarHBondContact O-N 3.49Å
325	I	31.1	Very low	30.5	Very low	124 Å²	124	125.2 Å²	125.2	64%	0.636	67%	0.665	S	S	*	*			trans	-55.8	99.2	164.2	-62.3	169.8	0	0	0	101	I323 R327	I323-I325 PolarHBondContact O-N 2.87Å; I325-R327 PolarHBondContact O-N 2.95Å
326	E	27.8	Very low	29.9	Very low	121 Å²	121	126.1 Å²	126.1	57%	0.565	69%	0.685	S	S	*	*			trans	-54.4	94.4	176.5	-77.7	174.4	167.5	0	0	104.5	E324 E328 R479	E324-E326 PolarHBondContact O-N 3.49Å; E326-E328 PolarHBondContact O-N 3.26Å; E326-R479 IonicContact OE1-NH1 3.31Å; E326-R479 IonicContact OE2-CZ 3.67Å; E326-R479 VanDerWaalsContact OE2-CZ 3.23Å; E326-R479 IonicContact OE2-NH1 3.3Å; E326-R479 PolarHBondContact OE2-NH1 2.85Å; E326-R479 IonicContact OE2-NH2 3.64Å; E326-R479 PolarHBondContact OE2-NH2 3.39Å
327	R	31	Very low	29.5	Very low	225 Å²	225	125.5 Å²	125.5	85%	0.849	70%	0.698	S	S	*	*			trans	-65.8	94.6	159.7	-72.4	-175.3	179.9	176.9	0.4	102	I325 N329	I325-R327 PolarHBondContact O-N 2.95Å; R327-N329 PolarHBondContact O-N 3.42Å
328	E	27.8	Very low	28.6	Very low	147 Å²	147	130.1 Å²	130.1	69%	0.687	72%	0.718	S	S	*	*			trans	-54.6	93.9	165.7	-74.8	-175	172.2	0	0	106.4	E326 I330	E326-E328 PolarHBondContact O-N 3.26Å; E328-I330 PolarHBondContact O-N 3.22Å
329	N	25.7	Very low	28.5	Very low	144 Å²	144	127.2 Å²	127.2	77%	0.77	71%	0.714	S	S	*	*			trans	-65.4	87.8	159.3	-93.8	-15.3	0	0	0	104.4	R327 V331	R327-N329 PolarHBondContact O-N 3.42Å; N329-V331 PolarHBondContact O-N 3.09Å
330	I	31.3	Very low	28.1	Very low	134 Å²	134	130.6 Å²	130.6	69%	0.687	73%	0.727	S	S	*	*			trans	-59.6	95.5	157.6	-57.5	171	0	0	0	104.2	E328 S332	E328-I330 PolarHBondContact O-N 3.22Å; I330-S332 PolarHBondContact O-N 3.49Å
331	V	25.5	Very low	27.8	Very low	119 Å²	119	133.2 Å²	133.2	72%	0.721	74%	0.738	S	S	*	*			trans	-58.9	86	162.4	172.2	0	0	0	0	105.4	N329 T333	N329-V331 PolarHBondContact O-N 3.09Å; V331-T333 HydrophobicContact CG1-CG2 4.24Å; V331-T333 PolarHBondContact O-N 2.87Å
332	S	30.5	Very low	28.3	Very low	99 Å²	99	131.1 Å²	131.1	69%	0.692	74%	0.737	S	S	*	*			trans	-67.9	97	155.6	-68.3	0	0	0	0	104.8	I330 S334	I330-S332 PolarHBondContact O-N 3.49Å; S332-S334 PolarHBondContact O-N 3.47Å
333	T	25.7	Very low	28.3	Very low	118 Å²	118	129 Å²	129	72%	0.724	74%	0.735	S	S	*	*			trans	-44.8	107.6	171.3	46.6	0	0	0	0	109.6	V331 S335	V331-T333 HydrophobicContact CG1-CG2 4.24Å; V331-T333 PolarHBondContact O-N 2.87Å; T333-S335 PolarHBondContact O-N 3.33Å; T333-S335 VanDerWaalsContact O-N 3.14Å
334	S	24.7	Very low	28.1	Very low	122 Å²	122	130.3 Å²	130.3	85%	0.853	75%	0.746	S	S	*	*			trans	-71.8	93.7	167.8	41.6	0	0	0	0	108.9	S332	S332-S334 PolarHBondContact O-N 3.47Å
335	S	29.1	Very low	28.3	Very low	111 Å²	111	129.9 Å²	129.9	78%	0.776	75%	0.75	S	S	*	*			trans	-101.6	93.4	158.1	65.3	0	0	0	0	109.3	T333	T333-S335 PolarHBondContact O-N 3.33Å; T333-S335 VanDerWaalsContact O-N 3.14Å
336	S	24.8	Very low	28.1	Very low	129 Å²	129	128.3 Å²	128.3	90%	0.902	76%	0.755	S	S	*	*			trans	24.7	119.8	136.7	-164.7	0	0	0	0	118.8
337	G	26.2	Very low	28.2	Very low	74 Å²	74	127 Å²	127	76%	0.763	77%	0.765	S	S	*	*			trans	173.4	73.5	164	0	0	0	0	0	113.6
338	M	22.6	Very low	28.3	Very low	168 Å²	168	121.7 Å²	121.7	83%	0.828	76%	0.762	S	S	*	*			trans	-63	145.7	156.3	-72.4	-70.6	-122.5	0	0	108.9
339	P	30.3	Very low	28.4	Very low	116 Å²	116	122.8 Å²	122.8	75%	0.753	77%	0.768	S	S	*	*				-142.9	143.5	79.7	33.8	-14.9	0	0	0	116.6
340	D	24.9	Very low	28.5	Very low	132 Å²	132	120.5 Å²	120.5	71%	0.706	76%	0.763	S	S	*	*			trans	22.6	116.6	134.8	-66.7	-27.4	0	0	0	121.5
341	N	27.7	Very low	28.4	Very low	152 Å²	152	119.3 Å²	119.3	81%	0.813	76%	0.758	S	S	*	*				55	165.1	125.7	-101.3	0.1	0	0	0	121.4
342	P	43	Very low	28.5	Very low	109 Å²	109	119.6 Å²	119.6	71%	0.708	76%	0.759	S	S	*	*			cis	-128.7	-167.8	-46.2	34.4	-15.6	0	0	0	110.7
343	S	27.9	Very low	28.3	Very low	106 Å²	106	119.7 Å²	119.7	74%	0.741	76%	0.756	S	S	*	*			trans	111.3	107.6	152.3	-140	0	0	0	0	115.6
344	V	28.6	Very low	28.7	Very low	117 Å²	117	120.8 Å²	120.8	71%	0.709	76%	0.757	S	S	*	*			trans	20	118.3	141.9	-74.3	0	0	0	0	118.4
345	D	28.5	Very low	29.2	Very low	160 Å²	160	120.2 Å²	120.2	86%	0.856	75%	0.753	S	S	*	*				-174.5	152.6	96.9	-98.4	-31.5	0	0	0	111.8
346	A	27.1	Very low	29.6	Very low	92 Å²	92	122.3 Å²	122.3	76%	0.76	75%	0.754	S	S	*	*			trans	-59.6	164.9	-179	0	0	0	0	0	113.7
347	A	29.6	Very low	30.3	Very low	93 Å²	93	123.4 Å²	123.4	77%	0.769	75%	0.75	S	S	*	*			trans	73.1	72.1	161.6	0	0	0	0	0	116
348	S	32.6	Very low	31	Very low	113 Å²	113	127.9 Å²	127.9	79%	0.79	75%	0.751	S	S	*	*				-155.3	95.2	126.7	-80	0	0	0	0	108.1	S350	S348-S350 PolarHBondContact O-N 2.91Å
349	Q	29.4	Very low	32.3	Very low	171 Å²	171	131.2 Å²	131.2	80%	0.799	75%	0.754	S	S	*	*			trans	-56.1	87.1	145.5	-69.8	174.1	1.3	0	0	106.1	N351	Q349-N351 PolarHBondContact O-N 3.05Å
350	S	27.5	Very low	33.3	Very low	96 Å²	96	134.9 Å²	134.9	67%	0.671	76%	0.758	S	S	*	*			trans	-65.6	86.9	149	58.1	0	0	0	0	104.3	S348 V352	S348-S350 PolarHBondContact O-N 2.91Å; S350-V352 VanDerWaalsContact C-N 3.25Å; S350-V352 PolarHBondContact O-N 2.93Å
351	N	29.4	Very low	34.9	Very low	109 Å²	109	133 Å²	133	58%	0.583	75%	0.753	S	S	*	*			trans	-41.3	111.7	140.2	-75	-21.6	0	0	0	104.4	Q349 T353	Q349-N351 PolarHBondContact O-N 3.05Å; N351-T353 WeakPolarHBondContact CB-OG1 3.46Å; N351-T353 PolarHBondContact O-N 3.08Å; N351-T353 PolarHBondContact O-OG1 3.01Å
352	V	27.5	Very low	37.1	Very low	124 Å²	124	129.3 Å²	129.3	75%	0.752	73%	0.732	S	S	*	*			trans	-67.6	66.9	157.2	-177.7	0	0	0	0	104.5	S350 L354	S350-V352 VanDerWaalsContact C-N 3.25Å; S350-V352 PolarHBondContact O-N 2.93Å; V352-L354 HydrophobicContact CG1-CD2 4.23Å; V352-L354 PolarHBondContact O-N 2.89Å
353	T	27.2	Very low	38.8	Very low	102 Å²	102	125.5 Å²	125.5	63%	0.626	71%	0.707	S	S	*	*			trans	-63.5	97.5	152.6	-35.2	0	0	0	0	101.1	N351 S355	N351-T353 WeakPolarHBondContact CB-OG1 3.46Å; N351-T353 PolarHBondContact O-N 3.08Å; N351-T353 PolarHBondContact O-OG1 3.01Å; T353-S355 VanDerWaalsContact C-N 3.33Å; T353-S355 PolarHBondContact O-N 3.17Å
354	L	34.9	Very low	41.3	Very low	140 Å²	140	120.5 Å²	120.5	73%	0.733	67%	0.672	S	S	*	*			trans	-43.9	110.8	168.7	-71.8	168.5	0	0	0	105.2	V352 I356	V352-L354 HydrophobicContact CG1-CD2 4.23Å; V352-L354 PolarHBondContact O-N 2.89Å; L354-I356 PolarHBondContact O-N 3.05Å
355	S	33.5	Very low	43.9	Very low	111 Å²	111	117.7 Å²	117.7	78%	0.776	66%	0.658	S	S	*	*			trans	-57.1	111.6	173.9	-58.6	0	0	0	0	104.1	T353 D357	T353-S355 VanDerWaalsContact C-N 3.33Å; T353-S355 PolarHBondContact O-N 3.17Å; S355-D357 PolarHBondContact O-N 3.16Å
356	I	39	Very low	46.5	Very low	154 Å²	154	111.1 Å²	111.1	79%	0.79	63%	0.628	S	S	*	*			trans	-63.6	88.4	176.9	-63.9	166.3	0	0	0	104.5	L354 E358	L354-I356 PolarHBondContact O-N 3.05Å; I356-E358 PolarHBondContact O-N 3.31Å
357	D	39.6	Very low	49.2	Very low	153 Å²	153	109.5 Å²	109.5	82%	0.818	62%	0.615	S	S	*	*			trans	-62.6	107.2	164.9	-116.2	-9.9	0	0	0	105.2	S355 R359	S355-D357 PolarHBondContact O-N 3.16Å; D357-R359 PolarHBondContact O-N 3.03Å
358	E	41.2	Very low	51.8	Low	168 Å²	168	107 Å²	107	79%	0.785	59%	0.591	S	S	*	*	S	Bend	trans	-53.7	130.9	-178.6	-61.2	-179.7	155.1	0	0	110.4	I356	I356-E358 PolarHBondContact O-N 3.31Å
359	R	48.4	Very low	54.4	Low	238 Å²	238	102 Å²	102	90%	0.898	56%	0.557	S	S	*	*			trans	79.9	54.7	164.7	-52.3	179.5	-174.7	-174.2	1.4	118.5	D357	D357-R359 PolarHBondContact O-N 3.03Å
360	K	51.3	Low	57.3	Low	192 Å²	192	94.7 Å²	94.7	84%	0.835	52%	0.522	S	S	*	.			trans	-117.5	129.2	140.5	-71.7	179.8	-177.3	172.3	0	108.6
361	P	58.1	Low	60.3	Low	93 Å²	93	94.8 Å²	94.8	60%	0.604	51%	0.509	S	S	*	.			trans	-57.1	146.4	177.2	22.4	-29.9	0	0	0	110	V363	P361-V363 HydrophobicContact CB-CG2 3.64Å; P361-V363 HydrophobicContact CG-CG2 3.65Å; P361-V363 PolarHBondContact O-N 3.14Å
362	I	74.1	Confident	63.4	Low	74 Å²	74	89.6 Å²	89.6	38%	0.379	48%	0.481	S	S	.	.			trans	-74.9	80.7	177.7	-60.9	177.8	0	0	0	107.1	F247 E256 H257	F247-I362 HydrophobicContact CE1-CG2 3.5Å; F247-I362 VanDerWaalsContact CE1-CG2 3.5Å; F247-I362 HydrophobicContact CE2-CG2 4.45Å; F247-I362 HydrophobicContact CZ-CB 4.49Å; F247-I362 HydrophobicContact CZ-CG2 3.28Å; E256-I362 HydrophobicContact CB-CB 4.47Å; E256-I362 HydrophobicContact CG-CB 4.17Å; E256-I362 PolarHBondContact N-O 2.88Å; H257-I362 PolarHBondContact N-O 2.93Å
363	V	79.7	Confident	66.5	Low	30 Å²	30	83.7 Å²	83.7	18%	0.182	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	128.9	-174.2	-172.8	0	0	0	0	110.7	H257 E259 P361	H257-V363 HydrophobicContact CB-CG1 4.42Å; H257-V363 HydrophobicContact CB-CG2 4.19Å; H257-V363 WeakPolarHBondContact O-CA 3.48Å; E259-V363 HydrophobicContact CB-CG1 3.98Å; E259-V363 HydrophobicContact CG-CG1 3.49Å; E259-V363 VanDerWaalsContact CG-CG1 3.49Å; P361-V363 HydrophobicContact CB-CG2 3.64Å; P361-V363 HydrophobicContact CG-CG2 3.65Å; P361-V363 PolarHBondContact O-N 3.14Å
364	A	79.6	Confident	69.5	Low	0 Å²	0	79.1 Å²	79.1	0%	0	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	119.8	166.9	0	0	0	0	0	109.2	F247 P255 H257 E259 A369	F247-A364 HydrophobicContact CB-CB 3.8Å; F247-A364 HydrophobicContact CD2-CB 3.93Å; F247-A364 HydrophobicContact CG-CB 3.9Å; P255-A364 HydrophobicContact CB-CB 3.83Å; P255-A364 HydrophobicContact CG-CB 4.13Å; H257-A364 PolarHBondContact O-N 2.89Å; E259-A364 PolarHBondContact N-O 2.65Å; A364-A369 HydrophobicContact CB-CB 4.35Å
365	S	83.1	Confident	72.2	Confident	58 Å²	58	73.6 Å²	73.6	41%	0.406	39%	0.39	S	S	.	.			trans	-131.2	150.9	178.4	65.1	0	0	0	0	112.2	E259 A367 S368	E259-S365 VanDerWaalsContact OE2-CB 3.25Å; E259-S365 WeakPolarHBondContact OE2-CB 3.44Å; S365-A367 PolarHBondContact O-N 2.92Å; S365-S368 PolarHBondContact O-N 3.45Å; S365-S368 VanDerWaalsContact O-N 3.15Å
366	G	84.7	Confident	74.9	Confident	22 Å²	22	70.9 Å²	70.9	23%	0.227	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	55.8	-125.5	179.3	0	0	0	0	0	112.8	G260 D262 S368 A369	G260-G366 PolarHBondContact O-N 3.16Å; G260-G366 VanDerWaalsContact O-N 3.13Å; D262-G366 VanDerWaalsContact OD1-C 3.28Å; G366-S368 PolarHBondContact O-N 3.36Å; G366-A369 WeakPolarHBondContact O-CA 3.34Å; G366-A369 WeakPolarHBondContact O-CB 3.3Å; G366-A369 PolarHBondContact O-N 2.96Å
367	A	82.7	Confident	77.4	Confident	59 Å²	59	67.9 Å²	67.9	49%	0.488	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-61.8	-28	-179.2	0	0	0	0	0	113.9	D262 S365 A369 R370	D262-A367 PolarHBondContact OD1-N 3.31Å; S365-A367 PolarHBondContact O-N 2.92Å; A367-A369 VanDerWaalsContact C-N 3.26Å; A367-A369 PolarHBondContact O-N 2.93Å; A367-R370 PolarHBondContact O-N 3.1Å
368	S	85.2	Confident	79.9	Confident	39 Å²	39	60.6 Å²	60.6	27%	0.273	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-73.5	-20	175.3	-70.7	0	0	0	0	112.7	F247 S365 G366 R370	F247-S368 WeakPolarHBondContact CB-O 3.32Å; F247-S368 PolarHBondContact N-O 2.93Å; S365-S368 PolarHBondContact O-N 3.45Å; S365-S368 VanDerWaalsContact O-N 3.15Å; G366-S368 PolarHBondContact O-N 3.36Å; S368-R370 VanDerWaalsContact C-N 3.29Å
369	A	87	Confident	82.4	Confident	9 Å²	9	54.8 Å²	54.8	7%	0.074	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-86.8	9.2	174.6	0	0	0	0	0	113.2	M245 I258 A364 G366 A367	M245-A369 HydrophobicContact CE-CB 4.49Å; M245-A369 WeakPolarHBondContact CE-O 3.31Å; I258-A369 HydrophobicContact CG2-CB 4.03Å; A364-A369 HydrophobicContact CB-CB 4.35Å; G366-A369 WeakPolarHBondContact O-CA 3.34Å; G366-A369 WeakPolarHBondContact O-CB 3.3Å; G366-A369 PolarHBondContact O-N 2.96Å; A367-A369 VanDerWaalsContact C-N 3.26Å; A367-A369 PolarHBondContact O-N 2.93Å
370	R	89.1	Confident	84.6	Confident	17 Å²	17	46.9 Å²	46.9	6%	0.064	27%	0.265	C	S	.	.	S	Bend	trans	-91	157	169.4	-63.9	-170.2	-178.9	-168.5	0.9	111.4	M245 V246 D262 A367 S368 D374 R477	M245-R370 WeakPolarHBondContact CA-O 3.48Å; V246-R370 PolarHBondContact N-O 3.16Å; D262-R370 VanDerWaalsContact C-NH2 3.26Å; D262-R370 VanDerWaalsContact CG-NH2 3.31Å; D262-R370 PolarHBondContact O-NH2 2.72Å; D262-R370 IonicContact OD1-CZ 2.76Å; D262-R370 VanDerWaalsContact OD1-CZ 3.31Å; D262-R370 IonicContact OD1-NE 3.15Å; D262-R370 PolarHBondContact OD1-NE 2.59Å; D262-R370 IonicContact OD1-NH2 2.89Å; D262-R370 PolarHBondContact OD1-NH2 3.07Å; D262-R370 IonicContact OD2-CZ 3.74Å; D262-R370 IonicContact OD2-NE 3.93Å; D262-R370 IonicContact OD2-NH2 2.65Å; D262-R370 PolarHBondContact OD2-NH2 3.06Å; A367-R370 PolarHBondContact O-N 3.1Å; S368-R370 VanDerWaalsContact C-N 3.29Å; R370-D374 HydrophobicContact CB-CB 4.18Å; R370-R477 PolarHBondContact NH1-O 3.5Å; R370-R477 PolarHBondContact NH2-O 2.72Å
371	Y	92.1	Very high	86.8	Confident	99 Å²	99	38.5 Å²	38.5	39%	0.388	23%	0.232	S	C	.	.	B	Isolated β-bridge	trans	-62.5	151.3	165.5	-73.7	-69.1	0	0	0	111.3	H243 M245 L373 D374	H243-Y371 HydrophobicContact CB-CD1 4.35Å; H243-Y371 VanDerWaalsContact CE1-CB 3.42Å; H243-Y371 WeakPolarHBondContact CE1-CB 3.41Å; H243-Y371 AromaticContact CE1-CG 3.79Å; H243-Y371 AromaticContact CG-CD1 3.83Å; H243-Y371 AromaticContact ND1-CD1 3.8Å; H243-Y371 AromaticContact ND1-CG 3.81Å; H243-Y371 WeakPolarHBondContact NE2-CB 3.35Å; H243-Y371 WeakPolarHBondContact O-CD1 3.44Å; H243-Y371 WeakPolarHBondContact O-CE1 3.49Å; M245-Y371 HydrophobicContact SD-CD1 3.88Å; M245-Y371 HydrophobicContact SD-CE1 4.07Å; M245-Y371 HydrophobicContact SD-CG 4.3Å; Y371-L373 VanDerWaalsContact C-N 3.34Å; Y371-L373 PolarHBondContact O-N 3.48Å; Y371-D374 WeakPolarHBondContact O-CB 3.47Å; Y371-D374 PolarHBondContact O-N 3.43Å; Y371-D374 VanDerWaalsContact O-N 3.09Å
372	L	93	Very high	88.6	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-57.6	-44.6	-172.8	178.9	58.1	0	0	0	112.6	T234 L238 V244 W249 D374 S375	T234-L372 HydrophobicContact CG2-CD2 3.81Å; L238-L372 HydrophobicContact CD2-CD2 4.13Å; L238-L372 HydrophobicContact CG-CD2 4.4Å; V244-L372 HydrophobicContact CG2-CB 4.14Å; V244-L372 HydrophobicContact CG2-CD2 3.9Å; V244-L372 VanDerWaalsContact O-CB 3.29Å; V244-L372 WeakPolarHBondContact O-CB 3.3Å; V244-L372 PolarHBondContact O-N 3.02Å; W249-L372 HydrophobicContact CB-CD1 3.68Å; W249-L372 HydrophobicContact CB-CD2 4Å; W249-L372 HydrophobicContact CB-CG 4.39Å; W249-L372 HydrophobicContact CD2-CD1 3.35Å; W249-L372 HydrophobicContact CD2-CD2 4.31Å; W249-L372 HydrophobicContact CD2-CG 4.48Å; W249-L372 HydrophobicContact CE3-CD1 3.47Å; W249-L372 VanDerWaalsContact CE3-CD1 3.47Å; W249-L372 HydrophobicContact CG-CD1 3.45Å; W249-L372 VanDerWaalsContact CG-CD1 3.45Å; W249-L372 HydrophobicContact CG-CD2 3.73Å; W249-L372 HydrophobicContact CG-CG 4.25Å; W249-L372 HydrophobicContact CZ3-CD1 4.22Å; L372-D374 VanDerWaalsContact C-N 3.27Å; L372-D374 PolarHBondContact O-N 3.08Å; L372-S375 WeakPolarHBondContact O-CB 3.48Å; L372-S375 PolarHBondContact O-N 3.32Å; L372-S375 VanDerWaalsContact O-N 3.16Å
373	L	92.9	Very high	89.7	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-78.9	-7.9	-178.1	-58.3	-171.9	0	0	0	113.8	L190 F193 V194 L238 H243 Y371 S375 R379 L382	L190-L373 HydrophobicContact CB-CB 4.42Å; L190-L373 HydrophobicContact CD1-CB 3.94Å; L190-L373 HydrophobicContact CD2-CB 4.28Å; L190-L373 HydrophobicContact CD2-CD1 4.41Å; L190-L373 HydrophobicContact CG-CB 4.46Å; F193-L373 HydrophobicContact CD1-CD1 3.87Å; F193-L373 HydrophobicContact CE1-CD1 4.11Å; V194-L373 HydrophobicContact CG2-CD1 3.42Å; V194-L373 VanDerWaalsContact CG2-CD1 3.42Å; V194-L373 HydrophobicContact CG2-CG 4.23Å; L238-L373 HydrophobicContact CD1-CD2 4.06Å; L238-L373 HydrophobicContact CD1-CG 4.47Å; H243-L373 PolarHBondContact NE2-N 3.19Å; Y371-L373 VanDerWaalsContact C-N 3.34Å; Y371-L373 PolarHBondContact O-N 3.48Å; L373-S375 VanDerWaalsContact C-N 3.29Å; L373-R379 HydrophobicContact CB-CG 4.29Å; L373-R379 HydrophobicContact CD2-CG 4.42Å; L373-R379 WeakPolarHBondContact O-CD 3.44Å; L373-R379 WeakPolarHBondContact O-CG 3.41Å; L373-R379 PolarHBondContact O-NH1 3.38Å; L373-L382 HydrophobicContact CD1-CD2 3.99Å; L373-L382 HydrophobicContact CD2-CB 4.16Å; L373-L382 HydrophobicContact CD2-CD2 3.64Å; L373-L382 HydrophobicContact CG-CD2 4.48Å
374	D	90.5	Very high	90.5	Very high	5 Å²	5	34.6 Å²	34.6	3%	0.027	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-74.8	-25.2	167.5	-82.8	3.9	0	0	0	110.9	L190 R370 Y371 L372 R379 R477	L190-D374 WeakPolarHBondContact CD1-OD1 3.28Å; R370-D374 HydrophobicContact CB-CB 4.18Å; Y371-D374 WeakPolarHBondContact O-CB 3.47Å; Y371-D374 PolarHBondContact O-N 3.43Å; Y371-D374 VanDerWaalsContact O-N 3.09Å; L372-D374 VanDerWaalsContact C-N 3.27Å; L372-D374 PolarHBondContact O-N 3.08Å; D374-R379 PolarHBondContact O-NH1 2.99Å; D374-R477 IonicContact OD2-CZ 2.66Å; D374-R477 IonicContact OD2-NE 3.13Å; D374-R477 IonicContact OD2-NH2 3.71Å; D374-R477 PolarHBondContact OD2-NH2 3.12Å
375	S	90.4	Very high	91.3	Very high	24 Å²	24	35.1 Å²	35.1	17%	0.168	21%	0.208	C	C	.	.	S	Bend	trans	-79	140.4	173.9	-179.3	0	0	0	0	112.1	L372 L373 D377 G378 R379	L372-S375 WeakPolarHBondContact O-CB 3.48Å; L372-S375 PolarHBondContact O-N 3.32Å; L372-S375 VanDerWaalsContact O-N 3.16Å; L373-S375 VanDerWaalsContact C-N 3.29Å; S375-D377 VanDerWaalsContact C-N 3.3Å; S375-D377 PolarHBondContact O-N 2.88Å; S375-D377 PolarHBondContact OG-N 3.28Å; S375-G378 PolarHBondContact O-N 2.95Å; S375-R379 PolarHBondContact O-N 2.94Å; S375-R379 VanDerWaalsContact O-N 3.13Å; S375-R379 PolarHBondContact O-NH1 3.45Å
376	A	90.5	Very high	92	Very high	55 Å²	55	32.3 Å²	32.3	46%	0.455	19%	0.189	S	C	.	.	H	α-helix	trans	-60.6	-41.2	172.9	0	0	0	0	0	111.6	G378 R379 Q380	A376-G378 PolarHBondContact O-N 3.44Å; A376-R379 PolarHBondContact O-N 3.08Å; A376-Q380 WeakPolarHBondContact O-CB 3.43Å; A376-Q380 PolarHBondContact O-N 2.94Å
377	D	92	Very high	92.6	Very high	90 Å²	90	35.4 Å²	35.4	48%	0.481	20%	0.199	S	C	.	.	H	α-helix	trans	-60.6	-46.2	178.9	-60.6	-20.7	0	0	0	111.5	W249 K250 S375 Q380 A381	W249-D377 HydrophobicContact CH2-CB 4.16Å; W249-D377 HydrophobicContact CZ3-CB 4.08Å; K250-D377 IonicContact NZ-OD2 3.96Å; S375-D377 VanDerWaalsContact C-N 3.3Å; S375-D377 PolarHBondContact O-N 2.88Å; S375-D377 PolarHBondContact OG-N 3.28Å; D377-Q380 PolarHBondContact O-N 3.24Å; D377-A381 WeakPolarHBondContact O-CB 3.47Å; D377-A381 PolarHBondContact O-N 3.3Å
378	G	93.1	Very high	93.3	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-66	-40.4	-178.8	0	0	0	0	0	112.3	S375 A376 A381 L382	S375-G378 PolarHBondContact O-N 2.95Å; A376-G378 PolarHBondContact O-N 3.44Å; G378-A381 PolarHBondContact O-N 3.05Å; G378-L382 PolarHBondContact O-N 3.47Å
379	R	93.4	Very high	93.8	Very high	46 Å²	46	34.1 Å²	34.1	17%	0.174	18%	0.179	C	C	.	.	H	α-helix	trans	-65.6	-43.9	173.6	-69.4	-167.2	-59.1	-81.7	0.1	112.2	L373 D374 S375 A376 A381 L382 L383 L465 M474	L373-R379 HydrophobicContact CB-CG 4.29Å; L373-R379 HydrophobicContact CD2-CG 4.42Å; L373-R379 WeakPolarHBondContact O-CD 3.44Å; L373-R379 WeakPolarHBondContact O-CG 3.41Å; L373-R379 PolarHBondContact O-NH1 3.38Å; D374-R379 PolarHBondContact O-NH1 2.99Å; S375-R379 PolarHBondContact O-N 2.94Å; S375-R379 VanDerWaalsContact O-N 3.13Å; S375-R379 PolarHBondContact O-NH1 3.45Å; A376-R379 PolarHBondContact O-N 3.08Å; R379-A381 VanDerWaalsContact C-N 3.31Å; R379-A381 PolarHBondContact O-N 2.95Å; R379-L382 PolarHBondContact O-N 3.17Å; R379-L383 VanDerWaalsContact O-CB 3.26Å; R379-L383 WeakPolarHBondContact O-CB 3.46Å; R379-L383 PolarHBondContact O-N 2.99Å; R379-L465 HydrophobicContact CG-CD1 4.45Å; R379-M474 PolarHBondContact NH1-SD 3.38Å
380	Q	94.7	Very high	94.3	Very high	72 Å²	72	34.6 Å²	34.6	34%	0.336	18%	0.18	S	C	.	.	H	α-helix	trans	-64.3	-39.7	178.8	-173.8	61	47.1	0	0	111.2	A376 D377 L383 N384	A376-Q380 WeakPolarHBondContact O-CB 3.43Å; A376-Q380 PolarHBondContact O-N 2.94Å; D377-Q380 PolarHBondContact O-N 3.24Å; Q380-L383 PolarHBondContact O-N 3.34Å; Q380-N384 PolarHBondContact NE2-OD1 2.99Å; Q380-N384 WeakPolarHBondContact O-CB 3.33Å; Q380-N384 PolarHBondContact O-N 2.83Å; Q380-N384 PolarHBondContact O-ND2 3.47Å; Q380-N384 PolarHBondContact O-OD1 3.22Å
381	A	95.9	Very high	94.6	Very high	17 Å²	17	36.4 Å²	36.4	14%	0.14	20%	0.199	C	C	.	.	H	α-helix	trans	-62.7	-47.7	175.1	0	0	0	0	0	111.7	T234 W249 D377 G378 R379 L383 N384 D385	T234-A381 HydrophobicContact CG2-CB 4.3Å; T234-A381 WeakPolarHBondContact OG1-CB 3.48Å; W249-A381 HydrophobicContact CH2-CB 4.24Å; W249-A381 HydrophobicContact CZ2-CB 3.63Å; D377-A381 WeakPolarHBondContact O-CB 3.47Å; D377-A381 PolarHBondContact O-N 3.3Å; G378-A381 PolarHBondContact O-N 3.05Å; R379-A381 VanDerWaalsContact C-N 3.31Å; R379-A381 PolarHBondContact O-N 2.95Å; A381-L383 VanDerWaalsContact C-N 3.33Å; A381-L383 PolarHBondContact O-N 2.94Å; A381-N384 PolarHBondContact O-N 3.49Å; A381-D385 PolarHBondContact O-N 3.32Å
382	L	96.9	Very high	94.7	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62.7	-39.4	174.6	179	60.5	0	0	0	112.2	F193 L197 T234 L235 L238 L373 G378 R379 D385 L386 L465	F193-L382 HydrophobicContact CE1-CD2 3.9Å; L197-L382 HydrophobicContact CD1-CD1 4.26Å; L197-L382 HydrophobicContact CD1-CD2 3.95Å; T234-L382 HydrophobicContact CG2-CB 4.18Å; L235-L382 HydrophobicContact CB-CD1 4Å; L235-L382 HydrophobicContact CD1-CD1 3.98Å; L238-L382 HydrophobicContact CD1-CD1 4Å; L238-L382 HydrophobicContact CD1-CD2 3.82Å; L238-L382 HydrophobicContact CD1-CG 4.35Å; L373-L382 HydrophobicContact CD1-CD2 3.99Å; L373-L382 HydrophobicContact CD2-CB 4.16Å; L373-L382 HydrophobicContact CD2-CD2 3.64Å; L373-L382 HydrophobicContact CG-CD2 4.48Å; G378-L382 PolarHBondContact O-N 3.47Å; R379-L382 PolarHBondContact O-N 3.17Å; L382-D385 WeakPolarHBondContact O-CB 3.47Å; L382-D385 PolarHBondContact O-N 3.12Å; L382-L386 HydrophobicContact CD1-CD1 4.31Å; L382-L386 HydrophobicContact CD1-CG 4.14Å; L382-L386 HydrophobicContact CG-CD1 4.06Å; L382-L386 HydrophobicContact CG-CG 4.35Å; L382-L386 VanDerWaalsContact O-CG 3.32Å; L382-L386 WeakPolarHBondContact O-CG 3.28Å; L382-L386 PolarHBondContact O-N 3.39Å; L382-L465 HydrophobicContact CD2-CD2 4Å; L382-L465 HydrophobicContact CG-CD2 4.24Å
383	L	96.3	Very high	94.8	Very high	35 Å²	35	32.8 Å²	32.8	18%	0.183	19%	0.185	C	C	.	.	H	α-helix	trans	-62.5	-44.3	178.2	-174.7	70.1	0	0	0	110.9	R379 Q380 A381 D385 L386 L387 L462 T466	R379-L383 VanDerWaalsContact O-CB 3.26Å; R379-L383 WeakPolarHBondContact O-CB 3.46Å; R379-L383 PolarHBondContact O-N 2.99Å; Q380-L383 PolarHBondContact O-N 3.34Å; A381-L383 VanDerWaalsContact C-N 3.33Å; A381-L383 PolarHBondContact O-N 2.94Å; L383-D385 VanDerWaalsContact C-N 3.34Å; L383-L386 PolarHBondContact O-N 2.66Å; L383-L387 HydrophobicContact CG-CD1 4.14Å; L383-L387 WeakPolarHBondContact O-CB 3.33Å; L383-L387 VanDerWaalsContact O-CG 3.24Å; L383-L387 WeakPolarHBondContact O-CG 3.38Å; L383-L387 PolarHBondContact O-N 2.82Å; L383-L462 HydrophobicContact CD1-CD2 3.52Å; L383-T466 HydrophobicContact CD1-CG2 3.84Å
384	N	96.5	Very high	94.9	Very high	79 Å²	79	36.3 Å²	36.3	42%	0.422	20%	0.202	S	C	.	.	H	α-helix	trans	-60.3	-45.4	175.5	-67.8	-16.7	0	0	0	111	Q380 A381 L386 L387 E388	Q380-N384 PolarHBondContact NE2-OD1 2.99Å; Q380-N384 WeakPolarHBondContact O-CB 3.33Å; Q380-N384 PolarHBondContact O-N 2.83Å; Q380-N384 PolarHBondContact O-ND2 3.47Å; Q380-N384 PolarHBondContact O-OD1 3.22Å; A381-N384 PolarHBondContact O-N 3.49Å; N384-L386 PolarHBondContact O-N 3.49Å; N384-L387 PolarHBondContact O-N 3.44Å; N384-E388 WeakPolarHBondContact O-CB 3.44Å; N384-E388 PolarHBondContact O-N 3.23Å
385	D	97.7	Very high	94.9	Very high	11 Å²	11	41 Å²	41	6%	0.059	22%	0.219	C	C	.	.	H	α-helix	trans	-60.4	-43.3	177.3	-74.6	6.3	0	0	0	112.3	C232 T234 L235 A381 L382 L383 E388 L389	C232-D385 VanDerWaalsContact CA-CG 3.41Å; C232-D385 WeakPolarHBondContact CA-OD2 3.48Å; C232-D385 HydrophobicContact CB-CB 3.83Å; C232-D385 PolarHBondContact SG-O 2.85Å; C232-D385 VanDerWaalsContact SG-O 3.39Å; T234-D385 WeakPolarHBondContact CA-OD2 3.31Å; T234-D385 WeakPolarHBondContact CB-OD2 3.32Å; T234-D385 PolarHBondContact N-OD2 3.18Å; L235-D385 HydrophobicContact CB-CB 4.04Å; L235-D385 PolarHBondContact N-OD2 3Å; A381-D385 PolarHBondContact O-N 3.32Å; L382-D385 WeakPolarHBondContact O-CB 3.47Å; L382-D385 PolarHBondContact O-N 3.12Å; L383-D385 VanDerWaalsContact C-N 3.34Å; D385-E388 PolarHBondContact O-N 3.32Å; D385-L389 WeakPolarHBondContact O-CB 3.37Å; D385-L389 PolarHBondContact O-N 3.3Å
386	L	97.7	Very high	94.8	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-67.8	-38.2	177.2	-70.9	173	0	0	0	111.9	L200 L235 L382 L383 N384 N390 V458 A461 L462	L200-L386 HydrophobicContact CD1-CD2 3.6Å; L235-L386 HydrophobicContact CD1-CD2 4.2Å; L235-L386 HydrophobicContact CD2-CD2 4.22Å; L382-L386 HydrophobicContact CD1-CD1 4.31Å; L382-L386 HydrophobicContact CD1-CG 4.14Å; L382-L386 HydrophobicContact CG-CD1 4.06Å; L382-L386 HydrophobicContact CG-CG 4.35Å; L382-L386 VanDerWaalsContact O-CG 3.32Å; L382-L386 WeakPolarHBondContact O-CG 3.28Å; L382-L386 PolarHBondContact O-N 3.39Å; L383-L386 PolarHBondContact O-N 2.66Å; N384-L386 PolarHBondContact O-N 3.49Å; L386-N390 VanDerWaalsContact O-CB 3.26Å; L386-N390 WeakPolarHBondContact O-CB 3.31Å; L386-N390 PolarHBondContact O-N 3.09Å; L386-V458 HydrophobicContact CB-CG1 4.38Å; L386-V458 HydrophobicContact CD2-CG1 4.35Å; L386-V458 VanDerWaalsContact O-CG1 3.29Å; L386-V458 WeakPolarHBondContact O-CG1 3.41Å; L386-A461 HydrophobicContact CD1-CB 4.23Å; L386-A461 HydrophobicContact CD2-CB 4.3Å; L386-L462 HydrophobicContact CB-CD2 3.51Å; L386-L462 HydrophobicContact CB-CG 4.03Å; L386-L462 HydrophobicContact CD1-CD2 4.08Å; L386-L462 HydrophobicContact CD1-CG 4.49Å; L386-L462 HydrophobicContact CG-CD2 4.46Å
387	L	97.1	Very high	94.8	Very high	86 Å²	86	39.1 Å²	39.1	45%	0.45	20%	0.198	S	C	.	.	H	α-helix	trans	-67.5	-40.8	175.3	-71.9	171.8	0	0	0	111.7	L383 N384 N390 A391 L462	L383-L387 HydrophobicContact CG-CD1 4.14Å; L383-L387 WeakPolarHBondContact O-CB 3.33Å; L383-L387 VanDerWaalsContact O-CG 3.24Å; L383-L387 WeakPolarHBondContact O-CG 3.38Å; L383-L387 PolarHBondContact O-N 2.82Å; N384-L387 PolarHBondContact O-N 3.44Å; L387-N390 PolarHBondContact O-N 3.15Å; L387-A391 WeakPolarHBondContact O-CB 3.48Å; L387-A391 PolarHBondContact O-N 3.33Å; L387-L462 HydrophobicContact CD2-CD1 4.04Å; L387-L462 HydrophobicContact CD2-CD2 4.19Å; L387-L462 HydrophobicContact CG-CD2 4.22Å
388	E	96.7	Very high	94.5	Very high	72 Å²	72	39.4 Å²	39.4	34%	0.336	20%	0.196	S	C	.	.	H	α-helix	trans	-59.4	-50.9	172.9	-180	-178.7	150.8	0	0	110.8	Y207 N384 D385 N390 A391 F392	Y207-E388 HydrophobicContact CE1-CG 4.11Å; Y207-E388 VanDerWaalsContact CE1-OE1 3.3Å; Y207-E388 WeakPolarHBondContact CE1-OE1 3.41Å; Y207-E388 PolarHBondContact OH-OE1 2.93Å; N384-E388 WeakPolarHBondContact O-CB 3.44Å; N384-E388 PolarHBondContact O-N 3.23Å; D385-E388 PolarHBondContact O-N 3.32Å; E388-N390 VanDerWaalsContact C-N 3.34Å; E388-N390 PolarHBondContact O-N 2.97Å; E388-A391 PolarHBondContact O-N 3.44Å; E388-F392 PolarHBondContact O-N 3.37Å
389	L	97.1	Very high	94.1	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-60.9	-42.7	177.7	-178	60.9	0	0	0	111.8	A203 Y207 L235 D385 F392 L393 V458	A203-L389 HydrophobicContact CB-CD1 4.48Å; A203-L389 HydrophobicContact CB-CD2 4.28Å; Y207-L389 HydrophobicContact CD1-CD1 4.38Å; L235-L389 HydrophobicContact CD2-CD2 3.71Å; D385-L389 WeakPolarHBondContact O-CB 3.37Å; D385-L389 PolarHBondContact O-N 3.3Å; L389-F392 HydrophobicContact CD1-CD1 4.33Å; L389-F392 PolarHBondContact O-N 3.47Å; L389-L393 HydrophobicContact CD1-CD1 4.36Å; L389-L393 HydrophobicContact CD1-CG 4.31Å; L389-L393 HydrophobicContact CG-CD1 4.13Å; L389-L393 VanDerWaalsContact O-CG 3.27Å; L389-L393 WeakPolarHBondContact O-CG 3.43Å; L389-L393 PolarHBondContact O-N 3.09Å; L389-V458 HydrophobicContact CD2-CG2 3.79Å; L389-V458 HydrophobicContact CG-CG2 4.07Å
390	N	96.7	Very high	93.5	Very high	19 Å²	19	38.6 Å²	38.6	10%	0.102	20%	0.196	C	C	.	.	H	α-helix	trans	-61.8	-45.6	177.1	-171.7	32.1	0	0	0	111.8	L386 L387 E388 F392 L393 Q394 V458	L386-N390 VanDerWaalsContact O-CB 3.26Å; L386-N390 WeakPolarHBondContact O-CB 3.31Å; L386-N390 PolarHBondContact O-N 3.09Å; L387-N390 PolarHBondContact O-N 3.15Å; E388-N390 VanDerWaalsContact C-N 3.34Å; E388-N390 PolarHBondContact O-N 2.97Å; N390-F392 VanDerWaalsContact C-N 3.35Å; N390-F392 PolarHBondContact O-N 2.97Å; N390-L393 PolarHBondContact O-N 2.96Å; N390-Q394 PolarHBondContact ND2-NE2 2.96Å; N390-Q394 WeakPolarHBondContact O-CB 3.35Å; N390-Q394 VanDerWaalsContact O-CG 3.3Å; N390-Q394 WeakPolarHBondContact O-CG 3.47Å; N390-Q394 PolarHBondContact O-N 2.91Å; N390-Q394 PolarHBondContact OD1-NE2 3.29Å; N390-Q394 VanDerWaalsContact OD1-NE2 3.11Å; N390-V458 HydrophobicContact CB-CG1 3.72Å
391	A	95.6	Very high	92.9	Very high	55 Å²	55	39.9 Å²	39.9	46%	0.455	20%	0.2	S	C	.	.	H	α-helix	trans	-62.9	-42.5	178.8	0	0	0	0	0	111.5	L387 E388 R395	L387-A391 WeakPolarHBondContact O-CB 3.48Å; L387-A391 PolarHBondContact O-N 3.33Å; E388-A391 PolarHBondContact O-N 3.44Å; A391-R395 WeakPolarHBondContact O-CB 3.16Å; A391-R395 PolarHBondContact O-N 3.37Å
392	F	94.6	Very high	92	Very high	23 Å²	23	41.7 Å²	41.7	10%	0.101	21%	0.206	C	C	.	.	H	α-helix	trans	-58.5	-51.4	173.3	163.6	-105	0	0	0	111.7	L206 Y207 F210 E388 L389 N390 Q394 R395 F396	L206-F392 HydrophobicContact CD2-CE1 4.36Å; L206-F392 HydrophobicContact CG-CE1 4.05Å; L206-F392 HydrophobicContact CG-CZ 4.21Å; Y207-F392 VanDerWaalsContact CA-CE1 3.49Å; Y207-F392 HydrophobicContact CD2-CB 3.98Å; Y207-F392 AromaticContact CD2-CD1 3.56Å; Y207-F392 HydrophobicContact CD2-CD1 3.56Å; Y207-F392 AromaticContact CD2-CD2 3.4Å; Y207-F392 HydrophobicContact CD2-CD2 3.4Å; Y207-F392 VanDerWaalsContact CD2-CD2 3.4Å; Y207-F392 AromaticContact CD2-CE1 3.86Å; Y207-F392 HydrophobicContact CD2-CE1 3.86Å; Y207-F392 AromaticContact CD2-CE2 3.72Å; Y207-F392 HydrophobicContact CD2-CE2 3.72Å; Y207-F392 AromaticContact CD2-CG 3.32Å; Y207-F392 HydrophobicContact CD2-CG 3.32Å; Y207-F392 AromaticContact CD2-CZ 3.93Å; Y207-F392 HydrophobicContact CD2-CZ 3.93Å; Y207-F392 HydrophobicContact CE2-CB 4.01Å; Y207-F392 HydrophobicContact CE2-CD1 4.42Å; Y207-F392 AromaticContact CE2-CD2 3.7Å; Y207-F392 HydrophobicContact CE2-CD2 3.7Å; Y207-F392 HydrophobicContact CE2-CE2 4.32Å; Y207-F392 AromaticContact CE2-CG 3.75Å; Y207-F392 HydrophobicContact CE2-CG 3.75Å; Y207-F392 HydrophobicContact CG-CB 4.42Å; Y207-F392 AromaticContact CG-CD1 3.71Å; Y207-F392 HydrophobicContact CG-CD1 3.71Å; Y207-F392 HydrophobicContact CG-CD2 4.37Å; Y207-F392 HydrophobicContact CG-CE1 4.05Å; Y207-F392 AromaticContact CG-CG 3.88Å; Y207-F392 HydrophobicContact CG-CG 3.88Å; F210-F392 HydrophobicContact CB-CE2 4.03Å; F210-F392 HydrophobicContact CB-CZ 3.88Å; F210-F392 HydrophobicContact CD1-CD2 4.46Å; F210-F392 AromaticContact CD1-CE2 3.55Å; F210-F392 HydrophobicContact CD1-CE2 3.55Å; F210-F392 HydrophobicContact CD1-CZ 4.28Å; F210-F392 HydrophobicContact CE1-CE2 4.14Å; F210-F392 AromaticContact CG-CE2 3.8Å; F210-F392 HydrophobicContact CG-CE2 3.8Å; F210-F392 HydrophobicContact CG-CZ 4.08Å; E388-F392 PolarHBondContact O-N 3.37Å; L389-F392 HydrophobicContact CD1-CD1 4.33Å; L389-F392 PolarHBondContact O-N 3.47Å; N390-F392 VanDerWaalsContact C-N 3.35Å; N390-F392 PolarHBondContact O-N 2.97Å; F392-Q394 VanDerWaalsContact C-N 3.35Å; F392-Q394 PolarHBondContact O-N 3.34Å; F392-R395 PolarHBondContact O-N 2.98Å; F392-F396 HydrophobicContact CE2-CB 4.39Å; F392-F396 HydrophobicContact CE2-CD2 4.16Å; F392-F396 HydrophobicContact CZ-CB 4.33Å; F392-F396 AromaticContact CZ-CD2 3.99Å; F392-F396 HydrophobicContact CZ-CD2 3.99Å; F392-F396 HydrophobicContact CZ-CG 4.3Å; F392-F396 WeakPolarHBondContact O-CB 3.3Å; F392-F396 PolarHBondContact O-N 3.12Å
393	L	94.5	Very high	90.8	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.6	-39.6	-177.3	-69.3	170.3	0	0	0	112.3	A203 L206 L389 N390 F396 Q397 I451 M454 I455 V458	A203-L393 HydrophobicContact CB-CD1 4.18Å; A203-L393 HydrophobicContact CB-CD2 4.44Å; L206-L393 HydrophobicContact CD2-CD2 4.13Å; L389-L393 HydrophobicContact CD1-CD1 4.36Å; L389-L393 HydrophobicContact CD1-CG 4.31Å; L389-L393 HydrophobicContact CG-CD1 4.13Å; L389-L393 VanDerWaalsContact O-CG 3.27Å; L389-L393 WeakPolarHBondContact O-CG 3.43Å; L389-L393 PolarHBondContact O-N 3.09Å; N390-L393 PolarHBondContact O-N 2.96Å; L393-F396 PolarHBondContact O-N 3.27Å; L393-Q397 WeakPolarHBondContact O-CB 3.47Å; L393-Q397 PolarHBondContact O-N 3.36Å; L393-I451 HydrophobicContact CB-CG2 4.44Å; L393-I451 HydrophobicContact CD2-CG2 4.45Å; L393-I451 WeakPolarHBondContact O-CG2 3.37Å; L393-M454 HydrophobicContact CD1-CB 3.86Å; L393-M454 HydrophobicContact CD2-CB 4.21Å; L393-M454 HydrophobicContact CD2-SD 4.12Å; L393-I455 HydrophobicContact CB-CD1 4.16Å; L393-I455 HydrophobicContact CB-CG1 3.52Å; L393-I455 HydrophobicContact CD1-CG1 4.25Å; L393-V458 HydrophobicContact CD1-CG2 3.86Å
394	Q	94.3	Very high	89.5	Confident	74 Å²	74	46.5 Å²	46.5	35%	0.346	23%	0.228	S	C	.	.	H	α-helix	trans	-61.7	-46	175.4	-74.4	174.9	8	0	0	111.1	N390 F392 F396 Q397 E398 I455	N390-Q394 PolarHBondContact ND2-NE2 2.96Å; N390-Q394 WeakPolarHBondContact O-CB 3.35Å; N390-Q394 VanDerWaalsContact O-CG 3.3Å; N390-Q394 WeakPolarHBondContact O-CG 3.47Å; N390-Q394 PolarHBondContact O-N 2.91Å; N390-Q394 PolarHBondContact OD1-NE2 3.29Å; N390-Q394 VanDerWaalsContact OD1-NE2 3.11Å; F392-Q394 VanDerWaalsContact C-N 3.35Å; F392-Q394 PolarHBondContact O-N 3.34Å; Q394-F396 VanDerWaalsContact C-N 3.34Å; Q394-F396 PolarHBondContact O-N 2.75Å; Q394-Q397 WeakPolarHBondContact O-CB 3.45Å; Q394-Q397 PolarHBondContact O-N 2.89Å; Q394-E398 WeakPolarHBondContact O-CG 3.33Å; Q394-E398 PolarHBondContact O-N 2.92Å; Q394-I455 HydrophobicContact CG-CD1 4.06Å
395	R	90.4	Very high	88	Confident	102 Å²	102	47.4 Å²	47.4	39%	0.385	23%	0.233	S	C	.	.	H	α-helix	trans	-63.8	-41.8	177.1	-170.3	60.1	175.5	144.2	12.3	111.9	A391 F392 Q397 E398 D399	A391-R395 WeakPolarHBondContact O-CB 3.16Å; A391-R395 PolarHBondContact O-N 3.37Å; F392-R395 PolarHBondContact O-N 2.98Å; R395-Q397 VanDerWaalsContact C-N 3.29Å; R395-Q397 PolarHBondContact O-N 2.88Å; R395-E398 WeakPolarHBondContact CD-OE2 3.36Å; R395-E398 IonicContact CZ-OE2 2.64Å; R395-E398 IonicContact NH1-OE2 3.23Å; R395-E398 PolarHBondContact NH1-OE2 3.29Å; R395-E398 PolarHBondContact O-N 3.45Å; R395-D399 IonicContact CZ-OD1 3.88Å; R395-D399 IonicContact NH2-OD1 2.72Å; R395-D399 VanDerWaalsContact O-CG 3.32Å; R395-D399 PolarHBondContact O-N 3.12Å
396	F	89.7	Confident	86.2	Confident	7 Å²	7	48.8 Å²	48.8	3%	0.031	24%	0.24	C	C	.	.	H	α-helix	trans	-63.1	-36.6	175.6	-166.2	-92.9	0	0	0	111.7	L206 F210 F392 L393 Q394 D399 L400 I451	L206-F396 HydrophobicContact CD1-CE1 4.5Å; L206-F396 HydrophobicContact CD1-CZ 4.17Å; L206-F396 HydrophobicContact CD2-CD1 4.4Å; L206-F396 HydrophobicContact CD2-CE1 4.29Å; F210-F396 HydrophobicContact CD2-CD2 4.14Å; F210-F396 AromaticContact CD2-CE2 3.76Å; F210-F396 HydrophobicContact CD2-CE2 3.76Å; F210-F396 HydrophobicContact CE2-CD2 4.19Å; F210-F396 AromaticContact CE2-CE2 3.97Å; F210-F396 HydrophobicContact CE2-CE2 3.97Å; F392-F396 HydrophobicContact CE2-CB 4.39Å; F392-F396 HydrophobicContact CE2-CD2 4.16Å; F392-F396 HydrophobicContact CZ-CB 4.33Å; F392-F396 AromaticContact CZ-CD2 3.99Å; F392-F396 HydrophobicContact CZ-CD2 3.99Å; F392-F396 HydrophobicContact CZ-CG 4.3Å; F392-F396 WeakPolarHBondContact O-CB 3.3Å; F392-F396 PolarHBondContact O-N 3.12Å; L393-F396 PolarHBondContact O-N 3.27Å; Q394-F396 VanDerWaalsContact C-N 3.34Å; Q394-F396 PolarHBondContact O-N 2.75Å; F396-D399 PolarHBondContact O-N 3.05Å; F396-L400 HydrophobicContact CD1-CD1 4.07Å; F396-L400 HydrophobicContact CD1-CG 4.3Å; F396-L400 HydrophobicContact CE1-CD1 3.9Å; F396-L400 HydrophobicContact CE1-CD2 4.42Å; F396-L400 HydrophobicContact CE1-CG 4.16Å; F396-L400 WeakPolarHBondContact O-CG 3.26Å; F396-L400 PolarHBondContact O-N 3.38Å; F396-L400 VanDerWaalsContact O-N 3.09Å; F396-I451 HydrophobicContact CD1-CD1 3.69Å; F396-I451 HydrophobicContact CD1-CG1 3.87Å; F396-I451 HydrophobicContact CD1-CG2 4.47Å; F396-I451 HydrophobicContact CE1-CD1 3.79Å; F396-I451 HydrophobicContact CE1-CG1 4.1Å
397	Q	89.2	Confident	84.5	Confident	34 Å²	34	54.3 Å²	54.3	16%	0.159	27%	0.266	C	S	.	.	H	α-helix	trans	-66.1	-44.2	175.6	-163.7	-173	18.5	0	0	112.2	L393 Q394 R395 L400 F401 I451 I455	L393-Q397 WeakPolarHBondContact O-CB 3.47Å; L393-Q397 PolarHBondContact O-N 3.36Å; Q394-Q397 WeakPolarHBondContact O-CB 3.45Å; Q394-Q397 PolarHBondContact O-N 2.89Å; R395-Q397 VanDerWaalsContact C-N 3.29Å; R395-Q397 PolarHBondContact O-N 2.88Å; Q397-L400 WeakPolarHBondContact O-CB 3.41Å; Q397-L400 PolarHBondContact O-N 3.09Å; Q397-F401 HydrophobicContact CG-CD2 4.06Å; Q397-F401 HydrophobicContact CG-CE2 3.64Å; Q397-F401 WeakPolarHBondContact O-CD2 3.43Å; Q397-F401 PolarHBondContact O-N 3.28Å; Q397-F401 VanDerWaalsContact O-N 3.07Å; Q397-I451 HydrophobicContact CB-CG2 3.8Å; Q397-I451 HydrophobicContact CG-CG2 4.21Å; Q397-I455 HydrophobicContact CB-CD1 4.13Å; Q397-I455 VanDerWaalsContact OE1-CD1 3.24Å
398	E	87	Confident	82.6	Confident	95 Å²	95	52.7 Å²	52.7	44%	0.444	26%	0.261	S	S	.	.	H	α-helix	trans	-58.4	-47.6	174.5	-71.1	171.9	179.7	0	0	111.1	Q394 R395 L400 F401 E402	Q394-E398 WeakPolarHBondContact O-CG 3.33Å; Q394-E398 PolarHBondContact O-N 2.92Å; R395-E398 WeakPolarHBondContact CD-OE2 3.36Å; R395-E398 IonicContact CZ-OE2 2.64Å; R395-E398 IonicContact NH1-OE2 3.23Å; R395-E398 PolarHBondContact NH1-OE2 3.29Å; R395-E398 PolarHBondContact O-N 3.45Å; E398-L400 PolarHBondContact O-N 2.95Å; E398-F401 PolarHBondContact O-N 3.38Å; E398-E402 PolarHBondContact O-N 2.99Å
399	D	83.5	Confident	80.6	Confident	3 Å²	3	53.7 Å²	53.7	2%	0.016	27%	0.266	C	S	.	.	H	α-helix	trans	-59.4	-36.4	177.9	-70	-10.1	0	0	0	111.3	R395 F396 R403 Q432 I436	R395-D399 IonicContact CZ-OD1 3.88Å; R395-D399 IonicContact NH2-OD1 2.72Å; R395-D399 VanDerWaalsContact O-CG 3.32Å; R395-D399 PolarHBondContact O-N 3.12Å; F396-D399 PolarHBondContact O-N 3.05Å; D399-R403 VanDerWaalsContact O-CD 3.3Å; D399-R403 WeakPolarHBondContact O-CD 3.43Å; D399-R403 VanDerWaalsContact O-CG 3.22Å; D399-R403 WeakPolarHBondContact O-CG 3.45Å; D399-R403 PolarHBondContact O-N 3.25Å; D399-Q432 WeakPolarHBondContact OD2-CG 3.38Å; D399-Q432 PolarHBondContact OD2-NE2 2.93Å; D399-I436 HydrophobicContact CB-CD1 4.06Å
400	L	82.4	Confident	78.5	Confident	27 Å²	27	58.8 Å²	58.8	14%	0.141	29%	0.294	C	S	.	.	H	α-helix	trans	-67.5	-37.2	173.5	-71.1	179.7	0	0	0	113	F396 Q397 E398 L404 I451	F396-L400 HydrophobicContact CD1-CD1 4.07Å; F396-L400 HydrophobicContact CD1-CG 4.3Å; F396-L400 HydrophobicContact CE1-CD1 3.9Å; F396-L400 HydrophobicContact CE1-CD2 4.42Å; F396-L400 HydrophobicContact CE1-CG 4.16Å; F396-L400 WeakPolarHBondContact O-CG 3.26Å; F396-L400 PolarHBondContact O-N 3.38Å; F396-L400 VanDerWaalsContact O-N 3.09Å; Q397-L400 WeakPolarHBondContact O-CB 3.41Å; Q397-L400 PolarHBondContact O-N 3.09Å; E398-L400 PolarHBondContact O-N 2.95Å; L400-L404 WeakPolarHBondContact O-CG 3.45Å; L400-L404 PolarHBondContact O-N 3.03Å; L400-I451 HydrophobicContact CD1-CG1 3.76Å
401	F	81	Confident	76.1	Confident	98 Å²	98	64 Å²	64	43%	0.43	32%	0.317	S	S	.	.	H	α-helix	trans	-70.1	-44.3	176.7	-77.2	-62	0	0	0	112.1	Q397 E398 R403 L404 D405 S448	Q397-F401 HydrophobicContact CG-CD2 4.06Å; Q397-F401 HydrophobicContact CG-CE2 3.64Å; Q397-F401 WeakPolarHBondContact O-CD2 3.43Å; Q397-F401 PolarHBondContact O-N 3.28Å; Q397-F401 VanDerWaalsContact O-N 3.07Å; E398-F401 PolarHBondContact O-N 3.38Å; F401-R403 PolarHBondContact O-N 3.41Å; F401-L404 PolarHBondContact O-N 3.02Å; F401-L404 VanDerWaalsContact O-N 3.11Å; F401-D405 PolarHBondContact O-N 3.21Å; F401-S448 WeakPolarHBondContact CZ-OG 3.42Å
402	E	77.6	Confident	73.6	Confident	55 Å²	55	66.9 Å²	66.9	26%	0.257	32%	0.324	S	S	.	.	H	α-helix	trans	-57.1	-37	176.1	-72.5	-179.1	-175.1	0	0	111.5	E398 N406	E398-E402 PolarHBondContact O-N 2.99Å; E402-N406 VanDerWaalsContact O-CB 3.25Å; E402-N406 WeakPolarHBondContact O-CB 3.43Å; E402-N406 PolarHBondContact O-N 3.03Å; E402-N406 PolarHBondContact O-ND2 3.46Å
403	R	70.9	Confident	71.2	Confident	44 Å²	44	69.9 Å²	69.9	17%	0.166	35%	0.348	C	S	.	.	H	α-helix	trans	-63.8	-46.9	174.2	-73.1	164	172.8	-128.1	-22.7	113.3	D399 F401 N406 E407 N433 I436 Q437	D399-R403 VanDerWaalsContact O-CD 3.3Å; D399-R403 WeakPolarHBondContact O-CD 3.43Å; D399-R403 VanDerWaalsContact O-CG 3.22Å; D399-R403 WeakPolarHBondContact O-CG 3.45Å; D399-R403 PolarHBondContact O-N 3.25Å; F401-R403 PolarHBondContact O-N 3.41Å; R403-N406 PolarHBondContact O-N 3.31Å; R403-E407 WeakPolarHBondContact O-CG 3.44Å; R403-E407 PolarHBondContact O-N 2.84Å; R403-N433 PolarHBondContact NH2-O 3.44Å; R403-I436 VanDerWaalsContact NH1-CG2 3.3Å; R403-I436 PolarHBondContact NH1-O 3.27Å; R403-I436 PolarHBondContact NH2-O 3.45Å; R403-I436 VanDerWaalsContact NH2-O 3.11Å; R403-Q437 VanDerWaalsContact NH2-N 3.17Å
404	L	68.9	Low	68.8	Low	93 Å²	93	80.6 Å²	80.6	49%	0.487	39%	0.389	S	S	.	.	H	α-helix	trans	-64.6	-41.3	179.6	-70.1	169.7	0	0	0	111.5	L400 F401 E407 S408	L400-L404 WeakPolarHBondContact O-CG 3.45Å; L400-L404 PolarHBondContact O-N 3.03Å; F401-L404 PolarHBondContact O-N 3.02Å; F401-L404 VanDerWaalsContact O-N 3.11Å; L404-E407 PolarHBondContact O-N 3.32Å; L404-S408 PolarHBondContact O-N 2.85Å
405	D	64.8	Low	66.4	Low	98 Å²	98	82 Å²	82	52%	0.524	40%	0.402	S	S	.	.	H	α-helix	trans	-64.1	-44.5	175.6	-77.3	-11.7	0	0	0	110.7	F401 E407 S408 E409	F401-D405 PolarHBondContact O-N 3.21Å; D405-E407 PolarHBondContact O-N 3.5Å; D405-S408 PolarHBondContact O-N 3.24Å; D405-S408 VanDerWaalsContact O-N 3.16Å; D405-S408 PolarHBondContact O-OG 3.03Å; D405-E409 PolarHBondContact O-N 2.86Å
406	N	61.3	Low	64.1	Low	39 Å²	39	80.3 Å²	80.3	21%	0.209	42%	0.417	C	S	.	.	H	α-helix	trans	-64.1	-36.4	176	-74.3	-32.7	0	0	0	112.8	E402 R403 N410	E402-N406 VanDerWaalsContact O-CB 3.25Å; E402-N406 WeakPolarHBondContact O-CB 3.43Å; E402-N406 PolarHBondContact O-N 3.03Å; E402-N406 PolarHBondContact O-ND2 3.46Å; R403-N406 PolarHBondContact O-N 3.31Å; N406-N410 WeakPolarHBondContact O-CB 3.5Å; N406-N410 PolarHBondContact O-N 3.37Å; N406-N410 PolarHBondContact O-ND2 2.95Å
407	E	61.1	Low	61.3	Low	117 Å²	117	90.5 Å²	90.5	55%	0.547	46%	0.455	S	S	.	.	H	α-helix	trans	-65.6	-39.9	172.3	-75.9	-171.6	172.8	0	0	111.7	R403 L404 D405 Q411	R403-E407 WeakPolarHBondContact O-CG 3.44Å; R403-E407 PolarHBondContact O-N 2.84Å; L404-E407 PolarHBondContact O-N 3.32Å; D405-E407 PolarHBondContact O-N 3.5Å; E407-Q411 WeakPolarHBondContact O-CB 3.45Å; E407-Q411 WeakPolarHBondContact O-CG 3.36Å; E407-Q411 PolarHBondContact O-N 2.98Å
408	S	57.8	Low	58.6	Low	51 Å²	51	96.1 Å²	96.1	36%	0.357	49%	0.486	S	S	.	.	H	α-helix	trans	-69.5	-41.5	177.6	79.2	0	0	0	0	112.6	L404 D405 Q411 L412	L404-S408 PolarHBondContact O-N 2.85Å; D405-S408 PolarHBondContact O-N 3.24Å; D405-S408 VanDerWaalsContact O-N 3.16Å; D405-S408 PolarHBondContact O-OG 3.03Å; S408-Q411 PolarHBondContact O-N 3.31Å; S408-L412 WeakPolarHBondContact O-CB 3.35Å; S408-L412 WeakPolarHBondContact O-CG 3.36Å; S408-L412 PolarHBondContact O-N 3.11Å
409	E	54.6	Low	56.2	Low	94 Å²	94	97 Å²	97	44%	0.439	50%	0.498	S	S	.	.	H	α-helix	trans	-67.9	-38.8	174	-77.6	-168.4	171.5	0	0	111.3	D405 Q411 L412 S413 R427	D405-E409 PolarHBondContact O-N 2.86Å; E409-Q411 VanDerWaalsContact C-N 3.31Å; E409-Q411 PolarHBondContact O-N 2.96Å; E409-L412 PolarHBondContact O-N 3.1Å; E409-S413 WeakPolarHBondContact O-CB 3.46Å; E409-S413 PolarHBondContact O-N 3.29Å; E409-S413 PolarHBondContact O-OG 3.41Å; E409-R427 IonicContact OE2-NH1 2.91Å
410	N	52.1	Low	53.7	Low	107 Å²	107	105.6 Å²	105.6	57%	0.572	54%	0.535	S	S	*	.	H	α-helix	trans	-66	-34.1	173.4	-79.5	-37.7	0	0	0	111.7	N406 R414	N406-N410 WeakPolarHBondContact O-CB 3.5Å; N406-N410 PolarHBondContact O-N 3.37Å; N406-N410 PolarHBondContact O-ND2 2.95Å; N410-R414 VanDerWaalsContact O-CG 3.28Å; N410-R414 WeakPolarHBondContact O-CG 3.34Å; N410-R414 PolarHBondContact O-N 3.1Å
411	Q	47	Very low	51.3	Low	127 Å²	127	113.7 Å²	113.7	59%	0.593	57%	0.569	S	S	*	*	H	α-helix	trans	-71.4	-41.2	173	-73.5	178	41	0	0	112.4	E407 S408 E409 R414 T415	E407-Q411 WeakPolarHBondContact O-CB 3.45Å; E407-Q411 WeakPolarHBondContact O-CG 3.36Å; E407-Q411 PolarHBondContact O-N 2.98Å; S408-Q411 PolarHBondContact O-N 3.31Å; E409-Q411 VanDerWaalsContact C-N 3.31Å; E409-Q411 PolarHBondContact O-N 2.96Å; Q411-R414 WeakPolarHBondContact O-CB 3.27Å; Q411-R414 PolarHBondContact O-N 3.29Å; Q411-R414 VanDerWaalsContact O-N 3.17Å; Q411-T415 PolarHBondContact O-N 2.7Å
412	L	42	Very low	49.1	Very low	116 Å²	116	113.9 Å²	113.9	61%	0.607	58%	0.583	S	S	*	*	H	α-helix	trans	-66.5	-36.5	174.8	-79.1	158.4	0	0	0	112.3	S408 E409 R414 T415	S408-L412 WeakPolarHBondContact O-CB 3.35Å; S408-L412 WeakPolarHBondContact O-CG 3.36Å; S408-L412 PolarHBondContact O-N 3.11Å; E409-L412 PolarHBondContact O-N 3.1Å; L412-R414 VanDerWaalsContact C-N 3.31Å; L412-T415 WeakPolarHBondContact CA-OG1 3.14Å; L412-T415 CarbonylContact O-C 3.58Å; L412-T415 VanDerWaalsContact O-C 3.24Å; L412-T415 WeakPolarHBondContact O-CA 3.14Å; L412-T415 PolarHBondContact O-N 3.44Å; L412-T415 VanDerWaalsContact O-N 3.11Å; L412-T415 PolarHBondContact O-OG1 3.01Å; L412-T415 VanDerWaalsContact O-OG1 3.06Å
413	S	45.8	Very low	47	Very low	87 Å²	87	117.4 Å²	117.4	61%	0.608	61%	0.614	S	S	*	*	H	α-helix	trans	-66.5	-33.5	172.1	-59.4	0	0	0	0	111.4	E409 T415 G416	E409-S413 WeakPolarHBondContact O-CB 3.46Å; E409-S413 PolarHBondContact O-N 3.29Å; E409-S413 PolarHBondContact O-OG 3.41Å; S413-T415 VanDerWaalsContact C-N 3.31Å; S413-G416 PolarHBondContact O-N 2.87Å
414	R	42.7	Very low	45.1	Very low	224 Å²	224	118.9 Å²	118.9	85%	0.845	64%	0.643	S	S	*	*	H	α-helix	trans	-70.1	-26.9	170.5	-75.8	177.9	97.4	-170	7.5	112.5	N410 Q411 L412 G416	N410-R414 VanDerWaalsContact O-CG 3.28Å; N410-R414 WeakPolarHBondContact O-CG 3.34Å; N410-R414 PolarHBondContact O-N 3.1Å; Q411-R414 WeakPolarHBondContact O-CB 3.27Å; Q411-R414 PolarHBondContact O-N 3.29Å; Q411-R414 VanDerWaalsContact O-N 3.17Å; L412-R414 VanDerWaalsContact C-N 3.31Å; R414-G416 VanDerWaalsContact C-N 3.28Å; R414-G416 PolarHBondContact O-N 3.05Å
415	T	43.8	Very low	43.4	Very low	103 Å²	103	117.4 Å²	117.4	63%	0.632	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	46	169	61.4	0	0	0	0	112.9	Q411 L412 S413 R417	Q411-T415 PolarHBondContact O-N 2.7Å; L412-T415 WeakPolarHBondContact CA-OG1 3.14Å; L412-T415 CarbonylContact O-C 3.58Å; L412-T415 VanDerWaalsContact O-C 3.24Å; L412-T415 WeakPolarHBondContact O-CA 3.14Å; L412-T415 PolarHBondContact O-N 3.44Å; L412-T415 VanDerWaalsContact O-N 3.11Å; L412-T415 PolarHBondContact O-OG1 3.01Å; L412-T415 VanDerWaalsContact O-OG1 3.06Å; S413-T415 VanDerWaalsContact C-N 3.31Å; T415-R417 PolarHBondContact O-N 3.33Å; T415-R417 VanDerWaalsContact O-N 3.1Å
416	G	43.1	Very low	42.2	Very low	67 Å²	67	119.8 Å²	119.8	69%	0.691	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	59.9	36.4	136.3	0	0	0	0	0	119.1	S413 R414	S413-G416 PolarHBondContact O-N 2.87Å; R414-G416 VanDerWaalsContact C-N 3.28Å; R414-G416 PolarHBondContact O-N 3.05Å
417	R	30.6	Very low	41.3	Very low	222 Å²	222	125.1 Å²	125.1	84%	0.838	69%	0.685	S	S	*	*			trans	-136.1	88.1	164.7	-134.2	174.7	-173.9	156	1.1	112.1	T415 V419	T415-R417 PolarHBondContact O-N 3.33Å; T415-R417 VanDerWaalsContact O-N 3.1Å; R417-V419 VanDerWaalsContact C-N 3.34Å; R417-V419 PolarHBondContact O-N 3.31Å
418	N	33.8	Very low	40.5	Very low	152 Å²	152	124.9 Å²	124.9	81%	0.813	70%	0.695	S	S	*	*			trans	-55.3	92.4	165.2	-70.2	-20.3	0	0	0	110.1
419	V	34.6	Very low	40.1	Very low	113 Å²	113	123.9 Å²	123.9	69%	0.685	69%	0.685	S	S	*	*			trans	-101.1	101.9	157.4	-179.8	0	0	0	0	106.2	R417 K421	R417-V419 VanDerWaalsContact C-N 3.34Å; R417-V419 PolarHBondContact O-N 3.31Å; V419-K421 PolarHBondContact O-N 3.46Å
420	F	32.2	Very low	40.1	Very low	183 Å²	183	124.8 Å²	124.8	80%	0.803	70%	0.698	S	S	*	*			trans	-46.7	102.2	162.6	-85.9	-100.1	0	0	0	109.8
421	K	32.3	Very low	40.3	Very low	197 Å²	197	125.8 Å²	125.8	86%	0.857	70%	0.702	S	S	*	*			trans	-109.7	94.5	150.2	-85.3	-173	176.5	-179.8	0	107.2	V419	V419-K421 PolarHBondContact O-N 3.46Å
422	S	33.6	Very low	40.7	Very low	102 Å²	102	122.7 Å²	122.7	71%	0.713	69%	0.687	S	S	*	*			trans	-66.5	153	166.2	-61.3	0	0	0	0	110.7
423	S	34	Very low	41.6	Very low	130 Å²	130	117.8 Å²	117.8	91%	0.909	66%	0.662	S	S	*	*			trans	84.4	113.3	174.9	-138	0	0	0	0	112.9
424	G	31.2	Very low	42.2	Very low	75 Å²	75	119.7 Å²	119.7	77%	0.773	66%	0.663	S	S	*	*			cis	140.9	37.7	28.3	0	0	0	0	0	109.3
425	G	33.9	Very low	43.3	Very low	62 Å²	62	111.1 Å²	111.1	64%	0.639	63%	0.633	S	S	*	*			trans	-98.9	110.7	169	0	0	0	0	0	107.2	R427	G425-R427 PolarHBondContact O-N 2.97Å
426	V	39.8	Very low	44.3	Very low	148 Å²	148	106.4 Å²	106.4	90%	0.897	60%	0.604	S	S	*	*			trans	-61.7	82.4	161.7	177.5	0	0	0	0	105.7	C428	V426-C428 PolarHBondContact O-N 3.37Å
427	R	42.1	Very low	45.4	Very low	151 Å²	151	110 Å²	110	57%	0.57	60%	0.602	S	S	*	*			trans	-68.1	128.3	172.4	-63.3	-168.2	173.6	154.3	-3.5	106.1	E409 G425 D429	E409-R427 IonicContact OE2-NH1 2.91Å; G425-R427 PolarHBondContact O-N 2.97Å; R427-D429 HydrophobicContact CB-CB 4.29Å; R427-D429 VanDerWaalsContact CB-OD1 3.28Å; R427-D429 WeakPolarHBondContact CB-OD1 3.43Å; R427-D429 WeakPolarHBondContact CB-OD2 3.35Å; R427-D429 WeakPolarHBondContact CD-OD2 3.43Å; R427-D429 PolarHBondContact O-N 3.38Å
428	C	44.7	Very low	47.2	Very low	111 Å²	111	105.1 Å²	105.1	75%	0.75	59%	0.593	S	S	*	*			trans	-73.8	32.1	-173.5	-152.5	0	0	0	0	111.7	V426 T430	V426-C428 PolarHBondContact O-N 3.37Å; C428-T430 PolarHBondContact O-N 2.88Å
429	D	47.8	Very low	48.9	Very low	30 Å²	30	98.3 Å²	98.3	16%	0.16	56%	0.558	C	S	.	*	T	Hydrogen-bonded Turn	trans	-90.1	6.6	-155	-64.4	5	0	0	0	113.6	R427 N433	R427-D429 HydrophobicContact CB-CB 4.29Å; R427-D429 VanDerWaalsContact CB-OD1 3.28Å; R427-D429 WeakPolarHBondContact CB-OD1 3.43Å; R427-D429 WeakPolarHBondContact CB-OD2 3.35Å; R427-D429 WeakPolarHBondContact CD-OD2 3.43Å; R427-D429 PolarHBondContact O-N 3.38Å; D429-N433 VanDerWaalsContact O-CB 3.28Å; D429-N433 WeakPolarHBondContact O-CB 3.5Å; D429-N433 PolarHBondContact O-ND2 3.35Å
430	T	54.6	Low	50.6	Low	114 Å²	114	95.8 Å²	95.8	70%	0.699	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	-47.3	-169.2	32.6	0	0	0	0	114.5	C428 M434	C428-T430 PolarHBondContact O-N 2.88Å; T430-M434 WeakPolarHBondContact O-CB 3.33Å; T430-M434 PolarHBondContact O-N 2.9Å
431	I	56	Low	52.3	Low	127 Å²	127	93.5 Å²	93.5	65%	0.651	54%	0.54	S	S	*	.	H	α-helix	trans	-76.4	-48	-175.1	-58.9	177.1	0	0	0	111.1	N433 M434 I435	I431-N433 PolarHBondContact O-N 3.31Å; I431-M434 PolarHBondContact O-N 2.83Å; I431-I435 HydrophobicContact CG2-CD1 3.83Å; I431-I435 HydrophobicContact CG2-CG1 4.42Å; I431-I435 WeakPolarHBondContact O-CG1 3.31Å; I431-I435 PolarHBondContact O-N 3.46Å
432	Q	56.5	Low	54.1	Low	63 Å²	63	89.7 Å²	89.7	29%	0.294	53%	0.529	S	S	.	.	H	α-helix	trans	-60.8	-48	-179.1	-166.6	89.9	-10.5	0	0	111.3	D399 M434 I435 I436	D399-Q432 WeakPolarHBondContact OD2-CG 3.38Å; D399-Q432 PolarHBondContact OD2-NE2 2.93Å; Q432-M434 VanDerWaalsContact C-N 3.32Å; Q432-M434 PolarHBondContact O-N 3.17Å; Q432-I435 PolarHBondContact O-N 2.91Å; Q432-I436 HydrophobicContact CG-CD1 4.23Å; Q432-I436 WeakPolarHBondContact O-CD1 3.22Å; Q432-I436 VanDerWaalsContact O-CG1 3.29Å; Q432-I436 WeakPolarHBondContact O-CG1 3.46Å; Q432-I436 PolarHBondContact O-N 3.33Å
433	N	59.7	Low	56	Low	13 Å²	13	85 Å²	85	7%	0.07	50%	0.496	C	S	.	.	H	α-helix	trans	-62.8	-37.9	177.9	-76.9	-38.7	0	0	0	112.5	R403 D429 I431 Q437	R403-N433 PolarHBondContact NH2-O 3.44Å; D429-N433 VanDerWaalsContact O-CB 3.28Å; D429-N433 WeakPolarHBondContact O-CB 3.5Å; D429-N433 PolarHBondContact O-ND2 3.35Å; I431-N433 PolarHBondContact O-N 3.31Å; N433-Q437 WeakPolarHBondContact O-CB 3.44Å; N433-Q437 VanDerWaalsContact O-CG 3.29Å; N433-Q437 WeakPolarHBondContact O-CG 3.44Å; N433-Q437 PolarHBondContact O-N 2.91Å
434	M	59.1	Low	57.9	Low	127 Å²	127	82.5 Å²	82.5	63%	0.626	47%	0.472	S	S	*	.	H	α-helix	trans	-66.8	-40.3	176.3	-169.1	176.3	-173.1	0	0	112	T430 I431 Q432 Q437	T430-M434 WeakPolarHBondContact O-CB 3.33Å; T430-M434 PolarHBondContact O-N 2.9Å; I431-M434 PolarHBondContact O-N 2.83Å; Q432-M434 VanDerWaalsContact C-N 3.32Å; Q432-M434 PolarHBondContact O-N 3.17Å; M434-Q437 PolarHBondContact O-N 2.99Å
435	I	65.4	Low	60.2	Low	44 Å²	44	82.8 Å²	82.8	23%	0.226	46%	0.462	C	S	.	.	H	α-helix	trans	-60.3	-54.7	175.1	-71.2	167.9	0	0	0	109.7	F213 V214 I431 Q432 Q437 N438	F213-I435 HydrophobicContact CD1-CG2 4.44Å; F213-I435 HydrophobicContact CE1-CG2 3.63Å; F213-I435 VanDerWaalsContact CE1-O 3.28Å; F213-I435 WeakPolarHBondContact CE1-O 3.27Å; F213-I435 HydrophobicContact CZ-CG2 4.3Å; F213-I435 WeakPolarHBondContact CZ-O 3.42Å; V214-I435 HydrophobicContact CG2-CG2 4.13Å; I431-I435 HydrophobicContact CG2-CD1 3.83Å; I431-I435 HydrophobicContact CG2-CG1 4.42Å; I431-I435 WeakPolarHBondContact O-CG1 3.31Å; I431-I435 PolarHBondContact O-N 3.46Å; Q432-I435 PolarHBondContact O-N 2.91Å; I435-Q437 VanDerWaalsContact C-N 3.25Å; I435-Q437 PolarHBondContact O-N 2.83Å; I435-N438 PolarHBondContact O-N 3.38Å; I435-N438 VanDerWaalsContact O-N 3.08Å
436	I	65.7	Low	62.6	Low	3 Å²	3	82.2 Å²	82.2	2%	0.015	44%	0.441	C	S	.	.	H	α-helix	trans	-77.1	-6.3	-176.6	18.2	96.2	0	0	0	113.7	F210 D399 R403 Q432 N438 A439 L444	F210-I436 HydrophobicContact CE2-CB 4.32Å; F210-I436 HydrophobicContact CE2-CG1 4.08Å; F210-I436 HydrophobicContact CZ-CG1 4.45Å; D399-I436 HydrophobicContact CB-CD1 4.06Å; R403-I436 VanDerWaalsContact NH1-CG2 3.3Å; R403-I436 PolarHBondContact NH1-O 3.27Å; R403-I436 PolarHBondContact NH2-O 3.45Å; R403-I436 VanDerWaalsContact NH2-O 3.11Å; Q432-I436 HydrophobicContact CG-CD1 4.23Å; Q432-I436 WeakPolarHBondContact O-CD1 3.22Å; Q432-I436 VanDerWaalsContact O-CG1 3.29Å; Q432-I436 WeakPolarHBondContact O-CG1 3.46Å; Q432-I436 PolarHBondContact O-N 3.33Å; I436-N438 VanDerWaalsContact C-N 3.32Å; I436-A439 HydrophobicContact CB-CB 4.27Å; I436-A439 HydrophobicContact CG2-CB 4.06Å; I436-A439 WeakPolarHBondContact O-CB 3.42Å; I436-L444 HydrophobicContact CG2-CD2 4.45Å; I436-L444 WeakPolarHBondContact O-CD2 3.47Å
437	Q	65.4	Low	64.8	Low	142 Å²	142	78.6 Å²	78.6	66%	0.664	42%	0.42	S	S	*	.	H	α-helix	trans	-71.8	-29.1	165.8	-85.2	177.7	12.1	0	0	111.9	R403 N433 M434 I435 A439	R403-Q437 VanDerWaalsContact NH2-N 3.17Å; N433-Q437 WeakPolarHBondContact O-CB 3.44Å; N433-Q437 VanDerWaalsContact O-CG 3.29Å; N433-Q437 WeakPolarHBondContact O-CG 3.44Å; N433-Q437 PolarHBondContact O-N 2.91Å; M434-Q437 PolarHBondContact O-N 2.99Å; I435-Q437 VanDerWaalsContact C-N 3.25Å; I435-Q437 PolarHBondContact O-N 2.83Å; Q437-A439 VanDerWaalsContact C-N 3.29Å
438	N	68.6	Low	66.9	Low	121 Å²	121	72.7 Å²	72.7	65%	0.647	40%	0.401	S	S	*	.	S	Bend	trans	-89.3	5.5	175	-68.9	-25.6	0	0	0	112.8	F213 I435 I436	F213-N438 WeakPolarHBondContact CE2-O 3.37Å; F213-N438 VanDerWaalsContact CZ-C 3.43Å; F213-N438 HydrophobicContact CZ-CB 4.14Å; F213-N438 WeakPolarHBondContact CZ-O 3.43Å; I435-N438 PolarHBondContact O-N 3.38Å; I435-N438 VanDerWaalsContact O-N 3.08Å; I436-N438 VanDerWaalsContact C-N 3.32Å
439	A	69.6	Low	69	Low	8 Å²	8	71.7 Å²	71.7	7%	0.066	39%	0.388	C	S	.	.	S	Bend	trans	-65.8	145.3	-179.5	0	0	0	0	0	111.6	F213 I436 Q437 L443 L444	F213-A439 HydrophobicContact CD1-CB 4.27Å; F213-A439 HydrophobicContact CE1-CB 3.87Å; F213-A439 VanDerWaalsContact CZ-CA 3.44Å; F213-A439 HydrophobicContact CZ-CB 4.09Å; I436-A439 HydrophobicContact CB-CB 4.27Å; I436-A439 HydrophobicContact CG2-CB 4.06Å; I436-A439 WeakPolarHBondContact O-CB 3.42Å; Q437-A439 VanDerWaalsContact C-N 3.29Å; A439-L443 HydrophobicContact CB-CB 4.09Å; A439-L443 HydrophobicContact CB-CD1 4.08Å; A439-L444 HydrophobicContact CB-CD2 4.46Å; A439-L444 HydrophobicContact CB-CG 4.36Å
440	P	71.2	Confident	71.1	Confident	61 Å²	61	72.8 Å²	72.8	40%	0.396	39%	0.394	S	S	.	.			trans	-49	146.7	168.3	-27	31.2	0	0	0	112.5	F213 D442 L443 L444	F213-P440 VanDerWaalsContact CD2-CD 3.46Å; F213-P440 HydrophobicContact CD2-CG 4.3Å; P440-D442 PolarHBondContact O-N 3.05Å; P440-L443 PolarHBondContact O-N 2.91Å; P440-L444 PolarHBondContact O-N 3.28Å
441	N	67.7	Low	72.9	Confident	135 Å²	135	67.3 Å²	67.3	72%	0.722	36%	0.361	S	S	*	.	H	α-helix	trans	-54	-29.5	178.2	-71.2	-28.3	0	0	0	112.8	L443 L444 S445	N441-L443 VanDerWaalsContact C-N 3.34Å; N441-L443 PolarHBondContact O-N 3.12Å; N441-L444 PolarHBondContact O-N 3.5Å; N441-S445 PolarHBondContact O-N 2.92Å
442	D	69.7	Low	74.7	Confident	117 Å²	117	65.7 Å²	65.7	63%	0.626	35%	0.349	S	S	*	.	H	α-helix	trans	-62.5	-39.9	177.8	-57.8	-32.8	0	0	0	111.6	P440 S445 Y446	P440-D442 PolarHBondContact O-N 3.05Å; D442-S445 PolarHBondContact O-N 2.98Å; D442-S445 PolarHBondContact O-OG 3.19Å; D442-Y446 WeakPolarHBondContact O-CD2 3.42Å; D442-Y446 VanDerWaalsContact O-CE2 3.25Å; D442-Y446 WeakPolarHBondContact O-CE2 3.11Å
443	L	74.4	Confident	76.5	Confident	4 Å²	4	67.7 Å²	67.7	2%	0.021	36%	0.357	C	S	.	.	H	α-helix	trans	-72.7	-29.9	175.5	-66	-178.8	0	0	0	112.5	L206 D209 F210 F213 A439 P440 N441 S445	L206-L443 HydrophobicContact CD1-CD2 3.53Å; D209-L443 HydrophobicContact CB-CD2 3.82Å; F210-L443 HydrophobicContact CB-CD1 4.46Å; F210-L443 HydrophobicContact CB-CD2 4.3Å; F210-L443 HydrophobicContact CD2-CD1 4.21Å; F213-L443 HydrophobicContact CB-CD1 3.97Å; F213-L443 HydrophobicContact CD1-CD1 4.14Å; F213-L443 HydrophobicContact CG-CD1 4.15Å; A439-L443 HydrophobicContact CB-CB 4.09Å; A439-L443 HydrophobicContact CB-CD1 4.08Å; P440-L443 PolarHBondContact O-N 2.91Å; N441-L443 VanDerWaalsContact C-N 3.34Å; N441-L443 PolarHBondContact O-N 3.12Å; L443-S445 VanDerWaalsContact C-N 3.33Å
444	L	72	Confident	78.3	Confident	76 Å²	76	67.9 Å²	67.9	40%	0.398	36%	0.358	S	S	.	.	H	α-helix	trans	-80.8	-13.3	178.8	-65.6	173	0	0	0	113.3	I436 A439 P440 N441 Y446	I436-L444 HydrophobicContact CG2-CD2 4.45Å; I436-L444 WeakPolarHBondContact O-CD2 3.47Å; A439-L444 HydrophobicContact CB-CD2 4.46Å; A439-L444 HydrophobicContact CB-CG 4.36Å; P440-L444 PolarHBondContact O-N 3.28Å; N441-L444 PolarHBondContact O-N 3.5Å; L444-Y446 VanDerWaalsContact C-N 3.33Å; L444-Y446 PolarHBondContact O-N 3.27Å
445	S	80.9	Confident	80.1	Confident	81 Å²	81	62 Å²	62	57%	0.566	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-17.5	-175.7	72.5	0	0	0	0	114.1	N441 D442 L443	N441-S445 PolarHBondContact O-N 2.92Å; D442-S445 PolarHBondContact O-N 2.98Å; D442-S445 PolarHBondContact O-OG 3.19Å; L443-S445 VanDerWaalsContact C-N 3.33Å
446	Y	84.8	Confident	81.6	Confident	50 Å²	50	63.7 Å²	63.7	20%	0.196	34%	0.335	C	S	.	.			trans	-76.8	128	-177.5	-66.4	-78.6	0	0	0	111.9	T202 L206 D442 L444 I451 M454	T202-Y446 HydrophobicContact CG2-CE1 4.14Å; L206-Y446 HydrophobicContact CB-CE2 4.49Å; L206-Y446 HydrophobicContact CD1-CD2 3.77Å; L206-Y446 HydrophobicContact CD1-CE2 3.66Å; L206-Y446 HydrophobicContact CD2-CD2 4.43Å; L206-Y446 HydrophobicContact CG-CE2 4.46Å; D442-Y446 WeakPolarHBondContact O-CD2 3.42Å; D442-Y446 VanDerWaalsContact O-CE2 3.25Å; D442-Y446 WeakPolarHBondContact O-CE2 3.11Å; L444-Y446 VanDerWaalsContact C-N 3.33Å; L444-Y446 PolarHBondContact O-N 3.27Å; Y446-I451 HydrophobicContact CG-CD1 4.34Å; Y446-M454 HydrophobicContact CD1-CE 3.86Å; Y446-M454 HydrophobicContact CE1-CE 3.64Å
447	T	85.6	Confident	83.1	Confident	73 Å²	73	66.5 Å²	66.5	45%	0.448	35%	0.35	S	S	.	.			trans	-83.1	157.2	173.7	72.7	0	0	0	0	111	N449 D450 I451	T447-N449 PolarHBondContact O-N 2.93Å; T447-N449 VanDerWaalsContact O-N 3.12Å; T447-D450 WeakPolarHBondContact CB-OD2 3.42Å; T447-D450 PolarHBondContact N-OD2 3.42Å; T447-D450 VanDerWaalsContact N-OD2 3.13Å; T447-D450 PolarHBondContact O-N 3.44Å; T447-D450 PolarHBondContact OG1-N 3.16Å; T447-D450 PolarHBondContact OG1-OD2 2.95Å; T447-I451 PolarHBondContact O-N 3.41Å; T447-I451 VanDerWaalsContact O-N 3.15Å
448	S	85.4	Confident	84.6	Confident	26 Å²	26	59.7 Å²	59.7	18%	0.182	32%	0.319	C	S	.	.	H	α-helix	trans	-55.2	-30.9	173.1	178	0	0	0	0	112.4	F401 F452	F401-S448 WeakPolarHBondContact CZ-OG 3.42Å; S448-F452 WeakPolarHBondContact O-CB 3.47Å; S448-F452 PolarHBondContact O-N 3.49Å
449	N	89.4	Confident	86	Confident	90 Å²	90	57.7 Å²	57.7	48%	0.481	30%	0.304	S	S	.	.	H	α-helix	trans	-69.9	-34.7	175.2	-170.8	30.5	0	0	0	112.8	T447 K453	T447-N449 PolarHBondContact O-N 2.93Å; T447-N449 VanDerWaalsContact O-N 3.12Å; N449-K453 VanDerWaalsContact O-CG 3.3Å; N449-K453 WeakPolarHBondContact O-CG 3.48Å; N449-K453 PolarHBondContact O-N 3.39Å
450	D	91.6	Very high	87.2	Confident	53 Å²	53	61.6 Å²	61.6	28%	0.283	32%	0.321	S	S	.	.	H	α-helix	trans	-70.2	-42.9	177.5	-57.7	-43.5	0	0	0	110.8	T447 F452 K453 M454	T447-D450 WeakPolarHBondContact CB-OD2 3.42Å; T447-D450 PolarHBondContact N-OD2 3.42Å; T447-D450 VanDerWaalsContact N-OD2 3.13Å; T447-D450 PolarHBondContact O-N 3.44Å; T447-D450 PolarHBondContact OG1-N 3.16Å; T447-D450 PolarHBondContact OG1-OD2 2.95Å; D450-F452 VanDerWaalsContact C-N 3.35Å; D450-F452 PolarHBondContact O-N 3.18Å; D450-K453 PolarHBondContact O-N 3.07Å; D450-K453 IonicContact OD1-NZ 2.99Å; D450-M454 WeakPolarHBondContact O-CG 3.49Å; D450-M454 PolarHBondContact O-N 3.23Å
451	I	92.2	Very high	88.4	Confident	0 Å²	0	59 Å²	59	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-63	-42.3	174.2	-56.1	-57.8	0	0	0	111	L206 L393 F396 Q397 L400 Y446 T447 K453 M454 I455	L206-I451 HydrophobicContact CD2-CD1 3.35Å; L393-I451 HydrophobicContact CB-CG2 4.44Å; L393-I451 HydrophobicContact CD2-CG2 4.45Å; L393-I451 WeakPolarHBondContact O-CG2 3.37Å; F396-I451 HydrophobicContact CD1-CD1 3.69Å; F396-I451 HydrophobicContact CD1-CG1 3.87Å; F396-I451 HydrophobicContact CD1-CG2 4.47Å; F396-I451 HydrophobicContact CE1-CD1 3.79Å; F396-I451 HydrophobicContact CE1-CG1 4.1Å; Q397-I451 HydrophobicContact CB-CG2 3.8Å; Q397-I451 HydrophobicContact CG-CG2 4.21Å; L400-I451 HydrophobicContact CD1-CG1 3.76Å; Y446-I451 HydrophobicContact CG-CD1 4.34Å; T447-I451 PolarHBondContact O-N 3.41Å; T447-I451 VanDerWaalsContact O-N 3.15Å; I451-K453 VanDerWaalsContact C-N 3.33Å; I451-K453 PolarHBondContact O-N 2.87Å; I451-M454 HydrophobicContact CD1-SD 4.1Å; I451-M454 WeakPolarHBondContact O-CB 3.28Å; I451-M454 PolarHBondContact O-N 3.41Å; I451-M454 VanDerWaalsContact O-N 3.12Å; I451-I455 HydrophobicContact CG2-CD1 4.1Å; I451-I455 HydrophobicContact CG2-CG1 4.5Å; I451-I455 WeakPolarHBondContact O-CG1 3.25Å; I451-I455 PolarHBondContact O-N 2.99Å
452	F	94.1	Very high	89.7	Confident	93 Å²	93	53.5 Å²	53.5	41%	0.408	28%	0.275	S	S	.	.	H	α-helix	trans	-57.4	-45.8	174.8	-179	-100.9	0	0	0	111.9	S448 D450 M454 I455 E456	S448-F452 WeakPolarHBondContact O-CB 3.47Å; S448-F452 PolarHBondContact O-N 3.49Å; D450-F452 VanDerWaalsContact C-N 3.35Å; D450-F452 PolarHBondContact O-N 3.18Å; F452-M454 VanDerWaalsContact C-N 3.32Å; F452-M454 PolarHBondContact O-N 3.15Å; F452-I455 WeakPolarHBondContact O-CB 3.31Å; F452-I455 PolarHBondContact O-N 3.42Å; F452-E456 HydrophobicContact CD1-CG 4.24Å; F452-E456 HydrophobicContact CE1-CG 3.78Å; F452-E456 HydrophobicContact CE2-CG 4.32Å; F452-E456 HydrophobicContact CZ-CG 3.82Å; F452-E456 WeakPolarHBondContact O-CG 3.4Å; F452-E456 PolarHBondContact O-N 2.88Å
453	K	95	Very high	90.9	Very high	104 Å²	104	52 Å²	52	45%	0.452	27%	0.27	S	S	.	.	H	α-helix	trans	-61	-40	175.2	-69.1	167.2	-168.3	163.9	0	112.2	N449 D450 I451 E456 L457	N449-K453 VanDerWaalsContact O-CG 3.3Å; N449-K453 WeakPolarHBondContact O-CG 3.48Å; N449-K453 PolarHBondContact O-N 3.39Å; D450-K453 PolarHBondContact O-N 3.07Å; D450-K453 IonicContact OD1-NZ 2.99Å; I451-K453 VanDerWaalsContact C-N 3.33Å; I451-K453 PolarHBondContact O-N 2.87Å; K453-E456 PolarHBondContact O-N 2.6Å; K453-L457 WeakPolarHBondContact O-CG 3.36Å; K453-L457 PolarHBondContact O-N 3.14Å
454	M	96.4	Very high	91.9	Very high	18 Å²	18	55.3 Å²	55.3	9%	0.089	29%	0.285	C	S	.	.	H	α-helix	trans	-62.2	-44	175.8	-67.1	176.1	-174.5	0	0	111.6	T202 A203 L206 L393 Y446 D450 I451 F452 E456 L457 V458	T202-M454 HydrophobicContact CG2-CE 3.66Å; A203-M454 HydrophobicContact CB-CB 3.97Å; A203-M454 HydrophobicContact CB-CG 3.94Å; A203-M454 HydrophobicContact CB-SD 3.83Å; L206-M454 HydrophobicContact CD2-SD 4.1Å; L393-M454 HydrophobicContact CD1-CB 3.86Å; L393-M454 HydrophobicContact CD2-CB 4.21Å; L393-M454 HydrophobicContact CD2-SD 4.12Å; Y446-M454 HydrophobicContact CD1-CE 3.86Å; Y446-M454 HydrophobicContact CE1-CE 3.64Å; D450-M454 WeakPolarHBondContact O-CG 3.49Å; D450-M454 PolarHBondContact O-N 3.23Å; I451-M454 HydrophobicContact CD1-SD 4.1Å; I451-M454 WeakPolarHBondContact O-CB 3.28Å; I451-M454 PolarHBondContact O-N 3.41Å; I451-M454 VanDerWaalsContact O-N 3.12Å; F452-M454 VanDerWaalsContact C-N 3.32Å; F452-M454 PolarHBondContact O-N 3.15Å; M454-E456 VanDerWaalsContact C-N 3.33Å; M454-E456 PolarHBondContact O-N 2.83Å; M454-L457 PolarHBondContact O-N 2.88Å; M454-V458 WeakPolarHBondContact O-CG2 2.96Å; M454-V458 PolarHBondContact O-N 3.23Å
455	I	96.4	Very high	92.9	Very high	2 Å²	2	52.5 Å²	52.5	1%	0.01	27%	0.27	C	S	.	.	H	α-helix	trans	-59.4	-45.3	175.4	-69.4	167.9	0	0	0	110.5	L393 Q394 Q397 I451 F452 L457 V458 K459	L393-I455 HydrophobicContact CB-CD1 4.16Å; L393-I455 HydrophobicContact CB-CG1 3.52Å; L393-I455 HydrophobicContact CD1-CG1 4.25Å; Q394-I455 HydrophobicContact CG-CD1 4.06Å; Q397-I455 HydrophobicContact CB-CD1 4.13Å; Q397-I455 VanDerWaalsContact OE1-CD1 3.24Å; I451-I455 HydrophobicContact CG2-CD1 4.1Å; I451-I455 HydrophobicContact CG2-CG1 4.5Å; I451-I455 WeakPolarHBondContact O-CG1 3.25Å; I451-I455 PolarHBondContact O-N 2.99Å; F452-I455 WeakPolarHBondContact O-CB 3.31Å; F452-I455 PolarHBondContact O-N 3.42Å; I455-L457 VanDerWaalsContact C-N 3.34Å; I455-L457 PolarHBondContact O-N 3.49Å; I455-V458 PolarHBondContact O-N 2.83Å; I455-K459 HydrophobicContact CG2-CD 4.06Å; I455-K459 VanDerWaalsContact CG2-CE 3.4Å; I455-K459 HydrophobicContact CG2-CG 4.36Å; I455-K459 WeakPolarHBondContact O-CB 3.39Å; I455-K459 WeakPolarHBondContact O-CG 3.37Å; I455-K459 PolarHBondContact O-N 3.15Å
456	E	97.3	Very high	93.4	Very high	80 Å²	80	52.6 Å²	52.6	37%	0.374	27%	0.267	S	S	.	.	H	α-helix	trans	-63.5	-39	178.5	-68.6	-59	113.5	0	0	111.9	F452 K453 M454 K459 E460	F452-E456 HydrophobicContact CD1-CG 4.24Å; F452-E456 HydrophobicContact CE1-CG 3.78Å; F452-E456 HydrophobicContact CE2-CG 4.32Å; F452-E456 HydrophobicContact CZ-CG 3.82Å; F452-E456 WeakPolarHBondContact O-CG 3.4Å; F452-E456 PolarHBondContact O-N 2.88Å; K453-E456 PolarHBondContact O-N 2.6Å; M454-E456 VanDerWaalsContact C-N 3.33Å; M454-E456 PolarHBondContact O-N 2.83Å; E456-K459 PolarHBondContact O-N 3.12Å; E456-K459 WeakPolarHBondContact OE1-CD 3.24Å; E456-K459 IonicContact OE1-NZ 3.76Å; E456-K459 PolarHBondContact OE1-NZ 3.3Å; E456-E460 WeakPolarHBondContact O-CB 3.22Å; E456-E460 PolarHBondContact O-N 3.34Å
457	L	97.3	Very high	93.7	Very high	62 Å²	62	52.8 Å²	52.8	33%	0.325	27%	0.273	S	S	.	.	H	α-helix	trans	-63.4	-41.1	173.3	-69.9	171.9	0	0	0	112.3	L200 K453 M454 I455 E460 A461	L200-L457 HydrophobicContact CD2-CB 3.56Å; K453-L457 WeakPolarHBondContact O-CG 3.36Å; K453-L457 PolarHBondContact O-N 3.14Å; M454-L457 PolarHBondContact O-N 2.88Å; I455-L457 VanDerWaalsContact C-N 3.34Å; I455-L457 PolarHBondContact O-N 3.49Å; L457-E460 PolarHBondContact O-N 2.91Å; L457-A461 PolarHBondContact O-N 3.19Å
458	V	97.3	Very high	94	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-66.8	-42.9	177.3	177.8	0	0	0	0	110.5	L200 L386 L389 N390 L393 M454 I455 E460 A461 L462	L200-V458 HydrophobicContact CD1-CG2 4.37Å; L200-V458 HydrophobicContact CD2-CB 4.43Å; L200-V458 HydrophobicContact CD2-CG2 3.57Å; L386-V458 HydrophobicContact CB-CG1 4.38Å; L386-V458 HydrophobicContact CD2-CG1 4.35Å; L386-V458 VanDerWaalsContact O-CG1 3.29Å; L386-V458 WeakPolarHBondContact O-CG1 3.41Å; L389-V458 HydrophobicContact CD2-CG2 3.79Å; L389-V458 HydrophobicContact CG-CG2 4.07Å; N390-V458 HydrophobicContact CB-CG1 3.72Å; L393-V458 HydrophobicContact CD1-CG2 3.86Å; M454-V458 WeakPolarHBondContact O-CG2 2.96Å; M454-V458 PolarHBondContact O-N 3.23Å; I455-V458 PolarHBondContact O-N 2.83Å; V458-E460 VanDerWaalsContact C-N 3.34Å; V458-E460 PolarHBondContact O-N 3.11Å; V458-A461 PolarHBondContact O-N 3.17Å; V458-L462 HydrophobicContact CG1-CD1 4.19Å; V458-L462 HydrophobicContact CG1-CG 4.45Å; V458-L462 WeakPolarHBondContact O-CB 3.43Å; V458-L462 VanDerWaalsContact O-CG 3.32Å; V458-L462 WeakPolarHBondContact O-CG 3.42Å; V458-L462 PolarHBondContact O-N 3.31Å
459	K	96.8	Very high	94.3	Very high	79 Å²	79	51.9 Å²	51.9	34%	0.343	27%	0.27	S	S	.	.	H	α-helix	trans	-62	-40.8	173.8	-72.2	176	-173	163.4	0	111.9	I455 E456 A461 L462 T463	I455-K459 HydrophobicContact CG2-CD 4.06Å; I455-K459 VanDerWaalsContact CG2-CE 3.4Å; I455-K459 HydrophobicContact CG2-CG 4.36Å; I455-K459 WeakPolarHBondContact O-CB 3.39Å; I455-K459 WeakPolarHBondContact O-CG 3.37Å; I455-K459 PolarHBondContact O-N 3.15Å; E456-K459 PolarHBondContact O-N 3.12Å; E456-K459 WeakPolarHBondContact OE1-CD 3.24Å; E456-K459 IonicContact OE1-NZ 3.76Å; E456-K459 PolarHBondContact OE1-NZ 3.3Å; K459-A461 VanDerWaalsContact C-N 3.34Å; K459-A461 PolarHBondContact O-N 3.43Å; K459-L462 PolarHBondContact O-N 3.42Å; K459-T463 WeakPolarHBondContact O-CG2 3.24Å; K459-T463 PolarHBondContact O-N 3.07Å; K459-T463 PolarHBondContact O-OG1 3.45Å; K459-T463 VanDerWaalsContact O-OG1 3.07Å
460	E	96.6	Very high	94.4	Very high	90 Å²	90	48 Å²	48	42%	0.421	25%	0.249	S	C	.	.	H	α-helix	trans	-60.4	-45.1	174.7	-169.4	-171.6	154	0	0	110.7	E456 L457 V458 T463 K464	E456-E460 WeakPolarHBondContact O-CB 3.22Å; E456-E460 PolarHBondContact O-N 3.34Å; L457-E460 PolarHBondContact O-N 2.91Å; V458-E460 VanDerWaalsContact C-N 3.34Å; V458-E460 PolarHBondContact O-N 3.11Å; E460-T463 WeakPolarHBondContact CA-OG1 3.31Å; E460-T463 PolarHBondContact O-N 3.35Å; E460-T463 PolarHBondContact O-OG1 3.45Å; E460-K464 HydrophobicContact CG-CD 4.35Å; E460-K464 WeakPolarHBondContact O-CB 3.43Å; E460-K464 WeakPolarHBondContact O-CG 3.14Å; E460-K464 PolarHBondContact O-N 3.38Å; E460-K464 VanDerWaalsContact OE1-CE 3.29Å; E460-K464 WeakPolarHBondContact OE1-CE 3.37Å; E460-K464 IonicContact OE1-NZ 3.14Å; E460-K464 PolarHBondContact OE1-NZ 3.08Å
461	A	95.9	Very high	94.4	Very high	7 Å²	7	47.9 Å²	47.9	6%	0.058	25%	0.253	C	S	.	.	H	α-helix	trans	-62.4	-43.6	175.9	0	0	0	0	0	112.5	F193 L197 L200 L386 L457 V458 K459 K464 L465	F193-A461 HydrophobicContact CE2-CB 4.2Å; F193-A461 WeakPolarHBondContact CE2-O 3.35Å; F193-A461 HydrophobicContact CZ-CB 4.3Å; L197-A461 HydrophobicContact CD2-CB 4.15Å; L200-A461 HydrophobicContact CD1-CB 4.12Å; L386-A461 HydrophobicContact CD1-CB 4.23Å; L386-A461 HydrophobicContact CD2-CB 4.3Å; L457-A461 PolarHBondContact O-N 3.19Å; V458-A461 PolarHBondContact O-N 3.17Å; K459-A461 VanDerWaalsContact C-N 3.34Å; K459-A461 PolarHBondContact O-N 3.43Å; A461-K464 PolarHBondContact O-N 2.93Å; A461-L465 PolarHBondContact O-N 3.04Å; A461-L465 VanDerWaalsContact O-N 3.12Å
462	L	95.8	Very high	94.4	Very high	19 Å²	19	48.8 Å²	48.8	10%	0.099	26%	0.257	C	S	.	.	H	α-helix	trans	-59.3	-49.2	174.8	-74.8	171.9	0	0	0	111.3	L383 L386 L387 V458 K459 K464 L465 T466	L383-L462 HydrophobicContact CD1-CD2 3.52Å; L386-L462 HydrophobicContact CB-CD2 3.51Å; L386-L462 HydrophobicContact CB-CG 4.03Å; L386-L462 HydrophobicContact CD1-CD2 4.08Å; L386-L462 HydrophobicContact CD1-CG 4.49Å; L386-L462 HydrophobicContact CG-CD2 4.46Å; L387-L462 HydrophobicContact CD2-CD1 4.04Å; L387-L462 HydrophobicContact CD2-CD2 4.19Å; L387-L462 HydrophobicContact CG-CD2 4.22Å; V458-L462 HydrophobicContact CG1-CD1 4.19Å; V458-L462 HydrophobicContact CG1-CG 4.45Å; V458-L462 WeakPolarHBondContact O-CB 3.43Å; V458-L462 VanDerWaalsContact O-CG 3.32Å; V458-L462 WeakPolarHBondContact O-CG 3.42Å; V458-L462 PolarHBondContact O-N 3.31Å; K459-L462 PolarHBondContact O-N 3.42Å; L462-K464 PolarHBondContact O-N 3.43Å; L462-L465 PolarHBondContact O-N 2.84Å; L462-T466 WeakPolarHBondContact O-CB 3.14Å; L462-T466 VanDerWaalsContact O-CG2 3.31Å; L462-T466 WeakPolarHBondContact O-CG2 3.34Å; L462-T466 PolarHBondContact O-N 3.37Å; L462-T466 PolarHBondContact O-OG1 3.12Å
463	T	94.6	Very high	94.4	Very high	84 Å²	84	44.9 Å²	44.9	52%	0.515	24%	0.24	S	C	.	.	H	α-helix	trans	-62.8	-41.3	-179.9	53.1	0	0	0	0	112.7	K459 E460 L465 T466 T467	K459-T463 WeakPolarHBondContact O-CG2 3.24Å; K459-T463 PolarHBondContact O-N 3.07Å; K459-T463 PolarHBondContact O-OG1 3.45Å; K459-T463 VanDerWaalsContact O-OG1 3.07Å; E460-T463 WeakPolarHBondContact CA-OG1 3.31Å; E460-T463 PolarHBondContact O-N 3.35Å; E460-T463 PolarHBondContact O-OG1 3.45Å; T463-L465 PolarHBondContact O-N 2.96Å; T463-T466 PolarHBondContact O-N 3.47Å; T463-T467 VanDerWaalsContact O-CG2 3.23Å; T463-T467 WeakPolarHBondContact O-CG2 3.47Å; T463-T467 PolarHBondContact O-N 3.12Å
464	K	93.7	Very high	94.2	Very high	75 Å²	75	40 Å²	40	33%	0.326	22%	0.219	S	C	.	.	H	α-helix	trans	-60.1	-42.5	174.7	-78.1	172.5	170.4	170.2	0	112.4	F193 E460 A461 L462 T467 L470	F193-K464 HydrophobicContact CD2-CB 3.99Å; F193-K464 HydrophobicContact CD2-CD 4.22Å; F193-K464 HydrophobicContact CE2-CB 3.8Å; F193-K464 HydrophobicContact CE2-CD 4.38Å; E460-K464 HydrophobicContact CG-CD 4.35Å; E460-K464 WeakPolarHBondContact O-CB 3.43Å; E460-K464 WeakPolarHBondContact O-CG 3.14Å; E460-K464 PolarHBondContact O-N 3.38Å; E460-K464 VanDerWaalsContact OE1-CE 3.29Å; E460-K464 WeakPolarHBondContact OE1-CE 3.37Å; E460-K464 IonicContact OE1-NZ 3.14Å; E460-K464 PolarHBondContact OE1-NZ 3.08Å; A461-K464 PolarHBondContact O-N 2.93Å; L462-K464 PolarHBondContact O-N 3.43Å; K464-T467 PolarHBondContact O-OG1 2.9Å; K464-L470 WeakPolarHBondContact O-CD2 3.42Å
465	L	93.1	Very high	93.9	Very high	17 Å²	17	41.3 Å²	41.3	9%	0.089	23%	0.225	C	C	.	.	H	α-helix	trans	-77.3	-19.3	-178.9	-166.8	63.9	0	0	0	113.6	L190 F193 R379 L382 A461 L462 T463 L470	L190-L465 HydrophobicContact CD2-CD1 4.31Å; F193-L465 HydrophobicContact CE1-CB 4.44Å; F193-L465 HydrophobicContact CE1-CD1 4.03Å; F193-L465 HydrophobicContact CZ-CB 4.04Å; F193-L465 HydrophobicContact CZ-CD1 4.47Å; R379-L465 HydrophobicContact CG-CD1 4.45Å; L382-L465 HydrophobicContact CD2-CD2 4Å; L382-L465 HydrophobicContact CG-CD2 4.24Å; A461-L465 PolarHBondContact O-N 3.04Å; A461-L465 VanDerWaalsContact O-N 3.12Å; L462-L465 PolarHBondContact O-N 2.84Å; T463-L465 PolarHBondContact O-N 2.96Å; L465-L470 HydrophobicContact CD1-CD2 4.39Å
466	T	92.2	Very high	93.7	Very high	83 Å²	83	41.4 Å²	41.4	51%	0.509	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.2	13.3	-174.8	56	0	0	0	0	114	L383 L462 T463	L383-T466 HydrophobicContact CD1-CG2 3.84Å; L462-T466 WeakPolarHBondContact O-CB 3.14Å; L462-T466 VanDerWaalsContact O-CG2 3.31Å; L462-T466 WeakPolarHBondContact O-CG2 3.34Å; L462-T466 PolarHBondContact O-N 3.37Å; L462-T466 PolarHBondContact O-OG1 3.12Å; T463-T466 PolarHBondContact O-N 3.47Å
467	T	91.8	Very high	93.4	Very high	53 Å²	53	38 Å²	38	33%	0.325	21%	0.21	S	C	.	.			trans	-62.3	140	174.8	56.1	0	0	0	0	111.4	T463 K464 S469 L470 S471	T463-T467 VanDerWaalsContact O-CG2 3.23Å; T463-T467 WeakPolarHBondContact O-CG2 3.47Å; T463-T467 PolarHBondContact O-N 3.12Å; K464-T467 PolarHBondContact O-OG1 2.9Å; T467-S469 VanDerWaalsContact C-N 3.34Å; T467-S469 PolarHBondContact O-N 3.07Å; T467-L470 PolarHBondContact O-N 3.38Å; T467-L470 WeakPolarHBondContact OG1-CB 3.4Å; T467-S471 PolarHBondContact O-N 3.02Å
468	S	90.5	Very high	92.9	Very high	51 Å²	51	37.9 Å²	37.9	36%	0.357	21%	0.212	S	C	.	.	H	α-helix	trans	-61.1	-41.7	179.5	159.1	0	0	0	0	111.7	E165 L470 S471 Q472	E165-S468 WeakPolarHBondContact OE1-CB 3.41Å; E165-S468 PolarHBondContact OE1-OG 3.3Å; S468-L470 PolarHBondContact O-N 3.37Å; S468-S471 PolarHBondContact O-N 3.34Å; S468-Q472 WeakPolarHBondContact O-CG 3.1Å; S468-Q472 PolarHBondContact O-N 3.15Å; S468-Q472 PolarHBondContact OG-NE2 3.33Å
469	S	91.5	Very high	92.5	Very high	30 Å²	30	43.2 Å²	43.2	21%	0.21	23%	0.232	C	C	.	.	H	α-helix	trans	-56.8	-50	174.9	58	0	0	0	0	112.1	E165 T467 S471 Q472 L473	E165-S469 WeakPolarHBondContact O-CB 3.32Å; E165-S469 PolarHBondContact OE1-N 2.93Å; E165-S469 VanDerWaalsContact OE1-N 3.07Å; T467-S469 VanDerWaalsContact C-N 3.34Å; T467-S469 PolarHBondContact O-N 3.07Å; S469-S471 VanDerWaalsContact C-N 3.34Å; S469-S471 PolarHBondContact O-N 2.87Å; S469-Q472 PolarHBondContact O-N 3.33Å; S469-L473 WeakPolarHBondContact O-CB 3.33Å; S469-L473 WeakPolarHBondContact O-CG 3.39Å; S469-L473 PolarHBondContact O-N 2.87Å
470	L	92.7	Very high	92	Very high	7 Å²	7	44 Å²	44	4%	0.037	24%	0.238	C	C	.	.	H	α-helix	trans	-59.8	-44.9	178.8	179.9	64.7	0	0	0	111.7	V186 F189 L190 K464 L465 T467 S468 Q472 L473 M474	V186-L470 HydrophobicContact CG1-CD1 3.26Å; F189-L470 HydrophobicContact CD1-CD1 4.1Å; F189-L470 HydrophobicContact CE1-CD1 4.13Å; F189-L470 HydrophobicContact CE1-CD2 4.14Å; L190-L470 HydrophobicContact CD2-CD1 4.33Å; L190-L470 HydrophobicContact CD2-CD2 4.31Å; K464-L470 WeakPolarHBondContact O-CD2 3.42Å; L465-L470 HydrophobicContact CD1-CD2 4.39Å; T467-L470 PolarHBondContact O-N 3.38Å; T467-L470 WeakPolarHBondContact OG1-CB 3.4Å; S468-L470 PolarHBondContact O-N 3.37Å; L470-Q472 PolarHBondContact O-N 3.13Å; L470-L473 PolarHBondContact O-N 2.97Å; L470-M474 HydrophobicContact CD1-CG 4.4Å; L470-M474 VanDerWaalsContact O-CB 3.31Å; L470-M474 WeakPolarHBondContact O-CB 3.46Å; L470-M474 VanDerWaalsContact O-CG 3.24Å; L470-M474 WeakPolarHBondContact O-CG 3.47Å; L470-M474 PolarHBondContact O-N 2.92Å
471	S	92	Very high	91.6	Very high	51 Å²	51	41.2 Å²	41.2	36%	0.357	23%	0.234	S	C	.	.	H	α-helix	trans	-58.8	-48.1	177.8	-176	0	0	0	0	111.6	T467 S468 S469 M474 M475	T467-S471 PolarHBondContact O-N 3.02Å; S468-S471 PolarHBondContact O-N 3.34Å; S469-S471 VanDerWaalsContact C-N 3.34Å; S469-S471 PolarHBondContact O-N 2.87Å; S471-M474 WeakPolarHBondContact O-CB 3.44Å; S471-M474 PolarHBondContact O-N 2.9Å; S471-M475 WeakPolarHBondContact O-CG 3.41Å; S471-M475 PolarHBondContact O-N 3.26Å
472	Q	92	Very high	91.5	Very high	20 Å²	20	41.7 Å²	41.7	9%	0.093	24%	0.235	C	C	.	.	H	α-helix	trans	-70.2	-38.4	-179	-65.1	-172	47.7	0	0	112.6	F166 S468 S469 L470 M474 M475 I476 Y482 L486	F166-Q472 HydrophobicContact CE1-CB 3.94Å; F166-Q472 HydrophobicContact CZ-CB 4.07Å; F166-Q472 HydrophobicContact CZ-CG 4.4Å; F166-Q472 VanDerWaalsContact CZ-OE1 3.28Å; S468-Q472 WeakPolarHBondContact O-CG 3.1Å; S468-Q472 PolarHBondContact O-N 3.15Å; S468-Q472 PolarHBondContact OG-NE2 3.33Å; S469-Q472 PolarHBondContact O-N 3.33Å; L470-Q472 PolarHBondContact O-N 3.13Å; Q472-M474 VanDerWaalsContact C-N 3.28Å; Q472-M474 PolarHBondContact O-N 3.29Å; Q472-M475 WeakPolarHBondContact O-CB 3.45Å; Q472-M475 PolarHBondContact O-N 3.01Å; Q472-M475 VanDerWaalsContact O-N 3.16Å; Q472-I476 PolarHBondContact O-N 3.25Å; Q472-I476 VanDerWaalsContact O-N 3.1Å; Q472-Y482 HydrophobicContact CB-CE1 4.08Å; Q472-Y482 VanDerWaalsContact CG-OH 3.31Å; Q472-Y482 WeakPolarHBondContact CG-OH 3.45Å; Q472-Y482 WeakPolarHBondContact O-CE1 3.5Å; Q472-Y482 PolarHBondContact OE1-OH 3.49Å; Q472-Y482 VanDerWaalsContact OE1-OH 3.14Å; Q472-L486 VanDerWaalsContact OE1-CD1 3.26Å
473	L	92.9	Very high	91.3	Very high	10 Å²	10	40.8 Å²	40.8	5%	0.052	23%	0.23	C	C	.	.	H	α-helix	trans	-64.5	-34.7	173.2	-66.7	171.1	0	0	0	111.4	F166 E182 A183 V186 S469 L470 I476 R477	F166-L473 HydrophobicContact CD1-CD2 4.32Å; E182-L473 HydrophobicContact CB-CD1 4.46Å; E182-L473 HydrophobicContact CB-CD2 4Å; E182-L473 HydrophobicContact CG-CD1 3.76Å; E182-L473 HydrophobicContact CG-CD2 4.15Å; A183-L473 HydrophobicContact CB-CD2 4.39Å; V186-L473 HydrophobicContact CG2-CB 3.86Å; V186-L473 HydrophobicContact CG2-CD1 4.12Å; S469-L473 WeakPolarHBondContact O-CB 3.33Å; S469-L473 WeakPolarHBondContact O-CG 3.39Å; S469-L473 PolarHBondContact O-N 2.87Å; L470-L473 PolarHBondContact O-N 2.97Å; L473-I476 HydrophobicContact CD2-CD1 4.22Å; L473-I476 WeakPolarHBondContact O-CB 3.3Å; L473-I476 PolarHBondContact O-N 3.14Å; L473-R477 PolarHBondContact O-N 3.42Å
474	M	90.5	Very high	91.2	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.01	23%	0.225	C	C	.	.	H	α-helix	trans	-68	-35.7	171.3	-78.6	-69.7	138	0	0	112.8	V186 L190 R379 L470 S471 Q472 I476 R477 T478	V186-M474 HydrophobicContact CB-CE 3.52Å; V186-M474 HydrophobicContact CG1-CE 3.02Å; V186-M474 HydrophobicContact CG2-CE 4.35Å; L190-M474 HydrophobicContact CD1-CE 3.52Å; L190-M474 HydrophobicContact CD1-SD 4.38Å; L190-M474 HydrophobicContact CG-CE 4.49Å; R379-M474 PolarHBondContact NH1-SD 3.38Å; L470-M474 HydrophobicContact CD1-CG 4.4Å; L470-M474 VanDerWaalsContact O-CB 3.31Å; L470-M474 WeakPolarHBondContact O-CB 3.46Å; L470-M474 VanDerWaalsContact O-CG 3.24Å; L470-M474 WeakPolarHBondContact O-CG 3.47Å; L470-M474 PolarHBondContact O-N 2.92Å; S471-M474 WeakPolarHBondContact O-CB 3.44Å; S471-M474 PolarHBondContact O-N 2.9Å; Q472-M474 VanDerWaalsContact C-N 3.28Å; Q472-M474 PolarHBondContact O-N 3.29Å; M474-I476 VanDerWaalsContact C-N 3.28Å; M474-I476 PolarHBondContact O-N 3.42Å; M474-R477 PolarHBondContact O-N 2.82Å; M474-R477 VanDerWaalsContact O-N 3.15Å; M474-T478 PolarHBondContact O-N 2.98Å; M474-T478 VanDerWaalsContact O-N 3.09Å; M474-T478 PolarHBondContact O-OG1 3.36Å
475	M	91.7	Very high	91.3	Very high	45 Å²	45	45.2 Å²	45.2	22%	0.222	24%	0.241	C	C	.	.	H	α-helix	trans	-62.6	-35.4	172.7	-71.6	-176.7	77.5	0	0	111.9	S471 Q472 R477 T478 R479 Y482	S471-M475 WeakPolarHBondContact O-CG 3.41Å; S471-M475 PolarHBondContact O-N 3.26Å; Q472-M475 WeakPolarHBondContact O-CB 3.45Å; Q472-M475 PolarHBondContact O-N 3.01Å; Q472-M475 VanDerWaalsContact O-N 3.16Å; M475-R477 VanDerWaalsContact C-N 3.34Å; M475-R477 PolarHBondContact O-N 2.89Å; M475-T478 WeakPolarHBondContact CA-OG1 3.42Å; M475-T478 PolarHBondContact O-N 3.07Å; M475-T478 PolarHBondContact O-OG1 3.32Å; M475-R479 PolarHBondContact O-N 2.85Å; M475-Y482 HydrophobicContact CB-CD1 3.42Å; M475-Y482 VanDerWaalsContact CB-CD1 3.42Å; M475-Y482 HydrophobicContact CB-CD2 4.11Å; M475-Y482 HydrophobicContact CB-CE1 3.6Å; M475-Y482 HydrophobicContact CB-CE2 4.25Å; M475-Y482 HydrophobicContact CB-CG 3.71Å; M475-Y482 HydrophobicContact CE-CD2 3.53Å; M475-Y482 HydrophobicContact CE-CE2 3.47Å; M475-Y482 VanDerWaalsContact CE-CE2 3.47Å; M475-Y482 HydrophobicContact CE-CG 4.27Å; M475-Y482 HydrophobicContact SD-CD2 4.21Å; M475-Y482 HydrophobicContact SD-CE1 4.35Å; M475-Y482 HydrophobicContact SD-CE2 3.71Å
476	I	91.6	Very high	91.3	Very high	5 Å²	5	44.5 Å²	44.5	3%	0.026	24%	0.237	C	C	.	.	H	α-helix	trans	-60.2	-43.8	171.9	-65.9	170.3	0	0	0	111	L179 A183 V265 Q472 L473 M474 T478 Y482 L483 L486	L179-I476 HydrophobicContact CB-CD1 4.23Å; A183-I476 HydrophobicContact CB-CB 4.37Å; A183-I476 HydrophobicContact CB-CG2 3.98Å; V265-I476 HydrophobicContact CG2-CG2 4.24Å; Q472-I476 PolarHBondContact O-N 3.25Å; Q472-I476 VanDerWaalsContact O-N 3.1Å; L473-I476 HydrophobicContact CD2-CD1 4.22Å; L473-I476 WeakPolarHBondContact O-CB 3.3Å; L473-I476 PolarHBondContact O-N 3.14Å; M474-I476 VanDerWaalsContact C-N 3.28Å; M474-I476 PolarHBondContact O-N 3.42Å; I476-T478 VanDerWaalsContact C-N 3.3Å; I476-T478 PolarHBondContact O-N 3.29Å; I476-Y482 HydrophobicContact CG1-CD1 3.81Å; I476-Y482 HydrophobicContact CG1-CE1 4.34Å; I476-L483 HydrophobicContact CD1-CD1 3.98Å; I476-L483 HydrophobicContact CG1-CB 4.44Å; I476-L483 HydrophobicContact CG1-CD1 4.34Å; I476-L483 HydrophobicContact CG2-CB 4.24Å; I476-L483 HydrophobicContact CG2-CD1 4.27Å; I476-L486 HydrophobicContact CD1-CD2 4.01Å
477	R	90.3	Very high	91.3	Very high	9 Å²	9	41.1 Å²	41.1	3%	0.034	22%	0.216	C	C	.	.	H	α-helix	trans	-71.3	-20.4	-178.9	-66.8	178	66.3	61.4	8.1	114.2	A183 P187 D263 V265 R370 D374 L473 M474 M475	A183-R477 WeakPolarHBondContact O-CD 3.38Å; A183-R477 PolarHBondContact O-NH1 3.2Å; P187-R477 VanDerWaalsContact CG-NH2 3.3Å; D263-R477 VanDerWaalsContact CG-NH2 3.33Å; D263-R477 IonicContact OD1-CZ 2.72Å; D263-R477 IonicContact OD1-NH1 2.75Å; D263-R477 PolarHBondContact OD1-NH1 2.78Å; D263-R477 IonicContact OD1-NH2 3.74Å; D263-R477 IonicContact OD2-CZ 2.87Å; D263-R477 IonicContact OD2-NH1 3.8Å; D263-R477 PolarHBondContact OD2-NH1 2.95Å; D263-R477 IonicContact OD2-NH2 3.92Å; D263-R477 PolarHBondContact OD2-NH2 3.48Å; V265-R477 HydrophobicContact CG2-CB 4.42Å; V265-R477 HydrophobicContact CG2-CG 3.78Å; R370-R477 PolarHBondContact NH1-O 3.5Å; R370-R477 PolarHBondContact NH2-O 2.72Å; D374-R477 IonicContact OD2-CZ 2.66Å; D374-R477 IonicContact OD2-NE 3.13Å; D374-R477 IonicContact OD2-NH2 3.71Å; D374-R477 PolarHBondContact OD2-NH2 3.12Å; L473-R477 PolarHBondContact O-N 3.42Å; M474-R477 PolarHBondContact O-N 2.82Å; M474-R477 VanDerWaalsContact O-N 3.15Å; M475-R477 VanDerWaalsContact C-N 3.34Å; M475-R477 PolarHBondContact O-N 2.89Å
478	T	87.6	Confident	91.4	Very high	59 Å²	59	43.6 Å²	43.6	36%	0.362	23%	0.228	S	C	.	.	H	α-helix	trans	-101.4	-34	-178.5	50.4	0	0	0	0	112.6	M474 M475 I476	M474-T478 PolarHBondContact O-N 2.98Å; M474-T478 VanDerWaalsContact O-N 3.09Å; M474-T478 PolarHBondContact O-OG1 3.36Å; M475-T478 WeakPolarHBondContact CA-OG1 3.42Å; M475-T478 PolarHBondContact O-N 3.07Å; M475-T478 PolarHBondContact O-OG1 3.32Å; I476-T478 VanDerWaalsContact C-N 3.3Å; I476-T478 PolarHBondContact O-N 3.29Å
479	R	88.6	Confident	91.6	Very high	111 Å²	111	46.7 Å²	46.7	42%	0.419	23%	0.231	S	C	.	.			trans	-129.9	111.9	-176.6	-63	-178.6	-179.9	-177.4	-1.7	111	E326 M475 G481 Y482	E326-R479 IonicContact OE1-NH1 3.31Å; E326-R479 IonicContact OE2-CZ 3.67Å; E326-R479 VanDerWaalsContact OE2-CZ 3.23Å; E326-R479 IonicContact OE2-NH1 3.3Å; E326-R479 PolarHBondContact OE2-NH1 2.85Å; E326-R479 IonicContact OE2-NH2 3.64Å; E326-R479 PolarHBondContact OE2-NH2 3.39Å; M475-R479 PolarHBondContact O-N 2.85Å; R479-G481 VanDerWaalsContact C-N 3.29Å; R479-G481 PolarHBondContact O-N 2.99Å; R479-Y482 WeakPolarHBondContact O-CB 3.42Å; R479-Y482 PolarHBondContact O-N 3.14Å
480	I	85.8	Confident	91.7	Very high	95 Å²	95	45.2 Å²	45.2	49%	0.487	22%	0.221	S	C	.	.	H	α-helix	trans	-56.2	-39.1	-178.6	-168.2	154.4	0	0	0	113.8	L268 Y482 L483	L268-I480 HydrophobicContact CD1-CD1 3.94Å; L268-I480 HydrophobicContact CD1-CG1 3.91Å; L268-I480 HydrophobicContact CD2-CD1 4.07Å; L268-I480 HydrophobicContact CG-CD1 4.44Å; I480-Y482 VanDerWaalsContact C-N 3.26Å; I480-Y482 PolarHBondContact O-N 3.27Å; I480-L483 PolarHBondContact O-N 3.39Å
481	G	89.6	Confident	91.8	Very high	32 Å²	32	47.2 Å²	47.2	33%	0.33	23%	0.232	S	C	.	.	H	α-helix	trans	-75.1	-10	-179.6	0	0	0	0	0	114.5	R479 L483 R485	R479-G481 VanDerWaalsContact C-N 3.29Å; R479-G481 PolarHBondContact O-N 2.99Å; G481-L483 VanDerWaalsContact C-N 3.34Å; G481-R485 WeakPolarHBondContact O-CG 3.28Å; G481-R485 PolarHBondContact O-N 2.88Å
482	Y	92.6	Very high	91.9	Very high	18 Å²	18	47.5 Å²	47.5	7%	0.071	23%	0.229	C	C	.	.	H	α-helix	trans	-72.1	-31.5	176.2	-173.7	-98.3	0	0	0	111.7	Q472 M475 I476 R479 I480 D484 R485 L486	Q472-Y482 HydrophobicContact CB-CE1 4.08Å; Q472-Y482 VanDerWaalsContact CG-OH 3.31Å; Q472-Y482 WeakPolarHBondContact CG-OH 3.45Å; Q472-Y482 WeakPolarHBondContact O-CE1 3.5Å; Q472-Y482 PolarHBondContact OE1-OH 3.49Å; Q472-Y482 VanDerWaalsContact OE1-OH 3.14Å; M475-Y482 HydrophobicContact CB-CD1 3.42Å; M475-Y482 VanDerWaalsContact CB-CD1 3.42Å; M475-Y482 HydrophobicContact CB-CD2 4.11Å; M475-Y482 HydrophobicContact CB-CE1 3.6Å; M475-Y482 HydrophobicContact CB-CE2 4.25Å; M475-Y482 HydrophobicContact CB-CG 3.71Å; M475-Y482 HydrophobicContact CE-CD2 3.53Å; M475-Y482 HydrophobicContact CE-CE2 3.47Å; M475-Y482 VanDerWaalsContact CE-CE2 3.47Å; M475-Y482 HydrophobicContact CE-CG 4.27Å; M475-Y482 HydrophobicContact SD-CD2 4.21Å; M475-Y482 HydrophobicContact SD-CE1 4.35Å; M475-Y482 HydrophobicContact SD-CE2 3.71Å; I476-Y482 HydrophobicContact CG1-CD1 3.81Å; I476-Y482 HydrophobicContact CG1-CE1 4.34Å; R479-Y482 WeakPolarHBondContact O-CB 3.42Å; R479-Y482 PolarHBondContact O-N 3.14Å; I480-Y482 VanDerWaalsContact C-N 3.26Å; I480-Y482 PolarHBondContact O-N 3.27Å; Y482-D484 VanDerWaalsContact C-N 3.35Å; Y482-D484 PolarHBondContact O-N 3.49Å; Y482-R485 PolarHBondContact O-N 3.29Å; Y482-L486 HydrophobicContact CD1-CB 4.48Å; Y482-L486 HydrophobicContact CE1-CB 4.11Å; Y482-L486 HydrophobicContact CE1-CD2 4.12Å; Y482-L486 WeakPolarHBondContact O-CB 3.47Å; Y482-L486 PolarHBondContact O-N 3.14Å
483	L	92.5	Very high	92	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59.4	-45.3	176	178.2	62.3	0	0	0	111.9	R176 L179 L180 I476 I480 G481 L486 T487	R176-L483 HydrophobicContact CG-CD1 4.5Å; R176-L483 HydrophobicContact CG-CD2 4.27Å; R176-L483 HydrophobicContact CG-CG 4.36Å; R176-L483 VanDerWaalsContact CZ-CD2 3.45Å; R176-L483 VanDerWaalsContact NH1-CD2 3.26Å; R176-L483 VanDerWaalsContact NH1-CG 3.34Å; L179-L483 HydrophobicContact CB-CD1 3.86Å; L179-L483 HydrophobicContact CD1-CD1 4.15Å; L180-L483 HydrophobicContact CD1-CD2 3.94Å; L180-L483 HydrophobicContact CD2-CD2 3.6Å; L180-L483 HydrophobicContact CG-CD1 4.29Å; L180-L483 HydrophobicContact CG-CD2 3.71Å; I476-L483 HydrophobicContact CD1-CD1 3.98Å; I476-L483 HydrophobicContact CG1-CB 4.44Å; I476-L483 HydrophobicContact CG1-CD1 4.34Å; I476-L483 HydrophobicContact CG2-CB 4.24Å; I476-L483 HydrophobicContact CG2-CD1 4.27Å; I480-L483 PolarHBondContact O-N 3.39Å; G481-L483 VanDerWaalsContact C-N 3.34Å; L483-L486 PolarHBondContact O-N 3.46Å; L483-T487 WeakPolarHBondContact O-CB 3.35Å; L483-T487 PolarHBondContact O-N 2.95Å; L483-T487 PolarHBondContact O-OG1 3.36Å
484	D	92.9	Very high	92.1	Very high	76 Å²	76	51.4 Å²	51.4	41%	0.406	24%	0.243	S	C	.	.	H	α-helix	trans	-63	-48.7	177.8	-62.8	-31.8	0	0	0	110.2	R176 Y482 L486 T487 D488	R176-D484 IonicContact CZ-OD1 3.76Å; R176-D484 IonicContact NH1-OD1 2.73Å; R176-D484 PolarHBondContact NH1-OD1 3.23Å; R176-D484 IonicContact NH2-OD1 3.84Å; Y482-D484 VanDerWaalsContact C-N 3.35Å; Y482-D484 PolarHBondContact O-N 3.49Å; D484-L486 VanDerWaalsContact C-N 3.34Å; D484-L486 PolarHBondContact O-N 3.12Å; D484-T487 WeakPolarHBondContact O-CB 3.34Å; D484-T487 PolarHBondContact O-N 3.43Å; D484-D488 WeakPolarHBondContact O-CB 3.5Å; D484-D488 VanDerWaalsContact O-CG 3.29Å; D484-D488 PolarHBondContact O-N 2.99Å
485	R	94.2	Very high	92.3	Very high	176 Å²	176	58.5 Å²	58.5	66%	0.664	27%	0.269	S	S	*	.	H	α-helix	trans	-58.6	-43	178	-68	177.6	-172.5	-178.3	2.2	112.8	G481 Y482 R489	G481-R485 WeakPolarHBondContact O-CG 3.28Å; G481-R485 PolarHBondContact O-N 2.88Å; Y482-R485 PolarHBondContact O-N 3.29Å; R485-R489 WeakPolarHBondContact O-CB 3.27Å; R485-R489 PolarHBondContact O-N 3.36Å
486	L	93	Very high	92.4	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-69.2	-41.3	178.4	-176.7	60.2	0	0	0	111	F166 L179 Q472 I476 Y482 L483 D484 R489 L490	F166-L486 HydrophobicContact CE1-CD2 4.07Å; F166-L486 HydrophobicContact CE2-CD1 4.37Å; F166-L486 HydrophobicContact CZ-CD1 4.26Å; F166-L486 HydrophobicContact CZ-CD2 4.2Å; L179-L486 HydrophobicContact CD1-CB 4.39Å; L179-L486 HydrophobicContact CD1-CD2 3.97Å; L179-L486 HydrophobicContact CD1-CG 3.97Å; L179-L486 HydrophobicContact CD2-CD2 3.9Å; Q472-L486 VanDerWaalsContact OE1-CD1 3.26Å; I476-L486 HydrophobicContact CD1-CD2 4.01Å; Y482-L486 HydrophobicContact CD1-CB 4.48Å; Y482-L486 HydrophobicContact CE1-CB 4.11Å; Y482-L486 HydrophobicContact CE1-CD2 4.12Å; Y482-L486 WeakPolarHBondContact O-CB 3.47Å; Y482-L486 PolarHBondContact O-N 3.14Å; L483-L486 PolarHBondContact O-N 3.46Å; D484-L486 VanDerWaalsContact C-N 3.34Å; D484-L486 PolarHBondContact O-N 3.12Å; L486-R489 PolarHBondContact O-N 2.98Å; L486-L490 HydrophobicContact CD1-CG 4.48Å; L486-L490 WeakPolarHBondContact O-CG 3.38Å; L486-L490 PolarHBondContact O-N 3.43Å
487	T	93.4	Very high	92.6	Very high	13 Å²	13	57.9 Å²	57.9	8%	0.08	27%	0.266	C	S	.	.	H	α-helix	trans	-59	-49.7	175.5	-56.7	0	0	0	0	110.4	R176 L483 D484 R489 L490 L491	R176-T487 HydrophobicContact CB-CG2 4Å; L483-T487 WeakPolarHBondContact O-CB 3.35Å; L483-T487 PolarHBondContact O-N 2.95Å; L483-T487 PolarHBondContact O-OG1 3.36Å; D484-T487 WeakPolarHBondContact O-CB 3.34Å; D484-T487 PolarHBondContact O-N 3.43Å; T487-R489 VanDerWaalsContact C-N 3.31Å; T487-R489 PolarHBondContact O-N 2.8Å; T487-L490 PolarHBondContact O-N 3.25Å; T487-L491 HydrophobicContact CG2-CD1 3.98Å; T487-L491 HydrophobicContact CG2-CG 4.41Å; T487-L491 WeakPolarHBondContact O-CB 3.45Å; T487-L491 VanDerWaalsContact O-CG 3.32Å; T487-L491 WeakPolarHBondContact O-CG 3.32Å; T487-L491 PolarHBondContact O-N 3.47Å
488	D	94.3	Very high	92.8	Very high	105 Å²	105	61.7 Å²	61.7	56%	0.561	28%	0.284	S	S	*	.	H	α-helix	trans	-60	-42.2	178.3	-71.5	-23.3	0	0	0	111.4	D484 L491 D492	D484-D488 WeakPolarHBondContact O-CB 3.5Å; D484-D488 VanDerWaalsContact O-CG 3.29Å; D484-D488 PolarHBondContact O-N 2.99Å; D488-L491 PolarHBondContact O-N 2.83Å; D488-D492 VanDerWaalsContact O-CB 3.31Å; D488-D492 WeakPolarHBondContact O-CB 3.37Å; D488-D492 PolarHBondContact O-N 3.21Å
489	R	93.6	Very high	93.2	Very high	115 Å²	115	62.7 Å²	62.7	43%	0.434	29%	0.287	S	S	.	.	H	α-helix	trans	-60.7	-46.4	176.2	-174.5	-172.3	-66.2	164.7	-6.2	112.1	R485 L486 T487 D492 Y493	R485-R489 WeakPolarHBondContact O-CB 3.27Å; R485-R489 PolarHBondContact O-N 3.36Å; L486-R489 PolarHBondContact O-N 2.98Å; T487-R489 VanDerWaalsContact C-N 3.31Å; T487-R489 PolarHBondContact O-N 2.8Å; R489-D492 PolarHBondContact O-N 3.04Å; R489-Y493 HydrophobicContact CG-CD2 4.28Å; R489-Y493 HydrophobicContact CG-CE2 3.75Å; R489-Y493 VanDerWaalsContact O-CD2 3.23Å; R489-Y493 WeakPolarHBondContact O-CD2 3.33Å; R489-Y493 PolarHBondContact O-N 3.2Å
490	L	93.7	Very high	93.6	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-64.1	-44.2	177.8	-68.5	-178.8	0	0	0	111.7	V162 Y163 F166 V175 L179 L486 T487 D492 Y493 R494	V162-L490 HydrophobicContact CG1-CD2 3.33Å; Y163-L490 HydrophobicContact CD2-CD2 4.23Å; Y163-L490 HydrophobicContact CE2-CB 4Å; Y163-L490 HydrophobicContact CE2-CD2 4.12Å; Y163-L490 PolarHBondContact OH-O 3.22Å; F166-L490 HydrophobicContact CD2-CD1 4.34Å; F166-L490 HydrophobicContact CD2-CD2 4.17Å; F166-L490 HydrophobicContact CE2-CD2 4.4Å; V175-L490 HydrophobicContact CG1-CB 3.99Å; V175-L490 HydrophobicContact CG1-CD1 3.54Å; V175-L490 HydrophobicContact CG1-CG 4.41Å; L179-L490 HydrophobicContact CD1-CD1 3.99Å; L179-L490 HydrophobicContact CD2-CD1 4.07Å; L179-L490 HydrophobicContact CG-CD1 4.3Å; L486-L490 HydrophobicContact CD1-CG 4.48Å; L486-L490 WeakPolarHBondContact O-CG 3.38Å; L486-L490 PolarHBondContact O-N 3.43Å; T487-L490 PolarHBondContact O-N 3.25Å; L490-D492 VanDerWaalsContact C-N 3.28Å; L490-D492 PolarHBondContact O-N 3.34Å; L490-Y493 PolarHBondContact O-N 2.95Å; L490-R494 PolarHBondContact O-N 3.37Å; L490-R494 VanDerWaalsContact O-N 3.14Å
491	L	94.3	Very high	94.1	Very high	48 Å²	48	57.8 Å²	57.8	25%	0.251	26%	0.263	S	S	.	.	H	α-helix	trans	-64.1	-34.2	176.1	-69.4	176.8	0	0	0	112.2	V175 T487 D488 R494 R495	V175-L491 HydrophobicContact CG2-CD2 4.04Å; T487-L491 HydrophobicContact CG2-CD1 3.98Å; T487-L491 HydrophobicContact CG2-CG 4.41Å; T487-L491 WeakPolarHBondContact O-CB 3.45Å; T487-L491 VanDerWaalsContact O-CG 3.32Å; T487-L491 WeakPolarHBondContact O-CG 3.32Å; T487-L491 PolarHBondContact O-N 3.47Å; D488-L491 PolarHBondContact O-N 2.83Å; L491-R494 PolarHBondContact O-N 3.07Å; L491-R495 WeakPolarHBondContact O-CB 3.48Å; L491-R495 PolarHBondContact O-N 3.27Å
492	D	94.4	Very high	94.4	Very high	58 Å²	58	59.6 Å²	59.6	31%	0.31	27%	0.267	S	S	.	.	H	α-helix	trans	-67.3	-43.4	175.5	-169.4	51.8	0	0	0	111.6	D488 R489 L490 R494 R495 Q496	D488-D492 VanDerWaalsContact O-CB 3.31Å; D488-D492 WeakPolarHBondContact O-CB 3.37Å; D488-D492 PolarHBondContact O-N 3.21Å; R489-D492 PolarHBondContact O-N 3.04Å; L490-D492 VanDerWaalsContact C-N 3.28Å; L490-D492 PolarHBondContact O-N 3.34Å; D492-R494 VanDerWaalsContact C-N 3.27Å; D492-R494 PolarHBondContact O-N 2.93Å; D492-R495 PolarHBondContact O-N 3.09Å; D492-Q496 WeakPolarHBondContact O-CB 3.5Å; D492-Q496 VanDerWaalsContact O-CG 3.28Å; D492-Q496 WeakPolarHBondContact O-CG 3.45Å; D492-Q496 PolarHBondContact O-N 2.77Å; D492-Q496 PolarHBondContact OD2-NE2 2.88Å
493	Y	94.2	Very high	94.6	Very high	48 Å²	48	64.1 Å²	64.1	19%	0.188	28%	0.284	C	S	.	.	H	α-helix	trans	-55.6	-43.5	171.7	-73.9	-57	0	0	0	111.9	L158 V162 R489 L490 Q496 A497	L158-Y493 HydrophobicContact CD2-CD1 3.96Å; L158-Y493 HydrophobicContact CD2-CE1 3.57Å; L158-Y493 HydrophobicContact CG-CD1 4.35Å; L158-Y493 HydrophobicContact CG-CE1 4.15Å; V162-Y493 HydrophobicContact CG1-CD2 4.29Å; V162-Y493 HydrophobicContact CG1-CE2 4.22Å; V162-Y493 HydrophobicContact CG2-CE2 4.27Å; R489-Y493 HydrophobicContact CG-CD2 4.28Å; R489-Y493 HydrophobicContact CG-CE2 3.75Å; R489-Y493 VanDerWaalsContact O-CD2 3.23Å; R489-Y493 WeakPolarHBondContact O-CD2 3.33Å; R489-Y493 PolarHBondContact O-N 3.2Å; L490-Y493 PolarHBondContact O-N 2.95Å; Y493-Q496 PolarHBondContact O-N 3.47Å; Y493-A497 PolarHBondContact O-N 3.5Å; Y493-A497 VanDerWaalsContact O-N 3.09Å
494	R	94.4	Very high	94.8	Very high	63 Å²	63	65.4 Å²	65.4	24%	0.238	29%	0.292	C	S	.	.	H	α-helix	trans	-62.4	-47.9	177.2	-174.1	174.9	71.5	176.6	2.3	111.3	L159 E172 L490 L491 D492 Q496 A497 E498	L159-R494 HydrophobicContact CD1-CB 4.09Å; E172-R494 PolarHBondContact O-NH1 3.35Å; L490-R494 PolarHBondContact O-N 3.37Å; L490-R494 VanDerWaalsContact O-N 3.14Å; L491-R494 PolarHBondContact O-N 3.07Å; D492-R494 VanDerWaalsContact C-N 3.27Å; D492-R494 PolarHBondContact O-N 2.93Å; R494-Q496 VanDerWaalsContact C-N 3.34Å; R494-Q496 PolarHBondContact O-N 2.84Å; R494-A497 PolarHBondContact O-N 2.95Å; R494-E498 WeakPolarHBondContact O-CG 3.23Å; R494-E498 PolarHBondContact O-N 3.39Å
495	R	95.1	Very high	95	Very high	151 Å²	151	64.6 Å²	64.6	57%	0.57	29%	0.292	S	S	*	.	H	α-helix	trans	-59.4	-44.2	177.8	-175.4	-172.2	-64.5	175.5	0.9	111.6	L491 D492 A497 E498 L499	L491-R495 WeakPolarHBondContact O-CB 3.48Å; L491-R495 PolarHBondContact O-N 3.27Å; D492-R495 PolarHBondContact O-N 3.09Å; R495-A497 VanDerWaalsContact C-N 3.31Å; R495-A497 PolarHBondContact O-N 2.9Å; R495-E498 PolarHBondContact O-N 2.92Å; R495-L499 HydrophobicContact CG-CD1 4.15Å; R495-L499 HydrophobicContact CG-CG 4.42Å; R495-L499 WeakPolarHBondContact O-CB 3.18Å; R495-L499 VanDerWaalsContact O-CG 3.32Å; R495-L499 WeakPolarHBondContact O-CG 3.37Å; R495-L499 PolarHBondContact O-N 3.5Å
496	Q	94.9	Very high	95.1	Very high	37 Å²	37	61.5 Å²	61.5	17%	0.173	29%	0.285	C	S	.	.	H	α-helix	trans	-62.5	-38.4	178.8	-72.3	-176	30.8	0	0	112.2	K155 D492 Y493 R494 A500	K155-Q496 HydrophobicContact CD-CB 4.5Å; D492-Q496 WeakPolarHBondContact O-CB 3.5Å; D492-Q496 VanDerWaalsContact O-CG 3.28Å; D492-Q496 WeakPolarHBondContact O-CG 3.45Å; D492-Q496 PolarHBondContact O-N 2.77Å; D492-Q496 PolarHBondContact OD2-NE2 2.88Å; Y493-Q496 PolarHBondContact O-N 3.47Å; R494-Q496 VanDerWaalsContact C-N 3.34Å; R494-Q496 PolarHBondContact O-N 2.84Å; Q496-A500 WeakPolarHBondContact O-CB 3.41Å; Q496-A500 PolarHBondContact O-N 3Å; Q496-A500 VanDerWaalsContact O-N 3.08Å
497	A	95	Very high	95.3	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-67.1	-44.6	174.2	0	0	0	0	0	111.4	K155 L159 Y493 R494 R495 L499 A500 R501	K155-A497 HydrophobicContact CB-CB 4.39Å; L159-A497 HydrophobicContact CD2-CB 4Å; Y493-A497 PolarHBondContact O-N 3.5Å; Y493-A497 VanDerWaalsContact O-N 3.09Å; R494-A497 PolarHBondContact O-N 2.95Å; R495-A497 VanDerWaalsContact C-N 3.31Å; R495-A497 PolarHBondContact O-N 2.9Å; A497-L499 PolarHBondContact O-N 3.43Å; A497-A500 WeakPolarHBondContact O-CB 3.33Å; A497-A500 PolarHBondContact O-N 3.22Å; A497-A500 VanDerWaalsContact O-N 3.16Å; A497-R501 WeakPolarHBondContact O-CG 3.22Å; A497-R501 PolarHBondContact O-N 3.09Å
498	E	95.7	Very high	95.5	Very high	90 Å²	90	64.6 Å²	64.6	42%	0.421	30%	0.3	S	S	.	.	H	α-helix	trans	-60.2	-45.9	175.9	-73	171.6	176.7	0	0	112.3	R494 R495 A500 R501 T502	R494-E498 WeakPolarHBondContact O-CG 3.23Å; R494-E498 PolarHBondContact O-N 3.39Å; R495-E498 PolarHBondContact O-N 2.92Å; E498-A500 VanDerWaalsContact C-N 3.27Å; E498-A500 PolarHBondContact O-N 3.31Å; E498-R501 WeakPolarHBondContact O-CB 3.35Å; E498-R501 PolarHBondContact O-N 3.29Å; E498-R501 VanDerWaalsContact O-N 3.1Å; E498-T502 WeakPolarHBondContact O-CG2 3.49Å; E498-T502 PolarHBondContact O-N 3.24Å
499	L	95.9	Very high	95.6	Very high	79 Å²	79	66.1 Å²	66.1	41%	0.414	30%	0.301	S	S	.	.	H	α-helix	trans	-62	-35	174.9	-70.6	174.4	0	0	0	112.3	R495 A497 T502 R503	R495-L499 HydrophobicContact CG-CD1 4.15Å; R495-L499 HydrophobicContact CG-CG 4.42Å; R495-L499 WeakPolarHBondContact O-CB 3.18Å; R495-L499 VanDerWaalsContact O-CG 3.32Å; R495-L499 WeakPolarHBondContact O-CG 3.37Å; R495-L499 PolarHBondContact O-N 3.5Å; A497-L499 PolarHBondContact O-N 3.43Å; L499-T502 WeakPolarHBondContact CA-OG1 3.19Å; L499-T502 PolarHBondContact O-OG1 2.97Å; L499-R503 VanDerWaalsContact O-CG 3.25Å; L499-R503 WeakPolarHBondContact O-CG 3.36Å; L499-R503 PolarHBondContact O-N 3.26Å
500	A	95.6	Very high	95.8	Very high	3 Å²	3	65 Å²	65	3%	0.025	30%	0.303	C	S	.	.	H	α-helix	trans	-67.5	-40.3	173.4	0	0	0	0	0	111.5	L152 K155 Q496 A497 E498 R503 V504	L152-A500 HydrophobicContact CB-CB 4.24Å; L152-A500 HydrophobicContact CD1-CB 3.94Å; K155-A500 HydrophobicContact CD-CB 3.82Å; Q496-A500 WeakPolarHBondContact O-CB 3.41Å; Q496-A500 PolarHBondContact O-N 3Å; Q496-A500 VanDerWaalsContact O-N 3.08Å; A497-A500 WeakPolarHBondContact O-CB 3.33Å; A497-A500 PolarHBondContact O-N 3.22Å; A497-A500 VanDerWaalsContact O-N 3.16Å; E498-A500 VanDerWaalsContact C-N 3.27Å; E498-A500 PolarHBondContact O-N 3.31Å; A500-R503 PolarHBondContact O-N 3.05Å; A500-V504 WeakPolarHBondContact O-CG2 3.33Å; A500-V504 PolarHBondContact O-N 2.85Å; A500-V504 VanDerWaalsContact O-N 3.08Å
501	R	96.8	Very high	96	Very high	101 Å²	101	65.2 Å²	65.2	38%	0.381	31%	0.305	S	S	.	.	H	α-helix	trans	-61.6	-45.5	175.5	-69.4	178.6	-175	142.1	1.2	111.9	L152 E156 A497 E498 R503 V504 S505	L152-R501 HydrophobicContact CD1-CB 4.32Å; L152-R501 HydrophobicContact CD1-CG 3.35Å; L152-R501 HydrophobicContact CD2-CG 3.97Å; L152-R501 HydrophobicContact CG-CG 4.3Å; E156-R501 IonicContact OE1-CZ 2.75Å; E156-R501 IonicContact OE1-NE 3.82Å; E156-R501 PolarHBondContact OE1-NE 3.39Å; E156-R501 IonicContact OE1-NH2 3.71Å; E156-R501 PolarHBondContact OE1-NH2 3.27Å; A497-R501 WeakPolarHBondContact O-CG 3.22Å; A497-R501 PolarHBondContact O-N 3.09Å; E498-R501 WeakPolarHBondContact O-CB 3.35Å; E498-R501 PolarHBondContact O-N 3.29Å; E498-R501 VanDerWaalsContact O-N 3.1Å; R501-R503 PolarHBondContact O-N 3.28Å; R501-V504 PolarHBondContact O-N 3.39Å; R501-S505 PolarHBondContact O-N 2.98Å
502	T	96.3	Very high	96.1	Very high	69 Å²	69	66.5 Å²	66.5	42%	0.423	31%	0.312	S	S	.	.	H	α-helix	trans	-63.6	-42	-179.8	57.6	0	0	0	0	111.4	E498 L499 V504 S505 Q506	E498-T502 WeakPolarHBondContact O-CG2 3.49Å; E498-T502 PolarHBondContact O-N 3.24Å; L499-T502 WeakPolarHBondContact CA-OG1 3.19Å; L499-T502 PolarHBondContact O-OG1 2.97Å; T502-V504 PolarHBondContact O-N 2.94Å; T502-S505 WeakPolarHBondContact O-CB 3.43Å; T502-S505 PolarHBondContact O-N 2.73Å; T502-Q506 WeakPolarHBondContact O-CB 3.3Å; T502-Q506 VanDerWaalsContact O-CG 3.28Å; T502-Q506 WeakPolarHBondContact O-CG 3.49Å; T502-Q506 PolarHBondContact O-N 3.12Å
503	R	95.6	Very high	96.2	Very high	113 Å²	113	69.8 Å²	69.8	43%	0.426	32%	0.323	S	S	.	.	H	α-helix	trans	-60.1	-45.1	174.9	-71.6	172	-168.6	166.4	3.3	112.5	Q148 L499 A500 R501 S505 Q506 T507	Q148-R503 PolarHBondContact OE1-O 2.96Å; L499-R503 VanDerWaalsContact O-CG 3.25Å; L499-R503 WeakPolarHBondContact O-CG 3.36Å; L499-R503 PolarHBondContact O-N 3.26Å; A500-R503 PolarHBondContact O-N 3.05Å; R501-R503 PolarHBondContact O-N 3.28Å; R503-S505 VanDerWaalsContact C-N 3.33Å; R503-S505 PolarHBondContact O-N 2.8Å; R503-Q506 PolarHBondContact O-N 2.79Å; R503-T507 PolarHBondContact O-N 3.16Å; R503-T507 PolarHBondContact O-OG1 2.92Å; R503-T507 VanDerWaalsContact O-OG1 3.12Å
504	V	97.6	Very high	96.2	Very high	28 Å²	28	67.6 Å²	67.6	17%	0.17	32%	0.315	C	S	.	.	H	α-helix	trans	-59.9	-45.8	175.4	169.8	0	0	0	0	110.4	L145 Q148 L152 A500 R501 T502 T507 Q508	L145-V504 HydrophobicContact CD1-CG1 3.95Å; Q148-V504 HydrophobicContact CB-CG2 3.81Å; L152-V504 HydrophobicContact CB-CG2 4.24Å; L152-V504 HydrophobicContact CD2-CB 4.49Å; L152-V504 HydrophobicContact CD2-CG2 4.14Å; A500-V504 WeakPolarHBondContact O-CG2 3.33Å; A500-V504 PolarHBondContact O-N 2.85Å; A500-V504 VanDerWaalsContact O-N 3.08Å; R501-V504 PolarHBondContact O-N 3.39Å; T502-V504 PolarHBondContact O-N 2.94Å; V504-T507 PolarHBondContact O-N 2.69Å; V504-Q508 WeakPolarHBondContact O-CB 3.44Å; V504-Q508 PolarHBondContact O-N 3.41Å
505	S	97.1	Very high	96.3	Very high	58 Å²	58	66.9 Å²	66.9	41%	0.406	32%	0.316	S	S	.	.	H	α-helix	trans	-62.1	-43.5	177.5	-175.1	0	0	0	0	112.6	R501 T502 R503 Q508 K509	R501-S505 PolarHBondContact O-N 2.98Å; T502-S505 WeakPolarHBondContact O-CB 3.43Å; T502-S505 PolarHBondContact O-N 2.73Å; R503-S505 VanDerWaalsContact C-N 3.33Å; R503-S505 PolarHBondContact O-N 2.8Å; S505-Q508 PolarHBondContact O-N 3.23Å; S505-K509 WeakPolarHBondContact O-CG 3.11Å; S505-K509 PolarHBondContact O-N 3.2Å
506	Q	96.9	Very high	96.4	Very high	111 Å²	111	64.6 Å²	64.6	52%	0.519	31%	0.314	S	S	.	.	H	α-helix	trans	-62.6	-48.2	177.4	-74.8	169.7	-17	0	0	111.5	T502 R503 Q508 K509 L510	T502-Q506 WeakPolarHBondContact O-CB 3.3Å; T502-Q506 VanDerWaalsContact O-CG 3.28Å; T502-Q506 WeakPolarHBondContact O-CG 3.49Å; T502-Q506 PolarHBondContact O-N 3.12Å; R503-Q506 PolarHBondContact O-N 2.79Å; Q506-Q508 VanDerWaalsContact C-N 3.29Å; Q506-Q508 PolarHBondContact O-N 2.85Å; Q506-K509 WeakPolarHBondContact O-CB 3.28Å; Q506-K509 PolarHBondContact O-N 3.47Å; Q506-K509 VanDerWaalsContact O-N 3.17Å; Q506-L510 WeakPolarHBondContact O-CG 3.35Å; Q506-L510 PolarHBondContact O-N 2.91Å
507	T	96.7	Very high	96.4	Very high	8 Å²	8	65.3 Å²	65.3	5%	0.049	32%	0.318	C	S	.	.	H	α-helix	trans	-61.7	-38.6	176.8	-59.1	0	0	0	0	111.4	R144 L145 Q148 R503 V504 L510 I511	R144-T507 HydrophobicContact CG-CG2 4.49Å; L145-T507 HydrophobicContact CB-CG2 3.98Å; L145-T507 HydrophobicContact CD1-CG2 4.16Å; Q148-T507 PolarHBondContact OE1-OG1 2.88Å; R503-T507 PolarHBondContact O-N 3.16Å; R503-T507 PolarHBondContact O-OG1 2.92Å; R503-T507 VanDerWaalsContact O-OG1 3.12Å; V504-T507 PolarHBondContact O-N 2.69Å; T507-L510 PolarHBondContact O-N 2.96Å; T507-I511 HydrophobicContact CG2-CD1 4.28Å; T507-I511 WeakPolarHBondContact O-CG1 3.31Å; T507-I511 PolarHBondContact O-N 2.75Å
508	Q	97.3	Very high	96.3	Very high	71 Å²	71	66.9 Å²	66.9	33%	0.332	33%	0.325	S	S	.	.	H	α-helix	trans	-61.5	-45.4	174.3	-174.8	59.8	46.2	0	0	111.7	L145 V504 S505 Q506 L510 I511 D512	L145-Q508 HydrophobicContact CD1-CB 4.41Å; V504-Q508 WeakPolarHBondContact O-CB 3.44Å; V504-Q508 PolarHBondContact O-N 3.41Å; S505-Q508 PolarHBondContact O-N 3.23Å; Q506-Q508 VanDerWaalsContact C-N 3.29Å; Q506-Q508 PolarHBondContact O-N 2.85Å; Q508-L510 VanDerWaalsContact C-N 3.3Å; Q508-L510 PolarHBondContact O-N 3.38Å; Q508-I511 WeakPolarHBondContact O-CB 3.42Å; Q508-I511 PolarHBondContact O-N 3.12Å; Q508-I511 VanDerWaalsContact O-N 3.12Å; Q508-D512 PolarHBondContact NE2-OD1 3.24Å; Q508-D512 VanDerWaalsContact O-CG 3.25Å; Q508-D512 PolarHBondContact O-N 3.36Å
509	K	97.4	Very high	96.3	Very high	138 Å²	138	68.3 Å²	68.3	60%	0.6	33%	0.332	S	S	*	.	H	α-helix	trans	-59.6	-39.2	175.2	-70.3	173.5	-176.4	-179.9	0	112.3	S505 Q506 D512 K513	S505-K509 WeakPolarHBondContact O-CG 3.11Å; S505-K509 PolarHBondContact O-N 3.2Å; Q506-K509 WeakPolarHBondContact O-CB 3.28Å; Q506-K509 PolarHBondContact O-N 3.47Å; Q506-K509 VanDerWaalsContact O-N 3.17Å; K509-D512 PolarHBondContact O-N 3.14Å; K509-K513 WeakPolarHBondContact O-CB 3.43Å; K509-K513 PolarHBondContact O-N 3.23Å
510	L	97	Very high	96.2	Very high	90 Å²	90	70 Å²	70	47%	0.471	34%	0.338	S	S	.	.	H	α-helix	trans	-64.6	-39.5	175.3	-69.5	175.9	0	0	0	112	L141 Q506 T507 Q508 A514	L141-L510 HydrophobicContact CD1-CB 4.43Å; Q506-L510 WeakPolarHBondContact O-CG 3.35Å; Q506-L510 PolarHBondContact O-N 2.91Å; T507-L510 PolarHBondContact O-N 2.96Å; Q508-L510 VanDerWaalsContact C-N 3.3Å; Q508-L510 PolarHBondContact O-N 3.38Å; L510-A514 WeakPolarHBondContact O-CB 3.21Å; L510-A514 PolarHBondContact O-N 3.3Å
511	I	97.6	Very high	96.1	Very high	6 Å²	6	73.3 Å²	73.3	3%	0.031	35%	0.351	C	S	.	.	H	α-helix	trans	-62.7	-47.3	173.9	-70.8	165	0	0	0	110.4	L138 L141 R142 L145 T507 Q508 K513 A514 L515	L138-I511 HydrophobicContact CD2-CG2 4.13Å; L141-I511 HydrophobicContact CB-CD1 4.23Å; L141-I511 HydrophobicContact CB-CG1 3.65Å; L141-I511 HydrophobicContact CD1-CG1 4.31Å; R142-I511 HydrophobicContact CG-CD1 4.28Å; L145-I511 HydrophobicContact CB-CD1 3.94Å; L145-I511 HydrophobicContact CD2-CD1 3.75Å; L145-I511 HydrophobicContact CG-CD1 4.32Å; T507-I511 HydrophobicContact CG2-CD1 4.28Å; T507-I511 WeakPolarHBondContact O-CG1 3.31Å; T507-I511 PolarHBondContact O-N 2.75Å; Q508-I511 WeakPolarHBondContact O-CB 3.42Å; Q508-I511 PolarHBondContact O-N 3.12Å; Q508-I511 VanDerWaalsContact O-N 3.12Å; I511-K513 VanDerWaalsContact C-N 3.34Å; I511-K513 PolarHBondContact O-N 3.37Å; I511-A514 PolarHBondContact O-N 3.44Å; I511-L515 HydrophobicContact CG2-CD1 3.87Å; I511-L515 HydrophobicContact CG2-CG 4.29Å; I511-L515 WeakPolarHBondContact O-CB 3.41Å; I511-L515 WeakPolarHBondContact O-CG 3.37Å; I511-L515 PolarHBondContact O-N 3.01Å
512	D	96.6	Very high	96	Very high	75 Å²	75	71.7 Å²	71.7	40%	0.401	35%	0.353	S	S	.	.	H	α-helix	trans	-61.6	-43.9	-179.1	-62.8	-23.2	0	0	0	110.9	Q508 K509 L515 L516	Q508-D512 PolarHBondContact NE2-OD1 3.24Å; Q508-D512 VanDerWaalsContact O-CG 3.25Å; Q508-D512 PolarHBondContact O-N 3.36Å; K509-D512 PolarHBondContact O-N 3.14Å; D512-L515 PolarHBondContact O-N 3.35Å; D512-L516 WeakPolarHBondContact O-CG 3.35Å; D512-L516 PolarHBondContact O-N 2.83Å
513	K	96.1	Very high	95.9	Very high	126 Å²	126	72.1 Å²	72.1	55%	0.548	36%	0.355	S	S	.	.	H	α-helix	trans	-59.7	-47.6	173.4	-177.8	179.9	176.8	-179.5	0	112	K509 I511 L515 L516 E517	K509-K513 WeakPolarHBondContact O-CB 3.43Å; K509-K513 PolarHBondContact O-N 3.23Å; I511-K513 VanDerWaalsContact C-N 3.34Å; I511-K513 PolarHBondContact O-N 3.37Å; K513-L515 VanDerWaalsContact C-N 3.29Å; K513-L515 PolarHBondContact O-N 2.81Å; K513-L516 PolarHBondContact O-N 3.02Å; K513-E517 VanDerWaalsContact CE-OE1 3.31Å; K513-E517 WeakPolarHBondContact CE-OE1 3.29Å; K513-E517 WeakPolarHBondContact O-CG 3.5Å; K513-E517 PolarHBondContact O-N 3.19Å
514	A	95.4	Very high	95.8	Very high	3 Å²	3	70.2 Å²	70.2	3%	0.025	35%	0.351	C	S	.	.	H	α-helix	trans	-65.4	-32.6	179.7	0	0	0	0	0	112.5	L138 L141 L510 I511 Q518	L138-A514 HydrophobicContact CD2-CB 3.6Å; L138-A514 HydrophobicContact CG-CB 4.03Å; L141-A514 HydrophobicContact CD1-CB 4.41Å; L510-A514 WeakPolarHBondContact O-CB 3.21Å; L510-A514 PolarHBondContact O-N 3.3Å; I511-A514 PolarHBondContact O-N 3.44Å; A514-Q518 WeakPolarHBondContact O-CB 3.42Å; A514-Q518 PolarHBondContact O-N 3.47Å
515	L	96.6	Very high	95.6	Very high	47 Å²	47	70 Å²	70	25%	0.246	35%	0.349	C	S	.	.	H	α-helix	trans	-66.8	-42.9	173.1	-75.6	171.4	0	0	0	111.9	L138 I511 D512 K513 Q518 Q519	L138-L515 HydrophobicContact CD1-CD2 3.77Å; L138-L515 HydrophobicContact CD1-CG 4.36Å; L138-L515 HydrophobicContact CD2-CD2 4.15Å; L138-L515 HydrophobicContact CD2-CG 3.96Å; I511-L515 HydrophobicContact CG2-CD1 3.87Å; I511-L515 HydrophobicContact CG2-CG 4.29Å; I511-L515 WeakPolarHBondContact O-CB 3.41Å; I511-L515 WeakPolarHBondContact O-CG 3.37Å; I511-L515 PolarHBondContact O-N 3.01Å; D512-L515 PolarHBondContact O-N 3.35Å; K513-L515 VanDerWaalsContact C-N 3.29Å; K513-L515 PolarHBondContact O-N 2.81Å; L515-Q518 PolarHBondContact O-N 3.12Å; L515-Q519 WeakPolarHBondContact O-CG 3.38Å; L515-Q519 PolarHBondContact O-N 3.41Å
516	L	96.1	Very high	95.4	Very high	104 Å²	104	70 Å²	70	55%	0.545	35%	0.352	S	S	.	.	H	α-helix	trans	-61.3	-49	175.5	-70.5	174.2	0	0	0	111.3	D512 K513 Q518 Q519 E520	D512-L516 WeakPolarHBondContact O-CG 3.35Å; D512-L516 PolarHBondContact O-N 2.83Å; K513-L516 PolarHBondContact O-N 3.02Å; L516-Q518 VanDerWaalsContact C-N 3.26Å; L516-Q518 PolarHBondContact O-N 3.5Å; L516-Q519 WeakPolarHBondContact O-CB 3.03Å; L516-Q519 PolarHBondContact O-N 3.18Å; L516-Q519 VanDerWaalsContact O-N 3.1Å; L516-E520 WeakPolarHBondContact O-CG 3.32Å; L516-E520 PolarHBondContact O-N 3.29Å
517	E	94.1	Very high	95.1	Very high	52 Å²	52	70.3 Å²	70.3	24%	0.243	35%	0.354	C	S	.	.	H	α-helix	trans	-57.8	-39.7	176.2	-70.8	174.7	-178.3	0	0	111.9	R134 K513 K521	R134-E517 IonicContact CZ-OE2 3.52Å; R134-E517 IonicContact NE-OE2 3.69Å; R134-E517 IonicContact NH1-OE2 3.06Å; R134-E517 PolarHBondContact NH1-OE2 3.34Å; R134-E517 IonicContact NH2-OE2 2.91Å; K513-E517 VanDerWaalsContact CE-OE1 3.31Å; K513-E517 WeakPolarHBondContact CE-OE1 3.29Å; K513-E517 WeakPolarHBondContact O-CG 3.5Å; K513-E517 PolarHBondContact O-N 3.19Å; E517-K521 WeakPolarHBondContact O-CG 2.99Å; E517-K521 PolarHBondContact O-N 2.89Å; E517-K521 VanDerWaalsContact O-N 3.1Å
518	Q	93.7	Very high	94.9	Very high	32 Å²	32	71.6 Å²	71.6	15%	0.15	36%	0.36	C	S	.	.	H	α-helix	trans	-65.5	-42.2	176.5	-171.9	-169	5.4	0	0	111.7	I131 L138 A514 L515 L516 K521 T522	I131-Q518 HydrophobicContact CG2-CG 4.47Å; L138-Q518 HydrophobicContact CD1-CB 4.49Å; A514-Q518 WeakPolarHBondContact O-CB 3.42Å; A514-Q518 PolarHBondContact O-N 3.47Å; L515-Q518 PolarHBondContact O-N 3.12Å; L516-Q518 VanDerWaalsContact C-N 3.26Å; L516-Q518 PolarHBondContact O-N 3.5Å; Q518-K521 PolarHBondContact O-N 3.31Å; Q518-T522 WeakPolarHBondContact O-CB 3.39Å; Q518-T522 PolarHBondContact O-N 3.2Å; Q518-T522 PolarHBondContact O-OG1 3Å
519	Q	94.8	Very high	94.5	Very high	120 Å²	120	70.8 Å²	70.8	56%	0.561	36%	0.356	S	S	*	.	H	α-helix	trans	-64.6	-42.1	178.1	-75.1	176.7	-2.2	0	0	111.9	L515 L516 K521 T522 T523	L515-Q519 WeakPolarHBondContact O-CG 3.38Å; L515-Q519 PolarHBondContact O-N 3.41Å; L516-Q519 WeakPolarHBondContact O-CB 3.03Å; L516-Q519 PolarHBondContact O-N 3.18Å; L516-Q519 VanDerWaalsContact O-N 3.1Å; Q519-K521 PolarHBondContact O-N 2.95Å; Q519-T522 PolarHBondContact O-N 3.45Å; Q519-T523 PolarHBondContact O-N 3.1Å; Q519-T523 PolarHBondContact O-OG1 3.39Å
520	E	95.4	Very high	94.2	Very high	116 Å²	116	68.3 Å²	68.3	54%	0.542	35%	0.349	S	S	.	.	H	α-helix	trans	-58.8	-48.4	174.5	-72.1	177.5	-179.9	0	0	111.1	L516 T522 T523 Q524	L516-E520 WeakPolarHBondContact O-CG 3.32Å; L516-E520 PolarHBondContact O-N 3.29Å; E520-T522 VanDerWaalsContact C-N 3.33Å; E520-T522 PolarHBondContact O-N 3.44Å; E520-T523 PolarHBondContact O-N 3.3Å; E520-Q524 WeakPolarHBondContact O-CG 3.42Å; E520-Q524 PolarHBondContact O-N 2.93Å
521	K	93.4	Very high	93.9	Very high	72 Å²	72	65.4 Å²	65.4	31%	0.313	34%	0.336	S	S	.	.	H	α-helix	trans	-66.7	-34.7	178.2	-67.3	-70.2	161.5	-164.1	0	112.6	C127 I131 E517 Q518 Q519 T523 Q524 L525	C127-K521 PolarHBondContact SG-O 3.27Å; C127-K521 VanDerWaalsContact SG-O 3.33Å; I131-K521 HydrophobicContact CD1-CB 4.42Å; I131-K521 HydrophobicContact CG1-CB 3.84Å; E517-K521 WeakPolarHBondContact O-CG 2.99Å; E517-K521 PolarHBondContact O-N 2.89Å; E517-K521 VanDerWaalsContact O-N 3.1Å; Q518-K521 PolarHBondContact O-N 3.31Å; Q519-K521 PolarHBondContact O-N 2.95Å; K521-T523 VanDerWaalsContact C-N 3.34Å; K521-Q524 PolarHBondContact O-N 3.46Å; K521-L525 WeakPolarHBondContact O-CB 3.44Å; K521-L525 PolarHBondContact O-N 3.01Å
522	T	94.1	Very high	93.6	Very high	66 Å²	66	65.1 Å²	65.1	41%	0.405	34%	0.335	S	S	.	.	H	α-helix	trans	-66.4	-39.3	175.6	-56.8	0	0	0	0	111.3	Q518 Q519 E520 L525 A526	Q518-T522 WeakPolarHBondContact O-CB 3.39Å; Q518-T522 PolarHBondContact O-N 3.2Å; Q518-T522 PolarHBondContact O-OG1 3Å; Q519-T522 PolarHBondContact O-N 3.45Å; E520-T522 VanDerWaalsContact C-N 3.33Å; E520-T522 PolarHBondContact O-N 3.44Å; T522-L525 WeakPolarHBondContact O-CB 3.13Å; T522-L525 PolarHBondContact O-N 2.91Å; T522-A526 PolarHBondContact O-N 3.31Å
523	T	94.8	Very high	93.3	Very high	79 Å²	79	68.1 Å²	68.1	49%	0.485	35%	0.345	S	S	.	.	H	α-helix	trans	-65.1	-44.7	173.4	-55.5	0	0	0	0	111.1	Q519 E520 K521 L525 A526 Q527	Q519-T523 PolarHBondContact O-N 3.1Å; Q519-T523 PolarHBondContact O-OG1 3.39Å; E520-T523 PolarHBondContact O-N 3.3Å; K521-T523 VanDerWaalsContact C-N 3.34Å; T523-L525 VanDerWaalsContact C-N 3.34Å; T523-L525 PolarHBondContact O-N 3.43Å; T523-A526 WeakPolarHBondContact O-CB 3.31Å; T523-A526 PolarHBondContact O-N 3.3Å; T523-A526 VanDerWaalsContact O-N 3.16Å; T523-Q527 WeakPolarHBondContact O-CG 3.32Å; T523-Q527 PolarHBondContact O-N 3Å
524	Q	93	Very high	93	Very high	73 Å²	73	68 Å²	68	34%	0.341	34%	0.344	S	S	.	.	H	α-helix	trans	-59.1	-44	173.8	-72.2	172.8	14.8	0	0	111.4	E520 K521 A526 Q527 L528	E520-Q524 WeakPolarHBondContact O-CG 3.42Å; E520-Q524 PolarHBondContact O-N 2.93Å; K521-Q524 PolarHBondContact O-N 3.46Å; Q524-A526 VanDerWaalsContact C-N 3.32Å; Q524-A526 PolarHBondContact O-N 3.31Å; Q524-Q527 PolarHBondContact O-N 3Å; Q524-L528 WeakPolarHBondContact O-CB 3.45Å; Q524-L528 VanDerWaalsContact O-CG 3.28Å; Q524-L528 WeakPolarHBondContact O-CG 3.39Å; Q524-L528 PolarHBondContact O-N 2.71Å
525	L	93.2	Very high	92.9	Very high	22 Å²	22	67.9 Å²	67.9	12%	0.115	34%	0.343	C	S	.	.	H	α-helix	trans	-58.5	-44.6	174.9	178.1	62.5	0	0	0	111.4	V124 C127 K128 I131 K521 T522 T523 L528 K529	V124-L525 HydrophobicContact CB-CD1 4.35Å; V124-L525 HydrophobicContact CG1-CD1 3.61Å; V124-L525 HydrophobicContact CG2-CD1 4.35Å; C127-L525 HydrophobicContact CB-CD1 4.3Å; K128-L525 HydrophobicContact CG-CD1 4.05Å; K128-L525 HydrophobicContact CG-CD2 4.1Å; I131-L525 HydrophobicContact CD1-CB 3.95Å; I131-L525 HydrophobicContact CD1-CD2 3.64Å; I131-L525 HydrophobicContact CD1-CG 4.4Å; K521-L525 WeakPolarHBondContact O-CB 3.44Å; K521-L525 PolarHBondContact O-N 3.01Å; T522-L525 WeakPolarHBondContact O-CB 3.13Å; T522-L525 PolarHBondContact O-N 2.91Å; T523-L525 VanDerWaalsContact C-N 3.34Å; T523-L525 PolarHBondContact O-N 3.43Å; L525-L528 PolarHBondContact O-N 2.91Å; L525-K529 HydrophobicContact CD1-CG 4.37Å; L525-K529 VanDerWaalsContact O-CG 3.31Å; L525-K529 WeakPolarHBondContact O-CG 3.2Å; L525-K529 PolarHBondContact O-N 3.2Å
526	A	92.6	Very high	92.6	Very high	58 Å²	58	66 Å²	66	48%	0.479	33%	0.333	S	S	.	.	H	α-helix	trans	-63.1	-41.1	177.6	0	0	0	0	0	112.2	T522 T523 Q524 K529 N530	T522-A526 PolarHBondContact O-N 3.31Å; T523-A526 WeakPolarHBondContact O-CB 3.31Å; T523-A526 PolarHBondContact O-N 3.3Å; T523-A526 VanDerWaalsContact O-N 3.16Å; Q524-A526 VanDerWaalsContact C-N 3.32Å; Q524-A526 PolarHBondContact O-N 3.31Å; A526-K529 PolarHBondContact O-N 3.04Å; A526-N530 WeakPolarHBondContact O-CB 3.25Å; A526-N530 PolarHBondContact O-N 3.36Å
527	Q	92	Very high	92.4	Very high	118 Å²	118	63.9 Å²	63.9	55%	0.551	33%	0.327	S	S	*	.	H	α-helix	trans	-62.7	-48.2	174.4	-71.8	173.3	-16.2	0	0	111.6	T523 Q524 K529 N530 S531	T523-Q527 WeakPolarHBondContact O-CG 3.32Å; T523-Q527 PolarHBondContact O-N 3Å; Q524-Q527 PolarHBondContact O-N 3Å; Q527-K529 VanDerWaalsContact C-N 3.34Å; Q527-K529 PolarHBondContact O-N 2.94Å; Q527-N530 PolarHBondContact O-N 2.67Å; Q527-N530 VanDerWaalsContact O-N 3.12Å; Q527-S531 WeakPolarHBondContact O-CB 3.47Å; Q527-S531 PolarHBondContact O-N 2.98Å; Q527-S531 PolarHBondContact O-OG 3.2Å
528	L	91.1	Very high	92.3	Very high	35 Å²	35	62.6 Å²	62.6	18%	0.183	32%	0.321	C	S	.	.	H	α-helix	trans	-59.9	-42.9	177.9	-69.8	173.1	0	0	0	112	L119 Q123 V124 C127 Q524 L525 N530 S531 C532	L119-L528 HydrophobicContact CD2-CD2 3.61Å; Q123-L528 HydrophobicContact CB-CD1 4.18Å; Q123-L528 HydrophobicContact CB-CD2 4.45Å; Q123-L528 VanDerWaalsContact OE1-CD2 3.25Å; V124-L528 HydrophobicContact CG2-CB 3.9Å; C127-L528 HydrophobicContact CB-CD1 4.27Å; Q524-L528 WeakPolarHBondContact O-CB 3.45Å; Q524-L528 VanDerWaalsContact O-CG 3.28Å; Q524-L528 WeakPolarHBondContact O-CG 3.39Å; Q524-L528 PolarHBondContact O-N 2.71Å; L525-L528 PolarHBondContact O-N 2.91Å; L528-N530 PolarHBondContact O-N 2.96Å; L528-S531 PolarHBondContact O-N 3.44Å; L528-C532 WeakPolarHBondContact O-CB 3.25Å; L528-C532 PolarHBondContact O-N 3.04Å
529	K	90.4	Very high	92.2	Very high	54 Å²	54	61.1 Å²	61.1	24%	0.235	31%	0.314	C	S	.	.	H	α-helix	trans	-62	-42.7	174.1	-72.5	-172.1	-170.9	-163.9	0	112	L525 A526 Q527 C532 K533 L560	L525-K529 HydrophobicContact CD1-CG 4.37Å; L525-K529 VanDerWaalsContact O-CG 3.31Å; L525-K529 WeakPolarHBondContact O-CG 3.2Å; L525-K529 PolarHBondContact O-N 3.2Å; A526-K529 PolarHBondContact O-N 3.04Å; Q527-K529 VanDerWaalsContact C-N 3.34Å; Q527-K529 PolarHBondContact O-N 2.94Å; K529-C532 PolarHBondContact O-N 3.41Å; K529-K533 WeakPolarHBondContact O-CG 3.42Å; K529-K533 PolarHBondContact O-N 2.94Å; K529-L560 HydrophobicContact CD-CB 4.41Å; K529-L560 WeakPolarHBondContact CE-OXT 3.29Å; K529-L560 HydrophobicContact CG-CB 4.25Å; K529-L560 PolarHBondContact NZ-O 3.39Å; K529-L560 VanDerWaalsContact NZ-O 3.14Å; K529-L560 PolarHBondContact NZ-OXT 3.3Å
530	N	91	Very high	92	Very high	86 Å²	86	57.5 Å²	57.5	46%	0.46	30%	0.297	S	S	.	.	H	α-helix	trans	-65.8	-43.8	178.3	-167.9	13.7	0	0	0	111.4	A526 Q527 L528 C532 K533 K534	A526-N530 WeakPolarHBondContact O-CB 3.25Å; A526-N530 PolarHBondContact O-N 3.36Å; Q527-N530 PolarHBondContact O-N 2.67Å; Q527-N530 VanDerWaalsContact O-N 3.12Å; L528-N530 PolarHBondContact O-N 2.96Å; N530-C532 PolarHBondContact O-N 3.39Å; N530-K533 PolarHBondContact O-N 3.29Å; N530-K534 WeakPolarHBondContact O-CG 3.43Å; N530-K534 PolarHBondContact O-N 2.94Å
531	S	90.3	Very high	91.8	Very high	29 Å²	29	56.6 Å²	56.6	20%	0.203	30%	0.296	C	S	.	.	H	α-helix	trans	-57.6	-46.7	173.4	-73.3	0	0	0	0	112	Q527 L528 K533 K534 L535	Q527-S531 WeakPolarHBondContact O-CB 3.47Å; Q527-S531 PolarHBondContact O-N 2.98Å; Q527-S531 PolarHBondContact O-OG 3.2Å; L528-S531 PolarHBondContact O-N 3.44Å; S531-K533 VanDerWaalsContact C-N 3.34Å; S531-K533 PolarHBondContact O-N 3.02Å; S531-K534 PolarHBondContact O-N 3.28Å; S531-L535 WeakPolarHBondContact O-CG 3.42Å; S531-L535 PolarHBondContact O-N 3.03Å
532	C	90.3	Very high	91.7	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.007	29%	0.286	C	S	.	.	H	α-helix	trans	-60.3	-42.8	175.7	-169.4	0	0	0	0	111.8	L119 L528 K529 N530 K534 L535 V536 L560	L119-C532 HydrophobicContact CB-CB 4.42Å; L119-C532 HydrophobicContact CD1-CB 4.43Å; L528-C532 WeakPolarHBondContact O-CB 3.25Å; L528-C532 PolarHBondContact O-N 3.04Å; K529-C532 PolarHBondContact O-N 3.41Å; N530-C532 PolarHBondContact O-N 3.39Å; C532-K534 PolarHBondContact O-N 3.04Å; C532-L535 PolarHBondContact O-N 3.45Å; C532-V536 WeakPolarHBondContact O-CB 3.4Å; C532-V536 VanDerWaalsContact O-CG2 3.28Å; C532-V536 WeakPolarHBondContact O-CG2 3.32Å; C532-V536 PolarHBondContact O-N 3.4Å; C532-L560 HydrophobicContact CB-CD1 3.92Å; C532-L560 VanDerWaalsContact SG-CD1 3.57Å
533	K	90.5	Very high	91.5	Very high	138 Å²	138	51.2 Å²	51.2	60%	0.6	27%	0.267	S	S	*	.	H	α-helix	trans	-61.7	-41.8	176	-74.7	178.4	-179.3	-176.3	0	112.6	K529 N530 S531 V536 S537	K529-K533 WeakPolarHBondContact O-CG 3.42Å; K529-K533 PolarHBondContact O-N 2.94Å; N530-K533 PolarHBondContact O-N 3.29Å; S531-K533 VanDerWaalsContact C-N 3.34Å; S531-K533 PolarHBondContact O-N 3.02Å; K533-V536 PolarHBondContact O-N 2.95Å; K533-S537 PolarHBondContact O-N 2.85Å
534	K	90.8	Very high	91.3	Very high	123 Å²	123	48.8 Å²	48.8	54%	0.535	25%	0.253	S	S	.	.	H	α-helix	trans	-62.6	-44.3	176.6	-72.1	177.1	-178.9	-178.7	0	111.8	N530 S531 C532 F538	N530-K534 WeakPolarHBondContact O-CG 3.43Å; N530-K534 PolarHBondContact O-N 2.94Å; S531-K534 PolarHBondContact O-N 3.28Å; C532-K534 PolarHBondContact O-N 3.04Å; K534-F538 WeakPolarHBondContact O-CB 3.46Å; K534-F538 PolarHBondContact O-N 3.37Å
535	L	91.9	Very high	91.1	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-65.3	-41.4	177.2	-68	-169.7	0	0	0	112.2	P62 L66 V112 I116 L119 S531 C532 F538 L539	P62-L535 HydrophobicContact CB-CD1 4.12Å; P62-L535 HydrophobicContact CB-CD2 4.47Å; P62-L535 HydrophobicContact CB-CG 4.27Å; P62-L535 HydrophobicContact CG-CD2 4.02Å; P62-L535 HydrophobicContact CG-CG 4.16Å; L66-L535 HydrophobicContact CD1-CD2 3.4Å; L66-L535 VanDerWaalsContact CD1-CD2 3.4Å; L66-L535 HydrophobicContact CG-CD2 4.48Å; V112-L535 HydrophobicContact CG1-CB 4.09Å; V112-L535 HydrophobicContact CG1-CD2 4.16Å; I116-L535 HydrophobicContact CD1-CB 3.93Å; I116-L535 HydrophobicContact CG1-CB 3.5Å; I116-L535 VanDerWaalsContact CG1-CB 3.5Å; I116-L535 HydrophobicContact CG1-CD1 3.99Å; I116-L535 HydrophobicContact CG1-CG 4.42Å; L119-L535 HydrophobicContact CD1-CD1 3.77Å; S531-L535 WeakPolarHBondContact O-CG 3.42Å; S531-L535 PolarHBondContact O-N 3.03Å; C532-L535 PolarHBondContact O-N 3.45Å; L535-F538 PolarHBondContact O-N 3.23Å; L535-L539 WeakPolarHBondContact O-CB 3.37Å; L535-L539 PolarHBondContact O-N 3.19Å
536	V	91.5	Very high	90.8	Very high	8 Å²	8	55.3 Å²	55.3	5%	0.048	28%	0.278	C	S	.	.	H	α-helix	trans	-61.5	-49.7	176.4	165.4	0	0	0	0	110.7	I116 C532 K533 F538 L539 E540 I553 F557	I116-V536 HydrophobicContact CD1-CG2 4.05Å; I116-V536 HydrophobicContact CG1-CG2 4.36Å; I116-V536 HydrophobicContact CG2-CG2 4.22Å; C532-V536 WeakPolarHBondContact O-CB 3.4Å; C532-V536 VanDerWaalsContact O-CG2 3.28Å; C532-V536 WeakPolarHBondContact O-CG2 3.32Å; C532-V536 PolarHBondContact O-N 3.4Å; K533-V536 PolarHBondContact O-N 2.95Å; V536-F538 VanDerWaalsContact C-N 3.32Å; V536-F538 PolarHBondContact O-N 2.86Å; V536-L539 PolarHBondContact O-N 2.91Å; V536-E540 HydrophobicContact CG1-CG 4.32Å; V536-E540 WeakPolarHBondContact O-CB 3.44Å; V536-E540 WeakPolarHBondContact O-CG 3.48Å; V536-E540 PolarHBondContact O-N 2.65Å; V536-I553 HydrophobicContact CB-CD1 4.44Å; V536-I553 HydrophobicContact CG1-CB 4.26Å; V536-I553 HydrophobicContact CG1-CD1 4.09Å; V536-I553 HydrophobicContact CG2-CD1 4.38Å; V536-F557 HydrophobicContact CG1-CD2 4.4Å; V536-F557 HydrophobicContact CG1-CE2 4.16Å; V536-F557 HydrophobicContact CG1-CZ 4.42Å; V536-F557 HydrophobicContact CG2-CB 4.49Å; V536-F557 HydrophobicContact CG2-CD2 4.19Å; V536-F557 HydrophobicContact CG2-CG 4.13Å
537	S	91.1	Very high	90.3	Very high	59 Å²	59	55.7 Å²	55.7	41%	0.413	27%	0.267	S	S	.	.	H	α-helix	trans	-58.2	-45.6	176.8	129.8	0	0	0	0	111.3	K533 L539 E540 D541	K533-S537 PolarHBondContact O-N 2.85Å; S537-L539 VanDerWaalsContact C-N 3.34Å; S537-L539 PolarHBondContact O-N 3.1Å; S537-E540 PolarHBondContact O-N 3.22Å; S537-D541 WeakPolarHBondContact O-CB 3.43Å; S537-D541 VanDerWaalsContact O-CG 3.22Å; S537-D541 PolarHBondContact O-N 2.97Å
538	F	92.1	Very high	89.9	Confident	26 Å²	26	56.1 Å²	56.1	11%	0.114	27%	0.274	C	S	.	.	H	α-helix	trans	-59.6	-44.3	178	175	-97.1	0	0	0	112	F65 L66 Y108 V112 K534 L535 V536 D541 E542	F65-F538 HydrophobicContact CD1-CE1 4.33Å; F65-F538 HydrophobicContact CD1-CZ 4.26Å; F65-F538 HydrophobicContact CE1-CE1 4.08Å; F65-F538 HydrophobicContact CE1-CE2 4.42Å; F65-F538 AromaticContact CE1-CZ 3.59Å; F65-F538 HydrophobicContact CE1-CZ 3.59Å; L66-F538 HydrophobicContact CD2-CD1 4.39Å; L66-F538 HydrophobicContact CD2-CD2 4.03Å; L66-F538 HydrophobicContact CD2-CE1 4.34Å; L66-F538 HydrophobicContact CD2-CE2 3.99Å; L66-F538 HydrophobicContact CD2-CG 4.25Å; L66-F538 HydrophobicContact CD2-CZ 4.16Å; Y108-F538 HydrophobicContact CD2-CE1 4.12Å; Y108-F538 HydrophobicContact CD2-CZ 4.21Å; Y108-F538 HydrophobicContact CE2-CE1 4.39Å; Y108-F538 HydrophobicContact CE2-CZ 4.31Å; V112-F538 HydrophobicContact CG1-CD1 4.23Å; V112-F538 HydrophobicContact CG2-CD1 4.16Å; V112-F538 HydrophobicContact CG2-CE1 4.09Å; K534-F538 WeakPolarHBondContact O-CB 3.46Å; K534-F538 PolarHBondContact O-N 3.37Å; L535-F538 PolarHBondContact O-N 3.23Å; V536-F538 VanDerWaalsContact C-N 3.32Å; V536-F538 PolarHBondContact O-N 2.86Å; F538-D541 PolarHBondContact O-N 3.35Å; F538-E542 HydrophobicContact CD2-CG 4.45Å; F538-E542 HydrophobicContact CE1-CG 4.11Å; F538-E542 HydrophobicContact CE2-CG 3.87Å; F538-E542 HydrophobicContact CZ-CG 3.66Å; F538-E542 PolarHBondContact O-N 3.46Å
539	L	91.3	Very high	89.6	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-72	-36.5	-178.8	-164.6	144.8	0	0	0	111.9	I19 V112 I116 L535 V536 S537 L543 I553	I19-L539 HydrophobicContact CG2-CD1 4.14Å; I19-L539 HydrophobicContact CG2-CD2 4.47Å; V112-L539 HydrophobicContact CB-CD1 4.26Å; V112-L539 HydrophobicContact CG1-CB 4.21Å; V112-L539 HydrophobicContact CG1-CD1 3.85Å; I116-L539 HydrophobicContact CD1-CB 4.27Å; I116-L539 HydrophobicContact CD1-CD1 4.07Å; L535-L539 WeakPolarHBondContact O-CB 3.37Å; L535-L539 PolarHBondContact O-N 3.19Å; V536-L539 PolarHBondContact O-N 2.91Å; S537-L539 VanDerWaalsContact C-N 3.34Å; S537-L539 PolarHBondContact O-N 3.1Å; L539-L543 HydrophobicContact CD2-CD1 3.39Å; L539-L543 HydrophobicContact CD2-CG 3.92Å; L539-L543 HydrophobicContact CG-CD1 4.41Å; L539-L543 HydrophobicContact CG-CG 4.48Å; L539-L543 VanDerWaalsContact O-CB 3.27Å; L539-L543 WeakPolarHBondContact O-CB 3.3Å; L539-L543 VanDerWaalsContact O-CG 3.3Å; L539-L543 WeakPolarHBondContact O-CG 3.27Å; L539-L543 PolarHBondContact O-N 3.18Å; L539-I553 HydrophobicContact CB-CD1 4.12Å; L539-I553 HydrophobicContact CD2-CD1 3.48Å; L539-I553 VanDerWaalsContact CD2-CD1 3.48Å; L539-I553 HydrophobicContact CD2-CG1 4.29Å; L539-I553 HydrophobicContact CG-CD1 4.33Å
540	E	91.2	Very high	89.4	Confident	44 Å²	44	61 Å²	61	21%	0.206	29%	0.293	C	S	.	.	H	α-helix	trans	-62.1	-43.8	172.2	-74.5	-179.9	166.5	0	0	111.7	V536 S537 S544 Q552 I553	V536-E540 HydrophobicContact CG1-CG 4.32Å; V536-E540 WeakPolarHBondContact O-CB 3.44Å; V536-E540 WeakPolarHBondContact O-CG 3.48Å; V536-E540 PolarHBondContact O-N 2.65Å; S537-E540 PolarHBondContact O-N 3.22Å; E540-S544 WeakPolarHBondContact O-CB 3.12Å; E540-S544 PolarHBondContact O-N 2.65Å; E540-S544 PolarHBondContact O-OG 2.89Å; E540-Q552 WeakPolarHBondContact OE1-CA 3.44Å; E540-I553 HydrophobicContact CG-CD1 4.11Å; E540-I553 HydrophobicContact CG-CG1 3.8Å; E540-I553 PolarHBondContact OE1-N 2.56Å
541	D	91.8	Very high	89.2	Confident	97 Å²	97	57 Å²	57	52%	0.519	27%	0.271	S	S	.	.	H	α-helix	trans	-65.7	-47.2	179.5	-72.3	-26.7	0	0	0	111.8	S537 F538 S544 R545	S537-D541 WeakPolarHBondContact O-CB 3.43Å; S537-D541 VanDerWaalsContact O-CG 3.22Å; S537-D541 PolarHBondContact O-N 2.97Å; F538-D541 PolarHBondContact O-N 3.35Å; D541-S544 PolarHBondContact O-N 3.24Å; D541-R545 WeakPolarHBondContact O-CB 3.35Å; D541-R545 PolarHBondContact O-N 3.21Å
542	E	90.6	Very high	89	Confident	25 Å²	25	58.9 Å²	58.9	12%	0.117	28%	0.277	C	S	.	.	H	α-helix	trans	-68.7	-41.1	179.5	-71.2	-61.5	156.4	0	0	112.1	Y108 L109 F538 R545 I546	Y108-E542 HydrophobicContact CE2-CB 4.39Å; Y108-E542 HydrophobicContact CE2-CG 4.18Å; L109-E542 HydrophobicContact CD2-CB 3.98Å; F538-E542 HydrophobicContact CD2-CG 4.45Å; F538-E542 HydrophobicContact CE1-CG 4.11Å; F538-E542 HydrophobicContact CE2-CG 3.87Å; F538-E542 HydrophobicContact CZ-CG 3.66Å; F538-E542 PolarHBondContact O-N 3.46Å; E542-R545 VanDerWaalsContact CD-NH1 3.27Å; E542-R545 PolarHBondContact O-N 3.27Å; E542-R545 IonicContact OE1-CZ 3.65Å; E542-R545 IonicContact OE1-NH1 3.49Å; E542-R545 PolarHBondContact OE1-NH1 3.01Å; E542-R545 IonicContact OE1-NH2 3.91Å; E542-R545 IonicContact OE2-CZ 3.86Å; E542-R545 IonicContact OE2-NH1 2.84Å; E542-R545 PolarHBondContact OE2-NH1 2.81Å; E542-I546 VanDerWaalsContact O-CG1 3.3Å; E542-I546 WeakPolarHBondContact O-CG1 3.47Å; E542-I546 PolarHBondContact O-N 2.97Å
543	L	90	Very high	88.8	Confident	1 Å²	1	59 Å²	59	1%	0.005	28%	0.278	C	S	.	.	H	α-helix	trans	-67.6	-36.6	174.5	-72.8	-172.7	0	0	0	112.3	I14 W22 L23 I28 L109 L539 R545 I546 Y547 V551	I14-L543 HydrophobicContact CD1-CD1 3.55Å; W22-L543 HydrophobicContact CH2-CD1 4.44Å; W22-L543 HydrophobicContact CZ3-CD1 3.9Å; W22-L543 HydrophobicContact CZ3-CD2 4.02Å; L23-L543 HydrophobicContact CD2-CD2 3.96Å; I28-L543 HydrophobicContact CD1-CD2 4.34Å; L109-L543 HydrophobicContact CD1-CD2 3.94Å; L539-L543 HydrophobicContact CD2-CD1 3.39Å; L539-L543 HydrophobicContact CD2-CG 3.92Å; L539-L543 HydrophobicContact CG-CD1 4.41Å; L539-L543 HydrophobicContact CG-CG 4.48Å; L539-L543 VanDerWaalsContact O-CB 3.27Å; L539-L543 WeakPolarHBondContact O-CB 3.3Å; L539-L543 VanDerWaalsContact O-CG 3.3Å; L539-L543 WeakPolarHBondContact O-CG 3.27Å; L539-L543 PolarHBondContact O-N 3.18Å; L543-R545 VanDerWaalsContact C-N 3.28Å; L543-R545 PolarHBondContact O-N 3.48Å; L543-I546 HydrophobicContact CD2-CD1 4.44Å; L543-I546 PolarHBondContact O-N 3.34Å; L543-Y547 PolarHBondContact O-N 2.97Å; L543-V551 HydrophobicContact CB-CB 4.09Å; L543-V551 HydrophobicContact CB-CG1 4.09Å; L543-V551 HydrophobicContact CB-CG2 3.92Å; L543-V551 HydrophobicContact CD1-CG1 4.04Å
544	S	89.8	Confident	88.6	Confident	27 Å²	27	54 Å²	54	19%	0.189	26%	0.259	C	S	.	.	H	α-helix	trans	-64.4	-36.8	175.9	-63.1	0	0	0	0	111.7	E540 D541 N548 R549 V551	E540-S544 WeakPolarHBondContact O-CB 3.12Å; E540-S544 PolarHBondContact O-N 2.65Å; E540-S544 PolarHBondContact O-OG 2.89Å; D541-S544 PolarHBondContact O-N 3.24Å; S544-N548 VanDerWaalsContact O-CA 3.3Å; S544-N548 WeakPolarHBondContact O-CA 3.29Å; S544-N548 PolarHBondContact O-N 2.77Å; S544-R549 VanDerWaalsContact CA-O 3.24Å; S544-R549 WeakPolarHBondContact CA-O 3.45Å; S544-R549 PolarHBondContact O-N 2.89Å; S544-V551 PolarHBondContact OG-N 3.02Å
545	R	89.2	Confident	88	Confident	162 Å²	162	49.1 Å²	49.1	61%	0.611	24%	0.243	S	C	*	.	H	α-helix	trans	-66.2	-43.2	173.3	-171.9	-173.7	-68.3	151.9	0.5	112.2	D541 E542 L543 Y547 N548	D541-R545 WeakPolarHBondContact O-CB 3.35Å; D541-R545 PolarHBondContact O-N 3.21Å; E542-R545 VanDerWaalsContact CD-NH1 3.27Å; E542-R545 PolarHBondContact O-N 3.27Å; E542-R545 IonicContact OE1-CZ 3.65Å; E542-R545 IonicContact OE1-NH1 3.49Å; E542-R545 PolarHBondContact OE1-NH1 3.01Å; E542-R545 IonicContact OE1-NH2 3.91Å; E542-R545 IonicContact OE2-CZ 3.86Å; E542-R545 IonicContact OE2-NH1 2.84Å; E542-R545 PolarHBondContact OE2-NH1 2.81Å; L543-R545 VanDerWaalsContact C-N 3.28Å; L543-R545 PolarHBondContact O-N 3.48Å; R545-Y547 VanDerWaalsContact C-N 3.34Å; R545-Y547 PolarHBondContact O-N 3.46Å; R545-N548 PolarHBondContact O-OD1 2.97Å
546	I	86.6	Confident	87.1	Confident	70 Å²	70	53 Å²	53	36%	0.359	26%	0.261	S	S	.	.	H	α-helix	trans	-65.2	-37.9	179.5	-69.6	165.4	0	0	0	111.6	L109 E542 L543	L109-I546 HydrophobicContact CD1-CD1 3.67Å; E542-I546 VanDerWaalsContact O-CG1 3.3Å; E542-I546 WeakPolarHBondContact O-CG1 3.47Å; E542-I546 PolarHBondContact O-N 2.97Å; L543-I546 HydrophobicContact CD2-CD1 4.44Å; L543-I546 PolarHBondContact O-N 3.34Å
547	Y	82.4	Confident	86.1	Confident	67 Å²	67	54.3 Å²	54.3	26%	0.263	27%	0.266	S	S	.	.	H	α-helix	trans	-95.3	-5.9	-177.3	-81.1	-78	0	0	0	115.1	L12 W22 R26 I28 L543 R545 R549	L12-Y547 HydrophobicContact CD1-CG 4.41Å; W22-Y547 AromaticContact CH2-CD2 3.92Å; W22-Y547 HydrophobicContact CH2-CD2 3.92Å; W22-Y547 AromaticContact CH2-CE2 3.27Å; W22-Y547 HydrophobicContact CH2-CE2 3.27Å; W22-Y547 AromaticContact CH2-CZ 3.82Å; W22-Y547 HydrophobicContact CZ2-CE2 4.22Å; W22-Y547 AromaticContact CZ3-CE2 3.88Å; W22-Y547 HydrophobicContact CZ3-CE2 3.88Å; R26-Y547 VanDerWaalsContact CB-OH 3.29Å; R26-Y547 WeakPolarHBondContact CB-OH 3.45Å; R26-Y547 WeakPolarHBondContact CG-OH 3.35Å; I28-Y547 HydrophobicContact CD1-CE2 3.74Å; L543-Y547 PolarHBondContact O-N 2.97Å; R545-Y547 VanDerWaalsContact C-N 3.34Å; R545-Y547 PolarHBondContact O-N 3.46Å; Y547-R549 PolarHBondContact O-N 2.99Å; Y547-R549 VanDerWaalsContact O-N 3.14Å
548	N	83.8	Confident	84.6	Confident	127 Å²	127	55.1 Å²	55.1	68%	0.679	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.9	36.7	-168.6	-67.1	-40.1	0	0	0	112.3	S544 R545	S544-N548 VanDerWaalsContact O-CA 3.3Å; S544-N548 WeakPolarHBondContact O-CA 3.29Å; S544-N548 PolarHBondContact O-N 2.77Å; R545-N548 PolarHBondContact O-OD1 2.97Å
549	R	84.8	Confident	83.2	Confident	77 Å²	77	60 Å²	60	29%	0.291	30%	0.299	S	S	.	.	S	Bend	trans	-151	138.6	-177.7	179.6	171.6	175.9	-175.4	-2.5	108.7	P10 L12 S544 Y547 V551	P10-R549 PolarHBondContact O-NE 3.4Å; P10-R549 PolarHBondContact O-NH2 2.94Å; L12-R549 HydrophobicContact CD1-CB 4.48Å; L12-R549 HydrophobicContact CD1-CG 4.29Å; L12-R549 HydrophobicContact CG-CG 4.41Å; S544-R549 VanDerWaalsContact CA-O 3.24Å; S544-R549 WeakPolarHBondContact CA-O 3.45Å; S544-R549 PolarHBondContact O-N 2.89Å; Y547-R549 PolarHBondContact O-N 2.99Å; Y547-R549 VanDerWaalsContact O-N 3.14Å; R549-V551 PolarHBondContact O-N 3.47Å
550	Q	86.6	Confident	81.6	Confident	113 Å²	113	61.9 Å²	61.9	53%	0.528	31%	0.309	S	S	.	.			trans	-57	125.5	177.8	-170.5	176.3	7.7	0	0	111	P11 L12	P11-Q550 CarbonylContact C-O 3.51Å; P11-Q550 VanDerWaalsContact CA-O 3.26Å; P11-Q550 WeakPolarHBondContact CA-O 3.05Å; P11-Q550 HydrophobicContact CB-CB 4.34Å; P11-Q550 HydrophobicContact CB-CG 4.2Å; L12-Q550 PolarHBondContact N-O 3.29Å
551	V	86.7	Confident	81.2	Confident	2 Å²	2	62.8 Å²	62.8	1%	0.012	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	135	173.4	179	0	0	0	0	108	L12 I14 L543 S544 R549	L12-V551 HydrophobicContact CB-CG2 4.1Å; L12-V551 HydrophobicContact CD1-CG2 4.21Å; L12-V551 WeakPolarHBondContact O-CA 3.23Å; I14-V551 HydrophobicContact CD1-CG1 3.41Å; I14-V551 VanDerWaalsContact CD1-CG1 3.41Å; I14-V551 HydrophobicContact CG1-CG1 3.99Å; L543-V551 HydrophobicContact CB-CB 4.09Å; L543-V551 HydrophobicContact CB-CG1 4.09Å; L543-V551 HydrophobicContact CB-CG2 3.92Å; L543-V551 HydrophobicContact CD1-CG1 4.04Å; S544-V551 PolarHBondContact OG-N 3.02Å; R549-V551 PolarHBondContact O-N 3.47Å
552	Q	86.9	Confident	80.6	Confident	69 Å²	69	61 Å²	61	32%	0.322	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	127.2	175	-77.5	178.7	-9.1	0	0	108.6	P11 L12 L13 I14 E540	P11-Q552 HydrophobicContact CB-CB 4.39Å; P11-Q552 HydrophobicContact CB-CG 4.01Å; L12-Q552 PolarHBondContact O-N 3.26Å; L13-Q552 CarbonylContact C-O 3.24Å; L13-Q552 VanDerWaalsContact CA-O 3.32Å; L13-Q552 WeakPolarHBondContact CA-O 2.99Å; L13-Q552 HydrophobicContact CD2-CB 3.92Å; I14-Q552 PolarHBondContact N-O 2.91Å; E540-Q552 WeakPolarHBondContact OE1-CA 3.44Å
553	I	86.1	Confident	80	Confident	4 Å²	4	63 Å²	63	2%	0.021	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	144.3	171.2	-52.7	176.9	0	0	0	106.2	I14 I19 I116 V536 L539 E540 F557	I14-I553 CarbonylContact O-C 3.52Å; I14-I553 WeakPolarHBondContact O-CA 3.36Å; I19-I553 HydrophobicContact CD1-CD1 4.27Å; I19-I553 HydrophobicContact CD1-CG2 4.22Å; I116-I553 HydrophobicContact CD1-CD1 4.46Å; V536-I553 HydrophobicContact CB-CD1 4.44Å; V536-I553 HydrophobicContact CG1-CB 4.26Å; V536-I553 HydrophobicContact CG1-CD1 4.09Å; V536-I553 HydrophobicContact CG2-CD1 4.38Å; L539-I553 HydrophobicContact CB-CD1 4.12Å; L539-I553 HydrophobicContact CD2-CD1 3.48Å; L539-I553 VanDerWaalsContact CD2-CD1 3.48Å; L539-I553 HydrophobicContact CD2-CG1 4.29Å; L539-I553 HydrophobicContact CG-CD1 4.33Å; E540-I553 HydrophobicContact CG-CD1 4.11Å; E540-I553 HydrophobicContact CG-CG1 3.8Å; E540-I553 PolarHBondContact OE1-N 2.56Å; I553-F557 HydrophobicContact CB-CE1 3.86Å; I553-F557 HydrophobicContact CB-CZ 4.31Å; I553-F557 HydrophobicContact CG2-CD1 3.92Å; I553-F557 HydrophobicContact CG2-CE1 3.64Å; I553-F557 WeakPolarHBondContact O-CE1 3.23Å; I553-F557 WeakPolarHBondContact O-CZ 3.44Å
554	T	84.9	Confident	79.5	Confident	33 Å²	33	66.6 Å²	66.6	20%	0.202	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	164.8	174.1	44.7	0	0	0	0	111.1	L13 I14 Q15 S16 F557	L13-T554 HydrophobicContact CD2-CG2 3.91Å; I14-T554 PolarHBondContact O-N 3.24Å; I14-T554 PolarHBondContact O-OG1 3.4Å; Q15-T554 CarbonylContact C-O 3.28Å; Q15-T554 WeakPolarHBondContact CA-O 3.35Å; Q15-T554 PolarHBondContact NE2-OG1 3.04Å; S16-T554 PolarHBondContact N-O 2.93Å; S16-T554 PolarHBondContact OG-O 2.84Å; S16-T554 VanDerWaalsContact OG-O 3.09Å; T554-F557 VanDerWaalsContact C-CE1 3.48Å
555	G	79.5	Confident	78.8	Confident	20 Å²	20	69.1 Å²	69.1	21%	0.206	34%	0.34	C	S	.	.	S	Bend	trans	111.6	-136	172.4	0	0	0	0	0	114.5	F557 C558	G555-F557 PolarHBondContact O-N 2.69Å; G555-C558 WeakPolarHBondContact O-CA 3.3Å; G555-C558 VanDerWaalsContact O-CB 3.23Å; G555-C558 WeakPolarHBondContact O-CB 3.44Å; G555-C558 PolarHBondContact O-N 2.81Å
556	Q	73.4	Confident	78.1	Confident	82 Å²	82	62.9 Å²	62.9	38%	0.383	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-29.1	-169.3	-71.1	177.4	-20.2	0	0	114.7	S16 C558 D559	S16-Q556 PolarHBondContact OG-N 2.92Å; S16-Q556 VanDerWaalsContact OG-N 3.11Å; Q556-C558 VanDerWaalsContact C-N 3.34Å; Q556-D559 PolarHBondContact O-N 2.85Å
557	F	69.4	Low	77.5	Confident	35 Å²	35	62.4 Å²	62.4	15%	0.154	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-23.8	175.9	85.8	-84.1	0	0	0	112.9	V536 I553 T554 G555 D559 L560	V536-F557 HydrophobicContact CG1-CD2 4.4Å; V536-F557 HydrophobicContact CG1-CE2 4.16Å; V536-F557 HydrophobicContact CG1-CZ 4.42Å; V536-F557 HydrophobicContact CG2-CB 4.49Å; V536-F557 HydrophobicContact CG2-CD2 4.19Å; V536-F557 HydrophobicContact CG2-CG 4.13Å; I553-F557 HydrophobicContact CB-CE1 3.86Å; I553-F557 HydrophobicContact CB-CZ 4.31Å; I553-F557 HydrophobicContact CG2-CD1 3.92Å; I553-F557 HydrophobicContact CG2-CE1 3.64Å; I553-F557 WeakPolarHBondContact O-CE1 3.23Å; I553-F557 WeakPolarHBondContact O-CZ 3.44Å; T554-F557 VanDerWaalsContact C-CE1 3.48Å; G555-F557 PolarHBondContact O-N 2.69Å; F557-D559 VanDerWaalsContact C-N 3.26Å; F557-L560 HydrophobicContact CB-CD1 3.77Å; F557-L560 HydrophobicContact CB-CG 4.47Å; F557-L560 VanDerWaalsContact O-CB 3.22Å; F557-L560 WeakPolarHBondContact O-CB 3.3Å; F557-L560 WeakPolarHBondContact O-CD1 3.26Å; F557-L560 VanDerWaalsContact O-CG 3.31Å; F557-L560 WeakPolarHBondContact O-CG 3.24Å; F557-L560 PolarHBondContact O-N 2.89Å
558	C	59.2	Low	77.1	Confident	77 Å²	77	62.1 Å²	62.1	52%	0.52	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-29.3	175.1	-59.5	0	0	0	0	111.1	G555 Q556 L560	G555-C558 WeakPolarHBondContact O-CA 3.3Å; G555-C558 VanDerWaalsContact O-CB 3.23Å; G555-C558 WeakPolarHBondContact O-CB 3.44Å; G555-C558 PolarHBondContact O-N 2.81Å; Q556-C558 VanDerWaalsContact C-N 3.34Å; C558-L560 PolarHBondContact O-N 3.27Å
559	D	63	Low	76.6	Confident	128 Å²	128	56.7 Å²	56.7	68%	0.684	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	4.8	177.3	-58.3	-31.8	0	0	0	113	K128 Q556 F557	K128-D559 PolarHBondContact NZ-O 3.21Å; K128-D559 VanDerWaalsContact NZ-O 3.12Å; Q556-D559 PolarHBondContact O-N 2.85Å; F557-D559 VanDerWaalsContact C-N 3.26Å
560	L	58.5	Low	75.8	Confident	40 Å²	40	54.8 Å²	54.8	21%	0.209	30%	0.295	C	S	.	.			trans	-69.4	0	-172.7	-76.9	173.2	0	0	0	114.3	V124 K128 K529 C532 F557 C558	V124-L560 HydrophobicContact CB-CD2 3.62Å; V124-L560 HydrophobicContact CG1-CD2 3.26Å; V124-L560 HydrophobicContact CG2-CD2 3.69Å; K128-L560 WeakPolarHBondContact CE-OXT 3.31Å; K128-L560 PolarHBondContact NZ-OXT 3.14Å; K529-L560 HydrophobicContact CD-CB 4.41Å; K529-L560 WeakPolarHBondContact CE-OXT 3.29Å; K529-L560 HydrophobicContact CG-CB 4.25Å; K529-L560 PolarHBondContact NZ-O 3.39Å; K529-L560 VanDerWaalsContact NZ-O 3.14Å; K529-L560 PolarHBondContact NZ-OXT 3.3Å; C532-L560 HydrophobicContact CB-CD1 3.92Å; C532-L560 VanDerWaalsContact SG-CD1 3.57Å; F557-L560 HydrophobicContact CB-CD1 3.77Å; F557-L560 HydrophobicContact CB-CG 4.47Å; F557-L560 VanDerWaalsContact O-CB 3.22Å; F557-L560 WeakPolarHBondContact O-CB 3.3Å; F557-L560 WeakPolarHBondContact O-CD1 3.26Å; F557-L560 VanDerWaalsContact O-CG 3.31Å; F557-L560 WeakPolarHBondContact O-CG 3.24Å; F557-L560 PolarHBondContact O-N 2.89Å; C558-L560 PolarHBondContact O-N 3.27Å

Retrieved 560 of 560 residues in 148.8 ms (Link to these results)

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