A0A3Q0KTC4_SCHMA Loading...

Target of myb1 related (Tom1-related)

AlphaFold DB , UniProt , Accession A0A3Q0KTC4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 670 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	45.8	Very low	72.9	Confident	219 Å²	219	112.5 Å²	112.5	100%	1.079	57%	0.571	S	S	*	*				0	4	0	-69.2	172.5	177.7	0	0	114.7	N3	M1-N3 VanDerWaalsContact C-N 3.34Å; M1-N3 PolarHBondContact O-N 3.16Å; M1-N3 VanDerWaalsContact O-N 3.17Å
2	Q	48.6	Very low	74.7	Confident	174 Å²	174	105 Å²	105	81%	0.813	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-69.5	-14.2	-166.9	-70.5	166.8	-19.3	0	0	117	I4	Q2-I4 VanDerWaalsContact C-N 3.3Å; Q2-I4 PolarHBondContact O-N 2.99Å
3	N	54.4	Low	76.3	Confident	127 Å²	127	104.4 Å²	104.4	68%	0.679	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-76.1	-8.1	-174.4	-74.7	-16.2	0	0	0	115.3	M1 Q6	M1-N3 VanDerWaalsContact C-N 3.34Å; M1-N3 PolarHBondContact O-N 3.16Å; M1-N3 VanDerWaalsContact O-N 3.17Å; N3-Q6 PolarHBondContact OD1-NE2 3.34Å
4	I	57	Low	77.8	Confident	141 Å²	141	97 Å²	97	72%	0.723	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-74.5	-31.2	-174.6	-63.2	175.4	0	0	0	112.4	Q2	Q2-I4 VanDerWaalsContact C-N 3.3Å; Q2-I4 PolarHBondContact O-N 2.99Å
5	F	67.1	Low	79.1	Confident	192 Å²	192	90.5 Å²	90.5	84%	0.842	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-94.4	6	-174.6	-67.9	-77.7	0	0	0	114.7
6	Q	71.6	Confident	80.3	Confident	89 Å²	89	89.1 Å²	89.1	42%	0.416	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-81.3	130	179.7	-63.6	179.5	-2	0	0	110.6	N3	N3-Q6 PolarHBondContact OD1-NE2 3.34Å
7	P	80.3	Confident	81.3	Confident	74 Å²	74	84.4 Å²	84.4	48%	0.481	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-62.2	158.4	178.9	25.4	-33.9	0	0	0	112.2	T12 R53	P7-T12 HydrophobicContact CG-CG2 4.46Å; P7-R53 PolarHBondContact O-NH2 2.86Å
8	H	91.8	Very high	82.2	Confident	103 Å²	103	79.7 Å²	79.7	48%	0.477	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-60.9	137.2	178.7	-168.1	83.4	0	0	0	109.8	F10 S11	H8-F10 PolarHBondContact CD2-N 3.27Å; H8-F10 AromaticContact NE2-CD2 3.89Å; H8-F10 PolarHBondContact O-N 3.39Å; H8-S11 PolarHBondContact N-OG 3.3Å; H8-S11 PolarHBondContact O-N 3.47Å; H8-S11 PolarHBondContact O-OG 3.2Å
9	P	93.9	Very high	83	Confident	23 Å²	23	79.4 Å²	79.4	15%	0.149	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-21.5	-174.6	-28.7	37.1	0	0	0	115.8	G15 R53 K57	P9-G15 WeakPolarHBondContact O-CA 3.24Å; P9-R53 HydrophobicContact CB-CB 4.22Å; P9-K57 HydrophobicContact CB-CB 3.69Å; P9-K57 HydrophobicContact CB-CG 3.99Å; P9-K57 HydrophobicContact CG-CB 3.91Å; P9-K57 HydrophobicContact CG-CD 4.44Å; P9-K57 HydrophobicContact CG-CG 4.09Å
10	F	96.1	Very high	83.7	Confident	17 Å²	17	82 Å²	82	8%	0.075	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	7.9	174	-51.5	-47	0	0	0	114.4	H8 G15 T16 E19 A54 K57 R58	H8-F10 PolarHBondContact CD2-N 3.27Å; H8-F10 AromaticContact NE2-CD2 3.89Å; H8-F10 PolarHBondContact O-N 3.39Å; F10-G15 WeakPolarHBondContact CD1-O 3.5Å; F10-T16 WeakPolarHBondContact O-CG2 3.44Å; F10-E19 HydrophobicContact CB-CB 4.39Å; F10-E19 WeakPolarHBondContact CB-OE2 3.42Å; F10-E19 HydrophobicContact CD1-CB 4.13Å; F10-E19 VanDerWaalsContact CD2-OE2 3.32Å; F10-E19 WeakPolarHBondContact CD2-OE2 3.24Å; F10-E19 HydrophobicContact CG-CB 4.22Å; F10-E19 WeakPolarHBondContact CG-OE2 3.22Å; F10-A54 HydrophobicContact CD1-CB 4.11Å; F10-A54 HydrophobicContact CE1-CB 4.09Å; F10-A54 WeakPolarHBondContact CE1-O 3.45Å; F10-K57 HydrophobicContact CD2-CG 4.22Å; F10-K57 HydrophobicContact CE1-CB 4.37Å; F10-K57 HydrophobicContact CE1-CG 4.23Å; F10-K57 HydrophobicContact CE2-CG 3.55Å; F10-K57 HydrophobicContact CZ-CB 4.03Å; F10-K57 HydrophobicContact CZ-CG 3.55Å; F10-R58 HydrophobicContact CE1-CB 4.39Å; F10-R58 HydrophobicContact CZ-CB 3.95Å
11	S	95	Very high	84.2	Confident	78 Å²	78	78.2 Å²	78.2	55%	0.545	40%	0.397	S	S	.	.	S	Bend	trans	-96.2	3.6	177.4	69.9	0	0	0	0	114.3	H8	H8-S11 PolarHBondContact N-OG 3.3Å; H8-S11 PolarHBondContact O-N 3.47Å; H8-S11 PolarHBondContact O-OG 3.2Å
12	T	95.2	Very high	86.6	Confident	23 Å²	23	67.8 Å²	67.8	14%	0.141	35%	0.346	C	S	.	.	S	Bend	trans	-99.9	166.7	172.6	83.8	0	0	0	0	109.6	P7 G15 T16 E50	P7-T12 HydrophobicContact CG-CG2 4.46Å; T12-G15 CarbonylContact O-C 3.59Å; T12-G15 WeakPolarHBondContact O-CA 3.45Å; T12-G15 PolarHBondContact O-N 3Å; T12-G15 VanDerWaalsContact O-N 3.11Å; T12-G15 PolarHBondContact OG1-N 2.95Å; T12-G15 VanDerWaalsContact OG1-N 3.1Å; T12-T16 PolarHBondContact O-N 3.41Å; T12-E50 VanDerWaalsContact CB-CD 3.43Å; T12-E50 WeakPolarHBondContact CB-OE1 3.5Å; T12-E50 WeakPolarHBondContact CB-OE2 3.4Å; T12-E50 HydrophobicContact CG2-CG 4.45Å; T12-E50 WeakPolarHBondContact CG2-OE1 3.49Å; T12-E50 VanDerWaalsContact OG1-CD 3.24Å; T12-E50 PolarHBondContact OG1-OE2 3.41Å
13	T	95.6	Very high	88.8	Confident	97 Å²	97	62.4 Å²	62.4	60%	0.595	32%	0.323	S	S	*	.	H	α-helix	trans	-57	-55.3	179.3	-50.6	0	0	0	0	110.9	G15 T16 L17	T13-G15 PolarHBondContact O-N 3.14Å; T13-T16 PolarHBondContact O-N 3.11Å; T13-T16 VanDerWaalsContact O-N 3.1Å; T13-T16 PolarHBondContact O-OG1 3.05Å; T13-L17 HydrophobicContact CG2-CD1 4.36Å; T13-L17 WeakPolarHBondContact O-CG 3.43Å; T13-L17 PolarHBondContact O-N 2.95Å
14	I	97.2	Very high	90.6	Very high	1 Å²	1	58.8 Å²	58.8	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-58.1	-35.7	175.9	-70	164.2	0	0	0	111.3	T18 I37 T40 V41 E50 A51	I14-T18 VanDerWaalsContact O-CB 3.23Å; I14-T18 WeakPolarHBondContact O-CB 3.35Å; I14-T18 PolarHBondContact O-N 2.79Å; I14-T18 PolarHBondContact O-OG1 3.45Å; I14-I37 HydrophobicContact CG2-CG2 4.41Å; I14-T40 HydrophobicContact CD1-CG2 3.94Å; I14-T40 HydrophobicContact CG1-CG2 3.53Å; I14-V41 HydrophobicContact CD1-CG2 3.9Å; I14-V41 HydrophobicContact CG1-CG2 4.34Å; I14-V41 HydrophobicContact CG2-CG2 4.13Å; I14-E50 HydrophobicContact CB-CB 4.22Å; I14-E50 HydrophobicContact CD1-CB 4.33Å; I14-E50 HydrophobicContact CG2-CB 4.25Å; I14-A51 HydrophobicContact CG2-CB 3.76Å
15	G	97.4	Very high	92.1	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-59.4	-49.2	173.3	0	0	0	0	0	114	P9 F10 T12 T13 T18 E19	P9-G15 WeakPolarHBondContact O-CA 3.24Å; F10-G15 WeakPolarHBondContact CD1-O 3.5Å; T12-G15 CarbonylContact O-C 3.59Å; T12-G15 WeakPolarHBondContact O-CA 3.45Å; T12-G15 PolarHBondContact O-N 3Å; T12-G15 VanDerWaalsContact O-N 3.11Å; T12-G15 PolarHBondContact OG1-N 2.95Å; T12-G15 VanDerWaalsContact OG1-N 3.1Å; T13-G15 PolarHBondContact O-N 3.14Å; G15-T18 PolarHBondContact O-N 2.73Å; G15-E19 WeakPolarHBondContact O-CB 3.41Å; G15-E19 PolarHBondContact O-N 3.48Å
16	T	97.3	Very high	92.6	Very high	67 Å²	67	49.6 Å²	49.6	41%	0.411	28%	0.28	S	S	.	.	H	α-helix	trans	-71.7	-34	-179.7	59.9	0	0	0	0	112.7	F10 T12 T13 R20	F10-T16 WeakPolarHBondContact O-CG2 3.44Å; T12-T16 PolarHBondContact O-N 3.41Å; T13-T16 PolarHBondContact O-N 3.11Å; T13-T16 VanDerWaalsContact O-N 3.1Å; T13-T16 PolarHBondContact O-OG1 3.05Å; T16-R20 WeakPolarHBondContact O-CG 3.34Å; T16-R20 PolarHBondContact O-N 3.27Å; T16-R20 VanDerWaalsContact O-N 3.15Å
17	L	97.3	Very high	92.7	Very high	9 Å²	9	51.2 Å²	51.2	5%	0.047	30%	0.298	C	S	.	.	H	α-helix	trans	-65.3	-45.2	171	-59.9	178.5	0	0	0	110.8	T13 E19 R20 A21 L33 E36 I37	T13-L17 HydrophobicContact CG2-CD1 4.36Å; T13-L17 WeakPolarHBondContact O-CG 3.43Å; T13-L17 PolarHBondContact O-N 2.95Å; L17-E19 PolarHBondContact O-N 3.44Å; L17-R20 VanDerWaalsContact CD2-NH1 3.32Å; L17-R20 PolarHBondContact O-N 2.74Å; L17-A21 WeakPolarHBondContact O-CB 3.37Å; L17-A21 PolarHBondContact O-N 3.39Å; L17-L33 HydrophobicContact CB-CD1 3.99Å; L17-L33 HydrophobicContact CD2-CD1 3.65Å; L17-L33 HydrophobicContact CG-CD1 4.32Å; L17-E36 HydrophobicContact CD1-CG 4.15Å; L17-E36 VanDerWaalsContact CD2-OE1 3.29Å; L17-E36 WeakPolarHBondContact CD2-OE1 3.23Å; L17-I37 HydrophobicContact CB-CD1 4.04Å; L17-I37 HydrophobicContact CB-CG1 3.55Å; L17-I37 HydrophobicContact CD1-CG1 4.33Å
18	T	98.1	Very high	92.6	Very high	0 Å²	0	51 Å²	51	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-61.5	-41.1	175.3	-60.6	0	0	0	0	112.1	I14 G15 A21 T22 A54 I55 L76	I14-T18 VanDerWaalsContact O-CB 3.23Å; I14-T18 WeakPolarHBondContact O-CB 3.35Å; I14-T18 PolarHBondContact O-N 2.79Å; I14-T18 PolarHBondContact O-OG1 3.45Å; G15-T18 PolarHBondContact O-N 2.73Å; T18-A21 PolarHBondContact O-N 3.18Å; T18-T22 HydrophobicContact CG2-CG2 4.49Å; T18-T22 WeakPolarHBondContact O-CB 3.26Å; T18-T22 WeakPolarHBondContact O-CG2 3.38Å; T18-T22 PolarHBondContact O-N 3.47Å; T18-T22 PolarHBondContact O-OG1 3.07Å; T18-A54 HydrophobicContact CG2-CB 3.66Å; T18-I55 HydrophobicContact CG2-CG1 4.28Å; T18-L76 HydrophobicContact CG2-CD2 3.87Å
19	E	97	Very high	92.2	Very high	75 Å²	75	47.7 Å²	47.7	35%	0.35	28%	0.283	S	S	.	.	H	α-helix	trans	-55.7	-51.7	174.8	174	107.4	-102	0	0	110.4	F10 G15 L17 T22 D23 R58	F10-E19 HydrophobicContact CB-CB 4.39Å; F10-E19 WeakPolarHBondContact CB-OE2 3.42Å; F10-E19 HydrophobicContact CD1-CB 4.13Å; F10-E19 VanDerWaalsContact CD2-OE2 3.32Å; F10-E19 WeakPolarHBondContact CD2-OE2 3.24Å; F10-E19 HydrophobicContact CG-CB 4.22Å; F10-E19 WeakPolarHBondContact CG-OE2 3.22Å; G15-E19 WeakPolarHBondContact O-CB 3.41Å; G15-E19 PolarHBondContact O-N 3.48Å; L17-E19 PolarHBondContact O-N 3.44Å; E19-T22 PolarHBondContact O-N 2.75Å; E19-T22 PolarHBondContact O-OG1 2.94Å; E19-D23 PolarHBondContact O-N 3.13Å; E19-R58 VanDerWaalsContact CA-NH2 3.33Å; E19-R58 PolarHBondContact O-NH2 3.37Å; E19-R58 IonicContact OE1-CZ 3.16Å; E19-R58 IonicContact OE1-NH1 3.76Å; E19-R58 PolarHBondContact OE1-NH1 3.42Å; E19-R58 IonicContact OE1-NH2 2.74Å; E19-R58 PolarHBondContact OE1-NH2 2.99Å
20	R	96.8	Very high	91.7	Very high	130 Å²	130	49.3 Å²	49.3	49%	0.491	29%	0.291	S	S	.	.	H	α-helix	trans	-63.2	-43.2	177.8	-74.3	167.8	55.5	-146.6	-9.7	113.3	T16 L17 T22 D23 L33	T16-R20 WeakPolarHBondContact O-CG 3.34Å; T16-R20 PolarHBondContact O-N 3.27Å; T16-R20 VanDerWaalsContact O-N 3.15Å; L17-R20 VanDerWaalsContact CD2-NH1 3.32Å; L17-R20 PolarHBondContact O-N 2.74Å; R20-T22 PolarHBondContact O-N 3.42Å; R20-D23 PolarHBondContact O-N 3.09Å; R20-L33 HydrophobicContact CB-CD2 3.55Å
21	A	95.7	Very high	91.2	Very high	3 Å²	3	53.9 Å²	53.9	3%	0.025	31%	0.307	C	S	.	.	H	α-helix	trans	-69.1	-12.6	-178.3	0	0	0	0	0	114.2	L17 T18 L33 I34 I37 L76	L17-A21 WeakPolarHBondContact O-CB 3.37Å; L17-A21 PolarHBondContact O-N 3.39Å; T18-A21 PolarHBondContact O-N 3.18Å; A21-L33 HydrophobicContact CB-CD2 3.78Å; A21-L33 HydrophobicContact CB-CG 3.98Å; A21-I34 HydrophobicContact CB-CG1 4.38Å; A21-I37 HydrophobicContact CB-CD1 3.61Å; A21-L76 HydrophobicContact CB-CD2 4.37Å
22	T	96.3	Very high	90.7	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.9	17.2	-175.5	61.4	0	0	0	0	112.6	T18 E19 R20 R58 S69 T73 L76	T18-T22 HydrophobicContact CG2-CG2 4.49Å; T18-T22 WeakPolarHBondContact O-CB 3.26Å; T18-T22 WeakPolarHBondContact O-CG2 3.38Å; T18-T22 PolarHBondContact O-N 3.47Å; T18-T22 PolarHBondContact O-OG1 3.07Å; E19-T22 PolarHBondContact O-N 2.75Å; E19-T22 PolarHBondContact O-OG1 2.94Å; R20-T22 PolarHBondContact O-N 3.42Å; T22-R58 PolarHBondContact OG1-NE 3.35Å; T22-S69 VanDerWaalsContact O-CB 3.3Å; T22-S69 WeakPolarHBondContact O-CB 3.32Å; T22-S69 PolarHBondContact O-OG 2.86Å; T22-T73 WeakPolarHBondContact CB-OG1 3.48Å; T22-T73 HydrophobicContact CG2-CG2 4.31Å; T22-T73 VanDerWaalsContact CG2-OG1 3.31Å; T22-T73 WeakPolarHBondContact CG2-OG1 3.43Å; T22-L76 HydrophobicContact CG2-CD2 4.01Å
23	D	94.6	Very high	90.5	Very high	62 Å²	62	50.6 Å²	50.6	33%	0.332	29%	0.287	S	S	.	.			trans	-72.3	124.8	171.5	170.3	33.7	0	0	0	110.8	E19 R20 G25 Q26 Y72	E19-D23 PolarHBondContact O-N 3.13Å; R20-D23 PolarHBondContact O-N 3.09Å; D23-G25 PolarHBondContact O-N 2.68Å; D23-G25 PolarHBondContact OD1-N 2.84Å; D23-Q26 HydrophobicContact CB-CG 4.2Å; D23-Q26 PolarHBondContact O-N 3.34Å; D23-Q26 PolarHBondContact OD2-NE2 2.79Å; D23-Y72 WeakPolarHBondContact O-CD2 3.32Å; D23-Y72 WeakPolarHBondContact O-CE2 3.07Å
24	S	92.2	Very high	90.3	Very high	50 Å²	50	46 Å²	46	35%	0.35	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-4.6	176.5	51.1	0	0	0	0	113.9	Q26 D66	S24-Q26 VanDerWaalsContact C-N 3.26Å; S24-D66 WeakPolarHBondContact CB-OD1 3.24Å; S24-D66 WeakPolarHBondContact CB-OD2 3.35Å; S24-D66 PolarHBondContact OG-OD2 3.09Å
25	G	87.5	Confident	89.8	Confident	59 Å²	59	47.6 Å²	47.6	61%	0.608	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-14.6	166.4	0	0	0	0	0	114.2	D23	D23-G25 PolarHBondContact O-N 2.68Å; D23-G25 PolarHBondContact OD1-N 2.84Å
26	Q	77.2	Confident	89.6	Confident	81 Å²	81	51.4 Å²	51.4	38%	0.379	29%	0.285	S	S	.	.	S	Bend	trans	-75.7	142.6	176	-56	-51.9	-50.2	0	0	111.4	D23 S24 S28 Y72	D23-Q26 HydrophobicContact CB-CG 4.2Å; D23-Q26 PolarHBondContact O-N 3.34Å; D23-Q26 PolarHBondContact OD2-NE2 2.79Å; S24-Q26 VanDerWaalsContact C-N 3.26Å; Q26-S28 VanDerWaalsContact C-N 3.3Å; Q26-S28 PolarHBondContact O-N 3.22Å; Q26-Y72 HydrophobicContact CB-CE2 4.25Å; Q26-Y72 PolarHBondContact O-OH 3.35Å
27	P	73.3	Confident	89.5	Confident	124 Å²	124	48.2 Å²	48.2	81%	0.805	27%	0.266	S	S	*	.	S	Bend	trans	-76.4	-17.7	-179.6	31.7	-36.4	0	0	0	113.6
28	S	79.2	Confident	89.2	Confident	69 Å²	69	47.9 Å²	47.9	48%	0.483	26%	0.264	S	S	.	.	S	Bend	trans	-163.5	167.1	-179.7	59.5	0	0	0	0	109.3	Q26 D30 Y72	Q26-S28 VanDerWaalsContact C-N 3.3Å; Q26-S28 PolarHBondContact O-N 3.22Å; S28-D30 PolarHBondContact O-N 3.16Å; S28-Y72 WeakPolarHBondContact CA-OH 3.42Å; S28-Y72 PolarHBondContact N-OH 3.4Å
29	E	82.4	Confident	88.8	Confident	34 Å²	34	50 Å²	50	16%	0.159	28%	0.275	C	S	.	.			trans	-52.6	123.3	173.3	-70.8	79.3	175.9	0	0	112.5	W31 I34 W71 Y72 T75	E29-W31 VanDerWaalsContact C-N 3.31Å; E29-W31 HydrophobicContact CB-CD2 4.3Å; E29-W31 PolarHBondContact O-N 3.3Å; E29-I34 HydrophobicContact CB-CD1 4.14Å; E29-W71 VanDerWaalsContact OE1-CD1 3.32Å; E29-W71 PolarHBondContact OE1-NE1 3.41Å; E29-Y72 VanDerWaalsContact CD-CE1 3.41Å; E29-Y72 HydrophobicContact CG-CD1 3.65Å; E29-Y72 HydrophobicContact CG-CE1 3.93Å; E29-Y72 WeakPolarHBondContact OE1-CD1 3.42Å; E29-Y72 WeakPolarHBondContact OE1-CE1 3.39Å; E29-T75 HydrophobicContact CG-CG2 4.19Å
30	D	84.5	Confident	88.6	Confident	57 Å²	57	47.8 Å²	47.8	31%	0.305	27%	0.267	S	S	.	.			trans	-76.5	85.4	169	-173.3	-10.7	0	0	0	110.2	S28 A32 L33 I34	S28-D30 PolarHBondContact O-N 3.16Å; D30-A32 PolarHBondContact O-N 3.01Å; D30-A32 WeakPolarHBondContact OD1-CB 3.05Å; D30-A32 PolarHBondContact OD1-N 3.27Å; D30-L33 HydrophobicContact CB-CB 4.01Å; D30-L33 VanDerWaalsContact CG-CB 3.47Å; D30-L33 PolarHBondContact O-N 2.85Å; D30-L33 PolarHBondContact OD1-N 3.01Å; D30-L33 VanDerWaalsContact OD1-N 3.12Å; D30-L33 WeakPolarHBondContact OD2-CB 3.33Å; D30-I34 VanDerWaalsContact O-CG1 3.27Å; D30-I34 WeakPolarHBondContact O-CG1 3.35Å; D30-I34 PolarHBondContact O-N 3.31Å
31	W	86.5	Confident	88.5	Confident	112 Å²	112	41.6 Å²	41.6	42%	0.424	24%	0.244	S	C	.	.	H	α-helix	trans	-64.3	-14.1	178.4	-74.7	128.8	0	0	0	115.2	E29 I34 T75 R427	E29-W31 VanDerWaalsContact C-N 3.31Å; E29-W31 HydrophobicContact CB-CD2 4.3Å; E29-W31 PolarHBondContact O-N 3.3Å; W31-I34 HydrophobicContact CD2-CD1 4.39Å; W31-I34 HydrophobicContact CE3-CB 4.16Å; W31-I34 HydrophobicContact CE3-CD1 3.63Å; W31-I34 HydrophobicContact CE3-CG1 4.5Å; W31-I34 HydrophobicContact CE3-CG2 3.97Å; W31-I34 HydrophobicContact CZ3-CD1 4.1Å; W31-I34 HydrophobicContact CZ3-CG2 4.12Å; W31-T75 HydrophobicContact CH2-CG2 3.41Å; W31-T75 VanDerWaalsContact CH2-CG2 3.41Å; W31-T75 HydrophobicContact CZ2-CG2 4.13Å; W31-T75 HydrophobicContact CZ3-CG2 3.74Å; W31-R427 PolarHBondContact O-NE 3.21Å; W31-R427 VanDerWaalsContact O-NE 3.14Å; W31-R427 PolarHBondContact O-NH2 2.89Å
32	A	82.7	Confident	88.3	Confident	30 Å²	30	45.3 Å²	45.3	25%	0.248	26%	0.263	C	S	.	.	H	α-helix	trans	-79.4	-51.1	172	0	0	0	0	0	109.9	D30 I34 L35 E36	D30-A32 PolarHBondContact O-N 3.01Å; D30-A32 WeakPolarHBondContact OD1-CB 3.05Å; D30-A32 PolarHBondContact OD1-N 3.27Å; A32-I34 VanDerWaalsContact C-N 3.27Å; A32-I34 PolarHBondContact O-N 2.87Å; A32-L35 PolarHBondContact O-N 3.19Å; A32-E36 PolarHBondContact O-N 3.13Å
33	L	91.2	Very high	88.1	Confident	3 Å²	3	53 Å²	53	2%	0.016	30%	0.299	C	S	.	.	H	α-helix	trans	-61.8	-33.7	176.4	-176.5	61.5	0	0	0	112.6	L17 R20 A21 D30 L35 E36 I37	L17-L33 HydrophobicContact CB-CD1 3.99Å; L17-L33 HydrophobicContact CD2-CD1 3.65Å; L17-L33 HydrophobicContact CG-CD1 4.32Å; R20-L33 HydrophobicContact CB-CD2 3.55Å; A21-L33 HydrophobicContact CB-CD2 3.78Å; A21-L33 HydrophobicContact CB-CG 3.98Å; D30-L33 HydrophobicContact CB-CB 4.01Å; D30-L33 VanDerWaalsContact CG-CB 3.47Å; D30-L33 PolarHBondContact O-N 2.85Å; D30-L33 PolarHBondContact OD1-N 3.01Å; D30-L33 VanDerWaalsContact OD1-N 3.12Å; D30-L33 WeakPolarHBondContact OD2-CB 3.33Å; L33-L35 VanDerWaalsContact C-N 3.31Å; L33-L35 PolarHBondContact O-N 2.7Å; L33-E36 WeakPolarHBondContact CD1-OE2 3.42Å; L33-E36 PolarHBondContact O-N 3.33Å; L33-I37 HydrophobicContact CG-CD1 4.33Å; L33-I37 WeakPolarHBondContact O-CD1 3.47Å; L33-I37 VanDerWaalsContact O-CG1 3.24Å; L33-I37 WeakPolarHBondContact O-CG1 3.22Å; L33-I37 PolarHBondContact O-N 3.31Å
34	I	91.8	Very high	88	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-64.3	-32.2	173.4	-70	165.5	0	0	0	112	A21 E29 D30 W31 A32 C38 L76 T79	A21-I34 HydrophobicContact CB-CG1 4.38Å; E29-I34 HydrophobicContact CB-CD1 4.14Å; D30-I34 VanDerWaalsContact O-CG1 3.27Å; D30-I34 WeakPolarHBondContact O-CG1 3.35Å; D30-I34 PolarHBondContact O-N 3.31Å; W31-I34 HydrophobicContact CD2-CD1 4.39Å; W31-I34 HydrophobicContact CE3-CB 4.16Å; W31-I34 HydrophobicContact CE3-CD1 3.63Å; W31-I34 HydrophobicContact CE3-CG1 4.5Å; W31-I34 HydrophobicContact CE3-CG2 3.97Å; W31-I34 HydrophobicContact CZ3-CD1 4.1Å; W31-I34 HydrophobicContact CZ3-CG2 4.12Å; A32-I34 VanDerWaalsContact C-N 3.27Å; A32-I34 PolarHBondContact O-N 2.87Å; I34-C38 PolarHBondContact O-N 3.06Å; I34-C38 PolarHBondContact O-SG 3.19Å; I34-L76 HydrophobicContact CB-CD1 4.43Å; I34-L76 HydrophobicContact CG1-CD1 4.22Å; I34-L76 HydrophobicContact CG2-CD1 4.05Å; I34-T79 HydrophobicContact CG2-CG2 3.81Å
35	L	87.1	Confident	88	Confident	35 Å²	35	56.3 Å²	56.3	18%	0.183	32%	0.315	C	S	.	.	H	α-helix	trans	-75.2	-45.3	171.8	-68.3	-173.5	0	0	0	111.4	A32 L33 I37 C38 D39 R427	A32-L35 PolarHBondContact O-N 3.19Å; L33-L35 VanDerWaalsContact C-N 3.31Å; L33-L35 PolarHBondContact O-N 2.7Å; L35-I37 PolarHBondContact O-N 3.34Å; L35-I37 VanDerWaalsContact O-N 3.1Å; L35-C38 CarbonylContact O-C 3.53Å; L35-C38 WeakPolarHBondContact O-CA 3.16Å; L35-C38 VanDerWaalsContact O-CB 3.31Å; L35-C38 WeakPolarHBondContact O-CB 3.29Å; L35-C38 PolarHBondContact O-N 3.47Å; L35-D39 VanDerWaalsContact O-CG 3.27Å; L35-D39 PolarHBondContact O-N 3.07Å; L35-R427 HydrophobicContact CD1-CG 3.99Å
36	E	92.9	Very high	88.3	Confident	80 Å²	80	57.5 Å²	57.5	37%	0.374	31%	0.307	S	S	.	.	H	α-helix	trans	-50.5	-38.7	176.2	-171	-173.3	159.8	0	0	111.7	L17 A32 L33 T40	L17-E36 HydrophobicContact CD1-CG 4.15Å; L17-E36 VanDerWaalsContact CD2-OE1 3.29Å; L17-E36 WeakPolarHBondContact CD2-OE1 3.23Å; A32-E36 PolarHBondContact O-N 3.13Å; L33-E36 WeakPolarHBondContact CD1-OE2 3.42Å; L33-E36 PolarHBondContact O-N 3.33Å; E36-T40 WeakPolarHBondContact O-CB 3.46Å; E36-T40 PolarHBondContact O-N 2.59Å; E36-T40 PolarHBondContact O-OG1 2.78Å
37	I	95.4	Very high	89.3	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-69.4	-40	173.5	-61.5	159.6	0	0	0	112.3	I14 L17 A21 L33 L35 V41 L76 L80	I14-I37 HydrophobicContact CG2-CG2 4.41Å; L17-I37 HydrophobicContact CB-CD1 4.04Å; L17-I37 HydrophobicContact CB-CG1 3.55Å; L17-I37 HydrophobicContact CD1-CG1 4.33Å; A21-I37 HydrophobicContact CB-CD1 3.61Å; L33-I37 HydrophobicContact CG-CD1 4.33Å; L33-I37 WeakPolarHBondContact O-CD1 3.47Å; L33-I37 VanDerWaalsContact O-CG1 3.24Å; L33-I37 WeakPolarHBondContact O-CG1 3.22Å; L33-I37 PolarHBondContact O-N 3.31Å; L35-I37 PolarHBondContact O-N 3.34Å; L35-I37 VanDerWaalsContact O-N 3.1Å; I37-V41 HydrophobicContact CG2-CG2 4.21Å; I37-V41 VanDerWaalsContact O-CB 3.23Å; I37-V41 WeakPolarHBondContact O-CB 3.35Å; I37-V41 WeakPolarHBondContact O-CG2 3.29Å; I37-V41 PolarHBondContact O-N 2.94Å; I37-L76 HydrophobicContact CB-CD1 4.25Å; I37-L76 HydrophobicContact CD1-CD1 3.91Å; I37-L76 HydrophobicContact CD1-CD2 4.04Å; I37-L76 HydrophobicContact CG2-CD1 4.14Å; I37-L80 HydrophobicContact CG2-CD1 4.29Å; I37-L80 HydrophobicContact CG2-CD2 4.18Å
38	C	91.3	Very high	90.4	Very high	2 Å²	2	48 Å²	48	1%	0.014	25%	0.252	C	S	.	.	H	α-helix	trans	-62.1	-44.8	175.7	-62.5	0	0	0	0	111.5	I34 L35 V41 N42 L80 N83	I34-C38 PolarHBondContact O-N 3.06Å; I34-C38 PolarHBondContact O-SG 3.19Å; L35-C38 CarbonylContact O-C 3.53Å; L35-C38 WeakPolarHBondContact O-CA 3.16Å; L35-C38 VanDerWaalsContact O-CB 3.31Å; L35-C38 WeakPolarHBondContact O-CB 3.29Å; L35-C38 PolarHBondContact O-N 3.47Å; C38-V41 PolarHBondContact O-N 2.84Å; C38-N42 WeakPolarHBondContact O-CB 3.33Å; C38-N42 VanDerWaalsContact O-CG 3.29Å; C38-N42 PolarHBondContact O-N 3.42Å; C38-N42 PolarHBondContact O-ND2 2.88Å; C38-L80 HydrophobicContact CB-CD2 4.13Å; C38-L80 VanDerWaalsContact SG-CD2 3.57Å; C38-N83 HydrophobicContact CB-CB 4.45Å
39	D	88.9	Confident	91.3	Very high	45 Å²	45	49.6 Å²	49.6	24%	0.241	25%	0.251	C	S	.	.	H	α-helix	trans	-64	-51.9	179.6	-54.7	-31.2	0	0	0	109.7	L35 V41 N42 E43	L35-D39 VanDerWaalsContact O-CG 3.27Å; L35-D39 PolarHBondContact O-N 3.07Å; D39-V41 VanDerWaalsContact C-N 3.26Å; D39-V41 PolarHBondContact O-N 3.29Å; D39-N42 PolarHBondContact O-N 3.28Å; D39-E43 WeakPolarHBondContact O-CG 3.27Å; D39-E43 PolarHBondContact O-N 2.69Å
40	T	93.3	Very high	92	Very high	27 Å²	27	50.5 Å²	50.5	17%	0.166	26%	0.255	C	S	.	.	H	α-helix	trans	-59.2	-34.8	177.4	-47.7	0	0	0	0	112.5	I14 E36 T44	I14-T40 HydrophobicContact CD1-CG2 3.94Å; I14-T40 HydrophobicContact CG1-CG2 3.53Å; E36-T40 WeakPolarHBondContact O-CB 3.46Å; E36-T40 PolarHBondContact O-N 2.59Å; E36-T40 PolarHBondContact O-OG1 2.78Å; T40-T44 HydrophobicContact CG2-CG2 4.38Å; T40-T44 WeakPolarHBondContact O-CB 3.33Å; T40-T44 WeakPolarHBondContact O-CG2 3.4Å; T40-T44 PolarHBondContact O-N 3.26Å; T40-T44 PolarHBondContact O-OG1 2.76Å
41	V	94.6	Very high	92.6	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.006	24%	0.24	C	C	.	.	H	α-helix	trans	-71.5	-29.5	176.3	165.1	0	0	0	0	112.6	I14 I37 C38 D39 P48 A51 L80 C84 F88	I14-V41 HydrophobicContact CD1-CG2 3.9Å; I14-V41 HydrophobicContact CG1-CG2 4.34Å; I14-V41 HydrophobicContact CG2-CG2 4.13Å; I37-V41 HydrophobicContact CG2-CG2 4.21Å; I37-V41 VanDerWaalsContact O-CB 3.23Å; I37-V41 WeakPolarHBondContact O-CB 3.35Å; I37-V41 WeakPolarHBondContact O-CG2 3.29Å; I37-V41 PolarHBondContact O-N 2.94Å; C38-V41 PolarHBondContact O-N 2.84Å; D39-V41 VanDerWaalsContact C-N 3.26Å; D39-V41 PolarHBondContact O-N 3.29Å; V41-P48 HydrophobicContact CG1-CB 4.44Å; V41-P48 HydrophobicContact CG1-CG 4.03Å; V41-P48 WeakPolarHBondContact O-CD 3.29Å; V41-A51 HydrophobicContact CG2-CB 3.58Å; V41-L80 HydrophobicContact CB-CD2 4.26Å; V41-L80 HydrophobicContact CG1-CD2 4.38Å; V41-L80 HydrophobicContact CG2-CD2 4.18Å; V41-C84 HydrophobicContact CG1-CB 3.97Å; V41-F88 HydrophobicContact CG1-CD2 4.3Å
42	N	90.9	Very high	93.2	Very high	80 Å²	80	43 Å²	43	43%	0.428	22%	0.223	S	C	.	.	H	α-helix	trans	-82.6	-34.9	177.4	-74.2	-16.5	0	0	0	112.3	C38 D39 N83 C84	C38-N42 WeakPolarHBondContact O-CB 3.33Å; C38-N42 VanDerWaalsContact O-CG 3.29Å; C38-N42 PolarHBondContact O-N 3.42Å; C38-N42 PolarHBondContact O-ND2 2.88Å; D39-N42 PolarHBondContact O-N 3.28Å; N42-N83 PolarHBondContact ND2-O 3.21Å; N42-N83 VanDerWaalsContact ND2-O 3.07Å; N42-C84 VanDerWaalsContact OD1-CA 3.23Å; N42-C84 WeakPolarHBondContact OD1-CA 3.2Å; N42-C84 VanDerWaalsContact OD1-CB 3.28Å; N42-C84 WeakPolarHBondContact OD1-CB 3.48Å; N42-C84 PolarHBondContact OD1-SG 3.42Å
43	E	92.5	Very high	93.9	Very high	161 Å²	161	45.1 Å²	45.1	75%	0.752	23%	0.225	S	C	*	.	H	α-helix	trans	-75.9	-27.1	179.4	-70.6	-178.8	167.3	0	0	114.2	D39	D39-E43 WeakPolarHBondContact O-CG 3.27Å; D39-E43 PolarHBondContact O-N 2.69Å
44	T	92	Very high	94.3	Very high	55 Å²	55	45 Å²	45	34%	0.337	22%	0.224	S	C	.	.			trans	-109	134.3	-171.7	62.3	0	0	0	0	113.4	T40 D46 G47	T40-T44 HydrophobicContact CG2-CG2 4.38Å; T40-T44 WeakPolarHBondContact O-CB 3.33Å; T40-T44 WeakPolarHBondContact O-CG2 3.4Å; T40-T44 PolarHBondContact O-N 3.26Å; T40-T44 PolarHBondContact O-OG1 2.76Å; T44-D46 PolarHBondContact O-N 2.99Å; T44-G47 PolarHBondContact O-N 3.38Å; T44-G47 WeakPolarHBondContact OG1-CA 3.45Å; T44-G47 PolarHBondContact OG1-N 2.9Å
45	D	91.9	Very high	94.6	Very high	127 Å²	127	45 Å²	45	68%	0.679	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-38.6	-170.9	-93.9	-38.1	0	0	0	114.4	G47 R87	D45-G47 VanDerWaalsContact C-N 3.32Å; D45-R87 VanDerWaalsContact CA-NH2 3.31Å; D45-R87 PolarHBondContact O-NH2 3.39Å; D45-R87 IonicContact OD1-CZ 3.66Å; D45-R87 IonicContact OD1-NH1 3.58Å; D45-R87 PolarHBondContact OD1-NH1 3.21Å; D45-R87 IonicContact OD1-NH2 2.73Å; D45-R87 PolarHBondContact OD1-NH2 2.93Å
46	D	95.4	Very high	95.1	Very high	84 Å²	84	46.7 Å²	46.7	45%	0.449	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-7.8	171.9	-101.6	-53.6	0	0	0	112.9	T44 K49 E50	T44-D46 PolarHBondContact O-N 2.99Å; D46-K49 CarbonylContact O-C 3.45Å; D46-K49 WeakPolarHBondContact O-CA 3.44Å; D46-K49 WeakPolarHBondContact O-CB 3.37Å; D46-K49 PolarHBondContact O-N 3.12Å; D46-K49 VanDerWaalsContact OD1-CD 3.25Å; D46-K49 WeakPolarHBondContact OD1-CD 3.43Å; D46-K49 VanDerWaalsContact OD1-CE 3.23Å; D46-K49 WeakPolarHBondContact OD1-CE 3.37Å; D46-K49 IonicContact OD1-NZ 2.72Å; D46-K49 PolarHBondContact OD1-NZ 2.85Å; D46-K49 IonicContact OD2-NZ 2.64Å; D46-E50 PolarHBondContact O-N 2.78Å
47	G	96.5	Very high	95.4	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-51.5	-47.7	-171.7	0	0	0	0	0	115.3	T44 D45 K49 E50 A51	T44-G47 PolarHBondContact O-N 3.38Å; T44-G47 WeakPolarHBondContact OG1-CA 3.45Å; T44-G47 PolarHBondContact OG1-N 2.9Å; D45-G47 VanDerWaalsContact C-N 3.32Å; G47-K49 PolarHBondContact O-N 3.39Å; G47-E50 PolarHBondContact O-N 3.18Å; G47-A51 WeakPolarHBondContact O-CB 3.3Å; G47-A51 PolarHBondContact O-N 3.29Å
48	P	97.3	Very high	95.5	Very high	5 Å²	5	47.6 Å²	47.6	3%	0.032	23%	0.232	C	C	.	.	H	α-helix	trans	-59.5	-34.6	176	-27.5	37	0	0	0	113.6	V41 I52 R87 F88 Q91	V41-P48 HydrophobicContact CG1-CB 4.44Å; V41-P48 HydrophobicContact CG1-CG 4.03Å; V41-P48 WeakPolarHBondContact O-CD 3.29Å; P48-I52 WeakPolarHBondContact O-CB 3.45Å; P48-I52 PolarHBondContact O-N 3.09Å; P48-I52 VanDerWaalsContact O-N 3.14Å; P48-R87 HydrophobicContact CB-CB 4.49Å; P48-R87 HydrophobicContact CG-CB 3.92Å; P48-F88 HydrophobicContact CB-CB 4.41Å; P48-F88 HydrophobicContact CB-CD2 4.04Å; P48-Q91 HydrophobicContact CB-CG 3.99Å
49	K	97.3	Very high	95.8	Very high	104 Å²	104	47.6 Å²	47.6	45%	0.452	23%	0.232	S	C	.	.	H	α-helix	trans	-80.2	-28.4	179.7	166.9	179	144.5	-144.4	0	111.7	D46 G47 R53	D46-K49 CarbonylContact O-C 3.45Å; D46-K49 WeakPolarHBondContact O-CA 3.44Å; D46-K49 WeakPolarHBondContact O-CB 3.37Å; D46-K49 PolarHBondContact O-N 3.12Å; D46-K49 VanDerWaalsContact OD1-CD 3.25Å; D46-K49 WeakPolarHBondContact OD1-CD 3.43Å; D46-K49 VanDerWaalsContact OD1-CE 3.23Å; D46-K49 WeakPolarHBondContact OD1-CE 3.37Å; D46-K49 IonicContact OD1-NZ 2.72Å; D46-K49 PolarHBondContact OD1-NZ 2.85Å; D46-K49 IonicContact OD2-NZ 2.64Å; G47-K49 PolarHBondContact O-N 3.39Å; K49-R53 WeakPolarHBondContact O-CD 3.32Å; K49-R53 WeakPolarHBondContact O-CG 3.48Å
50	E	97.4	Very high	96.2	Very high	53 Å²	53	49.2 Å²	49.2	25%	0.248	24%	0.243	C	C	.	.	H	α-helix	trans	-72	-50.4	168.5	-63.3	-158.4	157.2	0	0	111.9	T12 I14 D46 G47 I52 R53 A54	T12-E50 VanDerWaalsContact CB-CD 3.43Å; T12-E50 WeakPolarHBondContact CB-OE1 3.5Å; T12-E50 WeakPolarHBondContact CB-OE2 3.4Å; T12-E50 HydrophobicContact CG2-CG 4.45Å; T12-E50 WeakPolarHBondContact CG2-OE1 3.49Å; T12-E50 VanDerWaalsContact OG1-CD 3.24Å; T12-E50 PolarHBondContact OG1-OE2 3.41Å; I14-E50 HydrophobicContact CB-CB 4.22Å; I14-E50 HydrophobicContact CD1-CB 4.33Å; I14-E50 HydrophobicContact CG2-CB 4.25Å; D46-E50 PolarHBondContact O-N 2.78Å; G47-E50 PolarHBondContact O-N 3.18Å; E50-I52 PolarHBondContact O-N 3.02Å; E50-R53 WeakPolarHBondContact O-CB 3.26Å; E50-R53 PolarHBondContact O-N 3.13Å; E50-R53 VanDerWaalsContact O-N 3.08Å; E50-A54 PolarHBondContact O-N 2.85Å
51	A	98.4	Very high	96.3	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-56.6	-48.7	179.8	0	0	0	0	0	111.9	I14 V41 G47 R53 A54 I55 L80 F88	I14-A51 HydrophobicContact CG2-CB 3.76Å; V41-A51 HydrophobicContact CG2-CB 3.58Å; G47-A51 WeakPolarHBondContact O-CB 3.3Å; G47-A51 PolarHBondContact O-N 3.29Å; A51-R53 PolarHBondContact O-N 2.82Å; A51-A54 PolarHBondContact O-N 3.2Å; A51-I55 WeakPolarHBondContact O-CB 3.35Å; A51-I55 WeakPolarHBondContact O-CD1 3.49Å; A51-I55 WeakPolarHBondContact O-CG1 3.42Å; A51-I55 PolarHBondContact O-N 3.35Å; A51-L80 HydrophobicContact CB-CD1 4.43Å; A51-F88 HydrophobicContact CB-CE2 3.88Å
52	I	98.4	Very high	96.4	Very high	12 Å²	12	50.7 Å²	50.7	6%	0.062	25%	0.252	C	S	.	.	H	α-helix	trans	-62.3	-32	179.6	-154.5	69.7	0	0	0	112.3	P48 E50 K56 L77 F88 Q91 V92 F97	P48-I52 WeakPolarHBondContact O-CB 3.45Å; P48-I52 PolarHBondContact O-N 3.09Å; P48-I52 VanDerWaalsContact O-N 3.14Å; E50-I52 PolarHBondContact O-N 3.02Å; I52-K56 WeakPolarHBondContact O-CB 3.49Å; I52-K56 PolarHBondContact O-N 3.31Å; I52-L77 HydrophobicContact CD1-CD1 4.46Å; I52-F88 HydrophobicContact CD1-CE2 4.36Å; I52-F88 HydrophobicContact CD1-CZ 4.14Å; I52-Q91 HydrophobicContact CB-CB 3.9Å; I52-Q91 HydrophobicContact CD1-CB 4.35Å; I52-Q91 HydrophobicContact CG1-CB 3.96Å; I52-Q91 HydrophobicContact CG2-CB 3.96Å; I52-Q91 HydrophobicContact CG2-CG 4.41Å; I52-V92 HydrophobicContact CD1-CG2 3.76Å; I52-F97 HydrophobicContact CD1-CD1 4.2Å; I52-F97 HydrophobicContact CD1-CD2 3.58Å; I52-F97 HydrophobicContact CD1-CE1 4.1Å; I52-F97 HydrophobicContact CD1-CE2 3.46Å; I52-F97 VanDerWaalsContact CD1-CE2 3.46Å; I52-F97 HydrophobicContact CD1-CG 3.96Å; I52-F97 HydrophobicContact CD1-CZ 3.73Å; I52-F97 HydrophobicContact CG1-CD2 3.5Å; I52-F97 HydrophobicContact CG1-CE2 3.82Å; I52-F97 HydrophobicContact CG1-CG 4.01Å
53	R	97.8	Very high	96.7	Very high	74 Å²	74	47.7 Å²	47.7	28%	0.279	24%	0.239	S	C	.	.	H	α-helix	trans	-70.2	-44.9	175.3	-73.8	168.6	63.2	80.6	-3	111.3	P7 P9 K49 E50 A51 K57	P7-R53 PolarHBondContact O-NH2 2.86Å; P9-R53 HydrophobicContact CB-CB 4.22Å; K49-R53 WeakPolarHBondContact O-CD 3.32Å; K49-R53 WeakPolarHBondContact O-CG 3.48Å; E50-R53 WeakPolarHBondContact O-CB 3.26Å; E50-R53 PolarHBondContact O-N 3.13Å; E50-R53 VanDerWaalsContact O-N 3.08Å; A51-R53 PolarHBondContact O-N 2.82Å; R53-K57 WeakPolarHBondContact O-CB 3.31Å; R53-K57 PolarHBondContact O-N 2.86Å
54	A	98.3	Very high	96.7	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64.2	-47	178.5	0	0	0	0	0	111.3	F10 T18 E50 A51 K57 R58	F10-A54 HydrophobicContact CD1-CB 4.11Å; F10-A54 HydrophobicContact CE1-CB 4.09Å; F10-A54 WeakPolarHBondContact CE1-O 3.45Å; T18-A54 HydrophobicContact CG2-CB 3.66Å; E50-A54 PolarHBondContact O-N 2.85Å; A51-A54 PolarHBondContact O-N 3.2Å; A54-K57 WeakPolarHBondContact O-CB 3.42Å; A54-K57 PolarHBondContact O-N 3.23Å; A54-R58 PolarHBondContact O-N 2.8Å
55	I	98.7	Very high	96.9	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-59.5	-53.1	174.8	-66.5	166.3	0	0	0	110.4	T18 A51 K57 R58 L59 T73 L76 L77 L80 F88 F97	T18-I55 HydrophobicContact CG2-CG1 4.28Å; A51-I55 WeakPolarHBondContact O-CB 3.35Å; A51-I55 WeakPolarHBondContact O-CD1 3.49Å; A51-I55 WeakPolarHBondContact O-CG1 3.42Å; A51-I55 PolarHBondContact O-N 3.35Å; I55-K57 VanDerWaalsContact C-N 3.27Å; I55-K57 PolarHBondContact O-N 2.88Å; I55-R58 PolarHBondContact O-N 2.98Å; I55-R58 VanDerWaalsContact O-N 3.14Å; I55-L59 HydrophobicContact CG2-CD1 3.97Å; I55-L59 HydrophobicContact CG2-CG 4.33Å; I55-L59 WeakPolarHBondContact O-CB 3.34Å; I55-L59 WeakPolarHBondContact O-CG 3.38Å; I55-L59 PolarHBondContact O-N 3.36Å; I55-T73 HydrophobicContact CB-CG2 4.36Å; I55-T73 HydrophobicContact CG2-CG2 3.79Å; I55-L76 HydrophobicContact CG1-CD2 4.48Å; I55-L77 HydrophobicContact CD1-CD1 4.3Å; I55-L77 HydrophobicContact CG2-CB 4.24Å; I55-L77 HydrophobicContact CG2-CD1 4.3Å; I55-L77 HydrophobicContact CG2-CD2 4.43Å; I55-L80 HydrophobicContact CD1-CD1 3.61Å; I55-F88 HydrophobicContact CD1-CZ 4.01Å; I55-F97 HydrophobicContact CG2-CE2 4.19Å; I55-F97 HydrophobicContact CG2-CZ 4.23Å
56	K	98.4	Very high	97	Very high	70 Å²	70	43.1 Å²	43.1	30%	0.304	22%	0.219	S	C	.	.	H	α-helix	trans	-57.9	-40.3	177.5	178.9	169.7	169.2	170.5	0	112	I52 V60 E96 F97 A100	I52-K56 WeakPolarHBondContact O-CB 3.49Å; I52-K56 PolarHBondContact O-N 3.31Å; K56-V60 HydrophobicContact CG-CG2 4.49Å; K56-V60 WeakPolarHBondContact O-CB 3.47Å; K56-V60 VanDerWaalsContact O-CG2 3.27Å; K56-V60 WeakPolarHBondContact O-CG2 3.43Å; K56-V60 PolarHBondContact O-N 3.36Å; K56-V60 VanDerWaalsContact O-N 3.1Å; K56-E96 VanDerWaalsContact NZ-C 3.35Å; K56-E96 PolarHBondContact NZ-O 2.99Å; K56-F97 HydrophobicContact CB-CD2 3.95Å; K56-F97 HydrophobicContact CB-CE2 4.01Å; K56-F97 HydrophobicContact CD-CD2 4.28Å; K56-F97 HydrophobicContact CG-CD2 4.43Å; K56-A100 HydrophobicContact CD-CB 4.17Å; K56-A100 HydrophobicContact CG-CB 4.1Å
57	K	97.8	Very high	97	Very high	71 Å²	71	40.9 Å²	40.9	31%	0.309	21%	0.207	S	C	.	.	H	α-helix	trans	-60.6	-50.2	175.5	174.8	61.8	178.1	172.1	0	110.5	P9 F10 R53 A54 I55 V60 T61	P9-K57 HydrophobicContact CB-CB 3.69Å; P9-K57 HydrophobicContact CB-CG 3.99Å; P9-K57 HydrophobicContact CG-CB 3.91Å; P9-K57 HydrophobicContact CG-CD 4.44Å; P9-K57 HydrophobicContact CG-CG 4.09Å; F10-K57 HydrophobicContact CD2-CG 4.22Å; F10-K57 HydrophobicContact CE1-CB 4.37Å; F10-K57 HydrophobicContact CE1-CG 4.23Å; F10-K57 HydrophobicContact CE2-CG 3.55Å; F10-K57 HydrophobicContact CZ-CB 4.03Å; F10-K57 HydrophobicContact CZ-CG 3.55Å; R53-K57 WeakPolarHBondContact O-CB 3.31Å; R53-K57 PolarHBondContact O-N 2.86Å; A54-K57 WeakPolarHBondContact O-CB 3.42Å; A54-K57 PolarHBondContact O-N 3.23Å; I55-K57 VanDerWaalsContact C-N 3.27Å; I55-K57 PolarHBondContact O-N 2.88Å; K57-V60 PolarHBondContact O-N 3.11Å; K57-T61 HydrophobicContact CD-CG2 4.02Å; K57-T61 WeakPolarHBondContact O-CG2 3.18Å; K57-T61 PolarHBondContact O-N 2.82Å; K57-T61 PolarHBondContact O-OG1 3.37Å
58	R	98	Very high	96.8	Very high	29 Å²	29	42.7 Å²	42.7	11%	0.109	22%	0.218	C	C	.	.	H	α-helix	trans	-62.9	-50.6	-179.2	-174	64.2	97	-146.8	6.4	112.1	F10 E19 T22 A54 I55 V60 T61 S62 S69 T73	F10-R58 HydrophobicContact CE1-CB 4.39Å; F10-R58 HydrophobicContact CZ-CB 3.95Å; E19-R58 VanDerWaalsContact CA-NH2 3.33Å; E19-R58 PolarHBondContact O-NH2 3.37Å; E19-R58 IonicContact OE1-CZ 3.16Å; E19-R58 IonicContact OE1-NH1 3.76Å; E19-R58 PolarHBondContact OE1-NH1 3.42Å; E19-R58 IonicContact OE1-NH2 2.74Å; E19-R58 PolarHBondContact OE1-NH2 2.99Å; T22-R58 PolarHBondContact OG1-NE 3.35Å; A54-R58 PolarHBondContact O-N 2.8Å; I55-R58 PolarHBondContact O-N 2.98Å; I55-R58 VanDerWaalsContact O-N 3.14Å; R58-V60 VanDerWaalsContact C-N 3.31Å; R58-V60 PolarHBondContact O-N 3.02Å; R58-T61 WeakPolarHBondContact CA-OG1 3.42Å; R58-T61 PolarHBondContact O-N 3.33Å; R58-T61 VanDerWaalsContact O-N 3.12Å; R58-T61 PolarHBondContact O-OG1 2.92Å; R58-S62 WeakPolarHBondContact CD-OG 3.3Å; R58-S62 WeakPolarHBondContact O-CB 3.32Å; R58-S62 PolarHBondContact O-N 3.44Å; R58-S62 PolarHBondContact O-OG 3.02Å; R58-S69 VanDerWaalsContact CD-OG 3.26Å; R58-S69 WeakPolarHBondContact CD-OG 3.44Å; R58-T73 HydrophobicContact CB-CG2 4.22Å; R58-T73 HydrophobicContact CG-CG2 4.35Å; R58-T73 WeakPolarHBondContact CG-OG1 3.4Å
59	L	98.1	Very high	96.8	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-52.4	-48	177	-70.1	-180	0	0	0	111.6	I55 A63 I70 T73 L74 F97 F101 L104	I55-L59 HydrophobicContact CG2-CD1 3.97Å; I55-L59 HydrophobicContact CG2-CG 4.33Å; I55-L59 WeakPolarHBondContact O-CB 3.34Å; I55-L59 WeakPolarHBondContact O-CG 3.38Å; I55-L59 PolarHBondContact O-N 3.36Å; L59-A63 WeakPolarHBondContact O-CB 3.4Å; L59-A63 PolarHBondContact O-N 3.21Å; L59-A63 VanDerWaalsContact O-N 3.09Å; L59-I70 HydrophobicContact CD2-CG2 4Å; L59-T73 HydrophobicContact CD2-CG2 3.55Å; L59-T73 HydrophobicContact CG-CG2 3.67Å; L59-L74 HydrophobicContact CD2-CD2 4.32Å; L59-F97 HydrophobicContact CD1-CZ 4.37Å; L59-F101 HydrophobicContact CD1-CD2 4.28Å; L59-L104 HydrophobicContact CB-CD2 4.23Å; L59-L104 HydrophobicContact CD1-CD1 4.33Å; L59-L104 HydrophobicContact CD2-CD1 4.02Å; L59-L104 HydrophobicContact CD2-CD2 4.41Å
60	V	96.7	Very high	96.8	Very high	78 Å²	78	37.8 Å²	37.8	47%	0.473	20%	0.197	S	C	.	.	H	α-helix	trans	-72.1	-31.5	-179.7	173.5	0	0	0	0	112.8	K56 K57 R58 A100	K56-V60 HydrophobicContact CG-CG2 4.49Å; K56-V60 WeakPolarHBondContact O-CB 3.47Å; K56-V60 VanDerWaalsContact O-CG2 3.27Å; K56-V60 WeakPolarHBondContact O-CG2 3.43Å; K56-V60 PolarHBondContact O-N 3.36Å; K56-V60 VanDerWaalsContact O-N 3.1Å; K57-V60 PolarHBondContact O-N 3.11Å; R58-V60 VanDerWaalsContact C-N 3.31Å; R58-V60 PolarHBondContact O-N 3.02Å; V60-A100 HydrophobicContact CG2-CB 4.13Å
61	T	96.8	Very high	96.6	Very high	47 Å²	47	35.3 Å²	35.3	29%	0.288	19%	0.185	S	C	.	.	H	α-helix	trans	-75.6	-38.8	176.8	47.9	0	0	0	0	113.4	K57 R58 K65	K57-T61 HydrophobicContact CD-CG2 4.02Å; K57-T61 WeakPolarHBondContact O-CG2 3.18Å; K57-T61 PolarHBondContact O-N 2.82Å; K57-T61 PolarHBondContact O-OG1 3.37Å; R58-T61 WeakPolarHBondContact CA-OG1 3.42Å; R58-T61 PolarHBondContact O-N 3.33Å; R58-T61 VanDerWaalsContact O-N 3.12Å; R58-T61 PolarHBondContact O-OG1 2.92Å; T61-K65 PolarHBondContact O-NZ 3.34Å
62	S	96.9	Very high	96.5	Very high	12 Å²	12	36.2 Å²	36.2	8%	0.084	19%	0.189	C	C	.	.	H	α-helix	trans	-85.7	-18.4	-174.6	-57.6	0	0	0	0	113.3	R58 G64 K65 D66 S69	R58-S62 WeakPolarHBondContact CD-OG 3.3Å; R58-S62 WeakPolarHBondContact O-CB 3.32Å; R58-S62 PolarHBondContact O-N 3.44Å; R58-S62 PolarHBondContact O-OG 3.02Å; S62-G64 PolarHBondContact O-N 3.36Å; S62-K65 PolarHBondContact O-N 2.9Å; S62-D66 PolarHBondContact O-N 3.34Å; S62-S69 PolarHBondContact OG-OG 3.32Å
63	A	96	Very high	96.4	Very high	18 Å²	18	35.7 Å²	35.7	15%	0.149	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-42.8	124.7	174.2	0	0	0	0	0	113.1	L59 K65 L104	L59-A63 WeakPolarHBondContact O-CB 3.4Å; L59-A63 PolarHBondContact O-N 3.21Å; L59-A63 VanDerWaalsContact O-N 3.09Å; A63-K65 PolarHBondContact O-N 2.89Å; A63-L104 HydrophobicContact CB-CD2 4.39Å
64	G	93.5	Very high	96.4	Very high	41 Å²	41	32.1 Å²	32.1	42%	0.423	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.6	6.5	179.3	0	0	0	0	0	115.9	S62	S62-G64 PolarHBondContact O-N 3.36Å
65	K	95.2	Very high	96.2	Very high	165 Å²	165	32.4 Å²	32.4	72%	0.717	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-128.8	-48.2	-174.6	-58	167.3	-153.5	152.2	0	112.7	T61 S62 A63	T61-K65 PolarHBondContact O-NZ 3.34Å; S62-K65 PolarHBondContact O-N 2.9Å; A63-K65 PolarHBondContact O-N 2.89Å
66	D	95.2	Very high	96.1	Very high	40 Å²	40	32.4 Å²	32.4	21%	0.214	17%	0.174	C	C	.	.			trans	-135.2	92.4	-172	-176.1	-9.7	0	0	0	110.4	S24 S62 V68 S69 I70	S24-D66 WeakPolarHBondContact CB-OD1 3.24Å; S24-D66 WeakPolarHBondContact CB-OD2 3.35Å; S24-D66 PolarHBondContact OG-OD2 3.09Å; S62-D66 PolarHBondContact O-N 3.34Å; D66-V68 VanDerWaalsContact C-N 3.3Å; D66-V68 PolarHBondContact O-N 3.46Å; D66-V68 PolarHBondContact OD1-N 3.45Å; D66-S69 PolarHBondContact OD1-N 3.02Å; D66-S69 WeakPolarHBondContact OD2-CB 3.35Å; D66-I70 VanDerWaalsContact O-CG1 3.28Å; D66-I70 WeakPolarHBondContact O-CG1 3.49Å; D66-I70 PolarHBondContact O-N 2.93Å
67	N	93.8	Very high	96.1	Very high	37 Å²	37	29 Å²	29	20%	0.198	16%	0.16	C	C	.	.	H	α-helix	trans	-74.6	-19	-179.9	-63.7	-57.5	0	0	0	113.1	W71 P112 L115 Y162	N67-W71 WeakPolarHBondContact O-CB 3.39Å; N67-W71 PolarHBondContact O-N 3.44Å; N67-P112 HydrophobicContact CB-CG 4.15Å; N67-P112 WeakPolarHBondContact OD1-CD 3.27Å; N67-L115 HydrophobicContact CB-CD1 4.05Å; N67-L115 WeakPolarHBondContact OD1-CD1 3.5Å; N67-Y162 HydrophobicContact CB-CE1 4.02Å; N67-Y162 HydrophobicContact CB-CE2 4.13Å; N67-Y162 WeakPolarHBondContact CB-OH 3.27Å
68	V	93.3	Very high	95.9	Very high	38 Å²	38	26.7 Å²	26.7	23%	0.23	15%	0.15	C	C	.	.	H	α-helix	trans	-74.6	-49.2	176.5	-178.9	0	0	0	0	109.1	D66 I70 W71 Y72 Y162	D66-V68 VanDerWaalsContact C-N 3.3Å; D66-V68 PolarHBondContact O-N 3.46Å; D66-V68 PolarHBondContact OD1-N 3.45Å; V68-I70 VanDerWaalsContact C-N 3.31Å; V68-I70 PolarHBondContact O-N 3.07Å; V68-W71 WeakPolarHBondContact O-CB 3.33Å; V68-W71 PolarHBondContact O-N 3.16Å; V68-Y72 HydrophobicContact CG1-CD2 4.2Å; V68-Y72 HydrophobicContact CG1-CE1 4.35Å; V68-Y72 HydrophobicContact CG1-CE2 3.65Å; V68-Y72 PolarHBondContact O-N 2.85Å; V68-Y162 HydrophobicContact CG2-CD1 3.89Å; V68-Y162 HydrophobicContact CG2-CE1 3.92Å
69	S	96.3	Very high	95.5	Very high	3 Å²	3	26 Å²	26	2%	0.021	15%	0.149	C	C	.	.	H	α-helix	trans	-59.8	-40.2	174.2	178.7	0	0	0	0	111.9	T22 R58 S62 D66 T73	T22-S69 VanDerWaalsContact O-CB 3.3Å; T22-S69 WeakPolarHBondContact O-CB 3.32Å; T22-S69 PolarHBondContact O-OG 2.86Å; R58-S69 VanDerWaalsContact CD-OG 3.26Å; R58-S69 WeakPolarHBondContact CD-OG 3.44Å; S62-S69 PolarHBondContact OG-OG 3.32Å; D66-S69 PolarHBondContact OD1-N 3.02Å; D66-S69 WeakPolarHBondContact OD2-CB 3.35Å; S69-T73 WeakPolarHBondContact O-CB 3.28Å; S69-T73 PolarHBondContact O-N 2.86Å; S69-T73 PolarHBondContact O-OG1 2.92Å
70	I	97	Very high	95.5	Very high	4 Å²	4	25.9 Å²	25.9	2%	0.021	15%	0.148	C	C	.	.	H	α-helix	trans	-61	-45.7	171.9	-63.1	163.4	0	0	0	110.7	L59 D66 V68 T73 L74 L104 L115	L59-I70 HydrophobicContact CD2-CG2 4Å; D66-I70 VanDerWaalsContact O-CG1 3.28Å; D66-I70 WeakPolarHBondContact O-CG1 3.49Å; D66-I70 PolarHBondContact O-N 2.93Å; V68-I70 VanDerWaalsContact C-N 3.31Å; V68-I70 PolarHBondContact O-N 3.07Å; I70-T73 CarbonylContact O-C 3.57Å; I70-T73 WeakPolarHBondContact O-CB 3.5Å; I70-T73 PolarHBondContact O-N 3.09Å; I70-T73 VanDerWaalsContact O-N 3.14Å; I70-L74 HydrophobicContact CG2-CD1 3.98Å; I70-L74 HydrophobicContact CG2-CG 4.13Å; I70-L74 WeakPolarHBondContact O-CG 3.38Å; I70-L74 PolarHBondContact O-N 3.43Å; I70-L104 HydrophobicContact CD1-CD2 4.41Å; I70-L104 HydrophobicContact CG2-CD1 4.45Å; I70-L104 HydrophobicContact CG2-CD2 4.35Å; I70-L115 HydrophobicContact CB-CD1 4.02Å; I70-L115 HydrophobicContact CD1-CD1 4.15Å; I70-L115 HydrophobicContact CG2-CD1 3.76Å; I70-L115 HydrophobicContact CG2-CD2 4.24Å; I70-L115 HydrophobicContact CG2-CG 4.2Å
71	W	94.3	Very high	95.4	Very high	1 Å²	1	22.9 Å²	22.9	0%	0.004	13%	0.129	C	C	.	.	H	α-helix	trans	-58.7	-51.1	-179.5	-170.9	-94.2	0	0	0	112.3	E29 N67 V68 T73 L74 T75 Q114 K118 P158 V159 Y162	E29-W71 VanDerWaalsContact OE1-CD1 3.32Å; E29-W71 PolarHBondContact OE1-NE1 3.41Å; N67-W71 WeakPolarHBondContact O-CB 3.39Å; N67-W71 PolarHBondContact O-N 3.44Å; V68-W71 WeakPolarHBondContact O-CB 3.33Å; V68-W71 PolarHBondContact O-N 3.16Å; W71-T73 VanDerWaalsContact C-N 3.26Å; W71-T73 PolarHBondContact O-N 3.25Å; W71-L74 WeakPolarHBondContact O-CB 3.44Å; W71-L74 PolarHBondContact O-N 3.39Å; W71-T75 PolarHBondContact O-N 3.21Å; W71-T75 PolarHBondContact O-OG1 3.18Å; W71-Q114 HydrophobicContact CZ3-CB 4.19Å; W71-K118 HydrophobicContact CD2-CD 4.36Å; W71-K118 HydrophobicContact CE3-CD 4.16Å; W71-K118 HydrophobicContact CH2-CB 4.25Å; W71-K118 HydrophobicContact CH2-CD 3.73Å; W71-K118 HydrophobicContact CZ2-CD 3.93Å; W71-K118 HydrophobicContact CZ3-CB 3.88Å; W71-K118 HydrophobicContact CZ3-CD 3.84Å; W71-K118 HydrophobicContact CZ3-CG 4.45Å; W71-P158 HydrophobicContact CH2-CB 4.42Å; W71-V159 WeakPolarHBondContact CZ2-O 3.05Å; W71-Y162 HydrophobicContact CB-CG 4.3Å; W71-Y162 HydrophobicContact CD2-CD2 4.3Å; W71-Y162 HydrophobicContact CD2-CG 4.3Å; W71-Y162 AromaticContact CE3-CD2 3.95Å; W71-Y162 HydrophobicContact CE3-CD2 3.95Å; W71-Y162 HydrophobicContact CE3-CG 4.4Å; W71-Y162 HydrophobicContact CG-CG 4.27Å; W71-Y162 HydrophobicContact CZ3-CD2 4.43Å
72	Y	95.1	Very high	95	Very high	19 Å²	19	25.6 Å²	25.6	8%	0.075	14%	0.137	C	C	.	.	H	α-helix	trans	-59.9	-36.6	175.1	-61.9	-19.8	0	0	0	112	D23 Q26 S28 E29 V68 T75 L76	D23-Y72 WeakPolarHBondContact O-CD2 3.32Å; D23-Y72 WeakPolarHBondContact O-CE2 3.07Å; Q26-Y72 HydrophobicContact CB-CE2 4.25Å; Q26-Y72 PolarHBondContact O-OH 3.35Å; S28-Y72 WeakPolarHBondContact CA-OH 3.42Å; S28-Y72 PolarHBondContact N-OH 3.4Å; E29-Y72 VanDerWaalsContact CD-CE1 3.41Å; E29-Y72 HydrophobicContact CG-CD1 3.65Å; E29-Y72 HydrophobicContact CG-CE1 3.93Å; E29-Y72 WeakPolarHBondContact OE1-CD1 3.42Å; E29-Y72 WeakPolarHBondContact OE1-CE1 3.39Å; V68-Y72 HydrophobicContact CG1-CD2 4.2Å; V68-Y72 HydrophobicContact CG1-CE1 4.35Å; V68-Y72 HydrophobicContact CG1-CE2 3.65Å; V68-Y72 PolarHBondContact O-N 2.85Å; Y72-T75 PolarHBondContact O-N 3.38Å; Y72-L76 WeakPolarHBondContact O-CB 3.44Å; Y72-L76 PolarHBondContact O-N 3.01Å
73	T	98.2	Very high	94.5	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-66.6	-36.2	174.7	-50.5	0	0	0	0	112.7	T22 I55 R58 L59 S69 I70 W71 L77	T22-T73 WeakPolarHBondContact CB-OG1 3.48Å; T22-T73 HydrophobicContact CG2-CG2 4.31Å; T22-T73 VanDerWaalsContact CG2-OG1 3.31Å; T22-T73 WeakPolarHBondContact CG2-OG1 3.43Å; I55-T73 HydrophobicContact CB-CG2 4.36Å; I55-T73 HydrophobicContact CG2-CG2 3.79Å; R58-T73 HydrophobicContact CB-CG2 4.22Å; R58-T73 HydrophobicContact CG-CG2 4.35Å; R58-T73 WeakPolarHBondContact CG-OG1 3.4Å; L59-T73 HydrophobicContact CD2-CG2 3.55Å; L59-T73 HydrophobicContact CG-CG2 3.67Å; S69-T73 WeakPolarHBondContact O-CB 3.28Å; S69-T73 PolarHBondContact O-N 2.86Å; S69-T73 PolarHBondContact O-OG1 2.92Å; I70-T73 CarbonylContact O-C 3.57Å; I70-T73 WeakPolarHBondContact O-CB 3.5Å; I70-T73 PolarHBondContact O-N 3.09Å; I70-T73 VanDerWaalsContact O-N 3.14Å; W71-T73 VanDerWaalsContact C-N 3.26Å; W71-T73 PolarHBondContact O-N 3.25Å; T73-L77 VanDerWaalsContact O-CB 3.29Å; T73-L77 WeakPolarHBondContact O-CB 3.2Å; T73-L77 PolarHBondContact O-N 3.44Å
74	L	97.1	Very high	94.1	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-68.2	-42.9	174.4	-68.1	173.8	0	0	0	111	L59 I70 W71 L77 E78 F101 L104 L115 K118 V119 M122	L59-L74 HydrophobicContact CD2-CD2 4.32Å; I70-L74 HydrophobicContact CG2-CD1 3.98Å; I70-L74 HydrophobicContact CG2-CG 4.13Å; I70-L74 WeakPolarHBondContact O-CG 3.38Å; I70-L74 PolarHBondContact O-N 3.43Å; W71-L74 WeakPolarHBondContact O-CB 3.44Å; W71-L74 PolarHBondContact O-N 3.39Å; L74-L77 PolarHBondContact O-N 2.91Å; L74-E78 WeakPolarHBondContact O-CB 3.49Å; L74-E78 PolarHBondContact O-N 3.06Å; L74-F101 HydrophobicContact CD2-CD2 4.43Å; L74-F101 HydrophobicContact CD2-CE2 3.59Å; L74-F101 HydrophobicContact CD2-CZ 4.33Å; L74-L104 HydrophobicContact CD2-CD1 4.3Å; L74-L115 HydrophobicContact CD1-CG 4.4Å; L74-K118 HydrophobicContact CD1-CG 4.42Å; L74-V119 HydrophobicContact CD1-CG2 3.74Å; L74-V119 HydrophobicContact CD2-CG2 4.09Å; L74-M122 HydrophobicContact CB-SD 4.08Å; L74-M122 HydrophobicContact CD2-SD 4.04Å; L74-M122 WeakPolarHBondContact O-CE 3.48Å
75	T	92.8	Very high	93.9	Very high	5 Å²	5	26.4 Å²	26.4	3%	0.031	14%	0.136	C	C	.	.	H	α-helix	trans	-65.1	-39.1	176.5	-57.2	0	0	0	0	112.3	E29 W31 W71 Y72 T79	E29-T75 HydrophobicContact CG-CG2 4.19Å; W31-T75 HydrophobicContact CH2-CG2 3.41Å; W31-T75 VanDerWaalsContact CH2-CG2 3.41Å; W31-T75 HydrophobicContact CZ2-CG2 4.13Å; W31-T75 HydrophobicContact CZ3-CG2 3.74Å; W71-T75 PolarHBondContact O-N 3.21Å; W71-T75 PolarHBondContact O-OG1 3.18Å; Y72-T75 PolarHBondContact O-N 3.38Å; T75-T79 WeakPolarHBondContact O-CB 3.49Å; T75-T79 PolarHBondContact O-N 3.39Å; T75-T79 PolarHBondContact O-OG1 3.3Å
76	L	97.3	Very high	93.8	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-62.6	-48.6	171.4	173.9	60.2	0	0	0	111.7	T18 A21 T22 I34 I37 I55 Y72 E78 T79 L80	T18-L76 HydrophobicContact CG2-CD2 3.87Å; A21-L76 HydrophobicContact CB-CD2 4.37Å; T22-L76 HydrophobicContact CG2-CD2 4.01Å; I34-L76 HydrophobicContact CB-CD1 4.43Å; I34-L76 HydrophobicContact CG1-CD1 4.22Å; I34-L76 HydrophobicContact CG2-CD1 4.05Å; I37-L76 HydrophobicContact CB-CD1 4.25Å; I37-L76 HydrophobicContact CD1-CD1 3.91Å; I37-L76 HydrophobicContact CD1-CD2 4.04Å; I37-L76 HydrophobicContact CG2-CD1 4.14Å; I55-L76 HydrophobicContact CG1-CD2 4.48Å; Y72-L76 WeakPolarHBondContact O-CB 3.44Å; Y72-L76 PolarHBondContact O-N 3.01Å; L76-E78 VanDerWaalsContact C-N 3.33Å; L76-E78 PolarHBondContact O-N 2.76Å; L76-T79 PolarHBondContact O-N 3.12Å; L76-L80 HydrophobicContact CD1-CD1 3.8Å; L76-L80 HydrophobicContact CD1-CG 4.11Å; L76-L80 HydrophobicContact CG-CD1 3.92Å; L76-L80 WeakPolarHBondContact O-CG 3.5Å; L76-L80 PolarHBondContact O-N 3.14Å
77	L	98.3	Very high	93.9	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-58.6	-43.7	176.9	174.3	63.1	0	0	0	111.9	I52 I55 T73 L74 T79 L80 I81 F88 V92 F97 F101 M122 W126	I52-L77 HydrophobicContact CD1-CD1 4.46Å; I55-L77 HydrophobicContact CD1-CD1 4.3Å; I55-L77 HydrophobicContact CG2-CB 4.24Å; I55-L77 HydrophobicContact CG2-CD1 4.3Å; I55-L77 HydrophobicContact CG2-CD2 4.43Å; T73-L77 VanDerWaalsContact O-CB 3.29Å; T73-L77 WeakPolarHBondContact O-CB 3.2Å; T73-L77 PolarHBondContact O-N 3.44Å; L74-L77 PolarHBondContact O-N 2.91Å; L77-T79 VanDerWaalsContact C-N 3.34Å; L77-L80 PolarHBondContact O-N 3.08Å; L77-I81 HydrophobicContact CD1-CD1 4.04Å; L77-I81 HydrophobicContact CD1-CG1 4.39Å; L77-I81 HydrophobicContact CG-CD1 4.1Å; L77-I81 WeakPolarHBondContact O-CB 3.44Å; L77-I81 VanDerWaalsContact O-CG1 3.27Å; L77-I81 WeakPolarHBondContact O-CG1 3.35Å; L77-I81 PolarHBondContact O-N 3.27Å; L77-F88 HydrophobicContact CD1-CE1 4.02Å; L77-F88 HydrophobicContact CD1-CZ 4.08Å; L77-V92 HydrophobicContact CD1-CG2 3.96Å; L77-F97 HydrophobicContact CD1-CE1 4.46Å; L77-F97 HydrophobicContact CD1-CZ 4.08Å; L77-F97 HydrophobicContact CD2-CE1 4.21Å; L77-F97 HydrophobicContact CD2-CZ 3.87Å; L77-F101 HydrophobicContact CD2-CD2 4.1Å; L77-F101 HydrophobicContact CD2-CE2 3.78Å; L77-M122 HydrophobicContact CB-CE 4.33Å; L77-M122 HydrophobicContact CD2-CE 4Å; L77-M122 HydrophobicContact CG-CE 4.05Å; L77-W126 HydrophobicContact CD2-CH2 4.22Å; L77-W126 HydrophobicContact CD2-CZ2 4.05Å; L77-W126 HydrophobicContact CG-CZ2 4.47Å
78	E	93.1	Very high	94	Very high	22 Å²	22	26.3 Å²	26.3	10%	0.103	13%	0.129	C	C	.	.	H	α-helix	trans	-61.2	-42.9	176.2	-161.1	-167.6	137.7	0	0	111.7	L74 L76 I81 K82 K118 M122	L74-E78 WeakPolarHBondContact O-CB 3.49Å; L74-E78 PolarHBondContact O-N 3.06Å; L76-E78 VanDerWaalsContact C-N 3.33Å; L76-E78 PolarHBondContact O-N 2.76Å; E78-I81 PolarHBondContact O-N 2.99Å; E78-K82 WeakPolarHBondContact O-CG 3.09Å; E78-K82 PolarHBondContact O-N 3.29Å; E78-K82 VanDerWaalsContact O-N 3.08Å; E78-K82 WeakPolarHBondContact OE1-CE 3.42Å; E78-K82 IonicContact OE1-NZ 3.34Å; E78-K82 PolarHBondContact OE1-NZ 2.98Å; E78-K118 WeakPolarHBondContact OE2-CE 3.41Å; E78-K118 IonicContact OE2-NZ 3.62Å; E78-K118 PolarHBondContact OE2-NZ 3.46Å; E78-M122 HydrophobicContact CB-CE 3.85Å; E78-M122 HydrophobicContact CG-CE 4.34Å
79	T	91.5	Very high	94.2	Very high	13 Å²	13	25.8 Å²	25.8	8%	0.08	12%	0.124	C	C	.	.	H	α-helix	trans	-66.6	-43	179.3	-51.1	0	0	0	0	111.5	I34 T75 L76 L77 I81 K82 N83	I34-T79 HydrophobicContact CG2-CG2 3.81Å; T75-T79 WeakPolarHBondContact O-CB 3.49Å; T75-T79 PolarHBondContact O-N 3.39Å; T75-T79 PolarHBondContact O-OG1 3.3Å; L76-T79 PolarHBondContact O-N 3.12Å; L77-T79 VanDerWaalsContact C-N 3.34Å; T79-I81 PolarHBondContact O-N 3.49Å; T79-K82 PolarHBondContact O-N 2.92Å; T79-K82 VanDerWaalsContact O-N 3.16Å; T79-N83 PolarHBondContact O-N 3.49Å; T79-N83 PolarHBondContact O-ND2 3.33Å
80	L	96.3	Very high	94.2	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-65.8	-36.5	176.7	-69.8	164.7	0	0	0	112.2	I37 C38 V41 A51 I55 L76 L77 K82 N83 C84 F88	I37-L80 HydrophobicContact CG2-CD1 4.29Å; I37-L80 HydrophobicContact CG2-CD2 4.18Å; C38-L80 HydrophobicContact CB-CD2 4.13Å; C38-L80 VanDerWaalsContact SG-CD2 3.57Å; V41-L80 HydrophobicContact CB-CD2 4.26Å; V41-L80 HydrophobicContact CG1-CD2 4.38Å; V41-L80 HydrophobicContact CG2-CD2 4.18Å; A51-L80 HydrophobicContact CB-CD1 4.43Å; I55-L80 HydrophobicContact CD1-CD1 3.61Å; L76-L80 HydrophobicContact CD1-CD1 3.8Å; L76-L80 HydrophobicContact CD1-CG 4.11Å; L76-L80 HydrophobicContact CG-CD1 3.92Å; L76-L80 WeakPolarHBondContact O-CG 3.5Å; L76-L80 PolarHBondContact O-N 3.14Å; L77-L80 PolarHBondContact O-N 3.08Å; L80-K82 VanDerWaalsContact C-N 3.29Å; L80-K82 PolarHBondContact O-N 3.16Å; L80-N83 PolarHBondContact O-N 3.13Å; L80-C84 VanDerWaalsContact CD2-SG 3.53Å; L80-C84 VanDerWaalsContact O-CB 3.24Å; L80-C84 WeakPolarHBondContact O-CB 3.48Å; L80-C84 PolarHBondContact O-N 3.41Å; L80-F88 HydrophobicContact CB-CD1 3.86Å; L80-F88 HydrophobicContact CB-CE1 3.37Å; L80-F88 HydrophobicContact CB-CE2 4.33Å; L80-F88 HydrophobicContact CB-CZ 3.65Å; L80-F88 HydrophobicContact CD1-CE2 4.35Å; L80-F88 HydrophobicContact CD1-CZ 3.93Å; L80-F88 HydrophobicContact CG-CZ 4.41Å
81	I	95.9	Very high	94.2	Very high	16 Å²	16	31 Å²	31	8%	0.082	15%	0.153	C	C	.	.	H	α-helix	trans	-61.5	-39.7	172.1	-73.9	171.9	0	0	0	111.4	L77 E78 T79 F88 H89 V92 W126 W131	L77-I81 HydrophobicContact CD1-CD1 4.04Å; L77-I81 HydrophobicContact CD1-CG1 4.39Å; L77-I81 HydrophobicContact CG-CD1 4.1Å; L77-I81 WeakPolarHBondContact O-CB 3.44Å; L77-I81 VanDerWaalsContact O-CG1 3.27Å; L77-I81 WeakPolarHBondContact O-CG1 3.35Å; L77-I81 PolarHBondContact O-N 3.27Å; E78-I81 PolarHBondContact O-N 2.99Å; T79-I81 PolarHBondContact O-N 3.49Å; I81-F88 HydrophobicContact CG1-CD1 4.11Å; I81-F88 HydrophobicContact CG1-CE1 3.91Å; I81-H89 PolarHBondContact O-NE2 3.37Å; I81-V92 HydrophobicContact CD1-CB 4.5Å; I81-V92 HydrophobicContact CD1-CG1 3.89Å; I81-V92 HydrophobicContact CD1-CG2 4.04Å; I81-V92 HydrophobicContact CG1-CG2 3.93Å; I81-W126 HydrophobicContact CD1-CD2 4.48Å; I81-W126 VanDerWaalsContact CD1-CE2 3.48Å; I81-W126 HydrophobicContact CD1-CZ2 3.58Å; I81-W131 HydrophobicContact CD1-CH2 4.36Å; I81-W131 HydrophobicContact CG2-CH2 4.48Å; I81-W131 HydrophobicContact CG2-CZ2 3.64Å
82	K	88.2	Confident	94.4	Very high	104 Å²	104	30.9 Å²	30.9	45%	0.452	15%	0.153	S	C	.	.	H	α-helix	trans	-73.1	-28	178.6	-73.6	170.2	170.4	174.9	0	113.8	E78 T79 L80	E78-K82 WeakPolarHBondContact O-CG 3.09Å; E78-K82 PolarHBondContact O-N 3.29Å; E78-K82 VanDerWaalsContact O-N 3.08Å; E78-K82 WeakPolarHBondContact OE1-CE 3.42Å; E78-K82 IonicContact OE1-NZ 3.34Å; E78-K82 PolarHBondContact OE1-NZ 2.98Å; T79-K82 PolarHBondContact O-N 2.92Å; T79-K82 VanDerWaalsContact O-N 3.16Å; L80-K82 VanDerWaalsContact C-N 3.29Å; L80-K82 PolarHBondContact O-N 3.16Å
83	N	85.4	Confident	94.5	Very high	48 Å²	48	30 Å²	30	26%	0.257	15%	0.15	S	C	.	.	H	α-helix	trans	-119.8	-9.3	-170	-61.1	-92.2	0	0	0	116	C38 N42 T79 L80 R424	C38-N83 HydrophobicContact CB-CB 4.45Å; N42-N83 PolarHBondContact ND2-O 3.21Å; N42-N83 VanDerWaalsContact ND2-O 3.07Å; T79-N83 PolarHBondContact O-N 3.49Å; T79-N83 PolarHBondContact O-ND2 3.33Å; L80-N83 PolarHBondContact O-N 3.13Å; N83-R424 PolarHBondContact OD1-NH2 2.93Å
84	C	89	Confident	94.3	Very high	10 Å²	10	32.9 Å²	32.9	7%	0.068	17%	0.165	C	C	.	.	S	Bend	trans	-113.4	4.1	-175.5	-58.3	0	0	0	0	115.6	V41 N42 L80 F88	V41-C84 HydrophobicContact CG1-CB 3.97Å; N42-C84 VanDerWaalsContact OD1-CA 3.23Å; N42-C84 WeakPolarHBondContact OD1-CA 3.2Å; N42-C84 VanDerWaalsContact OD1-CB 3.28Å; N42-C84 WeakPolarHBondContact OD1-CB 3.48Å; N42-C84 PolarHBondContact OD1-SG 3.42Å; L80-C84 VanDerWaalsContact CD2-SG 3.53Å; L80-C84 VanDerWaalsContact O-CB 3.24Å; L80-C84 WeakPolarHBondContact O-CB 3.48Å; L80-C84 PolarHBondContact O-N 3.41Å; C84-F88 HydrophobicContact CB-CB 3.61Å; C84-F88 HydrophobicContact CB-CG 4.08Å
85	G	88.9	Confident	94.1	Very high	30 Å²	30	36.8 Å²	36.8	31%	0.309	18%	0.182	S	C	.	.	H	α-helix	trans	56.1	-158	166.5	0	0	0	0	0	116.6	R87 F88 H89	G85-R87 VanDerWaalsContact C-N 3.28Å; G85-R87 PolarHBondContact O-N 3.1Å; G85-R87 VanDerWaalsContact O-N 3.13Å; G85-F88 PolarHBondContact O-N 2.9Å; G85-H89 PolarHBondContact O-CD2 2.86Å; G85-H89 PolarHBondContact O-N 3.12Å; G85-H89 PolarHBondContact O-ND1 3.42Å
86	K	93.6	Very high	94.2	Very high	115 Å²	115	41.4 Å²	41.4	50%	0.5	20%	0.203	S	C	.	.	H	α-helix	trans	-58.3	-30.7	-167.9	-178.8	166.4	168.4	166.5	0	114.6	S90 D132 V133	K86-S90 WeakPolarHBondContact O-CB 3.44Å; K86-S90 PolarHBondContact O-N 3.33Å; K86-S90 VanDerWaalsContact O-N 3.11Å; K86-S90 PolarHBondContact O-OG 2.96Å; K86-D132 WeakPolarHBondContact CE-O 3.24Å; K86-D132 PolarHBondContact NZ-O 3.45Å; K86-D132 IonicContact NZ-OD2 2.7Å; K86-D132 PolarHBondContact NZ-OD2 3.16Å; K86-V133 HydrophobicContact CG-CG1 3.94Å
87	R	95.4	Very high	94.2	Very high	125 Å²	125	41.6 Å²	41.6	47%	0.472	20%	0.204	S	C	.	.	H	α-helix	trans	-61.8	-44.8	174.4	-64.2	-176.4	74.2	147.1	11.4	110.9	D45 P48 G85	D45-R87 VanDerWaalsContact CA-NH2 3.31Å; D45-R87 PolarHBondContact O-NH2 3.39Å; D45-R87 IonicContact OD1-CZ 3.66Å; D45-R87 IonicContact OD1-NH1 3.58Å; D45-R87 PolarHBondContact OD1-NH1 3.21Å; D45-R87 IonicContact OD1-NH2 2.73Å; D45-R87 PolarHBondContact OD1-NH2 2.93Å; P48-R87 HydrophobicContact CB-CB 4.49Å; P48-R87 HydrophobicContact CG-CB 3.92Å; G85-R87 VanDerWaalsContact C-N 3.28Å; G85-R87 PolarHBondContact O-N 3.1Å; G85-R87 VanDerWaalsContact O-N 3.13Å
88	F	96.9	Very high	94.1	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-79.7	-38.5	179.1	-167.4	-105.9	0	0	0	112.7	V41 P48 A51 I52 I55 L77 L80 I81 C84 G85 S90 Q91 V92	V41-F88 HydrophobicContact CG1-CD2 4.3Å; P48-F88 HydrophobicContact CB-CB 4.41Å; P48-F88 HydrophobicContact CB-CD2 4.04Å; A51-F88 HydrophobicContact CB-CE2 3.88Å; I52-F88 HydrophobicContact CD1-CE2 4.36Å; I52-F88 HydrophobicContact CD1-CZ 4.14Å; I55-F88 HydrophobicContact CD1-CZ 4.01Å; L77-F88 HydrophobicContact CD1-CE1 4.02Å; L77-F88 HydrophobicContact CD1-CZ 4.08Å; L80-F88 HydrophobicContact CB-CD1 3.86Å; L80-F88 HydrophobicContact CB-CE1 3.37Å; L80-F88 HydrophobicContact CB-CE2 4.33Å; L80-F88 HydrophobicContact CB-CZ 3.65Å; L80-F88 HydrophobicContact CD1-CE2 4.35Å; L80-F88 HydrophobicContact CD1-CZ 3.93Å; L80-F88 HydrophobicContact CG-CZ 4.41Å; I81-F88 HydrophobicContact CG1-CD1 4.11Å; I81-F88 HydrophobicContact CG1-CE1 3.91Å; C84-F88 HydrophobicContact CB-CB 3.61Å; C84-F88 HydrophobicContact CB-CG 4.08Å; G85-F88 PolarHBondContact O-N 2.9Å; F88-S90 PolarHBondContact O-N 3.33Å; F88-Q91 WeakPolarHBondContact O-CA 3.28Å; F88-Q91 WeakPolarHBondContact O-CB 3.3Å; F88-Q91 PolarHBondContact O-N 2.9Å; F88-V92 HydrophobicContact CD1-CG2 3.88Å; F88-V92 HydrophobicContact CE1-CG2 3.56Å; F88-V92 HydrophobicContact CZ-CG2 4.1Å; F88-V92 PolarHBondContact O-N 2.98Å
89	H	97.2	Very high	94.1	Very high	27 Å²	27	42.6 Å²	42.6	13%	0.125	21%	0.209	C	C	.	.	H	α-helix	trans	-55.8	-37	173.7	-56.2	155.3	0	0	0	112.1	I81 G85 Q91 V92 A93 W131 V133	I81-H89 PolarHBondContact O-NE2 3.37Å; G85-H89 PolarHBondContact O-CD2 2.86Å; G85-H89 PolarHBondContact O-N 3.12Å; G85-H89 PolarHBondContact O-ND1 3.42Å; H89-Q91 VanDerWaalsContact C-N 3.26Å; H89-Q91 PolarHBondContact O-N 3.26Å; H89-V92 PolarHBondContact O-N 3.19Å; H89-A93 VanDerWaalsContact O-CB 3.32Å; H89-A93 WeakPolarHBondContact O-CB 2.96Å; H89-A93 PolarHBondContact O-N 2.9Å; H89-W131 HydrophobicContact CB-CD2 3.97Å; H89-W131 HydrophobicContact CB-CE3 4.23Å; H89-W131 HydrophobicContact CB-CG 4.16Å; H89-W131 AromaticContact CD2-CE2 3.86Å; H89-W131 AromaticContact CD2-NE1 3.8Å; H89-W131 AromaticContact CE1-CD1 3.82Å; H89-W131 AromaticContact CE1-NE1 3.73Å; H89-W131 AromaticContact CG-CD1 3.91Å; H89-W131 AromaticContact CG-CE2 3.92Å; H89-W131 AromaticContact CG-NE1 3.82Å; H89-W131 AromaticContact ND1-CD1 3.59Å; H89-W131 AromaticContact ND1-NE1 3.81Å; H89-W131 AromaticContact NE2-NE1 3.75Å; H89-V133 HydrophobicContact CB-CG1 4.08Å
90	S	96.8	Very high	94.4	Very high	54 Å²	54	42.7 Å²	42.7	38%	0.378	21%	0.211	S	C	.	.	H	α-helix	trans	-64.3	-27.7	175.4	-59.1	0	0	0	0	113.6	K86 F88 V133	K86-S90 WeakPolarHBondContact O-CB 3.44Å; K86-S90 PolarHBondContact O-N 3.33Å; K86-S90 VanDerWaalsContact O-N 3.11Å; K86-S90 PolarHBondContact O-OG 2.96Å; F88-S90 PolarHBondContact O-N 3.33Å; S90-V133 VanDerWaalsContact OG-CG1 3.31Å; S90-V133 WeakPolarHBondContact OG-CG1 3.46Å
91	Q	97.7	Very high	94.4	Very high	61 Å²	61	42.8 Å²	42.8	29%	0.285	21%	0.211	S	C	.	.	H	α-helix	trans	-82.9	-36.2	175.9	-59.8	-62.7	-38.1	0	0	111.8	P48 I52 F88 H89 N94	P48-Q91 HydrophobicContact CB-CG 3.99Å; I52-Q91 HydrophobicContact CB-CB 3.9Å; I52-Q91 HydrophobicContact CD1-CB 4.35Å; I52-Q91 HydrophobicContact CG1-CB 3.96Å; I52-Q91 HydrophobicContact CG2-CB 3.96Å; I52-Q91 HydrophobicContact CG2-CG 4.41Å; F88-Q91 WeakPolarHBondContact O-CA 3.28Å; F88-Q91 WeakPolarHBondContact O-CB 3.3Å; F88-Q91 PolarHBondContact O-N 2.9Å; H89-Q91 VanDerWaalsContact C-N 3.26Å; H89-Q91 PolarHBondContact O-N 3.26Å; Q91-N94 VanDerWaalsContact O-CB 3.27Å; Q91-N94 WeakPolarHBondContact O-CB 3.31Å; Q91-N94 PolarHBondContact O-N 3.45Å
92	V	97.8	Very high	94.4	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-70.6	-40.3	176.1	177.1	0	0	0	0	111.5	I52 L77 I81 F88 H89 N94 F97 W126 W131	I52-V92 HydrophobicContact CD1-CG2 3.76Å; L77-V92 HydrophobicContact CD1-CG2 3.96Å; I81-V92 HydrophobicContact CD1-CB 4.5Å; I81-V92 HydrophobicContact CD1-CG1 3.89Å; I81-V92 HydrophobicContact CD1-CG2 4.04Å; I81-V92 HydrophobicContact CG1-CG2 3.93Å; F88-V92 HydrophobicContact CD1-CG2 3.88Å; F88-V92 HydrophobicContact CE1-CG2 3.56Å; F88-V92 HydrophobicContact CZ-CG2 4.1Å; F88-V92 PolarHBondContact O-N 2.98Å; H89-V92 PolarHBondContact O-N 3.19Å; V92-N94 PolarHBondContact O-N 2.9Å; V92-N94 VanDerWaalsContact O-N 3.15Å; V92-F97 HydrophobicContact CG1-CD1 4.35Å; V92-F97 HydrophobicContact CG1-CE1 4.17Å; V92-F97 WeakPolarHBondContact O-CD1 3.24Å; V92-W126 HydrophobicContact CG1-CD2 4.25Å; V92-W126 HydrophobicContact CG1-CE3 4.07Å; V92-W126 HydrophobicContact CG1-CH2 3.78Å; V92-W126 HydrophobicContact CG1-CZ2 3.96Å; V92-W126 HydrophobicContact CG1-CZ3 3.85Å; V92-W131 HydrophobicContact CB-CH2 4.42Å; V92-W131 HydrophobicContact CG1-CH2 3.92Å; V92-W131 HydrophobicContact CG1-CZ3 4.2Å
93	A	96.8	Very high	94.8	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.008	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	9.8	177.5	0	0	0	0	0	114.1	H89 W131 V133 G135	H89-A93 VanDerWaalsContact O-CB 3.32Å; H89-A93 WeakPolarHBondContact O-CB 2.96Å; H89-A93 PolarHBondContact O-N 2.9Å; A93-W131 HydrophobicContact CB-CE3 4.43Å; A93-W131 HydrophobicContact CB-CZ3 4.4Å; A93-V133 HydrophobicContact CB-CG2 3.73Å; A93-G135 WeakPolarHBondContact O-CA 3.4Å
94	N	95	Very high	95.3	Very high	59 Å²	59	39.4 Å²	39.4	32%	0.316	19%	0.194	S	C	.	.			trans	-74	133.9	174.6	165.4	-98.4	0	0	0	111.2	Q91 V92 E96 F97 L98	Q91-N94 VanDerWaalsContact O-CB 3.27Å; Q91-N94 WeakPolarHBondContact O-CB 3.31Å; Q91-N94 PolarHBondContact O-N 3.45Å; V92-N94 PolarHBondContact O-N 2.9Å; V92-N94 VanDerWaalsContact O-N 3.15Å; N94-E96 VanDerWaalsContact C-N 3.34Å; N94-E96 PolarHBondContact ND2-OE2 3.44Å; N94-E96 PolarHBondContact O-N 3.02Å; N94-E96 WeakPolarHBondContact OD1-CA 3.4Å; N94-E96 WeakPolarHBondContact OD1-CB 3.31Å; N94-E96 PolarHBondContact OD1-N 3Å; N94-E96 PolarHBondContact OD1-OE2 3.41Å; N94-F97 HydrophobicContact CB-CB 4.3Å; N94-F97 WeakPolarHBondContact O-CB 3.36Å; N94-F97 PolarHBondContact O-N 3.16Å; N94-F97 PolarHBondContact OD1-N 3.05Å; N94-L98 WeakPolarHBondContact O-CG 3.5Å; N94-L98 PolarHBondContact O-N 3.37Å
95	K	93.1	Very high	95.6	Very high	83 Å²	83	39 Å²	39	36%	0.361	19%	0.191	S	C	.	.	H	α-helix	trans	-54.1	-45.8	-179.5	180	-176.6	174.6	-148.2	0	112.8	F97 L98 H99 D578	K95-F97 VanDerWaalsContact C-N 3.26Å; K95-F97 PolarHBondContact O-N 3.22Å; K95-L98 PolarHBondContact O-N 3.43Å; K95-H99 VanDerWaalsContact CE-NE2 3.34Å; K95-H99 WeakPolarHBondContact CE-NE2 3.39Å; K95-H99 PolarHBondContact O-CD2 3.39Å; K95-H99 PolarHBondContact O-N 2.9Å; K95-D578 WeakPolarHBondContact CE-OD2 3.21Å; K95-D578 IonicContact NZ-OD2 3.21Å; K95-D578 PolarHBondContact NZ-OD2 3.47Å
96	E	93.8	Very high	95.8	Very high	102 Å²	102	37.7 Å²	37.7	48%	0.477	18%	0.177	S	C	.	.	H	α-helix	trans	-68.5	-25.5	-178.4	-62.3	66.2	-124.9	0	0	112.1	K56 N94	K56-E96 VanDerWaalsContact NZ-C 3.35Å; K56-E96 PolarHBondContact NZ-O 2.99Å; N94-E96 VanDerWaalsContact C-N 3.34Å; N94-E96 PolarHBondContact ND2-OE2 3.44Å; N94-E96 PolarHBondContact O-N 3.02Å; N94-E96 WeakPolarHBondContact OD1-CA 3.4Å; N94-E96 WeakPolarHBondContact OD1-CB 3.31Å; N94-E96 PolarHBondContact OD1-N 3Å; N94-E96 PolarHBondContact OD1-OE2 3.41Å
97	F	97.5	Very high	95.7	Very high	3 Å²	3	33.8 Å²	33.8	1%	0.013	16%	0.164	C	C	.	.	H	α-helix	trans	-74.8	-49.7	169.1	-174.5	-96.4	0	0	0	111.4	I52 I55 K56 L59 L77 V92 N94 K95 H99 A100 F101 W126	I52-F97 HydrophobicContact CD1-CD1 4.2Å; I52-F97 HydrophobicContact CD1-CD2 3.58Å; I52-F97 HydrophobicContact CD1-CE1 4.1Å; I52-F97 HydrophobicContact CD1-CE2 3.46Å; I52-F97 VanDerWaalsContact CD1-CE2 3.46Å; I52-F97 HydrophobicContact CD1-CG 3.96Å; I52-F97 HydrophobicContact CD1-CZ 3.73Å; I52-F97 HydrophobicContact CG1-CD2 3.5Å; I52-F97 HydrophobicContact CG1-CE2 3.82Å; I52-F97 HydrophobicContact CG1-CG 4.01Å; I55-F97 HydrophobicContact CG2-CE2 4.19Å; I55-F97 HydrophobicContact CG2-CZ 4.23Å; K56-F97 HydrophobicContact CB-CD2 3.95Å; K56-F97 HydrophobicContact CB-CE2 4.01Å; K56-F97 HydrophobicContact CD-CD2 4.28Å; K56-F97 HydrophobicContact CG-CD2 4.43Å; L59-F97 HydrophobicContact CD1-CZ 4.37Å; L77-F97 HydrophobicContact CD1-CE1 4.46Å; L77-F97 HydrophobicContact CD1-CZ 4.08Å; L77-F97 HydrophobicContact CD2-CE1 4.21Å; L77-F97 HydrophobicContact CD2-CZ 3.87Å; V92-F97 HydrophobicContact CG1-CD1 4.35Å; V92-F97 HydrophobicContact CG1-CE1 4.17Å; V92-F97 WeakPolarHBondContact O-CD1 3.24Å; N94-F97 HydrophobicContact CB-CB 4.3Å; N94-F97 WeakPolarHBondContact O-CB 3.36Å; N94-F97 PolarHBondContact O-N 3.16Å; N94-F97 PolarHBondContact OD1-N 3.05Å; K95-F97 VanDerWaalsContact C-N 3.26Å; K95-F97 PolarHBondContact O-N 3.22Å; F97-H99 PolarHBondContact O-N 3.28Å; F97-A100 CarbonylContact O-C 3.59Å; F97-A100 WeakPolarHBondContact O-CA 3.46Å; F97-A100 WeakPolarHBondContact O-CB 3.49Å; F97-A100 PolarHBondContact O-N 3.23Å; F97-F101 HydrophobicContact CE1-CB 4.24Å; F97-F101 HydrophobicContact CE1-CD2 4.36Å; F97-F101 PolarHBondContact O-N 3.22Å; F97-W126 HydrophobicContact CE1-CH2 4.26Å
98	L	96.2	Very high	95.6	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-56.8	-44.4	-178.3	-67.7	171.5	0	0	0	112.3	N94 K95 A100 F101 L102 W126 L139 I142	N94-L98 WeakPolarHBondContact O-CG 3.5Å; N94-L98 PolarHBondContact O-N 3.37Å; K95-L98 PolarHBondContact O-N 3.43Å; L98-A100 VanDerWaalsContact C-N 3.34Å; L98-A100 PolarHBondContact O-N 2.81Å; L98-F101 PolarHBondContact O-N 2.98Å; L98-L102 WeakPolarHBondContact O-CG 3.43Å; L98-L102 PolarHBondContact O-N 3.06Å; L98-W126 HydrophobicContact CD2-CE3 4.24Å; L98-W126 HydrophobicContact CD2-CZ3 3.9Å; L98-L139 HydrophobicContact CD1-CB 3.95Å; L98-L139 HydrophobicContact CD2-CD1 4.13Å; L98-I142 HydrophobicContact CB-CD1 3.83Å; L98-I142 HydrophobicContact CD1-CD1 4.12Å
99	H	94.2	Very high	95.4	Very high	43 Å²	43	36.4 Å²	36.4	20%	0.199	18%	0.18	C	C	.	.	H	α-helix	trans	-63.3	-37.7	174	-80.5	-77.9	0	0	0	112.9	K95 F97 K103	K95-H99 VanDerWaalsContact CE-NE2 3.34Å; K95-H99 WeakPolarHBondContact CE-NE2 3.39Å; K95-H99 PolarHBondContact O-CD2 3.39Å; K95-H99 PolarHBondContact O-N 2.9Å; F97-H99 PolarHBondContact O-N 3.28Å; H99-K103 WeakPolarHBondContact O-CB 3.36Å; H99-K103 PolarHBondContact O-N 3.28Å
100	A	95.9	Very high	95.2	Very high	15 Å²	15	39.7 Å²	39.7	12%	0.124	20%	0.199	C	C	.	.	H	α-helix	trans	-69.4	-33.6	177	0	0	0	0	0	112.5	K56 V60 F97 L98	K56-A100 HydrophobicContact CD-CB 4.17Å; K56-A100 HydrophobicContact CG-CB 4.1Å; V60-A100 HydrophobicContact CG2-CB 4.13Å; F97-A100 CarbonylContact O-C 3.59Å; F97-A100 WeakPolarHBondContact O-CA 3.46Å; F97-A100 WeakPolarHBondContact O-CB 3.49Å; F97-A100 PolarHBondContact O-N 3.23Å; L98-A100 VanDerWaalsContact C-N 3.34Å; L98-A100 PolarHBondContact O-N 2.81Å
101	F	97.5	Very high	94.9	Very high	1 Å²	1	37.3 Å²	37.3	0%	0.004	18%	0.182	C	C	.	.	H	α-helix	trans	-68	-48.3	173.7	-174.8	-104.3	0	0	0	111.4	L59 L74 L77 F97 L98 K103 L104 V119 M122 L123 W126	L59-F101 HydrophobicContact CD1-CD2 4.28Å; L74-F101 HydrophobicContact CD2-CD2 4.43Å; L74-F101 HydrophobicContact CD2-CE2 3.59Å; L74-F101 HydrophobicContact CD2-CZ 4.33Å; L77-F101 HydrophobicContact CD2-CD2 4.1Å; L77-F101 HydrophobicContact CD2-CE2 3.78Å; F97-F101 HydrophobicContact CE1-CB 4.24Å; F97-F101 HydrophobicContact CE1-CD2 4.36Å; F97-F101 PolarHBondContact O-N 3.22Å; L98-F101 PolarHBondContact O-N 2.98Å; F101-K103 VanDerWaalsContact C-N 3.26Å; F101-K103 PolarHBondContact O-N 2.99Å; F101-L104 HydrophobicContact CD2-CD1 4.29Å; F101-L104 VanDerWaalsContact O-CB 3.28Å; F101-L104 WeakPolarHBondContact O-CB 3Å; F101-L104 VanDerWaalsContact O-CG 3.29Å; F101-L104 WeakPolarHBondContact O-CG 3.5Å; F101-L104 PolarHBondContact O-N 3.38Å; F101-V119 HydrophobicContact CD1-CG1 4.14Å; F101-V119 HydrophobicContact CE1-CG1 3.63Å; F101-V119 HydrophobicContact CE2-CG1 4.48Å; F101-V119 HydrophobicContact CZ-CB 4.37Å; F101-V119 HydrophobicContact CZ-CG1 3.83Å; F101-M122 HydrophobicContact CZ-CB 4.11Å; F101-M122 HydrophobicContact CZ-SD 4.43Å; F101-L123 HydrophobicContact CD1-CD1 4.47Å; F101-L123 HydrophobicContact CE1-CD1 4.38Å; F101-W126 AromaticContact CD1-CH2 3.74Å; F101-W126 HydrophobicContact CD1-CH2 3.74Å; F101-W126 AromaticContact CD1-CZ3 3.78Å; F101-W126 HydrophobicContact CD1-CZ3 3.78Å; F101-W126 AromaticContact CD2-CH2 3.92Å; F101-W126 HydrophobicContact CD2-CH2 3.92Å; F101-W126 AromaticContact CE1-CH2 3.46Å; F101-W126 HydrophobicContact CE1-CH2 3.46Å; F101-W126 VanDerWaalsContact CE1-CH2 3.46Å; F101-W126 HydrophobicContact CE1-CZ2 4.22Å; F101-W126 AromaticContact CE1-CZ3 3.69Å; F101-W126 HydrophobicContact CE1-CZ3 3.69Å; F101-W126 AromaticContact CE2-CH2 3.65Å; F101-W126 HydrophobicContact CE2-CH2 3.65Å; F101-W126 HydrophobicContact CE2-CZ2 4.14Å; F101-W126 AromaticContact CG-CH2 3.96Å; F101-W126 HydrophobicContact CG-CH2 3.96Å; F101-W126 HydrophobicContact CG-CZ3 4.3Å; F101-W126 AromaticContact CZ-CH2 3.42Å; F101-W126 HydrophobicContact CZ-CH2 3.42Å; F101-W126 VanDerWaalsContact CZ-CH2 3.42Å; F101-W126 AromaticContact CZ-CZ2 3.84Å; F101-W126 HydrophobicContact CZ-CZ2 3.84Å; F101-W126 HydrophobicContact CZ-CZ3 4.14Å
102	L	95.9	Very high	94.6	Very high	4 Å²	4	35.3 Å²	35.3	2%	0.021	17%	0.174	C	C	.	.	H	α-helix	trans	-59.4	-36.2	173.3	-68.6	175.2	0	0	0	112.5	L98 L104 L105 L123 I142 L146 T582 I585	L98-L102 WeakPolarHBondContact O-CG 3.43Å; L98-L102 PolarHBondContact O-N 3.06Å; L102-L104 PolarHBondContact O-N 2.97Å; L102-L105 WeakPolarHBondContact O-CA 3.35Å; L102-L105 WeakPolarHBondContact O-CB 3.49Å; L102-L105 PolarHBondContact O-N 3.05Å; L102-L123 HydrophobicContact CD2-CD2 4.15Å; L102-I142 HydrophobicContact CD1-CD1 4.19Å; L102-I142 HydrophobicContact CD1-CG1 4.34Å; L102-I142 HydrophobicContact CD1-CG2 3.71Å; L102-I142 HydrophobicContact CD2-CG2 4.17Å; L102-I142 HydrophobicContact CG-CG2 4.39Å; L102-L146 HydrophobicContact CD2-CD1 3.94Å; L102-T582 HydrophobicContact CD1-CG2 4.43Å; L102-I585 HydrophobicContact CB-CD1 4.33Å
103	K	95.4	Very high	94.1	Very high	89 Å²	89	38.7 Å²	38.7	39%	0.387	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-59.3	-20	179.7	-157.2	178.1	-169.1	72.3	0	113.1	H99 F101 L105 S106 N109 E581	H99-K103 WeakPolarHBondContact O-CB 3.36Å; H99-K103 PolarHBondContact O-N 3.28Å; F101-K103 VanDerWaalsContact C-N 3.26Å; F101-K103 PolarHBondContact O-N 2.99Å; K103-L105 PolarHBondContact O-N 3.3Å; K103-S106 WeakPolarHBondContact O-CB 3.36Å; K103-S106 PolarHBondContact O-N 3.38Å; K103-S106 VanDerWaalsContact O-N 3.08Å; K103-N109 PolarHBondContact O-ND2 2.87Å; K103-E581 IonicContact NZ-OE1 2.67Å; K103-E581 PolarHBondContact NZ-OE1 3.44Å; K103-E581 IonicContact NZ-OE2 2.65Å; K103-E581 PolarHBondContact NZ-OE2 3.31Å
104	L	96.2	Very high	93.6	Very high	5 Å²	5	41.5 Å²	41.5	3%	0.026	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-56.2	-37.5	169.2	-63.8	172.9	0	0	0	111.7	L59 A63 I70 L74 F101 L102 S106 N109 V119	L59-L104 HydrophobicContact CB-CD2 4.23Å; L59-L104 HydrophobicContact CD1-CD1 4.33Å; L59-L104 HydrophobicContact CD2-CD1 4.02Å; L59-L104 HydrophobicContact CD2-CD2 4.41Å; A63-L104 HydrophobicContact CB-CD2 4.39Å; I70-L104 HydrophobicContact CD1-CD2 4.41Å; I70-L104 HydrophobicContact CG2-CD1 4.45Å; I70-L104 HydrophobicContact CG2-CD2 4.35Å; L74-L104 HydrophobicContact CD2-CD1 4.3Å; F101-L104 HydrophobicContact CD2-CD1 4.29Å; F101-L104 VanDerWaalsContact O-CB 3.28Å; F101-L104 WeakPolarHBondContact O-CB 3Å; F101-L104 VanDerWaalsContact O-CG 3.29Å; F101-L104 WeakPolarHBondContact O-CG 3.5Å; F101-L104 PolarHBondContact O-N 3.38Å; L102-L104 PolarHBondContact O-N 2.97Å; L104-S106 VanDerWaalsContact C-N 3.25Å; L104-S106 PolarHBondContact O-N 3.48Å; L104-N109 PolarHBondContact O-ND2 2.97Å; L104-N109 VanDerWaalsContact O-ND2 3.15Å; L104-V119 HydrophobicContact CD1-CG2 4.01Å
105	L	95.5	Very high	93.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-81.7	7.2	178.1	-54.4	-179.4	0	0	0	113.9	L102 K103 Q116 V119 L120 I585 L589	L102-L105 WeakPolarHBondContact O-CA 3.35Å; L102-L105 WeakPolarHBondContact O-CB 3.49Å; L102-L105 PolarHBondContact O-N 3.05Å; K103-L105 PolarHBondContact O-N 3.3Å; L105-Q116 HydrophobicContact CD2-CB 4.16Å; L105-Q116 HydrophobicContact CD2-CG 3.99Å; L105-V119 HydrophobicContact CD1-CG1 3.87Å; L105-V119 HydrophobicContact CD2-CB 4.07Å; L105-V119 HydrophobicContact CD2-CG1 4.04Å; L105-V119 HydrophobicContact CG-CB 4.47Å; L105-V119 HydrophobicContact CG-CG1 3.88Å; L105-L120 HydrophobicContact CD1-CD2 3.69Å; L105-L120 HydrophobicContact CD1-CG 3.93Å; L105-I585 HydrophobicContact CB-CG2 3.84Å; L105-L589 HydrophobicContact CB-CD1 4.32Å; L105-L589 HydrophobicContact CB-CD2 4.35Å; L105-L589 HydrophobicContact CD1-CD1 3.87Å; L105-L589 HydrophobicContact CD1-CD2 4.4Å
106	S	93.3	Very high	93.4	Very high	3 Å²	3	35.1 Å²	35.1	2%	0.021	17%	0.173	C	C	.	.			trans	-62.3	140.2	176.4	-172.2	0	0	0	0	111.4	K103 L104 K108 N109	K103-S106 WeakPolarHBondContact O-CB 3.36Å; K103-S106 PolarHBondContact O-N 3.38Å; K103-S106 VanDerWaalsContact O-N 3.08Å; L104-S106 VanDerWaalsContact C-N 3.25Å; L104-S106 PolarHBondContact O-N 3.48Å; S106-K108 PolarHBondContact O-N 3.4Å; S106-N109 PolarHBondContact O-N 2.8Å
107	P	91.4	Very high	93.2	Very high	34 Å²	34	31.5 Å²	31.5	22%	0.221	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-50.7	-32.1	174.6	-24.6	30.1	0	0	0	113.4	N109 D110 E584 W588	P107-N109 PolarHBondContact O-N 2.88Å; P107-D110 PolarHBondContact O-N 2.99Å; P107-E584 HydrophobicContact CG-CG 3.94Å; P107-W588 HydrophobicContact CB-CD2 4.37Å; P107-W588 HydrophobicContact CB-CG 4.03Å; P107-W588 HydrophobicContact CG-CB 3.8Å; P107-W588 HydrophobicContact CG-CD2 4.2Å; P107-W588 HydrophobicContact CG-CG 3.63Å
108	K	93	Very high	92.9	Very high	144 Å²	144	31.5 Å²	31.5	63%	0.626	16%	0.158	S	C	*	.	G	3₁₀ helix	trans	-66.6	-17.1	-177	-66.2	150.4	-167.5	148.2	0	113.6	S106 E584	S106-K108 PolarHBondContact O-N 3.4Å; K108-E584 VanDerWaalsContact CE-OE1 3.3Å; K108-E584 WeakPolarHBondContact CE-OE1 3.47Å; K108-E584 IonicContact NZ-OE1 3.88Å; K108-E584 PolarHBondContact NZ-OE1 3.12Å; K108-E584 IonicContact NZ-OE2 2.88Å; K108-E584 PolarHBondContact NZ-OE2 3.24Å
109	N	93.9	Very high	92.9	Very high	35 Å²	35	31.5 Å²	31.5	19%	0.187	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-100	-12.6	178.1	-61.8	-23.1	0	0	0	113.6	K103 L104 S106 P107 P111	K103-N109 PolarHBondContact O-ND2 2.87Å; L104-N109 PolarHBondContact O-ND2 2.97Å; L104-N109 VanDerWaalsContact O-ND2 3.15Å; S106-N109 PolarHBondContact O-N 2.8Å; P107-N109 PolarHBondContact O-N 2.88Å; N109-P111 VanDerWaalsContact C-CD 3.45Å; N109-P111 VanDerWaalsContact C-N 3.34Å
110	D	91.8	Very high	92.9	Very high	97 Å²	97	29.5 Å²	29.5	52%	0.519	15%	0.149	S	C	.	.			trans	32.4	55	-169.4	-162.2	25.5	0	0	0	115.2	P107 R592	P107-D110 PolarHBondContact O-N 2.99Å; D110-R592 IonicContact OD1-CZ 2.61Å; D110-R592 IonicContact OD1-NH1 2.88Å; D110-R592 PolarHBondContact OD1-NH1 3.31Å; D110-R592 IonicContact OD1-NH2 2.7Å; D110-R592 PolarHBondContact OD1-NH2 2.72Å; D110-R592 IonicContact OD2-NH2 2.73Å
111	P	92.1	Very high	92.7	Very high	4 Å²	4	29 Å²	29	3%	0.026	14%	0.143	C	C	.	.			trans	-59.7	142.5	-170.2	22.8	-35.9	0	0	0	113	N109 L115 Q116 W588	N109-P111 VanDerWaalsContact C-CD 3.45Å; N109-P111 VanDerWaalsContact C-N 3.34Å; P111-L115 HydrophobicContact CB-CD2 4.02Å; P111-Q116 HydrophobicContact CB-CG 4.04Å; P111-Q116 HydrophobicContact CG-CG 3.7Å; P111-Q116 PolarHBondContact O-NE2 3.33Å; P111-W588 HydrophobicContact CG-CH2 3.9Å; P111-W588 HydrophobicContact CG-CZ3 4.26Å
112	P	90.4	Very high	92.6	Very high	19 Å²	19	29.1 Å²	29.1	12%	0.123	14%	0.144	C	C	.	.			trans	-54.2	149.2	172.2	-24.3	32.6	0	0	0	112.6	N67 Q114 L115 Q116 Y162	N67-P112 HydrophobicContact CB-CG 4.15Å; N67-P112 WeakPolarHBondContact OD1-CD 3.27Å; P112-Q114 VanDerWaalsContact C-N 3.28Å; P112-Q114 PolarHBondContact O-N 3.02Å; P112-L115 HydrophobicContact CB-CB 4.43Å; P112-L115 WeakPolarHBondContact O-CA 3.28Å; P112-L115 WeakPolarHBondContact O-CB 3.35Å; P112-L115 PolarHBondContact O-N 2.78Å; P112-Q116 PolarHBondContact O-N 3.05Å; P112-Y162 HydrophobicContact CB-CE2 4.11Å; P112-Y162 HydrophobicContact CG-CE2 4.08Å; P112-Y162 WeakPolarHBondContact CG-OH 3.35Å
113	Q	87.8	Confident	92.6	Very high	70 Å²	70	29 Å²	29	33%	0.327	14%	0.144	S	C	.	.	H	α-helix	trans	-59.8	-37.7	-176.1	-167.2	168.7	18	0	0	112.4	L115 Q116 T117 L594 P596	Q113-L115 VanDerWaalsContact C-N 3.29Å; Q113-L115 PolarHBondContact O-N 2.96Å; Q113-Q116 PolarHBondContact O-N 3.17Å; Q113-T117 PolarHBondContact O-N 2.87Å; Q113-T117 PolarHBondContact O-OG1 3.14Å; Q113-L594 HydrophobicContact CG-CD2 4.01Å; Q113-P596 HydrophobicContact CG-CG 4.31Å
114	Q	85.1	Confident	92.5	Very high	61 Å²	61	27 Å²	27	29%	0.285	14%	0.135	S	C	.	.	H	α-helix	trans	-61	-38.1	175	-53	100.2	-62.5	0	0	112.4	W71 P112 T117 K118 V163	W71-Q114 HydrophobicContact CZ3-CB 4.19Å; P112-Q114 VanDerWaalsContact C-N 3.28Å; P112-Q114 PolarHBondContact O-N 3.02Å; Q114-T117 PolarHBondContact O-N 3.45Å; Q114-K118 PolarHBondContact O-N 3.34Å; Q114-V163 PolarHBondContact NE2-O 2.98Å
115	L	91.5	Very high	92.2	Very high	1 Å²	1	27 Å²	27	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-71.5	-41.8	178.7	-163.7	159.2	0	0	0	110.6	N67 I70 L74 P111 P112 Q113 T117 K118 V119	N67-L115 HydrophobicContact CB-CD1 4.05Å; N67-L115 WeakPolarHBondContact OD1-CD1 3.5Å; I70-L115 HydrophobicContact CB-CD1 4.02Å; I70-L115 HydrophobicContact CD1-CD1 4.15Å; I70-L115 HydrophobicContact CG2-CD1 3.76Å; I70-L115 HydrophobicContact CG2-CD2 4.24Å; I70-L115 HydrophobicContact CG2-CG 4.2Å; L74-L115 HydrophobicContact CD1-CG 4.4Å; P111-L115 HydrophobicContact CB-CD2 4.02Å; P112-L115 HydrophobicContact CB-CB 4.43Å; P112-L115 WeakPolarHBondContact O-CA 3.28Å; P112-L115 WeakPolarHBondContact O-CB 3.35Å; P112-L115 PolarHBondContact O-N 2.78Å; Q113-L115 VanDerWaalsContact C-N 3.29Å; Q113-L115 PolarHBondContact O-N 2.96Å; L115-T117 VanDerWaalsContact C-N 3.34Å; L115-T117 PolarHBondContact O-N 2.82Å; L115-K118 PolarHBondContact O-N 2.82Å; L115-V119 HydrophobicContact CD2-CG2 3.92Å; L115-V119 WeakPolarHBondContact O-CG2 3.19Å; L115-V119 PolarHBondContact O-N 3.06Å
116	Q	93	Very high	92.1	Very high	7 Å²	7	27.3 Å²	27.3	3%	0.033	14%	0.136	C	C	.	.	H	α-helix	trans	-57.5	-46.4	171.4	-65.5	179.7	62.1	0	0	111.4	L105 P111 P112 Q113 L120 L594	L105-Q116 HydrophobicContact CD2-CB 4.16Å; L105-Q116 HydrophobicContact CD2-CG 3.99Å; P111-Q116 HydrophobicContact CB-CG 4.04Å; P111-Q116 HydrophobicContact CG-CG 3.7Å; P111-Q116 PolarHBondContact O-NE2 3.33Å; P112-Q116 PolarHBondContact O-N 3.05Å; Q113-Q116 PolarHBondContact O-N 3.17Å; Q116-L120 WeakPolarHBondContact O-CB 3.48Å; Q116-L120 WeakPolarHBondContact O-CG 3.44Å; Q116-L120 PolarHBondContact O-N 3.01Å; Q116-L120 VanDerWaalsContact O-N 3.08Å; Q116-L594 HydrophobicContact CB-CD1 4.32Å; Q116-L594 HydrophobicContact CB-CD2 4.08Å
117	T	89.9	Confident	92.2	Very high	26 Å²	26	28.7 Å²	28.7	16%	0.16	14%	0.143	C	C	.	.	H	α-helix	trans	-59.2	-50.1	175.4	-58.6	0	0	0	0	111.8	Q113 Q114 L115 L120 Y121 P154 P158	Q113-T117 PolarHBondContact O-N 2.87Å; Q113-T117 PolarHBondContact O-OG1 3.14Å; Q114-T117 PolarHBondContact O-N 3.45Å; L115-T117 VanDerWaalsContact C-N 3.34Å; L115-T117 PolarHBondContact O-N 2.82Å; T117-L120 PolarHBondContact O-N 2.95Å; T117-Y121 WeakPolarHBondContact O-CB 3.43Å; T117-Y121 PolarHBondContact O-N 2.81Å; T117-P154 HydrophobicContact CG2-CB 4.18Å; T117-P154 HydrophobicContact CG2-CG 3.71Å; T117-P158 HydrophobicContact CG2-CB 4.14Å
118	K	91.7	Very high	92.1	Very high	2 Å²	2	30 Å²	30	1%	0.009	15%	0.153	C	C	.	.	H	α-helix	trans	-63.8	-43.4	-178.4	-171.3	154.9	179.5	112.3	0	112.3	W71 L74 E78 Q114 L115 Y121 M122 P158 D160	W71-K118 HydrophobicContact CD2-CD 4.36Å; W71-K118 HydrophobicContact CE3-CD 4.16Å; W71-K118 HydrophobicContact CH2-CB 4.25Å; W71-K118 HydrophobicContact CH2-CD 3.73Å; W71-K118 HydrophobicContact CZ2-CD 3.93Å; W71-K118 HydrophobicContact CZ3-CB 3.88Å; W71-K118 HydrophobicContact CZ3-CD 3.84Å; W71-K118 HydrophobicContact CZ3-CG 4.45Å; L74-K118 HydrophobicContact CD1-CG 4.42Å; E78-K118 WeakPolarHBondContact OE2-CE 3.41Å; E78-K118 IonicContact OE2-NZ 3.62Å; E78-K118 PolarHBondContact OE2-NZ 3.46Å; Q114-K118 PolarHBondContact O-N 3.34Å; L115-K118 PolarHBondContact O-N 2.82Å; K118-Y121 PolarHBondContact O-N 3.06Å; K118-M122 HydrophobicContact CG-CG 4.42Å; K118-M122 HydrophobicContact CG-SD 4.01Å; K118-M122 WeakPolarHBondContact O-CB 3.46Å; K118-M122 WeakPolarHBondContact O-CG 3.34Å; K118-M122 PolarHBondContact O-N 3.35Å; K118-P158 HydrophobicContact CB-CB 4.16Å; K118-P158 HydrophobicContact CB-CG 3.79Å; K118-P158 HydrophobicContact CD-CG 3.99Å; K118-P158 HydrophobicContact CG-CG 3.83Å; K118-D160 IonicContact NZ-OD1 2.79Å; K118-D160 PolarHBondContact NZ-OD1 3.44Å
119	V	95.5	Very high	91.9	Very high	2 Å²	2	24.1 Å²	24.1	1%	0.012	13%	0.13	C	C	.	.	H	α-helix	trans	-62.9	-44.9	177.8	173.2	0	0	0	0	112.1	L74 F101 L104 L105 L115 L123	L74-V119 HydrophobicContact CD1-CG2 3.74Å; L74-V119 HydrophobicContact CD2-CG2 4.09Å; F101-V119 HydrophobicContact CD1-CG1 4.14Å; F101-V119 HydrophobicContact CE1-CG1 3.63Å; F101-V119 HydrophobicContact CE2-CG1 4.48Å; F101-V119 HydrophobicContact CZ-CB 4.37Å; F101-V119 HydrophobicContact CZ-CG1 3.83Å; L104-V119 HydrophobicContact CD1-CG2 4.01Å; L105-V119 HydrophobicContact CD1-CG1 3.87Å; L105-V119 HydrophobicContact CD2-CB 4.07Å; L105-V119 HydrophobicContact CD2-CG1 4.04Å; L105-V119 HydrophobicContact CG-CB 4.47Å; L105-V119 HydrophobicContact CG-CG1 3.88Å; L115-V119 HydrophobicContact CD2-CG2 3.92Å; L115-V119 WeakPolarHBondContact O-CG2 3.19Å; L115-V119 PolarHBondContact O-N 3.06Å; V119-L123 PolarHBondContact O-N 2.91Å; V119-L123 VanDerWaalsContact O-N 3.12Å
120	L	94.4	Very high	91.8	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.005	16%	0.16	C	C	.	.	H	α-helix	trans	-70	-40.2	178.4	-70	170.3	0	0	0	112.3	L105 Q116 T117 L123 K124 V151 F153 L589 L594	L105-L120 HydrophobicContact CD1-CD2 3.69Å; L105-L120 HydrophobicContact CD1-CG 3.93Å; Q116-L120 WeakPolarHBondContact O-CB 3.48Å; Q116-L120 WeakPolarHBondContact O-CG 3.44Å; Q116-L120 PolarHBondContact O-N 3.01Å; Q116-L120 VanDerWaalsContact O-N 3.08Å; T117-L120 PolarHBondContact O-N 2.95Å; L120-L123 PolarHBondContact O-N 3.02Å; L120-K124 PolarHBondContact O-N 2.86Å; L120-V151 HydrophobicContact CD1-CG1 4.38Å; L120-V151 HydrophobicContact CD2-CG1 4.12Å; L120-F153 HydrophobicContact CB-CD1 3.95Å; L120-F153 HydrophobicContact CB-CE1 4.1Å; L120-F153 HydrophobicContact CD2-CD1 4.18Å; L120-F153 HydrophobicContact CD2-CE1 3.57Å; L120-F153 HydrophobicContact CD2-CZ 4.01Å; L120-F153 HydrophobicContact CG-CE1 4.43Å; L120-F153 WeakPolarHBondContact O-CD1 3.26Å; L120-L589 HydrophobicContact CD2-CD1 4.41Å; L120-L594 HydrophobicContact CD1-CD1 3.43Å; L120-L594 VanDerWaalsContact CD1-CD1 3.43Å
121	Y	91.6	Very high	91.8	Very high	4 Å²	4	25.9 Å²	25.9	2%	0.016	14%	0.138	C	C	.	.	H	α-helix	trans	-62.7	-42.7	176	176.9	-102	0	0	0	111.8	T117 K118 L123 K124 C125 P154 V156 A157 P158 C229 V231	T117-Y121 WeakPolarHBondContact O-CB 3.43Å; T117-Y121 PolarHBondContact O-N 2.81Å; K118-Y121 PolarHBondContact O-N 3.06Å; Y121-L123 PolarHBondContact O-N 2.88Å; Y121-K124 WeakPolarHBondContact O-CB 3.27Å; Y121-K124 PolarHBondContact O-N 2.61Å; Y121-C125 VanDerWaalsContact CZ-SG 3.56Å; Y121-C125 PolarHBondContact O-N 2.73Å; Y121-C125 PolarHBondContact O-SG 3.24Å; Y121-P154 HydrophobicContact CD2-CB 4.33Å; Y121-V156 WeakPolarHBondContact CD2-O 3.42Å; Y121-A157 HydrophobicContact CE1-CB 3.8Å; Y121-A157 HydrophobicContact CE2-CB 4.24Å; Y121-A157 VanDerWaalsContact CZ-CA 3.49Å; Y121-P158 HydrophobicContact CD1-CG 4.4Å; Y121-C229 PolarHBondContact OH-SG 3.27Å; Y121-V231 HydrophobicContact CE1-CB 4.33Å; Y121-V231 HydrophobicContact CE1-CG2 3.81Å; Y121-V231 WeakPolarHBondContact OH-CG2 3.42Å
122	M	94.9	Very high	91.8	Very high	4 Å²	4	31.4 Å²	31.4	2%	0.02	17%	0.168	C	C	.	.	H	α-helix	trans	-59.1	-47.2	172.7	-72.1	173.4	78.7	0	0	111.3	L74 L77 E78 F101 K118 K124 C125 W126	L74-M122 HydrophobicContact CB-SD 4.08Å; L74-M122 HydrophobicContact CD2-SD 4.04Å; L74-M122 WeakPolarHBondContact O-CE 3.48Å; L77-M122 HydrophobicContact CB-CE 4.33Å; L77-M122 HydrophobicContact CD2-CE 4Å; L77-M122 HydrophobicContact CG-CE 4.05Å; E78-M122 HydrophobicContact CB-CE 3.85Å; E78-M122 HydrophobicContact CG-CE 4.34Å; F101-M122 HydrophobicContact CZ-CB 4.11Å; F101-M122 HydrophobicContact CZ-SD 4.43Å; K118-M122 HydrophobicContact CG-CG 4.42Å; K118-M122 HydrophobicContact CG-SD 4.01Å; K118-M122 WeakPolarHBondContact O-CB 3.46Å; K118-M122 WeakPolarHBondContact O-CG 3.34Å; K118-M122 PolarHBondContact O-N 3.35Å; M122-K124 VanDerWaalsContact C-N 3.31Å; M122-K124 PolarHBondContact O-N 3.22Å; M122-C125 PolarHBondContact O-N 3.2Å; M122-C125 VanDerWaalsContact O-N 3.11Å; M122-W126 HydrophobicContact CB-CZ2 4.24Å; M122-W126 HydrophobicContact CE-CZ2 4.08Å; M122-W126 PolarHBondContact O-N 3.29Å; M122-W126 PolarHBondContact O-NE1 2.98Å
123	L	95.7	Very high	92	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.01	17%	0.166	C	C	.	.	H	α-helix	trans	-58.9	-41	178.3	-164.1	75.6	0	0	0	112.4	F101 L102 V119 L120 Y121 W126 I127 L139 I142 Y143 L146 F153	F101-L123 HydrophobicContact CD1-CD1 4.47Å; F101-L123 HydrophobicContact CE1-CD1 4.38Å; L102-L123 HydrophobicContact CD2-CD2 4.15Å; V119-L123 PolarHBondContact O-N 2.91Å; V119-L123 VanDerWaalsContact O-N 3.12Å; L120-L123 PolarHBondContact O-N 3.02Å; Y121-L123 PolarHBondContact O-N 2.88Å; L123-W126 HydrophobicContact CD1-CE3 3.95Å; L123-W126 HydrophobicContact CD1-CZ3 4.12Å; L123-W126 PolarHBondContact O-N 3.41Å; L123-I127 WeakPolarHBondContact O-CG1 3.32Å; L123-I127 PolarHBondContact O-N 3.39Å; L123-L139 HydrophobicContact CD1-CD1 3.45Å; L123-L139 VanDerWaalsContact CD1-CD1 3.45Å; L123-L139 HydrophobicContact CG-CD1 4.13Å; L123-I142 HydrophobicContact CD2-CG2 4.32Å; L123-Y143 HydrophobicContact CD2-CD2 4.46Å; L123-L146 HydrophobicContact CD2-CD1 3.57Å; L123-F153 HydrophobicContact CB-CE1 4.36Å; L123-F153 HydrophobicContact CD2-CE1 3.97Å; L123-F153 HydrophobicContact CD2-CZ 4.14Å
124	K	93.1	Very high	92.2	Very high	47 Å²	47	31.6 Å²	31.6	20%	0.204	18%	0.182	C	C	.	.	H	α-helix	trans	-61.9	-46.9	173.2	179	-163.9	173.3	-163.2	0	111.4	L120 Y121 M122 W126 I127 S128 Y143 F153 P154 T155	L120-K124 PolarHBondContact O-N 2.86Å; Y121-K124 WeakPolarHBondContact O-CB 3.27Å; Y121-K124 PolarHBondContact O-N 2.61Å; M122-K124 VanDerWaalsContact C-N 3.31Å; M122-K124 PolarHBondContact O-N 3.22Å; K124-W126 VanDerWaalsContact C-N 3.29Å; K124-W126 PolarHBondContact O-N 3.04Å; K124-I127 WeakPolarHBondContact O-CB 3.44Å; K124-I127 PolarHBondContact O-N 3.04Å; K124-I127 VanDerWaalsContact O-N 3.17Å; K124-S128 PolarHBondContact O-N 3.39Å; K124-S128 PolarHBondContact O-OG 3.36Å; K124-Y143 HydrophobicContact CB-CE2 4.35Å; K124-F153 HydrophobicContact CB-CD1 4.16Å; K124-F153 HydrophobicContact CD-CB 4.49Å; K124-P154 WeakPolarHBondContact CD-O 3.46Å; K124-P154 WeakPolarHBondContact CE-O 3.34Å; K124-P154 PolarHBondContact NZ-O 3.01Å; K124-T155 PolarHBondContact NZ-O 2.96Å
125	C	89.9	Confident	92.6	Very high	5 Å²	5	29.5 Å²	29.5	3%	0.034	18%	0.176	C	C	.	.	H	α-helix	trans	-61	-37.9	179.1	-65.7	0	0	0	0	112.2	Y121 M122 S128 S129 V231	Y121-C125 VanDerWaalsContact CZ-SG 3.56Å; Y121-C125 PolarHBondContact O-N 2.73Å; Y121-C125 PolarHBondContact O-SG 3.24Å; M122-C125 PolarHBondContact O-N 3.2Å; M122-C125 VanDerWaalsContact O-N 3.11Å; C125-S128 PolarHBondContact O-N 3.17Å; C125-S129 WeakPolarHBondContact O-CB 3.4Å; C125-S129 PolarHBondContact O-N 2.97Å; C125-S129 PolarHBondContact O-OG 2.97Å; C125-V231 HydrophobicContact CB-CG1 3.82Å
126	W	95.2	Very high	92.7	Very high	6 Å²	6	31.3 Å²	31.3	2%	0.023	18%	0.184	C	C	.	.	H	α-helix	trans	-65.7	-36	176.4	-55.4	-11.7	0	0	0	112.6	L77 I81 V92 F97 L98 F101 M122 L123 K124 S129 W131 L139	L77-W126 HydrophobicContact CD2-CH2 4.22Å; L77-W126 HydrophobicContact CD2-CZ2 4.05Å; L77-W126 HydrophobicContact CG-CZ2 4.47Å; I81-W126 HydrophobicContact CD1-CD2 4.48Å; I81-W126 VanDerWaalsContact CD1-CE2 3.48Å; I81-W126 HydrophobicContact CD1-CZ2 3.58Å; V92-W126 HydrophobicContact CG1-CD2 4.25Å; V92-W126 HydrophobicContact CG1-CE3 4.07Å; V92-W126 HydrophobicContact CG1-CH2 3.78Å; V92-W126 HydrophobicContact CG1-CZ2 3.96Å; V92-W126 HydrophobicContact CG1-CZ3 3.85Å; F97-W126 HydrophobicContact CE1-CH2 4.26Å; L98-W126 HydrophobicContact CD2-CE3 4.24Å; L98-W126 HydrophobicContact CD2-CZ3 3.9Å; F101-W126 AromaticContact CD1-CH2 3.74Å; F101-W126 HydrophobicContact CD1-CH2 3.74Å; F101-W126 AromaticContact CD1-CZ3 3.78Å; F101-W126 HydrophobicContact CD1-CZ3 3.78Å; F101-W126 AromaticContact CD2-CH2 3.92Å; F101-W126 HydrophobicContact CD2-CH2 3.92Å; F101-W126 AromaticContact CE1-CH2 3.46Å; F101-W126 HydrophobicContact CE1-CH2 3.46Å; F101-W126 VanDerWaalsContact CE1-CH2 3.46Å; F101-W126 HydrophobicContact CE1-CZ2 4.22Å; F101-W126 AromaticContact CE1-CZ3 3.69Å; F101-W126 HydrophobicContact CE1-CZ3 3.69Å; F101-W126 AromaticContact CE2-CH2 3.65Å; F101-W126 HydrophobicContact CE2-CH2 3.65Å; F101-W126 HydrophobicContact CE2-CZ2 4.14Å; F101-W126 AromaticContact CG-CH2 3.96Å; F101-W126 HydrophobicContact CG-CH2 3.96Å; F101-W126 HydrophobicContact CG-CZ3 4.3Å; F101-W126 AromaticContact CZ-CH2 3.42Å; F101-W126 HydrophobicContact CZ-CH2 3.42Å; F101-W126 VanDerWaalsContact CZ-CH2 3.42Å; F101-W126 AromaticContact CZ-CZ2 3.84Å; F101-W126 HydrophobicContact CZ-CZ2 3.84Å; F101-W126 HydrophobicContact CZ-CZ3 4.14Å; M122-W126 HydrophobicContact CB-CZ2 4.24Å; M122-W126 HydrophobicContact CE-CZ2 4.08Å; M122-W126 PolarHBondContact O-N 3.29Å; M122-W126 PolarHBondContact O-NE1 2.98Å; L123-W126 HydrophobicContact CD1-CE3 3.95Å; L123-W126 HydrophobicContact CD1-CZ3 4.12Å; L123-W126 PolarHBondContact O-N 3.41Å; K124-W126 VanDerWaalsContact C-N 3.29Å; K124-W126 PolarHBondContact O-N 3.04Å; W126-S129 WeakPolarHBondContact O-CB 3.43Å; W126-S129 PolarHBondContact O-N 2.69Å; W126-W131 HydrophobicContact CB-CH2 3.5Å; W126-W131 VanDerWaalsContact CB-CH2 3.5Å; W126-W131 HydrophobicContact CB-CZ2 3.96Å; W126-W131 HydrophobicContact CB-CZ3 3.9Å; W126-W131 AromaticContact CD1-CH2 3.6Å; W126-W131 AromaticContact CD1-CZ2 3.7Å; W126-W131 AromaticContact CD2-CH2 3.82Å; W126-W131 HydrophobicContact CD2-CH2 3.82Å; W126-W131 HydrophobicContact CE3-CH2 4.46Å; W126-W131 AromaticContact CG-CH2 3.35Å; W126-W131 HydrophobicContact CG-CH2 3.35Å; W126-W131 AromaticContact CG-CZ2 3.85Å; W126-W131 HydrophobicContact CG-CZ2 3.85Å; W126-W131 HydrophobicContact CG-CZ3 4.15Å; W126-L139 HydrophobicContact CB-CD2 3.68Å; W126-L139 HydrophobicContact CE3-CD1 4.25Å
127	I	94.1	Very high	92.7	Very high	32 Å²	32	38.5 Å²	38.5	16%	0.164	21%	0.211	C	C	.	.	H	α-helix	trans	-65.7	-47.5	173.6	-71.8	-78.7	0	0	0	111.1	L123 K124 S129 K136 L139 E140 Y143	L123-I127 WeakPolarHBondContact O-CG1 3.32Å; L123-I127 PolarHBondContact O-N 3.39Å; K124-I127 WeakPolarHBondContact O-CB 3.44Å; K124-I127 PolarHBondContact O-N 3.04Å; K124-I127 VanDerWaalsContact O-N 3.17Å; I127-S129 PolarHBondContact O-N 3.03Å; I127-K136 PolarHBondContact O-NZ 2.74Å; I127-L139 HydrophobicContact CD1-CD1 4.26Å; I127-L139 HydrophobicContact CD1-CD2 4.47Å; I127-L139 HydrophobicContact CD1-CG 3.76Å; I127-L139 HydrophobicContact CG1-CD1 4.3Å; I127-L139 HydrophobicContact CG1-CG 4.17Å; I127-E140 HydrophobicContact CD1-CB 4.41Å; I127-E140 HydrophobicContact CD1-CG 3.99Å; I127-Y143 VanDerWaalsContact CD1-CB 3.5Å; I127-Y143 HydrophobicContact CD1-CD1 4.08Å; I127-Y143 HydrophobicContact CD1-CG 3.84Å; I127-Y143 HydrophobicContact CG1-CD1 3.99Å; I127-Y143 HydrophobicContact CG1-CD2 3.9Å; I127-Y143 HydrophobicContact CG1-CE2 4.49Å; I127-Y143 HydrophobicContact CG1-CG 3.62Å; I127-Y143 HydrophobicContact CG2-CD1 4.03Å; I127-Y143 HydrophobicContact CG2-CE1 4.06Å
128	S	89.6	Confident	92.8	Very high	60 Å²	60	39.8 Å²	39.8	42%	0.42	22%	0.217	S	C	.	.	H	α-helix	trans	-67.6	-15.6	176.8	-62.6	0	0	0	0	113.9	K124 C125	K124-S128 PolarHBondContact O-N 3.39Å; K124-S128 PolarHBondContact O-OG 3.36Å; C125-S128 PolarHBondContact O-N 3.17Å
129	S	89.9	Confident	93	Very high	21 Å²	21	39.7 Å²	39.7	15%	0.147	22%	0.216	C	C	.	.	S	Bend	trans	-75.9	143.7	179.3	-63.1	0	0	0	0	112.2	C125 W126 I127 W131 K136	C125-S129 WeakPolarHBondContact O-CB 3.4Å; C125-S129 PolarHBondContact O-N 2.97Å; C125-S129 PolarHBondContact O-OG 2.97Å; W126-S129 WeakPolarHBondContact O-CB 3.43Å; W126-S129 PolarHBondContact O-N 2.69Å; I127-S129 PolarHBondContact O-N 3.03Å; S129-W131 VanDerWaalsContact CB-CD1 3.43Å; S129-W131 VanDerWaalsContact CB-NE1 3.28Å; S129-W131 PolarHBondContact O-N 3.1Å; S129-K136 PolarHBondContact O-NZ 2.54Å
130	N	90.2	Very high	92.9	Very high	155 Å²	155	43.5 Å²	43.5	83%	0.829	23%	0.234	S	C	*	.			trans	-76.9	32	179.4	64.2	-6.7	0	0	0	114.4	D132	N130-D132 PolarHBondContact O-N 3.29Å
131	W	92.5	Very high	92.9	Very high	14 Å²	14	49.5 Å²	49.5	5%	0.053	26%	0.26	C	S	.	.			trans	-63.8	106.8	-176	-60	-9.2	0	0	0	112.8	I81 H89 V92 A93 W126 S129 V133 K136 L139	I81-W131 HydrophobicContact CD1-CH2 4.36Å; I81-W131 HydrophobicContact CG2-CH2 4.48Å; I81-W131 HydrophobicContact CG2-CZ2 3.64Å; H89-W131 HydrophobicContact CB-CD2 3.97Å; H89-W131 HydrophobicContact CB-CE3 4.23Å; H89-W131 HydrophobicContact CB-CG 4.16Å; H89-W131 AromaticContact CD2-CE2 3.86Å; H89-W131 AromaticContact CD2-NE1 3.8Å; H89-W131 AromaticContact CE1-CD1 3.82Å; H89-W131 AromaticContact CE1-NE1 3.73Å; H89-W131 AromaticContact CG-CD1 3.91Å; H89-W131 AromaticContact CG-CE2 3.92Å; H89-W131 AromaticContact CG-NE1 3.82Å; H89-W131 AromaticContact ND1-CD1 3.59Å; H89-W131 AromaticContact ND1-NE1 3.81Å; H89-W131 AromaticContact NE2-NE1 3.75Å; V92-W131 HydrophobicContact CB-CH2 4.42Å; V92-W131 HydrophobicContact CG1-CH2 3.92Å; V92-W131 HydrophobicContact CG1-CZ3 4.2Å; A93-W131 HydrophobicContact CB-CE3 4.43Å; A93-W131 HydrophobicContact CB-CZ3 4.4Å; W126-W131 HydrophobicContact CB-CH2 3.5Å; W126-W131 VanDerWaalsContact CB-CH2 3.5Å; W126-W131 HydrophobicContact CB-CZ2 3.96Å; W126-W131 HydrophobicContact CB-CZ3 3.9Å; W126-W131 AromaticContact CD1-CH2 3.6Å; W126-W131 AromaticContact CD1-CZ2 3.7Å; W126-W131 AromaticContact CD2-CH2 3.82Å; W126-W131 HydrophobicContact CD2-CH2 3.82Å; W126-W131 HydrophobicContact CE3-CH2 4.46Å; W126-W131 AromaticContact CG-CH2 3.35Å; W126-W131 HydrophobicContact CG-CH2 3.35Å; W126-W131 AromaticContact CG-CZ2 3.85Å; W126-W131 HydrophobicContact CG-CZ2 3.85Å; W126-W131 HydrophobicContact CG-CZ3 4.15Å; S129-W131 VanDerWaalsContact CB-CD1 3.43Å; S129-W131 VanDerWaalsContact CB-NE1 3.28Å; S129-W131 PolarHBondContact O-N 3.1Å; W131-V133 VanDerWaalsContact C-N 3.28Å; W131-V133 HydrophobicContact CB-CG2 4.02Å; W131-V133 HydrophobicContact CE3-CG2 4.42Å; W131-V133 PolarHBondContact O-N 3.33Å; W131-K136 HydrophobicContact CB-CD 4.47Å; W131-K136 VanDerWaalsContact O-CD 3.32Å; W131-K136 WeakPolarHBondContact O-CD 3.47Å; W131-L139 HydrophobicContact CE3-CD2 4.4Å; W131-L139 HydrophobicContact CZ3-CD2 4.08Å
132	D	91.6	Very high	93	Very high	120 Å²	120	50.1 Å²	50.1	64%	0.642	26%	0.263	S	S	*	.			trans	-77.9	74.8	167.5	174.2	40.1	0	0	0	110.8	K86 N130	K86-D132 WeakPolarHBondContact CE-O 3.24Å; K86-D132 PolarHBondContact NZ-O 3.45Å; K86-D132 IonicContact NZ-OD2 2.7Å; K86-D132 PolarHBondContact NZ-OD2 3.16Å; N130-D132 PolarHBondContact O-N 3.29Å
133	V	94.5	Very high	93	Very high	14 Å²	14	52 Å²	52	9%	0.085	27%	0.271	C	S	.	.			trans	-136.5	139.8	177.4	-59.9	0	0	0	0	111.4	K86 H89 S90 A93 W131 G135 K136	K86-V133 HydrophobicContact CG-CG1 3.94Å; H89-V133 HydrophobicContact CB-CG1 4.08Å; S90-V133 VanDerWaalsContact OG-CG1 3.31Å; S90-V133 WeakPolarHBondContact OG-CG1 3.46Å; A93-V133 HydrophobicContact CB-CG2 3.73Å; W131-V133 VanDerWaalsContact C-N 3.28Å; W131-V133 HydrophobicContact CB-CG2 4.02Å; W131-V133 HydrophobicContact CE3-CG2 4.42Å; W131-V133 PolarHBondContact O-N 3.33Å; V133-G135 PolarHBondContact O-N 3.17Å; V133-G135 VanDerWaalsContact O-N 3.07Å; V133-K136 HydrophobicContact CG2-CB 4.19Å; V133-K136 WeakPolarHBondContact O-CB 3.38Å; V133-K136 PolarHBondContact O-N 3.06Å
134	A	92.2	Very high	92.9	Very high	80 Å²	80	54.5 Å²	54.5	66%	0.661	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-31.4	-171	0	0	0	0	0	114.7	R137	A134-R137 PolarHBondContact O-NE 2.98Å
135	G	93.2	Very high	92.9	Very high	16 Å²	16	53.8 Å²	53.8	17%	0.165	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-8.3	178.6	0	0	0	0	0	115.4	A93 V133 R137 D138 L139	A93-G135 WeakPolarHBondContact O-CA 3.4Å; V133-G135 PolarHBondContact O-N 3.17Å; V133-G135 VanDerWaalsContact O-N 3.07Å; G135-R137 PolarHBondContact O-N 2.84Å; G135-R137 VanDerWaalsContact O-N 3.15Å; G135-D138 PolarHBondContact O-N 2.82Å; G135-L139 PolarHBondContact O-N 2.93Å
136	K	94.1	Very high	93.1	Very high	39 Å²	39	53.5 Å²	53.5	17%	0.17	29%	0.291	C	S	.	.	H	α-helix	trans	-55.3	-34.6	175.3	177.4	168.4	174.3	166.6	0	111.5	I127 S129 W131 V133 D138 L139 E140	I127-K136 PolarHBondContact O-NZ 2.74Å; S129-K136 PolarHBondContact O-NZ 2.54Å; W131-K136 HydrophobicContact CB-CD 4.47Å; W131-K136 VanDerWaalsContact O-CD 3.32Å; W131-K136 WeakPolarHBondContact O-CD 3.47Å; V133-K136 HydrophobicContact CG2-CB 4.19Å; V133-K136 WeakPolarHBondContact O-CB 3.38Å; V133-K136 PolarHBondContact O-N 3.06Å; K136-D138 VanDerWaalsContact C-N 3.27Å; K136-D138 PolarHBondContact O-N 3.2Å; K136-L139 WeakPolarHBondContact O-CB 3.48Å; K136-L139 PolarHBondContact O-N 3Å; K136-E140 WeakPolarHBondContact CE-OE1 3.34Å; K136-E140 HydrophobicContact CG-CG 4.29Å; K136-E140 WeakPolarHBondContact O-CB 3.5Å; K136-E140 VanDerWaalsContact O-CG 3.28Å; K136-E140 WeakPolarHBondContact O-CG 3.45Å; K136-E140 PolarHBondContact O-N 3.38Å
137	R	93	Very high	93	Very high	158 Å²	158	57.2 Å²	57.2	60%	0.596	31%	0.311	S	S	*	.	H	α-helix	trans	-63.8	-24.7	175.9	-64.4	177.9	-60.5	151.9	5.7	114.6	A134 G135 E140 K141	A134-R137 PolarHBondContact O-NE 2.98Å; G135-R137 PolarHBondContact O-N 2.84Å; G135-R137 VanDerWaalsContact O-N 3.15Å; R137-E140 WeakPolarHBondContact CA-OE2 3.31Å; R137-K141 WeakPolarHBondContact O-CD 3.4Å; R137-K141 VanDerWaalsContact O-CE 3.3Å; R137-K141 WeakPolarHBondContact O-CE 3.46Å; R137-K141 VanDerWaalsContact O-CG 3.24Å; R137-K141 WeakPolarHBondContact O-CG 3.35Å; R137-K141 PolarHBondContact O-N 3.24Å
138	D	92.4	Very high	92.9	Very high	53 Å²	53	63.2 Å²	63.2	28%	0.283	34%	0.338	S	S	.	.	H	α-helix	trans	-87.7	-34.8	177.1	-66.2	-55.5	0	0	0	111.4	G135 K136 E140 K141 I142	G135-D138 PolarHBondContact O-N 2.82Å; K136-D138 VanDerWaalsContact C-N 3.27Å; K136-D138 PolarHBondContact O-N 3.2Å; D138-E140 VanDerWaalsContact C-N 3.35Å; D138-K141 PolarHBondContact O-N 2.89Å; D138-K141 IonicContact OD1-NZ 2.68Å; D138-K141 PolarHBondContact OD1-NZ 3.45Å; D138-I142 WeakPolarHBondContact O-CB 3.23Å; D138-I142 WeakPolarHBondContact O-CG1 3.28Å; D138-I142 PolarHBondContact O-N 2.67Å
139	L	95.1	Very high	93	Very high	0 Å²	0	63 Å²	63	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-57.7	-44.9	164.7	169.6	61.8	0	0	0	111.5	L98 L123 W126 I127 W131 G135 K136 I142 Y143	L98-L139 HydrophobicContact CD1-CB 3.95Å; L98-L139 HydrophobicContact CD2-CD1 4.13Å; L123-L139 HydrophobicContact CD1-CD1 3.45Å; L123-L139 VanDerWaalsContact CD1-CD1 3.45Å; L123-L139 HydrophobicContact CG-CD1 4.13Å; W126-L139 HydrophobicContact CB-CD2 3.68Å; W126-L139 HydrophobicContact CE3-CD1 4.25Å; I127-L139 HydrophobicContact CD1-CD1 4.26Å; I127-L139 HydrophobicContact CD1-CD2 4.47Å; I127-L139 HydrophobicContact CD1-CG 3.76Å; I127-L139 HydrophobicContact CG1-CD1 4.3Å; I127-L139 HydrophobicContact CG1-CG 4.17Å; W131-L139 HydrophobicContact CE3-CD2 4.4Å; W131-L139 HydrophobicContact CZ3-CD2 4.08Å; G135-L139 PolarHBondContact O-N 2.93Å; K136-L139 WeakPolarHBondContact O-CB 3.48Å; K136-L139 PolarHBondContact O-N 3Å; L139-I142 WeakPolarHBondContact O-CB 3.24Å; L139-I142 PolarHBondContact O-N 2.97Å; L139-Y143 WeakPolarHBondContact O-CB 3.27Å; L139-Y143 PolarHBondContact O-N 3.47Å
140	E	94.8	Very high	93	Very high	82 Å²	82	64.1 Å²	64.1	38%	0.383	34%	0.344	S	S	.	.	H	α-helix	trans	-59.7	-46.4	175.4	-75	165.5	172.7	0	0	112.7	I127 K136 R137 D138 I142 Y143 A144	I127-E140 HydrophobicContact CD1-CB 4.41Å; I127-E140 HydrophobicContact CD1-CG 3.99Å; K136-E140 WeakPolarHBondContact CE-OE1 3.34Å; K136-E140 HydrophobicContact CG-CG 4.29Å; K136-E140 WeakPolarHBondContact O-CB 3.5Å; K136-E140 VanDerWaalsContact O-CG 3.28Å; K136-E140 WeakPolarHBondContact O-CG 3.45Å; K136-E140 PolarHBondContact O-N 3.38Å; R137-E140 WeakPolarHBondContact CA-OE2 3.31Å; D138-E140 VanDerWaalsContact C-N 3.35Å; E140-I142 VanDerWaalsContact C-N 3.34Å; E140-I142 PolarHBondContact O-N 3.07Å; E140-Y143 PolarHBondContact O-N 3Å; E140-A144 VanDerWaalsContact O-CB 3.31Å; E140-A144 WeakPolarHBondContact O-CB 3.42Å; E140-A144 PolarHBondContact O-N 2.67Å
141	K	93.7	Very high	93.1	Very high	127 Å²	127	56.9 Å²	56.9	55%	0.552	31%	0.305	S	S	*	.	H	α-helix	trans	-60.2	-42.9	175	-69.5	163.8	-156.4	167	0	112.1	R137 D138 S145	R137-K141 WeakPolarHBondContact O-CD 3.4Å; R137-K141 VanDerWaalsContact O-CE 3.3Å; R137-K141 WeakPolarHBondContact O-CE 3.46Å; R137-K141 VanDerWaalsContact O-CG 3.24Å; R137-K141 WeakPolarHBondContact O-CG 3.35Å; R137-K141 PolarHBondContact O-N 3.24Å; D138-K141 PolarHBondContact O-N 2.89Å; D138-K141 IonicContact OD1-NZ 2.68Å; D138-K141 PolarHBondContact OD1-NZ 3.45Å; K141-S145 WeakPolarHBondContact O-CB 3.35Å; K141-S145 PolarHBondContact O-N 3.22Å
142	I	93.7	Very high	92.9	Very high	17 Å²	17	61.5 Å²	61.5	9%	0.087	33%	0.327	C	S	.	.	H	α-helix	trans	-60	-51.3	177.3	-81.6	167.6	0	0	0	110.3	L98 L102 L123 D138 L139 E140 S145 L146	L98-I142 HydrophobicContact CB-CD1 3.83Å; L98-I142 HydrophobicContact CD1-CD1 4.12Å; L102-I142 HydrophobicContact CD1-CD1 4.19Å; L102-I142 HydrophobicContact CD1-CG1 4.34Å; L102-I142 HydrophobicContact CD1-CG2 3.71Å; L102-I142 HydrophobicContact CD2-CG2 4.17Å; L102-I142 HydrophobicContact CG-CG2 4.39Å; L123-I142 HydrophobicContact CD2-CG2 4.32Å; D138-I142 WeakPolarHBondContact O-CB 3.23Å; D138-I142 WeakPolarHBondContact O-CG1 3.28Å; D138-I142 PolarHBondContact O-N 2.67Å; L139-I142 WeakPolarHBondContact O-CB 3.24Å; L139-I142 PolarHBondContact O-N 2.97Å; E140-I142 VanDerWaalsContact C-N 3.34Å; E140-I142 PolarHBondContact O-N 3.07Å; I142-S145 PolarHBondContact O-N 3.15Å; I142-L146 HydrophobicContact CG2-CD1 4.05Å; I142-L146 WeakPolarHBondContact O-CG 3.22Å; I142-L146 PolarHBondContact O-N 3.25Å
143	Y	94.6	Very high	92.9	Very high	44 Å²	44	57.2 Å²	57.2	17%	0.173	30%	0.303	C	S	.	.	H	α-helix	trans	-63.1	-45	-179.4	-176.5	-103.9	0	0	0	112.1	L123 K124 I127 L139 E140 S145 L146 L147 F153	L123-Y143 HydrophobicContact CD2-CD2 4.46Å; K124-Y143 HydrophobicContact CB-CE2 4.35Å; I127-Y143 VanDerWaalsContact CD1-CB 3.5Å; I127-Y143 HydrophobicContact CD1-CD1 4.08Å; I127-Y143 HydrophobicContact CD1-CG 3.84Å; I127-Y143 HydrophobicContact CG1-CD1 3.99Å; I127-Y143 HydrophobicContact CG1-CD2 3.9Å; I127-Y143 HydrophobicContact CG1-CE2 4.49Å; I127-Y143 HydrophobicContact CG1-CG 3.62Å; I127-Y143 HydrophobicContact CG2-CD1 4.03Å; I127-Y143 HydrophobicContact CG2-CE1 4.06Å; L139-Y143 WeakPolarHBondContact O-CB 3.27Å; L139-Y143 PolarHBondContact O-N 3.47Å; E140-Y143 PolarHBondContact O-N 3Å; Y143-S145 VanDerWaalsContact C-N 3.32Å; Y143-S145 PolarHBondContact O-N 2.93Å; Y143-L146 PolarHBondContact O-N 2.85Å; Y143-L147 HydrophobicContact CD1-CD1 3.86Å; Y143-L147 HydrophobicContact CD1-CG 4.48Å; Y143-L147 HydrophobicContact CE1-CD1 3.45Å; Y143-L147 VanDerWaalsContact CE1-CD1 3.45Å; Y143-L147 HydrophobicContact CE1-CG 4.22Å; Y143-L147 PolarHBondContact O-N 3.29Å; Y143-F153 HydrophobicContact CD2-CD1 4.37Å; Y143-F153 HydrophobicContact CD2-CD2 4.43Å; Y143-F153 AromaticContact CD2-CE1 3.8Å; Y143-F153 HydrophobicContact CD2-CE1 3.8Å; Y143-F153 AromaticContact CD2-CE2 3.86Å; Y143-F153 HydrophobicContact CD2-CE2 3.86Å; Y143-F153 AromaticContact CD2-CZ 3.51Å; Y143-F153 HydrophobicContact CD2-CZ 3.51Å; Y143-F153 AromaticContact CE2-CD1 3.7Å; Y143-F153 HydrophobicContact CE2-CD1 3.7Å; Y143-F153 AromaticContact CE2-CD2 3.7Å; Y143-F153 HydrophobicContact CE2-CD2 3.7Å; Y143-F153 AromaticContact CE2-CE1 3.6Å; Y143-F153 HydrophobicContact CE2-CE1 3.6Å; Y143-F153 AromaticContact CE2-CE2 3.59Å; Y143-F153 HydrophobicContact CE2-CE2 3.59Å; Y143-F153 AromaticContact CE2-CG 3.75Å; Y143-F153 HydrophobicContact CE2-CG 3.75Å; Y143-F153 AromaticContact CE2-CZ 3.54Å; Y143-F153 HydrophobicContact CE2-CZ 3.54Å
144	A	94.1	Very high	92.4	Very high	55 Å²	55	57.9 Å²	57.9	46%	0.455	31%	0.308	S	S	.	.	H	α-helix	trans	-60.9	-38.8	175	0	0	0	0	0	112.5	E140 Q148	E140-A144 VanDerWaalsContact O-CB 3.31Å; E140-A144 WeakPolarHBondContact O-CB 3.42Å; E140-A144 PolarHBondContact O-N 2.67Å; A144-Q148 WeakPolarHBondContact O-CB 3.4Å; A144-Q148 PolarHBondContact O-N 2.93Å
145	S	93.1	Very high	91.7	Very high	31 Å²	31	58.8 Å²	58.8	22%	0.217	31%	0.305	C	S	.	.	H	α-helix	trans	-65.3	-45.4	174.7	-167.6	0	0	0	0	111.6	K141 I142 Y143 L147 Q148 K149	K141-S145 WeakPolarHBondContact O-CB 3.35Å; K141-S145 PolarHBondContact O-N 3.22Å; I142-S145 PolarHBondContact O-N 3.15Å; Y143-S145 VanDerWaalsContact C-N 3.32Å; Y143-S145 PolarHBondContact O-N 2.93Å; S145-L147 PolarHBondContact O-N 3.03Å; S145-Q148 WeakPolarHBondContact O-CB 3.49Å; S145-Q148 PolarHBondContact O-N 3.41Å; S145-Q148 VanDerWaalsContact O-N 3.16Å; S145-K149 WeakPolarHBondContact O-CD 3.33Å; S145-K149 PolarHBondContact O-N 3.28Å; S145-K149 VanDerWaalsContact O-N 3.1Å; S145-K149 PolarHBondContact OG-NZ 3.31Å
146	L	93.5	Very high	90.5	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-58.7	-46.3	177.1	-68.6	167.2	0	0	0	111.2	L102 L123 I142 Y143 Q148 K149 G150 V151 F153 A586	L102-L146 HydrophobicContact CD2-CD1 3.94Å; L123-L146 HydrophobicContact CD2-CD1 3.57Å; I142-L146 HydrophobicContact CG2-CD1 4.05Å; I142-L146 WeakPolarHBondContact O-CG 3.22Å; I142-L146 PolarHBondContact O-N 3.25Å; Y143-L146 PolarHBondContact O-N 2.85Å; L146-Q148 PolarHBondContact O-N 2.9Å; L146-K149 PolarHBondContact O-N 3.36Å; L146-G150 PolarHBondContact O-N 3.46Å; L146-V151 HydrophobicContact CB-CB 4.1Å; L146-V151 HydrophobicContact CB-CG2 4.23Å; L146-V151 HydrophobicContact CD2-CG2 4.1Å; L146-V151 VanDerWaalsContact O-CB 3.28Å; L146-V151 WeakPolarHBondContact O-CB 3.43Å; L146-V151 WeakPolarHBondContact O-CG2 3.49Å; L146-V151 PolarHBondContact O-N 3.42Å; L146-F153 HydrophobicContact CB-CE2 4.06Å; L146-F153 HydrophobicContact CB-CZ 3.98Å; L146-F153 HydrophobicContact CD1-CZ 3.95Å; L146-A586 HydrophobicContact CD2-CB 3.94Å
147	L	93.4	Very high	89.3	Confident	84 Å²	84	61.4 Å²	61.4	44%	0.44	33%	0.325	S	S	.	.	H	α-helix	trans	-59.5	-43.7	173.4	-72.5	176.8	0	0	0	112.6	Y143 S145 K149 G150 F153	Y143-L147 HydrophobicContact CD1-CD1 3.86Å; Y143-L147 HydrophobicContact CD1-CG 4.48Å; Y143-L147 HydrophobicContact CE1-CD1 3.45Å; Y143-L147 VanDerWaalsContact CE1-CD1 3.45Å; Y143-L147 HydrophobicContact CE1-CG 4.22Å; Y143-L147 PolarHBondContact O-N 3.29Å; S145-L147 PolarHBondContact O-N 3.03Å; L147-K149 PolarHBondContact O-N 3.4Å; L147-G150 WeakPolarHBondContact O-CA 3.45Å; L147-G150 PolarHBondContact O-N 3.29Å; L147-F153 HydrophobicContact CD2-CD2 3.71Å; L147-F153 HydrophobicContact CD2-CE2 3.95Å; L147-F153 HydrophobicContact CG-CD2 4.38Å; L147-F153 HydrophobicContact CG-CE2 4.16Å
148	Q	92.3	Very high	88	Confident	158 Å²	158	54.7 Å²	54.7	74%	0.738	30%	0.301	S	S	*	.	H	α-helix	trans	-61.7	-30.1	179.4	-170.5	-178.1	34.7	0	0	113	A144 S145 L146 G150	A144-Q148 WeakPolarHBondContact O-CB 3.4Å; A144-Q148 PolarHBondContact O-N 2.93Å; S145-Q148 WeakPolarHBondContact O-CB 3.49Å; S145-Q148 PolarHBondContact O-N 3.41Å; S145-Q148 VanDerWaalsContact O-N 3.16Å; L146-Q148 PolarHBondContact O-N 2.9Å; Q148-G150 VanDerWaalsContact C-N 3.3Å
149	K	90.6	Very high	86.4	Confident	56 Å²	56	57.5 Å²	57.5	24%	0.243	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	1.3	172.3	-77.3	108.2	154.1	-153.2	0	114.1	S145 L146 L147 T582 D583 A586 S590	S145-K149 WeakPolarHBondContact O-CD 3.33Å; S145-K149 PolarHBondContact O-N 3.28Å; S145-K149 VanDerWaalsContact O-N 3.1Å; S145-K149 PolarHBondContact OG-NZ 3.31Å; L146-K149 PolarHBondContact O-N 3.36Å; L147-K149 PolarHBondContact O-N 3.4Å; K149-T582 PolarHBondContact NZ-O 2.9Å; K149-D583 WeakPolarHBondContact CE-OD1 3.17Å; K149-D583 IonicContact NZ-OD1 2.69Å; K149-D583 PolarHBondContact NZ-OD1 3.46Å; K149-A586 HydrophobicContact CB-CB 3.56Å; K149-A586 HydrophobicContact CD-CB 3.62Å; K149-A586 HydrophobicContact CG-CB 3.69Å; K149-S590 PolarHBondContact O-OG 3.11Å
150	G	90.5	Very high	84.7	Confident	43 Å²	43	62.1 Å²	62.1	44%	0.443	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.3	16.2	179.5	0	0	0	0	0	115.4	L146 L147 Q148 Q152 S590	L146-G150 PolarHBondContact O-N 3.46Å; L147-G150 WeakPolarHBondContact O-CA 3.45Å; L147-G150 PolarHBondContact O-N 3.29Å; Q148-G150 VanDerWaalsContact C-N 3.3Å; G150-Q152 PolarHBondContact O-N 2.97Å; G150-S590 PolarHBondContact O-OG 3.13Å
151	V	92.1	Very high	82.7	Confident	4 Å²	4	61.6 Å²	61.6	2%	0.024	35%	0.349	C	S	.	.			trans	-68.7	119.3	175.3	-178.9	0	0	0	0	109.1	L120 L146 F153 A586 L589 S590	L120-V151 HydrophobicContact CD1-CG1 4.38Å; L120-V151 HydrophobicContact CD2-CG1 4.12Å; L146-V151 HydrophobicContact CB-CB 4.1Å; L146-V151 HydrophobicContact CB-CG2 4.23Å; L146-V151 HydrophobicContact CD2-CG2 4.1Å; L146-V151 VanDerWaalsContact O-CB 3.28Å; L146-V151 WeakPolarHBondContact O-CB 3.43Å; L146-V151 WeakPolarHBondContact O-CG2 3.49Å; L146-V151 PolarHBondContact O-N 3.42Å; V151-F153 HydrophobicContact CB-CE2 4.48Å; V151-F153 HydrophobicContact CG1-CE2 4.24Å; V151-F153 HydrophobicContact CG1-CZ 4.48Å; V151-A586 HydrophobicContact CG2-CB 3.91Å; V151-L589 HydrophobicContact CG1-CB 4.14Å; V151-L589 HydrophobicContact CG1-CD1 3.95Å; V151-L589 HydrophobicContact CG2-CB 4.02Å; V151-L589 HydrophobicContact CG2-CD1 4.25Å; V151-S590 PolarHBondContact N-OG 2.94Å
152	Q	89.4	Confident	80.8	Confident	110 Å²	110	57.6 Å²	57.6	51%	0.514	33%	0.331	S	S	.	.			trans	-84	140.5	177.2	-61.2	-177.6	12.1	0	0	110.6	G150	G150-Q152 PolarHBondContact O-N 2.97Å
153	F	90.5	Very high	78.5	Confident	30 Å²	30	61.3 Å²	61.3	13%	0.132	35%	0.354	C	S	.	.			trans	-110.1	138.4	-179.6	-77.2	-89.8	0	0	0	111.1	L120 L123 K124 Y143 L146 L147 V151	L120-F153 HydrophobicContact CB-CD1 3.95Å; L120-F153 HydrophobicContact CB-CE1 4.1Å; L120-F153 HydrophobicContact CD2-CD1 4.18Å; L120-F153 HydrophobicContact CD2-CE1 3.57Å; L120-F153 HydrophobicContact CD2-CZ 4.01Å; L120-F153 HydrophobicContact CG-CE1 4.43Å; L120-F153 WeakPolarHBondContact O-CD1 3.26Å; L123-F153 HydrophobicContact CB-CE1 4.36Å; L123-F153 HydrophobicContact CD2-CE1 3.97Å; L123-F153 HydrophobicContact CD2-CZ 4.14Å; K124-F153 HydrophobicContact CB-CD1 4.16Å; K124-F153 HydrophobicContact CD-CB 4.49Å; Y143-F153 HydrophobicContact CD2-CD1 4.37Å; Y143-F153 HydrophobicContact CD2-CD2 4.43Å; Y143-F153 AromaticContact CD2-CE1 3.8Å; Y143-F153 HydrophobicContact CD2-CE1 3.8Å; Y143-F153 AromaticContact CD2-CE2 3.86Å; Y143-F153 HydrophobicContact CD2-CE2 3.86Å; Y143-F153 AromaticContact CD2-CZ 3.51Å; Y143-F153 HydrophobicContact CD2-CZ 3.51Å; Y143-F153 AromaticContact CE2-CD1 3.7Å; Y143-F153 HydrophobicContact CE2-CD1 3.7Å; Y143-F153 AromaticContact CE2-CD2 3.7Å; Y143-F153 HydrophobicContact CE2-CD2 3.7Å; Y143-F153 AromaticContact CE2-CE1 3.6Å; Y143-F153 HydrophobicContact CE2-CE1 3.6Å; Y143-F153 AromaticContact CE2-CE2 3.59Å; Y143-F153 HydrophobicContact CE2-CE2 3.59Å; Y143-F153 AromaticContact CE2-CG 3.75Å; Y143-F153 HydrophobicContact CE2-CG 3.75Å; Y143-F153 AromaticContact CE2-CZ 3.54Å; Y143-F153 HydrophobicContact CE2-CZ 3.54Å; L146-F153 HydrophobicContact CB-CE2 4.06Å; L146-F153 HydrophobicContact CB-CZ 3.98Å; L146-F153 HydrophobicContact CD1-CZ 3.95Å; L147-F153 HydrophobicContact CD2-CD2 3.71Å; L147-F153 HydrophobicContact CD2-CE2 3.95Å; L147-F153 HydrophobicContact CG-CD2 4.38Å; L147-F153 HydrophobicContact CG-CE2 4.16Å; V151-F153 HydrophobicContact CB-CE2 4.48Å; V151-F153 HydrophobicContact CG1-CE2 4.24Å; V151-F153 HydrophobicContact CG1-CZ 4.48Å
154	P	83.9	Confident	76	Confident	28 Å²	28	61.9 Å²	61.9	18%	0.182	37%	0.368	C	S	.	.			trans	-58.6	140.3	179.7	-25.5	35.1	0	0	0	113.2	T117 Y121 K124	T117-P154 HydrophobicContact CG2-CB 4.18Å; T117-P154 HydrophobicContact CG2-CG 3.71Å; Y121-P154 HydrophobicContact CD2-CB 4.33Å; K124-P154 WeakPolarHBondContact CD-O 3.46Å; K124-P154 WeakPolarHBondContact CE-O 3.34Å; K124-P154 PolarHBondContact NZ-O 3.01Å
155	T	76.8	Confident	73.4	Confident	100 Å²	100	66.9 Å²	66.9	61%	0.613	38%	0.38	S	S	*	.	S	Bend	trans	-75.3	-57.3	169.3	43.1	0	0	0	0	110.4	K124	K124-T155 PolarHBondContact NZ-O 2.96Å
156	V	69.4	Low	70.2	Confident	77 Å²	77	71.1 Å²	71.1	47%	0.467	41%	0.407	S	S	.	.	S	Bend	trans	-86.4	156.1	-178.7	-168.9	0	0	0	0	111.5	Y121	Y121-V156 WeakPolarHBondContact CD2-O 3.42Å
157	A	67.9	Low	67.1	Low	33 Å²	33	76.6 Å²	76.6	27%	0.273	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-58.6	150.5	169.3	0	0	0	0	0	112.5	Y121	Y121-A157 HydrophobicContact CE1-CB 3.8Å; Y121-A157 HydrophobicContact CE2-CB 4.24Å; Y121-A157 VanDerWaalsContact CZ-CA 3.49Å
158	P	66.9	Low	64.2	Low	16 Å²	16	84.3 Å²	84.3	10%	0.104	47%	0.468	C	S	.	.	P	Polyproline II helix	trans	-64.7	150.4	164.6	32.5	-37.3	0	0	0	110.1	W71 T117 K118 Y121 D160	W71-P158 HydrophobicContact CH2-CB 4.42Å; T117-P158 HydrophobicContact CG2-CB 4.14Å; K118-P158 HydrophobicContact CB-CB 4.16Å; K118-P158 HydrophobicContact CB-CG 3.79Å; K118-P158 HydrophobicContact CD-CG 3.99Å; K118-P158 HydrophobicContact CG-CG 3.83Å; Y121-P158 HydrophobicContact CD1-CG 4.4Å; P158-D160 PolarHBondContact O-N 3.25Å
159	V	59.1	Low	61.2	Low	112 Å²	112	79.7 Å²	79.7	68%	0.679	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-66.7	128.6	168.1	-172.6	0	0	0	0	108.6	W71 C161	W71-V159 WeakPolarHBondContact CZ2-O 3.05Å; V159-C161 PolarHBondContact O-N 2.98Å
160	D	58	Low	58.3	Low	98 Å²	98	85.8 Å²	85.8	52%	0.524	50%	0.497	S	S	.	.	S	Bend	trans	-75.6	51.3	179.8	-80.4	-44.7	0	0	0	113.4	K118 P158	K118-D160 IonicContact NZ-OD1 2.79Å; K118-D160 PolarHBondContact NZ-OD1 3.44Å; P158-D160 PolarHBondContact O-N 3.25Å
161	C	52.6	Low	55.4	Low	70 Å²	70	93.6 Å²	93.6	47%	0.473	51%	0.513	S	S	.	.			trans	-142.4	113.8	167.4	66	0	0	0	0	111.9	V159 V163	V159-C161 PolarHBondContact O-N 2.98Å; C161-V163 PolarHBondContact O-N 3.41Å
162	Y	54.9	Low	52.3	Low	44 Å²	44	100.3 Å²	100.3	17%	0.173	55%	0.549	C	S	.	.			trans	-81.5	82.7	173.3	-174.4	-98.9	0	0	0	111.2	N67 V68 W71 P112 A164	N67-Y162 HydrophobicContact CB-CE1 4.02Å; N67-Y162 HydrophobicContact CB-CE2 4.13Å; N67-Y162 WeakPolarHBondContact CB-OH 3.27Å; V68-Y162 HydrophobicContact CG2-CD1 3.89Å; V68-Y162 HydrophobicContact CG2-CE1 3.92Å; W71-Y162 HydrophobicContact CB-CG 4.3Å; W71-Y162 HydrophobicContact CD2-CD2 4.3Å; W71-Y162 HydrophobicContact CD2-CG 4.3Å; W71-Y162 AromaticContact CE3-CD2 3.95Å; W71-Y162 HydrophobicContact CE3-CD2 3.95Å; W71-Y162 HydrophobicContact CE3-CG 4.4Å; W71-Y162 HydrophobicContact CG-CG 4.27Å; W71-Y162 HydrophobicContact CZ3-CD2 4.43Å; P112-Y162 HydrophobicContact CB-CE2 4.11Å; P112-Y162 HydrophobicContact CG-CE2 4.08Å; P112-Y162 WeakPolarHBondContact CG-OH 3.35Å; Y162-A164 HydrophobicContact CE1-CB 3.98Å; Y162-A164 PolarHBondContact O-N 3.16Å
163	V	44.4	Very low	49.6	Very low	94 Å²	94	100.6 Å²	100.6	57%	0.57	56%	0.563	S	S	*	*			trans	-71.6	101.3	169.2	-175.5	0	0	0	0	109.1	Q114 C161 K165	Q114-V163 PolarHBondContact NE2-O 2.98Å; C161-V163 PolarHBondContact O-N 3.41Å; V163-K165 PolarHBondContact O-N 3.24Å
164	A	43.5	Very low	46.7	Very low	57 Å²	57	107.5 Å²	107.5	47%	0.471	60%	0.6	S	S	.	*	P	Polyproline II helix	trans	-57.8	128.1	169.9	0	0	0	0	0	109.8	Y162	Y162-A164 HydrophobicContact CE1-CB 3.98Å; Y162-A164 PolarHBondContact O-N 3.16Å
165	K	38.1	Very low	44.4	Very low	159 Å²	159	112.8 Å²	112.8	69%	0.691	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-57.7	131.8	178.7	-71.8	179.3	178.3	175.1	0	109.7	V163 S167	V163-K165 PolarHBondContact O-N 3.24Å; K165-S167 PolarHBondContact O-N 2.93Å
166	P	26	Very low	42.2	Very low	121 Å²	121	114 Å²	114	79%	0.786	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-54	117.6	172.8	-26.5	34.7	0	0	0	110.2
167	S	29.9	Very low	40.5	Very low	115 Å²	115	115 Å²	115	80%	0.804	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-62.9	139.9	178.5	-167.1	0	0	0	0	109.3	K165 G169	K165-S167 PolarHBondContact O-N 2.93Å; S167-G169 PolarHBondContact O-N 3.48Å
168	R	30.6	Very low	38.8	Very low	245 Å²	245	122.5 Å²	122.5	93%	0.925	68%	0.676	S	S	*	*	S	Bend	trans	-74.2	70.2	-174.1	-70	-178.5	174.3	176.8	-2.3	111
169	G	29.9	Very low	37.3	Very low	61 Å²	61	128.7 Å²	128.7	63%	0.629	71%	0.714	S	S	*	*			trans	-128.6	10.6	-163.4	0	0	0	0	0	116.1	S167	S167-G169 PolarHBondContact O-N 3.48Å
170	L	30.7	Very low	36.1	Very low	184 Å²	184	127.2 Å²	127.2	96%	0.963	72%	0.722	S	S	*	*			trans	-126.7	110	163.4	-99	119.7	0	0	0	109.9
171	R	28.5	Very low	34.9	Very low	207 Å²	207	130 Å²	130	78%	0.781	74%	0.735	S	S	*	*			trans	-135	151.7	169.3	39.5	-177.3	155.4	-170.4	-5	107
172	D	28.6	Very low	34	Very low	146 Å²	146	133 Å²	133	78%	0.781	75%	0.751	S	S	*	*			trans	69.5	72.5	168.7	-44.6	-38.8	0	0	0	117.2
173	S	31.6	Very low	33.2	Very low	115 Å²	115	140.1 Å²	140.1	80%	0.804	78%	0.783	S	S	*	*			trans	-161.2	52.5	147.2	-83.5	0	0	0	0	113.7
174	L	29.4	Very low	32.8	Very low	175 Å²	175	141.6 Å²	141.6	92%	0.916	80%	0.795	S	S	*	*			trans	-105.8	88.6	154.4	-101.8	75.8	0	0	0	108.6
175	V	35.9	Very low	32.2	Very low	140 Å²	140	149.1 Å²	149.1	85%	0.848	81%	0.811	S	S	*	*			trans	-103.4	108.1	168.4	178.5	0	0	0	0	108.5
176	T	31.4	Very low	32.1	Very low	124 Å²	124	147.5 Å²	147.5	76%	0.761	82%	0.815	S	S	*	*			trans	-70.7	129	179.6	-47.8	0	0	0	0	111.3
177	S	31.9	Very low	32.6	Very low	99 Å²	99	145 Å²	145	69%	0.692	81%	0.811	S	S	*	*				153.4	113.3	129.7	-70.7	0	0	0	0	115.2
178	K	33.3	Very low	33.3	Very low	190 Å²	190	145.7 Å²	145.7	83%	0.826	81%	0.813	S	S	*	*			trans	43	128.9	131.3	-62.4	-179.3	176.4	179.2	0	121.6
179	T	34.3	Very low	33.6	Very low	147 Å²	147	141.8 Å²	141.8	90%	0.902	81%	0.805	S	S	*	*			trans	64.7	116.8	142.4	52.5	0	0	0	0	120.3
180	G	34	Very low	34	Very low	81 Å²	81	145.5 Å²	145.5	84%	0.835	81%	0.806	S	S	*	*			trans	178.8	130.5	163.2	0	0	0	0	0	111.6
181	I	32.6	Very low	34.3	Very low	157 Å²	157	143.1 Å²	143.1	81%	0.805	79%	0.794	S	S	*	*			trans	-114.7	145.4	-177.2	-63.8	166.5	0	0	0	109.3
182	T	35.1	Very low	34.8	Very low	132 Å²	132	139.6 Å²	139.6	81%	0.81	79%	0.787	S	S	*	*			trans	164.3	141.1	134.1	-70.7	0	0	0	0	112.9
183	F	37.9	Very low	35.2	Very low	193 Å²	193	140.1 Å²	140.1	85%	0.846	78%	0.782	S	S	*	*			trans	-100.3	156.6	175.2	-64.6	-95.4	0	0	0	112.4
184	P	35.9	Very low	35.4	Very low	126 Å²	126	141.9 Å²	141.9	82%	0.818	78%	0.782	S	S	*	*				-152.9	-171.4	110.7	38.8	-21.5	0	0	0	115.1
185	R	31.3	Very low	35.9	Very low	214 Å²	214	139.7 Å²	139.7	81%	0.808	78%	0.778	S	S	*	*				-175.7	113.1	-56.6	-174.4	-143.3	-179.4	-153.8	0.5	111.9
186	T	36.3	Very low	35.9	Very low	126 Å²	126	136.6 Å²	136.6	77%	0.773	77%	0.774	S	S	*	*			trans	62	159	164.3	49.1	0	0	0	0	118.2
187	G	36.8	Very low	35.9	Very low	69 Å²	69	142.2 Å²	142.2	71%	0.711	78%	0.781	S	S	*	*			cis	-159.9	-165.1	11.9	0	0	0	0	0	115.6
188	P	43.2	Very low	36	Very low	128 Å²	128	143 Å²	143	83%	0.831	79%	0.787	S	S	*	*			trans	-133.8	172.9	-152.8	43.9	-29.9	0	0	0	118.5
189	Q	37.9	Very low	36	Very low	164 Å²	164	139.3 Å²	139.3	77%	0.766	78%	0.78	S	S	*	*			trans	-164.1	130.1	146.2	-106.3	-173.1	-43.4	0	0	109.5
190	E	37.2	Very low	35.7	Very low	139 Å²	139	138.2 Å²	138.2	65%	0.65	77%	0.773	S	S	*	*				64.5	136.5	98.2	-67.7	-165.2	111.6	0	0	115.9
191	N	36.6	Very low	35.6	Very low	134 Å²	134	141.1 Å²	141.1	72%	0.717	77%	0.768	S	S	*	*			cis	-156.8	-178.4	-10.8	-87.2	-32.3	0	0	0	106.7
192	E	39.1	Very low	35.3	Very low	132 Å²	132	142.7 Å²	142.7	62%	0.617	77%	0.769	S	S	*	*			cis	-158.3	177.8	11.5	-155.7	-119.3	121.2	0	0	111.3
193	K	37.4	Very low	35.3	Very low	158 Å²	158	141 Å²	141	69%	0.687	76%	0.762	S	S	*	*			trans	76.9	138.2	155.5	-133.6	162.1	-134.9	73.3	0	122.1
194	L	37	Very low	35.1	Very low	152 Å²	152	137.4 Å²	137.4	80%	0.796	76%	0.761	S	S	*	*			trans	-114	-170.5	-169.6	-58.1	84.5	0	0	0	111.3
195	P	39.6	Very low	34.6	Very low	128 Å²	128	135 Å²	135	83%	0.831	76%	0.759	S	S	*	*			cis	-128.5	167.1	-19.1	19.4	4.3	0	0	0	114.4
196	G	35.3	Very low	34.7	Very low	75 Å²	75	131.4 Å²	131.4	77%	0.773	76%	0.761	S	S	*	*			trans	-162.5	22.4	-178.8	0	0	0	0	0	120.3
197	R	31.8	Very low	34.3	Very low	243 Å²	243	134.2 Å²	134.2	92%	0.917	77%	0.766	S	S	*	*			trans	25.6	92.3	166.6	-169.4	-177.5	-175.7	167.5	1.2	117.7
198	S	34.1	Very low	34.2	Very low	115 Å²	115	136 Å²	136	80%	0.804	77%	0.767	S	S	*	*			trans	-126.4	144.4	155.7	-172.6	0	0	0	0	110.1
199	V	32	Very low	33.3	Very low	113 Å²	113	137.4 Å²	137.4	69%	0.685	77%	0.768	S	S	*	*			trans	-106.9	119.4	-172.6	176.8	0	0	0	0	109.8	I201	V199-I201 HydrophobicContact CG1-CG1 4.2Å
200	V	28.5	Very low	33.1	Very low	123 Å²	123	137.7 Å²	137.7	75%	0.745	77%	0.773	S	S	*	*			trans	-116.2	111.2	168.9	177.6	0	0	0	0	107.9
201	I	32.9	Very low	32.6	Very low	143 Å²	143	138.1 Å²	138.1	73%	0.733	77%	0.774	S	S	*	*			trans	-80.9	125.4	170.8	-61.6	178.3	0	0	0	108	V199	V199-I201 HydrophobicContact CG1-CG1 4.2Å
202	K	26.3	Very low	32.4	Very low	190 Å²	190	139.2 Å²	139.2	83%	0.826	78%	0.78	S	S	*	*			trans	-109.7	129	163.1	-73.8	-175.7	177.7	-179.6	0	108.7
203	S	34.5	Very low	31.9	Very low	96 Å²	96	139.2 Å²	139.2	67%	0.671	78%	0.779	S	S	*	*			trans	-141.6	110.1	159.7	-52.1	0	0	0	0	105.9
204	S	32.9	Very low	31.4	Very low	117 Å²	117	137.1 Å²	137.1	82%	0.818	78%	0.775	S	S	*	*				53.1	87.1	70.8	77.5	0	0	0	0	110.8
205	G	27.1	Very low	31.2	Very low	76 Å²	76	137.6 Å²	137.6	78%	0.784	77%	0.773	S	S	*	*			trans	-91.8	168.4	175.5	0	0	0	0	0	112.7
206	T	33.3	Very low	30.8	Very low	139 Å²	139	138.8 Å²	138.8	85%	0.853	77%	0.772	S	S	*	*			trans	-140.7	141.1	161	40.2	0	0	0	0	108.8
207	E	26.4	Very low	30.5	Very low	185 Å²	185	141.1 Å²	141.1	86%	0.864	77%	0.773	S	S	*	*			trans	-79.5	144.2	177.8	-171.1	169	-149.1	0	0	110.1
208	S	34.7	Very low	30.4	Very low	107 Å²	107	136 Å²	136	75%	0.748	76%	0.763	S	S	*	*			trans	-161.2	95.7	177.8	-71.2	0	0	0	0	111.8
209	D	25.3	Very low	30.2	Very low	156 Å²	156	137.9 Å²	137.9	83%	0.834	76%	0.764	S	S	*	*			trans	-68.7	130.4	162.9	-78.1	-56.8	0	0	0	110.6
210	I	33.2	Very low	30.2	Very low	170 Å²	170	137.2 Å²	137.2	87%	0.872	76%	0.762	S	S	*	*			trans	-131.2	135.8	154.4	-62.4	-174.9	0	0	0	108.2
211	H	27	Very low	30.3	Very low	148 Å²	148	137.2 Å²	137.2	69%	0.685	77%	0.767	S	S	*	*			trans	-120.3	139.8	-163.1	-171.7	76.9	0	0	0	110.6	H213	H211-H213 AromaticContact NE2-CE1 3.74Å; H211-H213 AromaticContact NE2-ND1 3.68Å
212	L	32.2	Very low	29.9	Very low	158 Å²	158	135.8 Å²	135.8	83%	0.827	77%	0.77	S	S	*	*			trans	169	120.1	158.1	-89.3	148.5	0	0	0	105.9
213	H	27.6	Very low	30.1	Very low	132 Å²	132	131.3 Å²	131.3	61%	0.611	76%	0.763	S	S	*	*				53.2	133.8	74.5	-75.2	71.8	0	0	0	112.9	H211	H211-H213 AromaticContact NE2-CE1 3.74Å; H211-H213 AromaticContact NE2-ND1 3.68Å
214	N	28.1	Very low	29.9	Very low	113 Å²	113	133.9 Å²	133.9	60%	0.604	77%	0.767	S	S	*	*			cis	-162.9	168.6	26.8	-141.6	-14.4	0	0	0	115.8
215	H	31.7	Very low	29.8	Very low	162 Å²	162	132.9 Å²	132.9	75%	0.75	76%	0.756	S	S	*	*			trans	69.5	116.2	158.5	-62.5	-55.5	0	0	0	123.3
216	L	31.1	Very low	30.1	Very low	153 Å²	153	135 Å²	135	80%	0.801	75%	0.749	S	S	*	*			trans	-95.7	161.8	151.9	-83.6	161.4	0	0	0	109.3
217	P	30.9	Very low	30.1	Very low	124 Å²	124	133 Å²	133	81%	0.805	73%	0.733	S	S	*	*				-152	129.8	93.9	36.7	-16.9	0	0	0	118.2
218	I	29.8	Very low	30.8	Very low	137 Å²	137	125.9 Å²	125.9	70%	0.703	70%	0.703	S	S	*	*			trans	9.3	122	138.3	-51.2	165.1	0	0	0	118.5
219	N	28.9	Very low	30.8	Very low	154 Å²	154	122.2 Å²	122.2	82%	0.824	68%	0.677	S	S	*	*			trans	-154.4	137.8	133.6	-152.6	17.3	0	0	0	110.2
220	P	31.2	Very low	31.7	Very low	99 Å²	99	116.3 Å²	116.3	64%	0.643	65%	0.648	S	S	*	*			trans	-104.3	126.8	-174.7	35.4	-27.4	0	0	0	113.6
221	S	30.5	Very low	32.3	Very low	123 Å²	123	109.8 Å²	109.8	86%	0.86	62%	0.616	S	S	*	*			trans	-133.5	147.4	167.4	-75.9	0	0	0	0	111.2
222	S	25.9	Very low	32.9	Very low	113 Å²	113	104 Å²	104	79%	0.79	59%	0.592	S	S	*	*			trans	-78.2	126	-171.7	50	0	0	0	0	114.6
223	S	29.6	Very low	33.3	Very low	96 Å²	96	101 Å²	101	67%	0.671	57%	0.573	S	S	*	*			trans	-140.4	123.7	145.5	-70	0	0	0	0	108.9	V225	S223-V225 PolarHBondContact O-N 3.44Å
224	I	30.8	Very low	33.6	Very low	149 Å²	149	98.5 Å²	98.5	76%	0.764	57%	0.569	S	S	*	*			trans	-95.7	88.9	177.3	-59.5	178.2	0	0	0	107.7	L226	I224-L226 HydrophobicContact CG2-CD2 4.09Å; I224-L226 HydrophobicContact CG2-CG 4.33Å; I224-L226 PolarHBondContact O-N 3.1Å
225	V	31.5	Very low	33.9	Very low	96 Å²	96	97.9 Å²	97.9	58%	0.582	57%	0.57	S	S	*	*			trans	-68.4	112.8	173.7	-176.8	0	0	0	0	108.6	S223	S223-V225 PolarHBondContact O-N 3.44Å
226	L	32.5	Very low	34.2	Very low	120 Å²	120	97.7 Å²	97.7	63%	0.628	57%	0.569	S	S	*	*			trans	-93.4	100.1	178.2	-70.9	173.8	0	0	0	109.3	I224	I224-L226 HydrophobicContact CG2-CD2 4.09Å; I224-L226 HydrophobicContact CG2-CG 4.33Å; I224-L226 PolarHBondContact O-N 3.1Å
227	N	33.6	Very low	34.2	Very low	99 Å²	99	99.7 Å²	99.7	53%	0.529	57%	0.574	S	S	.	*			trans	-57.6	134.7	172.7	-70.6	0.7	0	0	0	110.5
228	P	39.9	Very low	34.3	Very low	34 Å²	34	97.4 Å²	97.4	22%	0.221	56%	0.561	C	S	.	*			trans	-66.6	179.4	176.8	27.7	-34.3	0	0	0	112.6	I412 Q413	P228-I412 HydrophobicContact CG-CG2 4.19Å; P228-Q413 HydrophobicContact CG-CB 4.02Å
229	C	35.3	Very low	34.2	Very low	30 Å²	30	98 Å²	98	20%	0.203	57%	0.566	C	S	.	*			trans	-108.1	102.9	-169.7	-173.2	0	0	0	0	112.2	Y121 V231 C232 H233	Y121-C229 PolarHBondContact OH-SG 3.27Å; C229-V231 PolarHBondContact O-N 3.27Å; C229-C232 PolarHBondContact O-N 3.07Å; C229-H233 PolarHBondContact O-N 2.88Å
230	S	44.1	Very low	34.3	Very low	33 Å²	33	98.2 Å²	98.2	23%	0.231	57%	0.565	C	S	.	*	T	Hydrogen-bonded Turn	trans	-51.9	-3.3	176.8	-13.6	0	0	0	0	116.7	E416	S230-E416 WeakPolarHBondContact CB-OE1 3.38Å; S230-E416 PolarHBondContact N-OE2 2.93Å; S230-E416 PolarHBondContact OG-OE1 2.9Å
231	V	45.7	Very low	34.2	Very low	33 Å²	33	100.9 Å²	100.9	20%	0.2	57%	0.569	C	S	.	*	T	Hydrogen-bonded Turn	trans	-123.5	-12	-164.9	179.6	0	0	0	0	113	Y121 C125 C229	Y121-V231 HydrophobicContact CE1-CB 4.33Å; Y121-V231 HydrophobicContact CE1-CG2 3.81Å; Y121-V231 WeakPolarHBondContact OH-CG2 3.42Å; C125-V231 HydrophobicContact CB-CG1 3.82Å; C229-V231 PolarHBondContact O-N 3.27Å
232	C	40.4	Very low	34	Very low	27 Å²	27	100.4 Å²	100.4	18%	0.182	57%	0.566	C	S	.	*	T	Hydrogen-bonded Turn	trans	-141.9	-9.8	177.2	62.3	0	0	0	0	116.8	C229 C234	C229-C232 PolarHBondContact O-N 3.07Å; C232-C234 PolarHBondContact O-N 2.84Å; C232-C234 PolarHBondContact O-SG 3.39Å; C232-C234 VanDerWaalsContact O-SG 3.39Å
233	H	39.7	Very low	34	Very low	95 Å²	95	103.3 Å²	103.3	44%	0.44	57%	0.571	S	S	.	*			trans	56.9	-2	-176.1	-60.2	-100.2	0	0	0	116.5	C229 T235 N417	C229-H233 PolarHBondContact O-N 2.88Å; H233-T235 PolarHBondContact O-N 3.23Å; H233-T235 VanDerWaalsContact O-N 3.13Å; H233-N417 PolarHBondContact CE1-OD1 2.99Å; H233-N417 PolarHBondContact ND1-OD1 2.96Å
234	C	35.5	Very low	34	Very low	78 Å²	78	102 Å²	102	53%	0.527	57%	0.567	S	S	.	*			trans	-73.1	104.3	-179.1	-59.5	0	0	0	0	111.8	C232	C232-C234 PolarHBondContact O-N 2.84Å; C232-C234 PolarHBondContact O-SG 3.39Å; C232-C234 VanDerWaalsContact O-SG 3.39Å
235	T	33.6	Very low	33.7	Very low	100 Å²	100	100.2 Å²	100.2	61%	0.613	57%	0.566	S	S	*	*			trans	-71.3	133.8	156.4	45	0	0	0	0	109.5	H233	H233-T235 PolarHBondContact O-N 3.23Å; H233-T235 VanDerWaalsContact O-N 3.13Å
236	H	37.2	Very low	33.7	Very low	158 Å²	158	104.7 Å²	104.7	73%	0.731	58%	0.58	S	S	*	*			trans	-154.8	100.2	164.2	-154.1	-64.4	0	0	0	110.7	S238	H236-S238 PolarHBondContact ND1-OG 2.98Å; H236-S238 PolarHBondContact O-N 3.45Å
237	E	30.9	Very low	33.5	Very low	196 Å²	196	106.1 Å²	106.1	92%	0.916	59%	0.589	S	S	*	*			trans	-69.1	118.7	162.4	-64.4	-171.3	107.7	0	0	109.1
238	S	34.5	Very low	33.3	Very low	76 Å²	76	109.8 Å²	109.8	53%	0.531	61%	0.607	S	S	.	*			trans	-165.9	120.9	157.8	53.1	0	0	0	0	110.9	H236 I240	H236-S238 PolarHBondContact ND1-OG 2.98Å; H236-S238 PolarHBondContact O-N 3.45Å; S238-I240 PolarHBondContact O-N 3.11Å; S238-I240 VanDerWaalsContact O-N 3.14Å
239	N	27.5	Very low	32.7	Very low	150 Å²	150	113.2 Å²	113.2	80%	0.802	63%	0.632	S	S	*	*			trans	-47	115	165.1	-106.3	-71.6	0	0	0	111.2
240	I	30.6	Very low	32.5	Very low	157 Å²	157	117.5 Å²	117.5	81%	0.805	66%	0.662	S	S	*	*			trans	-108.4	88.8	156.2	-58.9	-176.1	0	0	0	106.9	S238	S238-I240 PolarHBondContact O-N 3.11Å; S238-I240 VanDerWaalsContact O-N 3.14Å
241	Q	29.2	Very low	31.7	Very low	156 Å²	156	125.2 Å²	125.2	73%	0.729	69%	0.692	S	S	*	*			trans	-62	147.5	168.9	-73.5	-177.1	-22.3	0	0	110.1	L243	Q241-L243 PolarHBondContact O-N 3.35Å; Q241-L243 VanDerWaalsContact O-N 3.12Å
242	S	25.3	Very low	31.1	Very low	112 Å²	112	128.8 Å²	128.8	78%	0.783	72%	0.716	S	S	*	*			trans	-60	113.5	178.5	-178.2	0	0	0	0	111.6
243	L	27	Very low	30.5	Very low	174 Å²	174	133.9 Å²	133.9	91%	0.911	74%	0.741	S	S	*	*			trans	-105.7	74.2	161	-80.7	172.7	0	0	0	109.5	Q241	Q241-L243 PolarHBondContact O-N 3.35Å; Q241-L243 VanDerWaalsContact O-N 3.12Å
244	A	30.1	Very low	30.3	Very low	69 Å²	69	137.6 Å²	137.6	57%	0.57	76%	0.762	S	S	*	*			trans	-60.8	147.4	165.2	0	0	0	0	0	110.9	H246	A244-H246 PolarHBondContact O-N 2.96Å
245	C	24.6	Very low	30.1	Very low	112 Å²	112	142 Å²	142	76%	0.757	78%	0.775	S	S	*	*			trans	-61.8	120.9	-171.8	-53.9	0	0	0	0	113.1
246	H	31	Very low	30.2	Very low	189 Å²	189	142.5 Å²	142.5	88%	0.875	78%	0.78	S	S	*	*			trans	-124.5	124	158.1	-83.4	-83.2	0	0	0	111	A244	A244-H246 PolarHBondContact O-N 2.96Å
247	N	27	Very low	30	Very low	151 Å²	151	142.3 Å²	142.3	81%	0.807	78%	0.784	S	S	*	*			trans	-66.2	148.8	173.9	-59.3	-77.4	0	0	0	110.7
248	L	30.3	Very low	30.2	Very low	175 Å²	175	137.9 Å²	137.9	92%	0.916	78%	0.775	S	S	*	*				-166.3	147	114.6	-101.5	160.2	0	0	0	111.4
249	S	26.3	Very low	30.1	Very low	107 Å²	107	139.2 Å²	139.2	75%	0.748	78%	0.784	S	S	*	*			trans	-84.4	135.8	-179.6	178.8	0	0	0	0	111.3
250	S	31.2	Very low	30.3	Very low	119 Å²	119	137.3 Å²	137.3	83%	0.832	78%	0.783	S	S	*	*			trans	-176.4	126.2	135.8	-81.3	0	0	0	0	112.8
251	K	27.8	Very low	30.2	Very low	195 Å²	195	136.3 Å²	136.3	85%	0.848	78%	0.784	S	S	*	*			trans	-101.7	160.5	156.5	-108.4	-179.2	-179.5	-179.1	0	107
252	P	33	Very low	30.3	Very low	109 Å²	109	134.2 Å²	134.2	71%	0.708	79%	0.786	S	S	*	*				-152.6	173.3	52.8	41.9	-21.2	0	0	0	119
253	N	29	Very low	30.4	Very low	133 Å²	133	133.3 Å²	133.3	71%	0.711	78%	0.78	S	S	*	*			trans	35.6	133.3	145	-60.6	-7.1	0	0	0	122.8
254	I	34	Very low	30.4	Very low	173 Å²	173	136.6 Å²	136.6	89%	0.887	78%	0.782	S	S	*	*				-155.1	161.3	112	-100.2	154.2	0	0	0	109.5
255	H	32.5	Very low	30.5	Very low	171 Å²	171	140.4 Å²	140.4	79%	0.792	79%	0.792	S	S	*	*			trans	-86.3	163.1	-164.6	-98.6	-115.8	0	0	0	116.1
256	P	35.5	Very low	30.6	Very low	110 Å²	110	145.2 Å²	145.2	71%	0.714	80%	0.795	S	S	*	*			trans	-95.6	173.8	-179.1	39.8	-36.9	0	0	0	114.1
257	N	33.3	Very low	30.5	Very low	155 Å²	155	141.4 Å²	141.4	83%	0.829	79%	0.789	S	S	*	*			trans	-158.7	142.3	165.3	-116.7	-20.9	0	0	0	113.6
258	S	33.4	Very low	30.5	Very low	103 Å²	103	140.7 Å²	140.7	72%	0.72	78%	0.784	S	S	*	*			trans	34.1	148	147.3	61.3	0	0	0	0	123.1
259	S	32.4	Very low	30.4	Very low	104 Å²	104	144 Å²	144	73%	0.727	79%	0.785	S	S	*	*			cis	-178.6	-176	-10.9	57.2	0	0	0	0	110.4
260	S	31.9	Very low	30.3	Very low	109 Å²	109	146.2 Å²	146.2	76%	0.762	79%	0.788	S	S	*	*			trans	73.2	132.3	178.6	75.4	0	0	0	0	116.4
261	V	28.8	Very low	30.2	Very low	137 Å²	137	147.3 Å²	147.3	83%	0.83	79%	0.789	S	S	*	*			cis	111.4	101.2	5.6	179	0	0	0	0	115.1
262	S	31	Very low	30.1	Very low	111 Å²	111	145.9 Å²	145.9	78%	0.776	79%	0.785	S	S	*	*			trans	-178.7	106.4	147.5	-172.8	0	0	0	0	107.8
263	S	28.4	Very low	29.9	Very low	93 Å²	93	149.7 Å²	149.7	65%	0.65	79%	0.791	S	S	*	*				68.4	101.2	57.3	-60.2	0	0	0	0	115.1
264	Y	27.3	Very low	29.7	Very low	243 Å²	243	149.6 Å²	149.6	95%	0.953	79%	0.79	S	S	*	*			trans	-155.8	168.4	137.1	-119	-81.6	0	0	0	110.9
265	N	31.4	Very low	29.5	Very low	149 Å²	149	148.2 Å²	148.2	80%	0.797	79%	0.785	S	S	*	*			trans	-129.5	172.5	-144.7	-135.3	-36.2	0	0	0	116.9
266	R	26.5	Very low	29.3	Very low	213 Å²	213	146 Å²	146	80%	0.804	78%	0.784	S	S	*	*			trans	-72.2	153.2	-174	-57.8	173	172.6	-173.9	-2.7	115.7
267	S	28.9	Very low	28.9	Very low	109 Å²	109	148 Å²	148	76%	0.762	79%	0.787	S	S	*	*				180	123.9	127.1	-78.4	0	0	0	0	109.5
268	I	26.9	Very low	28.9	Very low	137 Å²	137	149 Å²	149	70%	0.703	79%	0.786	S	S	*	*				64.2	110.5	70.4	-59.9	171.8	0	0	0	114
269	R	28.9	Very low	28.6	Very low	244 Å²	244	151.2 Å²	151.2	92%	0.921	79%	0.79	S	S	*	*			trans	-169.2	152.4	134.9	-104.2	167.9	-159.1	-159.9	4.8	111.9
270	N	24.3	Very low	28.3	Very low	154 Å²	154	158.1 Å²	158.1	82%	0.824	80%	0.8	S	S	*	*			trans	-98.2	170.8	178.2	-53.1	-20.2	0	0	0	110.9
271	V	29.5	Very low	28.1	Very low	142 Å²	142	157.9 Å²	157.9	86%	0.861	80%	0.799	S	S	*	*				172.8	146.4	124.4	149.9	0	0	0	0	111.5
272	H	25.8	Very low	28.3	Very low	165 Å²	165	159.3 Å²	159.3	76%	0.764	80%	0.797	S	S	*	*			trans	-81.2	157.3	172.8	-68.3	-46.2	0	0	0	112.9
273	F	29	Very low	28.2	Very low	189 Å²	189	159.2 Å²	159.2	83%	0.829	80%	0.796	S	S	*	*				-175.2	166	101.6	-117.5	-93.6	0	0	0	113.3
274	N	24.2	Very low	28.1	Very low	130 Å²	130	159.9 Å²	159.9	70%	0.695	80%	0.801	S	S	*	*			trans	-73.8	158.6	173.1	-59.7	-16.8	0	0	0	111.7
275	D	29.5	Very low	28.4	Very low	145 Å²	145	155.1 Å²	155.1	78%	0.775	80%	0.796	S	S	*	*				174.7	147.9	102.7	-96.6	-21.7	0	0	0	116.6
276	T	29.1	Very low	28.1	Very low	124 Å²	124	154.3 Å²	154.3	76%	0.761	79%	0.791	S	S	*	*			trans	68.5	133.4	149.7	-57.9	0	0	0	0	121.8
277	I	26.4	Very low	28.4	Very low	152 Å²	152	150.1 Å²	150.1	78%	0.779	79%	0.791	S	S	*	*			trans	-87.6	137.2	174.6	-64.1	162.1	0	0	0	111.3
278	Q	32.6	Very low	28.4	Very low	175 Å²	175	151.1 Å²	151.1	82%	0.818	79%	0.788	S	S	*	*			trans	-166	127.9	141.7	-115.2	163.1	76.1	0	0	117.1
279	N	27.1	Very low	28.5	Very low	150 Å²	150	152.7 Å²	152.7	80%	0.802	80%	0.798	S	S	*	*			trans	10.3	121.3	152.4	-63	-33.5	0	0	0	121
280	R	27.4	Very low	28.3	Very low	249 Å²	249	145.6 Å²	145.6	94%	0.94	78%	0.784	S	S	*	*			trans	-150.8	157.2	136	-147.5	168.3	-175.7	162.4	0.8	111.4
281	S	27.9	Very low	28.5	Very low	105 Å²	105	144.3 Å²	144.3	73%	0.734	78%	0.782	S	S	*	*			trans	-150	169.7	-174.1	57.7	0	0	0	0	113
282	Q	31.9	Very low	28.4	Very low	167 Å²	167	140.7 Å²	140.7	78%	0.78	76%	0.76	S	S	*	*			trans	99.2	146.3	169.2	-56.3	-174.2	-18.2	0	0	118.8
283	S	30.3	Very low	28.5	Very low	109 Å²	109	137.7 Å²	137.7	76%	0.762	75%	0.748	S	S	*	*			trans	62.1	113.8	172.9	-144	0	0	0	0	117
284	S	26.1	Very low	28.5	Very low	107 Å²	107	133.5 Å²	133.5	75%	0.748	74%	0.737	S	S	*	*			cis	83.3	109.9	25.7	89.9	0	0	0	0	116.7
285	V	32	Very low	28.8	Very low	143 Å²	143	132.8 Å²	132.8	87%	0.867	74%	0.738	S	S	*	*			trans	-144	146.8	157.8	-179.2	0	0	0	0	107.7
286	I	26.7	Very low	28.8	Very low	132 Å²	132	134.3 Å²	134.3	68%	0.677	74%	0.737	S	S	*	*			trans	-136.8	142.7	176.7	-62.9	168	0	0	0	107.6
287	P	32.2	Very low	28.7	Very low	125 Å²	125	133.8 Å²	133.8	81%	0.812	74%	0.739	S	S	*	*			trans	-114.4	147	136.6	-5.9	26	0	0	0	111.3
288	N	29.6	Very low	28.9	Very low	130 Å²	130	133.5 Å²	133.5	70%	0.695	74%	0.739	S	S	*	*			trans	-101.8	155.1	174.4	-37.3	-83.5	0	0	0	109.3
289	D	28.1	Very low	28.9	Very low	170 Å²	170	133.1 Å²	133.1	91%	0.909	74%	0.743	S	S	*	*			trans	-148.9	145.2	132.7	-108.1	-36.7	0	0	0	110.6
290	C	24.6	Very low	29.2	Very low	94 Å²	94	135.3 Å²	135.3	64%	0.635	75%	0.748	S	S	*	*			trans	-127.8	117	-174.4	-72.7	0	0	0	0	111.6
291	T	29.6	Very low	29.2	Very low	128 Å²	128	129 Å²	129	79%	0.785	74%	0.741	S	S	*	*			trans	-116.3	134.8	169.3	-52.6	0	0	0	0	109.4
292	V	26.2	Very low	29.4	Very low	66 Å²	66	129.3 Å²	129.3	40%	0.4	74%	0.744	S	S	.	*			trans	-127.6	137.1	177.3	142.7	0	0	0	0	109.3	V294 Q494	V292-V294 HydrophobicContact CG1-CG2 3.72Å; V292-Q494 HydrophobicContact CG2-CB 4.05Å; V292-Q494 HydrophobicContact CG2-CG 3.56Å; V292-Q494 VanDerWaalsContact CG2-NE2 3.35Å
293	M	28.6	Very low	29.5	Very low	101 Å²	101	126.1 Å²	126.1	50%	0.498	74%	0.74	S	S	.	*			trans	-99	129.3	167.8	-63.6	-78.5	-80.3	0	0	108	M338	M293-M338 HydrophobicContact CE-CE 4.12Å; M293-M338 HydrophobicContact CE-SD 3.54Å; M293-M338 VanDerWaalsContact CE-SD 3.54Å
294	V	28.4	Very low	29.4	Very low	101 Å²	101	129 Å²	129	61%	0.612	75%	0.746	S	S	*	*			trans	-129.8	118.6	167.8	173.1	0	0	0	0	107.1	V292 K296	V292-V294 HydrophobicContact CG1-CG2 3.72Å; V294-K296 HydrophobicContact CG1-CG 4.4Å
295	V	30.8	Very low	29.8	Very low	116 Å²	116	129.2 Å²	129.2	70%	0.703	75%	0.745	S	S	*	*			trans	-99	121.5	167.3	-176.8	0	0	0	0	107.7
296	K	28.9	Very low	29.8	Very low	177 Å²	177	133.1 Å²	133.1	77%	0.77	75%	0.746	S	S	*	*			trans	-120.7	115.6	168.1	-96.2	-164.7	170	-164.5	0	108.6	V294 D298	V294-K296 HydrophobicContact CG1-CG 4.4Å; K296-D298 PolarHBondContact O-N 3.32Å
297	S	28.4	Very low	30	Very low	113 Å²	113	130.9 Å²	130.9	79%	0.79	74%	0.742	S	S	*	*			trans	-91.6	90.4	-179	-54.2	0	0	0	0	110.7
298	D	29.8	Very low	30.2	Very low	145 Å²	145	132.7 Å²	132.7	78%	0.775	74%	0.739	S	S	*	*			trans	-137.8	106.7	170	-87.8	-54.8	0	0	0	108.7	K296	K296-D298 PolarHBondContact O-N 3.32Å
299	N	32.7	Very low	30.4	Very low	168 Å²	168	133.8 Å²	133.8	90%	0.898	74%	0.74	S	S	*	*			trans	-150.3	111	172.3	-144.3	-2.9	0	0	0	111.6
300	Q	32.9	Very low	30.7	Very low	196 Å²	196	130.1 Å²	130.1	92%	0.916	73%	0.728	S	S	*	*			trans	-92.2	152.8	173	-71.1	-172.1	4.2	0	0	110.9
301	S	27.8	Very low	31	Very low	115 Å²	115	134.3 Å²	134.3	80%	0.804	74%	0.738	S	S	*	*			trans	-90.9	145.5	-165.4	48.7	0	0	0	0	114.6
302	S	32.3	Very low	31.3	Very low	113 Å²	113	135.7 Å²	135.7	79%	0.79	74%	0.739	S	S	*	*			trans	-169.4	117.7	143.3	17.5	0	0	0	0	115.8
303	S	32.9	Very low	31.6	Very low	100 Å²	100	140 Å²	140	70%	0.699	75%	0.754	S	S	*	*			trans	57.5	111.7	137.4	61.7	0	0	0	0	124.4
304	L	30	Very low	31.9	Very low	169 Å²	169	143.2 Å²	143.2	89%	0.885	77%	0.768	S	S	*	*				86.2	131.6	125	-63.1	171.2	0	0	0	122.1
305	P	34.6	Very low	32.1	Very low	111 Å²	111	145.8 Å²	145.8	72%	0.721	78%	0.777	S	S	*	*			trans	-114.8	167.4	177.6	42.3	-34.5	0	0	0	115.5
306	Y	30.2	Very low	32.4	Very low	225 Å²	225	145.8 Å²	145.8	88%	0.882	78%	0.78	S	S	*	*			trans	-161.5	111.3	157.6	-116.4	-77.9	0	0	0	116.3
307	S	31.7	Very low	32.7	Very low	85 Å²	85	142.8 Å²	142.8	59%	0.594	78%	0.781	S	S	*	*			trans	33.7	153.9	140.6	-45.8	0	0	0	0	127.8
308	H	36.4	Very low	33.2	Very low	164 Å²	164	142 Å²	142	76%	0.759	78%	0.776	S	S	*	*			trans	84.8	153	156.2	-61.1	-77.1	0	0	0	120.7
309	Q	32.9	Very low	33.6	Very low	152 Å²	152	142 Å²	142	71%	0.71	78%	0.776	S	S	*	*			cis	-173.3	159.8	-32.8	-162.8	175.9	-31.6	0	0	111.1
310	S	34.6	Very low	33.8	Very low	94 Å²	94	141.4 Å²	141.4	66%	0.657	77%	0.772	S	S	*	*			trans	73.9	127.6	163	-52.4	0	0	0	0	117.3
311	Q	32.3	Very low	34	Very low	181 Å²	181	140.9 Å²	140.9	85%	0.846	77%	0.767	S	S	*	*			cis	77.1	118.6	49.4	-73.5	-166	-7.8	0	0	116.6
312	I	35.8	Very low	34.2	Very low	157 Å²	157	146.8 Å²	146.8	81%	0.805	77%	0.773	S	S	*	*				178.7	161.4	126.8	-93.3	156.8	0	0	0	112.2
313	H	32.4	Very low	34.2	Very low	156 Å²	156	151.1 Å²	151.1	72%	0.722	78%	0.781	S	S	*	*			trans	-80.4	171.9	-169.8	-59.2	-106.7	0	0	0	116
314	H	35	Very low	34.3	Very low	170 Å²	170	155.5 Å²	155.5	79%	0.787	79%	0.791	S	S	*	*				176.9	-175.3	105	-84	-58.1	0	0	0	114
315	L	32.3	Very low	34.5	Very low	155 Å²	155	156.5 Å²	156.5	81%	0.812	79%	0.793	S	S	*	*			trans	-99.9	165.8	-151.3	-98.3	70.9	0	0	0	117.2
316	P	36.7	Very low	34.5	Very low	116 Å²	116	158.2 Å²	158.2	75%	0.753	80%	0.796	S	S	*	*			trans	-100.9	179.6	-170.5	40.7	-37.9	0	0	0	115.7
317	S	36.1	Very low	34.9	Very low	113 Å²	113	153.5 Å²	153.5	79%	0.79	79%	0.791	S	S	*	*			trans	-157.3	131.5	167.8	-81	0	0	0	0	116.4
318	S	38.1	Very low	35.1	Very low	97 Å²	97	156.6 Å²	156.6	68%	0.678	80%	0.801	S	S	*	*			trans	68.6	120.6	137.5	-57.5	0	0	0	0	123.6
319	N	37.2	Very low	35	Very low	146 Å²	146	158.9 Å²	158.9	78%	0.781	80%	0.804	S	S	*	*			trans	68.2	131	145.6	-53.7	-23.6	0	0	0	117.9
320	N	37.7	Very low	35	Very low	155 Å²	155	156.7 Å²	156.7	83%	0.829	81%	0.806	S	S	*	*			cis	-150.4	174.2	37.5	-117.8	-40.6	0	0	0	114.6
321	K	37.1	Very low	35.5	Very low	185 Å²	185	159.6 Å²	159.6	80%	0.804	81%	0.811	S	S	*	*			trans	-75.3	137	-176.7	-59.1	168.2	-178.8	173	0	113
322	Y	32.9	Very low	35.8	Very low	238 Å²	238	157.2 Å²	157.2	93%	0.933	80%	0.804	S	S	*	*				-159.5	124.2	116.2	-95.9	-71.3	0	0	0	108.5
323	Q	30.9	Very low	36.2	Very low	204 Å²	204	155.3 Å²	155.3	95%	0.953	80%	0.799	S	S	*	*			trans	-97.1	122.2	177.7	-78.7	176.5	-45	0	0	110.4
324	Q	36.1	Very low	37.1	Very low	192 Å²	192	154.6 Å²	154.6	90%	0.897	80%	0.801	S	S	*	*			trans	-133.1	142.2	157.1	-158	163.6	32.7	0	0	107.5	N326	Q324-N326 PolarHBondContact O-N 2.99Å; Q324-N326 VanDerWaalsContact O-N 3.16Å
325	M	32.7	Very low	38	Very low	191 Å²	191	152.9 Å²	152.9	94%	0.941	80%	0.798	S	S	*	*			trans	-81.8	99	-162.2	-61	179.3	-171.8	0	0	112.1
326	N	35.4	Very low	39.7	Very low	147 Å²	147	149.5 Å²	149.5	79%	0.786	78%	0.78	S	S	*	*			trans	-102.3	122.9	160.9	-88.1	5.4	0	0	0	110	Q324 N328	Q324-N326 PolarHBondContact O-N 2.99Å; Q324-N326 VanDerWaalsContact O-N 3.16Å; N326-N328 PolarHBondContact O-N 3.49Å
327	T	37.4	Very low	41.4	Very low	126 Å²	126	152 Å²	152	77%	0.773	78%	0.782	S	S	*	*			trans	-80.8	101	170.4	46.6	0	0	0	0	109.5	Y329	T327-Y329 PolarHBondContact O-N 3.12Å
328	N	36.3	Very low	43.3	Very low	150 Å²	150	148.9 Å²	148.9	80%	0.802	76%	0.756	S	S	*	*			trans	-68.3	97.7	175.6	-71.4	-5.1	0	0	0	110.7	N326	N326-N328 PolarHBondContact O-N 3.49Å
329	Y	34	Very low	45	Very low	212 Å²	212	149.3 Å²	149.3	83%	0.831	75%	0.747	S	S	*	*			trans	-77.2	113	152.3	-92.1	-93	0	0	0	107.9	T327 M331	T327-Y329 PolarHBondContact O-N 3.12Å; Y329-M331 PolarHBondContact O-N 3.28Å
330	S	34.7	Very low	47	Very low	105 Å²	105	146.5 Å²	146.5	73%	0.734	73%	0.731	S	S	*	*			trans	-78.4	105.8	174.9	-168.9	0	0	0	0	108.7	N332	S330-N332 PolarHBondContact O-N 3.02Å
331	M	43.8	Very low	48.9	Very low	156 Å²	156	140.4 Å²	140.4	77%	0.768	70%	0.699	S	S	*	*			trans	-69.6	113.5	167.3	-66.5	-60.9	-160.4	0	0	108.5	Y329 T333	Y329-M331 PolarHBondContact O-N 3.28Å; M331-T333 HydrophobicContact CB-CG2 4Å; M331-T333 PolarHBondContact O-N 3.29Å
332	N	38.4	Very low	50.7	Low	131 Å²	131	140.9 Å²	140.9	70%	0.701	70%	0.704	S	S	*	*			trans	-74.4	112.7	160.8	-88.8	5.7	0	0	0	107.3	S330	S330-N332 PolarHBondContact O-N 3.02Å
333	T	44.7	Very low	52.8	Low	116 Å²	116	136.5 Å²	136.5	71%	0.712	70%	0.697	S	S	*	*			trans	-109	74	-178.9	56.5	0	0	0	0	110	M331	M331-T333 HydrophobicContact CB-CG2 4Å; M331-T333 PolarHBondContact O-N 3.29Å
334	N	51.1	Low	54.9	Low	142 Å²	142	129.1 Å²	129.1	76%	0.759	68%	0.675	S	S	*	*			trans	-142.6	-4.7	175	-77.4	-42.2	0	0	0	114
335	D	54.6	Low	56.8	Low	133 Å²	133	122.7 Å²	122.7	71%	0.711	65%	0.647	S	S	*	*	S	Bend	trans	-104.9	19	-164.7	-49.7	-49	0	0	0	113.9
336	D	68.6	Low	59.1	Low	84 Å²	84	114.4 Å²	114.4	45%	0.449	61%	0.606	S	S	.	*			trans	-124.8	36.6	-173.6	-165.3	31.8	0	0	0	111.8	N350 T351	D336-N350 VanDerWaalsContact O-CB 3.22Å; D336-N350 WeakPolarHBondContact O-CB 3.48Å; D336-T351 WeakPolarHBondContact OD1-CB 3.45Å; D336-T351 PolarHBondContact OD1-N 2.86Å; D336-T351 PolarHBondContact OD1-OG1 3.37Å; D336-T351 PolarHBondContact OD2-OG1 3.41Å
337	E	71.7	Confident	61.3	Low	169 Å²	169	113.3 Å²	113.3	79%	0.79	59%	0.591	S	S	*	*	S	Bend	trans	-99.5	152.8	175.8	-166	161.7	-140.2	0	0	110.8	E339	E337-E339 PolarHBondContact O-N 3.41Å
338	M	75.3	Confident	63.4	Low	48 Å²	48	110.4 Å²	110.4	24%	0.236	57%	0.569	C	S	.	*	P	Polyproline II helix	trans	-75	121.7	-177.9	169.1	-179.5	-93.3	0	0	111	M293 L340 V346 H348 L349	M293-M338 HydrophobicContact CE-CE 4.12Å; M293-M338 HydrophobicContact CE-SD 3.54Å; M293-M338 VanDerWaalsContact CE-SD 3.54Å; M338-L340 HydrophobicContact CG-CG 4.47Å; M338-L340 HydrophobicContact SD-CD2 4.32Å; M338-V346 HydrophobicContact CE-CG1 3.87Å; M338-V346 HydrophobicContact CE-CG2 3.84Å; M338-V346 HydrophobicContact CG-CG1 4.18Å; M338-V346 HydrophobicContact SD-CG2 4.18Å; M338-H348 WeakPolarHBondContact CA-O 3.38Å; M338-L349 HydrophobicContact CE-CD2 3.91Å
339	E	75.2	Confident	65.6	Low	105 Å²	105	103.8 Å²	103.8	49%	0.491	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	118.1	171.4	-166.6	-177.3	148.3	0	0	110.5	E337 R347 H348	E337-E339 PolarHBondContact O-N 3.41Å; E339-R347 HydrophobicContact CB-CB 4.45Å; E339-R347 HydrophobicContact CG-CB 4.47Å; E339-R347 PolarHBondContact O-N 3.16Å; E339-H348 HydrophobicContact CB-CB 3.92Å; E339-H348 PolarHBondContact N-O 3.45Å; E339-H348 VanDerWaalsContact N-O 3.16Å; E339-H348 PolarHBondContact O-N 2.93Å
340	L	79	Confident	68	Low	87 Å²	87	95.5 Å²	95.5	46%	0.455	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	151.9	165.5	-66.1	172.2	0	0	0	109.3	M338 I345 V346	M338-L340 HydrophobicContact CG-CG 4.47Å; M338-L340 HydrophobicContact SD-CD2 4.32Å; L340-I345 WeakPolarHBondContact CA-O 3.4Å; L340-V346 HydrophobicContact CD2-CB 4.39Å; L340-V346 HydrophobicContact CD2-CG2 3.63Å
341	D	76.5	Confident	70.4	Confident	27 Å²	27	93.7 Å²	93.7	14%	0.144	49%	0.488	C	S	.	.			trans	-103.2	178.1	168.7	70.3	14.8	0	0	0	115	D343 G344 I345 R347	D341-D343 PolarHBondContact O-N 3.27Å; D341-D343 PolarHBondContact OD1-N 3.41Å; D341-G344 WeakPolarHBondContact O-CA 3.27Å; D341-G344 PolarHBondContact O-N 2.71Å; D341-G344 PolarHBondContact OD1-N 3.19Å; D341-I345 PolarHBondContact N-O 2.82Å; D341-I345 WeakPolarHBondContact OD1-CB 3.34Å; D341-I345 PolarHBondContact OD1-N 2.95Å; D341-R347 HydrophobicContact CB-CG 4.28Å; D341-R347 VanDerWaalsContact CB-NE 3.3Å; D341-R347 IonicContact OD2-CZ 3.33Å; D341-R347 IonicContact OD2-NE 3.85Å; D341-R347 PolarHBondContact OD2-NE 3.33Å; D341-R347 IonicContact OD2-NH2 2.66Å; D341-R347 PolarHBondContact OD2-NH2 3.33Å
342	E	76.2	Confident	72.2	Confident	195 Å²	195	90.4 Å²	90.4	91%	0.911	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-26.4	-176.7	-58.7	-75.7	166.3	0	0	112.9
343	D	75.6	Confident	74.4	Confident	147 Å²	147	86.2 Å²	86.2	79%	0.786	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-4.1	175.9	-67.2	-57	0	0	0	112.5	D341 I345	D341-D343 PolarHBondContact O-N 3.27Å; D341-D343 PolarHBondContact OD1-N 3.41Å; D343-I345 HydrophobicContact CB-CD1 4.49Å; D343-I345 HydrophobicContact CB-CG1 4.43Å
344	G	75.2	Confident	76.4	Confident	49 Å²	49	81.9 Å²	81.9	51%	0.505	43%	0.428	S	S	.	.			trans	85.8	13.1	179.6	0	0	0	0	0	114.9	D341	D341-G344 WeakPolarHBondContact O-CA 3.27Å; D341-G344 PolarHBondContact O-N 2.71Å; D341-G344 PolarHBondContact OD1-N 3.19Å
345	I	76.9	Confident	78.1	Confident	57 Å²	57	80.3 Å²	80.3	29%	0.292	42%	0.418	S	S	.	.			trans	-83.8	136.3	179.8	-55.4	175.7	0	0	0	109.2	L340 D341 D343 R347	L340-I345 WeakPolarHBondContact CA-O 3.4Å; D341-I345 PolarHBondContact N-O 2.82Å; D341-I345 WeakPolarHBondContact OD1-CB 3.34Å; D341-I345 PolarHBondContact OD1-N 2.95Å; D343-I345 HydrophobicContact CB-CD1 4.49Å; D343-I345 HydrophobicContact CB-CG1 4.43Å; I345-R347 PolarHBondContact O-N 3.08Å
346	V	81.2	Confident	79.7	Confident	16 Å²	16	79.4 Å²	79.4	10%	0.097	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	109.9	174.6	-179	0	0	0	0	109.7	M338 L340 H348 L349 Q401 V402 S403	M338-V346 HydrophobicContact CE-CG1 3.87Å; M338-V346 HydrophobicContact CE-CG2 3.84Å; M338-V346 HydrophobicContact CG-CG1 4.18Å; M338-V346 HydrophobicContact SD-CG2 4.18Å; L340-V346 HydrophobicContact CD2-CB 4.39Å; L340-V346 HydrophobicContact CD2-CG2 3.63Å; V346-H348 WeakPolarHBondContact CG1-O 3.46Å; V346-L349 HydrophobicContact CG1-CD2 3.78Å; V346-L349 HydrophobicContact CG1-CG 4.07Å; V346-Q401 PolarHBondContact N-O 3.44Å; V346-V402 HydrophobicContact CB-CG2 4.26Å; V346-S403 PolarHBondContact O-N 2.98Å; V346-S403 PolarHBondContact O-OG 2.99Å
347	R	80.7	Confident	80.7	Confident	124 Å²	124	76 Å²	76	47%	0.468	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	-32.3	173.1	-68.4	-171.7	176.5	161.2	6.7	113	E339 D341 I345 D404	E339-R347 HydrophobicContact CB-CB 4.45Å; E339-R347 HydrophobicContact CG-CB 4.47Å; E339-R347 PolarHBondContact O-N 3.16Å; D341-R347 HydrophobicContact CB-CG 4.28Å; D341-R347 VanDerWaalsContact CB-NE 3.3Å; D341-R347 IonicContact OD2-CZ 3.33Å; D341-R347 IonicContact OD2-NE 3.85Å; D341-R347 PolarHBondContact OD2-NE 3.33Å; D341-R347 IonicContact OD2-NH2 2.66Å; D341-R347 PolarHBondContact OD2-NH2 3.33Å; I345-R347 PolarHBondContact O-N 3.08Å; R347-D404 VanDerWaalsContact O-CA 3.32Å; R347-D404 WeakPolarHBondContact O-CA 2.91Å
348	H	82	Confident	81.6	Confident	65 Å²	65	71.4 Å²	71.4	30%	0.301	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	121.5	177.1	-160.8	70.2	0	0	0	111.3	M338 E339 V346 R354 D404	M338-H348 WeakPolarHBondContact CA-O 3.38Å; E339-H348 HydrophobicContact CB-CB 3.92Å; E339-H348 PolarHBondContact N-O 3.45Å; E339-H348 VanDerWaalsContact N-O 3.16Å; E339-H348 PolarHBondContact O-N 2.93Å; V346-H348 WeakPolarHBondContact CG1-O 3.46Å; H348-R354 PolarHBondContact CE1-NH2 2.88Å; H348-R354 PolarHBondContact ND1-NH2 3.4Å; H348-R354 PolarHBondContact NE2-NH2 2.69Å; H348-D404 WeakPolarHBondContact CA-OD2 3.39Å; H348-D404 IonicContact ND1-OD2 2.78Å
349	L	81.8	Confident	82.3	Confident	11 Å²	11	75 Å²	75	6%	0.058	39%	0.389	C	S	.	.			trans	-82.6	140.5	167.7	-69.1	170.6	0	0	0	109.6	M338 V346 Q353 R354 L357 V402 D404 V407	M338-L349 HydrophobicContact CE-CD2 3.91Å; V346-L349 HydrophobicContact CG1-CD2 3.78Å; V346-L349 HydrophobicContact CG1-CG 4.07Å; L349-Q353 HydrophobicContact CB-CB 4.18Å; L349-Q353 HydrophobicContact CD2-CB 4.05Å; L349-R354 HydrophobicContact CB-CB 4.42Å; L349-R354 PolarHBondContact O-NH2 2.76Å; L349-L357 HydrophobicContact CD1-CD2 3.77Å; L349-V402 HydrophobicContact CD1-CG1 4.1Å; L349-V402 HydrophobicContact CG-CG1 4.31Å; L349-D404 HydrophobicContact CG-CB 4.48Å; L349-D404 PolarHBondContact N-OD2 3.28Å; L349-V407 HydrophobicContact CD1-CG1 4.47Å; L349-V407 HydrophobicContact CD1-CG2 3.74Å
350	N	84.1	Confident	83	Confident	38 Å²	38	70.8 Å²	70.8	20%	0.203	37%	0.37	C	S	.	.			trans	-67.1	159.4	169	71.2	38.1	0	0	0	111.1	D336 S352 Q353 R354	D336-N350 VanDerWaalsContact O-CB 3.22Å; D336-N350 WeakPolarHBondContact O-CB 3.48Å; N350-S352 PolarHBondContact O-N 2.84Å; N350-S352 VanDerWaalsContact O-N 3.11Å; N350-S352 PolarHBondContact OD1-N 3.07Å; N350-Q353 PolarHBondContact ND2-OE1 3.13Å; N350-Q353 PolarHBondContact O-N 3.12Å; N350-Q353 VanDerWaalsContact OD1-CG 3.26Å; N350-Q353 WeakPolarHBondContact OD1-CG 3.45Å; N350-Q353 PolarHBondContact OD1-N 3.33Å; N350-Q353 PolarHBondContact OD1-OE1 3.39Å; N350-R354 WeakPolarHBondContact O-CB 3.44Å; N350-R354 PolarHBondContact O-N 3.2Å
351	T	85	Confident	83.7	Confident	67 Å²	67	67.1 Å²	67.1	41%	0.411	35%	0.351	S	S	.	.	H	α-helix	trans	-54	-36.6	-174.7	-59.3	0	0	0	0	112.4	D336 I355	D336-T351 WeakPolarHBondContact OD1-CB 3.45Å; D336-T351 PolarHBondContact OD1-N 2.86Å; D336-T351 PolarHBondContact OD1-OG1 3.37Å; D336-T351 PolarHBondContact OD2-OG1 3.41Å; T351-I355 HydrophobicContact CG2-CD1 3.93Å; T351-I355 WeakPolarHBondContact O-CB 3.47Å; T351-I355 WeakPolarHBondContact O-CD1 3.3Å; T351-I355 VanDerWaalsContact O-CG1 3.24Å; T351-I355 WeakPolarHBondContact O-CG1 3.3Å; T351-I355 PolarHBondContact O-N 3.07Å
352	S	83.1	Confident	84.4	Confident	88 Å²	88	68.5 Å²	68.5	62%	0.615	36%	0.362	S	S	*	.	H	α-helix	trans	-69.2	-40.7	177.6	-177	0	0	0	0	113.1	N350 K356	N350-S352 PolarHBondContact O-N 2.84Å; N350-S352 VanDerWaalsContact O-N 3.11Å; N350-S352 PolarHBondContact OD1-N 3.07Å; S352-K356 WeakPolarHBondContact O-CB 3.17Å; S352-K356 PolarHBondContact O-N 2.94Å; S352-K356 VanDerWaalsContact O-N 3.14Å
353	Q	84.6	Confident	85.2	Confident	42 Å²	42	62.4 Å²	62.4	20%	0.196	34%	0.336	C	S	.	.	H	α-helix	trans	-68.5	-41.7	176.7	-69.1	159	-17.4	0	0	111.2	L349 N350 K356 L357	L349-Q353 HydrophobicContact CB-CB 4.18Å; L349-Q353 HydrophobicContact CD2-CB 4.05Å; N350-Q353 PolarHBondContact ND2-OE1 3.13Å; N350-Q353 PolarHBondContact O-N 3.12Å; N350-Q353 VanDerWaalsContact OD1-CG 3.26Å; N350-Q353 WeakPolarHBondContact OD1-CG 3.45Å; N350-Q353 PolarHBondContact OD1-N 3.33Å; N350-Q353 PolarHBondContact OD1-OE1 3.39Å; Q353-K356 PolarHBondContact O-N 2.78Å; Q353-L357 WeakPolarHBondContact O-CB 3.46Å; Q353-L357 PolarHBondContact O-N 3.15Å
354	R	85.9	Confident	86.1	Confident	26 Å²	26	55.4 Å²	55.4	10%	0.098	30%	0.298	C	S	.	.	H	α-helix	trans	-58.3	-47.8	176	-178.3	-171.7	-57.4	-66	-15.1	112.5	H348 L349 N350 T358 D404 E406 V407	H348-R354 PolarHBondContact CE1-NH2 2.88Å; H348-R354 PolarHBondContact ND1-NH2 3.4Å; H348-R354 PolarHBondContact NE2-NH2 2.69Å; L349-R354 HydrophobicContact CB-CB 4.42Å; L349-R354 PolarHBondContact O-NH2 2.76Å; N350-R354 WeakPolarHBondContact O-CB 3.44Å; N350-R354 PolarHBondContact O-N 3.2Å; R354-T358 PolarHBondContact O-N 2.97Å; R354-T358 VanDerWaalsContact O-N 3.09Å; R354-T358 PolarHBondContact O-OG1 3.31Å; R354-D404 IonicContact CZ-OD1 3.21Å; R354-D404 IonicContact CZ-OD2 2.89Å; R354-D404 IonicContact NH1-OD1 2.68Å; R354-D404 PolarHBondContact NH1-OD1 3.29Å; R354-D404 IonicContact NH1-OD2 2.69Å; R354-D404 PolarHBondContact NH1-OD2 3.47Å; R354-D404 IonicContact NH2-OD1 2.72Å; R354-D404 IonicContact NH2-OD2 2.67Å; R354-D404 PolarHBondContact NH2-OD2 3.05Å; R354-E406 VanDerWaalsContact CD-OE2 3.24Å; R354-E406 WeakPolarHBondContact CD-OE2 3.35Å; R354-E406 IonicContact CZ-OE2 3.24Å; R354-E406 IonicContact NE-OE2 3.7Å; R354-E406 PolarHBondContact NE-OE2 2.92Å; R354-E406 VanDerWaalsContact NH1-CD 3.3Å; R354-E406 IonicContact NH1-OE2 2.67Å; R354-E406 PolarHBondContact NH1-OE2 3.27Å; R354-V407 HydrophobicContact CG-CG1 4.19Å
355	I	87.5	Confident	87	Confident	108 Å²	108	56.5 Å²	56.5	55%	0.554	29%	0.29	S	S	*	.	H	α-helix	trans	-62.2	-49.7	175.6	-70.6	166.1	0	0	0	110.4	T351 L357 T358 E359	T351-I355 HydrophobicContact CG2-CD1 3.93Å; T351-I355 WeakPolarHBondContact O-CB 3.47Å; T351-I355 WeakPolarHBondContact O-CD1 3.3Å; T351-I355 VanDerWaalsContact O-CG1 3.24Å; T351-I355 WeakPolarHBondContact O-CG1 3.3Å; T351-I355 PolarHBondContact O-N 3.07Å; I355-L357 VanDerWaalsContact C-N 3.34Å; I355-L357 PolarHBondContact O-N 2.83Å; I355-T358 WeakPolarHBondContact O-CB 3.34Å; I355-T358 PolarHBondContact O-N 3.3Å; I355-E359 PolarHBondContact O-N 3.23Å
356	K	88.1	Confident	87.8	Confident	114 Å²	114	57.6 Å²	57.6	50%	0.496	30%	0.3	S	S	.	.	H	α-helix	trans	-62	-39.4	-179.4	-177.1	178.2	176.6	-177.9	0	112.8	S352 Q353 T358 E359 D360	S352-K356 WeakPolarHBondContact O-CB 3.17Å; S352-K356 PolarHBondContact O-N 2.94Å; S352-K356 VanDerWaalsContact O-N 3.14Å; Q353-K356 PolarHBondContact O-N 2.78Å; K356-T358 VanDerWaalsContact C-N 3.35Å; K356-E359 PolarHBondContact O-N 3.02Å; K356-D360 PolarHBondContact O-N 2.74Å
357	L	88.9	Confident	88.3	Confident	12 Å²	12	58.5 Å²	58.5	6%	0.063	30%	0.304	C	S	.	.	H	α-helix	trans	-65.3	-40.2	176.8	-179.1	58.7	0	0	0	111.2	L349 Q353 I355 D360 L361 F398 V407 L411 I499	L349-L357 HydrophobicContact CD1-CD2 3.77Å; Q353-L357 WeakPolarHBondContact O-CB 3.46Å; Q353-L357 PolarHBondContact O-N 3.15Å; I355-L357 VanDerWaalsContact C-N 3.34Å; I355-L357 PolarHBondContact O-N 2.83Å; L357-D360 PolarHBondContact O-N 2.9Å; L357-L361 HydrophobicContact CD1-CD1 4.3Å; L357-L361 HydrophobicContact CD1-CG 4.29Å; L357-L361 HydrophobicContact CG-CD1 4.13Å; L357-L361 WeakPolarHBondContact O-CB 3.43Å; L357-L361 VanDerWaalsContact O-CG 3.23Å; L357-L361 WeakPolarHBondContact O-CG 3.4Å; L357-L361 PolarHBondContact O-N 3.25Å; L357-F398 HydrophobicContact CD1-CD1 4.49Å; L357-F398 HydrophobicContact CD1-CE1 4.48Å; L357-V407 HydrophobicContact CD2-CB 3.97Å; L357-V407 HydrophobicContact CD2-CG1 4.17Å; L357-V407 HydrophobicContact CD2-CG2 3.99Å; L357-L411 HydrophobicContact CD1-CD2 4.47Å; L357-L411 HydrophobicContact CD2-CD1 4.32Å; L357-I499 HydrophobicContact CD1-CD1 3.59Å
358	T	90.2	Very high	88.9	Confident	74 Å²	74	52.7 Å²	52.7	45%	0.454	28%	0.282	S	S	.	.	H	α-helix	trans	-61.6	-41.9	173.9	-54.6	0	0	0	0	111.9	R354 I355 K356 L361 S362	R354-T358 PolarHBondContact O-N 2.97Å; R354-T358 VanDerWaalsContact O-N 3.09Å; R354-T358 PolarHBondContact O-OG1 3.31Å; I355-T358 WeakPolarHBondContact O-CB 3.34Å; I355-T358 PolarHBondContact O-N 3.3Å; K356-T358 VanDerWaalsContact C-N 3.35Å; T358-L361 PolarHBondContact O-N 3.47Å; T358-S362 PolarHBondContact O-N 2.94Å
359	E	89.8	Confident	89.3	Confident	124 Å²	124	54.1 Å²	54.1	58%	0.579	29%	0.292	S	S	*	.	H	α-helix	trans	-62.7	-50.7	174.7	-173.8	177.7	-163.3	0	0	111.8	I355 K356 L361 S362 I363	I355-E359 PolarHBondContact O-N 3.23Å; K356-E359 PolarHBondContact O-N 3.02Å; E359-L361 VanDerWaalsContact C-N 3.3Å; E359-L361 PolarHBondContact O-N 3.35Å; E359-S362 PolarHBondContact O-N 2.91Å; E359-S362 VanDerWaalsContact O-N 3.13Å; E359-S362 PolarHBondContact O-OG 3.45Å; E359-I363 PolarHBondContact O-N 3.21Å
360	D	90.9	Very high	89.8	Confident	15 Å²	15	56.7 Å²	56.7	8%	0.08	31%	0.308	C	S	.	.	H	α-helix	trans	-55.2	-44	176.3	-112.5	4.1	0	0	0	111.3	K356 L357 I363 V364 I499 T500	K356-D360 PolarHBondContact O-N 2.74Å; L357-D360 PolarHBondContact O-N 2.9Å; D360-I363 PolarHBondContact O-N 3.03Å; D360-V364 WeakPolarHBondContact O-CG2 3.42Å; D360-V364 PolarHBondContact O-N 3.49Å; D360-I499 HydrophobicContact CB-CB 4.25Å; D360-I499 HydrophobicContact CB-CD1 4.49Å; D360-I499 PolarHBondContact OD2-N 3.03Å; D360-T500 HydrophobicContact CB-CG2 4.35Å; D360-T500 WeakPolarHBondContact OD1-CB 3.44Å; D360-T500 WeakPolarHBondContact OD1-CG2 3.49Å; D360-T500 PolarHBondContact OD1-OG1 3.39Å
361	L	93.1	Very high	90	Very high	10 Å²	10	54.9 Å²	54.9	5%	0.052	30%	0.298	C	S	.	.	H	α-helix	trans	-66.5	-36.1	178.5	-70.5	172.1	0	0	0	112.9	L357 T358 E359 I363 V364 E365 V395 N410 L411 V414 I499	L357-L361 HydrophobicContact CD1-CD1 4.3Å; L357-L361 HydrophobicContact CD1-CG 4.29Å; L357-L361 HydrophobicContact CG-CD1 4.13Å; L357-L361 WeakPolarHBondContact O-CB 3.43Å; L357-L361 VanDerWaalsContact O-CG 3.23Å; L357-L361 WeakPolarHBondContact O-CG 3.4Å; L357-L361 PolarHBondContact O-N 3.25Å; T358-L361 PolarHBondContact O-N 3.47Å; E359-L361 VanDerWaalsContact C-N 3.3Å; E359-L361 PolarHBondContact O-N 3.35Å; L361-I363 VanDerWaalsContact C-N 3.26Å; L361-I363 PolarHBondContact O-N 2.98Å; L361-V364 WeakPolarHBondContact O-CB 3.46Å; L361-V364 PolarHBondContact O-N 3.4Å; L361-V364 VanDerWaalsContact O-N 3.11Å; L361-E365 PolarHBondContact O-N 3Å; L361-V395 HydrophobicContact CD2-CG2 4.24Å; L361-N410 HydrophobicContact CD1-CB 4.22Å; L361-L411 HydrophobicContact CD1-CD2 4.22Å; L361-L411 HydrophobicContact CD1-CG 4.3Å; L361-L411 HydrophobicContact CD2-CD2 4.05Å; L361-V414 HydrophobicContact CB-CG2 4.45Å; L361-V414 HydrophobicContact CD2-CB 4.08Å; L361-V414 HydrophobicContact CD2-CG1 3.94Å; L361-V414 HydrophobicContact CD2-CG2 4.09Å; L361-I499 HydrophobicContact CD2-CD1 3.86Å; L361-I499 HydrophobicContact CG-CD1 4.34Å
362	S	92.6	Very high	90.1	Very high	56 Å²	56	53.1 Å²	53.1	39%	0.392	29%	0.287	S	S	.	.	H	α-helix	trans	-63.3	-32.4	176.2	76.8	0	0	0	0	113	T358 E359 T366	T358-S362 PolarHBondContact O-N 2.94Å; E359-S362 PolarHBondContact O-N 2.91Å; E359-S362 VanDerWaalsContact O-N 3.13Å; E359-S362 PolarHBondContact O-OG 3.45Å; S362-T366 PolarHBondContact O-N 3.36Å; S362-T366 PolarHBondContact O-OG1 2.98Å
363	I	92.7	Very high	90.2	Very high	68 Å²	68	54 Å²	54	35%	0.349	28%	0.284	S	S	.	.	H	α-helix	trans	-71.4	-37.8	174.3	-63	164.1	0	0	0	110.3	E359 D360 L361 T366 N367 M391 T500	E359-I363 PolarHBondContact O-N 3.21Å; D360-I363 PolarHBondContact O-N 3.03Å; L361-I363 VanDerWaalsContact C-N 3.26Å; L361-I363 PolarHBondContact O-N 2.98Å; I363-T366 PolarHBondContact O-N 3.44Å; I363-N367 PolarHBondContact O-N 3.36Å; I363-M391 HydrophobicContact CG2-CE 4.28Å; I363-T500 HydrophobicContact CB-CG2 3.76Å; I363-T500 HydrophobicContact CD1-CG2 3.95Å; I363-T500 HydrophobicContact CG1-CG2 4.46Å; I363-T500 HydrophobicContact CG2-CG2 3.67Å
364	V	94.3	Very high	90.3	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-63.6	-46.1	174	-179.3	0	0	0	0	110.9	D360 L361 T366 N367 I368 M391 V414 L418 I499	D360-V364 WeakPolarHBondContact O-CG2 3.42Å; D360-V364 PolarHBondContact O-N 3.49Å; L361-V364 WeakPolarHBondContact O-CB 3.46Å; L361-V364 PolarHBondContact O-N 3.4Å; L361-V364 VanDerWaalsContact O-N 3.11Å; V364-T366 VanDerWaalsContact C-N 3.32Å; V364-T366 PolarHBondContact O-N 3.06Å; V364-N367 PolarHBondContact O-N 3.44Å; V364-I368 HydrophobicContact CG1-CD1 4.18Å; V364-I368 VanDerWaalsContact O-CG1 3.3Å; V364-I368 WeakPolarHBondContact O-CG1 3.29Å; V364-I368 PolarHBondContact O-N 3.13Å; V364-M391 HydrophobicContact CB-SD 4.25Å; V364-M391 HydrophobicContact CG1-CB 4.17Å; V364-M391 HydrophobicContact CG1-SD 4.22Å; V364-M391 HydrophobicContact CG2-CB 4.17Å; V364-M391 HydrophobicContact CG2-CE 3.96Å; V364-M391 HydrophobicContact CG2-CG 4.02Å; V364-M391 HydrophobicContact CG2-SD 3.81Å; V364-V414 HydrophobicContact CB-CG1 4.08Å; V364-V414 HydrophobicContact CG1-CG1 3.43Å; V364-V414 VanDerWaalsContact CG1-CG1 3.43Å; V364-L418 HydrophobicContact CG1-CD1 3.76Å; V364-L418 HydrophobicContact CG1-CD2 4.11Å; V364-L418 HydrophobicContact CG1-CG 4.13Å; V364-I499 HydrophobicContact CG2-CG2 3.59Å
365	E	94.2	Very high	90	Very high	71 Å²	71	53.6 Å²	53.6	33%	0.332	29%	0.285	S	S	.	.	H	α-helix	trans	-61.6	-38.2	175.1	-68.7	-161.2	132.1	0	0	112.6	L361 N367 I368 N369 V414	L361-E365 PolarHBondContact O-N 3Å; E365-N367 PolarHBondContact O-N 3Å; E365-I368 WeakPolarHBondContact O-CB 3.47Å; E365-I368 PolarHBondContact O-N 3.45Å; E365-N369 VanDerWaalsContact O-CG 3.28Å; E365-N369 PolarHBondContact O-N 3.19Å; E365-N369 PolarHBondContact O-ND2 3.33Å; E365-N369 VanDerWaalsContact O-ND2 3.16Å; E365-V414 HydrophobicContact CG-CG2 3.76Å
366	T	93.2	Very high	89.6	Confident	81 Å²	81	52 Å²	52	50%	0.497	29%	0.288	S	S	.	.	H	α-helix	trans	-60.1	-46.3	173.9	-57.8	0	0	0	0	111.2	S362 I363 V364 I368 N369 V370	S362-T366 PolarHBondContact O-N 3.36Å; S362-T366 PolarHBondContact O-OG1 2.98Å; I363-T366 PolarHBondContact O-N 3.44Å; V364-T366 VanDerWaalsContact C-N 3.32Å; V364-T366 PolarHBondContact O-N 3.06Å; T366-I368 PolarHBondContact O-N 2.95Å; T366-N369 PolarHBondContact O-N 3.01Å; T366-V370 WeakPolarHBondContact O-CG2 3.34Å; T366-V370 PolarHBondContact O-N 3.44Å; T366-V370 VanDerWaalsContact O-N 3.08Å
367	N	92.6	Very high	89.2	Confident	34 Å²	34	52.4 Å²	52.4	18%	0.182	29%	0.291	C	S	.	.	H	α-helix	trans	-65.6	-36.3	176.9	-76.9	-7.3	0	0	0	112.9	I363 V364 E365 L371 L384 M391	I363-N367 PolarHBondContact O-N 3.36Å; V364-N367 PolarHBondContact O-N 3.44Å; E365-N367 PolarHBondContact O-N 3Å; N367-L371 VanDerWaalsContact O-CB 3.29Å; N367-L371 WeakPolarHBondContact O-CB 3.1Å; N367-L371 PolarHBondContact O-N 3.42Å; N367-L384 HydrophobicContact CB-CD1 3.99Å; N367-M391 HydrophobicContact CB-SD 4.32Å; N367-M391 VanDerWaalsContact ND2-CE 3.29Å; N367-M391 WeakPolarHBondContact ND2-CE 3.23Å; N367-M391 PolarHBondContact ND2-SD 2.89Å; N367-M391 VanDerWaalsContact ND2-SD 3.44Å
368	I	91.8	Very high	88.6	Confident	2 Å²	2	56.6 Å²	56.6	1%	0.01	31%	0.313	C	S	.	.	H	α-helix	trans	-59.1	-47.6	172.7	-71.6	168	0	0	0	110.5	V364 E365 T366 L371 N372 V414 N417 L418	V364-I368 HydrophobicContact CG1-CD1 4.18Å; V364-I368 VanDerWaalsContact O-CG1 3.3Å; V364-I368 WeakPolarHBondContact O-CG1 3.29Å; V364-I368 PolarHBondContact O-N 3.13Å; E365-I368 WeakPolarHBondContact O-CB 3.47Å; E365-I368 PolarHBondContact O-N 3.45Å; T366-I368 PolarHBondContact O-N 2.95Å; I368-L371 PolarHBondContact O-N 3.08Å; I368-N372 WeakPolarHBondContact CG2-ND2 3.36Å; I368-N372 PolarHBondContact O-N 3.31Å; I368-N372 PolarHBondContact O-ND2 3.18Å; I368-V414 HydrophobicContact CD1-CG1 4.38Å; I368-N417 HydrophobicContact CD1-CB 3.64Å; I368-N417 HydrophobicContact CG2-CB 4.37Å; I368-L418 HydrophobicContact CD1-CD2 3.86Å; I368-L418 HydrophobicContact CD1-CG 3.7Å; I368-L418 HydrophobicContact CG1-CD2 3.62Å; I368-L418 HydrophobicContact CG1-CG 4.05Å
369	N	92.1	Very high	88	Confident	95 Å²	95	61.7 Å²	61.7	51%	0.508	32%	0.324	S	S	.	.	H	α-helix	trans	-63.8	-50.8	-178.1	-68.1	-31.2	0	0	0	111.1	E365 T366 L371 N372 D373	E365-N369 VanDerWaalsContact O-CG 3.28Å; E365-N369 PolarHBondContact O-N 3.19Å; E365-N369 PolarHBondContact O-ND2 3.33Å; E365-N369 VanDerWaalsContact O-ND2 3.16Å; T366-N369 PolarHBondContact O-N 3.01Å; N369-L371 VanDerWaalsContact C-N 3.3Å; N369-L371 PolarHBondContact O-N 3.42Å; N369-N372 PolarHBondContact O-N 2.85Å; N369-D373 PolarHBondContact O-N 3.37Å
370	V	91.1	Very high	87.3	Confident	66 Å²	66	56.7 Å²	56.7	40%	0.4	30%	0.302	S	S	.	.	H	α-helix	trans	-58.8	-40.1	177.4	177.1	0	0	0	0	111.8	T366 D373 L374 L384	T366-V370 WeakPolarHBondContact O-CG2 3.34Å; T366-V370 PolarHBondContact O-N 3.44Å; T366-V370 VanDerWaalsContact O-N 3.08Å; V370-D373 PolarHBondContact O-N 3.25Å; V370-L374 HydrophobicContact CG1-CD1 4.02Å; V370-L374 HydrophobicContact CG1-CG 4.4Å; V370-L374 VanDerWaalsContact O-CG 3.31Å; V370-L374 WeakPolarHBondContact O-CG 3.28Å; V370-L374 PolarHBondContact O-N 2.76Å; V370-L384 HydrophobicContact CB-CD2 4.14Å; V370-L384 HydrophobicContact CG1-CD2 3.73Å
371	L	88.2	Confident	86.9	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-68	-35	177	-174.4	56.9	0	0	0	112.3	N367 I368 N369 L375 P380 L384 N385 C388 T421 Y425	N367-L371 VanDerWaalsContact O-CB 3.29Å; N367-L371 WeakPolarHBondContact O-CB 3.1Å; N367-L371 PolarHBondContact O-N 3.42Å; I368-L371 PolarHBondContact O-N 3.08Å; N369-L371 VanDerWaalsContact C-N 3.3Å; N369-L371 PolarHBondContact O-N 3.42Å; L371-L375 HydrophobicContact CG-CD1 4.22Å; L371-L375 WeakPolarHBondContact O-CB 3.48Å; L371-L375 WeakPolarHBondContact O-CD1 3.4Å; L371-L375 WeakPolarHBondContact O-CG 3.27Å; L371-L375 PolarHBondContact O-N 3Å; L371-P380 HydrophobicContact CD1-CB 4.37Å; L371-L384 HydrophobicContact CB-CD2 3.86Å; L371-L384 HydrophobicContact CB-CG 4.27Å; L371-L384 HydrophobicContact CD1-CD2 4.28Å; L371-L384 HydrophobicContact CD1-CG 4.44Å; L371-N385 HydrophobicContact CD1-CB 4.42Å; L371-N385 HydrophobicContact CD2-CB 4.37Å; L371-C388 HydrophobicContact CD2-CB 3.98Å; L371-T421 HydrophobicContact CB-CG2 4.19Å; L371-T421 HydrophobicContact CD2-CG2 3.89Å; L371-T421 HydrophobicContact CG-CG2 3.98Å; L371-Y425 HydrophobicContact CD1-CD2 4.27Å
372	N	88.1	Confident	86.5	Confident	30 Å²	30	62.6 Å²	62.6	16%	0.16	34%	0.337	C	S	.	.	H	α-helix	trans	-69	-35.3	174.7	-82.1	-69.2	0	0	0	113	I368 N369 A376 T421 R424	I368-N372 WeakPolarHBondContact CG2-ND2 3.36Å; I368-N372 PolarHBondContact O-N 3.31Å; I368-N372 PolarHBondContact O-ND2 3.18Å; N369-N372 PolarHBondContact O-N 2.85Å; N372-A376 PolarHBondContact O-N 3.28Å; N372-A376 VanDerWaalsContact O-N 3.1Å; N372-T421 VanDerWaalsContact ND2-CG2 3.3Å; N372-T421 WeakPolarHBondContact ND2-CG2 3.37Å; N372-T421 PolarHBondContact ND2-OG1 3.31Å; N372-R424 WeakPolarHBondContact OD1-CD 3.29Å; N372-R424 PolarHBondContact OD1-NH1 3.23Å
373	D	85.3	Confident	86.1	Confident	106 Å²	106	65 Å²	65	57%	0.567	34%	0.342	S	S	*	.	H	α-helix	trans	-68.4	-47.7	174.6	-69	-26.7	0	0	0	111.1	N369 V370 L375 A376 E377	N369-D373 PolarHBondContact O-N 3.37Å; V370-D373 PolarHBondContact O-N 3.25Å; D373-L375 VanDerWaalsContact C-N 3.28Å; D373-L375 PolarHBondContact O-N 2.8Å; D373-A376 WeakPolarHBondContact O-CA 3.29Å; D373-A376 WeakPolarHBondContact O-CB 3.42Å; D373-A376 PolarHBondContact O-N 2.72Å; D373-E377 PolarHBondContact O-N 2.68Å
374	L	85.7	Confident	85.9	Confident	47 Å²	47	62.8 Å²	62.8	25%	0.246	33%	0.331	C	S	.	.	H	α-helix	trans	-64.2	-31.3	176.7	-67.2	173.1	0	0	0	112.9	V370 L378 R379 D381 L384	V370-L374 HydrophobicContact CG1-CD1 4.02Å; V370-L374 HydrophobicContact CG1-CG 4.4Å; V370-L374 VanDerWaalsContact O-CG 3.31Å; V370-L374 WeakPolarHBondContact O-CG 3.28Å; V370-L374 PolarHBondContact O-N 2.76Å; L374-L378 PolarHBondContact O-N 2.93Å; L374-R379 CarbonylContact O-C 3.57Å; L374-R379 PolarHBondContact O-N 3.02Å; L374-D381 HydrophobicContact CD1-CB 3.91Å; L374-L384 HydrophobicContact CD1-CD2 4.04Å
375	L	79.7	Confident	85.7	Confident	12 Å²	12	63.1 Å²	63.1	6%	0.063	33%	0.333	C	S	.	.	H	α-helix	trans	-68.1	-33.3	170.1	-78.5	166.4	0	0	0	112.3	L371 D373 L378 P380 T421 R424 Y425 F428	L371-L375 HydrophobicContact CG-CD1 4.22Å; L371-L375 WeakPolarHBondContact O-CB 3.48Å; L371-L375 WeakPolarHBondContact O-CD1 3.4Å; L371-L375 WeakPolarHBondContact O-CG 3.27Å; L371-L375 PolarHBondContact O-N 3Å; D373-L375 VanDerWaalsContact C-N 3.28Å; D373-L375 PolarHBondContact O-N 2.8Å; L375-L378 PolarHBondContact O-N 3.47Å; L375-P380 HydrophobicContact CD2-CB 3.71Å; L375-P380 HydrophobicContact CD2-CG 3.91Å; L375-P380 HydrophobicContact CG-CB 4.03Å; L375-T421 HydrophobicContact CD1-CG2 4.4Å; L375-R424 HydrophobicContact CD1-CB 3.92Å; L375-Y425 HydrophobicContact CD2-CD2 4.26Å; L375-F428 HydrophobicContact CD2-CB 3.83Å; L375-F428 HydrophobicContact CD2-CG 4.1Å
376	A	78.7	Confident	85.3	Confident	74 Å²	74	63 Å²	63	61%	0.612	34%	0.339	S	S	*	.	H	α-helix	trans	-73.5	-31.1	175	0	0	0	0	0	112.6	N372 D373 L378	N372-A376 PolarHBondContact O-N 3.28Å; N372-A376 VanDerWaalsContact O-N 3.1Å; D373-A376 WeakPolarHBondContact O-CA 3.29Å; D373-A376 WeakPolarHBondContact O-CB 3.42Å; D373-A376 PolarHBondContact O-N 2.72Å; A376-L378 PolarHBondContact O-N 3.44Å
377	E	79.4	Confident	85.1	Confident	123 Å²	123	61 Å²	61	58%	0.575	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	1	170.1	-73	-160.7	-161.4	0	0	114.3	D373 R379	D373-E377 PolarHBondContact O-N 2.68Å; E377-R379 PolarHBondContact O-N 3.34Å; E377-R379 IonicContact OE2-NH1 2.75Å
378	L	76.4	Confident	85	Confident	100 Å²	100	59.4 Å²	59.4	52%	0.524	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.8	26.9	-173.7	-59.1	174.8	0	0	0	113.7	L374 L375 A376 P380 F428	L374-L378 PolarHBondContact O-N 2.93Å; L375-L378 PolarHBondContact O-N 3.47Å; A376-L378 PolarHBondContact O-N 3.44Å; L378-P380 VanDerWaalsContact C-CD 3.41Å; L378-F428 HydrophobicContact CB-CE2 4.22Å; L378-F428 HydrophobicContact CD2-CD2 4.1Å; L378-F428 HydrophobicContact CD2-CE2 4.07Å
379	R	78.2	Confident	85	Confident	182 Å²	182	63.6 Å²	63.6	69%	0.687	33%	0.334	S	S	*	.			trans	-129.7	52.3	179.2	-66.5	175.4	-179.7	144.9	0.3	112.3	L374 E377 D381	L374-R379 CarbonylContact O-C 3.57Å; L374-R379 PolarHBondContact O-N 3.02Å; E377-R379 PolarHBondContact O-N 3.34Å; E377-R379 IonicContact OE2-NH1 2.75Å; R379-D381 PolarHBondContact O-N 2.91Å
380	P	75.6	Confident	84.8	Confident	18 Å²	18	61.7 Å²	61.7	12%	0.117	32%	0.323	C	S	.	.			trans	-66.2	134.9	-177.9	30.3	-36.1	0	0	0	112.1	L371 L375 L378 Y425 F428	L371-P380 HydrophobicContact CD1-CB 4.37Å; L375-P380 HydrophobicContact CD2-CB 3.71Å; L375-P380 HydrophobicContact CD2-CG 3.91Å; L375-P380 HydrophobicContact CG-CB 4.03Å; L378-P380 VanDerWaalsContact C-CD 3.41Å; P380-Y425 HydrophobicContact CB-CD2 3.98Å; P380-Y425 HydrophobicContact CB-CE2 3.84Å; P380-Y425 HydrophobicContact CG-CD2 4.45Å; P380-Y425 HydrophobicContact CG-CE2 4.15Å; P380-F428 VanDerWaalsContact CD-CZ 3.46Å; P380-F428 HydrophobicContact CG-CD1 3.49Å; P380-F428 VanDerWaalsContact CG-CD1 3.49Å; P380-F428 HydrophobicContact CG-CD2 4.3Å; P380-F428 HydrophobicContact CG-CE1 3.29Å; P380-F428 HydrophobicContact CG-CE2 4.12Å; P380-F428 HydrophobicContact CG-CG 4.01Å; P380-F428 HydrophobicContact CG-CZ 3.64Å
381	D	81.7	Confident	84.9	Confident	73 Å²	73	58.8 Å²	58.8	39%	0.39	31%	0.305	S	S	.	.			trans	-75.5	127.7	175	-178.8	-7.3	0	0	0	110.5	L374 R379 E383 L384 N385	L374-D381 HydrophobicContact CD1-CB 3.91Å; R379-D381 PolarHBondContact O-N 2.91Å; D381-E383 WeakPolarHBondContact OD1-CB 3.35Å; D381-E383 PolarHBondContact OD1-N 3.28Å; D381-L384 HydrophobicContact CB-CB 3.81Å; D381-L384 PolarHBondContact OD1-N 3.03Å; D381-N385 WeakPolarHBondContact O-CB 3.35Å; D381-N385 PolarHBondContact O-N 3.3Å
382	T	84.2	Confident	85.2	Confident	76 Å²	76	61 Å²	61	47%	0.466	32%	0.315	S	S	.	.	H	α-helix	trans	-76.6	-28.8	-178.6	68.5	0	0	0	0	112.5	C386 L456	T382-C386 WeakPolarHBondContact O-CB 3.3Å; T382-C386 PolarHBondContact O-N 3.38Å; T382-L456 HydrophobicContact CG2-CD2 4.28Å
383	E	85.2	Confident	85.3	Confident	107 Å²	107	64.8 Å²	64.8	50%	0.5	33%	0.332	S	S	.	.	H	α-helix	trans	-73.8	-45.2	174.5	-170.5	168.8	175.9	0	0	109.8	D381 N385 C386 T387	D381-E383 WeakPolarHBondContact OD1-CB 3.35Å; D381-E383 PolarHBondContact OD1-N 3.28Å; E383-N385 PolarHBondContact O-N 3.38Å; E383-C386 WeakPolarHBondContact O-CA 3.27Å; E383-C386 WeakPolarHBondContact O-CB 3.46Å; E383-C386 PolarHBondContact O-N 3.15Å; E383-C386 VanDerWaalsContact O-N 3.1Å; E383-T387 PolarHBondContact O-N 3.39Å; E383-T387 PolarHBondContact O-OG1 2.94Å; E383-T387 VanDerWaalsContact O-OG1 3.12Å
384	L	88.4	Confident	85.5	Confident	21 Å²	21	61.1 Å²	61.1	11%	0.11	31%	0.31	C	S	.	.	H	α-helix	trans	-59.6	-43.2	173.1	-175.7	61	0	0	0	112.2	N367 V370 L371 L374 D381 C386 T387 C388	N367-L384 HydrophobicContact CB-CD1 3.99Å; V370-L384 HydrophobicContact CB-CD2 4.14Å; V370-L384 HydrophobicContact CG1-CD2 3.73Å; L371-L384 HydrophobicContact CB-CD2 3.86Å; L371-L384 HydrophobicContact CB-CG 4.27Å; L371-L384 HydrophobicContact CD1-CD2 4.28Å; L371-L384 HydrophobicContact CD1-CG 4.44Å; L374-L384 HydrophobicContact CD1-CD2 4.04Å; D381-L384 HydrophobicContact CB-CB 3.81Å; D381-L384 PolarHBondContact OD1-N 3.03Å; L384-C386 VanDerWaalsContact C-N 3.33Å; L384-C386 PolarHBondContact O-N 3.38Å; L384-T387 WeakPolarHBondContact O-CB 3.44Å; L384-T387 PolarHBondContact O-N 3Å; L384-C388 PolarHBondContact O-N 3.21Å; L384-C388 PolarHBondContact O-SG 3.45Å; L384-C388 VanDerWaalsContact O-SG 3.39Å
385	N	89.1	Confident	85.8	Confident	7 Å²	7	58.9 Å²	58.9	4%	0.037	30%	0.299	C	S	.	.	H	α-helix	trans	-61.9	-39.6	174.2	179.9	51.2	0	0	0	112.3	L371 D381 E383 T387 C388 R389 L422 Y425	L371-N385 HydrophobicContact CD1-CB 4.42Å; L371-N385 HydrophobicContact CD2-CB 4.37Å; D381-N385 WeakPolarHBondContact O-CB 3.35Å; D381-N385 PolarHBondContact O-N 3.3Å; E383-N385 PolarHBondContact O-N 3.38Å; N385-T387 VanDerWaalsContact C-N 3.34Å; N385-C388 PolarHBondContact O-N 2.92Å; N385-R389 PolarHBondContact ND2-NE 2.82Å; N385-R389 PolarHBondContact ND2-NH2 3.43Å; N385-R389 WeakPolarHBondContact O-CG 3.47Å; N385-R389 PolarHBondContact O-N 2.66Å; N385-L422 VanDerWaalsContact OD1-CD2 3.24Å; N385-L422 WeakPolarHBondContact OD1-CD2 3.5Å; N385-Y425 HydrophobicContact CB-CD2 3.63Å; N385-Y425 HydrophobicContact CB-CE2 3.4Å; N385-Y425 VanDerWaalsContact CB-CE2 3.4Å; N385-Y425 HydrophobicContact CB-CG 4.25Å; N385-Y425 VanDerWaalsContact CG-CE2 3.47Å; N385-Y425 VanDerWaalsContact CG-CG 3.49Å; N385-Y425 WeakPolarHBondContact ND2-CD1 3.38Å; N385-Y425 WeakPolarHBondContact ND2-CE1 3.4Å
386	C	87.4	Confident	86.3	Confident	69 Å²	69	62.6 Å²	62.6	47%	0.466	32%	0.317	S	S	.	.	H	α-helix	trans	-60.5	-44.8	173.4	-167.6	0	0	0	0	111.2	T382 E383 L384 R389 I390	T382-C386 WeakPolarHBondContact O-CB 3.3Å; T382-C386 PolarHBondContact O-N 3.38Å; E383-C386 WeakPolarHBondContact O-CA 3.27Å; E383-C386 WeakPolarHBondContact O-CB 3.46Å; E383-C386 PolarHBondContact O-N 3.15Å; E383-C386 VanDerWaalsContact O-N 3.1Å; L384-C386 VanDerWaalsContact C-N 3.33Å; L384-C386 PolarHBondContact O-N 3.38Å; C386-R389 PolarHBondContact O-N 3.14Å; C386-I390 WeakPolarHBondContact O-CG1 3.46Å; C386-I390 PolarHBondContact O-N 2.83Å
387	T	87.4	Confident	86.7	Confident	39 Å²	39	62.4 Å²	62.4	24%	0.239	30%	0.303	C	S	.	.	H	α-helix	trans	-59	-46.4	174.1	-57.2	0	0	0	0	112	E383 L384 N385 R389 I390 M391	E383-T387 PolarHBondContact O-N 3.39Å; E383-T387 PolarHBondContact O-OG1 2.94Å; E383-T387 VanDerWaalsContact O-OG1 3.12Å; L384-T387 WeakPolarHBondContact O-CB 3.44Å; L384-T387 PolarHBondContact O-N 3Å; N385-T387 VanDerWaalsContact C-N 3.34Å; T387-R389 VanDerWaalsContact C-N 3.31Å; T387-R389 PolarHBondContact O-N 3.47Å; T387-I390 PolarHBondContact O-N 3.15Å; T387-I390 VanDerWaalsContact O-N 3.16Å; T387-M391 HydrophobicContact CG2-CE 4.1Å; T387-M391 HydrophobicContact CG2-SD 4Å; T387-M391 WeakPolarHBondContact O-CG 3.37Å; T387-M391 PolarHBondContact O-N 3.03Å
388	C	91.4	Very high	87.1	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-61.6	-35.2	176.2	-70.1	0	0	0	0	112.8	L371 L384 N385 M391 H392 L418 L422	L371-C388 HydrophobicContact CD2-CB 3.98Å; L384-C388 PolarHBondContact O-N 3.21Å; L384-C388 PolarHBondContact O-SG 3.45Å; L384-C388 VanDerWaalsContact O-SG 3.39Å; N385-C388 PolarHBondContact O-N 2.92Å; C388-M391 PolarHBondContact O-N 3.29Å; C388-H392 WeakPolarHBondContact O-CB 3.44Å; C388-H392 PolarHBondContact O-N 2.91Å; C388-L418 HydrophobicContact CB-CD2 4.12Å; C388-L422 HydrophobicContact CB-CD2 4.01Å
389	R	91.9	Very high	87.7	Confident	90 Å²	90	56.4 Å²	56.4	34%	0.34	27%	0.273	S	S	.	.	H	α-helix	trans	-68.9	-37.4	173.5	-67.4	-173.9	-155.9	-94.1	14.6	112.8	N385 C386 T387 H392 Q393 L422 D426	N385-R389 PolarHBondContact ND2-NE 2.82Å; N385-R389 PolarHBondContact ND2-NH2 3.43Å; N385-R389 WeakPolarHBondContact O-CG 3.47Å; N385-R389 PolarHBondContact O-N 2.66Å; C386-R389 PolarHBondContact O-N 3.14Å; T387-R389 VanDerWaalsContact C-N 3.31Å; T387-R389 PolarHBondContact O-N 3.47Å; R389-H392 PolarHBondContact O-N 3.04Å; R389-Q393 PolarHBondContact O-N 2.7Å; R389-L422 HydrophobicContact CG-CD1 4.04Å; R389-L422 HydrophobicContact CG-CD2 3.54Å; R389-L422 HydrophobicContact CG-CG 4.42Å; R389-D426 IonicContact CZ-OD1 3.42Å; R389-D426 VanDerWaalsContact CZ-OD1 3.24Å; R389-D426 IonicContact NH1-OD1 2.75Å; R389-D426 PolarHBondContact NH1-OD1 2.95Å; R389-D426 IonicContact NH1-OD2 3.22Å; R389-D426 IonicContact NH2-OD1 3.43Å; R389-D426 PolarHBondContact NH2-OD1 3.29Å
390	I	86.8	Confident	88.1	Confident	56 Å²	56	51.6 Å²	51.6	29%	0.287	27%	0.268	S	S	.	.	H	α-helix	trans	-65.6	-42.3	174	-66.5	165.4	0	0	0	110.5	C386 T387 Q393 R394	C386-I390 WeakPolarHBondContact O-CG1 3.46Å; C386-I390 PolarHBondContact O-N 2.83Å; T387-I390 PolarHBondContact O-N 3.15Å; T387-I390 VanDerWaalsContact O-N 3.16Å; I390-Q393 PolarHBondContact O-N 2.74Å; I390-R394 PolarHBondContact O-N 3.04Å; I390-R394 VanDerWaalsContact O-N 3.16Å
391	M	93.7	Very high	88.3	Confident	4 Å²	4	55.6 Å²	55.6	2%	0.02	29%	0.285	C	S	.	.	H	α-helix	trans	-62.1	-43.8	174.6	-70.5	172.1	154.4	0	0	111.6	I363 V364 N367 T387 C388 R394 V395 L418 I499 T500	I363-M391 HydrophobicContact CG2-CE 4.28Å; V364-M391 HydrophobicContact CB-SD 4.25Å; V364-M391 HydrophobicContact CG1-CB 4.17Å; V364-M391 HydrophobicContact CG1-SD 4.22Å; V364-M391 HydrophobicContact CG2-CB 4.17Å; V364-M391 HydrophobicContact CG2-CE 3.96Å; V364-M391 HydrophobicContact CG2-CG 4.02Å; V364-M391 HydrophobicContact CG2-SD 3.81Å; N367-M391 HydrophobicContact CB-SD 4.32Å; N367-M391 VanDerWaalsContact ND2-CE 3.29Å; N367-M391 WeakPolarHBondContact ND2-CE 3.23Å; N367-M391 PolarHBondContact ND2-SD 2.89Å; N367-M391 VanDerWaalsContact ND2-SD 3.44Å; T387-M391 HydrophobicContact CG2-CE 4.1Å; T387-M391 HydrophobicContact CG2-SD 4Å; T387-M391 WeakPolarHBondContact O-CG 3.37Å; T387-M391 PolarHBondContact O-N 3.03Å; C388-M391 PolarHBondContact O-N 3.29Å; M391-R394 PolarHBondContact O-N 2.91Å; M391-V395 WeakPolarHBondContact O-CG2 3.23Å; M391-V395 PolarHBondContact O-N 2.81Å; M391-L418 HydrophobicContact CB-CD1 4.44Å; M391-I499 HydrophobicContact CB-CG2 4.22Å; M391-I499 HydrophobicContact CG-CG2 4.26Å; M391-T500 HydrophobicContact CE-CG2 3.91Å
392	H	94.5	Very high	88.4	Confident	47 Å²	47	52.6 Å²	52.6	22%	0.218	27%	0.269	C	S	.	.	H	α-helix	trans	-61.3	-44.2	176.7	-178.9	-110.1	0	0	0	112.9	C388 R389 R394 V395 M396 N415 L418 T419 L422	C388-H392 WeakPolarHBondContact O-CB 3.44Å; C388-H392 PolarHBondContact O-N 2.91Å; R389-H392 PolarHBondContact O-N 3.04Å; H392-R394 VanDerWaalsContact C-N 3.33Å; H392-R394 PolarHBondContact O-N 3.37Å; H392-V395 PolarHBondContact O-N 3.14Å; H392-M396 WeakPolarHBondContact O-CB 3.39Å; H392-M396 WeakPolarHBondContact O-CG 3.4Å; H392-M396 PolarHBondContact O-N 3.31Å; H392-N415 PolarHBondContact CD2-OD1 3.01Å; H392-N415 VanDerWaalsContact CD2-OD1 3.23Å; H392-N415 PolarHBondContact NE2-OD1 3.43Å; H392-L418 HydrophobicContact CB-CB 4.23Å; H392-L418 HydrophobicContact CB-CD1 3.96Å; H392-T419 PolarHBondContact NE2-OG1 3.01Å; H392-L422 HydrophobicContact CB-CD1 3.79Å
393	Q	91.3	Very high	88.3	Confident	109 Å²	109	51.8 Å²	51.8	51%	0.509	27%	0.266	S	S	.	.	H	α-helix	trans	-57.2	-45.9	174.5	178.8	57.9	39.5	0	0	111.5	R389 I390 M396 E397	R389-Q393 PolarHBondContact O-N 2.7Å; I390-Q393 PolarHBondContact O-N 2.74Å; Q393-M396 PolarHBondContact O-N 2.68Å; Q393-E397 WeakPolarHBondContact CG-OE1 3.4Å; Q393-E397 PolarHBondContact NE2-OE1 2.64Å; Q393-E397 WeakPolarHBondContact O-CG 3.25Å; Q393-E397 PolarHBondContact O-N 2.75Å
394	R	89.7	Confident	88.3	Confident	29 Å²	29	46.9 Å²	46.9	11%	0.109	24%	0.243	C	C	.	.	H	α-helix	trans	-70.6	-38.7	178	-74.4	-172.6	178.6	126.2	-7.7	113.7	I390 M391 H392 M396 E397 F398 Q495 Q496 A498 I499 A501	I390-R394 PolarHBondContact O-N 3.04Å; I390-R394 VanDerWaalsContact O-N 3.16Å; M391-R394 PolarHBondContact O-N 2.91Å; H392-R394 VanDerWaalsContact C-N 3.33Å; H392-R394 PolarHBondContact O-N 3.37Å; R394-M396 VanDerWaalsContact C-N 3.26Å; R394-M396 PolarHBondContact O-N 3.26Å; R394-E397 WeakPolarHBondContact O-CB 3.46Å; R394-E397 PolarHBondContact O-N 3.34Å; R394-E397 VanDerWaalsContact O-N 3.09Å; R394-F398 VanDerWaalsContact O-CD2 3.29Å; R394-F398 WeakPolarHBondContact O-CD2 3.36Å; R394-F398 PolarHBondContact O-N 3.28Å; R394-Q495 PolarHBondContact NH2-O 2.67Å; R394-Q496 PolarHBondContact NE-O 3.27Å; R394-Q496 PolarHBondContact NH2-O 2.86Å; R394-A498 WeakPolarHBondContact CD-O 3.44Å; R394-A498 PolarHBondContact NE-O 3.37Å; R394-A498 VanDerWaalsContact NE-O 3.12Å; R394-A498 PolarHBondContact NH1-O 3.41Å; R394-A498 VanDerWaalsContact NH1-O 3.09Å; R394-I499 HydrophobicContact CB-CG1 4.47Å; R394-I499 HydrophobicContact CB-CG2 4.29Å; R394-I499 PolarHBondContact NH1-O 3.2Å; R394-A501 VanDerWaalsContact NH1-C 3.3Å; R394-A501 PolarHBondContact NH1-O 2.73Å; R394-A501 PolarHBondContact NH2-O 3.16Å
395	V	92.3	Very high	88.1	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-61.1	-38.9	175.1	170.1	0	0	0	0	110.5	L361 M391 H392 F398 L399 L411 V414 N415 L418 I499	L361-V395 HydrophobicContact CD2-CG2 4.24Å; M391-V395 WeakPolarHBondContact O-CG2 3.23Å; M391-V395 PolarHBondContact O-N 2.81Å; H392-V395 PolarHBondContact O-N 3.14Å; V395-F398 PolarHBondContact O-N 3.42Å; V395-L399 HydrophobicContact CG1-CD1 4.19Å; V395-L399 WeakPolarHBondContact O-CB 3.39Å; V395-L399 WeakPolarHBondContact O-CG 3.19Å; V395-L399 PolarHBondContact O-N 2.98Å; V395-L411 HydrophobicContact CG1-CD2 4.28Å; V395-V414 HydrophobicContact CG2-CG1 4.24Å; V395-N415 HydrophobicContact CG1-CB 3.69Å; V395-L418 HydrophobicContact CG2-CD1 4.19Å; V395-I499 HydrophobicContact CG2-CD1 4.19Å; V395-I499 HydrophobicContact CG2-CG2 4.06Å
396	M	89.2	Confident	87.9	Confident	90 Å²	90	58.8 Å²	58.8	44%	0.443	30%	0.298	S	S	.	.	H	α-helix	trans	-64.2	-38	171.7	-74.3	-69.6	-63.9	0	0	113	H392 Q393 R394 L399 S400 N415	H392-M396 WeakPolarHBondContact O-CB 3.39Å; H392-M396 WeakPolarHBondContact O-CG 3.4Å; H392-M396 PolarHBondContact O-N 3.31Å; Q393-M396 PolarHBondContact O-N 2.68Å; R394-M396 VanDerWaalsContact C-N 3.26Å; R394-M396 PolarHBondContact O-N 3.26Å; M396-L399 PolarHBondContact O-N 3.41Å; M396-S400 PolarHBondContact O-N 3.24Å; M396-N415 PolarHBondContact SD-ND2 3.36Å
397	E	87	Confident	88	Confident	71 Å²	71	55.6 Å²	55.6	33%	0.332	28%	0.277	S	S	.	.	H	α-helix	trans	-67.2	-38.6	174.3	-72.1	161.4	-170.1	0	0	112.5	Q393 R394 S400 Q401	Q393-E397 WeakPolarHBondContact CG-OE1 3.4Å; Q393-E397 PolarHBondContact NE2-OE1 2.64Å; Q393-E397 WeakPolarHBondContact O-CG 3.25Å; Q393-E397 PolarHBondContact O-N 2.75Å; R394-E397 WeakPolarHBondContact O-CB 3.46Å; R394-E397 PolarHBondContact O-N 3.34Å; R394-E397 VanDerWaalsContact O-N 3.09Å; E397-S400 PolarHBondContact O-N 3.18Å; E397-S400 PolarHBondContact O-OG 3.27Å; E397-Q401 PolarHBondContact O-N 2.73Å; E397-Q401 PolarHBondContact O-NE2 2.9Å
398	F	88	Confident	88.1	Confident	47 Å²	47	55 Å²	55	21%	0.206	27%	0.273	C	S	.	.	H	α-helix	trans	-66.2	-42.3	172.5	-85.5	-77.2	0	0	0	111.5	L357 R394 V395 S400 Q401 V402 L411 I499	L357-F398 HydrophobicContact CD1-CD1 4.49Å; L357-F398 HydrophobicContact CD1-CE1 4.48Å; R394-F398 VanDerWaalsContact O-CD2 3.29Å; R394-F398 WeakPolarHBondContact O-CD2 3.36Å; R394-F398 PolarHBondContact O-N 3.28Å; V395-F398 PolarHBondContact O-N 3.42Å; F398-S400 PolarHBondContact O-N 2.88Å; F398-Q401 PolarHBondContact O-N 2.69Å; F398-V402 HydrophobicContact CD1-CG2 3.97Å; F398-V402 PolarHBondContact O-N 3.14Å; F398-L411 HydrophobicContact CB-CD1 4.25Å; F398-L411 HydrophobicContact CB-CD2 3.86Å; F398-I499 HydrophobicContact CD2-CD1 3.84Å; F398-I499 HydrophobicContact CD2-CG1 3.69Å; F398-I499 HydrophobicContact CE2-CD1 4.01Å; F398-I499 HydrophobicContact CE2-CG1 3.46Å; F398-I499 VanDerWaalsContact CE2-CG1 3.46Å; F398-I499 HydrophobicContact CZ-CG1 4.42Å
399	L	89.4	Confident	88	Confident	50 Å²	50	58.1 Å²	58.1	26%	0.262	29%	0.29	S	S	.	.	H	α-helix	trans	-63.8	-18.9	175.7	-78.6	171.8	0	0	0	114.3	V395 M396 L411 I412 N415	V395-L399 HydrophobicContact CG1-CD1 4.19Å; V395-L399 WeakPolarHBondContact O-CB 3.39Å; V395-L399 WeakPolarHBondContact O-CG 3.19Å; V395-L399 PolarHBondContact O-N 2.98Å; M396-L399 PolarHBondContact O-N 3.41Å; L399-L411 HydrophobicContact CD2-CB 3.6Å; L399-L411 HydrophobicContact CG-CB 4.02Å; L399-I412 HydrophobicContact CD2-CG1 3.74Å; L399-N415 HydrophobicContact CD1-CB 3.66Å; L399-N415 WeakPolarHBondContact CD1-ND2 3.35Å
400	S	85.4	Confident	88	Confident	81 Å²	81	57.1 Å²	57.1	57%	0.566	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-6	172.3	63.6	0	0	0	0	114.4	M396 E397 F398	M396-S400 PolarHBondContact O-N 3.24Å; E397-S400 PolarHBondContact O-N 3.18Å; E397-S400 PolarHBondContact O-OG 3.27Å; F398-S400 PolarHBondContact O-N 2.88Å
401	Q	81.3	Confident	88.3	Confident	102 Å²	102	54.5 Å²	54.5	48%	0.477	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.6	-14.8	-172	-74.5	170.6	88.2	0	0	114.3	V346 E397 F398	V346-Q401 PolarHBondContact N-O 3.44Å; E397-Q401 PolarHBondContact O-N 2.73Å; E397-Q401 PolarHBondContact O-NE2 2.9Å; F398-Q401 PolarHBondContact O-N 2.69Å
402	V	82.7	Confident	88.3	Confident	10 Å²	10	56.3 Å²	56.3	6%	0.061	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-126.5	126.7	-177.4	-178	0	0	0	0	110.2	V346 L349 F398 D404 V407	V346-V402 HydrophobicContact CB-CG2 4.26Å; L349-V402 HydrophobicContact CD1-CG1 4.1Å; L349-V402 HydrophobicContact CG-CG1 4.31Å; F398-V402 HydrophobicContact CD1-CG2 3.97Å; F398-V402 PolarHBondContact O-N 3.14Å; V402-D404 HydrophobicContact CG1-CB 3.87Å; V402-V407 HydrophobicContact CG1-CG2 3.98Å
403	S	82.9	Confident	88.2	Confident	59 Å²	59	55.2 Å²	55.2	41%	0.413	28%	0.282	S	S	.	.			trans	-119.4	11	177.3	56.6	0	0	0	0	113.4	V346 E405 T408	V346-S403 PolarHBondContact O-N 2.98Å; V346-S403 PolarHBondContact O-OG 2.99Å; S403-E405 PolarHBondContact O-N 3.41Å; S403-T408 VanDerWaalsContact C-OG1 3.28Å
404	D	84.8	Confident	88.3	Confident	3 Å²	3	50.1 Å²	50.1	2%	0.016	26%	0.259	C	S	.	.			trans	-60.4	122.2	178.2	-177	-57.1	0	0	0	112.2	R347 H348 L349 R354 V402 E406 V407 T408	R347-D404 VanDerWaalsContact O-CA 3.32Å; R347-D404 WeakPolarHBondContact O-CA 2.91Å; H348-D404 WeakPolarHBondContact CA-OD2 3.39Å; H348-D404 IonicContact ND1-OD2 2.78Å; L349-D404 HydrophobicContact CG-CB 4.48Å; L349-D404 PolarHBondContact N-OD2 3.28Å; R354-D404 IonicContact CZ-OD1 3.21Å; R354-D404 IonicContact CZ-OD2 2.89Å; R354-D404 IonicContact NH1-OD1 2.68Å; R354-D404 PolarHBondContact NH1-OD1 3.29Å; R354-D404 IonicContact NH1-OD2 2.69Å; R354-D404 PolarHBondContact NH1-OD2 3.47Å; R354-D404 IonicContact NH2-OD1 2.72Å; R354-D404 IonicContact NH2-OD2 2.67Å; R354-D404 PolarHBondContact NH2-OD2 3.05Å; V402-D404 HydrophobicContact CG1-CB 3.87Å; D404-E406 VanDerWaalsContact C-N 3.32Å; D404-E406 PolarHBondContact O-N 3.34Å; D404-E406 PolarHBondContact OD1-N 3.47Å; D404-V407 HydrophobicContact CB-CG2 3.76Å; D404-V407 PolarHBondContact O-N 3.47Å; D404-T408 PolarHBondContact N-OG1 2.87Å; D404-T408 VanDerWaalsContact O-CB 3.22Å; D404-T408 WeakPolarHBondContact O-CB 3.15Å; D404-T408 PolarHBondContact O-N 3.43Å; D404-T408 PolarHBondContact O-OG1 2.91Å
405	E	84.2	Confident	88.5	Confident	150 Å²	150	50 Å²	50	70%	0.701	26%	0.26	S	S	*	.	H	α-helix	trans	-61.2	-33.7	-166.7	-172.9	167.1	-165.4	0	0	113.9	S403 N409	S403-E405 PolarHBondContact O-N 3.41Å; E405-N409 PolarHBondContact O-ND2 2.95Å
406	E	84.7	Confident	88.5	Confident	128 Å²	128	52.2 Å²	52.2	60%	0.598	27%	0.27	S	S	*	.	H	α-helix	trans	-79.5	-25.4	-175.8	-49.4	-178.5	168.2	0	0	112.8	R354 D404 N410	R354-E406 VanDerWaalsContact CD-OE2 3.24Å; R354-E406 WeakPolarHBondContact CD-OE2 3.35Å; R354-E406 IonicContact CZ-OE2 3.24Å; R354-E406 IonicContact NE-OE2 3.7Å; R354-E406 PolarHBondContact NE-OE2 2.92Å; R354-E406 VanDerWaalsContact NH1-CD 3.3Å; R354-E406 IonicContact NH1-OE2 2.67Å; R354-E406 PolarHBondContact NH1-OE2 3.27Å; D404-E406 VanDerWaalsContact C-N 3.32Å; D404-E406 PolarHBondContact O-N 3.34Å; D404-E406 PolarHBondContact OD1-N 3.47Å; E406-N410 PolarHBondContact O-ND2 3.5Å
407	V	88.8	Confident	88.7	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.012	25%	0.251	C	S	.	.	H	α-helix	trans	-105.5	-25.5	-180	-63.7	0	0	0	0	113.9	L349 R354 L357 V402 D404 N409 N410 L411	L349-V407 HydrophobicContact CD1-CG1 4.47Å; L349-V407 HydrophobicContact CD1-CG2 3.74Å; R354-V407 HydrophobicContact CG-CG1 4.19Å; L357-V407 HydrophobicContact CD2-CB 3.97Å; L357-V407 HydrophobicContact CD2-CG1 4.17Å; L357-V407 HydrophobicContact CD2-CG2 3.99Å; V402-V407 HydrophobicContact CG1-CG2 3.98Å; D404-V407 HydrophobicContact CB-CG2 3.76Å; D404-V407 PolarHBondContact O-N 3.47Å; V407-N409 VanDerWaalsContact C-N 3.29Å; V407-N409 PolarHBondContact O-N 2.91Å; V407-N410 PolarHBondContact O-N 3.2Å; V407-N410 VanDerWaalsContact O-N 3.09Å; V407-L411 PolarHBondContact O-N 3.01Å
408	T	90.1	Very high	89	Confident	28 Å²	28	44.9 Å²	44.9	17%	0.172	24%	0.235	C	C	.	.	H	α-helix	trans	-60.7	-39.1	-177.1	-65.5	0	0	0	0	111.7	S403 D404 N410 L411 I412	S403-T408 VanDerWaalsContact C-OG1 3.28Å; D404-T408 PolarHBondContact N-OG1 2.87Å; D404-T408 VanDerWaalsContact O-CB 3.22Å; D404-T408 WeakPolarHBondContact O-CB 3.15Å; D404-T408 PolarHBondContact O-N 3.43Å; D404-T408 PolarHBondContact O-OG1 2.91Å; T408-N410 PolarHBondContact O-N 3.33Å; T408-L411 PolarHBondContact O-N 3.34Å; T408-I412 HydrophobicContact CG2-CD1 3.89Å; T408-I412 HydrophobicContact CG2-CG1 4.43Å; T408-I412 VanDerWaalsContact O-CG1 3.27Å; T408-I412 WeakPolarHBondContact O-CG1 3.03Å; T408-I412 PolarHBondContact O-N 2.68Å
409	N	89.9	Confident	89.2	Confident	64 Å²	64	45.8 Å²	45.8	34%	0.342	25%	0.245	S	C	.	.	H	α-helix	trans	-61.9	-42.1	175.8	-68.1	-64.7	0	0	0	112.1	E405 V407 I412 Q413	E405-N409 PolarHBondContact O-ND2 2.95Å; V407-N409 VanDerWaalsContact C-N 3.29Å; V407-N409 PolarHBondContact O-N 2.91Å; N409-I412 PolarHBondContact O-N 3.22Å; N409-Q413 WeakPolarHBondContact O-CB 3.36Å; N409-Q413 PolarHBondContact O-N 2.95Å
410	N	92	Very high	89.2	Confident	70 Å²	70	46.5 Å²	46.5	37%	0.374	25%	0.249	S	C	.	.	H	α-helix	trans	-69	-40.8	177.4	-62.8	-41.1	0	0	0	111.6	L361 E406 V407 T408 Q413 V414	L361-N410 HydrophobicContact CD1-CB 4.22Å; E406-N410 PolarHBondContact O-ND2 3.5Å; V407-N410 PolarHBondContact O-N 3.2Å; V407-N410 VanDerWaalsContact O-N 3.09Å; T408-N410 PolarHBondContact O-N 3.33Å; N410-Q413 PolarHBondContact O-N 3.06Å; N410-V414 WeakPolarHBondContact O-CB 3.21Å; N410-V414 WeakPolarHBondContact O-CG2 3.27Å; N410-V414 PolarHBondContact O-N 2.86Å
411	L	92.9	Very high	89.2	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-59.5	-45.3	173.5	-78.7	166.5	0	0	0	111.9	L357 L361 V395 F398 L399 V407 T408 N415	L357-L411 HydrophobicContact CD1-CD2 4.47Å; L357-L411 HydrophobicContact CD2-CD1 4.32Å; L361-L411 HydrophobicContact CD1-CD2 4.22Å; L361-L411 HydrophobicContact CD1-CG 4.3Å; L361-L411 HydrophobicContact CD2-CD2 4.05Å; V395-L411 HydrophobicContact CG1-CD2 4.28Å; F398-L411 HydrophobicContact CB-CD1 4.25Å; F398-L411 HydrophobicContact CB-CD2 3.86Å; L399-L411 HydrophobicContact CD2-CB 3.6Å; L399-L411 HydrophobicContact CG-CB 4.02Å; V407-L411 PolarHBondContact O-N 3.01Å; T408-L411 PolarHBondContact O-N 3.34Å; L411-N415 VanDerWaalsContact O-CB 3.26Å; L411-N415 WeakPolarHBondContact O-CB 3.39Å; L411-N415 PolarHBondContact O-N 3.1Å
412	I	93.1	Very high	89.6	Confident	43 Å²	43	38.5 Å²	38.5	22%	0.221	20%	0.203	C	C	.	.	H	α-helix	trans	-61.6	-46.6	176.5	-69.3	168.2	0	0	0	110.6	P228 L399 T408 N409 N415 E416	P228-I412 HydrophobicContact CG-CG2 4.19Å; L399-I412 HydrophobicContact CD2-CG1 3.74Å; T408-I412 HydrophobicContact CG2-CD1 3.89Å; T408-I412 HydrophobicContact CG2-CG1 4.43Å; T408-I412 VanDerWaalsContact O-CG1 3.27Å; T408-I412 WeakPolarHBondContact O-CG1 3.03Å; T408-I412 PolarHBondContact O-N 2.68Å; N409-I412 PolarHBondContact O-N 3.22Å; I412-N415 WeakPolarHBondContact O-CB 3.45Å; I412-N415 PolarHBondContact O-N 3.02Å; I412-E416 PolarHBondContact O-N 3.09Å
413	Q	92.6	Very high	89.7	Confident	23 Å²	23	41.4 Å²	41.4	11%	0.107	22%	0.224	C	C	.	.	H	α-helix	trans	-61.4	-49.1	178.7	-180	166.8	-26.2	0	0	111.9	P228 N409 N410 N415 E416 N417	P228-Q413 HydrophobicContact CG-CB 4.02Å; N409-Q413 WeakPolarHBondContact O-CB 3.36Å; N409-Q413 PolarHBondContact O-N 2.95Å; N410-Q413 PolarHBondContact O-N 3.06Å; Q413-N415 VanDerWaalsContact C-N 3.28Å; Q413-N415 PolarHBondContact O-N 2.98Å; Q413-E416 PolarHBondContact O-N 2.66Å; Q413-N417 WeakPolarHBondContact O-CB 3.3Å; Q413-N417 PolarHBondContact O-N 2.98Å; Q413-N417 PolarHBondContact O-ND2 3.39Å; Q413-N417 PolarHBondContact O-OD1 3.31Å
414	V	92.7	Very high	89.7	Confident	3 Å²	3	42.8 Å²	42.8	2%	0.018	22%	0.22	C	C	.	.	H	α-helix	trans	-63.6	-35.5	178.6	173	0	0	0	0	111.5	L361 V364 E365 I368 V395 N410 N417 L418	L361-V414 HydrophobicContact CB-CG2 4.45Å; L361-V414 HydrophobicContact CD2-CB 4.08Å; L361-V414 HydrophobicContact CD2-CG1 3.94Å; L361-V414 HydrophobicContact CD2-CG2 4.09Å; V364-V414 HydrophobicContact CB-CG1 4.08Å; V364-V414 HydrophobicContact CG1-CG1 3.43Å; V364-V414 VanDerWaalsContact CG1-CG1 3.43Å; E365-V414 HydrophobicContact CG-CG2 3.76Å; I368-V414 HydrophobicContact CD1-CG1 4.38Å; V395-V414 HydrophobicContact CG2-CG1 4.24Å; N410-V414 WeakPolarHBondContact O-CB 3.21Å; N410-V414 WeakPolarHBondContact O-CG2 3.27Å; N410-V414 PolarHBondContact O-N 2.86Å; V414-N417 PolarHBondContact O-N 2.79Å; V414-L418 HydrophobicContact CG1-CD1 4.08Å; V414-L418 HydrophobicContact CG1-CG 4.49Å; V414-L418 WeakPolarHBondContact O-CB 3.09Å; V414-L418 WeakPolarHBondContact O-CG 3.42Å; V414-L418 PolarHBondContact O-N 3.42Å
415	N	94.2	Very high	89.7	Confident	26 Å²	26	43.2 Å²	43.2	14%	0.139	22%	0.222	C	C	.	.	H	α-helix	trans	-65	-44	174.8	-166.5	39.1	0	0	0	113	H392 V395 M396 L399 L411 I412 Q413 L418 T419	H392-N415 PolarHBondContact CD2-OD1 3.01Å; H392-N415 VanDerWaalsContact CD2-OD1 3.23Å; H392-N415 PolarHBondContact NE2-OD1 3.43Å; V395-N415 HydrophobicContact CG1-CB 3.69Å; M396-N415 PolarHBondContact SD-ND2 3.36Å; L399-N415 HydrophobicContact CD1-CB 3.66Å; L399-N415 WeakPolarHBondContact CD1-ND2 3.35Å; L411-N415 VanDerWaalsContact O-CB 3.26Å; L411-N415 WeakPolarHBondContact O-CB 3.39Å; L411-N415 PolarHBondContact O-N 3.1Å; I412-N415 WeakPolarHBondContact O-CB 3.45Å; I412-N415 PolarHBondContact O-N 3.02Å; Q413-N415 VanDerWaalsContact C-N 3.28Å; Q413-N415 PolarHBondContact O-N 2.98Å; N415-L418 PolarHBondContact O-N 3.14Å; N415-T419 WeakPolarHBondContact O-CB 3.38Å; N415-T419 PolarHBondContact O-N 3.02Å; N415-T419 PolarHBondContact O-OG1 2.69Å
416	E	93.1	Very high	89.7	Confident	46 Å²	46	38.3 Å²	38.3	22%	0.215	20%	0.2	C	C	.	.	H	α-helix	trans	-62.4	-44.8	174.3	179.7	170.2	-127.2	0	0	110.9	S230 I412 Q413 L418 T419 N420	S230-E416 WeakPolarHBondContact CB-OE1 3.38Å; S230-E416 PolarHBondContact N-OE2 2.93Å; S230-E416 PolarHBondContact OG-OE1 2.9Å; I412-E416 PolarHBondContact O-N 3.09Å; Q413-E416 PolarHBondContact O-N 2.66Å; E416-L418 PolarHBondContact O-N 3.06Å; E416-T419 PolarHBondContact O-N 2.98Å; E416-N420 WeakPolarHBondContact CG-ND2 3.13Å; E416-N420 WeakPolarHBondContact O-CB 3.49Å; E416-N420 PolarHBondContact O-N 3.01Å; E416-N420 PolarHBondContact O-ND2 3.34Å
417	N	92.9	Very high	89.4	Confident	7 Å²	7	34.7 Å²	34.7	4%	0.037	18%	0.181	C	C	.	.	H	α-helix	trans	-60.2	-44.2	177.3	-63.5	-12.6	0	0	0	111.8	H233 I368 Q413 V414 T421	H233-N417 PolarHBondContact CE1-OD1 2.99Å; H233-N417 PolarHBondContact ND1-OD1 2.96Å; I368-N417 HydrophobicContact CD1-CB 3.64Å; I368-N417 HydrophobicContact CG2-CB 4.37Å; Q413-N417 WeakPolarHBondContact O-CB 3.3Å; Q413-N417 PolarHBondContact O-N 2.98Å; Q413-N417 PolarHBondContact O-ND2 3.39Å; Q413-N417 PolarHBondContact O-OD1 3.31Å; V414-N417 PolarHBondContact O-N 2.79Å; N417-T421 WeakPolarHBondContact O-CB 3.23Å; N417-T421 PolarHBondContact O-N 2.92Å; N417-T421 PolarHBondContact O-OG1 2.98Å
418	L	93.3	Very high	89.1	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-65.1	-48.8	174.6	-77.5	168.1	0	0	0	111.8	V364 I368 C388 M391 H392 V395 V414 N415 E416 N420 T421 L422	V364-L418 HydrophobicContact CG1-CD1 3.76Å; V364-L418 HydrophobicContact CG1-CD2 4.11Å; V364-L418 HydrophobicContact CG1-CG 4.13Å; I368-L418 HydrophobicContact CD1-CD2 3.86Å; I368-L418 HydrophobicContact CD1-CG 3.7Å; I368-L418 HydrophobicContact CG1-CD2 3.62Å; I368-L418 HydrophobicContact CG1-CG 4.05Å; C388-L418 HydrophobicContact CB-CD2 4.12Å; M391-L418 HydrophobicContact CB-CD1 4.44Å; H392-L418 HydrophobicContact CB-CB 4.23Å; H392-L418 HydrophobicContact CB-CD1 3.96Å; V395-L418 HydrophobicContact CG2-CD1 4.19Å; V414-L418 HydrophobicContact CG1-CD1 4.08Å; V414-L418 HydrophobicContact CG1-CG 4.49Å; V414-L418 WeakPolarHBondContact O-CB 3.09Å; V414-L418 WeakPolarHBondContact O-CG 3.42Å; V414-L418 PolarHBondContact O-N 3.42Å; N415-L418 PolarHBondContact O-N 3.14Å; E416-L418 PolarHBondContact O-N 3.06Å; L418-N420 VanDerWaalsContact C-N 3.3Å; L418-N420 PolarHBondContact O-N 2.85Å; L418-T421 PolarHBondContact O-N 2.98Å; L418-T421 VanDerWaalsContact O-N 3.14Å; L418-L422 WeakPolarHBondContact O-CB 3.24Å; L418-L422 VanDerWaalsContact O-CG 3.27Å; L418-L422 WeakPolarHBondContact O-CG 3.37Å; L418-L422 PolarHBondContact O-N 3.04Å
419	T	92.9	Very high	88.5	Confident	66 Å²	66	38.6 Å²	38.6	41%	0.405	20%	0.197	S	C	.	.	H	α-helix	trans	-55.4	-46.7	179.3	-62.5	0	0	0	0	111	H392 N415 E416 S423	H392-T419 PolarHBondContact NE2-OG1 3.01Å; N415-T419 WeakPolarHBondContact O-CB 3.38Å; N415-T419 PolarHBondContact O-N 3.02Å; N415-T419 PolarHBondContact O-OG1 2.69Å; E416-T419 PolarHBondContact O-N 2.98Å; T419-S423 VanDerWaalsContact O-CB 3.24Å; T419-S423 WeakPolarHBondContact O-CB 3.42Å; T419-S423 PolarHBondContact O-N 3.26Å
420	N	87.9	Confident	87.9	Confident	64 Å²	64	42.2 Å²	42.2	34%	0.342	21%	0.206	S	C	.	.	H	α-helix	trans	-64.2	-43.4	177.6	-74.1	-41.1	0	0	0	112.3	E416 L418 S423 R424	E416-N420 WeakPolarHBondContact CG-ND2 3.13Å; E416-N420 WeakPolarHBondContact O-CB 3.49Å; E416-N420 PolarHBondContact O-N 3.01Å; E416-N420 PolarHBondContact O-ND2 3.34Å; L418-N420 VanDerWaalsContact C-N 3.3Å; L418-N420 PolarHBondContact O-N 2.85Å; N420-S423 WeakPolarHBondContact O-CB 3.4Å; N420-S423 PolarHBondContact O-N 2.69Å; N420-R424 PolarHBondContact O-N 2.98Å
421	T	85.8	Confident	86.7	Confident	4 Å²	4	43.4 Å²	43.4	3%	0.025	21%	0.205	C	C	.	.	H	α-helix	trans	-70.3	-42.3	-177.9	-55.6	0	0	0	0	112.3	L371 N372 L375 N417 L418 S423 R424 Y425	L371-T421 HydrophobicContact CB-CG2 4.19Å; L371-T421 HydrophobicContact CD2-CG2 3.89Å; L371-T421 HydrophobicContact CG-CG2 3.98Å; N372-T421 VanDerWaalsContact ND2-CG2 3.3Å; N372-T421 WeakPolarHBondContact ND2-CG2 3.37Å; N372-T421 PolarHBondContact ND2-OG1 3.31Å; L375-T421 HydrophobicContact CD1-CG2 4.4Å; N417-T421 WeakPolarHBondContact O-CB 3.23Å; N417-T421 PolarHBondContact O-N 2.92Å; N417-T421 PolarHBondContact O-OG1 2.98Å; L418-T421 PolarHBondContact O-N 2.98Å; L418-T421 VanDerWaalsContact O-N 3.14Å; T421-S423 VanDerWaalsContact C-N 3.31Å; T421-S423 PolarHBondContact O-N 2.78Å; T421-R424 WeakPolarHBondContact O-CB 3.35Å; T421-R424 PolarHBondContact O-N 2.85Å; T421-Y425 PolarHBondContact O-N 3.46Å
422	L	90.6	Very high	85.7	Confident	11 Å²	11	48.4 Å²	48.4	6%	0.058	23%	0.225	C	C	.	.	H	α-helix	trans	-64.9	-35.5	174.1	-67	174.5	0	0	0	111.4	N385 C388 R389 H392 L418 Y425 D426	N385-L422 VanDerWaalsContact OD1-CD2 3.24Å; N385-L422 WeakPolarHBondContact OD1-CD2 3.5Å; C388-L422 HydrophobicContact CB-CD2 4.01Å; R389-L422 HydrophobicContact CG-CD1 4.04Å; R389-L422 HydrophobicContact CG-CD2 3.54Å; R389-L422 HydrophobicContact CG-CG 4.42Å; H392-L422 HydrophobicContact CB-CD1 3.79Å; L418-L422 WeakPolarHBondContact O-CB 3.24Å; L418-L422 VanDerWaalsContact O-CG 3.27Å; L418-L422 WeakPolarHBondContact O-CG 3.37Å; L418-L422 PolarHBondContact O-N 3.04Å; L422-Y425 PolarHBondContact O-N 3.12Å; L422-D426 PolarHBondContact O-N 2.97Å
423	S	84	Confident	84.7	Confident	72 Å²	72	50.8 Å²	50.8	50%	0.503	24%	0.235	S	C	.	.	H	α-helix	trans	-64.9	-38.7	172	-174.2	0	0	0	0	112.5	T419 N420 T421 R427	T419-S423 VanDerWaalsContact O-CB 3.24Å; T419-S423 WeakPolarHBondContact O-CB 3.42Å; T419-S423 PolarHBondContact O-N 3.26Å; N420-S423 WeakPolarHBondContact O-CB 3.4Å; N420-S423 PolarHBondContact O-N 2.69Å; T421-S423 VanDerWaalsContact C-N 3.31Å; T421-S423 PolarHBondContact O-N 2.78Å; S423-R427 WeakPolarHBondContact O-CB 3.39Å; S423-R427 PolarHBondContact O-N 3.32Å; S423-R427 VanDerWaalsContact O-N 3.13Å
424	R	83.2	Confident	83.7	Confident	87 Å²	87	56 Å²	56	33%	0.328	25%	0.254	S	S	.	.	H	α-helix	trans	-61.2	-44	169.8	-67.6	-179.5	86.4	-152.9	4.9	111.2	N83 N372 L375 N420 T421 R427 F428	N83-R424 PolarHBondContact OD1-NH2 2.93Å; N372-R424 WeakPolarHBondContact OD1-CD 3.29Å; N372-R424 PolarHBondContact OD1-NH1 3.23Å; L375-R424 HydrophobicContact CD1-CB 3.92Å; N420-R424 PolarHBondContact O-N 2.98Å; T421-R424 WeakPolarHBondContact O-CB 3.35Å; T421-R424 PolarHBondContact O-N 2.85Å; R424-R427 PolarHBondContact O-N 3.44Å; R424-F428 PolarHBondContact O-N 3.29Å
425	Y	85.8	Confident	82.3	Confident	13 Å²	13	57.8 Å²	57.8	5%	0.051	27%	0.269	C	S	.	.	H	α-helix	trans	-62.9	-49.7	176.5	-172.7	-73.2	0	0	0	112.2	L371 L375 P380 N385 T421 L422 R427 F428 E429	L371-Y425 HydrophobicContact CD1-CD2 4.27Å; L375-Y425 HydrophobicContact CD2-CD2 4.26Å; P380-Y425 HydrophobicContact CB-CD2 3.98Å; P380-Y425 HydrophobicContact CB-CE2 3.84Å; P380-Y425 HydrophobicContact CG-CD2 4.45Å; P380-Y425 HydrophobicContact CG-CE2 4.15Å; N385-Y425 HydrophobicContact CB-CD2 3.63Å; N385-Y425 HydrophobicContact CB-CE2 3.4Å; N385-Y425 VanDerWaalsContact CB-CE2 3.4Å; N385-Y425 HydrophobicContact CB-CG 4.25Å; N385-Y425 VanDerWaalsContact CG-CE2 3.47Å; N385-Y425 VanDerWaalsContact CG-CG 3.49Å; N385-Y425 WeakPolarHBondContact ND2-CD1 3.38Å; N385-Y425 WeakPolarHBondContact ND2-CE1 3.4Å; T421-Y425 PolarHBondContact O-N 3.46Å; L422-Y425 PolarHBondContact O-N 3.12Å; Y425-R427 PolarHBondContact O-N 3.29Å; Y425-R427 VanDerWaalsContact O-N 3.12Å; Y425-F428 WeakPolarHBondContact O-CB 3.46Å; Y425-F428 PolarHBondContact O-N 3.06Å; Y425-E429 HydrophobicContact CD1-CB 4.47Å; Y425-E429 HydrophobicContact CE1-CB 4.16Å; Y425-E429 PolarHBondContact O-N 3.11Å
426	D	84.1	Confident	81	Confident	47 Å²	47	60.2 Å²	60.2	25%	0.251	28%	0.281	S	S	.	.	H	α-helix	trans	-60.8	-25.1	179.9	-71	-10	0	0	0	112.2	R389 L422 R430	R389-D426 IonicContact CZ-OD1 3.42Å; R389-D426 VanDerWaalsContact CZ-OD1 3.24Å; R389-D426 IonicContact NH1-OD1 2.75Å; R389-D426 PolarHBondContact NH1-OD1 2.95Å; R389-D426 IonicContact NH1-OD2 3.22Å; R389-D426 IonicContact NH2-OD1 3.43Å; R389-D426 PolarHBondContact NH2-OD1 3.29Å; L422-D426 PolarHBondContact O-N 2.97Å; D426-R430 WeakPolarHBondContact O-CG 3.4Å; D426-R430 PolarHBondContact O-N 3.44Å; D426-R430 PolarHBondContact O-NE 3.19Å
427	R	76.9	Confident	79.7	Confident	52 Å²	52	63.2 Å²	63.2	20%	0.196	30%	0.295	C	S	.	.	H	α-helix	trans	-80.6	-41.9	174.3	-174.7	177.6	174.4	176	-6.8	111.9	W31 L35 S423 R424 Y425 R430 Y431	W31-R427 PolarHBondContact O-NE 3.21Å; W31-R427 VanDerWaalsContact O-NE 3.14Å; W31-R427 PolarHBondContact O-NH2 2.89Å; L35-R427 HydrophobicContact CD1-CG 3.99Å; S423-R427 WeakPolarHBondContact O-CB 3.39Å; S423-R427 PolarHBondContact O-N 3.32Å; S423-R427 VanDerWaalsContact O-N 3.13Å; R424-R427 PolarHBondContact O-N 3.44Å; Y425-R427 PolarHBondContact O-N 3.29Å; Y425-R427 VanDerWaalsContact O-N 3.12Å; R427-R430 PolarHBondContact O-N 3.11Å; R427-Y431 PolarHBondContact O-N 3.01Å
428	F	82.4	Confident	78	Confident	34 Å²	34	67.7 Å²	67.7	15%	0.149	32%	0.319	C	S	.	.	H	α-helix	trans	-57.6	-48.3	170.4	170	-86.6	0	0	0	111.2	L375 L378 P380 R424 Y425 R430 Y431 Y432	L375-F428 HydrophobicContact CD2-CB 3.83Å; L375-F428 HydrophobicContact CD2-CG 4.1Å; L378-F428 HydrophobicContact CB-CE2 4.22Å; L378-F428 HydrophobicContact CD2-CD2 4.1Å; L378-F428 HydrophobicContact CD2-CE2 4.07Å; P380-F428 VanDerWaalsContact CD-CZ 3.46Å; P380-F428 HydrophobicContact CG-CD1 3.49Å; P380-F428 VanDerWaalsContact CG-CD1 3.49Å; P380-F428 HydrophobicContact CG-CD2 4.3Å; P380-F428 HydrophobicContact CG-CE1 3.29Å; P380-F428 HydrophobicContact CG-CE2 4.12Å; P380-F428 HydrophobicContact CG-CG 4.01Å; P380-F428 HydrophobicContact CG-CZ 3.64Å; R424-F428 PolarHBondContact O-N 3.29Å; Y425-F428 WeakPolarHBondContact O-CB 3.46Å; Y425-F428 PolarHBondContact O-N 3.06Å; F428-R430 VanDerWaalsContact C-N 3.33Å; F428-R430 PolarHBondContact O-N 3.35Å; F428-Y431 WeakPolarHBondContact O-CB 3.31Å; F428-Y431 PolarHBondContact O-N 3.44Å; F428-Y432 HydrophobicContact CE1-CG 4.44Å; F428-Y432 HydrophobicContact CZ-CD2 4.29Å; F428-Y432 HydrophobicContact CZ-CG 4.49Å; F428-Y432 WeakPolarHBondContact O-CB 3.49Å; F428-Y432 PolarHBondContact O-N 3.2Å
429	E	79.1	Confident	76	Confident	77 Å²	77	71 Å²	71	36%	0.36	34%	0.342	S	S	.	.	H	α-helix	trans	-60.8	-43.1	-179	-174.3	-179.3	-109.9	0	0	111.4	Y425 Y431 Y432 Q433	Y425-E429 HydrophobicContact CD1-CB 4.47Å; Y425-E429 HydrophobicContact CE1-CB 4.16Å; Y425-E429 PolarHBondContact O-N 3.11Å; E429-Y431 VanDerWaalsContact C-N 3.33Å; E429-Y431 PolarHBondContact O-N 3.01Å; E429-Y432 PolarHBondContact O-N 2.64Å; E429-Q433 WeakPolarHBondContact O-CB 3.44Å; E429-Q433 VanDerWaalsContact O-CG 3.27Å; E429-Q433 WeakPolarHBondContact O-CG 3.28Å; E429-Q433 PolarHBondContact O-N 2.79Å
430	R	75.4	Confident	73.9	Confident	141 Å²	141	72.9 Å²	72.9	53%	0.532	35%	0.35	S	S	.	.	H	α-helix	trans	-64	-33.4	174.2	-79.9	179.2	-95.5	-173.2	-10.4	113.3	D426 R427 F428 R434	D426-R430 WeakPolarHBondContact O-CG 3.4Å; D426-R430 PolarHBondContact O-N 3.44Å; D426-R430 PolarHBondContact O-NE 3.19Å; R427-R430 PolarHBondContact O-N 3.11Å; F428-R430 VanDerWaalsContact C-N 3.33Å; F428-R430 PolarHBondContact O-N 3.35Å; R430-R434 WeakPolarHBondContact O-CD 3.4Å; R430-R434 VanDerWaalsContact O-CG 3.27Å; R430-R434 WeakPolarHBondContact O-CG 3.36Å; R430-R434 PolarHBondContact O-N 2.71Å
431	Y	67.5	Low	72	Confident	94 Å²	94	75.6 Å²	75.6	37%	0.369	36%	0.364	S	S	.	.	H	α-helix	trans	-70.1	-49.9	173.5	173.3	-86.5	0	0	0	111	R427 F428 E429 Q433 R434 A435	R427-Y431 PolarHBondContact O-N 3.01Å; F428-Y431 WeakPolarHBondContact O-CB 3.31Å; F428-Y431 PolarHBondContact O-N 3.44Å; E429-Y431 VanDerWaalsContact C-N 3.33Å; E429-Y431 PolarHBondContact O-N 3.01Å; Y431-Q433 PolarHBondContact O-N 3.45Å; Y431-R434 WeakPolarHBondContact O-CB 3.48Å; Y431-R434 PolarHBondContact O-N 2.88Å; Y431-A435 PolarHBondContact O-N 2.86Å
432	Y	72.9	Confident	70.2	Confident	106 Å²	106	82.1 Å²	82.1	42%	0.416	40%	0.399	S	S	.	.	H	α-helix	trans	-58.9	-43.4	-179.1	-173.4	-104.7	0	0	0	112.2	F428 E429 R434 A435 I436 L456	F428-Y432 HydrophobicContact CE1-CG 4.44Å; F428-Y432 HydrophobicContact CZ-CD2 4.29Å; F428-Y432 HydrophobicContact CZ-CG 4.49Å; F428-Y432 WeakPolarHBondContact O-CB 3.49Å; F428-Y432 PolarHBondContact O-N 3.2Å; E429-Y432 PolarHBondContact O-N 2.64Å; Y432-R434 VanDerWaalsContact C-N 3.32Å; Y432-R434 PolarHBondContact O-N 3.13Å; Y432-A435 PolarHBondContact O-N 2.92Å; Y432-I436 HydrophobicContact CD1-CD1 3.91Å; Y432-I436 HydrophobicContact CE1-CD1 3.53Å; Y432-I436 WeakPolarHBondContact O-CG1 3.35Å; Y432-I436 PolarHBondContact O-N 3.24Å; Y432-I436 VanDerWaalsContact O-N 3.15Å; Y432-L456 HydrophobicContact CE1-CD1 3.74Å
433	Q	71	Confident	67.8	Low	92 Å²	92	87.6 Å²	87.6	43%	0.43	43%	0.428	S	S	.	.	H	α-helix	trans	-59.4	-38.8	173.6	-72.7	173.7	13.7	0	0	112.9	E429 Y431 Q437	E429-Q433 WeakPolarHBondContact O-CB 3.44Å; E429-Q433 VanDerWaalsContact O-CG 3.27Å; E429-Q433 WeakPolarHBondContact O-CG 3.28Å; E429-Q433 PolarHBondContact O-N 2.79Å; Y431-Q433 PolarHBondContact O-N 3.45Å; Q433-Q437 VanDerWaalsContact O-CG 3.26Å; Q433-Q437 WeakPolarHBondContact O-CG 3.32Å; Q433-Q437 PolarHBondContact O-N 3.08Å; Q433-Q437 VanDerWaalsContact O-N 3.15Å
434	R	71	Confident	65.5	Low	133 Å²	133	89 Å²	89	50%	0.502	44%	0.438	S	S	.	.	H	α-helix	trans	-71.7	-38.2	177	-70.1	170	-177.8	-168.7	0.4	112.3	R430 Y431 Y432 I436 Q437 N438	R430-R434 WeakPolarHBondContact O-CD 3.4Å; R430-R434 VanDerWaalsContact O-CG 3.27Å; R430-R434 WeakPolarHBondContact O-CG 3.36Å; R430-R434 PolarHBondContact O-N 2.71Å; Y431-R434 WeakPolarHBondContact O-CB 3.48Å; Y431-R434 PolarHBondContact O-N 2.88Å; Y432-R434 VanDerWaalsContact C-N 3.32Å; Y432-R434 PolarHBondContact O-N 3.13Å; R434-I436 VanDerWaalsContact C-N 3.32Å; R434-I436 PolarHBondContact O-N 2.96Å; R434-Q437 PolarHBondContact O-N 2.72Å; R434-N438 WeakPolarHBondContact O-CB 3.33Å; R434-N438 VanDerWaalsContact O-CG 3.28Å; R434-N438 PolarHBondContact O-N 2.65Å
435	A	65.2	Low	63.3	Low	40 Å²	40	89.2 Å²	89.2	33%	0.331	45%	0.453	S	S	.	.	H	α-helix	trans	-61.5	-40.5	177.1	0	0	0	0	0	112.1	Y431 Y432 S439	Y431-A435 PolarHBondContact O-N 2.86Å; Y432-A435 PolarHBondContact O-N 2.92Å; A435-S439 PolarHBondContact O-N 3.4Å; A435-S439 PolarHBondContact O-OG 2.92Å
436	I	66.4	Low	61	Low	78 Å²	78	95.3 Å²	95.3	40%	0.4	49%	0.487	S	S	.	.	H	α-helix	trans	-63	-53.6	171.8	-65.5	169	0	0	0	110.5	Y432 R434 N438 S439 D440	Y432-I436 HydrophobicContact CD1-CD1 3.91Å; Y432-I436 HydrophobicContact CE1-CD1 3.53Å; Y432-I436 WeakPolarHBondContact O-CG1 3.35Å; Y432-I436 PolarHBondContact O-N 3.24Å; Y432-I436 VanDerWaalsContact O-N 3.15Å; R434-I436 VanDerWaalsContact C-N 3.32Å; R434-I436 PolarHBondContact O-N 2.96Å; I436-N438 VanDerWaalsContact C-N 3.27Å; I436-N438 PolarHBondContact O-N 2.59Å; I436-S439 WeakPolarHBondContact O-CA 3.41Å; I436-S439 VanDerWaalsContact O-CB 3.3Å; I436-S439 WeakPolarHBondContact O-CB 3.4Å; I436-S439 PolarHBondContact O-N 2.88Å; I436-D440 PolarHBondContact O-N 3.28Å; I436-D440 VanDerWaalsContact O-N 3.11Å
437	Q	65.4	Low	58.6	Low	108 Å²	108	100 Å²	100	51%	0.505	51%	0.512	S	S	.	.	H	α-helix	trans	-58.5	-35.3	-178.8	-71.7	167.8	10.9	0	0	113.4	Q433 R434 S439 N441	Q433-Q437 VanDerWaalsContact O-CG 3.26Å; Q433-Q437 WeakPolarHBondContact O-CG 3.32Å; Q433-Q437 PolarHBondContact O-N 3.08Å; Q433-Q437 VanDerWaalsContact O-N 3.15Å; R434-Q437 PolarHBondContact O-N 2.72Å; Q437-S439 VanDerWaalsContact C-N 3.32Å; Q437-N441 PolarHBondContact O-N 3.1Å; Q437-N441 PolarHBondContact O-ND2 3.31Å
438	N	56.5	Low	56.7	Low	102 Å²	102	107 Å²	107	55%	0.545	55%	0.547	S	S	.	.	H	α-helix	trans	-73	-25.1	176.1	-72.4	-12.4	0	0	0	112.8	R434 I436 N442	R434-N438 WeakPolarHBondContact O-CB 3.33Å; R434-N438 VanDerWaalsContact O-CG 3.28Å; R434-N438 PolarHBondContact O-N 2.65Å; I436-N438 VanDerWaalsContact C-N 3.27Å; I436-N438 PolarHBondContact O-N 2.59Å; N438-N442 PolarHBondContact O-ND2 3.14Å
439	S	51.2	Low	54.5	Low	69 Å²	69	113.8 Å²	113.8	48%	0.483	58%	0.579	S	S	.	*	H	α-helix	trans	-74	-44.7	174.7	-58.3	0	0	0	0	111.2	A435 I436 Q437 N441 N442 N443	A435-S439 PolarHBondContact O-N 3.4Å; A435-S439 PolarHBondContact O-OG 2.92Å; I436-S439 WeakPolarHBondContact O-CA 3.41Å; I436-S439 VanDerWaalsContact O-CB 3.3Å; I436-S439 WeakPolarHBondContact O-CB 3.4Å; I436-S439 PolarHBondContact O-N 2.88Å; Q437-S439 VanDerWaalsContact C-N 3.32Å; S439-N441 PolarHBondContact O-N 3.17Å; S439-N442 PolarHBondContact O-N 2.95Å; S439-N443 PolarHBondContact O-N 2.9Å; S439-N443 VanDerWaalsContact O-N 3.16Å
440	D	49.7	Very low	52.4	Low	106 Å²	106	118.6 Å²	118.6	57%	0.567	60%	0.603	S	S	*	*	H	α-helix	trans	-62.2	-40.7	177.3	-68.1	-34.5	0	0	0	112.4	I436 N442 N443	I436-D440 PolarHBondContact O-N 3.28Å; I436-D440 VanDerWaalsContact O-N 3.11Å; D440-N442 VanDerWaalsContact C-N 3.32Å; D440-N442 PolarHBondContact O-N 2.9Å; D440-N443 PolarHBondContact O-N 2.82Å
441	N	47.5	Very low	50.3	Low	121 Å²	121	119.6 Å²	119.6	65%	0.647	62%	0.619	S	S	*	*	H	α-helix	trans	-67.1	-28.6	179.2	-78.6	-53.2	0	0	0	113.6	Q437 S439	Q437-N441 PolarHBondContact O-N 3.1Å; Q437-N441 PolarHBondContact O-ND2 3.31Å; S439-N441 PolarHBondContact O-N 3.17Å
442	N	47.8	Very low	48.7	Very low	142 Å²	142	120.1 Å²	120.1	76%	0.759	64%	0.637	S	S	*	*	H	α-helix	trans	-88.9	-23.9	178.7	-79.1	-40.5	0	0	0	113.7	N438 S439 D440	N438-N442 PolarHBondContact O-ND2 3.14Å; S439-N442 PolarHBondContact O-N 2.95Å; D440-N442 VanDerWaalsContact C-N 3.32Å; D440-N442 PolarHBondContact O-N 2.9Å
443	N	41.1	Very low	47	Very low	126 Å²	126	119.7 Å²	119.7	67%	0.674	66%	0.655	S	S	*	*			trans	-101	30.8	-178.5	-87.1	-20.6	0	0	0	114.3	S439 D440 S445	S439-N443 PolarHBondContact O-N 2.9Å; S439-N443 VanDerWaalsContact O-N 3.16Å; D440-N443 PolarHBondContact O-N 2.82Å; N443-S445 PolarHBondContact O-N 3.08Å
444	S	36.4	Very low	45.3	Very low	100 Å²	100	122.3 Å²	122.3	70%	0.699	67%	0.671	S	S	*	*			trans	-72.5	37.9	170.4	-72.2	0	0	0	0	113.9
445	S	36.3	Very low	43.2	Very low	92 Å²	92	121.3 Å²	121.3	64%	0.643	68%	0.683	S	S	*	*	S	Bend	trans	-165.8	122.6	163.6	-81	0	0	0	0	111.1	N443	N443-S445 PolarHBondContact O-N 3.08Å
446	N	36.3	Very low	41.7	Very low	142 Å²	142	125 Å²	125	76%	0.759	70%	0.696	S	S	*	*	S	Bend	trans	84.4	135.1	173.2	-51.8	-48.1	0	0	0	119.2
447	N	35.7	Very low	39.9	Very low	146 Å²	146	127.2 Å²	127.2	78%	0.781	71%	0.714	S	S	*	*			trans	72.1	91.5	155	-60.4	-9.2	0	0	0	120.2	Q449	N447-Q449 PolarHBondContact O-N 3.33Å
448	Q	35.4	Very low	38.2	Very low	199 Å²	199	129.8 Å²	129.8	93%	0.93	73%	0.731	S	S	*	*			trans	-65.9	79	162.7	-61.8	169.2	-13.4	0	0	112.3
449	Q	37.4	Very low	36.9	Very low	175 Å²	175	130.7 Å²	130.7	82%	0.818	75%	0.746	S	S	*	*			trans	-150.7	34	179.4	-134	169.2	22	0	0	118.8	N447	N447-Q449 PolarHBondContact O-N 3.33Å
450	M	34.2	Very low	35.8	Very low	178 Å²	178	136.9 Å²	136.9	88%	0.877	76%	0.758	S	S	*	*			trans	-130	32.4	168.8	-67.3	-161.6	-175.3	0	0	114.9	S452	M450-S452 PolarHBondContact O-N 2.67Å
451	N	32	Very low	34.9	Very low	163 Å²	163	137.3 Å²	137.3	87%	0.872	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.9	66.5	179.5	-69.2	-9	0	0	0	112.8
452	S	33.2	Very low	34	Very low	105 Å²	105	138.2 Å²	138.2	73%	0.734	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-149.3	6	178.3	57.6	0	0	0	0	117.1	M450	M450-S452 PolarHBondContact O-N 2.67Å
453	A	37.1	Very low	33.2	Very low	96 Å²	96	138.7 Å²	138.7	79%	0.793	77%	0.769	S	S	*	*	S	Bend	trans	-121.4	68.7	169.1	0	0	0	0	0	109.7
454	L	35.5	Very low	32.5	Very low	147 Å²	147	137.7 Å²	137.7	77%	0.77	77%	0.771	S	S	*	*				74.9	86.5	101.6	-69.7	173.4	0	0	0	114.9
455	C	26.3	Very low	31.9	Very low	112 Å²	112	140.8 Å²	140.8	76%	0.757	78%	0.778	S	S	*	*			trans	65	58.7	133.9	-57.6	0	0	0	0	119.6
456	L	33.3	Very low	31.5	Very low	117 Å²	117	141.8 Å²	141.8	61%	0.613	78%	0.781	S	S	*	*			trans	-116.5	61.3	153.9	-75.2	173.7	0	0	0	111.6	T382 Y432	T382-L456 HydrophobicContact CG2-CD2 4.28Å; Y432-L456 HydrophobicContact CE1-CD1 3.74Å
457	T	29.6	Very low	31.2	Very low	125 Å²	125	139.8 Å²	139.8	77%	0.767	78%	0.784	S	S	*	*	S	Bend	trans	-133.3	137.1	172.1	54.3	0	0	0	0	111.4
458	N	29.2	Very low	30.8	Very low	162 Å²	162	138.6 Å²	138.6	87%	0.866	79%	0.788	S	S	*	*	S	Bend	trans	55.5	67.7	171.5	-68.6	-18	0	0	0	118.5
459	S	29.4	Very low	30.6	Very low	122 Å²	122	134.4 Å²	134.4	85%	0.853	78%	0.78	S	S	*	*			trans	-137.8	61.7	150.4	-80.4	0	0	0	0	111.2	P461	S459-P461 VanDerWaalsContact O-CD 3.28Å; S459-P461 WeakPolarHBondContact O-CD 3.19Å
460	R	28.5	Very low	30.5	Very low	198 Å²	198	130.5 Å²	130.5	75%	0.747	77%	0.772	S	S	*	*			trans	-68.8	118.9	170.7	176.3	-178.7	178.7	175.4	1	108.8	Q462	R460-Q462 PolarHBondContact O-N 2.88Å
461	P	30.6	Very low	30.3	Very low	115 Å²	115	128.9 Å²	128.9	75%	0.747	77%	0.767	S	S	*	*			trans	-69.6	97	169.1	-11.3	28.1	0	0	0	108.1	S459 L463	S459-P461 VanDerWaalsContact O-CD 3.28Å; S459-P461 WeakPolarHBondContact O-CD 3.19Å; P461-L463 VanDerWaalsContact C-N 3.28Å; P461-L463 PolarHBondContact O-N 2.72Å
462	Q	29.3	Very low	30.4	Very low	140 Å²	140	130 Å²	130	65%	0.654	77%	0.767	S	S	*	*			trans	-68	95.2	159.3	-77.1	-80.7	28	0	0	106.4	R460 C464	R460-Q462 PolarHBondContact O-N 2.88Å; Q462-C464 VanDerWaalsContact C-N 3.29Å; Q462-C464 PolarHBondContact O-N 2.87Å
463	L	29.9	Very low	30.3	Very low	153 Å²	153	131.8 Å²	131.8	80%	0.801	77%	0.766	S	S	*	*			trans	-59.1	99	165.2	-87.5	168	0	0	0	107.2	P461 L465	P461-L463 VanDerWaalsContact C-N 3.28Å; P461-L463 PolarHBondContact O-N 2.72Å; L463-L465 VanDerWaalsContact C-N 3.26Å; L463-L465 PolarHBondContact O-N 3.09Å
464	C	25.9	Very low	30.1	Very low	104 Å²	104	133.6 Å²	133.6	70%	0.703	76%	0.763	S	S	*	*			trans	-79.1	81.5	-173	-149.8	0	0	0	0	108.6	Q462 T466	Q462-C464 VanDerWaalsContact C-N 3.29Å; Q462-C464 PolarHBondContact O-N 2.87Å; C464-T466 PolarHBondContact O-N 3.39Å
465	L	25.6	Very low	29.8	Very low	165 Å²	165	130.9 Å²	130.9	86%	0.864	76%	0.756	S	S	*	*			trans	-70.1	66.1	171.3	-69.8	172.9	0	0	0	110.1	L463 A467	L463-L465 VanDerWaalsContact C-N 3.26Å; L463-L465 PolarHBondContact O-N 3.09Å; L465-A467 VanDerWaalsContact C-N 3.26Å; L465-A467 PolarHBondContact O-N 3.38Å
466	T	26.5	Very low	30.2	Very low	113 Å²	113	134.8 Å²	134.8	69%	0.693	76%	0.755	S	S	*	*			trans	-73.4	84.9	166.2	51.2	0	0	0	0	108.5	C464 S468	C464-T466 PolarHBondContact O-N 3.39Å; T466-S468 PolarHBondContact O-N 3.15Å
467	A	30.6	Very low	30.4	Very low	101 Å²	101	136.4 Å²	136.4	84%	0.835	76%	0.759	S	S	*	*			trans	-58.9	110.1	168.7	0	0	0	0	0	109.1	L465 S469	L465-A467 VanDerWaalsContact C-N 3.26Å; L465-A467 PolarHBondContact O-N 3.38Å; A467-S469 PolarHBondContact O-N 3.25Å
468	S	27.8	Very low	30.8	Very low	121 Å²	121	137.6 Å²	137.6	85%	0.846	76%	0.756	S	S	*	*			trans	-87.5	99.7	-178.4	55.5	0	0	0	0	110.8	T466	T466-S468 PolarHBondContact O-N 3.15Å
469	S	31.8	Very low	31	Very low	111 Å²	111	140.5 Å²	140.5	78%	0.776	75%	0.754	S	S	*	*			trans	-154.2	153.7	160.2	-163	0	0	0	0	111.7	A467	A467-S469 PolarHBondContact O-N 3.25Å
470	S	33.8	Very low	31.3	Very low	92 Å²	92	138.8 Å²	138.8	64%	0.643	74%	0.742	S	S	*	*			trans	65.9	91.2	168.3	-64.4	0	0	0	0	119.6
471	D	30.8	Very low	31.7	Very low	145 Å²	145	136.2 Å²	136.2	78%	0.775	74%	0.743	S	S	*	*				55	105.6	117.9	-46.2	-46.8	0	0	0	120
472	H	32.9	Very low	32	Very low	186 Å²	186	139 Å²	139	86%	0.861	75%	0.746	S	S	*	*				-157.1	151.8	102.9	-134.1	-85.3	0	0	0	114.9
473	I	32.1	Very low	32.3	Very low	142 Å²	142	140.7 Å²	140.7	73%	0.728	75%	0.754	S	S	*	*			trans	-88.2	133.1	176.3	-64.8	157	0	0	0	110.3
474	D	32.1	Very low	32.6	Very low	135 Å²	135	141.9 Å²	141.9	72%	0.722	76%	0.755	S	S	*	*				-161.1	168.4	115.6	-144.7	-21.7	0	0	0	112.1
475	S	30.1	Very low	33.1	Very low	89 Å²	89	144.2 Å²	144.2	62%	0.622	76%	0.755	S	S	*	*			trans	-115.6	162.5	-166	-53.2	0	0	0	0	112.9
476	R	33.8	Very low	33.5	Very low	195 Å²	195	145.6 Å²	145.6	74%	0.736	76%	0.757	S	S	*	*				161.3	148.2	118.7	-86.7	160.2	-148.7	-157.7	6.6	115
477	H	38	Very low	34	Very low	150 Å²	150	147.9 Å²	147.9	69%	0.694	76%	0.759	S	S	*	*			trans	65.9	142.1	158.2	-53.5	-38	0	0	0	117.3
478	H	37.4	Very low	34.4	Very low	151 Å²	151	148.6 Å²	148.6	70%	0.699	75%	0.745	S	S	*	*			cis	-139.9	145.2	-6.5	-101.6	-54.3	0	0	0	107.9
479	R	33.4	Very low	34.8	Very low	222 Å²	222	151.3 Å²	151.3	84%	0.838	74%	0.744	S	S	*	*				42.8	126.3	94	-82	-164.2	179.8	-172.7	-0.5	114.6
480	S	36.2	Very low	35	Very low	86 Å²	86	153.2 Å²	153.2	60%	0.601	74%	0.74	S	S	*	*			cis	-159.8	174.1	6.6	-72.7	0	0	0	0	113.1
481	D	36.2	Very low	35	Very low	144 Å²	144	154.6 Å²	154.6	77%	0.77	74%	0.737	S	S	*	*			trans	102.4	139.6	140.9	-62.7	-42	0	0	0	123
482	H	38.4	Very low	35.2	Very low	174 Å²	174	154.5 Å²	154.5	81%	0.806	73%	0.732	S	S	*	*			trans	62.7	101.4	166.7	-66.7	-55.4	0	0	0	122.7	H484	H482-H484 PolarHBondContact O-N 3.01Å
483	H	35.2	Very low	35.3	Very low	176 Å²	176	151.8 Å²	151.8	82%	0.815	72%	0.719	S	S	*	*			trans	-15.3	114.8	144.5	-60.7	-27.6	0	0	0	116.9
484	H	35.9	Very low	35.4	Very low	178 Å²	178	148.6 Å²	148.6	82%	0.824	70%	0.701	S	S	*	*				178.4	123	118.3	-98.5	77	0	0	0	106.2	H482	H482-H484 PolarHBondContact O-N 3.01Å
485	H	35.9	Very low	35.6	Very low	153 Å²	153	148.7 Å²	148.7	71%	0.708	70%	0.697	S	S	*	*			trans	159.6	108.2	157.5	-95.4	53.7	0	0	0	108.9	H488	H485-H488 AromaticContact CD2-CD2 3.68Å; H485-H488 AromaticContact NE2-CD2 3.62Å
486	H	34.3	Very low	36	Very low	194 Å²	194	150 Å²	150	90%	0.898	69%	0.694	S	S	*	*	S	Bend	trans	-131.5	10.5	172.9	-148.3	68.1	0	0	0	114.1
487	H	37.8	Very low	36.5	Very low	160 Å²	160	146.2 Å²	146.2	74%	0.741	69%	0.687	S	S	*	*	S	Bend	trans	-111.6	-16.6	176.8	-97.2	-53.6	0	0	0	114.7	H489	H487-H489 VanDerWaalsContact C-N 3.28Å; H487-H489 PolarHBondContact O-N 3Å
488	H	38.6	Very low	37.5	Very low	117 Å²	117	140 Å²	140	54%	0.542	66%	0.662	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.9	-7.9	-164.7	-140.5	-43.4	0	0	0	115	H485	H485-H488 AromaticContact CD2-CD2 3.68Å; H485-H488 AromaticContact NE2-CD2 3.62Å
489	H	35.3	Very low	38.6	Very low	178 Å²	178	132.9 Å²	132.9	82%	0.824	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	-21.8	-174.5	-140.1	59.2	0	0	0	114	H487	H487-H489 VanDerWaalsContact C-N 3.28Å; H487-H489 PolarHBondContact O-N 3Å
490	Q	36.2	Very low	40	Very low	150 Å²	150	124.6 Å²	124.6	70%	0.701	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-39	-179.4	-83.5	175.9	-39.5	0	0	113.4	H492	Q490-H492 PolarHBondContact O-N 3.23Å; Q490-H492 VanDerWaalsContact O-N 3.13Å
491	Q	34.7	Very low	40.7	Very low	122 Å²	122	122.1 Å²	122.1	57%	0.57	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	-20.9	-178.9	-72.5	-177.6	-25.4	0	0	113.6	Q494	Q491-Q494 WeakPolarHBondContact O-CB 3.17Å; Q491-Q494 PolarHBondContact O-N 3.41Å
492	H	35.6	Very low	40.8	Very low	143 Å²	143	116.5 Å²	116.5	66%	0.662	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-15.3	-171.1	-137.6	-54.4	0	0	0	114.8	Q490	Q490-H492 PolarHBondContact O-N 3.23Å; Q490-H492 VanDerWaalsContact O-N 3.13Å
493	H	34.6	Very low	40.5	Very low	128 Å²	128	113.2 Å²	113.2	59%	0.593	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.3	-26.2	165.6	-84.5	21.7	0	0	0	112.2	Q495 Q496	H493-Q495 PolarHBondContact O-N 2.88Å; H493-Q496 PolarHBondContact O-N 3.24Å; H493-Q496 VanDerWaalsContact O-N 3.13Å
494	Q	33.5	Very low	40.1	Very low	75 Å²	75	110.7 Å²	110.7	35%	0.35	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.1	-15.2	-169.4	-172.4	143.5	53.7	0	0	114.7	V292 Q491	V292-Q494 HydrophobicContact CG2-CB 4.05Å; V292-Q494 HydrophobicContact CG2-CG 3.56Å; V292-Q494 VanDerWaalsContact CG2-NE2 3.35Å; Q491-Q494 WeakPolarHBondContact O-CB 3.17Å; Q491-Q494 PolarHBondContact O-N 3.41Å
495	Q	36.2	Very low	39.7	Very low	138 Å²	138	107.1 Å²	107.1	65%	0.645	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	-5.8	179.7	-62.4	-178.7	0.1	0	0	114.5	R394 H493	R394-Q495 PolarHBondContact NH2-O 2.67Å; H493-Q495 PolarHBondContact O-N 2.88Å
496	Q	39.2	Very low	39.3	Very low	117 Å²	117	106.3 Å²	106.3	55%	0.547	56%	0.555	S	S	.	*	S	Bend	trans	-78.3	-30.4	-170.3	-70.5	178	-35.7	0	0	113.7	R394 H493	R394-Q496 PolarHBondContact NE-O 3.27Å; R394-Q496 PolarHBondContact NH2-O 2.86Å; H493-Q496 PolarHBondContact O-N 3.24Å; H493-Q496 VanDerWaalsContact O-N 3.13Å
497	L	43.7	Very low	38.9	Very low	114 Å²	114	108.5 Å²	108.5	60%	0.597	56%	0.556	S	S	*	*	S	Bend	trans	-108.8	21.2	-160.4	-67.7	168.6	0	0	0	116.9
498	A	59.3	Low	38.4	Very low	21 Å²	21	112.4 Å²	112.4	17%	0.174	56%	0.564	C	S	.	*			trans	-116.2	136.6	168.5	0	0	0	0	0	109.4	R394 T500 A501	R394-A498 WeakPolarHBondContact CD-O 3.44Å; R394-A498 PolarHBondContact NE-O 3.37Å; R394-A498 VanDerWaalsContact NE-O 3.12Å; R394-A498 PolarHBondContact NH1-O 3.41Å; R394-A498 VanDerWaalsContact NH1-O 3.09Å; A498-T500 VanDerWaalsContact C-N 3.27Å; A498-T500 PolarHBondContact O-N 2.64Å; A498-A501 HydrophobicContact CB-CB 4.09Å; A498-A501 WeakPolarHBondContact O-CB 3.48Å; A498-A501 PolarHBondContact O-N 3.18Å
499	I	60.6	Low	38	Very low	1 Å²	1	112.9 Å²	112.9	1%	0.005	58%	0.575	C	S	.	*	T	Hydrogen-bonded Turn	trans	-59.9	-43.7	-171.7	-56.8	-179.9	0	0	0	109.9	L357 D360 L361 V364 M391 R394 V395 F398 A501	L357-I499 HydrophobicContact CD1-CD1 3.59Å; D360-I499 HydrophobicContact CB-CB 4.25Å; D360-I499 HydrophobicContact CB-CD1 4.49Å; D360-I499 PolarHBondContact OD2-N 3.03Å; L361-I499 HydrophobicContact CD2-CD1 3.86Å; L361-I499 HydrophobicContact CG-CD1 4.34Å; V364-I499 HydrophobicContact CG2-CG2 3.59Å; M391-I499 HydrophobicContact CB-CG2 4.22Å; M391-I499 HydrophobicContact CG-CG2 4.26Å; R394-I499 HydrophobicContact CB-CG1 4.47Å; R394-I499 HydrophobicContact CB-CG2 4.29Å; R394-I499 PolarHBondContact NH1-O 3.2Å; V395-I499 HydrophobicContact CG2-CD1 4.19Å; V395-I499 HydrophobicContact CG2-CG2 4.06Å; F398-I499 HydrophobicContact CD2-CD1 3.84Å; F398-I499 HydrophobicContact CD2-CG1 3.69Å; F398-I499 HydrophobicContact CE2-CD1 4.01Å; F398-I499 HydrophobicContact CE2-CG1 3.46Å; F398-I499 VanDerWaalsContact CE2-CG1 3.46Å; F398-I499 HydrophobicContact CZ-CG1 4.42Å; I499-A501 VanDerWaalsContact C-N 3.34Å; I499-A501 PolarHBondContact O-N 3.5Å
500	T	63.3	Low	37.6	Very low	48 Å²	48	110.7 Å²	110.7	29%	0.294	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.4	-6.8	-177.2	57.1	0	0	0	0	115.4	D360 I363 M391 A498 G502	D360-T500 HydrophobicContact CB-CG2 4.35Å; D360-T500 WeakPolarHBondContact OD1-CB 3.44Å; D360-T500 WeakPolarHBondContact OD1-CG2 3.49Å; D360-T500 PolarHBondContact OD1-OG1 3.39Å; I363-T500 HydrophobicContact CB-CG2 3.76Å; I363-T500 HydrophobicContact CD1-CG2 3.95Å; I363-T500 HydrophobicContact CG1-CG2 4.46Å; I363-T500 HydrophobicContact CG2-CG2 3.67Å; M391-T500 HydrophobicContact CE-CG2 3.91Å; A498-T500 VanDerWaalsContact C-N 3.27Å; A498-T500 PolarHBondContact O-N 2.64Å; T500-G502 VanDerWaalsContact C-N 3.28Å; T500-G502 PolarHBondContact O-N 3.48Å
501	A	49.9	Very low	37.2	Very low	34 Å²	34	113 Å²	113	28%	0.281	58%	0.577	S	S	.	*			trans	-74.3	72.9	-175.2	0	0	0	0	0	113	R394 A498 I499	R394-A501 VanDerWaalsContact NH1-C 3.3Å; R394-A501 PolarHBondContact NH1-O 2.73Å; R394-A501 PolarHBondContact NH2-O 3.16Å; A498-A501 HydrophobicContact CB-CB 4.09Å; A498-A501 WeakPolarHBondContact O-CB 3.48Å; A498-A501 PolarHBondContact O-N 3.18Å; I499-A501 VanDerWaalsContact C-N 3.34Å; I499-A501 PolarHBondContact O-N 3.5Å
502	G	39.8	Very low	37.1	Very low	26 Å²	26	112.2 Å²	112.2	27%	0.268	58%	0.576	S	S	.	*			trans	-74.9	174	169.1	0	0	0	0	0	113	T500 S504	T500-G502 VanDerWaalsContact C-N 3.28Å; T500-G502 PolarHBondContact O-N 3.48Å; G502-S504 PolarHBondContact O-N 3.31Å
503	P	30.9	Very low	36.7	Very low	105 Å²	105	113.7 Å²	113.7	68%	0.682	58%	0.584	S	S	*	*			trans	-72.3	90.4	-177.5	29.7	-35.2	0	0	0	112.2	S505	P503-S505 VanDerWaalsContact C-N 3.27Å; P503-S505 PolarHBondContact O-N 3.46Å
504	S	26.9	Very low	36.6	Very low	122 Å²	122	113 Å²	113	85%	0.853	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	75.7	175.4	-68.1	0	0	0	0	113.1	G502	G502-S504 PolarHBondContact O-N 3.31Å
505	S	27.4	Very low	36.4	Very low	103 Å²	103	115.5 Å²	115.5	72%	0.72	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-152.4	-1.3	178.9	-80.9	0	0	0	0	116.8	P503	P503-S505 VanDerWaalsContact C-N 3.27Å; P503-S505 PolarHBondContact O-N 3.46Å
506	L	27.7	Very low	36.3	Very low	137 Å²	137	116.7 Å²	116.7	72%	0.717	62%	0.622	S	S	*	*			trans	-94.4	10.9	175	-70.9	-179.9	0	0	0	115.6	R508	L506-R508 PolarHBondContact O-N 3.22Å
507	R	26.8	Very low	36	Very low	240 Å²	240	118.2 Å²	118.2	91%	0.906	63%	0.633	S	S	*	*			trans	-87.2	71.1	156.2	-80.4	-171	172.5	-177.5	-0.3	111.2	T509	R507-T509 PolarHBondContact O-N 3.4Å
508	R	27.3	Very low	35.4	Very low	241 Å²	241	116.3 Å²	116.3	91%	0.909	64%	0.641	S	S	*	*			trans	-73.7	98.2	168.3	-173.8	172.3	-67.3	-123.7	-0.1	109.8	L506	L506-R508 PolarHBondContact O-N 3.22Å
509	T	29	Very low	34.1	Very low	128 Å²	128	121.8 Å²	121.8	79%	0.785	67%	0.672	S	S	*	*			trans	-63.7	152.3	175.1	46.2	0	0	0	0	112.1	R507	R507-T509 PolarHBondContact O-N 3.4Å
510	T	27.2	Very low	32.6	Very low	131 Å²	131	127.7 Å²	127.7	80%	0.804	71%	0.708	S	S	*	*			trans	-87.5	127.5	176.1	44.2	0	0	0	0	111.1
511	R	28.2	Very low	31.1	Very low	199 Å²	199	131 Å²	131	75%	0.751	73%	0.733	S	S	*	*			trans	176.5	156.5	135	-102.9	-171.8	114.5	130.3	6.5	114.9
512	N	32.8	Very low	30.1	Very low	105 Å²	105	136.9 Å²	136.9	56%	0.561	76%	0.76	S	S	*	*			trans	54.8	104.6	154.8	-59.3	18.3	0	0	0	117.1
513	E	27.3	Very low	29.7	Very low	174 Å²	174	147.5 Å²	147.5	81%	0.813	79%	0.792	S	S	*	*				74.7	101.7	76	-74.2	-178.2	123.1	0	0	115.1
514	S	31.4	Very low	29.6	Very low	114 Å²	114	150.7 Å²	150.7	80%	0.797	80%	0.799	S	S	*	*				-175.2	123.2	118.8	60.7	0	0	0	0	113.4
515	T	29.9	Very low	29.8	Very low	127 Å²	127	152.9 Å²	152.9	78%	0.779	80%	0.802	S	S	*	*			trans	54.5	100.1	143.3	-45.1	0	0	0	0	120.6
516	M	34.7	Very low	29.8	Very low	164 Å²	164	152.8 Å²	152.8	81%	0.808	80%	0.801	S	S	*	*				-170.6	121	109.7	-97.8	-157.1	-175.1	0	0	113.9
517	N	32.9	Very low	30	Very low	149 Å²	149	153.8 Å²	153.8	80%	0.797	81%	0.806	S	S	*	*			trans	40.4	118.7	138.7	-51.5	-20.1	0	0	0	121.8
518	G	29.9	Very low	30.1	Very low	73 Å²	73	150.7 Å²	150.7	75%	0.753	80%	0.802	S	S	*	*			trans	152.2	105.5	143.1	0	0	0	0	0	118.8
519	V	31.5	Very low	30.2	Very low	136 Å²	136	149.1 Å²	149.1	82%	0.824	80%	0.798	S	S	*	*			trans	41	94.9	147.4	-167.5	0	0	0	0	117.4
520	V	29.4	Very low	30.2	Very low	125 Å²	125	150 Å²	150	76%	0.758	80%	0.798	S	S	*	*				64.6	101.2	69.8	-175.7	0	0	0	0	115.5
521	S	32.3	Very low	30.6	Very low	117 Å²	117	152.4 Å²	152.4	82%	0.818	80%	0.799	S	S	*	*				-175.5	136.7	123.4	-82.2	0	0	0	0	113.4
522	N	28.4	Very low	30.7	Very low	159 Å²	159	148.8 Å²	148.8	85%	0.85	80%	0.8	S	S	*	*			trans	-86.3	157.9	170.8	-65.8	-33.1	0	0	0	111.4
523	R	31	Very low	30.8	Very low	248 Å²	248	153.3 Å²	153.3	94%	0.936	82%	0.817	S	S	*	*				-167	131	120.1	-108.3	165	-174.6	-177.8	1.3	113.8
524	M	28.8	Very low	30.9	Very low	172 Å²	172	150.7 Å²	150.7	85%	0.847	82%	0.818	S	S	*	*			trans	-77.2	160.3	155.8	-63.7	168.6	166.9	0	0	109.6
525	N	32.5	Very low	31.1	Very low	168 Å²	168	148.7 Å²	148.7	90%	0.898	82%	0.816	S	S	*	*				-163.1	149.2	125.7	-104.7	-8.1	0	0	0	111.5
526	S	26.2	Very low	31.4	Very low	101 Å²	101	149.6 Å²	149.6	71%	0.706	82%	0.816	S	S	*	*			trans	-110.5	142.9	171.5	176.5	0	0	0	0	109.2
527	L	32.2	Very low	31.6	Very low	159 Å²	159	145.9 Å²	145.9	83%	0.832	81%	0.806	S	S	*	*			trans	-143.9	118.5	163.4	-77.3	-179.3	0	0	0	110
528	Q	29.1	Very low	31.8	Very low	175 Å²	175	145.8 Å²	145.8	82%	0.818	81%	0.806	S	S	*	*			trans	-82.1	147.1	154.4	-63.6	170.5	-81.4	0	0	108.4
529	Y	29	Very low	32.3	Very low	207 Å²	207	147.2 Å²	147.2	81%	0.812	80%	0.804	S	S	*	*			trans	-148.2	122.8	154.4	-116.5	-82.5	0	0	0	109.9
530	N	30.1	Very low	32.6	Very low	148 Å²	148	146.7 Å²	146.7	79%	0.791	80%	0.801	S	S	*	*			trans	-90.2	143.6	164.4	-71.5	-30.6	0	0	0	108.3
531	H	35.5	Very low	33	Very low	181 Å²	181	144.9 Å²	144.9	84%	0.838	80%	0.8	S	S	*	*			trans	-154.3	143	145.4	-116.2	-78.6	0	0	0	111.2
532	T	29.4	Very low	33.3	Very low	123 Å²	123	145.4 Å²	145.4	76%	0.755	80%	0.798	S	S	*	*			trans	-100.9	144.2	179.6	49.8	0	0	0	0	111
533	E	34.7	Very low	33.8	Very low	199 Å²	199	142.5 Å²	142.5	93%	0.93	79%	0.789	S	S	*	*			trans	-165.9	171	135.6	-114.3	169	-171.6	0	0	113.7
534	S	30.4	Very low	34.1	Very low	119 Å²	119	136.7 Å²	136.7	83%	0.832	78%	0.782	S	S	*	*			trans	-101.8	152.2	-163.7	55.4	0	0	0	0	115
535	G	35	Very low	34.5	Very low	73 Å²	73	132.5 Å²	132.5	75%	0.753	78%	0.775	S	S	*	*			trans	-149.1	9.8	-167.6	0	0	0	0	0	122.9
536	N	35.9	Very low	34.6	Very low	146 Å²	146	136.4 Å²	136.4	78%	0.781	78%	0.777	S	S	*	*			trans	63.1	141.1	154.9	-155.6	25.9	0	0	0	122.7
537	S	39.3	Very low	35.1	Very low	86 Å²	86	137.8 Å²	137.8	60%	0.601	78%	0.776	S	S	*	*			trans	63.7	147.6	153.2	51.6	0	0	0	0	121
538	N	37.9	Very low	35.5	Very low	147 Å²	147	137.7 Å²	137.7	79%	0.786	77%	0.771	S	S	*	*			cis	-163.5	170	-3.1	-111	-10.8	0	0	0	112.9
539	S	38.8	Very low	36.1	Very low	103 Å²	103	137 Å²	137	72%	0.72	77%	0.768	S	S	*	*			trans	73	137.3	153.3	-71	0	0	0	0	120.2
540	T	37.8	Very low	36.4	Very low	124 Å²	124	134.1 Å²	134.1	76%	0.761	77%	0.766	S	S	*	*			cis	-164.2	151.7	-12.1	-0.6	0	0	0	0	112.2
541	A	39.3	Very low	36.9	Very low	88 Å²	88	134.3 Å²	134.3	73%	0.727	77%	0.768	S	S	*	*			trans	66.9	146.9	141.5	0	0	0	0	0	120.1
542	V	38.5	Very low	37	Very low	128 Å²	128	132.7 Å²	132.7	78%	0.776	77%	0.765	S	S	*	*			cis	-159.9	143	-5	112.3	0	0	0	0	112.1
543	S	37.5	Very low	37.7	Very low	97 Å²	97	136 Å²	136	68%	0.678	77%	0.772	S	S	*	*			trans	34.8	155.3	145.7	-47.8	0	0	0	0	123.3
544	T	37.7	Very low	38	Very low	126 Å²	126	134 Å²	134	77%	0.773	77%	0.768	S	S	*	*			cis	-170.5	136.5	-10.1	25.6	0	0	0	0	105.7
545	A	37.1	Very low	39	Very low	85 Å²	85	137.4 Å²	137.4	70%	0.702	77%	0.77	S	S	*	*				87.4	102.8	51.1	0	0	0	0	0	116.1
546	R	36.2	Very low	39.4	Very low	250 Å²	250	141.8 Å²	141.8	94%	0.943	78%	0.777	S	S	*	*			trans	176	125.8	141.4	-98.2	163.9	177.4	136.9	-1.1	108.4
547	N	36.7	Very low	40.2	Very low	129 Å²	129	142.7 Å²	142.7	69%	0.69	78%	0.781	S	S	*	*			cis	87.7	128.9	36.9	-103	37.1	0	0	0	116.7
548	H	40.4	Very low	40.5	Very low	158 Å²	158	146.6 Å²	146.6	73%	0.731	80%	0.795	S	S	*	*			trans	73.3	149.1	173.9	-51.2	-60.6	0	0	0	116.1
549	H	41.5	Very low	40.9	Very low	160 Å²	160	148 Å²	148	74%	0.741	80%	0.797	S	S	*	*			cis	-141.5	161	4.4	-145.9	75	0	0	0	110.7
550	N	35.8	Very low	41.2	Very low	146 Å²	146	147.5 Å²	147.5	78%	0.781	79%	0.794	S	S	*	*			trans	-81.6	153.5	166.3	-72.9	-2.1	0	0	0	110
551	N	40.2	Very low	41.3	Very low	153 Å²	153	148.2 Å²	148.2	82%	0.818	79%	0.792	S	S	*	*				-170.3	156.6	126.7	-92.4	-9.6	0	0	0	109.2
552	N	36	Very low	41.5	Very low	147 Å²	147	152.1 Å²	152.1	79%	0.786	80%	0.8	S	S	*	*			trans	-91.7	154.9	167.7	-40.2	-43.7	0	0	0	108.3
553	E	44.2	Very low	41.4	Very low	193 Å²	193	152.7 Å²	152.7	90%	0.902	80%	0.798	S	S	*	*			trans	-164.8	145.8	137.5	-107.1	144.7	-152.6	0	0	108.4
554	D	42.6	Very low	41.8	Very low	157 Å²	157	155.4 Å²	155.4	84%	0.84	80%	0.804	S	S	*	*			trans	-100.6	130.3	-175.1	-50.3	-86.4	0	0	0	109.6
555	E	49.8	Very low	41.7	Very low	190 Å²	190	154.8 Å²	154.8	89%	0.888	81%	0.805	S	S	*	*			trans	-134.6	115.4	167.8	-69.8	-170.1	138.4	0	0	109.8
556	D	45.2	Very low	42	Very low	165 Å²	165	159.5 Å²	159.5	88%	0.882	81%	0.812	S	S	*	*			trans	-88.2	137.3	165.8	-68.9	-61.5	0	0	0	108.9
557	D	52.5	Low	42.2	Very low	165 Å²	165	150.2 Å²	150.2	88%	0.882	79%	0.794	S	S	*	*			trans	-136.8	111.3	171	-105.3	-31	0	0	0	110.4
558	D	44.3	Very low	42.2	Very low	167 Å²	167	150.9 Å²	150.9	89%	0.893	81%	0.806	S	S	*	*			trans	-85.4	132	168.5	-85.8	-50.3	0	0	0	110
559	E	47.3	Very low	42.2	Very low	177 Å²	177	148.7 Å²	148.7	83%	0.827	81%	0.808	S	S	*	*			trans	-142.3	166.3	162.1	-105.7	-63.6	178.5	0	0	112.3
560	S	44.2	Very low	41.9	Very low	92 Å²	92	144.3 Å²	144.3	64%	0.643	81%	0.806	S	S	*	*			trans	-107.8	140.5	-130.7	54.2	0	0	0	0	117.1
561	L	39.5	Very low	41.6	Very low	140 Å²	140	141.4 Å²	141.4	73%	0.733	81%	0.81	S	S	*	*			trans	-1.2	121.6	140.5	-170.8	157.9	0	0	0	116.9
562	L	44.3	Very low	41.4	Very low	169 Å²	169	139.1 Å²	139.1	89%	0.885	81%	0.807	S	S	*	*			trans	-132.7	114.5	148.9	-79	-179.1	0	0	0	110.7
563	D	36.4	Very low	41.7	Very low	140 Å²	140	138.5 Å²	138.5	75%	0.749	81%	0.808	S	S	*	*			trans	-76.1	126	169.9	-108.7	-43.8	0	0	0	110.6
564	I	45.1	Very low	41.6	Very low	154 Å²	154	135.8 Å²	135.8	79%	0.79	81%	0.805	S	S	*	*			trans	-135.1	115.5	157.9	-59.4	-176.7	0	0	0	108.1
565	S	36.6	Very low	42	Very low	113 Å²	113	135.1 Å²	135.1	79%	0.79	79%	0.791	S	S	*	*			trans	-105.8	110	-175.6	162.7	0	0	0	0	111.1
566	E	42.4	Very low	42.7	Very low	185 Å²	185	129.1 Å²	129.1	86%	0.864	77%	0.77	S	S	*	*			trans	-141.7	128.8	174.6	-107.8	-176.5	-163.4	0	0	114.3
567	G	41.1	Very low	44	Very low	55 Å²	55	128.1 Å²	128.1	57%	0.567	76%	0.76	S	S	*	*			trans	73.8	95.9	144.1	0	0	0	0	0	120.2	S569	G567-S569 PolarHBondContact O-N 3.34Å; G567-S569 VanDerWaalsContact O-N 3.11Å
568	P	37.4	Very low	44.8	Very low	143 Å²	143	123 Å²	123	93%	0.929	73%	0.732	S	S	*	*			trans	-69	108.2	164.7	29.9	-33.2	0	0	0	110.5
569	S	39.2	Very low	46.3	Very low	112 Å²	112	116.7 Å²	116.7	78%	0.783	70%	0.701	S	S	*	*			trans	-143.4	140.8	-175.5	59.5	0	0	0	0	114	G567	G567-S569 PolarHBondContact O-N 3.34Å; G567-S569 VanDerWaalsContact O-N 3.11Å
570	G	36.9	Very low	47.9	Very low	68 Å²	68	111.7 Å²	111.7	70%	0.701	68%	0.68	S	S	*	*			trans	55.2	80.7	158.2	0	0	0	0	0	118.4	S572	G570-S572 PolarHBondContact O-N 3.05Å
571	G	29	Very low	49.9	Very low	84 Å²	84	108.7 Å²	108.7	87%	0.866	66%	0.656	S	S	*	*			trans	-69.4	59.6	169.8	0	0	0	0	0	114.9	T573	G571-T573 PolarHBondContact O-N 2.88Å
572	S	36.2	Very low	52.2	Low	106 Å²	106	102.6 Å²	102.6	74%	0.741	63%	0.625	S	S	*	*			trans	-77.4	97.7	173.7	-72.7	0	0	0	0	110.3	G570 T574	G570-S572 PolarHBondContact O-N 3.05Å; S572-T574 PolarHBondContact O-N 3.41Å
573	T	40.6	Very low	54.4	Low	134 Å²	134	96.6 Å²	96.6	82%	0.822	59%	0.594	S	S	*	*			trans	-66.6	103.5	178.7	-56	0	0	0	0	110.2	G571 R575	G571-T573 PolarHBondContact O-N 2.88Å; T573-R575 PolarHBondContact O-N 2.83Å
574	T	43.5	Very low	57.1	Low	135 Å²	135	93.1 Å²	93.1	83%	0.828	57%	0.573	S	S	*	*			trans	-69.9	91.1	173.4	52.3	0	0	0	0	109.9	S572 S576	S572-T574 PolarHBondContact O-N 3.41Å; T574-S576 PolarHBondContact O-N 2.83Å
575	R	50.1	Low	59.3	Low	143 Å²	143	86 Å²	86	54%	0.54	54%	0.536	S	S	.	.			trans	-51.7	134.5	161.3	-92.8	171.2	151.9	-120.7	-0.7	108.6	T573 D580 D583	T573-R575 PolarHBondContact O-N 2.83Å; R575-D580 WeakPolarHBondContact CD-OD1 3.26Å; R575-D580 IonicContact CZ-OD1 3.13Å; R575-D580 IonicContact NE-OD1 2.8Å; R575-D580 IonicContact NH1-OD1 3.81Å; R575-D580 PolarHBondContact NH1-OD1 3.43Å; R575-D583 IonicContact CZ-OD2 2.64Å; R575-D583 IonicContact NH1-OD2 2.69Å; R575-D583 PolarHBondContact NH1-OD2 2.7Å; R575-D583 IonicContact NH2-OD2 3.6Å; R575-D583 PolarHBondContact NH2-OD2 2.91Å
576	S	64.9	Low	62	Low	65 Å²	65	80.6 Å²	80.6	46%	0.455	50%	0.498	S	S	.	.			trans	-75	141.9	174.2	52.1	0	0	0	0	109	T574 D578 S579 D580	T574-S576 PolarHBondContact O-N 2.83Å; S576-D578 PolarHBondContact O-N 3.24Å; S576-S579 PolarHBondContact O-N 3.4Å; S576-S579 PolarHBondContact O-OG 3.21Å; S576-D580 PolarHBondContact O-N 3.48Å
577	H	72.8	Confident	64.3	Low	143 Å²	143	78.7 Å²	78.7	66%	0.662	49%	0.49	S	S	*	.	H	α-helix	trans	-50.6	-33.6	176.8	-179.7	-68.3	0	0	0	112.3	S579 D580 E581	H577-S579 VanDerWaalsContact C-N 3.34Å; H577-S579 PolarHBondContact O-N 3.1Å; H577-D580 PolarHBondContact O-N 2.88Å; H577-E581 PolarHBondContact O-N 3.05Å; H577-E581 VanDerWaalsContact O-N 3.13Å
578	D	69	Low	66.7	Low	58 Å²	58	77.8 Å²	77.8	31%	0.31	47%	0.469	S	S	.	.	H	α-helix	trans	-56.8	-39	173.9	-62.1	-19.9	0	0	0	114	K95 S576 T582	K95-D578 WeakPolarHBondContact CE-OD2 3.21Å; K95-D578 IonicContact NZ-OD2 3.21Å; K95-D578 PolarHBondContact NZ-OD2 3.47Å; S576-D578 PolarHBondContact O-N 3.24Å; D578-T582 WeakPolarHBondContact O-CB 3.5Å; D578-T582 PolarHBondContact O-N 3.38Å; D578-T582 PolarHBondContact O-OG1 2.95Å
579	S	75.4	Confident	69.2	Low	35 Å²	35	71.1 Å²	71.1	25%	0.245	43%	0.426	C	S	.	.	H	α-helix	trans	-72	-40.3	177.4	62.2	0	0	0	0	111.2	S576 H577 T582 D583	S576-S579 PolarHBondContact O-N 3.4Å; S576-S579 PolarHBondContact O-OG 3.21Å; H577-S579 VanDerWaalsContact C-N 3.34Å; H577-S579 PolarHBondContact O-N 3.1Å; S579-T582 CarbonylContact O-C 3.33Å; S579-T582 PolarHBondContact O-N 3.11Å; S579-T582 VanDerWaalsContact O-N 3.14Å; S579-D583 PolarHBondContact O-N 3.22Å; S579-D583 VanDerWaalsContact O-OD1 3.12Å
580	D	82.2	Confident	71.5	Confident	71 Å²	71	67.6 Å²	67.6	38%	0.38	40%	0.401	S	S	.	.	H	α-helix	trans	-70.7	-36.8	-174.3	-62.1	-16.4	0	0	0	112	R575 S576 H577 D583 E584	R575-D580 WeakPolarHBondContact CD-OD1 3.26Å; R575-D580 IonicContact CZ-OD1 3.13Å; R575-D580 IonicContact NE-OD1 2.8Å; R575-D580 IonicContact NH1-OD1 3.81Å; R575-D580 PolarHBondContact NH1-OD1 3.43Å; S576-D580 PolarHBondContact O-N 3.48Å; H577-D580 PolarHBondContact O-N 2.88Å; D580-D583 PolarHBondContact O-N 2.95Å; D580-E584 PolarHBondContact O-N 2.98Å
581	E	86	Confident	73.8	Confident	30 Å²	30	68.6 Å²	68.6	14%	0.14	40%	0.397	C	S	.	.	H	α-helix	trans	-68.3	-34.2	170.1	178.7	156.9	-144.1	0	0	112.1	K103 H577 D583 E584 I585	K103-E581 IonicContact NZ-OE1 2.67Å; K103-E581 PolarHBondContact NZ-OE1 3.44Å; K103-E581 IonicContact NZ-OE2 2.65Å; K103-E581 PolarHBondContact NZ-OE2 3.31Å; H577-E581 PolarHBondContact O-N 3.05Å; H577-E581 VanDerWaalsContact O-N 3.13Å; E581-D583 VanDerWaalsContact C-N 3.27Å; E581-D583 PolarHBondContact O-N 3.03Å; E581-E584 PolarHBondContact O-N 3.01Å; E581-I585 HydrophobicContact CG-CD1 3.99Å; E581-I585 WeakPolarHBondContact O-CD1 3.42Å; E581-I585 VanDerWaalsContact O-CG1 3.3Å; E581-I585 WeakPolarHBondContact O-CG1 3.44Å; E581-I585 PolarHBondContact O-N 2.85Å
582	T	88	Confident	75.9	Confident	12 Å²	12	69.8 Å²	69.8	7%	0.074	38%	0.375	C	S	.	.	H	α-helix	trans	-74.1	-19.2	174.7	-49.9	0	0	0	0	112.3	L102 K149 D578 S579 A586	L102-T582 HydrophobicContact CD1-CG2 4.43Å; K149-T582 PolarHBondContact NZ-O 2.9Å; D578-T582 WeakPolarHBondContact O-CB 3.5Å; D578-T582 PolarHBondContact O-N 3.38Å; D578-T582 PolarHBondContact O-OG1 2.95Å; S579-T582 CarbonylContact O-C 3.33Å; S579-T582 PolarHBondContact O-N 3.11Å; S579-T582 VanDerWaalsContact O-N 3.14Å; T582-A586 VanDerWaalsContact O-CB 3.3Å; T582-A586 WeakPolarHBondContact O-CB 3.45Å; T582-A586 PolarHBondContact O-N 3Å
583	D	90.2	Very high	77	Confident	43 Å²	43	71.6 Å²	71.6	23%	0.23	37%	0.372	C	S	.	.	H	α-helix	trans	-78.3	-46.4	168.7	-75	15.7	0	0	0	110.8	K149 R575 S579 D580 E581 I585 A586 Q587	K149-D583 WeakPolarHBondContact CE-OD1 3.17Å; K149-D583 IonicContact NZ-OD1 2.69Å; K149-D583 PolarHBondContact NZ-OD1 3.46Å; R575-D583 IonicContact CZ-OD2 2.64Å; R575-D583 IonicContact NH1-OD2 2.69Å; R575-D583 PolarHBondContact NH1-OD2 2.7Å; R575-D583 IonicContact NH2-OD2 3.6Å; R575-D583 PolarHBondContact NH2-OD2 2.91Å; S579-D583 PolarHBondContact O-N 3.22Å; S579-D583 VanDerWaalsContact O-OD1 3.12Å; D580-D583 PolarHBondContact O-N 2.95Å; E581-D583 VanDerWaalsContact C-N 3.27Å; E581-D583 PolarHBondContact O-N 3.03Å; D583-I585 PolarHBondContact O-N 2.98Å; D583-A586 PolarHBondContact O-N 3.1Å; D583-Q587 WeakPolarHBondContact O-CB 3.3Å; D583-Q587 PolarHBondContact O-N 2.88Å
584	E	92.3	Very high	77.6	Confident	66 Å²	66	66.8 Å²	66.8	31%	0.308	34%	0.341	S	S	.	.	H	α-helix	trans	-55.6	-50.3	176.4	-175.7	-172.6	-167.9	0	0	111.6	P107 K108 D580 E581 A586 W588	P107-E584 HydrophobicContact CG-CG 3.94Å; K108-E584 VanDerWaalsContact CE-OE1 3.3Å; K108-E584 WeakPolarHBondContact CE-OE1 3.47Å; K108-E584 IonicContact NZ-OE1 3.88Å; K108-E584 PolarHBondContact NZ-OE1 3.12Å; K108-E584 IonicContact NZ-OE2 2.88Å; K108-E584 PolarHBondContact NZ-OE2 3.24Å; D580-E584 PolarHBondContact O-N 2.98Å; E581-E584 PolarHBondContact O-N 3.01Å; E584-A586 PolarHBondContact O-N 3.15Å; E584-W588 WeakPolarHBondContact O-CB 3.14Å; E584-W588 PolarHBondContact O-N 3.25Å; E584-W588 VanDerWaalsContact O-N 3.09Å
585	I	92.3	Very high	77.4	Confident	4 Å²	4	65.4 Å²	65.4	2%	0.021	33%	0.328	C	S	.	.	H	α-helix	trans	-59.1	-49	177.9	-69.7	162.1	0	0	0	110.7	L102 L105 E581 D583 W588 L589	L102-I585 HydrophobicContact CB-CD1 4.33Å; L105-I585 HydrophobicContact CB-CG2 3.84Å; E581-I585 HydrophobicContact CG-CD1 3.99Å; E581-I585 WeakPolarHBondContact O-CD1 3.42Å; E581-I585 VanDerWaalsContact O-CG1 3.3Å; E581-I585 WeakPolarHBondContact O-CG1 3.44Å; E581-I585 PolarHBondContact O-N 2.85Å; D583-I585 PolarHBondContact O-N 2.98Å; I585-W588 PolarHBondContact O-N 3.24Å; I585-L589 HydrophobicContact CG2-CD1 3.72Å; I585-L589 HydrophobicContact CG2-CG 4.37Å; I585-L589 VanDerWaalsContact O-CG 3.27Å; I585-L589 WeakPolarHBondContact O-CG 3.15Å; I585-L589 PolarHBondContact O-N 2.81Å
586	A	91.7	Very high	76.9	Confident	0 Å²	0	62 Å²	62	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-65.6	-43.6	-175.6	0	0	0	0	0	112.1	L146 K149 V151 T582 D583 E584 W588 L589 S590	L146-A586 HydrophobicContact CD2-CB 3.94Å; K149-A586 HydrophobicContact CB-CB 3.56Å; K149-A586 HydrophobicContact CD-CB 3.62Å; K149-A586 HydrophobicContact CG-CB 3.69Å; V151-A586 HydrophobicContact CG2-CB 3.91Å; T582-A586 VanDerWaalsContact O-CB 3.3Å; T582-A586 WeakPolarHBondContact O-CB 3.45Å; T582-A586 PolarHBondContact O-N 3Å; D583-A586 PolarHBondContact O-N 3.1Å; E584-A586 PolarHBondContact O-N 3.15Å; A586-W588 VanDerWaalsContact C-N 3.32Å; A586-W588 PolarHBondContact O-N 2.8Å; A586-L589 PolarHBondContact O-N 3.37Å; A586-S590 WeakPolarHBondContact O-CB 3.32Å; A586-S590 PolarHBondContact O-N 3.44Å; A586-S590 PolarHBondContact O-OG 2.94Å; A586-S590 VanDerWaalsContact O-OG 3.06Å
587	Q	91	Very high	75.3	Confident	146 Å²	146	64.8 Å²	64.8	68%	0.682	34%	0.338	S	S	*	.	H	α-helix	trans	-62.5	-39.9	177.5	-170.6	175.3	35.6	0	0	111.8	D583 S591	D583-Q587 WeakPolarHBondContact O-CB 3.3Å; D583-Q587 PolarHBondContact O-N 2.88Å; Q587-S591 WeakPolarHBondContact O-CB 3.39Å; Q587-S591 PolarHBondContact O-N 2.72Å
588	W	91.4	Very high	73.2	Confident	35 Å²	35	65.8 Å²	65.8	13%	0.133	35%	0.348	C	S	.	.	H	α-helix	trans	-66.5	-45.8	177.6	-178	88.2	0	0	0	112.6	P107 P111 E584 I585 A586 S591 R592	P107-W588 HydrophobicContact CB-CD2 4.37Å; P107-W588 HydrophobicContact CB-CG 4.03Å; P107-W588 HydrophobicContact CG-CB 3.8Å; P107-W588 HydrophobicContact CG-CD2 4.2Å; P107-W588 HydrophobicContact CG-CG 3.63Å; P111-W588 HydrophobicContact CG-CH2 3.9Å; P111-W588 HydrophobicContact CG-CZ3 4.26Å; E584-W588 WeakPolarHBondContact O-CB 3.14Å; E584-W588 PolarHBondContact O-N 3.25Å; E584-W588 VanDerWaalsContact O-N 3.09Å; I585-W588 PolarHBondContact O-N 3.24Å; A586-W588 VanDerWaalsContact C-N 3.32Å; A586-W588 PolarHBondContact O-N 2.8Å; W588-S591 PolarHBondContact O-N 2.97Å; W588-S591 PolarHBondContact O-OG 2.85Å; W588-R592 VanDerWaalsContact CH2-NH1 3.33Å; W588-R592 PolarHBondContact O-N 2.9Å
589	L	90.7	Very high	71.2	Confident	4 Å²	4	67.8 Å²	67.8	2%	0.021	37%	0.367	C	S	.	.	H	α-helix	trans	-60.1	-48.5	176.4	-69	168.6	0	0	0	111.3	L105 L120 V151 I585 A586 S591 R592 L594	L105-L589 HydrophobicContact CB-CD1 4.32Å; L105-L589 HydrophobicContact CB-CD2 4.35Å; L105-L589 HydrophobicContact CD1-CD1 3.87Å; L105-L589 HydrophobicContact CD1-CD2 4.4Å; L120-L589 HydrophobicContact CD2-CD1 4.41Å; V151-L589 HydrophobicContact CG1-CB 4.14Å; V151-L589 HydrophobicContact CG1-CD1 3.95Å; V151-L589 HydrophobicContact CG2-CB 4.02Å; V151-L589 HydrophobicContact CG2-CD1 4.25Å; I585-L589 HydrophobicContact CG2-CD1 3.72Å; I585-L589 HydrophobicContact CG2-CG 4.37Å; I585-L589 VanDerWaalsContact O-CG 3.27Å; I585-L589 WeakPolarHBondContact O-CG 3.15Å; I585-L589 PolarHBondContact O-N 2.81Å; A586-L589 PolarHBondContact O-N 3.37Å; L589-S591 VanDerWaalsContact C-N 3.29Å; L589-S591 PolarHBondContact O-N 3.3Å; L589-R592 PolarHBondContact O-N 2.56Å; L589-L594 HydrophobicContact CD2-CD1 3.86Å
590	S	87.6	Confident	69	Low	38 Å²	38	75.1 Å²	75.1	27%	0.266	40%	0.397	S	S	.	.	H	α-helix	trans	-60.9	-36.6	176.5	-61.2	0	0	0	0	112.5	K149 G150 V151 A586 R592	K149-S590 PolarHBondContact O-OG 3.11Å; G150-S590 PolarHBondContact O-OG 3.13Å; V151-S590 PolarHBondContact N-OG 2.94Å; A586-S590 WeakPolarHBondContact O-CB 3.32Å; A586-S590 PolarHBondContact O-N 3.44Å; A586-S590 PolarHBondContact O-OG 2.94Å; A586-S590 VanDerWaalsContact O-OG 3.06Å; S590-R592 PolarHBondContact O-N 2.74Å
591	S	84.6	Confident	66.4	Low	88 Å²	88	81 Å²	81	62%	0.615	42%	0.423	S	S	*	.	H	α-helix	trans	-66.6	-23.2	178.6	80.1	0	0	0	0	113.9	Q587 W588 L589	Q587-S591 WeakPolarHBondContact O-CB 3.39Å; Q587-S591 PolarHBondContact O-N 2.72Å; W588-S591 PolarHBondContact O-N 2.97Å; W588-S591 PolarHBondContact O-OG 2.85Å; L589-S591 VanDerWaalsContact C-N 3.29Å; L589-S591 PolarHBondContact O-N 3.3Å
592	R	74.1	Confident	63.7	Low	109 Å²	109	86.9 Å²	86.9	41%	0.411	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-5.3	-171.4	-82.1	-173.3	160	-157.7	-1.1	115.6	D110 W588 L589 S590	D110-R592 IonicContact OD1-CZ 2.61Å; D110-R592 IonicContact OD1-NH1 2.88Å; D110-R592 PolarHBondContact OD1-NH1 3.31Å; D110-R592 IonicContact OD1-NH2 2.7Å; D110-R592 PolarHBondContact OD1-NH2 2.72Å; D110-R592 IonicContact OD2-NH2 2.73Å; W588-R592 VanDerWaalsContact CH2-NH1 3.33Å; W588-R592 PolarHBondContact O-N 2.9Å; L589-R592 PolarHBondContact O-N 2.56Å; S590-R592 PolarHBondContact O-N 2.74Å
593	Q	57.7	Low	60.9	Low	145 Å²	145	91.7 Å²	91.7	68%	0.678	48%	0.484	S	S	*	.			trans	43.3	87.3	-176.3	-68.5	-169	-7.8	0	0	113.4	I595	Q593-I595 PolarHBondContact O-N 3.17Å
594	L	54.7	Low	58.2	Low	32 Å²	32	98.9 Å²	98.9	17%	0.168	52%	0.516	C	S	.	.			trans	-73.2	65.9	-178.9	-79.5	173.2	0	0	0	113.7	Q113 Q116 L120 L589	Q113-L594 HydrophobicContact CG-CD2 4.01Å; Q116-L594 HydrophobicContact CB-CD1 4.32Å; Q116-L594 HydrophobicContact CB-CD2 4.08Å; L120-L594 HydrophobicContact CD1-CD1 3.43Å; L120-L594 VanDerWaalsContact CD1-CD1 3.43Å; L589-L594 HydrophobicContact CD2-CD1 3.86Å
595	I	38.8	Very low	55.2	Low	107 Å²	107	105.3 Å²	105.3	55%	0.549	55%	0.546	S	S	.	.			trans	-132	91.8	177	-51.2	177.3	0	0	0	109.4	Q593	Q593-I595 PolarHBondContact O-N 3.17Å
596	P	39.5	Very low	52.4	Low	70 Å²	70	110 Å²	110	46%	0.455	58%	0.579	S	S	.	*			trans	-93.3	108.1	168.3	31.4	-25	0	0	0	111.6	Q113	Q113-P596 HydrophobicContact CG-CG 4.31Å
597	V	32.1	Very low	49.6	Very low	125 Å²	125	118.5 Å²	118.5	76%	0.758	62%	0.619	S	S	*	*	S	Bend	trans	43.3	91.7	146	-166.1	0	0	0	0	117.3
598	N	27.3	Very low	47	Very low	164 Å²	164	122.8 Å²	122.8	88%	0.877	63%	0.628	S	S	*	*	S	Bend	trans	-155.1	35.1	134.5	-120.8	6	0	0	0	114.3
599	S	27.9	Very low	44.3	Very low	100 Å²	100	126.8 Å²	126.8	70%	0.699	66%	0.659	S	S	*	*	S	Bend	trans	-158.4	51.9	-177.5	54.3	0	0	0	0	114.9
600	Q	29.1	Very low	41.3	Very low	188 Å²	188	136.1 Å²	136.1	88%	0.879	70%	0.7	S	S	*	*			trans	-175.9	88.5	157.9	-105.9	159	54.6	0	0	112.5
601	Q	27.8	Very low	38.9	Very low	195 Å²	195	143 Å²	143	91%	0.911	73%	0.728	S	S	*	*			trans	-130.4	49.7	156.1	-79	-159	16.1	0	0	110.9
602	Q	28.5	Very low	36.5	Very low	153 Å²	153	147 Å²	147	72%	0.715	74%	0.737	S	S	*	*	S	Bend	trans	-132.8	143.9	164.5	-71.8	-172.5	-4.1	0	0	110.3
603	S	28.9	Very low	34.6	Very low	113 Å²	113	150.6 Å²	150.6	79%	0.79	76%	0.758	S	S	*	*			trans	48.3	70.9	164.8	62.3	0	0	0	0	119
604	Q	33.6	Very low	33.5	Very low	195 Å²	195	151.6 Å²	151.6	91%	0.911	76%	0.763	S	S	*	*			trans	-135.4	42.2	140.1	-76.8	-150.9	25.6	0	0	113.1	S606	Q604-S606 PolarHBondContact O-N 3.25Å
605	H	30.8	Very low	32.3	Very low	200 Å²	200	160 Å²	160	93%	0.926	80%	0.801	S	S	*	*			trans	-76.1	96.2	153.5	-93.2	-58.4	0	0	0	108.8
606	S	33.4	Very low	32	Very low	103 Å²	103	159.2 Å²	159.2	72%	0.72	81%	0.805	S	S	*	*			trans	-129.5	99.6	168.5	-163.8	0	0	0	0	111.2	Q604	Q604-S606 PolarHBondContact O-N 3.25Å
607	H	32.7	Very low	31.7	Very low	179 Å²	179	164.3 Å²	164.3	83%	0.829	83%	0.828	S	S	*	*			trans	19	97.2	160.2	-54.7	-78.2	0	0	0	119
608	R	35	Very low	31.8	Very low	235 Å²	235	164 Å²	164	89%	0.887	83%	0.826	S	S	*	*			trans	-95.2	122.9	138.8	-84.4	-168.9	173.3	-159	-0.8	109.1	F610	R608-F610 PolarHBondContact O-N 2.94Å
609	P	35.6	Very low	32.1	Very low	120 Å²	120	161.8 Å²	161.8	78%	0.779	82%	0.819	S	S	*	*			trans	-72.6	115.4	172.8	28.8	-32.1	0	0	0	110.1	Q611	P609-Q611 PolarHBondContact O-N 2.89Å
610	F	28	Very low	32.5	Very low	200 Å²	200	163.8 Å²	163.8	88%	0.877	82%	0.822	S	S	*	*			trans	-78.8	96.3	168.2	-118.8	-87.4	0	0	0	108.7	R608	R608-F610 PolarHBondContact O-N 2.94Å
611	Q	37.4	Very low	32.8	Very low	181 Å²	181	159.3 Å²	159.3	85%	0.846	81%	0.811	S	S	*	*			trans	-96.9	120.5	164.1	-81.4	-170.1	-33.5	0	0	110	P609	P609-Q611 PolarHBondContact O-N 2.89Å
612	H	32.8	Very low	33	Very low	174 Å²	174	161.3 Å²	161.3	81%	0.806	81%	0.81	S	S	*	*			trans	-63.9	133.9	161	-72.2	6.4	0	0	0	109.6
613	Q	34.3	Very low	33.4	Very low	183 Å²	183	158.5 Å²	158.5	86%	0.855	81%	0.808	S	S	*	*				-156.7	168	119.4	-126.4	163.4	-4.7	0	0	112.8
614	Q	34.9	Very low	33.9	Very low	167 Å²	167	161.3 Å²	161.3	78%	0.78	81%	0.808	S	S	*	*			trans	-81.8	146.2	-164.2	-67.3	147.2	-23.5	0	0	112.7	S616	Q614-S616 PolarHBondContact O-N 2.74Å
615	Q	30	Very low	34	Very low	207 Å²	207	156.5 Å²	156.5	97%	0.967	80%	0.796	S	S	*	*			trans	-79.5	90.9	168.3	-69	-178.1	-2.9	0	0	110.5
616	S	32.3	Very low	34.2	Very low	92 Å²	92	152.2 Å²	152.2	64%	0.643	79%	0.787	S	S	*	*			trans	-161.6	72.9	170.5	60.7	0	0	0	0	113.5	Q614	Q614-S616 PolarHBondContact O-N 2.74Å
617	L	33.9	Very low	34.3	Very low	177 Å²	177	153 Å²	153	93%	0.927	79%	0.787	S	S	*	*			trans	-137.3	135.7	160	-87.2	-177.9	0	0	0	112.1
618	T	34.8	Very low	34.5	Very low	118 Å²	118	154.9 Å²	154.9	72%	0.724	79%	0.787	S	S	*	*			trans	-101.7	136.6	-173.3	47.5	0	0	0	0	112.1
619	T	33.3	Very low	34.6	Very low	117 Å²	117	149 Å²	149	72%	0.718	78%	0.777	S	S	*	*			trans	62.9	140	145.7	58.2	0	0	0	0	121.4
620	N	34.7	Very low	34.8	Very low	143 Å²	143	150.2 Å²	150.2	77%	0.765	78%	0.777	S	S	*	*			trans	85.3	102.6	144.2	-69.2	-7.9	0	0	0	121.6
621	S	35.4	Very low	35.3	Very low	94 Å²	94	148.6 Å²	148.6	66%	0.657	77%	0.772	S	S	*	*				96.6	114.7	116	-65.5	0	0	0	0	120.6
622	R	33.2	Very low	35	Very low	237 Å²	237	147 Å²	147	89%	0.894	77%	0.768	S	S	*	*			trans	49.4	141.4	132.9	-55.5	178.3	160.1	175.1	-6.7	118.3
623	S	36.6	Very low	35.2	Very low	94 Å²	94	144.6 Å²	144.6	66%	0.657	77%	0.771	S	S	*	*			cis	-169.1	166.3	36.8	-31.7	0	0	0	0	112.8
624	H	39.4	Very low	35	Very low	172 Å²	172	140.2 Å²	140.2	80%	0.796	77%	0.766	S	S	*	*			trans	57.6	111.9	150.3	-69.8	-61.5	0	0	0	120.1
625	S	36.6	Very low	35.1	Very low	94 Å²	94	140.3 Å²	140.3	66%	0.657	77%	0.771	S	S	*	*				66.3	128	77.9	72.2	0	0	0	0	114.3
626	C	34.3	Very low	35.4	Very low	110 Å²	110	135.4 Å²	135.4	74%	0.743	76%	0.755	S	S	*	*			cis	-153	150.9	46	-102.7	0	0	0	0	112.1
627	V	35.6	Very low	35.3	Very low	118 Å²	118	138 Å²	138	72%	0.715	76%	0.761	S	S	*	*				60.9	118.6	79.5	179.9	0	0	0	0	112.6
628	R	37.2	Very low	35.4	Very low	220 Å²	220	136.5 Å²	136.5	83%	0.83	76%	0.76	S	S	*	*				-162.6	129	60.1	-119.1	143.8	-179	-161	-0.4	110.9
629	T	36.7	Very low	35.4	Very low	110 Å²	110	137.1 Å²	137.1	68%	0.675	76%	0.763	S	S	*	*				75.8	152.4	90.2	66.3	0	0	0	0	119.8
630	N	39.2	Very low	35.6	Very low	147 Å²	147	137.9 Å²	137.9	79%	0.786	77%	0.768	S	S	*	*			trans	86.4	139.5	157.7	-63.4	-12.2	0	0	0	118.3
631	H	38.4	Very low	35.6	Very low	165 Å²	165	136.9 Å²	136.9	76%	0.764	77%	0.768	S	S	*	*			cis	-156	167	-12.4	-167.5	-94.8	0	0	0	111.4
632	L	31.4	Very low	35.6	Very low	148 Å²	148	139 Å²	139	78%	0.775	78%	0.777	S	S	*	*			trans	-66.9	146.1	172.8	-83.6	64.5	0	0	0	113.7
633	S	36.2	Very low	35.7	Very low	124 Å²	124	134.5 Å²	134.5	87%	0.867	78%	0.776	S	S	*	*				-159.6	159.6	129	49	0	0	0	0	110.2
634	A	31.9	Very low	35.8	Very low	91 Å²	91	136 Å²	136	75%	0.752	79%	0.786	S	S	*	*			trans	-126.9	161.3	179.2	0	0	0	0	0	109.9
635	I	36.9	Very low	35.7	Very low	169 Å²	169	133 Å²	133	87%	0.867	79%	0.791	S	S	*	*			trans	-174.8	152.7	145	-98.4	152	0	0	0	111.6
636	T	36.2	Very low	35.7	Very low	104 Å²	104	132.4 Å²	132.4	64%	0.638	80%	0.8	S	S	*	*			trans	-43.9	148.5	-169.8	54.5	0	0	0	0	121.9
637	N	29.9	Very low	35.8	Very low	146 Å²	146	133.7 Å²	133.7	78%	0.781	80%	0.804	S	S	*	*			trans	53.4	123.3	131.1	-53.2	-0.7	0	0	0	121.6
638	T	35.4	Very low	35.7	Very low	145 Å²	145	132.6 Å²	132.6	89%	0.89	80%	0.801	S	S	*	*			trans	-144.8	149.7	134.9	17.8	0	0	0	0	109.9
639	T	34.5	Very low	35.5	Very low	131 Å²	131	130 Å²	130	80%	0.804	80%	0.803	S	S	*	*			trans	-112.1	139.3	-179.5	-53.2	0	0	0	0	109.5
640	T	37.2	Very low	35.1	Very low	133 Å²	133	134.7 Å²	134.7	82%	0.816	81%	0.81	S	S	*	*			trans	-123.4	104	178.3	-35.7	0	0	0	0	110.3
641	T	34.9	Very low	34.8	Very low	123 Å²	123	132.6 Å²	132.6	76%	0.755	81%	0.813	S	S	*	*			trans	-88.7	138.3	170.9	32.4	0	0	0	0	110.8
642	T	36.9	Very low	34.5	Very low	139 Å²	139	130.4 Å²	130.4	85%	0.853	81%	0.812	S	S	*	*			trans	-120.1	101.2	171	32.4	0	0	0	0	110.1
643	T	34.4	Very low	34.7	Very low	142 Å²	142	132.9 Å²	132.9	87%	0.871	82%	0.819	S	S	*	*			trans	-89.6	128.6	169.5	44.1	0	0	0	0	110.5
644	S	37.8	Very low	34.5	Very low	125 Å²	125	134.4 Å²	134.4	87%	0.874	82%	0.818	S	S	*	*			trans	-105.5	142.1	159.2	54.7	0	0	0	0	109.5
645	A	38	Very low	34.6	Very low	110 Å²	110	135.2 Å²	135.2	91%	0.909	82%	0.815	S	S	*	*			trans	-109.6	131	-178.6	0	0	0	0	0	110.5
646	G	37.1	Very low	34.6	Very low	81 Å²	81	132.3 Å²	132.3	84%	0.835	81%	0.81	S	S	*	*			trans	-124.6	99.3	179.7	0	0	0	0	0	111.2
647	V	36.9	Very low	34.5	Very low	136 Å²	136	134.2 Å²	134.2	82%	0.824	82%	0.816	S	S	*	*			trans	-16.1	123.7	175.3	-178.5	0	0	0	0	116.6
648	S	31.8	Very low	34.7	Very low	95 Å²	95	136.2 Å²	136.2	66%	0.664	82%	0.818	S	S	*	*			trans	-82.8	138.2	161.3	175.7	0	0	0	0	110.7
649	L	34.5	Very low	34.6	Very low	165 Å²	165	134 Å²	134	86%	0.864	81%	0.808	S	S	*	*			trans	-122.1	136.3	161.3	-90.5	169.7	0	0	0	109.6
650	Y	27.7	Very low	34.5	Very low	209 Å²	209	134.1 Å²	134.1	82%	0.82	81%	0.809	S	S	*	*			trans	-86.2	135.4	-179.2	-85.6	-115.8	0	0	0	111.4
651	A	33.6	Very low	34.4	Very low	104 Å²	104	136.1 Å²	136.1	86%	0.86	81%	0.808	S	S	*	*			trans	-143.6	94.4	158	0	0	0	0	0	109.5
652	T	30.7	Very low	34.3	Very low	119 Å²	119	134.7 Å²	134.7	73%	0.73	80%	0.804	S	S	*	*			trans	-90.7	131.3	176.1	48.4	0	0	0	0	111.1
653	Q	35.5	Very low	34	Very low	199 Å²	199	137 Å²	137	93%	0.93	80%	0.804	S	S	*	*			trans	-149.5	152.4	158.2	-116.9	166.3	61.4	0	0	112
654	N	32.2	Very low	34	Very low	156 Å²	156	138.9 Å²	138.9	83%	0.834	80%	0.803	S	S	*	*			trans	-85.9	153.4	-166.4	-87.3	-40.5	0	0	0	113.6
655	P	35.2	Very low	33.9	Very low	108 Å²	108	137.1 Å²	137.1	70%	0.701	79%	0.791	S	S	*	*			trans	-74.1	168	160.8	34.5	-35.5	0	0	0	111.9
656	S	36.6	Very low	33.5	Very low	108 Å²	108	141.6 Å²	141.6	76%	0.755	79%	0.79	S	S	*	*			trans	67.2	105.1	171.5	72.8	0	0	0	0	117.9
657	N	33.1	Very low	33.4	Very low	145 Å²	145	145.7 Å²	145.7	78%	0.775	79%	0.787	S	S	*	*				-171.9	158.5	114.5	-122.6	-66.3	0	0	0	113.5
658	K	34.9	Very low	33.3	Very low	188 Å²	188	147.3 Å²	147.3	82%	0.817	79%	0.786	S	S	*	*			trans	66.6	153.2	168.1	-59.2	163.1	-174.6	176.4	0	117.4
659	S	33.4	Very low	33.5	Very low	97 Å²	97	151.3 Å²	151.3	68%	0.678	80%	0.799	S	S	*	*			cis	-164.4	139.5	-29.3	50.2	0	0	0	0	111.3
660	V	32.9	Very low	33.4	Very low	135 Å²	135	154.4 Å²	154.4	82%	0.818	82%	0.815	S	S	*	*			trans	-12.7	124.6	156	-178.2	0	0	0	0	116.2
661	H	34.3	Very low	33.7	Very low	174 Å²	174	151.7 Å²	151.7	81%	0.806	82%	0.815	S	S	*	*			trans	-145.2	136.9	143.1	-100.3	-68.1	0	0	0	111
662	S	33	Very low	33.7	Very low	94 Å²	94	154.2 Å²	154.2	66%	0.657	81%	0.813	S	S	*	*			trans	27.6	115.3	153.4	47.4	0	0	0	0	118.1
663	H	30.5	Very low	33.8	Very low	187 Å²	187	156.2 Å²	156.2	87%	0.866	82%	0.817	S	S	*	*			cis	51	89.3	43.7	-106.4	-76.1	0	0	0	113.6
664	Q	33.6	Very low	33.7	Very low	182 Å²	182	153.6 Å²	153.6	85%	0.85	81%	0.811	S	S	*	*			trans	178.6	153.8	138.6	-98.7	156	-22.3	0	0	110.6
665	S	35.8	Very low	33.8	Very low	88 Å²	88	153.5 Å²	153.5	62%	0.615	81%	0.809	S	S	*	*			trans	41.3	118.2	170.2	-58.1	0	0	0	0	118.1
666	F	30.4	Very low	33.7	Very low	203 Å²	203	156.5 Å²	156.5	89%	0.89	82%	0.816	S	S	*	*	S	Bend	cis	48.9	107.7	28.1	-111	-81	0	0	0	113.9
667	H	34.1	Very low	33.5	Very low	168 Å²	168	160 Å²	160	78%	0.778	82%	0.821	S	S	*	*	S	Bend	trans	83.9	19.8	160.5	-141.6	-53.4	0	0	0	119.7
668	E	35.5	Very low	33.6	Very low	169 Å²	169	161.2 Å²	161.2	79%	0.79	82%	0.824	S	S	*	*	S	Bend	trans	-126.9	9.2	177	-94.6	-178	140.3	0	0	116.9
669	L	35.5	Very low	33.5	Very low	179 Å²	179	158.9 Å²	158.9	94%	0.937	83%	0.825	S	S	*	*			trans	-127.1	49	169.3	-75.3	173.5	0	0	0	111.7
670	L	32.5	Very low	33.5	Very low	231 Å²	231	164.5 Å²	164.5	100%	1.209	84%	0.838	S	S	*	*			trans	60.6	0	-179.4	-68.7	167.8	0	0	0	114.8

Retrieved 670 of 670 residues in 682.6 ms (Link to these results)

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