A0A087XN51_POEFO Loading...

TRAF-interacting protein

AlphaFold DB , UniProt , Accession A0A087XN51, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 451 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	40.1	Very low	75.8	Confident	234 Å²	234	97.2 Å²	97.2	100%	1.153	51%	0.514	S	S	*	.				0	130.2	0	-71.1	-175.5	172.9	0	0	107.6
2	P	52.6	Low	77	Confident	113 Å²	113	95.1 Å²	95.1	73%	0.734	50%	0.503	S	S	*	.			trans	-64.4	142.2	177.3	27.6	-34	0	0	0	110.1	R4	P2-R4 PolarHBondContact O-N 2.97Å
3	I	56.3	Low	77.7	Confident	122 Å²	122	98.5 Å²	98.5	63%	0.626	51%	0.511	S	S	*	.			trans	-67	105.2	176.1	-61.9	168	0	0	0	107.3	A5	I3-A5 HydrophobicContact CG2-CB 3.72Å; I3-A5 PolarHBondContact O-N 3.44Å
4	R	66	Low	78.3	Confident	225 Å²	225	94.5 Å²	94.5	85%	0.849	49%	0.488	S	S	*	.			trans	-74.6	47.1	177.7	-76.3	-177.2	155.8	-173.7	-6.2	112.5	P2	P2-R4 PolarHBondContact O-N 2.97Å
5	A	79.1	Confident	78.2	Confident	33 Å²	33	92.3 Å²	92.3	27%	0.273	48%	0.478	S	S	.	.			trans	-95.8	140.1	173.3	0	0	0	0	0	109.7	I3 F14	I3-A5 HydrophobicContact CG2-CB 3.72Å; I3-A5 PolarHBondContact O-N 3.44Å; A5-F14 HydrophobicContact CB-CD2 3.66Å; A5-F14 HydrophobicContact CB-CE2 3.8Å; A5-F14 WeakPolarHBondContact O-CD2 3.28Å; A5-F14 PolarHBondContact O-N 3.02Å
6	H	87.8	Confident	77.9	Confident	86 Å²	86	97 Å²	97	40%	0.398	50%	0.496	S	S	.	.	B	Isolated β-bridge	trans	-134	152.1	-179.2	60.7	-85.4	0	0	0	108.9	T8 D12 F13	H6-T8 PolarHBondContact O-N 3.2Å; H6-D12 CarbonylContact C-O 3.56Å; H6-D12 WeakPolarHBondContact CA-O 3.39Å; H6-D12 VanDerWaalsContact CB-O 3.25Å; H6-D12 WeakPolarHBondContact CB-O 3Å; H6-F13 HydrophobicContact CB-CD1 4.42Å
7	C	91.7	Very high	77.8	Confident	0 Å²	0	100.3 Å²	100.3	0%	0	52%	0.515	C	S	.	.			trans	-74	117.6	174.6	-179.6	0	0	0	0	109.4	I9 C10 S11 D12 F14 H30	C7-I9 PolarHBondContact O-N 3.22Å; C7-C10 PolarHBondContact O-N 3.33Å; C7-S11 WeakPolarHBondContact O-CA 3.42Å; C7-S11 PolarHBondContact O-N 3.15Å; C7-D12 PolarHBondContact N-O 3.17Å; C7-F14 HydrophobicContact CB-CD1 4.49Å; C7-F14 HydrophobicContact CB-CE1 3.67Å; C7-F14 HydrophobicContact CB-CZ 4.02Å; C7-H30 WeakPolarHBondContact CB-ND1 3.44Å; C7-H30 PolarHBondContact SG-N 3Å; C7-H30 VanDerWaalsContact SG-N 3.41Å
8	T	89.3	Confident	78.1	Confident	61 Å²	61	99.2 Å²	99.2	37%	0.374	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	0.7	-179	52.1	0	0	0	0	114.6	H6 F29 Q48	H6-T8 PolarHBondContact O-N 3.2Å; T8-F29 VanDerWaalsContact OG1-CE1 3.23Å; T8-F29 WeakPolarHBondContact OG1-CE1 3.4Å; T8-Q48 PolarHBondContact OG1-OE1 3.09Å
9	I	90.5	Very high	78.7	Confident	56 Å²	56	97.2 Å²	97.2	29%	0.287	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-49	172.7	-60.6	164.8	0	0	0	111.3	C7 F29 C33 W37 P47	C7-I9 PolarHBondContact O-N 3.22Å; I9-F29 HydrophobicContact CD1-CB 4.09Å; I9-F29 HydrophobicContact CD1-CD1 3.46Å; I9-F29 VanDerWaalsContact CD1-CD1 3.46Å; I9-F29 HydrophobicContact CD1-CE1 4.13Å; I9-F29 HydrophobicContact CD1-CG 3.93Å; I9-F29 HydrophobicContact CG1-CD1 3.6Å; I9-F29 HydrophobicContact CG1-CE1 3.98Å; I9-C33 HydrophobicContact CB-CB 4.01Å; I9-C33 HydrophobicContact CD1-CB 3.88Å; I9-C33 HydrophobicContact CG2-CB 3.94Å; I9-W37 HydrophobicContact CD1-CB 4.22Å; I9-P47 HydrophobicContact CD1-CG 3.85Å; I9-P47 HydrophobicContact CG1-CB 4.18Å; I9-P47 HydrophobicContact CG1-CG 3.98Å
10	C	91.8	Very high	79.3	Confident	49 Å²	49	92.8 Å²	92.8	33%	0.331	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-9.8	-179.7	61.6	0	0	0	0	114.1	C7 D12 H30	C7-C10 PolarHBondContact O-N 3.33Å; C10-D12 PolarHBondContact O-N 3.35Å; C10-H30 PolarHBondContact SG-ND1 2.97Å
11	S	88.5	Confident	79.9	Confident	90 Å²	90	88.3 Å²	88.3	63%	0.629	45%	0.45	S	S	*	.			trans	66.1	2.2	-173.2	-49	0	0	0	0	116.2	C7	C7-S11 WeakPolarHBondContact O-CA 3.42Å; C7-S11 PolarHBondContact O-N 3.15Å
12	D	89.9	Confident	82.4	Confident	72 Å²	72	77.8 Å²	77.8	39%	0.385	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-74	150.6	174.1	-70.1	-17.4	0	0	0	112.6	H6 C7 C10 R18	H6-D12 CarbonylContact C-O 3.56Å; H6-D12 WeakPolarHBondContact CA-O 3.39Å; H6-D12 VanDerWaalsContact CB-O 3.25Å; H6-D12 WeakPolarHBondContact CB-O 3Å; C7-D12 PolarHBondContact N-O 3.17Å; C10-D12 PolarHBondContact O-N 3.35Å; D12-R18 IonicContact OD2-CZ 3.14Å; D12-R18 IonicContact OD2-NH1 2.81Å; D12-R18 PolarHBondContact OD2-NH1 2.85Å; D12-R18 IonicContact OD2-NH2 2.66Å; D12-R18 PolarHBondContact OD2-NH2 2.99Å
13	F	87	Confident	84.2	Confident	139 Å²	139	72.6 Å²	72.6	61%	0.61	37%	0.366	S	S	*	.	B	Isolated β-bridge	trans	-62.7	151.5	166.6	-61.9	-75	0	0	0	111.9	H6 R18	H6-F13 HydrophobicContact CB-CD1 4.42Å; F13-R18 PolarHBondContact O-NH2 3.5Å
14	F	85.5	Confident	85.7	Confident	43 Å²	43	71.5 Å²	71.5	19%	0.189	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-74.5	127	167.6	-60.3	-59.5	0	0	0	109.9	A5 C7 V20 H30	A5-F14 HydrophobicContact CB-CD2 3.66Å; A5-F14 HydrophobicContact CB-CE2 3.8Å; A5-F14 WeakPolarHBondContact O-CD2 3.28Å; A5-F14 PolarHBondContact O-N 3.02Å; C7-F14 HydrophobicContact CB-CD1 4.49Å; C7-F14 HydrophobicContact CB-CE1 3.67Å; C7-F14 HydrophobicContact CB-CZ 4.02Å; F14-V20 HydrophobicContact CB-CG2 3.88Å; F14-V20 HydrophobicContact CD1-CB 4.31Å; F14-V20 HydrophobicContact CD1-CG1 3.86Å; F14-V20 HydrophobicContact CD1-CG2 3.55Å; F14-V20 HydrophobicContact CE1-CG1 3.81Å; F14-V20 HydrophobicContact CE1-CG2 4.3Å; F14-V20 HydrophobicContact CG-CG1 4.27Å; F14-V20 HydrophobicContact CG-CG2 3.85Å; F14-V20 HydrophobicContact CZ-CG1 4.18Å; F14-H30 AromaticContact CD1-CD2 3.72Å; F14-H30 AromaticContact CD1-NE2 3.47Å; F14-H30 WeakPolarHBondContact CD1-NE2 3.38Å
15	D	77.7	Confident	86.9	Confident	62 Å²	62	62.1 Å²	62.1	33%	0.332	33%	0.326	S	S	.	.			trans	-117.4	178	179.4	47.7	36.8	0	0	0	111.5	D17 R18	D15-D17 VanDerWaalsContact C-N 3.32Å; D15-R18 VanDerWaalsContact OD1-CB 3.31Å; D15-R18 WeakPolarHBondContact OD1-CB 3.36Å; D15-R18 WeakPolarHBondContact OD1-CG 3.46Å; D15-R18 PolarHBondContact OD1-N 3.4Å; D15-R18 VanDerWaalsContact OD1-N 3.1Å; D15-R18 IonicContact OD1-NE 2.82Å; D15-R18 PolarHBondContact OD1-NE 3.02Å; D15-R18 IonicContact OD2-CZ 3.18Å; D15-R18 IonicContact OD2-NE 3.48Å; D15-R18 PolarHBondContact OD2-NE 2.72Å; D15-R18 IonicContact OD2-NH2 3.62Å; D15-R18 PolarHBondContact OD2-NH2 2.91Å
16	H	72.6	Confident	87.3	Confident	167 Å²	167	63.6 Å²	63.6	77%	0.773	34%	0.344	S	S	*	.	S	Bend	trans	-78	-17.9	178.1	-67.4	108.1	0	0	0	113.3
17	D	76.9	Confident	87.5	Confident	153 Å²	153	61.7 Å²	61.7	82%	0.818	34%	0.336	S	S	*	.	S	Bend	trans	-85.5	-24.1	-173.9	-64.6	-35	0	0	0	113	D15	D15-D17 VanDerWaalsContact C-N 3.32Å
18	R	82.6	Confident	87.5	Confident	81 Å²	81	63.7 Å²	63.7	31%	0.306	35%	0.348	S	S	.	.	S	Bend	trans	-115.4	132	-176.2	-62.2	179	-73.3	-176.4	0.2	112.7	D12 F13 D15 V20	D12-R18 IonicContact OD2-CZ 3.14Å; D12-R18 IonicContact OD2-NH1 2.81Å; D12-R18 PolarHBondContact OD2-NH1 2.85Å; D12-R18 IonicContact OD2-NH2 2.66Å; D12-R18 PolarHBondContact OD2-NH2 2.99Å; F13-R18 PolarHBondContact O-NH2 3.5Å; D15-R18 VanDerWaalsContact OD1-CB 3.31Å; D15-R18 WeakPolarHBondContact OD1-CB 3.36Å; D15-R18 WeakPolarHBondContact OD1-CG 3.46Å; D15-R18 PolarHBondContact OD1-N 3.4Å; D15-R18 VanDerWaalsContact OD1-N 3.1Å; D15-R18 IonicContact OD1-NE 2.82Å; D15-R18 PolarHBondContact OD1-NE 3.02Å; D15-R18 IonicContact OD2-CZ 3.18Å; D15-R18 IonicContact OD2-NE 3.48Å; D15-R18 PolarHBondContact OD2-NE 2.72Å; D15-R18 IonicContact OD2-NH2 3.62Å; D15-R18 PolarHBondContact OD2-NH2 2.91Å; R18-V20 PolarHBondContact O-N 3.07Å
19	D	88.8	Confident	87.7	Confident	61 Å²	61	60.8 Å²	60.8	33%	0.326	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-63.6	125.5	179.8	-75.7	-7.3	0	0	0	112.1	H30 Y31 K61	D19-H30 CarbonylContact O-C 2.82Å; D19-H30 WeakPolarHBondContact O-CA 3.3Å; D19-Y31 PolarHBondContact O-N 3.32Å; D19-K61 HydrophobicContact CB-CG 4.39Å; D19-K61 VanDerWaalsContact OD1-CD 3.32Å; D19-K61 WeakPolarHBondContact OD1-CD 3.42Å; D19-K61 WeakPolarHBondContact OD1-CE 3.29Å; D19-K61 IonicContact OD1-NZ 2.67Å; D19-K61 PolarHBondContact OD1-NZ 2.93Å; D19-K61 IonicContact OD2-NZ 2.63Å
20	V	91.1	Very high	87.8	Confident	8 Å²	8	58.3 Å²	58.3	5%	0.048	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	124.6	173.9	-172.1	0	0	0	0	109.9	F14 R18 T28 F29 K61 L62 F64	F14-V20 HydrophobicContact CB-CG2 3.88Å; F14-V20 HydrophobicContact CD1-CB 4.31Å; F14-V20 HydrophobicContact CD1-CG1 3.86Å; F14-V20 HydrophobicContact CD1-CG2 3.55Å; F14-V20 HydrophobicContact CE1-CG1 3.81Å; F14-V20 HydrophobicContact CE1-CG2 4.3Å; F14-V20 HydrophobicContact CG-CG1 4.27Å; F14-V20 HydrophobicContact CG-CG2 3.85Å; F14-V20 HydrophobicContact CZ-CG1 4.18Å; R18-V20 PolarHBondContact O-N 3.07Å; V20-T28 HydrophobicContact CG1-CG2 4.5Å; V20-F29 CarbonylContact C-O 3.46Å; V20-K61 CarbonylContact O-C 3.6Å; V20-K61 WeakPolarHBondContact O-CA 3.03Å; V20-L62 HydrophobicContact CG1-CD1 4.21Å; V20-L62 PolarHBondContact O-N 2.97Å; V20-F64 HydrophobicContact CB-CE2 4.04Å; V20-F64 HydrophobicContact CG1-CE2 4.25Å; V20-F64 HydrophobicContact CG1-CZ 4.32Å; V20-F64 HydrophobicContact CG2-CE2 4.11Å
21	S	91.8	Very high	87.7	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	153.9	174.7	-52.7	0	0	0	0	112.6	T28 F29 Y31 I59 N60	S21-T28 CarbonylContact O-C 3.6Å; S21-T28 WeakPolarHBondContact O-CA 3.38Å; S21-F29 PolarHBondContact N-O 3.11Å; S21-F29 PolarHBondContact O-N 2.88Å; S21-Y31 WeakPolarHBondContact OG-CA 3.45Å; S21-Y31 VanDerWaalsContact OG-CB 3.29Å; S21-Y31 WeakPolarHBondContact OG-CB 3.27Å; S21-Y31 WeakPolarHBondContact OG-CD2 3.22Å; S21-I59 CarbonylContact C-O 3.4Å; S21-I59 WeakPolarHBondContact CA-O 3.44Å; S21-I59 VanDerWaalsContact CB-O 3.31Å; S21-I59 WeakPolarHBondContact CB-O 3.46Å; S21-N60 WeakPolarHBondContact CB-O 3.37Å; S21-N60 PolarHBondContact OG-O 3.42Å
22	A	92.1	Very high	87.9	Confident	13 Å²	13	62.4 Å²	62.4	11%	0.107	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	141.5	166.7	0	0	0	0	0	112.3	T28 I59 L62	A22-T28 HydrophobicContact CB-CG2 4.12Å; A22-I59 HydrophobicContact CB-CB 4.42Å; A22-I59 PolarHBondContact N-O 2.86Å; A22-I59 PolarHBondContact O-N 3.24Å; A22-L62 HydrophobicContact CB-CD1 4.1Å; A22-L62 HydrophobicContact CB-CD2 4.19Å; A22-L62 HydrophobicContact CB-CG 4.37Å
23	I	91.7	Very high	88	Confident	3 Å²	3	60 Å²	60	2%	0.015	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	145.4	166.3	-55.8	176	0	0	0	108.3	C25 G26 H27 F29 L34 F38 C46 V53	I23-C25 HydrophobicContact CG2-CB 4.44Å; I23-C25 VanDerWaalsContact CG2-SG 3.58Å; I23-C25 PolarHBondContact O-N 3.44Å; I23-G26 PolarHBondContact O-N 3.38Å; I23-H27 PolarHBondContact N-O 3.44Å; I23-F29 HydrophobicContact CD1-CD2 4.01Å; I23-F29 HydrophobicContact CD1-CE2 3.52Å; I23-F29 HydrophobicContact CD1-CZ 4.48Å; I23-F29 HydrophobicContact CG1-CD2 4.3Å; I23-F29 HydrophobicContact CG1-CE2 4.14Å; I23-L34 HydrophobicContact CD1-CD1 3.77Å; I23-L34 HydrophobicContact CD1-CD2 4.44Å; I23-L34 HydrophobicContact CG1-CD1 4.23Å; I23-L34 HydrophobicContact CG1-CD2 3.98Å; I23-F38 HydrophobicContact CD1-CZ 4.21Å; I23-C46 HydrophobicContact CD1-CB 3.82Å; I23-V53 HydrophobicContact CD1-CG2 4.27Å; I23-V53 HydrophobicContact CG2-CB 4.33Å; I23-V53 HydrophobicContact CG2-CG1 3.85Å; I23-V53 HydrophobicContact CG2-CG2 3.51Å
24	H	87.7	Confident	88.2	Confident	100 Å²	100	53.6 Å²	53.6	46%	0.463	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.1	-11.9	174.2	72	-76.4	0	0	0	116.8	G26 Q52 H57	H24-G26 VanDerWaalsContact C-N 3.3Å; H24-Q52 PolarHBondContact CE1-O 3.25Å; H24-Q52 VanDerWaalsContact CE1-O 3.23Å; H24-H57 HydrophobicContact CB-CB 3.9Å; H24-H57 PolarHBondContact N-O 2.91Å
25	C	91.1	Very high	88.3	Confident	28 Å²	28	55 Å²	55	19%	0.189	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	0.8	171	68	0	0	0	0	114.3	I23 H27 C49 K51	I23-C25 HydrophobicContact CG2-CB 4.44Å; I23-C25 VanDerWaalsContact CG2-SG 3.58Å; I23-C25 PolarHBondContact O-N 3.44Å; C25-H27 PolarHBondContact SG-ND1 2.91Å; C25-C49 VanDerWaalsContact SG-SG 3.7Å; C25-K51 HydrophobicContact CB-CB 4.45Å; C25-K51 HydrophobicContact CB-CD 3.96Å
26	G	86.7	Confident	89	Confident	63 Å²	63	58 Å²	58	65%	0.649	30%	0.301	S	S	*	.	S	Bend	trans	90.5	-0.3	178.9	0	0	0	0	0	116.3	I23 H24	I23-G26 PolarHBondContact O-N 3.38Å; H24-G26 VanDerWaalsContact C-N 3.3Å
27	H	92	Very high	89.8	Confident	46 Å²	46	54.7 Å²	54.7	21%	0.213	28%	0.281	C	S	.	.			trans	-91.4	137.8	-178.3	-65.9	109	0	0	0	111.7	I23 C25 F29 Q48 C49	I23-H27 PolarHBondContact N-O 3.44Å; C25-H27 PolarHBondContact SG-ND1 2.91Å; H27-F29 HydrophobicContact CB-CE2 3.66Å; H27-F29 HydrophobicContact CB-CZ 3.88Å; H27-Q48 PolarHBondContact CD2-NE2 2.98Å; H27-Q48 VanDerWaalsContact CD2-NE2 3.32Å; H27-Q48 PolarHBondContact CD2-OE1 3.39Å; H27-Q48 PolarHBondContact NE2-NE2 3.22Å; H27-C49 PolarHBondContact ND1-SG 3.47Å
28	T	92.6	Very high	90.4	Very high	43 Å²	43	48.5 Å²	48.5	26%	0.264	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	146.4	-176	50.9	0	0	0	0	113.3	V20 S21 A22 L62	V20-T28 HydrophobicContact CG1-CG2 4.5Å; S21-T28 CarbonylContact O-C 3.6Å; S21-T28 WeakPolarHBondContact O-CA 3.38Å; A22-T28 HydrophobicContact CB-CG2 4.12Å; T28-L62 HydrophobicContact CG2-CD1 3.8Å
29	F	92.3	Very high	90.6	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	161.5	-175.7	-54	-85.2	0	0	0	109.8	T8 I9 V20 S21 I23 H27 L34 P47 Q48	T8-F29 VanDerWaalsContact OG1-CE1 3.23Å; T8-F29 WeakPolarHBondContact OG1-CE1 3.4Å; I9-F29 HydrophobicContact CD1-CB 4.09Å; I9-F29 HydrophobicContact CD1-CD1 3.46Å; I9-F29 VanDerWaalsContact CD1-CD1 3.46Å; I9-F29 HydrophobicContact CD1-CE1 4.13Å; I9-F29 HydrophobicContact CD1-CG 3.93Å; I9-F29 HydrophobicContact CG1-CD1 3.6Å; I9-F29 HydrophobicContact CG1-CE1 3.98Å; V20-F29 CarbonylContact C-O 3.46Å; S21-F29 PolarHBondContact N-O 3.11Å; S21-F29 PolarHBondContact O-N 2.88Å; I23-F29 HydrophobicContact CD1-CD2 4.01Å; I23-F29 HydrophobicContact CD1-CE2 3.52Å; I23-F29 HydrophobicContact CD1-CZ 4.48Å; I23-F29 HydrophobicContact CG1-CD2 4.3Å; I23-F29 HydrophobicContact CG1-CE2 4.14Å; H27-F29 HydrophobicContact CB-CE2 3.66Å; H27-F29 HydrophobicContact CB-CZ 3.88Å; F29-L34 HydrophobicContact CB-CB 4.04Å; F29-L34 HydrophobicContact CD2-CD1 4.03Å; F29-L34 HydrophobicContact CD2-CD2 4.38Å; F29-L34 HydrophobicContact CG-CD1 4.4Å; F29-P47 HydrophobicContact CD1-CG 4.23Å; F29-P47 HydrophobicContact CE1-CB 3.81Å; F29-P47 HydrophobicContact CE1-CG 3.62Å; F29-P47 HydrophobicContact CE2-CG 4.26Å; F29-P47 HydrophobicContact CZ-CB 3.98Å; F29-P47 HydrophobicContact CZ-CG 3.65Å; F29-Q48 HydrophobicContact CZ-CB 4.17Å
30	H	92.5	Very high	90.4	Very high	3 Å²	3	54 Å²	54	1%	0.014	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	141.4	164.4	-64.6	123	0	0	0	109.6	C7 C10 F14 D19 E32 C33 L34	C7-H30 WeakPolarHBondContact CB-ND1 3.44Å; C7-H30 PolarHBondContact SG-N 3Å; C7-H30 VanDerWaalsContact SG-N 3.41Å; C10-H30 PolarHBondContact SG-ND1 2.97Å; F14-H30 AromaticContact CD1-CD2 3.72Å; F14-H30 AromaticContact CD1-NE2 3.47Å; F14-H30 WeakPolarHBondContact CD1-NE2 3.38Å; D19-H30 CarbonylContact O-C 2.82Å; D19-H30 WeakPolarHBondContact O-CA 3.3Å; H30-E32 VanDerWaalsContact C-N 3.3Å; H30-E32 PolarHBondContact O-N 3.05Å; H30-C33 HydrophobicContact CB-CB 4.12Å; H30-C33 PolarHBondContact O-N 3.31Å; H30-L34 WeakPolarHBondContact O-CB 3.44Å; H30-L34 PolarHBondContact O-N 2.74Å
31	Y	91.6	Very high	90	Very high	82 Å²	82	54.8 Å²	54.8	32%	0.322	29%	0.29	S	S	.	.	H	α-helix	trans	-56.2	-45.3	-179.2	177.3	-113.4	0	0	0	111.7	D19 S21 L34 L35 N60	D19-Y31 PolarHBondContact O-N 3.32Å; S21-Y31 WeakPolarHBondContact OG-CA 3.45Å; S21-Y31 VanDerWaalsContact OG-CB 3.29Å; S21-Y31 WeakPolarHBondContact OG-CB 3.27Å; S21-Y31 WeakPolarHBondContact OG-CD2 3.22Å; Y31-L34 PolarHBondContact O-N 3.07Å; Y31-L35 HydrophobicContact CE1-CD2 4.32Å; Y31-L35 WeakPolarHBondContact O-CB 3.45Å; Y31-L35 PolarHBondContact O-N 3.07Å; Y31-N60 HydrophobicContact CD2-CB 3.98Å; Y31-N60 HydrophobicContact CE2-CB 3.81Å
32	E	91.8	Very high	89.3	Confident	144 Å²	144	61.3 Å²	61.3	67%	0.673	33%	0.332	S	S	*	.	H	α-helix	trans	-62.4	-47.9	178	-58.8	-172.3	154.9	0	0	112	H30 L34 L35 Q36	H30-E32 VanDerWaalsContact C-N 3.3Å; H30-E32 PolarHBondContact O-N 3.05Å; E32-L34 VanDerWaalsContact C-N 3.33Å; E32-L34 PolarHBondContact O-N 2.78Å; E32-L35 PolarHBondContact O-N 3.25Å; E32-Q36 WeakPolarHBondContact O-CB 3.47Å; E32-Q36 PolarHBondContact O-N 3.44Å
33	C	92.1	Very high	88.9	Confident	22 Å²	22	64.7 Å²	64.7	15%	0.149	35%	0.351	C	S	.	.	H	α-helix	trans	-61.3	-41.1	177.6	-61.1	0	0	0	0	112	I9 H30 W37	I9-C33 HydrophobicContact CB-CB 4.01Å; I9-C33 HydrophobicContact CD1-CB 3.88Å; I9-C33 HydrophobicContact CG2-CB 3.94Å; H30-C33 HydrophobicContact CB-CB 4.12Å; H30-C33 PolarHBondContact O-N 3.31Å; C33-W37 WeakPolarHBondContact O-CB 3.47Å; C33-W37 PolarHBondContact O-N 3.3Å
34	L	90.5	Very high	88.6	Confident	4 Å²	4	69 Å²	69	2%	0.021	37%	0.37	C	S	.	.	H	α-helix	trans	-69.6	-39.3	178.1	-176.7	59.3	0	0	0	112.1	I23 F29 H30 Y31 E32 W37 F38 I58	I23-L34 HydrophobicContact CD1-CD1 3.77Å; I23-L34 HydrophobicContact CD1-CD2 4.44Å; I23-L34 HydrophobicContact CG1-CD1 4.23Å; I23-L34 HydrophobicContact CG1-CD2 3.98Å; F29-L34 HydrophobicContact CB-CB 4.04Å; F29-L34 HydrophobicContact CD2-CD1 4.03Å; F29-L34 HydrophobicContact CD2-CD2 4.38Å; F29-L34 HydrophobicContact CG-CD1 4.4Å; H30-L34 WeakPolarHBondContact O-CB 3.44Å; H30-L34 PolarHBondContact O-N 2.74Å; Y31-L34 PolarHBondContact O-N 3.07Å; E32-L34 VanDerWaalsContact C-N 3.33Å; E32-L34 PolarHBondContact O-N 2.78Å; L34-W37 PolarHBondContact O-N 3.32Å; L34-F38 HydrophobicContact CD1-CD2 4.13Å; L34-F38 HydrophobicContact CD1-CE1 4.35Å; L34-F38 HydrophobicContact CD1-CE2 3.47Å; L34-F38 VanDerWaalsContact CD1-CE2 3.47Å; L34-F38 HydrophobicContact CD1-CZ 3.61Å; L34-F38 HydrophobicContact CD2-CE2 4.14Å; L34-F38 HydrophobicContact CG-CD2 4.08Å; L34-F38 HydrophobicContact CG-CE2 3.6Å; L34-F38 HydrophobicContact CG-CZ 4.25Å; L34-F38 VanDerWaalsContact O-CD2 3.32Å; L34-F38 WeakPolarHBondContact O-CD2 3.32Å; L34-F38 PolarHBondContact O-N 3.43Å; L34-I58 HydrophobicContact CD2-CG2 4.09Å
35	L	89	Confident	88.7	Confident	72 Å²	72	65.6 Å²	65.6	38%	0.377	36%	0.356	S	S	.	.	H	α-helix	trans	-63.9	-47.7	175.6	-179.5	62.3	0	0	0	110.7	Y31 E32 W37 F38 Q39	Y31-L35 HydrophobicContact CE1-CD2 4.32Å; Y31-L35 WeakPolarHBondContact O-CB 3.45Å; Y31-L35 PolarHBondContact O-N 3.07Å; E32-L35 PolarHBondContact O-N 3.25Å; L35-W37 PolarHBondContact O-N 3.45Å; L35-F38 PolarHBondContact O-N 3.45Å; L35-Q39 WeakPolarHBondContact O-CG 3.36Å; L35-Q39 PolarHBondContact O-N 3.47Å; L35-Q39 VanDerWaalsContact O-N 3.1Å
36	Q	91	Very high	88.8	Confident	125 Å²	125	64.3 Å²	64.3	58%	0.584	35%	0.347	S	S	*	.	H	α-helix	trans	-60.1	-44.7	175.4	-173.6	178.9	-3.6	0	0	111.2	E32 F38 Q39 T40	E32-Q36 WeakPolarHBondContact O-CB 3.47Å; E32-Q36 PolarHBondContact O-N 3.44Å; Q36-F38 VanDerWaalsContact C-N 3.34Å; Q36-F38 PolarHBondContact O-N 3.48Å; Q36-Q39 WeakPolarHBondContact O-CB 3.38Å; Q36-Q39 PolarHBondContact O-N 3.39Å; Q36-T40 PolarHBondContact O-N 3.42Å; Q36-T40 PolarHBondContact O-OG1 2.89Å
37	W	90.6	Very high	88.9	Confident	98 Å²	98	62.7 Å²	62.7	37%	0.371	33%	0.325	S	S	.	.	H	α-helix	trans	-56.2	-45	175.5	-179.2	-95	0	0	0	112.5	I9 C33 L34 L35 Q39 T40 A41 T45 P47	I9-W37 HydrophobicContact CD1-CB 4.22Å; C33-W37 WeakPolarHBondContact O-CB 3.47Å; C33-W37 PolarHBondContact O-N 3.3Å; L34-W37 PolarHBondContact O-N 3.32Å; L35-W37 PolarHBondContact O-N 3.45Å; W37-Q39 VanDerWaalsContact C-N 3.28Å; W37-Q39 PolarHBondContact O-N 2.92Å; W37-T40 PolarHBondContact O-N 3.19Å; W37-A41 WeakPolarHBondContact O-CB 3.47Å; W37-A41 PolarHBondContact O-N 2.96Å; W37-T45 PolarHBondContact NE1-O 3.37Å; W37-P47 HydrophobicContact CD2-CB 4.25Å; W37-P47 HydrophobicContact CD2-CG 3.98Å; W37-P47 HydrophobicContact CG-CG 3.88Å; W37-P47 HydrophobicContact CZ2-CB 4.12Å
38	F	88.9	Confident	88.7	Confident	23 Å²	23	65.5 Å²	65.5	10%	0.101	34%	0.339	C	S	.	.	H	α-helix	trans	-73.4	-12.7	176.7	-68.1	-38.2	0	0	0	115.1	I23 L34 L35 Q36 K44 V53 I58	I23-F38 HydrophobicContact CD1-CZ 4.21Å; L34-F38 HydrophobicContact CD1-CD2 4.13Å; L34-F38 HydrophobicContact CD1-CE1 4.35Å; L34-F38 HydrophobicContact CD1-CE2 3.47Å; L34-F38 VanDerWaalsContact CD1-CE2 3.47Å; L34-F38 HydrophobicContact CD1-CZ 3.61Å; L34-F38 HydrophobicContact CD2-CE2 4.14Å; L34-F38 HydrophobicContact CG-CD2 4.08Å; L34-F38 HydrophobicContact CG-CE2 3.6Å; L34-F38 HydrophobicContact CG-CZ 4.25Å; L34-F38 VanDerWaalsContact O-CD2 3.32Å; L34-F38 WeakPolarHBondContact O-CD2 3.32Å; L34-F38 PolarHBondContact O-N 3.43Å; L35-F38 PolarHBondContact O-N 3.45Å; Q36-F38 VanDerWaalsContact C-N 3.34Å; Q36-F38 PolarHBondContact O-N 3.48Å; F38-K44 HydrophobicContact CB-CG 4.33Å; F38-K44 HydrophobicContact CD1-CB 3.89Å; F38-K44 HydrophobicContact CD1-CG 3.98Å; F38-K44 HydrophobicContact CE1-CB 4.09Å; F38-K44 HydrophobicContact CG-CG 4.29Å; F38-V53 HydrophobicContact CE1-CB 4.13Å; F38-V53 HydrophobicContact CE1-CG2 4.23Å; F38-V53 HydrophobicContact CE2-CG1 4.32Å; F38-V53 HydrophobicContact CZ-CB 3.83Å; F38-V53 HydrophobicContact CZ-CG1 3.77Å; F38-V53 HydrophobicContact CZ-CG2 3.98Å; F38-I58 HydrophobicContact CD2-CD1 4.17Å; F38-I58 HydrophobicContact CE2-CD1 3.55Å; F38-I58 HydrophobicContact CE2-CG1 4.45Å; F38-I58 HydrophobicContact CZ-CD1 4.39Å
39	Q	86.9	Confident	88.7	Confident	145 Å²	145	65.7 Å²	65.7	68%	0.678	34%	0.341	S	S	*	.	H	α-helix	trans	-86.3	-36.2	170.8	-70.5	171.8	6.6	0	0	111.7	L35 Q36 W37	L35-Q39 WeakPolarHBondContact O-CG 3.36Å; L35-Q39 PolarHBondContact O-N 3.47Å; L35-Q39 VanDerWaalsContact O-N 3.1Å; Q36-Q39 WeakPolarHBondContact O-CB 3.38Å; Q36-Q39 PolarHBondContact O-N 3.39Å; W37-Q39 VanDerWaalsContact C-N 3.28Å; W37-Q39 PolarHBondContact O-N 2.92Å
40	T	84.8	Confident	88.6	Confident	113 Å²	113	75.6 Å²	75.6	69%	0.693	38%	0.379	S	S	*	.	H	α-helix	trans	-86	-31	-178.9	-48.3	0	0	0	0	113.3	Q36 W37	Q36-T40 PolarHBondContact O-N 3.42Å; Q36-T40 PolarHBondContact O-OG1 2.89Å; W37-T40 PolarHBondContact O-N 3.19Å
41	A	82.3	Confident	88.4	Confident	24 Å²	24	81.7 Å²	81.7	20%	0.198	41%	0.405	C	S	.	.	S	Bend	trans	-79.9	134	-177.7	0	0	0	0	0	112.6	W37 T43	W37-A41 WeakPolarHBondContact O-CB 3.47Å; W37-A41 PolarHBondContact O-N 2.96Å; A41-T43 PolarHBondContact O-N 3.13Å
42	P	77.6	Confident	88.2	Confident	136 Å²	136	85.5 Å²	85.5	88%	0.883	43%	0.426	S	S	*	.	S	Bend	trans	-68.5	-16.2	-179.5	27.8	-35.6	0	0	0	113.7
43	T	82.5	Confident	88	Confident	85 Å²	85	79 Å²	79	52%	0.521	40%	0.396	S	S	.	.	S	Bend	trans	-133.9	136.7	170.6	59.3	0	0	0	0	110.2	A41 T45	A41-T43 PolarHBondContact O-N 3.13Å; T43-T45 PolarHBondContact O-N 3.16Å; T43-T45 PolarHBondContact O-OG1 3.33Å
44	K	86.3	Confident	87.5	Confident	93 Å²	93	79.9 Å²	79.9	40%	0.404	40%	0.402	S	S	.	.			trans	-71.4	94.7	176.2	-64.4	-170.5	-179.9	-172.9	0	109.5	F38 V53	F38-K44 HydrophobicContact CB-CG 4.33Å; F38-K44 HydrophobicContact CD1-CB 3.89Å; F38-K44 HydrophobicContact CD1-CG 3.98Å; F38-K44 HydrophobicContact CE1-CB 4.09Å; F38-K44 HydrophobicContact CG-CG 4.29Å; K44-V53 WeakPolarHBondContact CB-O 3.19Å; K44-V53 PolarHBondContact O-N 2.92Å
45	T	90.8	Very high	86.8	Confident	29 Å²	29	84 Å²	84	18%	0.178	43%	0.428	C	S	.	.	B	Isolated β-bridge	trans	-131.3	146.9	180	53.6	0	0	0	0	109.8	W37 T43 R50 K51	W37-T45 PolarHBondContact NE1-O 3.37Å; T43-T45 PolarHBondContact O-N 3.16Å; T43-T45 PolarHBondContact O-OG1 3.33Å; T45-R50 WeakPolarHBondContact CB-O 3.39Å; T45-R50 WeakPolarHBondContact CG2-O 3.45Å; T45-K51 WeakPolarHBondContact CA-O 3.39Å
46	C	91.3	Very high	86.4	Confident	0 Å²	0	90.5 Å²	90.5	0%	0	45%	0.448	C	S	.	.			trans	-59.8	127.1	177.5	172.1	0	0	0	0	110.4	I23 Q48 R50 K51 V53	I23-C46 HydrophobicContact CD1-CB 3.82Å; C46-Q48 PolarHBondContact O-N 2.71Å; C46-Q48 VanDerWaalsContact O-N 3.15Å; C46-Q48 PolarHBondContact SG-N 2.95Å; C46-R50 WeakPolarHBondContact O-CA 3.27Å; C46-R50 PolarHBondContact O-N 3.12Å; C46-K51 PolarHBondContact N-O 3.22Å; C46-V53 HydrophobicContact CB-CG2 4.29Å
47	P	89.4	Confident	85.8	Confident	29 Å²	29	89.6 Å²	89.6	19%	0.188	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-38.3	179.2	-21	24.1	0	0	0	113.5	I9 F29 W37	I9-P47 HydrophobicContact CD1-CG 3.85Å; I9-P47 HydrophobicContact CG1-CB 4.18Å; I9-P47 HydrophobicContact CG1-CG 3.98Å; F29-P47 HydrophobicContact CD1-CG 4.23Å; F29-P47 HydrophobicContact CE1-CB 3.81Å; F29-P47 HydrophobicContact CE1-CG 3.62Å; F29-P47 HydrophobicContact CE2-CG 4.26Å; F29-P47 HydrophobicContact CZ-CB 3.98Å; F29-P47 HydrophobicContact CZ-CG 3.65Å; W37-P47 HydrophobicContact CD2-CB 4.25Å; W37-P47 HydrophobicContact CD2-CG 3.98Å; W37-P47 HydrophobicContact CG-CG 3.88Å; W37-P47 HydrophobicContact CZ2-CB 4.12Å
48	Q	89.1	Confident	85.6	Confident	105 Å²	105	86.3 Å²	86.3	49%	0.491	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-37.4	-171.6	-173.3	163	-21	0	0	114.2	T8 H27 F29 C46	T8-Q48 PolarHBondContact OG1-OE1 3.09Å; H27-Q48 PolarHBondContact CD2-NE2 2.98Å; H27-Q48 VanDerWaalsContact CD2-NE2 3.32Å; H27-Q48 PolarHBondContact CD2-OE1 3.39Å; H27-Q48 PolarHBondContact NE2-NE2 3.22Å; F29-Q48 HydrophobicContact CZ-CB 4.17Å; C46-Q48 PolarHBondContact O-N 2.71Å; C46-Q48 VanDerWaalsContact O-N 3.15Å; C46-Q48 PolarHBondContact SG-N 2.95Å
49	C	91.6	Very high	85.7	Confident	48 Å²	48	89.8 Å²	89.8	32%	0.324	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.8	6.4	-174.8	77.2	0	0	0	0	115.1	C25 H27 K51	C25-C49 VanDerWaalsContact SG-SG 3.7Å; H27-C49 PolarHBondContact ND1-SG 3.47Å; C49-K51 PolarHBondContact O-N 2.84Å
50	R	89.2	Confident	85.7	Confident	207 Å²	207	86.8 Å²	86.8	78%	0.781	44%	0.44	S	S	*	.			trans	55	5.6	175.6	-56.8	-173.7	-179.1	-168.4	0.2	117.5	T45 C46 Q52	T45-R50 WeakPolarHBondContact CB-O 3.39Å; T45-R50 WeakPolarHBondContact CG2-O 3.45Å; C46-R50 WeakPolarHBondContact O-CA 3.27Å; C46-R50 PolarHBondContact O-N 3.12Å; R50-Q52 PolarHBondContact O-N 3.28Å
51	K	88.8	Confident	85.9	Confident	131 Å²	131	85.7 Å²	85.7	57%	0.57	43%	0.426	S	S	*	.			trans	-56.7	137	169.9	-70.5	-175.1	178.8	-177.4	0	109.9	C25 T45 C46 C49 V53	C25-K51 HydrophobicContact CB-CB 4.45Å; C25-K51 HydrophobicContact CB-CD 3.96Å; T45-K51 WeakPolarHBondContact CA-O 3.39Å; C46-K51 PolarHBondContact N-O 3.22Å; C49-K51 PolarHBondContact O-N 2.84Å; K51-V53 WeakPolarHBondContact O-CG2 3.33Å
52	Q	87.6	Confident	86	Confident	162 Å²	162	86.6 Å²	86.6	76%	0.757	43%	0.427	S	S	*	.	B	Isolated β-bridge	trans	-66.7	136.3	-178.2	-168.1	178.6	19.7	0	0	111.1	H24 R50	H24-Q52 PolarHBondContact CE1-O 3.25Å; H24-Q52 VanDerWaalsContact CE1-O 3.23Å; R50-Q52 PolarHBondContact O-N 3.28Å
53	V	87.3	Confident	86.3	Confident	8 Å²	8	88.2 Å²	88.2	5%	0.048	42%	0.42	C	S	.	.			trans	-116.7	122.5	-173.4	-172.4	0	0	0	0	110.6	I23 F38 K44 C46 K51 I58	I23-V53 HydrophobicContact CD1-CG2 4.27Å; I23-V53 HydrophobicContact CG2-CB 4.33Å; I23-V53 HydrophobicContact CG2-CG1 3.85Å; I23-V53 HydrophobicContact CG2-CG2 3.51Å; F38-V53 HydrophobicContact CE1-CB 4.13Å; F38-V53 HydrophobicContact CE1-CG2 4.23Å; F38-V53 HydrophobicContact CE2-CG1 4.32Å; F38-V53 HydrophobicContact CZ-CB 3.83Å; F38-V53 HydrophobicContact CZ-CG1 3.77Å; F38-V53 HydrophobicContact CZ-CG2 3.98Å; K44-V53 WeakPolarHBondContact CB-O 3.19Å; K44-V53 PolarHBondContact O-N 2.92Å; C46-V53 HydrophobicContact CB-CG2 4.29Å; K51-V53 WeakPolarHBondContact O-CG2 3.33Å; V53-I58 HydrophobicContact CG1-CD1 4Å; V53-I58 HydrophobicContact CG1-CG1 3.7Å
54	S	82.3	Confident	86	Confident	40 Å²	40	89.5 Å²	89.5	28%	0.28	42%	0.419	S	S	.	.			trans	-90.9	136.8	167.3	-159.7	0	0	0	0	109.5	R56 H57	S54-R56 PolarHBondContact O-N 2.99Å; S54-R56 WeakPolarHBondContact OG-CG 3.47Å; S54-R56 PolarHBondContact OG-NE 3.34Å; S54-H57 PolarHBondContact O-N 3.23Å
55	T	76.6	Confident	85.2	Confident	92 Å²	92	93 Å²	93	56%	0.564	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-54	-31.2	-178.4	-40.5	0	0	0	0	113	H57	T55-H57 PolarHBondContact O-N 3.01Å
56	R	79.3	Confident	83.9	Confident	208 Å²	208	96.6 Å²	96.6	79%	0.785	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-73.8	-3.9	178.5	48.7	-175.1	170.2	-137	1.2	115	S54	S54-R56 PolarHBondContact O-N 2.99Å; S54-R56 WeakPolarHBondContact OG-CG 3.47Å; S54-R56 PolarHBondContact OG-NE 3.34Å
57	H	79.8	Confident	82	Confident	105 Å²	105	99.7 Å²	99.7	49%	0.486	49%	0.491	S	S	.	.	G	3₁₀ helix	trans	-124.4	36.7	177	-47.9	142.5	0	0	0	111.7	H24 S54 T55	H24-H57 HydrophobicContact CB-CB 3.9Å; H24-H57 PolarHBondContact N-O 2.91Å; S54-H57 PolarHBondContact O-N 3.23Å; T55-H57 PolarHBondContact O-N 3.01Å
58	I	86.3	Confident	80.3	Confident	29 Å²	29	102.2 Å²	102.2	15%	0.149	52%	0.522	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	131.2	170.3	-56.6	166.9	0	0	0	107.1	L34 F38 V53	L34-I58 HydrophobicContact CD2-CG2 4.09Å; F38-I58 HydrophobicContact CD2-CD1 4.17Å; F38-I58 HydrophobicContact CE2-CD1 3.55Å; F38-I58 HydrophobicContact CE2-CG1 4.45Å; F38-I58 HydrophobicContact CZ-CD1 4.39Å; V53-I58 HydrophobicContact CG1-CD1 4Å; V53-I58 HydrophobicContact CG1-CG1 3.7Å
59	I	89.6	Confident	78.2	Confident	97 Å²	97	100.6 Å²	100.6	50%	0.497	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	105.3	169.1	-55.7	173	0	0	0	105.9	S21 A22 K61 L62	S21-I59 CarbonylContact C-O 3.4Å; S21-I59 WeakPolarHBondContact CA-O 3.44Å; S21-I59 VanDerWaalsContact CB-O 3.31Å; S21-I59 WeakPolarHBondContact CB-O 3.46Å; A22-I59 HydrophobicContact CB-CB 4.42Å; A22-I59 PolarHBondContact N-O 2.86Å; A22-I59 PolarHBondContact O-N 3.24Å; I59-K61 PolarHBondContact O-N 3.43Å; I59-L62 HydrophobicContact CB-CD2 4.37Å; I59-L62 HydrophobicContact CG2-CD2 3.82Å
60	N	87.3	Confident	76.3	Confident	82 Å²	82	101.6 Å²	101.6	44%	0.439	55%	0.552	S	S	.	*	S	Bend	trans	-66.4	-36.2	-171	-65.9	-17.1	0	0	0	113	S21 Y31	S21-N60 WeakPolarHBondContact CB-O 3.37Å; S21-N60 PolarHBondContact OG-O 3.42Å; Y31-N60 HydrophobicContact CD2-CB 3.98Å; Y31-N60 HydrophobicContact CE2-CB 3.81Å
61	K	88.3	Confident	74.4	Confident	90 Å²	90	101.1 Å²	101.1	39%	0.391	56%	0.559	S	S	.	*			trans	-135.1	121.6	178.9	-173.6	169.2	-175.2	147.1	0	110.1	D19 V20 I59 F63	D19-K61 HydrophobicContact CB-CG 4.39Å; D19-K61 VanDerWaalsContact OD1-CD 3.32Å; D19-K61 WeakPolarHBondContact OD1-CD 3.42Å; D19-K61 WeakPolarHBondContact OD1-CE 3.29Å; D19-K61 IonicContact OD1-NZ 2.67Å; D19-K61 PolarHBondContact OD1-NZ 2.93Å; D19-K61 IonicContact OD2-NZ 2.63Å; V20-K61 CarbonylContact O-C 3.6Å; V20-K61 WeakPolarHBondContact O-CA 3.03Å; I59-K61 PolarHBondContact O-N 3.43Å; K61-F63 HydrophobicContact CB-CE2 4.37Å; K61-F63 HydrophobicContact CD-CE1 3.96Å; K61-F63 HydrophobicContact CD-CE2 4.12Å; K61-F63 HydrophobicContact CD-CZ 3.58Å; K61-F63 HydrophobicContact CG-CD2 4.47Å; K61-F63 HydrophobicContact CG-CE1 4.39Å; K61-F63 HydrophobicContact CG-CE2 3.99Å; K61-F63 HydrophobicContact CG-CZ 3.95Å
62	L	86.3	Confident	72.6	Confident	43 Å²	43	103.6 Å²	103.6	23%	0.225	57%	0.572	C	S	.	*			trans	-89.2	133.9	166.8	-64.3	179.5	0	0	0	108.8	V20 A22 T28 I59 F64	V20-L62 HydrophobicContact CG1-CD1 4.21Å; V20-L62 PolarHBondContact O-N 2.97Å; A22-L62 HydrophobicContact CB-CD1 4.1Å; A22-L62 HydrophobicContact CB-CD2 4.19Å; A22-L62 HydrophobicContact CB-CG 4.37Å; T28-L62 HydrophobicContact CG2-CD1 3.8Å; I59-L62 HydrophobicContact CB-CD2 4.37Å; I59-L62 HydrophobicContact CG2-CD2 3.82Å; L62-F64 HydrophobicContact CB-CE2 3.98Å; L62-F64 HydrophobicContact CB-CZ 3.93Å; L62-F64 HydrophobicContact CD1-CE1 4.2Å; L62-F64 HydrophobicContact CD1-CE2 4.4Å; L62-F64 HydrophobicContact CD1-CZ 3.65Å; L62-F64 HydrophobicContact CG-CZ 4.48Å
63	F	82.1	Confident	71	Confident	170 Å²	170	99.2 Å²	99.2	75%	0.746	57%	0.57	S	S	*	*			trans	-104	114.1	168.5	-63	-90	0	0	0	107.1	K61	K61-F63 HydrophobicContact CB-CE2 4.37Å; K61-F63 HydrophobicContact CD-CE1 3.96Å; K61-F63 HydrophobicContact CD-CE2 4.12Å; K61-F63 HydrophobicContact CD-CZ 3.58Å; K61-F63 HydrophobicContact CG-CD2 4.47Å; K61-F63 HydrophobicContact CG-CE1 4.39Å; K61-F63 HydrophobicContact CG-CE2 3.99Å; K61-F63 HydrophobicContact CG-CZ 3.95Å
64	F	77.2	Confident	69.3	Low	111 Å²	111	103.7 Å²	103.7	49%	0.487	60%	0.602	S	S	.	*			trans	-89.5	112.5	175	-61.1	-77.1	0	0	0	108.3	V20 L62 I66	V20-F64 HydrophobicContact CB-CE2 4.04Å; V20-F64 HydrophobicContact CG1-CE2 4.25Å; V20-F64 HydrophobicContact CG1-CZ 4.32Å; V20-F64 HydrophobicContact CG2-CE2 4.11Å; L62-F64 HydrophobicContact CB-CE2 3.98Å; L62-F64 HydrophobicContact CB-CZ 3.93Å; L62-F64 HydrophobicContact CD1-CE1 4.2Å; L62-F64 HydrophobicContact CD1-CE2 4.4Å; L62-F64 HydrophobicContact CD1-CZ 3.65Å; L62-F64 HydrophobicContact CG-CZ 4.48Å; F64-I66 HydrophobicContact CB-CD1 4.33Å; F64-I66 HydrophobicContact CB-CG1 3.88Å; F64-I66 PolarHBondContact O-N 2.96Å
65	D	69.3	Low	68.2	Low	166 Å²	166	106 Å²	106	89%	0.888	62%	0.616	S	S	*	*			trans	-77.1	74	171.7	-155.5	0.5	0	0	0	108.4	G67	D65-G67 VanDerWaalsContact C-N 3.28Å; D65-G67 PolarHBondContact O-N 3.35Å
66	I	64	Low	68.1	Low	106 Å²	106	105.5 Å²	105.5	54%	0.544	61%	0.61	S	S	.	*			trans	-72.2	90.4	176.3	-56.6	177.3	0	0	0	106.2	F64 G68	F64-I66 HydrophobicContact CB-CD1 4.33Å; F64-I66 HydrophobicContact CB-CG1 3.88Å; F64-I66 PolarHBondContact O-N 2.96Å; I66-G68 PolarHBondContact O-N 2.75Å
67	G	50.2	Low	68.2	Low	65 Å²	65	100.4 Å²	100.4	67%	0.67	60%	0.604	S	S	*	*			trans	-46.6	114.9	180	0	0	0	0	0	110.7	D65 G69	D65-G67 VanDerWaalsContact C-N 3.28Å; D65-G67 PolarHBondContact O-N 3.35Å; G67-G69 PolarHBondContact O-N 2.92Å
68	G	54.3	Low	68.5	Low	82 Å²	82	101.9 Å²	101.9	85%	0.845	61%	0.611	S	S	*	*			trans	-57.4	99.8	-160.6	0	0	0	0	0	113.7	I66	I66-G68 PolarHBondContact O-N 2.75Å
69	G	45.3	Very low	68.5	Low	71 Å²	71	103.6 Å²	103.6	73%	0.732	63%	0.626	S	S	*	*			trans	-75.8	118.4	158.9	0	0	0	0	0	108.1	G67	G67-G69 PolarHBondContact O-N 2.92Å
70	G	52.3	Low	68.5	Low	69 Å²	69	103.5 Å²	103.5	71%	0.711	63%	0.626	S	S	*	*			trans	-63.2	175.5	171	0	0	0	0	0	112.2
71	E	49.2	Very low	68.7	Low	196 Å²	196	104 Å²	104	92%	0.916	63%	0.626	S	S	*	*			trans	79.5	38.7	-179.3	-49.1	-176.9	171.6	0	0	116.6
72	E	50.3	Low	68.9	Low	183 Å²	183	103.7 Å²	103.7	86%	0.855	63%	0.628	S	S	*	*	S	Bend		-78.8	120.8	129.7	-79.4	-172.9	160.5	0	0	107.1	S74	E72-S74 PolarHBondContact O-N 3.1Å
73	G	53.3	Low	69.2	Low	70 Å²	70	105.4 Å²	105.4	72%	0.722	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-57.4	130.2	-170.7	0	0	0	0	0	111.5	P75	G73-P75 VanDerWaalsContact O-N 3.17Å
74	S	52.5	Low	69.8	Low	103 Å²	103	100.6 Å²	100.6	72%	0.72	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-48.7	125.6	168.7	54.1	0	0	0	0	108.4	E72 D76	E72-S74 PolarHBondContact O-N 3.1Å; S74-D76 PolarHBondContact O-N 3.38Å
75	P	59.2	Low	70.7	Confident	88 Å²	88	98.6 Å²	98.6	57%	0.571	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-55.1	119.3	-178.8	22.2	-33.4	0	0	0	108.1	G73 L80	G73-P75 VanDerWaalsContact O-N 3.17Å; P75-L80 HydrophobicContact CB-CD1 4.28Å; P75-L80 HydrophobicContact CB-CD2 4.13Å; P75-L80 HydrophobicContact CB-CG 4.08Å; P75-L80 HydrophobicContact CG-CD1 4.02Å; P75-L80 HydrophobicContact CG-CD2 4.37Å; P75-L80 HydrophobicContact CG-CG 4.34Å
76	D	74.8	Confident	72	Confident	82 Å²	82	97.8 Å²	97.8	44%	0.439	60%	0.598	S	S	.	*	P	Polyproline II helix	trans	-50.8	129.4	-172.2	157.9	55.8	0	0	0	110	S74 E78 S79 L80	S74-D76 PolarHBondContact O-N 3.38Å; D76-E78 PolarHBondContact O-N 2.97Å; D76-E78 VanDerWaalsContact O-N 3.14Å; D76-E78 PolarHBondContact OD1-N 3.41Å; D76-E78 WeakPolarHBondContact OD2-CB 3.35Å; D76-S79 WeakPolarHBondContact O-CA 3.42Å; D76-S79 VanDerWaalsContact O-CB 3.28Å; D76-S79 WeakPolarHBondContact O-CB 3.37Å; D76-S79 PolarHBondContact O-N 2.88Å; D76-S79 PolarHBondContact OD2-N 3.48Å; D76-L80 PolarHBondContact O-N 3.49Å
77	P	81.3	Confident	73.5	Confident	101 Å²	101	97.3 Å²	97.3	66%	0.656	60%	0.595	S	S	*	*	H	α-helix	trans	-57.6	-29.7	-175.6	20.7	-33.9	0	0	0	112.9	Q81	P77-Q81 VanDerWaalsContact O-CB 3.27Å; P77-Q81 WeakPolarHBondContact O-CB 3.19Å; P77-Q81 PolarHBondContact O-N 3.47Å
78	E	85.1	Confident	75.7	Confident	136 Å²	136	99.4 Å²	99.4	64%	0.636	59%	0.586	S	S	*	*	H	α-helix	trans	-70.7	-40.2	174.3	-175.4	171	-168.4	0	0	111.6	D76 Q81 N82	D76-E78 PolarHBondContact O-N 2.97Å; D76-E78 VanDerWaalsContact O-N 3.14Å; D76-E78 PolarHBondContact OD1-N 3.41Å; D76-E78 WeakPolarHBondContact OD2-CB 3.35Å; E78-Q81 PolarHBondContact O-N 3.47Å; E78-N82 WeakPolarHBondContact O-CB 3.35Å; E78-N82 VanDerWaalsContact O-CG 3.32Å; E78-N82 PolarHBondContact O-N 3.49Å; E78-N82 PolarHBondContact O-ND2 2.7Å
79	S	87.3	Confident	77.7	Confident	65 Å²	65	98.6 Å²	98.6	46%	0.455	57%	0.571	S	S	.	*	H	α-helix	trans	-58.4	-45.5	170.5	-170.8	0	0	0	0	113.2	D76 N82 E83	D76-S79 WeakPolarHBondContact O-CA 3.42Å; D76-S79 VanDerWaalsContact O-CB 3.28Å; D76-S79 WeakPolarHBondContact O-CB 3.37Å; D76-S79 PolarHBondContact O-N 2.88Å; D76-S79 PolarHBondContact OD2-N 3.48Å; S79-N82 PolarHBondContact O-N 2.85Å; S79-E83 PolarHBondContact O-N 3.18Å
80	L	89.4	Confident	80.2	Confident	94 Å²	94	100 Å²	100	49%	0.492	56%	0.561	S	S	.	*	H	α-helix	trans	-65.6	-41.3	175.7	-71	-179.5	0	0	0	112.4	P75 D76 N82 E83 V84	P75-L80 HydrophobicContact CB-CD1 4.28Å; P75-L80 HydrophobicContact CB-CD2 4.13Å; P75-L80 HydrophobicContact CB-CG 4.08Å; P75-L80 HydrophobicContact CG-CD1 4.02Å; P75-L80 HydrophobicContact CG-CD2 4.37Å; P75-L80 HydrophobicContact CG-CG 4.34Å; D76-L80 PolarHBondContact O-N 3.49Å; L80-N82 VanDerWaalsContact C-N 3.35Å; L80-E83 PolarHBondContact O-N 3.03Å; L80-V84 WeakPolarHBondContact O-CG2 3.26Å; L80-V84 PolarHBondContact O-N 3.07Å
81	Q	90.9	Very high	82.3	Confident	94 Å²	94	101.9 Å²	101.9	44%	0.439	55%	0.554	S	S	.	*	H	α-helix	trans	-62.4	-43.3	176.7	-178	59.5	45.1	0	0	111.3	P77 E78 E83 V84 D85	P77-Q81 VanDerWaalsContact O-CB 3.27Å; P77-Q81 WeakPolarHBondContact O-CB 3.19Å; P77-Q81 PolarHBondContact O-N 3.47Å; E78-Q81 PolarHBondContact O-N 3.47Å; Q81-E83 VanDerWaalsContact C-N 3.35Å; Q81-E83 PolarHBondContact O-N 3.15Å; Q81-V84 PolarHBondContact O-N 3.1Å; Q81-D85 VanDerWaalsContact NE2-CG 3.29Å; Q81-D85 PolarHBondContact NE2-OD1 3.22Å; Q81-D85 PolarHBondContact NE2-OD2 2.89Å; Q81-D85 PolarHBondContact O-N 3.33Å
82	N	92	Very high	84.6	Confident	83 Å²	83	96.2 Å²	96.2	44%	0.444	54%	0.536	S	S	.	.	H	α-helix	trans	-60.1	-41.2	174.6	-80.2	-54	0	0	0	112.3	E78 S79 L80 D85 R86	E78-N82 WeakPolarHBondContact O-CB 3.35Å; E78-N82 VanDerWaalsContact O-CG 3.32Å; E78-N82 PolarHBondContact O-N 3.49Å; E78-N82 PolarHBondContact O-ND2 2.7Å; S79-N82 PolarHBondContact O-N 2.85Å; L80-N82 VanDerWaalsContact C-N 3.35Å; N82-D85 PolarHBondContact O-N 3.23Å; N82-R86 WeakPolarHBondContact O-CG 3.47Å; N82-R86 PolarHBondContact O-N 3.45Å
83	E	94.3	Very high	86.8	Confident	79 Å²	79	90 Å²	90	37%	0.369	51%	0.513	S	S	.	.	H	α-helix	trans	-66.9	-42.6	175.6	-175.6	55.6	-152.6	0	0	112.3	S79 L80 Q81 D85 R86 M87	S79-E83 PolarHBondContact O-N 3.18Å; L80-E83 PolarHBondContact O-N 3.03Å; Q81-E83 VanDerWaalsContact C-N 3.35Å; Q81-E83 PolarHBondContact O-N 3.15Å; E83-D85 VanDerWaalsContact C-N 3.3Å; E83-D85 PolarHBondContact O-N 2.95Å; E83-R86 WeakPolarHBondContact O-CB 3.47Å; E83-R86 PolarHBondContact O-N 3.42Å; E83-R86 IonicContact OE2-CZ 3.09Å; E83-R86 IonicContact OE2-NE 3.94Å; E83-R86 PolarHBondContact OE2-NE 3.46Å; E83-R86 IonicContact OE2-NH2 2.83Å; E83-R86 PolarHBondContact OE2-NH2 2.99Å; E83-M87 WeakPolarHBondContact O-CB 3.32Å; E83-M87 WeakPolarHBondContact O-CG 3.38Å; E83-M87 PolarHBondContact O-N 3.32Å
84	V	94.6	Very high	88.9	Confident	69 Å²	69	94.2 Å²	94.2	42%	0.418	51%	0.507	S	S	.	.	H	α-helix	trans	-58.8	-41.8	174.5	164.3	0	0	0	0	111.2	L80 Q81 M87 K88	L80-V84 WeakPolarHBondContact O-CG2 3.26Å; L80-V84 PolarHBondContact O-N 3.07Å; Q81-V84 PolarHBondContact O-N 3.1Å; V84-M87 PolarHBondContact O-N 3.19Å; V84-K88 HydrophobicContact CG1-CD 4.36Å; V84-K88 VanDerWaalsContact CG1-CE 3.42Å; V84-K88 WeakPolarHBondContact O-CG 3.24Å; V84-K88 PolarHBondContact O-N 2.96Å
85	D	95.7	Very high	91.1	Very high	68 Å²	68	93.2 Å²	93.2	36%	0.364	49%	0.493	S	S	.	.	H	α-helix	trans	-75.4	-33.5	179.6	-68.7	-27.1	0	0	0	112.8	Q81 N82 E83 M87 K88 A89	Q81-D85 VanDerWaalsContact NE2-CG 3.29Å; Q81-D85 PolarHBondContact NE2-OD1 3.22Å; Q81-D85 PolarHBondContact NE2-OD2 2.89Å; Q81-D85 PolarHBondContact O-N 3.33Å; N82-D85 PolarHBondContact O-N 3.23Å; E83-D85 VanDerWaalsContact C-N 3.3Å; E83-D85 PolarHBondContact O-N 2.95Å; D85-M87 VanDerWaalsContact C-N 3.34Å; D85-K88 PolarHBondContact O-N 3.32Å; D85-K88 WeakPolarHBondContact OD1-CD 3.43Å; D85-K88 IonicContact OD1-NZ 3.92Å; D85-K88 PolarHBondContact OD1-NZ 3.48Å; D85-A89 WeakPolarHBondContact O-CB 3.37Å; D85-A89 PolarHBondContact O-N 3Å
86	R	95.8	Very high	92.9	Very high	150 Å²	150	94.8 Å²	94.8	57%	0.566	49%	0.488	S	S	*	.	H	α-helix	trans	-56.4	-48.3	165.5	-78	-164.6	-71.7	-121.5	5.6	111.1	N82 E83 A89 L90	N82-R86 WeakPolarHBondContact O-CG 3.47Å; N82-R86 PolarHBondContact O-N 3.45Å; E83-R86 WeakPolarHBondContact O-CB 3.47Å; E83-R86 PolarHBondContact O-N 3.42Å; E83-R86 IonicContact OE2-CZ 3.09Å; E83-R86 IonicContact OE2-NE 3.94Å; E83-R86 PolarHBondContact OE2-NE 3.46Å; E83-R86 IonicContact OE2-NH2 2.83Å; E83-R86 PolarHBondContact OE2-NH2 2.99Å; R86-A89 PolarHBondContact O-N 2.84Å; R86-L90 WeakPolarHBondContact O-CG 3.33Å; R86-L90 PolarHBondContact O-N 2.87Å
87	M	95.4	Very high	94	Very high	95 Å²	95	92.3 Å²	92.3	47%	0.468	48%	0.475	S	S	.	.	H	α-helix	trans	-67.4	-39.1	-178.7	-72.2	-66.4	-84	0	0	112.6	E83 V84 D85 A89 L90 L91	E83-M87 WeakPolarHBondContact O-CB 3.32Å; E83-M87 WeakPolarHBondContact O-CG 3.38Å; E83-M87 PolarHBondContact O-N 3.32Å; V84-M87 PolarHBondContact O-N 3.19Å; D85-M87 VanDerWaalsContact C-N 3.34Å; M87-A89 PolarHBondContact O-N 3.05Å; M87-L90 PolarHBondContact O-N 2.97Å; M87-L90 HydrophobicContact SD-CD1 4.06Å; M87-L91 WeakPolarHBondContact O-CB 3.43Å; M87-L91 WeakPolarHBondContact O-CG 3.1Å; M87-L91 PolarHBondContact O-N 3.38Å
88	K	96.7	Very high	94.8	Very high	110 Å²	110	95.1 Å²	95.1	48%	0.478	47%	0.472	S	S	.	.	H	α-helix	trans	-59.5	-44.3	170.8	-72.3	170.5	-165.1	156	0	112.1	V84 D85 L91 S92	V84-K88 HydrophobicContact CG1-CD 4.36Å; V84-K88 VanDerWaalsContact CG1-CE 3.42Å; V84-K88 WeakPolarHBondContact O-CG 3.24Å; V84-K88 PolarHBondContact O-N 2.96Å; D85-K88 PolarHBondContact O-N 3.32Å; D85-K88 WeakPolarHBondContact OD1-CD 3.43Å; D85-K88 IonicContact OD1-NZ 3.92Å; D85-K88 PolarHBondContact OD1-NZ 3.48Å; K88-L91 PolarHBondContact O-N 3.48Å; K88-S92 WeakPolarHBondContact O-CB 3.29Å; K88-S92 PolarHBondContact O-N 3.17Å
89	A	96.5	Very high	95.4	Very high	65 Å²	65	95.4 Å²	95.4	54%	0.537	47%	0.468	S	S	.	.	H	α-helix	trans	-64.2	-41.3	178.4	0	0	0	0	0	111.8	D85 R86 M87 S93	D85-A89 WeakPolarHBondContact O-CB 3.37Å; D85-A89 PolarHBondContact O-N 3Å; R86-A89 PolarHBondContact O-N 2.84Å; M87-A89 PolarHBondContact O-N 3.05Å; A89-S93 WeakPolarHBondContact O-CB 3.41Å; A89-S93 PolarHBondContact O-N 3.1Å
90	L	97.3	Very high	95.9	Very high	99 Å²	99	97.6 Å²	97.6	52%	0.518	47%	0.471	S	S	.	.	H	α-helix	trans	-62.7	-45.9	174.3	-73.3	171	0	0	0	112.1	R86 M87 S93 R94	R86-L90 WeakPolarHBondContact O-CG 3.33Å; R86-L90 PolarHBondContact O-N 2.87Å; M87-L90 PolarHBondContact O-N 2.97Å; M87-L90 HydrophobicContact SD-CD1 4.06Å; L90-S93 PolarHBondContact O-N 3.17Å; L90-R94 WeakPolarHBondContact O-CG 3.3Å; L90-R94 PolarHBondContact O-N 3.28Å
91	L	96.6	Very high	96.3	Very high	110 Å²	110	99.9 Å²	99.9	58%	0.576	48%	0.477	S	S	*	.	H	α-helix	trans	-60.6	-48.9	176.3	-72.9	170.3	0	0	0	111.6	M87 K88 S93 R94 D95	M87-L91 WeakPolarHBondContact O-CB 3.43Å; M87-L91 WeakPolarHBondContact O-CG 3.1Å; M87-L91 PolarHBondContact O-N 3.38Å; K88-L91 PolarHBondContact O-N 3.48Å; L91-S93 VanDerWaalsContact C-N 3.3Å; L91-S93 PolarHBondContact O-N 3.35Å; L91-R94 PolarHBondContact O-N 2.76Å; L91-R94 VanDerWaalsContact O-N 3.1Å; L91-D95 PolarHBondContact O-N 3.15Å
92	S	97.4	Very high	96.7	Very high	76 Å²	76	98 Å²	98	53%	0.531	47%	0.468	S	S	.	.	H	α-helix	trans	-58.4	-40.7	176.9	-177.5	0	0	0	0	112.6	K88 R96	K88-S92 WeakPolarHBondContact O-CB 3.29Å; K88-S92 PolarHBondContact O-N 3.17Å; S92-R96 PolarHBondContact O-N 2.9Å; S92-R96 VanDerWaalsContact O-N 3.07Å
93	S	97.4	Very high	97	Very high	52 Å²	52	102.2 Å²	102.2	36%	0.364	48%	0.482	S	S	.	.	H	α-helix	trans	-64.1	-43.3	174.6	-168.4	0	0	0	0	112	A89 L90 L91 R96 D97	A89-S93 WeakPolarHBondContact O-CB 3.41Å; A89-S93 PolarHBondContact O-N 3.1Å; L90-S93 PolarHBondContact O-N 3.17Å; L91-S93 VanDerWaalsContact C-N 3.3Å; L91-S93 PolarHBondContact O-N 3.35Å; S93-R96 WeakPolarHBondContact O-CB 3.32Å; S93-R96 PolarHBondContact O-N 2.61Å; S93-D97 PolarHBondContact O-N 3.45Å
94	R	97.6	Very high	97.2	Very high	159 Å²	159	102.6 Å²	102.6	60%	0.6	49%	0.49	S	S	*	.	H	α-helix	trans	-68	-36.6	177.3	-71	-63.3	-179.2	-134	0.7	113.3	L90 L91 R96 D97 W98	L90-R94 WeakPolarHBondContact O-CG 3.3Å; L90-R94 PolarHBondContact O-N 3.28Å; L91-R94 PolarHBondContact O-N 2.76Å; L91-R94 VanDerWaalsContact O-N 3.1Å; R94-R96 VanDerWaalsContact C-N 3.32Å; R94-R96 PolarHBondContact O-N 2.75Å; R94-D97 IonicContact CZ-OD2 2.68Å; R94-D97 IonicContact NH1-OD2 3.2Å; R94-D97 PolarHBondContact NH1-OD2 3.34Å; R94-D97 PolarHBondContact O-N 3.33Å; R94-W98 WeakPolarHBondContact O-CB 3.46Å; R94-W98 PolarHBondContact O-N 3.45Å
95	D	97.7	Very high	97.4	Very high	82 Å²	82	104.7 Å²	104.7	44%	0.439	50%	0.496	S	S	.	.	H	α-helix	trans	-64	-37.9	172.6	-77.4	-13.3	0	0	0	111.8	L91 R99	L91-D95 PolarHBondContact O-N 3.15Å; D95-R99 WeakPolarHBondContact O-CB 3.31Å; D95-R99 WeakPolarHBondContact O-CG 3.47Å; D95-R99 PolarHBondContact O-N 3.41Å; D95-R99 PolarHBondContact O-NE 2.87Å
96	R	97.7	Very high	97.5	Very high	121 Å²	121	104.5 Å²	104.5	46%	0.457	50%	0.496	S	S	.	.	H	α-helix	trans	-65.5	-48.8	173.2	-170.8	-166.6	57.4	58.5	18.4	111	S92 S93 R94 W98 R99 E100	S92-R96 PolarHBondContact O-N 2.9Å; S92-R96 VanDerWaalsContact O-N 3.07Å; S93-R96 WeakPolarHBondContact O-CB 3.32Å; S93-R96 PolarHBondContact O-N 2.61Å; R94-R96 VanDerWaalsContact C-N 3.32Å; R94-R96 PolarHBondContact O-N 2.75Å; R96-W98 VanDerWaalsContact C-N 3.28Å; R96-W98 PolarHBondContact O-N 3.11Å; R96-R99 PolarHBondContact O-N 2.91Å; R96-E100 IonicContact NH1-OE2 2.61Å; R96-E100 PolarHBondContact NH1-OE2 2.83Å; R96-E100 VanDerWaalsContact NH1-OE2 3.09Å; R96-E100 WeakPolarHBondContact O-CB 3.44Å; R96-E100 PolarHBondContact O-N 3.39Å
97	D	97.6	Very high	97.6	Very high	31 Å²	31	99.1 Å²	99.1	17%	0.166	49%	0.487	C	S	.	.	H	α-helix	trans	-57.2	-41.3	176	-71.3	-16.6	0	0	0	111.7	S93 R94 K101	S93-D97 PolarHBondContact O-N 3.45Å; R94-D97 IonicContact CZ-OD2 2.68Å; R94-D97 IonicContact NH1-OD2 3.2Å; R94-D97 PolarHBondContact NH1-OD2 3.34Å; R94-D97 PolarHBondContact O-N 3.33Å; D97-K101 WeakPolarHBondContact O-CB 3.32Å; D97-K101 VanDerWaalsContact O-CG 3.27Å; D97-K101 WeakPolarHBondContact O-CG 3.5Å; D97-K101 PolarHBondContact O-N 3Å
98	W	97.8	Very high	97.8	Very high	160 Å²	160	99.7 Å²	99.7	61%	0.606	49%	0.491	S	S	*	.	H	α-helix	trans	-67	-46.7	178.6	-179	90.9	0	0	0	111.4	R94 R96 E100 K101 Q102	R94-W98 WeakPolarHBondContact O-CB 3.46Å; R94-W98 PolarHBondContact O-N 3.45Å; R96-W98 VanDerWaalsContact C-N 3.28Å; R96-W98 PolarHBondContact O-N 3.11Å; W98-E100 VanDerWaalsContact C-N 3.29Å; W98-E100 PolarHBondContact O-N 2.9Å; W98-K101 PolarHBondContact O-N 3.17Å; W98-Q102 HydrophobicContact CH2-CB 4.44Å; W98-Q102 HydrophobicContact CH2-CG 4.23Å; W98-Q102 HydrophobicContact CZ3-CB 4.46Å; W98-Q102 WeakPolarHBondContact O-CB 3.44Å; W98-Q102 PolarHBondContact O-N 3.04Å
99	R	98.2	Very high	97.9	Very high	141 Å²	141	100.6 Å²	100.6	53%	0.532	50%	0.495	S	S	.	.	H	α-helix	trans	-59.9	-38.9	175.9	-77.6	-176.1	-75.5	-97.3	1.2	112.3	D95 R96 K103	D95-R99 WeakPolarHBondContact O-CB 3.31Å; D95-R99 WeakPolarHBondContact O-CG 3.47Å; D95-R99 PolarHBondContact O-N 3.41Å; D95-R99 PolarHBondContact O-NE 2.87Å; R96-R99 PolarHBondContact O-N 2.91Å; R99-K103 WeakPolarHBondContact O-CB 3.38Å; R99-K103 PolarHBondContact O-N 3.39Å
100	E	98.2	Very high	98	Very high	112 Å²	112	102.6 Å²	102.6	52%	0.523	50%	0.497	S	S	.	.	H	α-helix	trans	-65.7	-48.4	175.9	-178.3	162.7	-145	0	0	111.8	R96 W98 Q102 K103 V104	R96-E100 IonicContact NH1-OE2 2.61Å; R96-E100 PolarHBondContact NH1-OE2 2.83Å; R96-E100 VanDerWaalsContact NH1-OE2 3.09Å; R96-E100 WeakPolarHBondContact O-CB 3.44Å; R96-E100 PolarHBondContact O-N 3.39Å; W98-E100 VanDerWaalsContact C-N 3.29Å; W98-E100 PolarHBondContact O-N 2.9Å; E100-Q102 VanDerWaalsContact C-N 3.33Å; E100-Q102 PolarHBondContact O-N 3.44Å; E100-K103 PolarHBondContact O-N 3.19Å; E100-V104 WeakPolarHBondContact O-CG2 3.21Å; E100-V104 PolarHBondContact O-N 2.86Å
101	K	97.9	Very high	98	Very high	142 Å²	142	101.3 Å²	101.3	62%	0.617	49%	0.493	S	S	*	.	H	α-helix	trans	-61	-39.5	175	-73.1	168.6	-176.7	173.6	0	112.6	D97 W98 V104 M105	D97-K101 WeakPolarHBondContact O-CB 3.32Å; D97-K101 VanDerWaalsContact O-CG 3.27Å; D97-K101 WeakPolarHBondContact O-CG 3.5Å; D97-K101 PolarHBondContact O-N 3Å; W98-K101 PolarHBondContact O-N 3.17Å; K101-V104 PolarHBondContact O-N 3.24Å; K101-M105 WeakPolarHBondContact O-CB 3.44Å; K101-M105 PolarHBondContact O-N 3.28Å
102	Q	98.2	Very high	98.1	Very high	55 Å²	55	100 Å²	100	26%	0.257	49%	0.49	S	S	.	.	H	α-helix	trans	-62.5	-47.2	176.3	-176.2	56.4	43.5	0	0	111	W98 E100 V104 M105 D106	W98-Q102 HydrophobicContact CH2-CB 4.44Å; W98-Q102 HydrophobicContact CH2-CG 4.23Å; W98-Q102 HydrophobicContact CZ3-CB 4.46Å; W98-Q102 WeakPolarHBondContact O-CB 3.44Å; W98-Q102 PolarHBondContact O-N 3.04Å; E100-Q102 VanDerWaalsContact C-N 3.33Å; E100-Q102 PolarHBondContact O-N 3.44Å; Q102-V104 VanDerWaalsContact C-N 3.3Å; Q102-V104 PolarHBondContact O-N 3.42Å; Q102-M105 WeakPolarHBondContact O-CB 3.41Å; Q102-M105 PolarHBondContact O-N 3.01Å; Q102-M105 VanDerWaalsContact O-N 3.08Å; Q102-D106 VanDerWaalsContact NE2-CG 3.32Å; Q102-D106 PolarHBondContact NE2-OD1 3.49Å; Q102-D106 PolarHBondContact NE2-OD2 3.5Å; Q102-D106 PolarHBondContact O-N 3.02Å
103	K	98.4	Very high	98.2	Very high	170 Å²	170	98.1 Å²	98.1	74%	0.739	47%	0.473	S	S	*	.	H	α-helix	trans	-58.6	-39.4	175.3	-174.5	-179	179	-176.6	0	112.6	R99 E100 G107	R99-K103 WeakPolarHBondContact O-CB 3.38Å; R99-K103 PolarHBondContact O-N 3.39Å; E100-K103 PolarHBondContact O-N 3.19Å; K103-G107 PolarHBondContact O-N 2.95Å; K103-G107 VanDerWaalsContact O-N 3.1Å
104	V	98.4	Very high	98.2	Very high	87 Å²	87	101.8 Å²	101.8	53%	0.527	48%	0.483	S	S	.	.	H	α-helix	trans	-66.6	-43	174.1	173.2	0	0	0	0	111.2	E100 K101 Q102 D106 G107 L108	E100-V104 WeakPolarHBondContact O-CG2 3.21Å; E100-V104 PolarHBondContact O-N 2.86Å; K101-V104 PolarHBondContact O-N 3.24Å; Q102-V104 VanDerWaalsContact C-N 3.3Å; Q102-V104 PolarHBondContact O-N 3.42Å; V104-D106 PolarHBondContact O-N 3.49Å; V104-G107 PolarHBondContact O-N 3.5Å; V104-L108 HydrophobicContact CG1-CD1 4.06Å; V104-L108 HydrophobicContact CG1-CG 4.41Å; V104-L108 WeakPolarHBondContact O-CG 3.42Å; V104-L108 PolarHBondContact O-N 3.19Å
105	M	98.1	Very high	98.2	Very high	113 Å²	113	99.4 Å²	99.4	56%	0.557	48%	0.479	S	S	*	.	H	α-helix	trans	-60.3	-44.8	177.5	-170.6	-172.5	-57.4	0	0	111.9	K101 Q102 L108 K109	K101-M105 WeakPolarHBondContact O-CB 3.44Å; K101-M105 PolarHBondContact O-N 3.28Å; Q102-M105 WeakPolarHBondContact O-CB 3.41Å; Q102-M105 PolarHBondContact O-N 3.01Å; Q102-M105 VanDerWaalsContact O-N 3.08Å; M105-L108 PolarHBondContact O-N 2.9Å; M105-K109 WeakPolarHBondContact O-CB 3.35Å; M105-K109 PolarHBondContact O-N 3.42Å
106	D	98.4	Very high	98.3	Very high	65 Å²	65	101.1 Å²	101.1	35%	0.348	48%	0.479	S	S	.	.	H	α-helix	trans	-66.4	-41.5	178.3	-68.9	-41.8	0	0	0	111.5	Q102 V104 L108 K109 D110	Q102-D106 VanDerWaalsContact NE2-CG 3.32Å; Q102-D106 PolarHBondContact NE2-OD1 3.49Å; Q102-D106 PolarHBondContact NE2-OD2 3.5Å; Q102-D106 PolarHBondContact O-N 3.02Å; V104-D106 PolarHBondContact O-N 3.49Å; D106-L108 PolarHBondContact O-N 3.48Å; D106-K109 WeakPolarHBondContact O-CB 3.18Å; D106-K109 PolarHBondContact O-N 3.39Å; D106-D110 PolarHBondContact O-N 3.02Å
107	G	98.5	Very high	98.3	Very high	37 Å²	37	102.6 Å²	102.6	38%	0.381	48%	0.484	S	S	.	.	H	α-helix	trans	-62.9	-37.2	173.5	0	0	0	0	0	114	K103 V104 T111	K103-G107 PolarHBondContact O-N 2.95Å; K103-G107 VanDerWaalsContact O-N 3.1Å; V104-G107 PolarHBondContact O-N 3.5Å; G107-T111 WeakPolarHBondContact O-CB 3.49Å; G107-T111 PolarHBondContact O-N 3.3Å; G107-T111 PolarHBondContact O-OG1 2.89Å
108	L	98.5	Very high	98.4	Very high	107 Å²	107	105 Å²	105	56%	0.56	50%	0.497	S	S	*	.	H	α-helix	trans	-67.1	-42.1	172.5	-73	173.1	0	0	0	111.5	V104 M105 D106 D110 T111 V112	V104-L108 HydrophobicContact CG1-CD1 4.06Å; V104-L108 HydrophobicContact CG1-CG 4.41Å; V104-L108 WeakPolarHBondContact O-CG 3.42Å; V104-L108 PolarHBondContact O-N 3.19Å; M105-L108 PolarHBondContact O-N 2.9Å; D106-L108 PolarHBondContact O-N 3.48Å; L108-D110 VanDerWaalsContact C-N 3.34Å; L108-D110 PolarHBondContact O-N 2.98Å; L108-T111 WeakPolarHBondContact O-CB 3.22Å; L108-T111 PolarHBondContact O-N 2.8Å; L108-V112 WeakPolarHBondContact O-CG2 3.49Å; L108-V112 PolarHBondContact O-N 2.96Å
109	K	98.5	Very high	98.4	Very high	128 Å²	128	102.2 Å²	102.2	56%	0.557	49%	0.494	S	S	*	.	H	α-helix	trans	-60.8	-41.9	176.7	-175.9	-179.9	179.2	-177.6	0	111.7	M105 D106 V112 N113	M105-K109 WeakPolarHBondContact O-CB 3.35Å; M105-K109 PolarHBondContact O-N 3.42Å; D106-K109 WeakPolarHBondContact O-CB 3.18Å; D106-K109 PolarHBondContact O-N 3.39Å; K109-V112 PolarHBondContact O-N 3.38Å; K109-N113 WeakPolarHBondContact O-CB 3.45Å; K109-N113 VanDerWaalsContact O-CG 3.22Å; K109-N113 PolarHBondContact O-N 2.94Å; K109-N113 PolarHBondContact O-ND2 3.21Å; K109-N113 VanDerWaalsContact O-ND2 3.13Å
110	D	98.6	Very high	98.4	Very high	107 Å²	107	99.8 Å²	99.8	57%	0.572	49%	0.491	S	S	*	.	H	α-helix	trans	-67	-37.9	174.3	-79.4	-19.3	0	0	0	112.8	D106 L108 N113 K114	D106-D110 PolarHBondContact O-N 3.02Å; L108-D110 VanDerWaalsContact C-N 3.34Å; L108-D110 PolarHBondContact O-N 2.98Å; D110-N113 PolarHBondContact O-N 2.99Å; D110-K114 WeakPolarHBondContact O-CB 3.43Å; D110-K114 PolarHBondContact O-N 3.46Å
111	T	98.5	Very high	98.4	Very high	73 Å²	73	97.4 Å²	97.4	45%	0.448	49%	0.491	S	S	.	.	H	α-helix	trans	-61.9	-47.1	173.9	-58.4	0	0	0	0	111.4	G107 L108 N113 K114 Q115	G107-T111 WeakPolarHBondContact O-CB 3.49Å; G107-T111 PolarHBondContact O-N 3.3Å; G107-T111 PolarHBondContact O-OG1 2.89Å; L108-T111 WeakPolarHBondContact O-CB 3.22Å; L108-T111 PolarHBondContact O-N 2.8Å; T111-N113 VanDerWaalsContact C-N 3.35Å; T111-N113 PolarHBondContact O-N 3.34Å; T111-K114 WeakPolarHBondContact O-CB 3.49Å; T111-K114 PolarHBondContact O-N 2.93Å; T111-Q115 WeakPolarHBondContact O-CG 3.41Å; T111-Q115 PolarHBondContact O-N 3.43Å
112	V	98.6	Very high	98.4	Very high	83 Å²	83	95.6 Å²	95.6	50%	0.503	49%	0.486	S	S	.	.	H	α-helix	trans	-63.3	-40	175.2	171.1	0	0	0	0	111.4	L108 K109 K114 Q115 R116	L108-V112 WeakPolarHBondContact O-CG2 3.49Å; L108-V112 PolarHBondContact O-N 2.96Å; K109-V112 PolarHBondContact O-N 3.38Å; V112-K114 VanDerWaalsContact C-N 3.34Å; V112-K114 PolarHBondContact O-N 2.75Å; V112-Q115 PolarHBondContact O-N 3.19Å; V112-R116 WeakPolarHBondContact O-CB 3.24Å; V112-R116 PolarHBondContact O-N 3.31Å
113	N	98.4	Very high	98.5	Very high	35 Å²	35	101.3 Å²	101.3	19%	0.187	51%	0.505	C	S	.	.	H	α-helix	trans	-63.4	-37.6	174.6	-78.3	-36.3	0	0	0	112.5	K109 D110 T111 R116 R117	K109-N113 WeakPolarHBondContact O-CB 3.45Å; K109-N113 VanDerWaalsContact O-CG 3.22Å; K109-N113 PolarHBondContact O-N 2.94Å; K109-N113 PolarHBondContact O-ND2 3.21Å; K109-N113 VanDerWaalsContact O-ND2 3.13Å; D110-N113 PolarHBondContact O-N 2.99Å; T111-N113 VanDerWaalsContact C-N 3.35Å; T111-N113 PolarHBondContact O-N 3.34Å; N113-R116 PolarHBondContact OD1-NH1 3.4Å; N113-R116 PolarHBondContact OD1-NH2 2.96Å; N113-R117 VanDerWaalsContact C-NH1 3.35Å; N113-R117 WeakPolarHBondContact O-CG 3.49Å; N113-R117 PolarHBondContact O-N 3.2Å; N113-R117 PolarHBondContact O-NH1 3.42Å; N113-R117 VanDerWaalsContact O-NH1 3.13Å
114	K	98.5	Very high	98.5	Very high	130 Å²	130	99.4 Å²	99.4	57%	0.565	50%	0.497	S	S	*	.	H	α-helix	trans	-66.3	-53.5	173.9	-176	-178.6	174.9	-176.4	0	110.7	D110 T111 V112 R116 R117 D118	D110-K114 WeakPolarHBondContact O-CB 3.43Å; D110-K114 PolarHBondContact O-N 3.46Å; T111-K114 WeakPolarHBondContact O-CB 3.49Å; T111-K114 PolarHBondContact O-N 2.93Å; V112-K114 VanDerWaalsContact C-N 3.34Å; V112-K114 PolarHBondContact O-N 2.75Å; K114-R116 VanDerWaalsContact C-N 3.25Å; K114-R116 PolarHBondContact O-N 2.89Å; K114-R117 WeakPolarHBondContact O-CB 3.47Å; K114-R117 PolarHBondContact O-N 3.01Å; K114-D118 PolarHBondContact O-N 3.42Å
115	Q	98.4	Very high	98.5	Very high	109 Å²	109	99.3 Å²	99.3	51%	0.509	49%	0.491	S	S	.	.	H	α-helix	trans	-55.7	-37.7	178.9	-73.3	175.1	-28.4	0	0	112.8	T111 V112 D118 L119	T111-Q115 WeakPolarHBondContact O-CG 3.41Å; T111-Q115 PolarHBondContact O-N 3.43Å; V112-Q115 PolarHBondContact O-N 3.19Å; Q115-D118 PolarHBondContact O-N 3.46Å; Q115-L119 WeakPolarHBondContact O-CB 3.37Å; Q115-L119 VanDerWaalsContact O-CG 3.27Å; Q115-L119 WeakPolarHBondContact O-CG 3.46Å; Q115-L119 PolarHBondContact O-N 2.91Å
116	R	98.6	Very high	98.5	Very high	117 Å²	117	97.3 Å²	97.3	44%	0.442	48%	0.484	S	S	.	.	H	α-helix	trans	-61.2	-48.4	174.1	-175	176	66.3	-101.7	0.9	112.2	V112 N113 K114 D118 L119 D120	V112-R116 WeakPolarHBondContact O-CB 3.24Å; V112-R116 PolarHBondContact O-N 3.31Å; N113-R116 PolarHBondContact OD1-NH1 3.4Å; N113-R116 PolarHBondContact OD1-NH2 2.96Å; K114-R116 VanDerWaalsContact C-N 3.25Å; K114-R116 PolarHBondContact O-N 2.89Å; R116-D118 VanDerWaalsContact C-N 3.32Å; R116-D118 PolarHBondContact O-N 3.08Å; R116-L119 PolarHBondContact O-N 3.26Å; R116-D120 VanDerWaalsContact O-CG 3.26Å; R116-D120 PolarHBondContact O-N 2.86Å
117	R	98.6	Very high	98.5	Very high	152 Å²	152	99.4 Å²	99.4	57%	0.574	49%	0.493	S	S	*	.	H	α-helix	trans	-61.6	-41.4	177.7	-65.1	177.7	-165.4	106	-11.2	111.7	N113 K114 D120 A121	N113-R117 VanDerWaalsContact C-NH1 3.35Å; N113-R117 WeakPolarHBondContact O-CG 3.49Å; N113-R117 PolarHBondContact O-N 3.2Å; N113-R117 PolarHBondContact O-NH1 3.42Å; N113-R117 VanDerWaalsContact O-NH1 3.13Å; K114-R117 WeakPolarHBondContact O-CB 3.47Å; K114-R117 PolarHBondContact O-N 3.01Å; R117-D120 PolarHBondContact O-N 3.04Å; R117-A121 WeakPolarHBondContact O-CB 3.32Å; R117-A121 PolarHBondContact O-N 3.25Å
118	D	98.4	Very high	98.4	Very high	82 Å²	82	101.7 Å²	101.7	44%	0.439	50%	0.497	S	S	.	.	H	α-helix	trans	-64.1	-42.9	177.7	-61.9	-19.9	0	0	0	110.6	K114 Q115 R116 A121 M122	K114-D118 PolarHBondContact O-N 3.42Å; Q115-D118 PolarHBondContact O-N 3.46Å; R116-D118 VanDerWaalsContact C-N 3.32Å; R116-D118 PolarHBondContact O-N 3.08Å; D118-A121 PolarHBondContact O-N 2.98Å; D118-M122 WeakPolarHBondContact O-CB 3.46Å; D118-M122 VanDerWaalsContact O-CG 3.29Å; D118-M122 WeakPolarHBondContact O-CG 3.46Å; D118-M122 PolarHBondContact O-N 3.04Å
119	L	98.6	Very high	98.4	Very high	102 Å²	102	102.2 Å²	102.2	53%	0.534	50%	0.495	S	S	.	.	H	α-helix	trans	-63	-42.6	174.2	-75.4	170.9	0	0	0	112.7	Q115 R116 M122 R123	Q115-L119 WeakPolarHBondContact O-CB 3.37Å; Q115-L119 VanDerWaalsContact O-CG 3.27Å; Q115-L119 WeakPolarHBondContact O-CG 3.46Å; Q115-L119 PolarHBondContact O-N 2.91Å; R116-L119 PolarHBondContact O-N 3.26Å; L119-M122 PolarHBondContact O-N 3.05Å; L119-R123 WeakPolarHBondContact O-CB 3.39Å; L119-R123 VanDerWaalsContact O-CG 3.26Å; L119-R123 WeakPolarHBondContact O-CG 3.49Å; L119-R123 PolarHBondContact O-N 2.92Å
120	D	98.4	Very high	98.4	Very high	89 Å²	89	101.7 Å²	101.7	48%	0.476	49%	0.494	S	S	.	.	H	α-helix	trans	-66.3	-39	178.6	-66.9	-27.6	0	0	0	111.5	R116 R117 R123 K124	R116-D120 VanDerWaalsContact O-CG 3.26Å; R116-D120 PolarHBondContact O-N 2.86Å; R117-D120 PolarHBondContact O-N 3.04Å; D120-R123 PolarHBondContact O-N 2.92Å; D120-K124 PolarHBondContact O-N 3.19Å; D120-K124 VanDerWaalsContact O-N 3.11Å
121	A	98.6	Very high	98.4	Very high	63 Å²	63	103 Å²	103	52%	0.521	50%	0.498	S	S	.	.	H	α-helix	trans	-63.4	-47.3	173.1	0	0	0	0	0	111.9	R117 D118 R123 K124 E125	R117-A121 WeakPolarHBondContact O-CB 3.32Å; R117-A121 PolarHBondContact O-N 3.25Å; D118-A121 PolarHBondContact O-N 2.98Å; A121-R123 PolarHBondContact O-N 3.22Å; A121-K124 PolarHBondContact O-N 3.02Å; A121-E125 PolarHBondContact O-N 2.91Å
122	M	98.3	Very high	98.4	Very high	103 Å²	103	103.5 Å²	103.5	51%	0.507	50%	0.502	S	S	.	.	H	α-helix	trans	-63.3	-39.1	176.9	-71	-56.1	-53.8	0	0	112.4	D118 L119 K124 E125 V126	D118-M122 WeakPolarHBondContact O-CB 3.46Å; D118-M122 VanDerWaalsContact O-CG 3.29Å; D118-M122 WeakPolarHBondContact O-CG 3.46Å; D118-M122 PolarHBondContact O-N 3.04Å; L119-M122 PolarHBondContact O-N 3.05Å; M122-K124 VanDerWaalsContact C-N 3.33Å; M122-K124 PolarHBondContact O-N 3.08Å; M122-E125 PolarHBondContact O-N 3.02Å; M122-V126 WeakPolarHBondContact O-CG2 3.5Å; M122-V126 PolarHBondContact O-N 3.42Å
123	R	98.5	Very high	98.3	Very high	175 Å²	175	102.8 Å²	102.8	66%	0.66	50%	0.499	S	S	*	.	H	α-helix	trans	-59.3	-43.8	174.1	-77.7	172.8	-174.8	-79.3	1	111.6	L119 D120 A121 V126 M127	L119-R123 WeakPolarHBondContact O-CB 3.39Å; L119-R123 VanDerWaalsContact O-CG 3.26Å; L119-R123 WeakPolarHBondContact O-CG 3.49Å; L119-R123 PolarHBondContact O-N 2.92Å; D120-R123 PolarHBondContact O-N 2.92Å; A121-R123 PolarHBondContact O-N 3.22Å; R123-V126 PolarHBondContact O-N 2.84Å; R123-M127 PolarHBondContact O-N 3.42Å
124	K	98.4	Very high	98.4	Very high	131 Å²	131	104.5 Å²	104.5	57%	0.57	51%	0.511	S	S	*	.	H	α-helix	trans	-63.3	-45.8	176.1	-173.8	-177.9	174.9	-175.5	0	111.6	D120 A121 M122 V126 M127 D128	D120-K124 PolarHBondContact O-N 3.19Å; D120-K124 VanDerWaalsContact O-N 3.11Å; A121-K124 PolarHBondContact O-N 3.02Å; M122-K124 VanDerWaalsContact C-N 3.33Å; M122-K124 PolarHBondContact O-N 3.08Å; K124-V126 VanDerWaalsContact C-N 3.32Å; K124-V126 PolarHBondContact O-N 3.47Å; K124-M127 PolarHBondContact O-N 3.45Å; K124-D128 PolarHBondContact O-N 2.89Å
125	E	98.4	Very high	98.3	Very high	85 Å²	85	101.2 Å²	101.2	40%	0.397	51%	0.508	S	S	.	.	H	α-helix	trans	-63	-37.3	178.7	-165.9	-171.4	159.1	0	0	112.4	A121 M122 K129	A121-E125 PolarHBondContact O-N 2.91Å; M122-E125 PolarHBondContact O-N 3.02Å; E125-K129 HydrophobicContact CG-CD 4.4Å; E125-K129 WeakPolarHBondContact O-CB 3.33Å; E125-K129 VanDerWaalsContact O-CG 3.28Å; E125-K129 WeakPolarHBondContact O-CG 3.32Å; E125-K129 PolarHBondContact O-N 3.33Å; E125-K129 WeakPolarHBondContact OE1-CE 3.33Å; E125-K129 IonicContact OE1-NZ 3.81Å; E125-K129 PolarHBondContact OE1-NZ 3.2Å
126	V	98.6	Very high	98.3	Very high	70 Å²	70	100.3 Å²	100.3	42%	0.424	51%	0.506	S	S	.	.	H	α-helix	trans	-62.5	-48.3	172.5	168.5	0	0	0	0	110.7	M122 R123 K124 D128 K129 E130	M122-V126 WeakPolarHBondContact O-CG2 3.5Å; M122-V126 PolarHBondContact O-N 3.42Å; R123-V126 PolarHBondContact O-N 2.84Å; K124-V126 VanDerWaalsContact C-N 3.32Å; K124-V126 PolarHBondContact O-N 3.47Å; V126-D128 PolarHBondContact O-N 3.47Å; V126-K129 PolarHBondContact O-N 3.27Å; V126-E130 HydrophobicContact CG1-CG 4.33Å; V126-E130 WeakPolarHBondContact O-CG 3.46Å; V126-E130 PolarHBondContact O-N 3.41Å
127	M	98.2	Very high	98.3	Very high	109 Å²	109	101.4 Å²	101.4	54%	0.537	51%	0.514	S	S	.	.	H	α-helix	trans	-60.9	-44.5	178.3	-174.1	177.5	65.1	0	0	112.1	R123 K124 K129 E130 M131	R123-M127 PolarHBondContact O-N 3.42Å; K124-M127 PolarHBondContact O-N 3.45Å; M127-K129 VanDerWaalsContact C-N 3.31Å; M127-K129 PolarHBondContact O-N 3.44Å; M127-E130 PolarHBondContact O-N 3.04Å; M127-M131 VanDerWaalsContact O-CG 3.32Å; M127-M131 WeakPolarHBondContact O-CG 3.25Å; M127-M131 PolarHBondContact O-N 2.96Å
128	D	97.8	Very high	98.3	Very high	85 Å²	85	101.4 Å²	101.4	46%	0.455	52%	0.518	S	S	.	.	H	α-helix	trans	-60.8	-40.6	176.4	-70.7	-22.9	0	0	0	111.1	K124 V126 V132	K124-D128 PolarHBondContact O-N 2.89Å; V126-D128 PolarHBondContact O-N 3.47Å; D128-V132 WeakPolarHBondContact O-CG2 3.49Å; D128-V132 PolarHBondContact O-N 3.17Å
129	K	97.9	Very high	98.3	Very high	119 Å²	119	102.4 Å²	102.4	52%	0.517	52%	0.52	S	S	.	.	H	α-helix	trans	-68.8	-38.9	174.8	-74.9	171.7	-178.6	170.9	0	113.1	E125 V126 M127 V132 C133	E125-K129 HydrophobicContact CG-CD 4.4Å; E125-K129 WeakPolarHBondContact O-CB 3.33Å; E125-K129 VanDerWaalsContact O-CG 3.28Å; E125-K129 WeakPolarHBondContact O-CG 3.32Å; E125-K129 PolarHBondContact O-N 3.33Å; E125-K129 WeakPolarHBondContact OE1-CE 3.33Å; E125-K129 IonicContact OE1-NZ 3.81Å; E125-K129 PolarHBondContact OE1-NZ 3.2Å; V126-K129 PolarHBondContact O-N 3.27Å; M127-K129 VanDerWaalsContact C-N 3.31Å; M127-K129 PolarHBondContact O-N 3.44Å; K129-V132 PolarHBondContact O-N 3.44Å; K129-C133 WeakPolarHBondContact O-CB 3.47Å; K129-C133 PolarHBondContact O-N 3.34Å; K129-C133 PolarHBondContact O-SG 2.9Å; K129-C133 VanDerWaalsContact O-SG 3.34Å
130	E	98.4	Very high	98.3	Very high	116 Å²	116	103.8 Å²	103.8	54%	0.542	53%	0.526	S	S	.	.	H	α-helix	trans	-62.9	-42.3	176.5	-78.1	177.3	169	0	0	111.4	V126 M127 V132 C133 V134	V126-E130 HydrophobicContact CG1-CG 4.33Å; V126-E130 WeakPolarHBondContact O-CG 3.46Å; V126-E130 PolarHBondContact O-N 3.41Å; M127-E130 PolarHBondContact O-N 3.04Å; E130-V132 VanDerWaalsContact C-N 3.35Å; E130-V132 PolarHBondContact O-N 3.25Å; E130-C133 WeakPolarHBondContact O-CB 3.37Å; E130-C133 PolarHBondContact O-N 3.01Å; E130-C133 VanDerWaalsContact O-N 3.17Å; E130-V134 WeakPolarHBondContact O-CG2 3.49Å; E130-V134 PolarHBondContact O-N 2.88Å
131	M	98	Very high	98.3	Very high	134 Å²	134	103.7 Å²	103.7	66%	0.66	53%	0.528	S	S	*	.	H	α-helix	trans	-60.3	-42.8	175.2	-68.8	-65.1	-77.8	0	0	112.1	M127 V134 A135	M127-M131 VanDerWaalsContact O-CG 3.32Å; M127-M131 WeakPolarHBondContact O-CG 3.25Å; M127-M131 PolarHBondContact O-N 2.96Å; M131-V134 PolarHBondContact O-N 2.64Å; M131-A135 PolarHBondContact O-N 3.49Å
132	V	98.2	Very high	98.3	Very high	85 Å²	85	107.3 Å²	107.3	52%	0.515	53%	0.529	S	S	.	.	H	α-helix	trans	-64.4	-42.9	173.6	174.2	0	0	0	0	111.4	D128 K129 E130 V134 A135 L136	D128-V132 WeakPolarHBondContact O-CG2 3.49Å; D128-V132 PolarHBondContact O-N 3.17Å; K129-V132 PolarHBondContact O-N 3.44Å; E130-V132 VanDerWaalsContact C-N 3.35Å; E130-V132 PolarHBondContact O-N 3.25Å; V132-V134 VanDerWaalsContact C-N 3.35Å; V132-V134 PolarHBondContact O-N 3.43Å; V132-A135 PolarHBondContact O-N 3.47Å; V132-L136 HydrophobicContact CG1-CD1 3.89Å; V132-L136 HydrophobicContact CG1-CG 4.27Å; V132-L136 WeakPolarHBondContact O-CB 3.44Å; V132-L136 WeakPolarHBondContact O-CG 3.45Å; V132-L136 PolarHBondContact O-N 2.88Å
133	C	98.2	Very high	98.3	Very high	67 Å²	67	107.2 Å²	107.2	45%	0.453	53%	0.53	S	S	.	.	H	α-helix	trans	-60.5	-40.8	176	-76.6	0	0	0	0	112.6	K129 E130 K137	K129-C133 WeakPolarHBondContact O-CB 3.47Å; K129-C133 PolarHBondContact O-N 3.34Å; K129-C133 PolarHBondContact O-SG 2.9Å; K129-C133 VanDerWaalsContact O-SG 3.34Å; E130-C133 WeakPolarHBondContact O-CB 3.37Å; E130-C133 PolarHBondContact O-N 3.01Å; E130-C133 VanDerWaalsContact O-N 3.17Å; C133-K137 WeakPolarHBondContact O-CB 3.48Å; C133-K137 VanDerWaalsContact O-CG 3.26Å; C133-K137 WeakPolarHBondContact O-CG 3.48Å; C133-K137 PolarHBondContact O-N 3.41Å
134	V	98.4	Very high	98.3	Very high	72 Å²	72	104.7 Å²	104.7	44%	0.436	53%	0.526	S	S	.	.	H	α-helix	trans	-65.3	-42.8	175.5	171.2	0	0	0	0	111	E130 M131 V132 K137 K138	E130-V134 WeakPolarHBondContact O-CG2 3.49Å; E130-V134 PolarHBondContact O-N 2.88Å; M131-V134 PolarHBondContact O-N 2.64Å; V132-V134 VanDerWaalsContact C-N 3.35Å; V132-V134 PolarHBondContact O-N 3.43Å; V134-K137 PolarHBondContact O-N 3.45Å; V134-K138 WeakPolarHBondContact O-CG 3.32Å; V134-K138 PolarHBondContact O-N 3.1Å; V134-K138 VanDerWaalsContact O-N 3.08Å
135	A	98.3	Very high	98.3	Very high	60 Å²	60	101.5 Å²	101.5	50%	0.496	52%	0.518	S	S	.	.	H	α-helix	trans	-62.5	-45.6	176.4	0	0	0	0	0	112.2	M131 V132 K138 Q139	M131-A135 PolarHBondContact O-N 3.49Å; V132-A135 PolarHBondContact O-N 3.47Å; A135-K138 PolarHBondContact O-N 2.86Å; A135-Q139 PolarHBondContact O-N 2.88Å
136	L	98.4	Very high	98.3	Very high	90 Å²	90	100.4 Å²	100.4	47%	0.471	51%	0.512	S	S	.	.	H	α-helix	trans	-63.6	-41.6	177	-71.5	173.7	0	0	0	112.1	V132 K138 Q139 M140	V132-L136 HydrophobicContact CG1-CD1 3.89Å; V132-L136 HydrophobicContact CG1-CG 4.27Å; V132-L136 WeakPolarHBondContact O-CB 3.44Å; V132-L136 WeakPolarHBondContact O-CG 3.45Å; V132-L136 PolarHBondContact O-N 2.88Å; L136-K138 PolarHBondContact O-N 3.3Å; L136-Q139 PolarHBondContact O-N 2.91Å; L136-M140 WeakPolarHBondContact O-CG 3.26Å; L136-M140 PolarHBondContact O-N 3.39Å
137	K	98.4	Very high	98.3	Very high	141 Å²	141	102.4 Å²	102.4	61%	0.613	52%	0.517	S	S	*	.	H	α-helix	trans	-58.3	-46.1	174	-77	172.2	-179.8	-179.4	0	111.8	C133 V134 Q139 M140 V141	C133-K137 WeakPolarHBondContact O-CB 3.48Å; C133-K137 VanDerWaalsContact O-CG 3.26Å; C133-K137 WeakPolarHBondContact O-CG 3.48Å; C133-K137 PolarHBondContact O-N 3.41Å; V134-K137 PolarHBondContact O-N 3.45Å; K137-Q139 VanDerWaalsContact C-N 3.31Å; K137-Q139 PolarHBondContact O-N 3.2Å; K137-M140 PolarHBondContact O-N 3.39Å; K137-V141 WeakPolarHBondContact O-CG2 3.39Å; K137-V141 PolarHBondContact O-N 2.99Å
138	K	98.4	Very high	98.3	Very high	152 Å²	152	101.9 Å²	101.9	66%	0.661	52%	0.517	S	S	*	.	H	α-helix	trans	-60.8	-40.4	175.6	-71.7	-178.5	178.7	-174	0	111.9	V134 A135 L136 Y142	V134-K138 WeakPolarHBondContact O-CG 3.32Å; V134-K138 PolarHBondContact O-N 3.1Å; V134-K138 VanDerWaalsContact O-N 3.08Å; A135-K138 PolarHBondContact O-N 2.86Å; L136-K138 PolarHBondContact O-N 3.3Å; K138-Y142 PolarHBondContact O-N 2.59Å; K138-Y142 VanDerWaalsContact O-N 3.08Å
139	Q	98.3	Very high	98.3	Very high	102 Å²	102	102.8 Å²	102.8	48%	0.477	52%	0.518	S	S	.	.	H	α-helix	trans	-66.7	-39.6	176.3	-170.2	176.2	18.3	0	0	112.6	A135 L136 K137 Y142 L143	A135-Q139 PolarHBondContact O-N 2.88Å; L136-Q139 PolarHBondContact O-N 2.91Å; K137-Q139 VanDerWaalsContact C-N 3.31Å; K137-Q139 PolarHBondContact O-N 3.2Å; Q139-Y142 PolarHBondContact O-N 3Å; Q139-L143 HydrophobicContact CG-CD1 4.3Å; Q139-L143 WeakPolarHBondContact O-CG 3.48Å; Q139-L143 PolarHBondContact O-N 3.23Å
140	M	97.9	Very high	98.3	Very high	132 Å²	132	100.8 Å²	100.8	65%	0.65	51%	0.512	S	S	*	.	H	α-helix	trans	-61.4	-49.2	175.4	-73.6	179.1	69.8	0	0	111.5	L136 K137 Y142 L143 E144	L136-M140 WeakPolarHBondContact O-CG 3.26Å; L136-M140 PolarHBondContact O-N 3.39Å; K137-M140 PolarHBondContact O-N 3.39Å; M140-Y142 VanDerWaalsContact C-N 3.34Å; M140-Y142 PolarHBondContact O-N 3.3Å; M140-L143 PolarHBondContact O-N 3.41Å; M140-E144 WeakPolarHBondContact O-CB 3.42Å; M140-E144 PolarHBondContact O-N 2.97Å
141	V	98.6	Very high	98.3	Very high	87 Å²	87	98.8 Å²	98.8	53%	0.527	50%	0.503	S	S	.	.	H	α-helix	trans	-58.9	-45.2	177.7	173.1	0	0	0	0	111	K137 L143 E144 T145	K137-V141 WeakPolarHBondContact O-CG2 3.39Å; K137-V141 PolarHBondContact O-N 2.99Å; V141-L143 PolarHBondContact O-N 2.93Å; V141-E144 WeakPolarHBondContact O-CB 3.35Å; V141-E144 PolarHBondContact O-N 3.44Å; V141-T145 PolarHBondContact O-N 3.25Å; V141-T145 PolarHBondContact O-OG1 2.97Å
142	Y	98.4	Very high	98.3	Very high	138 Å²	138	95.1 Å²	95.1	54%	0.541	49%	0.494	S	S	.	.	H	α-helix	trans	-58.7	-44.9	176.3	172.1	-102.8	0	0	0	112.8	K138 Q139 M140 E144 T145 Q146	K138-Y142 PolarHBondContact O-N 2.59Å; K138-Y142 VanDerWaalsContact O-N 3.08Å; Q139-Y142 PolarHBondContact O-N 3Å; M140-Y142 VanDerWaalsContact C-N 3.34Å; M140-Y142 PolarHBondContact O-N 3.3Å; Y142-E144 VanDerWaalsContact C-N 3.34Å; Y142-T145 PolarHBondContact O-N 3.47Å; Y142-Q146 HydrophobicContact CD2-CG 4.44Å; Y142-Q146 HydrophobicContact CE1-CG 4.07Å; Y142-Q146 HydrophobicContact CE2-CG 3.93Å; Y142-Q146 WeakPolarHBondContact O-CG 3.37Å; Y142-Q146 PolarHBondContact O-N 3.47Å
143	L	98.4	Very high	98.3	Very high	101 Å²	101	93.7 Å²	93.7	53%	0.529	49%	0.491	S	S	.	.	H	α-helix	trans	-66.6	-35.3	177.6	-70.5	173.1	0	0	0	112.3	Q139 M140 V141 Q146 Q147	Q139-L143 HydrophobicContact CG-CD1 4.3Å; Q139-L143 WeakPolarHBondContact O-CG 3.48Å; Q139-L143 PolarHBondContact O-N 3.23Å; M140-L143 PolarHBondContact O-N 3.41Å; V141-L143 PolarHBondContact O-N 2.93Å; L143-Q146 PolarHBondContact O-N 3.02Å; L143-Q147 VanDerWaalsContact O-CB 3.32Å; L143-Q147 WeakPolarHBondContact O-CB 3.48Å; L143-Q147 PolarHBondContact O-N 2.86Å
144	E	98.5	Very high	98.3	Very high	123 Å²	123	95.7 Å²	95.7	58%	0.575	49%	0.492	S	S	*	.	H	α-helix	trans	-65.6	-44.3	174.3	-176.1	171.6	-159.3	0	0	111.6	M140 V141 Y142 Q146 Q147 N148	M140-E144 WeakPolarHBondContact O-CB 3.42Å; M140-E144 PolarHBondContact O-N 2.97Å; V141-E144 WeakPolarHBondContact O-CB 3.35Å; V141-E144 PolarHBondContact O-N 3.44Å; Y142-E144 VanDerWaalsContact C-N 3.34Å; E144-Q146 PolarHBondContact O-N 2.94Å; E144-Q147 PolarHBondContact O-N 3.3Å; E144-N148 VanDerWaalsContact O-CG 3.25Å; E144-N148 PolarHBondContact O-N 3.2Å; E144-N148 PolarHBondContact O-ND2 2.82Å
145	T	98.3	Very high	98.3	Very high	64 Å²	64	97 Å²	97	39%	0.393	49%	0.493	S	S	.	.	H	α-helix	trans	-58.4	-48.5	172.9	-50.2	0	0	0	0	111.3	V141 Y142 Q147 N148 E149	V141-T145 PolarHBondContact O-N 3.25Å; V141-T145 PolarHBondContact O-OG1 2.97Å; Y142-T145 PolarHBondContact O-N 3.47Å; T145-Q147 VanDerWaalsContact C-N 3.34Å; T145-Q147 PolarHBondContact O-N 3.46Å; T145-N148 PolarHBondContact O-N 3.11Å; T145-E149 WeakPolarHBondContact O-CG 3.44Å; T145-E149 PolarHBondContact O-N 3.15Å
146	Q	98.3	Very high	98.3	Very high	62 Å²	62	97.7 Å²	97.7	29%	0.29	49%	0.486	S	S	.	.	H	α-helix	trans	-61.8	-39.2	177.3	-71.1	-64.3	-75.1	0	0	112.8	Y142 L143 E144 N148 E149 I150	Y142-Q146 HydrophobicContact CD2-CG 4.44Å; Y142-Q146 HydrophobicContact CE1-CG 4.07Å; Y142-Q146 HydrophobicContact CE2-CG 3.93Å; Y142-Q146 WeakPolarHBondContact O-CG 3.37Å; Y142-Q146 PolarHBondContact O-N 3.47Å; L143-Q146 PolarHBondContact O-N 3.02Å; E144-Q146 PolarHBondContact O-N 2.94Å; Q146-N148 VanDerWaalsContact C-N 3.34Å; Q146-N148 PolarHBondContact O-N 3.41Å; Q146-E149 PolarHBondContact NE2-OE2 3.44Å; Q146-E149 PolarHBondContact O-N 2.92Å; Q146-I150 WeakPolarHBondContact O-CB 3.4Å; Q146-I150 WeakPolarHBondContact O-CD1 3.16Å; Q146-I150 VanDerWaalsContact O-CG1 3.22Å; Q146-I150 WeakPolarHBondContact O-CG1 3.48Å; Q146-I150 PolarHBondContact O-N 3.13Å
147	Q	98.2	Very high	98.3	Very high	112 Å²	112	96.7 Å²	96.7	52%	0.523	48%	0.484	S	S	.	.	H	α-helix	trans	-62.8	-41	175.5	-178.6	68.4	18	0	0	111.5	L143 E144 T145 Q151	L143-Q147 VanDerWaalsContact O-CB 3.32Å; L143-Q147 WeakPolarHBondContact O-CB 3.48Å; L143-Q147 PolarHBondContact O-N 2.86Å; E144-Q147 PolarHBondContact O-N 3.3Å; T145-Q147 VanDerWaalsContact C-N 3.34Å; T145-Q147 PolarHBondContact O-N 3.46Å; Q147-Q151 WeakPolarHBondContact O-CB 3.4Å; Q147-Q151 PolarHBondContact O-N 3.18Å
148	N	98.1	Very high	98.3	Very high	98 Å²	98	97.9 Å²	97.9	52%	0.524	49%	0.485	S	S	.	.	H	α-helix	trans	-68.4	-43.4	178.2	-69.6	-25.2	0	0	0	112.2	E144 T145 Q146 I150 Q151 A152	E144-N148 VanDerWaalsContact O-CG 3.25Å; E144-N148 PolarHBondContact O-N 3.2Å; E144-N148 PolarHBondContact O-ND2 2.82Å; T145-N148 PolarHBondContact O-N 3.11Å; Q146-N148 VanDerWaalsContact C-N 3.34Å; Q146-N148 PolarHBondContact O-N 3.41Å; N148-I150 PolarHBondContact O-N 3.43Å; N148-Q151 PolarHBondContact O-N 2.96Å; N148-A152 PolarHBondContact O-N 3.44Å
149	E	98.4	Very high	98.2	Very high	103 Å²	103	95.9 Å²	95.9	48%	0.481	47%	0.473	S	S	.	.	H	α-helix	trans	-58.4	-46.6	173.3	-73.3	171.3	-162.5	0	0	111.8	T145 Q146 Q151 A152 A153	T145-E149 WeakPolarHBondContact O-CG 3.44Å; T145-E149 PolarHBondContact O-N 3.15Å; Q146-E149 PolarHBondContact NE2-OE2 3.44Å; Q146-E149 PolarHBondContact O-N 2.92Å; E149-Q151 VanDerWaalsContact C-N 3.29Å; E149-Q151 PolarHBondContact O-N 2.9Å; E149-A152 PolarHBondContact O-N 2.97Å; E149-A153 WeakPolarHBondContact O-CB 3.42Å; E149-A153 PolarHBondContact O-N 3.37Å
150	I	98.4	Very high	98.2	Very high	78 Å²	78	95.2 Å²	95.2	40%	0.4	47%	0.472	S	S	.	.	H	α-helix	trans	-61.9	-37.3	176.6	-71.8	167.2	0	0	0	111.3	Q146 N148 K154	Q146-I150 WeakPolarHBondContact O-CB 3.4Å; Q146-I150 WeakPolarHBondContact O-CD1 3.16Å; Q146-I150 VanDerWaalsContact O-CG1 3.22Å; Q146-I150 WeakPolarHBondContact O-CG1 3.48Å; Q146-I150 PolarHBondContact O-N 3.13Å; N148-I150 PolarHBondContact O-N 3.43Å; I150-K154 HydrophobicContact CG2-CD 4.11Å; I150-K154 VanDerWaalsContact CG2-CE 3.48Å; I150-K154 WeakPolarHBondContact O-CD 3.43Å; I150-K154 VanDerWaalsContact O-CG 3.24Å; I150-K154 WeakPolarHBondContact O-CG 3.39Å; I150-K154 PolarHBondContact O-N 3.47Å
151	Q	98.3	Very high	98.2	Very high	73 Å²	73	96.9 Å²	96.9	34%	0.341	47%	0.471	S	S	.	.	H	α-helix	trans	-69.1	-46.3	178.2	-176.6	61.1	19.5	0	0	111.7	Q147 N148 E149 A153 K154 E155	Q147-Q151 WeakPolarHBondContact O-CB 3.4Å; Q147-Q151 PolarHBondContact O-N 3.18Å; N148-Q151 PolarHBondContact O-N 2.96Å; E149-Q151 VanDerWaalsContact C-N 3.29Å; E149-Q151 PolarHBondContact O-N 2.9Å; Q151-A153 VanDerWaalsContact C-N 3.33Å; Q151-A153 PolarHBondContact O-N 3.27Å; Q151-K154 WeakPolarHBondContact O-CB 3.28Å; Q151-K154 PolarHBondContact O-N 3.39Å; Q151-E155 PolarHBondContact NE2-OE1 3.43Å; Q151-E155 PolarHBondContact O-N 2.95Å
152	A	98.2	Very high	98.2	Very high	58 Å²	58	94.6 Å²	94.6	48%	0.479	47%	0.465	S	S	.	.	H	α-helix	trans	-58.7	-44.2	175.1	0	0	0	0	0	111.7	N148 E149 K154 E155 E156	N148-A152 PolarHBondContact O-N 3.44Å; E149-A152 PolarHBondContact O-N 2.97Å; A152-K154 PolarHBondContact O-N 2.92Å; A152-E155 PolarHBondContact O-N 2.87Å; A152-E156 PolarHBondContact O-N 3.43Å
153	A	97.9	Very high	98.1	Very high	55 Å²	55	93.1 Å²	93.1	46%	0.455	46%	0.461	S	S	.	.	H	α-helix	trans	-62	-39.8	175.7	0	0	0	0	0	112.7	E149 Q151 E155 E156 V157	E149-A153 WeakPolarHBondContact O-CB 3.42Å; E149-A153 PolarHBondContact O-N 3.37Å; Q151-A153 VanDerWaalsContact C-N 3.33Å; Q151-A153 PolarHBondContact O-N 3.27Å; A153-E155 VanDerWaalsContact C-N 3.35Å; A153-E156 PolarHBondContact O-N 3.39Å; A153-V157 VanDerWaalsContact O-CG2 3.32Å; A153-V157 WeakPolarHBondContact O-CG2 3.46Å; A153-V157 PolarHBondContact O-N 3.32Å
154	K	98.4	Very high	98	Very high	109 Å²	109	93.7 Å²	93.7	47%	0.474	46%	0.463	S	S	.	.	H	α-helix	trans	-64.2	-38.3	175	-77	166.3	-178.5	168.7	0	112.4	I150 Q151 A152 R158	I150-K154 HydrophobicContact CG2-CD 4.11Å; I150-K154 VanDerWaalsContact CG2-CE 3.48Å; I150-K154 WeakPolarHBondContact O-CD 3.43Å; I150-K154 VanDerWaalsContact O-CG 3.24Å; I150-K154 WeakPolarHBondContact O-CG 3.39Å; I150-K154 PolarHBondContact O-N 3.47Å; Q151-K154 WeakPolarHBondContact O-CB 3.28Å; Q151-K154 PolarHBondContact O-N 3.39Å; A152-K154 PolarHBondContact O-N 2.92Å; K154-R158 WeakPolarHBondContact O-CB 3.42Å; K154-R158 PolarHBondContact O-N 3.48Å
155	E	98.1	Very high	97.9	Very high	98 Å²	98	94.9 Å²	94.9	46%	0.458	47%	0.466	S	S	.	.	H	α-helix	trans	-69.3	-41.9	178.1	-74.5	172.5	-166.9	0	0	111.7	Q151 A152 A153 R158 R159	Q151-E155 PolarHBondContact NE2-OE1 3.43Å; Q151-E155 PolarHBondContact O-N 2.95Å; A152-E155 PolarHBondContact O-N 2.87Å; A153-E155 VanDerWaalsContact C-N 3.35Å; E155-R158 WeakPolarHBondContact O-CB 3.34Å; E155-R158 PolarHBondContact O-N 2.98Å; E155-R159 WeakPolarHBondContact O-CB 3.3Å; E155-R159 PolarHBondContact O-N 3.49Å
156	E	98	Very high	97.8	Very high	75 Å²	75	95.6 Å²	95.6	35%	0.35	47%	0.47	S	S	.	.	H	α-helix	trans	-62.2	-44.2	172.9	178.5	54.1	-153.1	0	0	111.9	A152 A153 R158 R159 L160	A152-E156 PolarHBondContact O-N 3.43Å; A153-E156 PolarHBondContact O-N 3.39Å; E156-R158 VanDerWaalsContact C-N 3.31Å; E156-R158 PolarHBondContact O-N 3.49Å; E156-R159 VanDerWaalsContact CD-CZ 3.47Å; E156-R159 WeakPolarHBondContact O-CB 3.45Å; E156-R159 PolarHBondContact O-N 2.86Å; E156-R159 VanDerWaalsContact O-N 3.15Å; E156-R159 IonicContact OE1-CZ 3.02Å; E156-R159 IonicContact OE1-NE 3.63Å; E156-R159 IonicContact OE1-NH1 2.9Å; E156-R159 IonicContact OE1-NH2 3.1Å; E156-R159 PolarHBondContact OE1-NH2 2.96Å; E156-R159 IonicContact OE2-CZ 3.97Å; E156-R159 IonicContact OE2-NE 2.61Å; E156-R159 PolarHBondContact OE2-NE 3.26Å; E156-R159 IonicContact OE2-NH2 3.03Å; E156-R159 PolarHBondContact OE2-NH2 2.87Å; E156-L160 HydrophobicContact CG-CD1 4.15Å; E156-L160 WeakPolarHBondContact O-CG 3.48Å; E156-L160 PolarHBondContact O-N 3.31Å; E156-L160 VanDerWaalsContact OE1-CD1 3.3Å; E156-L160 WeakPolarHBondContact OE1-CD1 3.5Å; E156-L160 WeakPolarHBondContact OE1-CG 3.11Å
157	V	98.3	Very high	97.6	Very high	69 Å²	69	99.2 Å²	99.2	42%	0.418	49%	0.486	S	S	.	.	H	α-helix	trans	-59.9	-40.2	173.1	167.9	0	0	0	0	111.7	A153 R161	A153-V157 VanDerWaalsContact O-CG2 3.32Å; A153-V157 WeakPolarHBondContact O-CG2 3.46Å; A153-V157 PolarHBondContact O-N 3.32Å; V157-R161 WeakPolarHBondContact O-CB 3.29Å; V157-R161 VanDerWaalsContact O-CG 3.31Å; V157-R161 WeakPolarHBondContact O-CG 3.48Å; V157-R161 PolarHBondContact O-N 2.86Å
158	R	98.3	Very high	97.5	Very high	167 Å²	167	98.5 Å²	98.5	63%	0.63	48%	0.482	S	S	*	.	H	α-helix	trans	-64.1	-42.7	175.1	-170.7	-174.1	-69	121.8	-5.4	111	K154 E155 E156 R161 G162	K154-R158 WeakPolarHBondContact O-CB 3.42Å; K154-R158 PolarHBondContact O-N 3.48Å; E155-R158 WeakPolarHBondContact O-CB 3.34Å; E155-R158 PolarHBondContact O-N 2.98Å; E156-R158 VanDerWaalsContact C-N 3.31Å; E156-R158 PolarHBondContact O-N 3.49Å; R158-R161 PolarHBondContact O-N 2.91Å; R158-G162 PolarHBondContact O-N 2.8Å
159	R	98	Very high	97.4	Very high	110 Å²	110	97.7 Å²	97.7	42%	0.415	48%	0.484	S	S	.	.	H	α-helix	trans	-63.1	-44.5	177.2	-168	-172	61.9	59.7	-25.5	112.1	E155 E156 G162 K163	E155-R159 WeakPolarHBondContact O-CB 3.3Å; E155-R159 PolarHBondContact O-N 3.49Å; E156-R159 VanDerWaalsContact CD-CZ 3.47Å; E156-R159 WeakPolarHBondContact O-CB 3.45Å; E156-R159 PolarHBondContact O-N 2.86Å; E156-R159 VanDerWaalsContact O-N 3.15Å; E156-R159 IonicContact OE1-CZ 3.02Å; E156-R159 IonicContact OE1-NE 3.63Å; E156-R159 IonicContact OE1-NH1 2.9Å; E156-R159 IonicContact OE1-NH2 3.1Å; E156-R159 PolarHBondContact OE1-NH2 2.96Å; E156-R159 IonicContact OE2-CZ 3.97Å; E156-R159 IonicContact OE2-NE 2.61Å; E156-R159 PolarHBondContact OE2-NE 3.26Å; E156-R159 IonicContact OE2-NH2 3.03Å; E156-R159 PolarHBondContact OE2-NH2 2.87Å; R159-G162 PolarHBondContact O-N 3.45Å; R159-K163 PolarHBondContact O-N 3.22Å; R159-K163 VanDerWaalsContact O-N 3.1Å
160	L	98	Very high	97.1	Very high	87 Å²	87	97.5 Å²	97.5	46%	0.455	49%	0.486	S	S	.	.	H	α-helix	trans	-66.4	-42.1	178.1	-70.8	171.1	0	0	0	111.9	E156 G162 K163 M164	E156-L160 HydrophobicContact CG-CD1 4.15Å; E156-L160 WeakPolarHBondContact O-CG 3.48Å; E156-L160 PolarHBondContact O-N 3.31Å; E156-L160 VanDerWaalsContact OE1-CD1 3.3Å; E156-L160 WeakPolarHBondContact OE1-CD1 3.5Å; E156-L160 WeakPolarHBondContact OE1-CG 3.11Å; L160-G162 VanDerWaalsContact C-N 3.26Å; L160-G162 PolarHBondContact O-N 3.21Å; L160-K163 PolarHBondContact O-N 3.48Å; L160-M164 WeakPolarHBondContact O-CB 3.26Å; L160-M164 PolarHBondContact O-N 3.13Å
161	R	98.1	Very high	96.8	Very high	167 Å²	167	97.7 Å²	97.7	63%	0.63	49%	0.488	S	S	*	.	H	α-helix	trans	-60	-35.7	172.2	-73.2	175.4	-172.4	-98.5	3.4	112.5	V157 R158 K165	V157-R161 WeakPolarHBondContact O-CB 3.29Å; V157-R161 VanDerWaalsContact O-CG 3.31Å; V157-R161 WeakPolarHBondContact O-CG 3.48Å; V157-R161 PolarHBondContact O-N 2.86Å; R158-R161 PolarHBondContact O-N 2.91Å; R161-K165 WeakPolarHBondContact O-CG 3.44Å; R161-K165 PolarHBondContact O-N 2.93Å; R161-K165 VanDerWaalsContact O-N 3.1Å
162	G	97	Very high	96.5	Very high	39 Å²	39	100.7 Å²	100.7	40%	0.402	50%	0.503	S	S	.	.	H	α-helix	trans	-60.6	-50.3	172.1	0	0	0	0	0	112.3	R158 R159 L160 M164 K165 T166	R158-G162 PolarHBondContact O-N 2.8Å; R159-G162 PolarHBondContact O-N 3.45Å; L160-G162 VanDerWaalsContact C-N 3.26Å; L160-G162 PolarHBondContact O-N 3.21Å; G162-M164 PolarHBondContact O-N 3.46Å; G162-K165 PolarHBondContact O-N 2.85Å; G162-T166 PolarHBondContact O-N 3.02Å
163	K	97.1	Very high	96.2	Very high	107 Å²	107	102.7 Å²	102.7	47%	0.465	51%	0.506	S	S	.	.	H	α-helix	trans	-62	-41.4	176.4	-70.3	-173.5	176.5	179.9	0	112.8	R159 L160 K165 T166 F167	R159-K163 PolarHBondContact O-N 3.22Å; R159-K163 VanDerWaalsContact O-N 3.1Å; L160-K163 PolarHBondContact O-N 3.48Å; K163-K165 PolarHBondContact O-N 3.28Å; K163-T166 WeakPolarHBondContact CA-OG1 3.33Å; K163-T166 PolarHBondContact O-N 3.48Å; K163-T166 PolarHBondContact O-OG1 2.83Å; K163-F167 HydrophobicContact CB-CE2 4.4Å; K163-F167 WeakPolarHBondContact O-CD2 3.41Å; K163-F167 PolarHBondContact O-N 2.89Å
164	M	96.7	Very high	95.7	Very high	113 Å²	113	105.5 Å²	105.5	56%	0.557	51%	0.512	S	S	*	.	H	α-helix	trans	-58.1	-48.6	177.1	-177.8	169.8	167.2	0	0	111	L160 G162 T166 F167 E168	L160-M164 WeakPolarHBondContact O-CB 3.26Å; L160-M164 PolarHBondContact O-N 3.13Å; G162-M164 PolarHBondContact O-N 3.46Å; M164-T166 VanDerWaalsContact C-N 3.31Å; M164-T166 PolarHBondContact O-N 2.89Å; M164-F167 PolarHBondContact O-N 2.86Å; M164-E168 WeakPolarHBondContact CE-OE1 3.44Å; M164-E168 WeakPolarHBondContact O-CG 3.5Å; M164-E168 PolarHBondContact O-N 3.48Å
165	K	96.9	Very high	95.3	Very high	148 Å²	148	105.9 Å²	105.9	64%	0.643	52%	0.516	S	S	*	.	H	α-helix	trans	-59.6	-36.3	174.7	-73.4	-175.8	174	-162.7	0	114.1	R161 G162 K163 E168 S169	R161-K165 WeakPolarHBondContact O-CG 3.44Å; R161-K165 PolarHBondContact O-N 2.93Å; R161-K165 VanDerWaalsContact O-N 3.1Å; G162-K165 PolarHBondContact O-N 2.85Å; K163-K165 PolarHBondContact O-N 3.28Å; K165-E168 WeakPolarHBondContact CA-OE2 3.39Å; K165-S169 WeakPolarHBondContact O-CB 3.31Å; K165-S169 PolarHBondContact O-N 3Å
166	T	95.4	Very high	94.8	Very high	79 Å²	79	103.7 Å²	103.7	49%	0.485	52%	0.52	S	S	.	.	H	α-helix	trans	-68.8	-34.7	174.9	50.5	0	0	0	0	112.3	G162 K163 M164 L170	G162-T166 PolarHBondContact O-N 3.02Å; K163-T166 WeakPolarHBondContact CA-OG1 3.33Å; K163-T166 PolarHBondContact O-N 3.48Å; K163-T166 PolarHBondContact O-OG1 2.83Å; M164-T166 VanDerWaalsContact C-N 3.31Å; M164-T166 PolarHBondContact O-N 2.89Å; T166-L170 VanDerWaalsContact O-CG 3.29Å; T166-L170 WeakPolarHBondContact O-CG 3.49Å; T166-L170 PolarHBondContact O-N 3.42Å; T166-L170 VanDerWaalsContact O-N 3.1Å
167	F	94.7	Very high	94.3	Very high	139 Å²	139	105.2 Å²	105.2	61%	0.61	53%	0.526	S	S	*	.	H	α-helix	trans	-71.3	-41.7	173.6	-70.2	-60.4	0	0	0	112.2	K163 M164 S169 L170 D171	K163-F167 HydrophobicContact CB-CE2 4.4Å; K163-F167 WeakPolarHBondContact O-CD2 3.41Å; K163-F167 PolarHBondContact O-N 2.89Å; M164-F167 PolarHBondContact O-N 2.86Å; F167-S169 VanDerWaalsContact C-N 3.3Å; F167-S169 PolarHBondContact O-N 3.1Å; F167-L170 HydrophobicContact CD1-CD1 4.48Å; F167-L170 PolarHBondContact O-N 3.27Å; F167-L170 VanDerWaalsContact O-N 3.15Å; F167-D171 PolarHBondContact O-N 2.82Å
168	E	95.6	Very high	93.9	Very high	97 Å²	97	109 Å²	109	45%	0.453	53%	0.533	S	S	.	.	H	α-helix	trans	-56.6	-44	172.2	-69.1	165	173.1	0	0	111.4	M164 K165 L170 D171 M172	M164-E168 WeakPolarHBondContact CE-OE1 3.44Å; M164-E168 WeakPolarHBondContact O-CG 3.5Å; M164-E168 PolarHBondContact O-N 3.48Å; K165-E168 WeakPolarHBondContact CA-OE2 3.39Å; E168-L170 VanDerWaalsContact C-N 3.35Å; E168-L170 PolarHBondContact O-N 3.12Å; E168-D171 PolarHBondContact O-N 3.5Å; E168-M172 WeakPolarHBondContact O-CG 3.36Å; E168-M172 PolarHBondContact O-N 3.25Å; E168-M172 VanDerWaalsContact O-N 3.12Å
169	S	94.9	Very high	93.4	Very high	81 Å²	81	103.2 Å²	103.2	57%	0.566	53%	0.525	S	S	*	.	H	α-helix	trans	-65.6	-34.3	176.5	-176.1	0	0	0	0	113.6	K165 F167 L173	K165-S169 WeakPolarHBondContact O-CB 3.31Å; K165-S169 PolarHBondContact O-N 3Å; F167-S169 VanDerWaalsContact C-N 3.3Å; F167-S169 PolarHBondContact O-N 3.1Å; S169-L173 PolarHBondContact O-N 3.35Å
170	L	92.8	Very high	92.8	Very high	98 Å²	98	104.6 Å²	104.6	51%	0.513	54%	0.536	S	S	.	.	H	α-helix	trans	-73.8	-41.7	177.9	-75.9	167.4	0	0	0	110.9	T166 F167 E168 L173 L174	T166-L170 VanDerWaalsContact O-CG 3.29Å; T166-L170 WeakPolarHBondContact O-CG 3.49Å; T166-L170 PolarHBondContact O-N 3.42Å; T166-L170 VanDerWaalsContact O-N 3.1Å; F167-L170 HydrophobicContact CD1-CD1 4.48Å; F167-L170 PolarHBondContact O-N 3.27Å; F167-L170 VanDerWaalsContact O-N 3.15Å; E168-L170 VanDerWaalsContact C-N 3.35Å; E168-L170 PolarHBondContact O-N 3.12Å; L170-L173 PolarHBondContact O-N 2.93Å; L170-L174 WeakPolarHBondContact O-CG 3.46Å; L170-L174 PolarHBondContact O-N 3.44Å
171	D	92.8	Very high	92.2	Very high	82 Å²	82	104 Å²	104	44%	0.439	54%	0.536	S	S	.	.	H	α-helix	trans	-61.4	-45.1	178	-170.8	63.3	0	0	0	111.5	F167 E168 L173 L174 Q175	F167-D171 PolarHBondContact O-N 2.82Å; E168-D171 PolarHBondContact O-N 3.5Å; D171-L173 VanDerWaalsContact C-N 3.29Å; D171-L173 PolarHBondContact O-N 3.04Å; D171-L174 PolarHBondContact O-N 3.19Å; D171-Q175 WeakPolarHBondContact O-CB 3.27Å; D171-Q175 WeakPolarHBondContact O-CG 3.4Å; D171-Q175 PolarHBondContact O-N 2.84Å; D171-Q175 PolarHBondContact OD2-NE2 2.9Å
172	M	92.1	Very high	91.7	Very high	137 Å²	137	100.6 Å²	100.6	68%	0.675	53%	0.527	S	S	*	.	H	α-helix	trans	-55.9	-39.9	174.3	-76.1	-62	-52.6	0	0	113.4	E168 G176	E168-M172 WeakPolarHBondContact O-CG 3.36Å; E168-M172 PolarHBondContact O-N 3.25Å; E168-M172 VanDerWaalsContact O-N 3.12Å; M172-G176 PolarHBondContact O-N 3.35Å
173	L	90.7	Very high	91.3	Very high	100 Å²	100	101.6 Å²	101.6	52%	0.524	53%	0.528	S	S	.	.	H	α-helix	trans	-71.7	-42.5	179	-173.4	149.3	0	0	0	111.5	S169 L170 D171 G176 Q177	S169-L173 PolarHBondContact O-N 3.35Å; L170-L173 PolarHBondContact O-N 2.93Å; D171-L173 VanDerWaalsContact C-N 3.29Å; D171-L173 PolarHBondContact O-N 3.04Å; L173-G176 PolarHBondContact O-N 3.46Å; L173-Q177 PolarHBondContact O-N 3.21Å
174	L	88.9	Confident	90.8	Very high	113 Å²	113	100.7 Å²	100.7	59%	0.592	53%	0.527	S	S	*	.	H	α-helix	trans	-66.3	-36.6	177.2	-69.3	172	0	0	0	112.4	L170 D171 R178	L170-L174 WeakPolarHBondContact O-CG 3.46Å; L170-L174 PolarHBondContact O-N 3.44Å; D171-L174 PolarHBondContact O-N 3.19Å; L174-R178 PolarHBondContact O-N 2.95Å
175	Q	89.5	Confident	90.3	Very high	118 Å²	118	99.3 Å²	99.3	55%	0.551	52%	0.52	S	S	*	.	H	α-helix	trans	-71	-38.5	173.6	-69.6	-161.2	40.8	0	0	112	D171 Q177 R178	D171-Q175 WeakPolarHBondContact O-CB 3.27Å; D171-Q175 WeakPolarHBondContact O-CG 3.4Å; D171-Q175 PolarHBondContact O-N 2.84Å; D171-Q175 PolarHBondContact OD2-NE2 2.9Å; Q175-Q177 PolarHBondContact O-N 3.48Å; Q175-R178 WeakPolarHBondContact O-CB 3.49Å; Q175-R178 PolarHBondContact O-N 2.91Å
176	G	88.1	Confident	89.9	Confident	52 Å²	52	97.4 Å²	97.4	54%	0.536	52%	0.522	S	S	.	.	H	α-helix	trans	-59.1	-43.6	177.6	0	0	0	0	0	113.4	M172 L173 R178	M172-G176 PolarHBondContact O-N 3.35Å; L173-G176 PolarHBondContact O-N 3.46Å; G176-R178 VanDerWaalsContact C-N 3.33Å; G176-R178 PolarHBondContact O-N 2.89Å
177	Q	86.8	Confident	89.6	Confident	106 Å²	106	99.9 Å²	99.9	50%	0.495	53%	0.532	S	S	.	.	H	α-helix	trans	-78.3	-13.1	-179.6	-67.8	-178.9	-20.5	0	0	114.1	L173 Q175 G179 E180 V181	L173-Q177 PolarHBondContact O-N 3.21Å; Q175-Q177 PolarHBondContact O-N 3.48Å; Q177-G179 PolarHBondContact O-N 3.32Å; Q177-E180 PolarHBondContact O-N 2.86Å; Q177-V181 WeakPolarHBondContact O-CG2 3.38Å; Q177-V181 PolarHBondContact O-N 2.92Å
178	R	89.1	Confident	89.1	Confident	150 Å²	150	95.8 Å²	95.8	57%	0.566	52%	0.515	S	S	*	.	H	α-helix	trans	-58.3	-48	-175.2	175.2	174.7	-70.6	-75.6	-2.3	112.7	L174 Q175 G176 E180 V181 E182	L174-R178 PolarHBondContact O-N 2.95Å; Q175-R178 WeakPolarHBondContact O-CB 3.49Å; Q175-R178 PolarHBondContact O-N 2.91Å; G176-R178 VanDerWaalsContact C-N 3.33Å; G176-R178 PolarHBondContact O-N 2.89Å; R178-E180 PolarHBondContact O-N 3.38Å; R178-V181 PolarHBondContact O-N 3.12Å; R178-E182 VanDerWaalsContact CD-OE1 3.3Å; R178-E182 WeakPolarHBondContact CD-OE1 3.43Å; R178-E182 VanDerWaalsContact CG-CD 3.46Å; R178-E182 HydrophobicContact CG-CG 4.3Å; R178-E182 WeakPolarHBondContact CG-OE1 3.49Å; R178-E182 IonicContact CZ-OE1 3.81Å; R178-E182 IonicContact NH1-OE1 2.62Å; R178-E182 PolarHBondContact NH1-OE1 3.33Å; R178-E182 WeakPolarHBondContact O-CB 3.37Å; R178-E182 WeakPolarHBondContact O-CG 3.3Å; R178-E182 PolarHBondContact O-N 3.34Å
179	G	87.7	Confident	88.6	Confident	44 Å²	44	92.9 Å²	92.9	45%	0.454	51%	0.512	S	S	.	.	H	α-helix	trans	-66.2	-36.3	-176.7	0	0	0	0	0	113.3	Q177 E182 S183	Q177-G179 PolarHBondContact O-N 3.32Å; G179-E182 PolarHBondContact O-N 3.47Å; G179-S183 WeakPolarHBondContact O-CB 3.42Å; G179-S183 PolarHBondContact O-N 2.94Å
180	E	86.1	Confident	88.1	Confident	140 Å²	140	96.9 Å²	96.9	65%	0.654	53%	0.532	S	S	*	.	H	α-helix	trans	-65.1	-42.9	175.5	-65.1	176	-161.9	0	0	111.2	Q177 R178 M184	Q177-E180 PolarHBondContact O-N 2.86Å; R178-E180 PolarHBondContact O-N 3.38Å; E180-M184 WeakPolarHBondContact O-CB 3.39Å; E180-M184 PolarHBondContact O-N 3.28Å
181	V	86.4	Confident	87.8	Confident	74 Å²	74	95 Å²	95	45%	0.448	53%	0.527	S	S	.	.	H	α-helix	trans	-67.6	-41.2	176.2	174.6	0	0	0	0	111.5	Q177 R178 M184 I185	Q177-V181 WeakPolarHBondContact O-CG2 3.38Å; Q177-V181 PolarHBondContact O-N 2.92Å; R178-V181 PolarHBondContact O-N 3.12Å; V181-M184 PolarHBondContact O-N 3.08Å; V181-I185 HydrophobicContact CG1-CD1 3.81Å; V181-I185 HydrophobicContact CG1-CG1 4.49Å; V181-I185 VanDerWaalsContact O-CG1 3.27Å; V181-I185 WeakPolarHBondContact O-CG1 3.37Å; V181-I185 PolarHBondContact O-N 3.33Å
182	E	87.4	Confident	87.6	Confident	96 Å²	96	97.4 Å²	97.4	45%	0.449	54%	0.536	S	S	.	.	H	α-helix	trans	-66.5	-37.6	177.2	-75	169.6	-170.7	0	0	111.8	R178 G179 T186	R178-E182 VanDerWaalsContact CD-OE1 3.3Å; R178-E182 WeakPolarHBondContact CD-OE1 3.43Å; R178-E182 VanDerWaalsContact CG-CD 3.46Å; R178-E182 HydrophobicContact CG-CG 4.3Å; R178-E182 WeakPolarHBondContact CG-OE1 3.49Å; R178-E182 IonicContact CZ-OE1 3.81Å; R178-E182 IonicContact NH1-OE1 2.62Å; R178-E182 PolarHBondContact NH1-OE1 3.33Å; R178-E182 WeakPolarHBondContact O-CB 3.37Å; R178-E182 WeakPolarHBondContact O-CG 3.3Å; R178-E182 PolarHBondContact O-N 3.34Å; G179-E182 PolarHBondContact O-N 3.47Å; E182-T186 WeakPolarHBondContact O-CB 3.22Å; E182-T186 PolarHBondContact O-N 2.95Å; E182-T186 VanDerWaalsContact O-N 3.07Å; E182-T186 PolarHBondContact O-OG1 3.04Å
183	S	88.9	Confident	87.3	Confident	59 Å²	59	92.7 Å²	92.7	41%	0.413	52%	0.522	S	S	.	.	H	α-helix	trans	-63.3	-49.5	170.6	-165.2	0	0	0	0	111.4	G179 I185 T186 D187	G179-S183 WeakPolarHBondContact O-CB 3.42Å; G179-S183 PolarHBondContact O-N 2.94Å; S183-I185 VanDerWaalsContact C-N 3.32Å; S183-I185 PolarHBondContact O-N 2.69Å; S183-T186 CarbonylContact O-C 3.56Å; S183-T186 WeakPolarHBondContact O-CA 3.4Å; S183-T186 WeakPolarHBondContact O-CB 3.43Å; S183-T186 PolarHBondContact O-N 3.42Å; S183-D187 VanDerWaalsContact O-CG 3.31Å; S183-D187 PolarHBondContact O-N 2.96Å; S183-D187 PolarHBondContact OG-OD2 3.03Å
184	M	85.3	Confident	87.1	Confident	89 Å²	89	88.2 Å²	88.2	44%	0.438	50%	0.5	S	S	.	.	H	α-helix	trans	-57	-43.3	179.3	-174.9	-171.8	-58.1	0	0	112.3	E180 V181 T186 M188	E180-M184 WeakPolarHBondContact O-CB 3.39Å; E180-M184 PolarHBondContact O-N 3.28Å; V181-M184 PolarHBondContact O-N 3.08Å; M184-T186 VanDerWaalsContact C-N 3.32Å; M184-T186 PolarHBondContact O-N 2.83Å; M184-M188 HydrophobicContact CG-SD 4.11Å; M184-M188 WeakPolarHBondContact O-CB 3.4Å; M184-M188 WeakPolarHBondContact O-CG 3.22Å; M184-M188 PolarHBondContact O-N 3.41Å; M184-M188 VanDerWaalsContact O-N 3.11Å
185	I	86.6	Confident	87	Confident	83 Å²	83	86.7 Å²	86.7	43%	0.426	50%	0.495	S	S	.	.	H	α-helix	trans	-64.3	-38.8	175.5	-69.2	165.8	0	0	0	111.1	V181 S183 G189 L198	V181-I185 HydrophobicContact CG1-CD1 3.81Å; V181-I185 HydrophobicContact CG1-CG1 4.49Å; V181-I185 VanDerWaalsContact O-CG1 3.27Å; V181-I185 WeakPolarHBondContact O-CG1 3.37Å; V181-I185 PolarHBondContact O-N 3.33Å; S183-I185 VanDerWaalsContact C-N 3.32Å; S183-I185 PolarHBondContact O-N 2.69Å; I185-G189 PolarHBondContact O-N 3.14Å; I185-L198 HydrophobicContact CG1-CD2 4.25Å
186	T	88.8	Confident	87	Confident	109 Å²	109	86 Å²	86	67%	0.669	49%	0.492	S	S	*	.	H	α-helix	trans	-66.8	-45.9	178.7	-55.8	0	0	0	0	111.4	E182 S183 M184 M188 G189	E182-T186 WeakPolarHBondContact O-CB 3.22Å; E182-T186 PolarHBondContact O-N 2.95Å; E182-T186 VanDerWaalsContact O-N 3.07Å; E182-T186 PolarHBondContact O-OG1 3.04Å; S183-T186 CarbonylContact O-C 3.56Å; S183-T186 WeakPolarHBondContact O-CA 3.4Å; S183-T186 WeakPolarHBondContact O-CB 3.43Å; S183-T186 PolarHBondContact O-N 3.42Å; M184-T186 VanDerWaalsContact C-N 3.32Å; M184-T186 PolarHBondContact O-N 2.83Å; T186-M188 VanDerWaalsContact C-N 3.33Å; T186-M188 PolarHBondContact O-N 2.88Å; T186-G189 PolarHBondContact O-N 3.32Å
187	D	87.9	Confident	87	Confident	130 Å²	130	88 Å²	88	70%	0.695	49%	0.487	S	S	*	.	H	α-helix	trans	-66.2	-32.8	-179.6	-65.6	-34.9	0	0	0	112.6	S183 G189	S183-D187 VanDerWaalsContact O-CG 3.31Å; S183-D187 PolarHBondContact O-N 2.96Å; S183-D187 PolarHBondContact OG-OD2 3.03Å; D187-G189 VanDerWaalsContact C-N 3.34Å
188	M	85.3	Confident	87.1	Confident	53 Å²	53	85.7 Å²	85.7	26%	0.261	48%	0.478	S	S	.	.	H	α-helix	trans	-73.5	-24.3	175.7	-71.3	175.7	65	0	0	113.4	M184 T186 A194 Q197 L198	M184-M188 HydrophobicContact CG-SD 4.11Å; M184-M188 WeakPolarHBondContact O-CB 3.4Å; M184-M188 WeakPolarHBondContact O-CG 3.22Å; M184-M188 PolarHBondContact O-N 3.41Å; M184-M188 VanDerWaalsContact O-N 3.11Å; T186-M188 VanDerWaalsContact C-N 3.33Å; T186-M188 PolarHBondContact O-N 2.88Å; M188-A194 HydrophobicContact CB-CB 3.97Å; M188-A194 HydrophobicContact CE-CB 4.13Å; M188-A194 WeakPolarHBondContact CE-O 3.47Å; M188-A194 WeakPolarHBondContact O-CB 3.44Å; M188-Q197 HydrophobicContact CE-CB 3.53Å; M188-L198 HydrophobicContact CE-CD2 4.29Å; M188-L198 HydrophobicContact CE-CG 3.86Å; M188-L198 HydrophobicContact SD-CD2 4.19Å; M188-L198 HydrophobicContact SD-CG 4.36Å
189	G	84.1	Confident	87.2	Confident	37 Å²	37	81.2 Å²	81.2	38%	0.381	47%	0.47	S	S	.	.			trans	65.4	-179	177.9	0	0	0	0	0	115.2	I185 T186 D187 S191 A194	I185-G189 PolarHBondContact O-N 3.14Å; T186-G189 PolarHBondContact O-N 3.32Å; D187-G189 VanDerWaalsContact C-N 3.34Å; G189-S191 PolarHBondContact O-N 3.49Å; G189-A194 VanDerWaalsContact O-CB 3.28Å; G189-A194 WeakPolarHBondContact O-CB 3.48Å
190	V	84.2	Confident	87.4	Confident	164 Å²	164	83.2 Å²	83.2	99%	0.994	47%	0.469	S	S	*	.	S	Bend	trans	-94.1	72	-174.9	-162.5	0	0	0	0	110.7
191	S	87.3	Confident	87.5	Confident	59 Å²	59	82.3 Å²	82.3	41%	0.413	46%	0.46	S	S	.	.			trans	-124.9	156.1	178.2	74.2	0	0	0	0	112.5	G189 G193 A194 V195	G189-S191 PolarHBondContact O-N 3.49Å; S191-G193 VanDerWaalsContact C-N 3.28Å; S191-G193 PolarHBondContact O-N 3.47Å; S191-A194 WeakPolarHBondContact O-CB 3.34Å; S191-A194 PolarHBondContact O-N 2.89Å; S191-A194 VanDerWaalsContact O-N 3.09Å; S191-A194 WeakPolarHBondContact OG-CB 3.4Å; S191-A194 PolarHBondContact OG-N 3.4Å; S191-A194 VanDerWaalsContact OG-N 3.15Å; S191-V195 PolarHBondContact O-N 2.61Å
192	Q	88	Confident	87.8	Confident	133 Å²	133	82.8 Å²	82.8	62%	0.621	47%	0.466	S	S	*	.	H	α-helix	trans	-57.7	-41.2	176.5	-179.2	60.8	26.3	0	0	111.9	A194 V195 E196	Q192-A194 VanDerWaalsContact C-N 3.34Å; Q192-A194 PolarHBondContact O-N 3.37Å; Q192-V195 PolarHBondContact O-N 3.27Å; Q192-E196 PolarHBondContact NE2-OE1 2.99Å; Q192-E196 PolarHBondContact O-N 3.28Å
193	G	86.2	Confident	88.1	Confident	37 Å²	37	83.9 Å²	83.9	38%	0.381	47%	0.474	S	S	.	.	H	α-helix	trans	-64.8	-33.7	175.6	0	0	0	0	0	113.4	S191 E196 Q197	S191-G193 VanDerWaalsContact C-N 3.28Å; S191-G193 PolarHBondContact O-N 3.47Å; G193-E196 PolarHBondContact O-N 3.29Å; G193-Q197 WeakPolarHBondContact O-CG 3.35Å; G193-Q197 PolarHBondContact O-N 2.98Å
194	A	87.1	Confident	88.3	Confident	7 Å²	7	83.9 Å²	83.9	6%	0.058	47%	0.474	C	S	.	.	H	α-helix	trans	-65	-41	173.7	0	0	0	0	0	112	M188 G189 S191 Q192 Q197 L198	M188-A194 HydrophobicContact CB-CB 3.97Å; M188-A194 HydrophobicContact CE-CB 4.13Å; M188-A194 WeakPolarHBondContact CE-O 3.47Å; M188-A194 WeakPolarHBondContact O-CB 3.44Å; G189-A194 VanDerWaalsContact O-CB 3.28Å; G189-A194 WeakPolarHBondContact O-CB 3.48Å; S191-A194 WeakPolarHBondContact O-CB 3.34Å; S191-A194 PolarHBondContact O-N 2.89Å; S191-A194 VanDerWaalsContact O-N 3.09Å; S191-A194 WeakPolarHBondContact OG-CB 3.4Å; S191-A194 PolarHBondContact OG-N 3.4Å; S191-A194 VanDerWaalsContact OG-N 3.15Å; Q192-A194 VanDerWaalsContact C-N 3.34Å; Q192-A194 PolarHBondContact O-N 3.37Å; A194-Q197 PolarHBondContact O-N 2.84Å; A194-L198 WeakPolarHBondContact O-CB 3.34Å; A194-L198 WeakPolarHBondContact O-CG 3.35Å; A194-L198 PolarHBondContact O-N 2.97Å
195	V	87.4	Confident	88.7	Confident	81 Å²	81	85.6 Å²	85.6	49%	0.491	48%	0.484	S	S	.	.	H	α-helix	trans	-63.9	-40.3	175.5	177.9	0	0	0	0	111.4	S191 Q192 S199	S191-V195 PolarHBondContact O-N 2.61Å; Q192-V195 PolarHBondContact O-N 3.27Å; V195-S199 WeakPolarHBondContact O-CB 3.46Å; V195-S199 PolarHBondContact O-N 3.49Å; V195-S199 PolarHBondContact O-OG 3.07Å
196	E	89.4	Confident	89.1	Confident	104 Å²	104	88.3 Å²	88.3	49%	0.486	49%	0.493	S	S	.	.	H	α-helix	trans	-64.7	-43.8	175.8	-73.5	167.8	-163.9	0	0	111.9	Q192 G193 S199 I200	Q192-E196 PolarHBondContact NE2-OE1 2.99Å; Q192-E196 PolarHBondContact O-N 3.28Å; G193-E196 PolarHBondContact O-N 3.29Å; E196-S199 WeakPolarHBondContact O-CB 3.45Å; E196-S199 PolarHBondContact O-N 3Å; E196-I200 WeakPolarHBondContact O-CG1 3.47Å; E196-I200 PolarHBondContact O-N 3.22Å
197	Q	88.1	Confident	89.4	Confident	93 Å²	93	89.6 Å²	89.6	44%	0.435	49%	0.489	S	S	.	.	H	α-helix	trans	-66.3	-42.8	176.2	-69.6	-58.6	-34.9	0	0	112.7	M188 G193 A194 S199 I200 Y201	M188-Q197 HydrophobicContact CE-CB 3.53Å; G193-Q197 WeakPolarHBondContact O-CG 3.35Å; G193-Q197 PolarHBondContact O-N 2.98Å; A194-Q197 PolarHBondContact O-N 2.84Å; Q197-S199 PolarHBondContact O-N 3.37Å; Q197-I200 PolarHBondContact O-N 3.05Å; Q197-I200 VanDerWaalsContact O-N 3.16Å; Q197-Y201 VanDerWaalsContact O-CD2 3.29Å; Q197-Y201 WeakPolarHBondContact O-CD2 3.24Å; Q197-Y201 PolarHBondContact O-N 2.93Å
198	L	87.6	Confident	89.7	Confident	57 Å²	57	88.2 Å²	88.2	30%	0.298	48%	0.478	S	S	.	.	H	α-helix	trans	-59.9	-36.1	172.3	-74.1	171.5	0	0	0	111.7	I185 M188 A194 Y201 C202	I185-L198 HydrophobicContact CG1-CD2 4.25Å; M188-L198 HydrophobicContact CE-CD2 4.29Å; M188-L198 HydrophobicContact CE-CG 3.86Å; M188-L198 HydrophobicContact SD-CD2 4.19Å; M188-L198 HydrophobicContact SD-CG 4.36Å; A194-L198 WeakPolarHBondContact O-CB 3.34Å; A194-L198 WeakPolarHBondContact O-CG 3.35Å; A194-L198 PolarHBondContact O-N 2.97Å; L198-Y201 PolarHBondContact O-N 3.26Å; L198-C202 WeakPolarHBondContact O-CB 3.4Å; L198-C202 PolarHBondContact O-N 2.88Å; L198-C202 PolarHBondContact O-SG 3.31Å
199	S	90.8	Very high	90.1	Very high	57 Å²	57	92.6 Å²	92.6	40%	0.399	49%	0.493	S	S	.	.	H	α-helix	trans	-66.3	-42.8	175	-58.9	0	0	0	0	111.8	V195 E196 Q197 C202 I203	V195-S199 WeakPolarHBondContact O-CB 3.46Å; V195-S199 PolarHBondContact O-N 3.49Å; V195-S199 PolarHBondContact O-OG 3.07Å; E196-S199 WeakPolarHBondContact O-CB 3.45Å; E196-S199 PolarHBondContact O-N 3Å; Q197-S199 PolarHBondContact O-N 3.37Å; S199-C202 PolarHBondContact O-N 3.33Å; S199-I203 WeakPolarHBondContact O-CB 3.22Å; S199-I203 WeakPolarHBondContact O-CD1 3.31Å; S199-I203 VanDerWaalsContact O-CG1 3.24Å; S199-I203 WeakPolarHBondContact O-CG1 3.45Å; S199-I203 PolarHBondContact O-N 2.93Å
200	I	92.6	Very high	90.6	Very high	85 Å²	85	94.2 Å²	94.2	44%	0.436	49%	0.493	S	S	.	.	H	α-helix	trans	-61.7	-44.3	174.9	-68.1	163.4	0	0	0	111	E196 Q197 I203 S204	E196-I200 WeakPolarHBondContact O-CG1 3.47Å; E196-I200 PolarHBondContact O-N 3.22Å; Q197-I200 PolarHBondContact O-N 3.05Å; Q197-I200 VanDerWaalsContact O-N 3.16Å; I200-I203 PolarHBondContact O-N 3.35Å; I200-S204 WeakPolarHBondContact O-CB 3.43Å; I200-S204 PolarHBondContact O-N 2.84Å; I200-S204 PolarHBondContact O-OG 2.86Å
201	Y	89.4	Confident	91.1	Very high	122 Å²	122	90.4 Å²	90.4	48%	0.478	47%	0.467	S	S	.	.	H	α-helix	trans	-62.2	-46.4	174.8	-75.2	-54.5	0	0	0	111.9	Q197 L198 I203 S204 L205	Q197-Y201 VanDerWaalsContact O-CD2 3.29Å; Q197-Y201 WeakPolarHBondContact O-CD2 3.24Å; Q197-Y201 PolarHBondContact O-N 2.93Å; L198-Y201 PolarHBondContact O-N 3.26Å; Y201-I203 PolarHBondContact O-N 3.09Å; Y201-S204 PolarHBondContact O-N 2.98Å; Y201-L205 WeakPolarHBondContact O-CB 3.45Å; Y201-L205 WeakPolarHBondContact O-CG 3.27Å; Y201-L205 PolarHBondContact O-N 3.34Å
202	C	91.1	Very high	91.4	Very high	84 Å²	84	93.2 Å²	93.2	57%	0.568	48%	0.477	S	S	*	.	H	α-helix	trans	-58.9	-44	176.7	-71	0	0	0	0	112.5	L198 S199 K206	L198-C202 WeakPolarHBondContact O-CB 3.4Å; L198-C202 PolarHBondContact O-N 2.88Å; L198-C202 PolarHBondContact O-SG 3.31Å; S199-C202 PolarHBondContact O-N 3.33Å; C202-K206 VanDerWaalsContact O-CB 3.26Å; C202-K206 WeakPolarHBondContact O-CB 3.49Å; C202-K206 PolarHBondContact O-N 2.95Å
203	I	95.2	Very high	91.7	Very high	119 Å²	119	92.3 Å²	92.3	61%	0.61	47%	0.471	S	S	*	.	H	α-helix	trans	-65.1	-42.5	177.5	-69.2	164.4	0	0	0	110.9	S199 I200 Y201 K206 K207	S199-I203 WeakPolarHBondContact O-CB 3.22Å; S199-I203 WeakPolarHBondContact O-CD1 3.31Å; S199-I203 VanDerWaalsContact O-CG1 3.24Å; S199-I203 WeakPolarHBondContact O-CG1 3.45Å; S199-I203 PolarHBondContact O-N 2.93Å; I200-I203 PolarHBondContact O-N 3.35Å; Y201-I203 PolarHBondContact O-N 3.09Å; I203-K206 PolarHBondContact O-N 3.13Å; I203-K207 WeakPolarHBondContact O-CB 3.33Å; I203-K207 PolarHBondContact O-N 3.32Å
204	S	93.3	Very high	92.2	Very high	59 Å²	59	92.5 Å²	92.5	41%	0.413	47%	0.472	S	S	.	.	H	α-helix	trans	-66.3	-47.2	179.9	-57.3	0	0	0	0	111.7	I200 Y201 K206 K207 E208	I200-S204 WeakPolarHBondContact O-CB 3.43Å; I200-S204 PolarHBondContact O-N 2.84Å; I200-S204 PolarHBondContact O-OG 2.86Å; Y201-S204 PolarHBondContact O-N 2.98Å; S204-K206 VanDerWaalsContact C-N 3.33Å; S204-K206 PolarHBondContact O-N 2.85Å; S204-K207 WeakPolarHBondContact O-CB 3.34Å; S204-K207 PolarHBondContact O-N 2.8Å; S204-E208 PolarHBondContact O-N 2.93Å
205	L	92.1	Very high	92.6	Very high	125 Å²	125	95.6 Å²	95.6	65%	0.654	49%	0.494	S	S	*	.	H	α-helix	trans	-61.7	-40	175.2	-72.1	170.3	0	0	0	112	Y201 E208 Y209	Y201-L205 WeakPolarHBondContact O-CB 3.45Å; Y201-L205 WeakPolarHBondContact O-CG 3.27Å; Y201-L205 PolarHBondContact O-N 3.34Å; L205-E208 PolarHBondContact O-N 3.1Å; L205-Y209 WeakPolarHBondContact O-CB 3.41Å; L205-Y209 PolarHBondContact O-N 2.83Å
206	K	94.8	Very high	92.9	Very high	139 Å²	139	97.8 Å²	97.8	60%	0.604	50%	0.502	S	S	*	.	H	α-helix	trans	-62.9	-44.2	174.6	-178	178.2	177.9	-177.9	0	111.8	C202 I203 S204 Y209 D210	C202-K206 VanDerWaalsContact O-CB 3.26Å; C202-K206 WeakPolarHBondContact O-CB 3.49Å; C202-K206 PolarHBondContact O-N 2.95Å; I203-K206 PolarHBondContact O-N 3.13Å; S204-K206 VanDerWaalsContact C-N 3.33Å; S204-K206 PolarHBondContact O-N 2.85Å; K206-Y209 PolarHBondContact O-N 2.98Å; K206-D210 PolarHBondContact O-N 3.07Å
207	K	96.1	Very high	93.2	Very high	136 Å²	136	99.5 Å²	99.5	59%	0.591	51%	0.508	S	S	*	.	H	α-helix	trans	-60.5	-46.4	177.2	-175.4	-174.8	176.5	-170.5	0	111.3	I203 S204 D210 N211	I203-K207 WeakPolarHBondContact O-CB 3.33Å; I203-K207 PolarHBondContact O-N 3.32Å; S204-K207 WeakPolarHBondContact O-CB 3.34Å; S204-K207 PolarHBondContact O-N 2.8Å; K207-D210 PolarHBondContact O-N 2.82Å; K207-N211 WeakPolarHBondContact O-CB 3.48Å; K207-N211 PolarHBondContact O-N 2.88Å; K207-N211 PolarHBondContact O-ND2 3.27Å
208	E	93.7	Very high	93.6	Very high	101 Å²	101	98.4 Å²	98.4	47%	0.472	51%	0.511	S	S	.	.	H	α-helix	trans	-67.9	-35.7	177.2	-69	-48.7	126.4	0	0	112.9	S204 L205 N211 L212	S204-E208 PolarHBondContact O-N 2.93Å; L205-E208 PolarHBondContact O-N 3.1Å; E208-N211 WeakPolarHBondContact O-CB 3.41Å; E208-N211 PolarHBondContact O-N 3Å; E208-N211 PolarHBondContact OE1-ND2 3.46Å; E208-N211 VanDerWaalsContact OE1-ND2 3.11Å; E208-N211 PolarHBondContact OE2-ND2 2.84Å; E208-L212 WeakPolarHBondContact O-CB 3.47Å; E208-L212 WeakPolarHBondContact O-CG 3.34Å; E208-L212 PolarHBondContact O-N 3.4Å
209	Y	93.2	Very high	93.9	Very high	146 Å²	146	99.3 Å²	99.3	57%	0.573	52%	0.522	S	S	*	.	H	α-helix	trans	-61.4	-46.4	170.9	173.4	-92.9	0	0	0	112.1	L205 K206 N211 L212 K213	L205-Y209 WeakPolarHBondContact O-CB 3.41Å; L205-Y209 PolarHBondContact O-N 2.83Å; K206-Y209 PolarHBondContact O-N 2.98Å; Y209-N211 VanDerWaalsContact C-N 3.35Å; Y209-L212 PolarHBondContact O-N 2.98Å; Y209-K213 HydrophobicContact CD1-CD 4.5Å; Y209-K213 HydrophobicContact CE1-CD 3.73Å; Y209-K213 WeakPolarHBondContact O-CB 3.33Å; Y209-K213 PolarHBondContact O-N 2.63Å
210	D	94.9	Very high	94	Very high	71 Å²	71	100.6 Å²	100.6	38%	0.38	52%	0.524	S	S	.	.	H	α-helix	trans	-67.7	-34.4	178.6	-78.9	-39.2	0	0	0	111.6	K206 K207 K213 G214	K206-D210 PolarHBondContact O-N 3.07Å; K207-D210 PolarHBondContact O-N 2.82Å; D210-K213 IonicContact OD1-NZ 2.75Å; D210-G214 PolarHBondContact O-N 3.41Å
211	N	95.1	Very high	94.2	Very high	83 Å²	83	100.5 Å²	100.5	44%	0.444	53%	0.525	S	S	.	.	H	α-helix	trans	-60.5	-51.9	169.3	-71.7	-19.8	0	0	0	111.6	K207 E208 Y209 K213 G214 S215	K207-N211 WeakPolarHBondContact O-CB 3.48Å; K207-N211 PolarHBondContact O-N 2.88Å; K207-N211 PolarHBondContact O-ND2 3.27Å; E208-N211 WeakPolarHBondContact O-CB 3.41Å; E208-N211 PolarHBondContact O-N 3Å; E208-N211 PolarHBondContact OE1-ND2 3.46Å; E208-N211 VanDerWaalsContact OE1-ND2 3.11Å; E208-N211 PolarHBondContact OE2-ND2 2.84Å; Y209-N211 VanDerWaalsContact C-N 3.35Å; N211-K213 VanDerWaalsContact C-N 3.34Å; N211-K213 PolarHBondContact O-N 3.02Å; N211-G214 PolarHBondContact O-N 3.49Å; N211-S215 WeakPolarHBondContact O-CB 3.18Å; N211-S215 PolarHBondContact O-N 3.19Å
212	L	94.4	Very high	94.5	Very high	119 Å²	119	100.7 Å²	100.7	62%	0.623	53%	0.531	S	S	*	.	H	α-helix	trans	-60.7	-41.5	178.4	-84	161.1	0	0	0	111.9	E208 Y209 S215 L216	E208-L212 WeakPolarHBondContact O-CB 3.47Å; E208-L212 WeakPolarHBondContact O-CG 3.34Å; E208-L212 PolarHBondContact O-N 3.4Å; Y209-L212 PolarHBondContact O-N 2.98Å; L212-S215 PolarHBondContact O-N 3.29Å; L212-L216 WeakPolarHBondContact O-CB 3.33Å; L212-L216 PolarHBondContact O-N 3.25Å
213	K	94.4	Very high	94.6	Very high	114 Å²	114	99.3 Å²	99.3	50%	0.496	52%	0.522	S	S	.	.	H	α-helix	trans	-64.7	-39.7	175.2	177	178.9	168.8	-168.9	0	112.1	Y209 D210 N211 K217	Y209-K213 HydrophobicContact CD1-CD 4.5Å; Y209-K213 HydrophobicContact CE1-CD 3.73Å; Y209-K213 WeakPolarHBondContact O-CB 3.33Å; Y209-K213 PolarHBondContact O-N 2.63Å; D210-K213 IonicContact OD1-NZ 2.75Å; N211-K213 VanDerWaalsContact C-N 3.34Å; N211-K213 PolarHBondContact O-N 3.02Å; K213-K217 WeakPolarHBondContact O-CB 3.18Å; K213-K217 PolarHBondContact O-N 2.67Å
214	G	95.3	Very high	94.7	Very high	40 Å²	40	97 Å²	97	41%	0.412	51%	0.508	S	S	.	.	H	α-helix	trans	-62.7	-45.6	172	0	0	0	0	0	112.4	D210 N211 K217 S218	D210-G214 PolarHBondContact O-N 3.41Å; N211-G214 PolarHBondContact O-N 3.49Å; G214-K217 PolarHBondContact O-N 2.92Å; G214-S218 PolarHBondContact O-N 2.69Å; G214-S218 PolarHBondContact O-OG 2.93Å
215	S	95.1	Very high	94.9	Very high	73 Å²	73	99.6 Å²	99.6	51%	0.51	51%	0.512	S	S	.	.	H	α-helix	trans	-64.6	-42.1	176.7	-171.6	0	0	0	0	112.7	N211 L212 K217 S218 S219	N211-S215 WeakPolarHBondContact O-CB 3.18Å; N211-S215 PolarHBondContact O-N 3.19Å; L212-S215 PolarHBondContact O-N 3.29Å; S215-K217 VanDerWaalsContact C-N 3.33Å; S215-K217 PolarHBondContact O-N 2.92Å; S215-S218 PolarHBondContact O-N 2.67Å; S215-S218 PolarHBondContact O-OG 2.65Å; S215-S219 VanDerWaalsContact O-CB 3.25Å; S215-S219 WeakPolarHBondContact O-CB 3.49Å; S215-S219 PolarHBondContact O-N 3.35Å
216	L	95.5	Very high	95	Very high	127 Å²	127	98 Å²	98	67%	0.665	50%	0.504	S	S	*	.	H	α-helix	trans	-62.6	-40.7	174	-179.5	62.9	0	0	0	111.3	L212 N220	L212-L216 WeakPolarHBondContact O-CB 3.33Å; L212-L216 PolarHBondContact O-N 3.25Å; L216-N220 WeakPolarHBondContact O-CB 3.35Å; L216-N220 PolarHBondContact O-N 2.95Å
217	K	95.4	Very high	95	Very high	139 Å²	139	96 Å²	96	60%	0.604	50%	0.496	S	S	*	.	H	α-helix	trans	-64.5	-48.6	176.5	-174.3	177.4	178	-177.3	0	111.6	K213 G214 S215 S219 N220 D221	K213-K217 WeakPolarHBondContact O-CB 3.18Å; K213-K217 PolarHBondContact O-N 2.67Å; G214-K217 PolarHBondContact O-N 2.92Å; S215-K217 VanDerWaalsContact C-N 3.33Å; S215-K217 PolarHBondContact O-N 2.92Å; K217-S219 VanDerWaalsContact C-N 3.33Å; K217-S219 PolarHBondContact O-N 3.37Å; K217-N220 PolarHBondContact O-N 3.22Å; K217-D221 WeakPolarHBondContact O-CB 3.38Å; K217-D221 VanDerWaalsContact O-CG 3.26Å; K217-D221 PolarHBondContact O-N 3.4Å
218	S	95	Very high	95	Very high	71 Å²	71	96.7 Å²	96.7	50%	0.497	49%	0.494	S	S	.	.	H	α-helix	trans	-65.4	-36.6	179.1	64.3	0	0	0	0	112.4	G214 S215 D221 M222	G214-S218 PolarHBondContact O-N 2.69Å; G214-S218 PolarHBondContact O-OG 2.93Å; S215-S218 PolarHBondContact O-N 2.67Å; S215-S218 PolarHBondContact O-OG 2.65Å; S218-D221 PolarHBondContact O-N 3.17Å; S218-M222 WeakPolarHBondContact O-CB 3.13Å; S218-M222 PolarHBondContact O-N 2.77Å
219	S	94.2	Very high	95.2	Very high	75 Å²	75	96 Å²	96	52%	0.524	49%	0.491	S	S	.	.	H	α-helix	trans	-61.5	-44.4	171.2	-174.5	0	0	0	0	112	S215 K217 M222 C223	S215-S219 VanDerWaalsContact O-CB 3.25Å; S215-S219 WeakPolarHBondContact O-CB 3.49Å; S215-S219 PolarHBondContact O-N 3.35Å; K217-S219 VanDerWaalsContact C-N 3.33Å; K217-S219 PolarHBondContact O-N 3.37Å; S219-M222 PolarHBondContact O-N 2.91Å; S219-C223 WeakPolarHBondContact O-CB 3.43Å; S219-C223 PolarHBondContact O-N 2.67Å
220	N	93.8	Very high	95.4	Very high	84 Å²	84	93.8 Å²	93.8	45%	0.449	49%	0.492	S	S	.	.	H	α-helix	trans	-66.8	-42.7	176.7	-175	80.4	0	0	0	112.3	L216 K217 M222 C223 E224	L216-N220 WeakPolarHBondContact O-CB 3.35Å; L216-N220 PolarHBondContact O-N 2.95Å; K217-N220 PolarHBondContact O-N 3.22Å; N220-M222 VanDerWaalsContact C-N 3.27Å; N220-M222 PolarHBondContact O-N 3.39Å; N220-C223 WeakPolarHBondContact O-CB 3.38Å; N220-C223 PolarHBondContact O-N 3.17Å; N220-C223 VanDerWaalsContact O-N 3.1Å; N220-E224 PolarHBondContact O-N 2.9Å
221	D	96.3	Very high	95.4	Very high	84 Å²	84	96.1 Å²	96.1	45%	0.449	50%	0.504	S	S	.	.	H	α-helix	trans	-62.1	-36.7	176.5	-69	-20.5	0	0	0	111.2	K217 S218 K225	K217-D221 WeakPolarHBondContact O-CB 3.38Å; K217-D221 VanDerWaalsContact O-CG 3.26Å; K217-D221 PolarHBondContact O-N 3.4Å; S218-D221 PolarHBondContact O-N 3.17Å; D221-K225 WeakPolarHBondContact O-CB 3.3Å; D221-K225 PolarHBondContact O-N 3.42Å
222	M	95.3	Very high	95.4	Very high	126 Å²	126	94.8 Å²	94.8	62%	0.621	50%	0.502	S	S	*	.	H	α-helix	trans	-68	-41.3	171.1	-176.1	168.4	-73.1	0	0	112.3	S218 S219 N220 E224 K225 L226	S218-M222 WeakPolarHBondContact O-CB 3.13Å; S218-M222 PolarHBondContact O-N 2.77Å; S219-M222 PolarHBondContact O-N 2.91Å; N220-M222 VanDerWaalsContact C-N 3.27Å; N220-M222 PolarHBondContact O-N 3.39Å; M222-E224 PolarHBondContact O-N 3.39Å; M222-K225 WeakPolarHBondContact O-CB 3.21Å; M222-K225 PolarHBondContact O-N 3.01Å; M222-L226 HydrophobicContact CG-CD1 4.28Å; M222-L226 WeakPolarHBondContact O-CG 3.18Å; M222-L226 PolarHBondContact O-N 2.89Å
223	C	94.3	Very high	95.4	Very high	55 Å²	55	92.7 Å²	92.7	37%	0.372	50%	0.497	S	S	.	.	H	α-helix	trans	-60	-45.2	174.4	-169.9	0	0	0	0	111.5	S219 N220 K225 L226 K227	S219-C223 WeakPolarHBondContact O-CB 3.43Å; S219-C223 PolarHBondContact O-N 2.67Å; N220-C223 WeakPolarHBondContact O-CB 3.38Å; N220-C223 PolarHBondContact O-N 3.17Å; N220-C223 VanDerWaalsContact O-N 3.1Å; C223-K225 VanDerWaalsContact C-N 3.32Å; C223-K225 PolarHBondContact O-N 3.3Å; C223-L226 PolarHBondContact O-N 3.18Å; C223-K227 WeakPolarHBondContact O-CG 3.33Å; C223-K227 PolarHBondContact O-N 3.22Å
224	E	96.3	Very high	95.5	Very high	69 Å²	69	90.9 Å²	90.9	32%	0.322	49%	0.493	S	S	.	.	H	α-helix	trans	-65.8	-32.5	175.4	-72.5	-54	136.9	0	0	112.9	N220 M222 K227 R228	N220-E224 PolarHBondContact O-N 2.9Å; M222-E224 PolarHBondContact O-N 3.39Å; E224-K227 WeakPolarHBondContact OE1-CD 3.42Å; E224-K227 IonicContact OE1-NZ 3.67Å; E224-K227 PolarHBondContact OE1-NZ 3.35Å; E224-R228 WeakPolarHBondContact O-CG 3.33Å; E224-R228 PolarHBondContact O-N 2.94Å; E224-R228 VanDerWaalsContact O-N 3.15Å; E224-R228 PolarHBondContact O-NE 2.91Å
225	K	97	Very high	95.5	Very high	114 Å²	114	92.5 Å²	92.5	50%	0.496	50%	0.497	S	S	.	.	H	α-helix	trans	-65.1	-49.2	172.1	-166.9	-170.6	-178.9	-157.2	0	110.9	D221 M222 C223 K227 R228 E229	D221-K225 WeakPolarHBondContact O-CB 3.3Å; D221-K225 PolarHBondContact O-N 3.42Å; M222-K225 WeakPolarHBondContact O-CB 3.21Å; M222-K225 PolarHBondContact O-N 3.01Å; C223-K225 VanDerWaalsContact C-N 3.32Å; C223-K225 PolarHBondContact O-N 3.3Å; K225-K227 PolarHBondContact O-N 3.28Å; K225-R228 PolarHBondContact O-N 3.31Å; K225-E229 WeakPolarHBondContact CE-OE1 3.41Å; K225-E229 IonicContact NZ-OE1 2.64Å; K225-E229 WeakPolarHBondContact O-CG 2.93Å; K225-E229 PolarHBondContact O-N 3.29Å
226	L	96	Very high	95.6	Very high	92 Å²	92	96.1 Å²	96.1	48%	0.482	50%	0.504	S	S	.	.	H	α-helix	trans	-61.9	-40.1	177.6	-70	170.9	0	0	0	112.1	M222 C223 R228 E229 V230	M222-L226 HydrophobicContact CG-CD1 4.28Å; M222-L226 WeakPolarHBondContact O-CG 3.18Å; M222-L226 PolarHBondContact O-N 2.89Å; C223-L226 PolarHBondContact O-N 3.18Å; L226-R228 PolarHBondContact O-N 2.94Å; L226-E229 PolarHBondContact O-N 3.45Å; L226-V230 WeakPolarHBondContact O-CB 3.31Å; L226-V230 VanDerWaalsContact O-CG2 3.3Å; L226-V230 WeakPolarHBondContact O-CG2 3.27Å; L226-V230 PolarHBondContact O-N 3.06Å
227	K	94.6	Very high	95.6	Very high	98 Å²	98	95.5 Å²	95.5	43%	0.426	50%	0.501	S	S	.	.	H	α-helix	trans	-58	-46.2	172.7	-73.9	173.8	-168.6	170	0	112	C223 E224 K225 V230 L231	C223-K227 WeakPolarHBondContact O-CG 3.33Å; C223-K227 PolarHBondContact O-N 3.22Å; E224-K227 WeakPolarHBondContact OE1-CD 3.42Å; E224-K227 IonicContact OE1-NZ 3.67Å; E224-K227 PolarHBondContact OE1-NZ 3.35Å; K225-K227 PolarHBondContact O-N 3.28Å; K227-V230 PolarHBondContact O-N 2.89Å; K227-L231 WeakPolarHBondContact O-CG 2.97Å; K227-L231 PolarHBondContact O-N 3.42Å
228	R	96.3	Very high	95.6	Very high	149 Å²	149	94.8 Å²	94.8	56%	0.562	50%	0.5	S	S	*	.	H	α-helix	trans	-63.8	-41.9	176.7	-78.7	174.6	-81.1	132.5	-9.7	112.1	E224 K225 L226 L231 S232	E224-R228 WeakPolarHBondContact O-CG 3.33Å; E224-R228 PolarHBondContact O-N 2.94Å; E224-R228 VanDerWaalsContact O-N 3.15Å; E224-R228 PolarHBondContact O-NE 2.91Å; K225-R228 PolarHBondContact O-N 3.31Å; L226-R228 PolarHBondContact O-N 2.94Å; R228-L231 PolarHBondContact O-N 3.13Å; R228-S232 WeakPolarHBondContact O-CB 3.38Å; R228-S232 PolarHBondContact O-N 2.73Å
229	E	96.8	Very high	95.7	Very high	88 Å²	88	97.8 Å²	97.8	41%	0.411	50%	0.504	S	S	.	.	H	α-helix	trans	-61.6	-47.2	175.2	-73.1	172.3	-167.7	0	0	111.2	K225 L226 L231 S232 S233	K225-E229 WeakPolarHBondContact CE-OE1 3.41Å; K225-E229 IonicContact NZ-OE1 2.64Å; K225-E229 WeakPolarHBondContact O-CG 2.93Å; K225-E229 PolarHBondContact O-N 3.29Å; L226-E229 PolarHBondContact O-N 3.45Å; E229-L231 PolarHBondContact O-N 3.31Å; E229-S232 PolarHBondContact O-N 2.74Å; E229-S232 PolarHBondContact O-OG 2.96Å; E229-S233 WeakPolarHBondContact O-CB 3.37Å; E229-S233 PolarHBondContact O-N 3.42Å
230	V	96.9	Very high	95.8	Very high	98 Å²	98	96.6 Å²	96.6	59%	0.594	50%	0.498	S	S	*	.	H	α-helix	trans	-58.6	-47	175.2	168.1	0	0	0	0	112	L226 K227 S232 S233 N234	L226-V230 WeakPolarHBondContact O-CB 3.31Å; L226-V230 VanDerWaalsContact O-CG2 3.3Å; L226-V230 WeakPolarHBondContact O-CG2 3.27Å; L226-V230 PolarHBondContact O-N 3.06Å; K227-V230 PolarHBondContact O-N 2.89Å; V230-S232 PolarHBondContact O-N 3.04Å; V230-S233 PolarHBondContact O-N 2.88Å; V230-N234 VanDerWaalsContact O-CB 3.31Å; V230-N234 WeakPolarHBondContact O-CB 3.45Å; V230-N234 PolarHBondContact O-N 3.1Å
231	L	94.9	Very high	95.9	Very high	120 Å²	120	95.6 Å²	95.6	63%	0.628	50%	0.498	S	S	*	.	H	α-helix	trans	-61	-44.1	176.8	-72.9	171	0	0	0	111.8	K227 R228 E229 S233 N234 S235	K227-L231 WeakPolarHBondContact O-CG 2.97Å; K227-L231 PolarHBondContact O-N 3.42Å; R228-L231 PolarHBondContact O-N 3.13Å; E229-L231 PolarHBondContact O-N 3.31Å; L231-S233 VanDerWaalsContact C-N 3.35Å; L231-S233 PolarHBondContact O-N 3.43Å; L231-N234 PolarHBondContact O-N 2.86Å; L231-S235 PolarHBondContact O-N 2.73Å
232	S	96.1	Very high	95.9	Very high	56 Å²	56	96.4 Å²	96.4	39%	0.392	50%	0.502	S	S	.	.	H	α-helix	trans	-65.3	-37.9	178.1	80.5	0	0	0	0	112.5	R228 E229 V230 K236	R228-S232 WeakPolarHBondContact O-CB 3.38Å; R228-S232 PolarHBondContact O-N 2.73Å; E229-S232 PolarHBondContact O-N 2.74Å; E229-S232 PolarHBondContact O-OG 2.96Å; V230-S232 PolarHBondContact O-N 3.04Å; S232-K236 VanDerWaalsContact O-CG 3.3Å; S232-K236 WeakPolarHBondContact O-CG 3.14Å; S232-K236 PolarHBondContact O-N 2.87Å; S232-K236 VanDerWaalsContact O-N 3.12Å
233	S	95.1	Very high	96	Very high	74 Å²	74	94 Å²	94	52%	0.517	49%	0.489	S	S	.	.	H	α-helix	trans	-69.3	-43.2	177.2	-169.7	0	0	0	0	111.2	E229 V230 L231 S235 K236 L237	E229-S233 WeakPolarHBondContact O-CB 3.37Å; E229-S233 PolarHBondContact O-N 3.42Å; V230-S233 PolarHBondContact O-N 2.88Å; L231-S233 VanDerWaalsContact C-N 3.35Å; L231-S233 PolarHBondContact O-N 3.43Å; S233-S235 PolarHBondContact O-N 2.96Å; S233-K236 PolarHBondContact O-N 3.47Å; S233-L237 WeakPolarHBondContact O-CB 3.17Å; S233-L237 PolarHBondContact O-N 3.14Å
234	N	95.4	Very high	96.1	Very high	77 Å²	77	94 Å²	94	41%	0.412	49%	0.493	S	S	.	.	H	α-helix	trans	-63.9	-40.4	176.8	-168.3	22.1	0	0	0	111.9	V230 L231 L237 Q238	V230-N234 VanDerWaalsContact O-CB 3.31Å; V230-N234 WeakPolarHBondContact O-CB 3.45Å; V230-N234 PolarHBondContact O-N 3.1Å; L231-N234 PolarHBondContact O-N 2.86Å; N234-L237 PolarHBondContact O-N 2.66Å; N234-Q238 WeakPolarHBondContact O-CB 3.29Å; N234-Q238 WeakPolarHBondContact O-CG 3.05Å; N234-Q238 PolarHBondContact O-N 2.81Å
235	S	96	Very high	96.1	Very high	73 Å²	73	96 Å²	96	51%	0.51	51%	0.505	S	S	.	.	H	α-helix	trans	-63.1	-42.9	174	178.2	0	0	0	0	112.3	L231 S233 L237 Q238 K239	L231-S235 PolarHBondContact O-N 2.73Å; S233-S235 PolarHBondContact O-N 2.96Å; S235-L237 PolarHBondContact O-N 3.03Å; S235-Q238 PolarHBondContact O-N 2.62Å; S235-K239 PolarHBondContact O-N 2.99Å
236	K	97.2	Very high	96.1	Very high	149 Å²	149	95.4 Å²	95.4	65%	0.648	50%	0.504	S	S	*	.	H	α-helix	trans	-60.9	-43.2	172.8	-71	168.1	-177.8	176.3	0	111.8	S232 S233 K239 A240	S232-K236 VanDerWaalsContact O-CG 3.3Å; S232-K236 WeakPolarHBondContact O-CG 3.14Å; S232-K236 PolarHBondContact O-N 2.87Å; S232-K236 VanDerWaalsContact O-N 3.12Å; S233-K236 PolarHBondContact O-N 3.47Å; K236-K239 PolarHBondContact O-N 2.67Å; K236-A240 WeakPolarHBondContact O-CB 3.44Å; K236-A240 PolarHBondContact O-N 2.94Å
237	L	95.6	Very high	96.1	Very high	115 Å²	115	95.8 Å²	95.8	60%	0.602	51%	0.506	S	S	*	.	H	α-helix	trans	-63.6	-42.5	177.3	-179.3	63.4	0	0	0	111.9	S233 N234 S235 A240 S241	S233-L237 WeakPolarHBondContact O-CB 3.17Å; S233-L237 PolarHBondContact O-N 3.14Å; N234-L237 PolarHBondContact O-N 2.66Å; S235-L237 PolarHBondContact O-N 3.03Å; L237-A240 PolarHBondContact O-N 3.14Å; L237-S241 VanDerWaalsContact O-CB 3.22Å; L237-S241 WeakPolarHBondContact O-CB 3.49Å; L237-S241 PolarHBondContact O-N 2.88Å
238	Q	95.6	Very high	96.2	Very high	124 Å²	124	97.3 Å²	97.3	58%	0.579	51%	0.513	S	S	*	.	H	α-helix	trans	-61.9	-43.7	174.3	-76.5	-179.4	-16.1	0	0	111.8	N234 S235 S241 L242	N234-Q238 WeakPolarHBondContact O-CB 3.29Å; N234-Q238 WeakPolarHBondContact O-CG 3.05Å; N234-Q238 PolarHBondContact O-N 2.81Å; S235-Q238 PolarHBondContact O-N 2.62Å; Q238-S241 PolarHBondContact O-N 3.45Å; Q238-L242 PolarHBondContact O-N 3.38Å
239	K	96.8	Very high	96.2	Very high	134 Å²	134	95.3 Å²	95.3	58%	0.583	51%	0.51	S	S	*	.	H	α-helix	trans	-61.4	-50.6	176	-165.8	-170.9	-175.2	-114.3	0	111.6	S235 K236 S241 L242 E243	S235-K239 PolarHBondContact O-N 2.99Å; K236-K239 PolarHBondContact O-N 2.67Å; K239-S241 VanDerWaalsContact C-N 3.26Å; K239-S241 PolarHBondContact O-N 3.31Å; K239-L242 WeakPolarHBondContact O-CB 3.37Å; K239-L242 PolarHBondContact O-N 2.8Å; K239-L242 VanDerWaalsContact O-N 3.12Å; K239-E243 VanDerWaalsContact CE-OE1 3.22Å; K239-E243 WeakPolarHBondContact CE-OE1 3.37Å; K239-E243 IonicContact NZ-OE1 2.59Å; K239-E243 PolarHBondContact NZ-OE1 2.7Å; K239-E243 WeakPolarHBondContact O-CG 3.27Å; K239-E243 PolarHBondContact O-N 2.94Å
240	A	96.2	Very high	96.2	Very high	49 Å²	49	96.2 Å²	96.2	41%	0.405	51%	0.514	S	S	.	.	H	α-helix	trans	-62	-33.6	177.9	0	0	0	0	0	112.6	K236 L237 A244	K236-A240 WeakPolarHBondContact O-CB 3.44Å; K236-A240 PolarHBondContact O-N 2.94Å; L237-A240 PolarHBondContact O-N 3.14Å; A240-A244 VanDerWaalsContact O-CB 3.24Å; A240-A244 WeakPolarHBondContact O-CB 3.48Å; A240-A244 PolarHBondContact O-N 3.33Å
241	S	96.1	Very high	96.2	Very high	64 Å²	64	97.2 Å²	97.2	45%	0.448	52%	0.516	S	S	.	.	H	α-helix	trans	-68.6	-38.9	174.1	-173.1	0	0	0	0	112.4	L237 Q238 K239 A244 L245	L237-S241 VanDerWaalsContact O-CB 3.22Å; L237-S241 WeakPolarHBondContact O-CB 3.49Å; L237-S241 PolarHBondContact O-N 2.88Å; Q238-S241 PolarHBondContact O-N 3.45Å; K239-S241 VanDerWaalsContact C-N 3.26Å; K239-S241 PolarHBondContact O-N 3.31Å; S241-A244 PolarHBondContact O-N 3.02Å; S241-L245 WeakPolarHBondContact O-CB 3.26Å; S241-L245 WeakPolarHBondContact O-CG 3.49Å; S241-L245 PolarHBondContact O-N 3.39Å
242	L	96.4	Very high	96.3	Very high	100 Å²	100	95.9 Å²	95.9	52%	0.524	51%	0.505	S	S	.	.	H	α-helix	trans	-64.7	-47.3	173.7	-168.9	87	0	0	0	111.2	Q238 K239 A244 L245 Q246	Q238-L242 PolarHBondContact O-N 3.38Å; K239-L242 WeakPolarHBondContact O-CB 3.37Å; K239-L242 PolarHBondContact O-N 2.8Å; K239-L242 VanDerWaalsContact O-N 3.12Å; L242-A244 VanDerWaalsContact C-N 3.34Å; L242-A244 PolarHBondContact O-N 3.33Å; L242-L245 WeakPolarHBondContact O-CB 3.43Å; L242-L245 PolarHBondContact O-N 3.34Å; L242-L245 VanDerWaalsContact O-N 3.14Å; L242-Q246 WeakPolarHBondContact O-CG 3.5Å; L242-Q246 PolarHBondContact O-N 2.78Å
243	E	96.9	Very high	96.3	Very high	76 Å²	76	95.9 Å²	95.9	36%	0.355	51%	0.505	S	S	.	.	H	α-helix	trans	-59.6	-43.9	176	-70.2	167.4	177.5	0	0	110.9	K239 L245 Q246 L247	K239-E243 VanDerWaalsContact CE-OE1 3.22Å; K239-E243 WeakPolarHBondContact CE-OE1 3.37Å; K239-E243 IonicContact NZ-OE1 2.59Å; K239-E243 PolarHBondContact NZ-OE1 2.7Å; K239-E243 WeakPolarHBondContact O-CG 3.27Å; K239-E243 PolarHBondContact O-N 2.94Å; E243-L245 VanDerWaalsContact C-N 3.32Å; E243-L245 PolarHBondContact O-N 2.88Å; E243-Q246 PolarHBondContact O-N 3.35Å; E243-L247 WeakPolarHBondContact O-CB 3.2Å; E243-L247 WeakPolarHBondContact O-CG 3.31Å; E243-L247 PolarHBondContact O-N 3.37Å
244	A	95.6	Very high	96.3	Very high	56 Å²	56	97.9 Å²	97.9	46%	0.463	51%	0.509	S	S	.	.	H	α-helix	trans	-64.4	-33.7	175.3	0	0	0	0	0	113	A240 S241 L242 K248	A240-A244 VanDerWaalsContact O-CB 3.24Å; A240-A244 WeakPolarHBondContact O-CB 3.48Å; A240-A244 PolarHBondContact O-N 3.33Å; S241-A244 PolarHBondContact O-N 3.02Å; L242-A244 VanDerWaalsContact C-N 3.34Å; L242-A244 PolarHBondContact O-N 3.33Å; A244-K248 VanDerWaalsContact O-CB 3.22Å; A244-K248 WeakPolarHBondContact O-CB 3.1Å; A244-K248 PolarHBondContact O-N 3.14Å
245	L	96.4	Very high	96.4	Very high	110 Å²	110	98.2 Å²	98.2	58%	0.576	51%	0.508	S	S	*	.	H	α-helix	trans	-70.6	-40.6	173.2	-78.7	167.3	0	0	0	112.1	S241 L242 E243 K248 E249	S241-L245 WeakPolarHBondContact O-CB 3.26Å; S241-L245 WeakPolarHBondContact O-CG 3.49Å; S241-L245 PolarHBondContact O-N 3.39Å; L242-L245 WeakPolarHBondContact O-CB 3.43Å; L242-L245 PolarHBondContact O-N 3.34Å; L242-L245 VanDerWaalsContact O-N 3.14Å; E243-L245 VanDerWaalsContact C-N 3.32Å; E243-L245 PolarHBondContact O-N 2.88Å; L245-K248 PolarHBondContact O-N 2.76Å; L245-E249 PolarHBondContact O-N 3.33Å
246	Q	96.8	Very high	96.4	Very high	101 Å²	101	98.5 Å²	98.5	47%	0.472	50%	0.5	S	S	.	.	H	α-helix	trans	-62.3	-52.6	174.5	-73.4	171.5	-21.4	0	0	110.8	L242 E243 K248 E249 E250	L242-Q246 WeakPolarHBondContact O-CG 3.5Å; L242-Q246 PolarHBondContact O-N 2.78Å; E243-Q246 PolarHBondContact O-N 3.35Å; Q246-K248 PolarHBondContact O-N 3.17Å; Q246-E249 CarbonylContact O-C 3.53Å; Q246-E249 WeakPolarHBondContact O-CA 3.09Å; Q246-E249 PolarHBondContact O-N 3.38Å; Q246-E250 PolarHBondContact O-N 2.83Å
247	L	96.3	Very high	96.3	Very high	101 Å²	101	96 Å²	96	53%	0.529	49%	0.494	S	S	.	.	H	α-helix	trans	-58	-33.7	175	-71	172.1	0	0	0	112.2	E243 L251	E243-L247 WeakPolarHBondContact O-CB 3.2Å; E243-L247 WeakPolarHBondContact O-CG 3.31Å; E243-L247 PolarHBondContact O-N 3.37Å; L247-L251 WeakPolarHBondContact O-CB 3.44Å; L247-L251 WeakPolarHBondContact O-CG 3.28Å; L247-L251 PolarHBondContact O-N 3.46Å
248	K	97.1	Very high	96.4	Very high	130 Å²	130	94 Å²	94	57%	0.565	48%	0.483	S	S	*	.	H	α-helix	trans	-69.6	-30.9	174.2	-174.3	175.2	-177.3	176.9	0	112.9	A244 L245 Q246 K252	A244-K248 VanDerWaalsContact O-CB 3.22Å; A244-K248 WeakPolarHBondContact O-CB 3.1Å; A244-K248 PolarHBondContact O-N 3.14Å; L245-K248 PolarHBondContact O-N 2.76Å; Q246-K248 PolarHBondContact O-N 3.17Å; K248-K252 WeakPolarHBondContact O-CG 3.25Å; K248-K252 PolarHBondContact O-N 2.65Å; K248-K252 VanDerWaalsContact O-N 3.07Å
249	E	96.3	Very high	96.4	Very high	107 Å²	107	88.9 Å²	88.9	50%	0.5	46%	0.462	S	S	.	.	H	α-helix	trans	-82	-37.9	176.2	-161.6	60.4	-146.3	0	0	112.1	L245 Q246 L251 K252 S253	L245-E249 PolarHBondContact O-N 3.33Å; Q246-E249 CarbonylContact O-C 3.53Å; Q246-E249 WeakPolarHBondContact O-CA 3.09Å; Q246-E249 PolarHBondContact O-N 3.38Å; E249-L251 VanDerWaalsContact C-N 3.35Å; E249-K252 CarbonylContact O-C 3.28Å; E249-K252 WeakPolarHBondContact O-CA 3.05Å; E249-K252 WeakPolarHBondContact O-CB 3.32Å; E249-K252 PolarHBondContact O-N 2.94Å; E249-K252 IonicContact OE1-NZ 2.69Å; E249-K252 VanDerWaalsContact OE2-CE 3.31Å; E249-K252 WeakPolarHBondContact OE2-CE 3.42Å; E249-K252 IonicContact OE2-NZ 3.62Å; E249-K252 PolarHBondContact OE2-NZ 3.33Å; E249-S253 PolarHBondContact O-N 2.9Å
250	E	97.1	Very high	96.4	Very high	106 Å²	106	83.3 Å²	83.3	50%	0.495	44%	0.443	S	S	.	.	H	α-helix	trans	-61.2	-44.1	168	-71.4	174.3	-165.9	0	0	111.1	Q246 K252 S253 L254	Q246-E250 PolarHBondContact O-N 2.83Å; E250-K252 PolarHBondContact O-N 3.3Å; E250-S253 PolarHBondContact O-N 2.92Å; E250-S253 VanDerWaalsContact O-N 3.13Å; E250-S253 PolarHBondContact O-OG 3.1Å; E250-L254 VanDerWaalsContact O-CB 3.3Å; E250-L254 WeakPolarHBondContact O-CB 3.42Å; E250-L254 WeakPolarHBondContact O-CG 3.36Å; E250-L254 PolarHBondContact O-N 2.91Å
251	L	96.7	Very high	96.3	Very high	119 Å²	119	82.9 Å²	82.9	62%	0.623	44%	0.439	S	S	*	.	H	α-helix	trans	-57.6	-38.8	169	-79.4	173.5	0	0	0	110.3	L247 E249 L254 Q255	L247-L251 WeakPolarHBondContact O-CB 3.44Å; L247-L251 WeakPolarHBondContact O-CG 3.28Å; L247-L251 PolarHBondContact O-N 3.46Å; E249-L251 VanDerWaalsContact C-N 3.35Å; L251-L254 CarbonylContact O-C 3.53Å; L251-Q255 WeakPolarHBondContact O-CA 3.48Å; L251-Q255 WeakPolarHBondContact O-CB 3.41Å; L251-Q255 PolarHBondContact O-N 3.37Å
252	K	96.6	Very high	96.3	Very high	93 Å²	93	82.8 Å²	82.8	40%	0.404	43%	0.434	S	S	.	.	H	α-helix	trans	-69.8	-27.4	174.4	-82.8	-172.7	-113.9	151.9	0	115.2	K248 E249 E250 Q255 K256	K248-K252 WeakPolarHBondContact O-CG 3.25Å; K248-K252 PolarHBondContact O-N 2.65Å; K248-K252 VanDerWaalsContact O-N 3.07Å; E249-K252 CarbonylContact O-C 3.28Å; E249-K252 WeakPolarHBondContact O-CA 3.05Å; E249-K252 WeakPolarHBondContact O-CB 3.32Å; E249-K252 PolarHBondContact O-N 2.94Å; E249-K252 IonicContact OE1-NZ 2.69Å; E249-K252 VanDerWaalsContact OE2-CE 3.31Å; E249-K252 WeakPolarHBondContact OE2-CE 3.42Å; E249-K252 IonicContact OE2-NZ 3.62Å; E249-K252 PolarHBondContact OE2-NZ 3.33Å; E250-K252 PolarHBondContact O-N 3.3Å; K252-Q255 CarbonylContact O-C 3.49Å; K252-Q255 VanDerWaalsContact O-CA 3.27Å; K252-Q255 WeakPolarHBondContact O-CA 3.44Å; K252-Q255 PolarHBondContact O-N 2.87Å; K252-K256 PolarHBondContact O-N 2.94Å
253	S	95.7	Very high	96.3	Very high	56 Å²	56	84.7 Å²	84.7	39%	0.392	44%	0.438	S	S	.	.	H	α-helix	trans	-83	-41.1	175.6	64.7	0	0	0	0	111.7	E249 E250 Q255 K256 D257	E249-S253 PolarHBondContact O-N 2.9Å; E250-S253 PolarHBondContact O-N 2.92Å; E250-S253 VanDerWaalsContact O-N 3.13Å; E250-S253 PolarHBondContact O-OG 3.1Å; S253-Q255 PolarHBondContact O-N 3.06Å; S253-K256 VanDerWaalsContact O-CA 3.31Å; S253-K256 WeakPolarHBondContact O-CA 3.19Å; S253-K256 WeakPolarHBondContact O-CB 3.39Å; S253-K256 PolarHBondContact O-N 2.82Å; S253-D257 PolarHBondContact O-N 2.83Å
254	L	96	Very high	96.3	Very high	115 Å²	115	86.7 Å²	86.7	60%	0.602	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-13.5	159.9	-61.7	177.5	0	0	0	111.9	E250 L251 K353	E250-L254 VanDerWaalsContact O-CB 3.3Å; E250-L254 WeakPolarHBondContact O-CB 3.42Å; E250-L254 WeakPolarHBondContact O-CG 3.36Å; E250-L254 PolarHBondContact O-N 2.91Å; L251-L254 CarbonylContact O-C 3.53Å; L254-K353 VanDerWaalsContact C-NZ 3.25Å; L254-K353 PolarHBondContact O-NZ 3.38Å
255	Q	96.9	Very high	96.3	Very high	84 Å²	84	87.8 Å²	87.8	39%	0.393	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102	22.2	162.5	-144.8	-161.9	6.7	0	0	112.7	L251 K252 S253 S352 K353 R354	L251-Q255 WeakPolarHBondContact O-CA 3.48Å; L251-Q255 WeakPolarHBondContact O-CB 3.41Å; L251-Q255 PolarHBondContact O-N 3.37Å; K252-Q255 CarbonylContact O-C 3.49Å; K252-Q255 VanDerWaalsContact O-CA 3.27Å; K252-Q255 WeakPolarHBondContact O-CA 3.44Å; K252-Q255 PolarHBondContact O-N 2.87Å; S253-Q255 PolarHBondContact O-N 3.06Å; Q255-S352 VanDerWaalsContact CG-C 3.43Å; Q255-S352 VanDerWaalsContact CG-CA 3.43Å; Q255-S352 VanDerWaalsContact CG-N 3.31Å; Q255-S352 PolarHBondContact NE2-O 3.12Å; Q255-K353 WeakPolarHBondContact O-CA 3.41Å; Q255-K353 WeakPolarHBondContact O-CE 3.29Å; Q255-K353 WeakPolarHBondContact O-CG 3.39Å; Q255-R354 PolarHBondContact O-N 3.39Å
256	K	96.1	Very high	96.2	Very high	80 Å²	80	85.6 Å²	85.6	35%	0.348	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.7	-28.2	162.7	-164.7	-178.4	175.7	-172.9	0	116	K252 S253 K353 R354 E356	K252-K256 PolarHBondContact O-N 2.94Å; S253-K256 VanDerWaalsContact O-CA 3.31Å; S253-K256 WeakPolarHBondContact O-CA 3.19Å; S253-K256 WeakPolarHBondContact O-CB 3.39Å; S253-K256 PolarHBondContact O-N 2.82Å; K256-K353 VanDerWaalsContact C-NZ 3.25Å; K256-K353 VanDerWaalsContact O-CD 3.29Å; K256-K353 WeakPolarHBondContact O-CD 3.41Å; K256-R354 HydrophobicContact CG-CG 4.11Å; K256-R354 PolarHBondContact O-NE 3.02Å; K256-R354 PolarHBondContact O-NH2 2.82Å; K256-E356 WeakPolarHBondContact CE-OE1 3.46Å; K256-E356 IonicContact NZ-OE1 3Å; K256-E356 PolarHBondContact NZ-OE1 3.45Å
257	D	96.1	Very high	96.1	Very high	97 Å²	97	83.2 Å²	83.2	52%	0.519	43%	0.433	S	S	.	.	S	Bend	trans	-82	-63.2	-178.8	-53.7	-32.5	0	0	0	116.6	S253 A259 G260 A261	S253-D257 PolarHBondContact O-N 2.83Å; D257-A259 PolarHBondContact O-N 2.68Å; D257-G260 WeakPolarHBondContact O-CA 3.34Å; D257-G260 PolarHBondContact O-N 3.1Å; D257-A261 PolarHBondContact O-N 3.37Å
258	L	96.8	Very high	96.1	Very high	72 Å²	72	82.3 Å²	82.3	38%	0.377	43%	0.428	S	S	.	.	H	α-helix	trans	-28.4	-68.4	171.9	-174.4	66	0	0	0	116.9	G260 A261 D262 S352 K353	L258-G260 CarbonylContact O-C 3.53Å; L258-G260 PolarHBondContact O-N 3.18Å; L258-A261 CarbonylContact O-C 3.59Å; L258-A261 VanDerWaalsContact O-C 3.28Å; L258-A261 WeakPolarHBondContact O-CA 3.35Å; L258-A261 WeakPolarHBondContact O-CB 3.21Å; L258-A261 PolarHBondContact O-N 3.46Å; L258-D262 PolarHBondContact O-N 2.91Å; L258-S352 WeakPolarHBondContact CD2-OG 3.31Å; L258-K353 HydrophobicContact CB-CD 4.42Å; L258-K353 VanDerWaalsContact CB-NZ 3.35Å
259	A	95.5	Very high	95.9	Very high	16 Å²	16	83 Å²	83	13%	0.132	43%	0.431	C	S	.	.	H	α-helix	trans	-72	7.9	171.7	0	0	0	0	0	117.6	D257 D262 K263 S352 K353	D257-A259 PolarHBondContact O-N 2.68Å; A259-D262 WeakPolarHBondContact CA-OD2 3.49Å; A259-D262 HydrophobicContact CB-CB 4.03Å; A259-D262 WeakPolarHBondContact CB-OD2 3.15Å; A259-D262 PolarHBondContact N-OD2 3Å; A259-K263 VanDerWaalsContact O-CG 3.26Å; A259-K263 WeakPolarHBondContact O-CG 3.35Å; A259-S352 WeakPolarHBondContact CB-OG 3.31Å; A259-S352 PolarHBondContact N-OG 2.91Å; A259-K353 HydrophobicContact CB-CB 3.55Å; A259-K353 HydrophobicContact CB-CD 3.51Å; A259-K353 HydrophobicContact CB-CG 3.72Å
260	G	96.6	Very high	95.9	Very high	17 Å²	17	85 Å²	85	18%	0.175	44%	0.438	C	S	.	.	H	α-helix	trans	-70.9	-56.7	145.6	0	0	0	0	0	109.8	D257 L258 D262 K263 E264 R354	D257-G260 WeakPolarHBondContact O-CA 3.34Å; D257-G260 PolarHBondContact O-N 3.1Å; L258-G260 CarbonylContact O-C 3.53Å; L258-G260 PolarHBondContact O-N 3.18Å; G260-D262 PolarHBondContact O-N 3.48Å; G260-K263 WeakPolarHBondContact O-CB 3.5Å; G260-K263 PolarHBondContact O-N 2.93Å; G260-K263 VanDerWaalsContact O-N 3.13Å; G260-E264 PolarHBondContact O-N 2.91Å; G260-R354 VanDerWaalsContact CA-CZ 3.41Å
261	A	95.5	Very high	95.7	Very high	40 Å²	40	86.2 Å²	86.2	33%	0.331	44%	0.442	S	S	.	.	H	α-helix	trans	-56.8	-41	171.4	0	0	0	0	0	112.9	D257 L258 K263 E264 I265	D257-A261 PolarHBondContact O-N 3.37Å; L258-A261 CarbonylContact O-C 3.59Å; L258-A261 VanDerWaalsContact O-C 3.28Å; L258-A261 WeakPolarHBondContact O-CA 3.35Å; L258-A261 WeakPolarHBondContact O-CB 3.21Å; L258-A261 PolarHBondContact O-N 3.46Å; A261-K263 VanDerWaalsContact C-N 3.28Å; A261-K263 PolarHBondContact O-N 2.76Å; A261-E264 CarbonylContact O-C 3.43Å; A261-E264 WeakPolarHBondContact O-CB 3.29Å; A261-E264 PolarHBondContact O-N 3.23Å; A261-E264 VanDerWaalsContact O-N 3.1Å; A261-I265 VanDerWaalsContact O-CB 3.31Å; A261-I265 WeakPolarHBondContact O-CB 3.38Å; A261-I265 WeakPolarHBondContact O-CD1 3.4Å; A261-I265 WeakPolarHBondContact O-CG1 3.37Å; A261-I265 PolarHBondContact O-N 2.82Å
262	D	96.1	Very high	95.5	Very high	63 Å²	63	84.9 Å²	84.9	34%	0.337	44%	0.438	S	S	.	.	H	α-helix	trans	-62.7	-35.5	176.4	-52.7	-43.6	0	0	0	111.6	L258 A259 G260 S266 S352	L258-D262 PolarHBondContact O-N 2.91Å; A259-D262 WeakPolarHBondContact CA-OD2 3.49Å; A259-D262 HydrophobicContact CB-CB 4.03Å; A259-D262 WeakPolarHBondContact CB-OD2 3.15Å; A259-D262 PolarHBondContact N-OD2 3Å; G260-D262 PolarHBondContact O-N 3.48Å; D262-S266 VanDerWaalsContact O-CB 3.25Å; D262-S266 WeakPolarHBondContact O-CB 3.47Å; D262-S266 PolarHBondContact O-N 3.46Å; D262-S266 PolarHBondContact O-OG 2.94Å; D262-S352 PolarHBondContact OD2-OG 3.49Å
263	K	95.9	Very high	95.3	Very high	139 Å²	139	84.8 Å²	84.8	60%	0.604	44%	0.439	S	S	*	.	H	α-helix	trans	-70.7	-39.8	173.2	-76.1	-178.3	-175.6	-160.3	0	111.5	A259 G260 A261 S266 S267	A259-K263 VanDerWaalsContact O-CG 3.26Å; A259-K263 WeakPolarHBondContact O-CG 3.35Å; G260-K263 WeakPolarHBondContact O-CB 3.5Å; G260-K263 PolarHBondContact O-N 2.93Å; G260-K263 VanDerWaalsContact O-N 3.13Å; A261-K263 VanDerWaalsContact C-N 3.28Å; A261-K263 PolarHBondContact O-N 2.76Å; K263-S266 PolarHBondContact O-N 3.29Å; K263-S267 WeakPolarHBondContact O-CB 3.5Å; K263-S267 PolarHBondContact O-N 2.87Å
264	E	96.2	Very high	94.9	Very high	118 Å²	118	88.8 Å²	88.8	55%	0.551	45%	0.45	S	S	*	.	H	α-helix	trans	-64.4	-51.9	175.9	-176.4	169.8	-169	0	0	111.2	G260 A261 S266 S267 L268	G260-E264 PolarHBondContact O-N 2.91Å; A261-E264 CarbonylContact O-C 3.43Å; A261-E264 WeakPolarHBondContact O-CB 3.29Å; A261-E264 PolarHBondContact O-N 3.23Å; A261-E264 VanDerWaalsContact O-N 3.1Å; E264-S266 VanDerWaalsContact C-N 3.27Å; E264-S266 PolarHBondContact O-N 3.4Å; E264-S267 CarbonylContact O-C 3.42Å; E264-S267 WeakPolarHBondContact O-CA 3.47Å; E264-S267 WeakPolarHBondContact O-CB 3.42Å; E264-S267 PolarHBondContact O-N 3.49Å; E264-S267 PolarHBondContact O-OG 3.03Å; E264-L268 HydrophobicContact CG-CD1 4.07Å; E264-L268 HydrophobicContact CG-CG 4.45Å; E264-L268 WeakPolarHBondContact O-CG 3.34Å; E264-L268 PolarHBondContact O-N 3.41Å
265	I	96	Very high	94.4	Very high	80 Å²	80	88.3 Å²	88.3	41%	0.41	45%	0.447	S	S	.	.	H	α-helix	trans	-51.8	-45.5	171	-68.7	164.2	0	0	0	110.4	A261 S267 L268 K269	A261-I265 VanDerWaalsContact O-CB 3.31Å; A261-I265 WeakPolarHBondContact O-CB 3.38Å; A261-I265 WeakPolarHBondContact O-CD1 3.4Å; A261-I265 WeakPolarHBondContact O-CG1 3.37Å; A261-I265 PolarHBondContact O-N 2.82Å; I265-S267 VanDerWaalsContact C-N 3.33Å; I265-S267 PolarHBondContact O-N 3.45Å; I265-L268 PolarHBondContact O-N 3.36Å; I265-K269 HydrophobicContact CG2-CD 4.1Å; I265-K269 HydrophobicContact CG2-CG 4.45Å; I265-K269 WeakPolarHBondContact O-CB 3.5Å; I265-K269 VanDerWaalsContact O-CG 3.29Å; I265-K269 WeakPolarHBondContact O-CG 3.31Å; I265-K269 PolarHBondContact O-N 3.19Å
266	S	94.6	Very high	93.9	Very high	64 Å²	64	90.2 Å²	90.2	45%	0.448	46%	0.456	S	S	.	.	H	α-helix	trans	-63.8	-36.9	176.1	-61.9	0	0	0	0	112.6	D262 K263 E264 K270	D262-S266 VanDerWaalsContact O-CB 3.25Å; D262-S266 WeakPolarHBondContact O-CB 3.47Å; D262-S266 PolarHBondContact O-N 3.46Å; D262-S266 PolarHBondContact O-OG 2.94Å; K263-S266 PolarHBondContact O-N 3.29Å; E264-S266 VanDerWaalsContact C-N 3.27Å; E264-S266 PolarHBondContact O-N 3.4Å; S266-K270 WeakPolarHBondContact O-CG 3.36Å; S266-K270 PolarHBondContact O-N 2.88Å; S266-K270 VanDerWaalsContact O-N 3.1Å
267	S	94.9	Very high	93.3	Very high	50 Å²	50	92.2 Å²	92.2	35%	0.35	47%	0.465	S	S	.	.	H	α-helix	trans	-71.2	-39	176.3	82.1	0	0	0	0	112.3	K263 E264 I265 K270 K271	K263-S267 WeakPolarHBondContact O-CB 3.5Å; K263-S267 PolarHBondContact O-N 2.87Å; E264-S267 CarbonylContact O-C 3.42Å; E264-S267 WeakPolarHBondContact O-CA 3.47Å; E264-S267 WeakPolarHBondContact O-CB 3.42Å; E264-S267 PolarHBondContact O-N 3.49Å; E264-S267 PolarHBondContact O-OG 3.03Å; I265-S267 VanDerWaalsContact C-N 3.33Å; I265-S267 PolarHBondContact O-N 3.45Å; S267-K270 PolarHBondContact O-N 3.06Å; S267-K271 WeakPolarHBondContact O-CG 3.2Å; S267-K271 PolarHBondContact O-N 3.27Å
268	L	94.9	Very high	92.4	Very high	83 Å²	83	90.5 Å²	90.5	44%	0.435	46%	0.458	S	S	.	.	H	α-helix	trans	-67.8	-44.3	176	-69.7	172	0	0	0	110.3	E264 I265 K270 K271 V272	E264-L268 HydrophobicContact CG-CD1 4.07Å; E264-L268 HydrophobicContact CG-CG 4.45Å; E264-L268 WeakPolarHBondContact O-CG 3.34Å; E264-L268 PolarHBondContact O-N 3.41Å; I265-L268 PolarHBondContact O-N 3.36Å; L268-K270 VanDerWaalsContact C-N 3.32Å; L268-K270 PolarHBondContact O-N 3.38Å; L268-K271 HydrophobicContact CD2-CD 4.46Å; L268-K271 WeakPolarHBondContact O-CB 3.47Å; L268-K271 PolarHBondContact O-N 2.9Å; L268-K271 VanDerWaalsContact O-N 3.12Å; L268-V272 WeakPolarHBondContact O-CG2 3.35Å; L268-V272 PolarHBondContact O-N 2.97Å
269	K	94.5	Very high	91.1	Very high	145 Å²	145	92.2 Å²	92.2	63%	0.63	47%	0.467	S	S	*	.	H	α-helix	trans	-55.7	-44.7	171.8	-77.2	178.8	177.5	-175.9	0	111.8	I265 V272 E273	I265-K269 HydrophobicContact CG2-CD 4.1Å; I265-K269 HydrophobicContact CG2-CG 4.45Å; I265-K269 WeakPolarHBondContact O-CB 3.5Å; I265-K269 VanDerWaalsContact O-CG 3.29Å; I265-K269 WeakPolarHBondContact O-CG 3.31Å; I265-K269 PolarHBondContact O-N 3.19Å; K269-V272 PolarHBondContact O-N 3.18Å; K269-E273 WeakPolarHBondContact O-CB 3.19Å; K269-E273 PolarHBondContact O-N 3.18Å
270	K	94.6	Very high	89.9	Confident	149 Å²	149	95.7 Å²	95.7	65%	0.648	49%	0.49	S	S	*	.	H	α-helix	trans	-64.8	-38.5	174.7	-75	179.2	179.1	-171.8	0	113.5	S266 S267 L268 E273 F274	S266-K270 WeakPolarHBondContact O-CG 3.36Å; S266-K270 PolarHBondContact O-N 2.88Å; S266-K270 VanDerWaalsContact O-N 3.1Å; S267-K270 PolarHBondContact O-N 3.06Å; L268-K270 VanDerWaalsContact C-N 3.32Å; L268-K270 PolarHBondContact O-N 3.38Å; K270-E273 PolarHBondContact O-N 3.1Å; K270-F274 WeakPolarHBondContact O-CB 3.28Å; K270-F274 PolarHBondContact O-N 2.91Å
271	K	93.9	Very high	88.2	Confident	131 Å²	131	98.6 Å²	98.6	57%	0.57	51%	0.505	S	S	*	.	H	α-helix	trans	-64.3	-45.6	174.1	-74.7	174.7	179.3	179.8	0	111.2	S267 L268 F274 L275	S267-K271 WeakPolarHBondContact O-CG 3.2Å; S267-K271 PolarHBondContact O-N 3.27Å; L268-K271 HydrophobicContact CD2-CD 4.46Å; L268-K271 WeakPolarHBondContact O-CB 3.47Å; L268-K271 PolarHBondContact O-N 2.9Å; L268-K271 VanDerWaalsContact O-N 3.12Å; K271-F274 PolarHBondContact O-N 3.32Å; K271-L275 WeakPolarHBondContact O-CB 3.29Å; K271-L275 VanDerWaalsContact O-CG 3.27Å; K271-L275 WeakPolarHBondContact O-CG 3.33Å; K271-L275 PolarHBondContact O-N 3.38Å
272	V	91.7	Very high	86.3	Confident	90 Å²	90	102.7 Å²	102.7	55%	0.545	53%	0.528	S	S	.	.	H	α-helix	trans	-61.1	-45.9	175.4	171.4	0	0	0	0	110.5	L268 K269 F274 L275 Q276	L268-V272 WeakPolarHBondContact O-CG2 3.35Å; L268-V272 PolarHBondContact O-N 2.97Å; K269-V272 PolarHBondContact O-N 3.18Å; V272-F274 PolarHBondContact O-N 3.44Å; V272-L275 PolarHBondContact O-N 3.42Å; V272-Q276 WeakPolarHBondContact O-CB 3.32Å; V272-Q276 PolarHBondContact O-N 2.85Å
273	E	92.1	Very high	84.6	Confident	91 Å²	91	103.7 Å²	103.7	43%	0.425	54%	0.536	S	S	.	.	H	α-helix	trans	-60.5	-42.3	176	-173	-168.7	170.1	0	0	112.1	K269 K270 Q276 K277	K269-E273 WeakPolarHBondContact O-CB 3.19Å; K269-E273 PolarHBondContact O-N 3.18Å; K270-E273 PolarHBondContact O-N 3.1Å; E273-Q276 PolarHBondContact O-N 3.35Å; E273-K277 HydrophobicContact CG-CD 4.41Å; E273-K277 WeakPolarHBondContact O-CB 3.27Å; E273-K277 WeakPolarHBondContact O-CG 3.48Å; E273-K277 PolarHBondContact O-N 3.33Å; E273-K277 VanDerWaalsContact OE1-CE 3.28Å; E273-K277 WeakPolarHBondContact OE1-CE 3.41Å; E273-K277 IonicContact OE1-NZ 2.61Å; E273-K277 PolarHBondContact OE1-NZ 2.61Å
274	F	88.3	Confident	82.8	Confident	141 Å²	141	108 Å²	108	62%	0.618	55%	0.549	S	S	*	.	H	α-helix	trans	-62.9	-50.3	175.4	177.1	-94.4	0	0	0	111.5	K270 K271 V272 Q276 K277 T278	K270-F274 WeakPolarHBondContact O-CB 3.28Å; K270-F274 PolarHBondContact O-N 2.91Å; K271-F274 PolarHBondContact O-N 3.32Å; V272-F274 PolarHBondContact O-N 3.44Å; F274-Q276 VanDerWaalsContact C-N 3.32Å; F274-Q276 PolarHBondContact O-N 3.5Å; F274-K277 PolarHBondContact O-N 2.92Å; F274-T278 PolarHBondContact O-N 2.82Å; F274-T278 PolarHBondContact O-OG1 2.84Å
275	L	85.4	Confident	81	Confident	105 Å²	105	105.3 Å²	105.3	55%	0.55	55%	0.546	S	S	.	.	H	α-helix	trans	-59.5	-43.1	177.2	-69.6	169.1	0	0	0	111.5	K271 V272 T278 L279	K271-L275 WeakPolarHBondContact O-CB 3.29Å; K271-L275 VanDerWaalsContact O-CG 3.27Å; K271-L275 WeakPolarHBondContact O-CG 3.33Å; K271-L275 PolarHBondContact O-N 3.38Å; V272-L275 PolarHBondContact O-N 3.42Å; L275-T278 PolarHBondContact O-N 3.35Å; L275-L279 WeakPolarHBondContact O-CG 3.39Å; L275-L279 PolarHBondContact O-N 2.81Å
276	Q	85.8	Confident	79.3	Confident	124 Å²	124	102.9 Å²	102.9	58%	0.579	53%	0.534	S	S	*	.	H	α-helix	trans	-63	-42	176.9	-172.2	175.9	5.2	0	0	111.7	V272 E273 F274 L279 S280	V272-Q276 WeakPolarHBondContact O-CB 3.32Å; V272-Q276 PolarHBondContact O-N 2.85Å; E273-Q276 PolarHBondContact O-N 3.35Å; F274-Q276 VanDerWaalsContact C-N 3.32Å; F274-Q276 PolarHBondContact O-N 3.5Å; Q276-L279 PolarHBondContact O-N 2.82Å; Q276-S280 WeakPolarHBondContact O-CB 3.22Å; Q276-S280 PolarHBondContact O-N 2.78Å; Q276-S280 PolarHBondContact O-OG 3.05Å
277	K	83.1	Confident	77.8	Confident	122 Å²	122	105.4 Å²	105.4	53%	0.53	54%	0.539	S	S	.	.	H	α-helix	trans	-64.2	-43.5	173	-75.5	175	-173.7	172.9	0	112	E273 F274 L279 S280 T281	E273-K277 HydrophobicContact CG-CD 4.41Å; E273-K277 WeakPolarHBondContact O-CB 3.27Å; E273-K277 WeakPolarHBondContact O-CG 3.48Å; E273-K277 PolarHBondContact O-N 3.33Å; E273-K277 VanDerWaalsContact OE1-CE 3.28Å; E273-K277 WeakPolarHBondContact OE1-CE 3.41Å; E273-K277 IonicContact OE1-NZ 2.61Å; E273-K277 PolarHBondContact OE1-NZ 2.61Å; F274-K277 PolarHBondContact O-N 2.92Å; K277-L279 VanDerWaalsContact C-N 3.3Å; K277-L279 PolarHBondContact O-N 3.39Å; K277-S280 PolarHBondContact O-N 3.26Å; K277-S280 VanDerWaalsContact O-N 3.08Å; K277-T281 PolarHBondContact O-N 3.41Å; K277-T281 PolarHBondContact O-OG1 3Å
278	T	77.9	Confident	76.1	Confident	60 Å²	60	105.4 Å²	105.4	37%	0.368	54%	0.542	S	S	.	.	H	α-helix	trans	-58.7	-41	176	-57.9	0	0	0	0	111.8	F274 L275 T281 N286	F274-T278 PolarHBondContact O-N 2.82Å; F274-T278 PolarHBondContact O-OG1 2.84Å; L275-T278 PolarHBondContact O-N 3.35Å; T278-T281 PolarHBondContact O-OG1 3.32Å; T278-N286 PolarHBondContact O-ND2 2.93Å
279	L	69.8	Low	74.5	Confident	109 Å²	109	105.6 Å²	105.6	57%	0.571	54%	0.543	S	S	*	.	H	α-helix	trans	-71.1	-31.6	174.5	-68.5	169.1	0	0	0	112.7	L275 Q276 K277	L275-L279 WeakPolarHBondContact O-CG 3.39Å; L275-L279 PolarHBondContact O-N 2.81Å; Q276-L279 PolarHBondContact O-N 2.82Å; K277-L279 VanDerWaalsContact C-N 3.3Å; K277-L279 PolarHBondContact O-N 3.39Å
280	S	69.1	Low	73.1	Confident	88 Å²	88	100.2 Å²	100.2	62%	0.615	53%	0.529	S	S	*	.	H	α-helix	trans	-77.7	-23.1	-178.9	-56.9	0	0	0	0	113.9	Q276 K277 P282	Q276-S280 WeakPolarHBondContact O-CB 3.22Å; Q276-S280 PolarHBondContact O-N 2.78Å; Q276-S280 PolarHBondContact O-OG 3.05Å; K277-S280 PolarHBondContact O-N 3.26Å; K277-S280 VanDerWaalsContact O-N 3.08Å; S280-P282 WeakPolarHBondContact O-CD 3.19Å
281	T	60.8	Low	71.7	Confident	79 Å²	79	100.3 Å²	100.3	49%	0.485	53%	0.526	S	S	.	.	S	Bend	trans	-74.8	118.1	171.1	36.6	0	0	0	0	110.8	K277 T278 T283 N286	K277-T281 PolarHBondContact O-N 3.41Å; K277-T281 PolarHBondContact O-OG1 3Å; T278-T281 PolarHBondContact O-OG1 3.32Å; T281-T283 PolarHBondContact O-N 3.02Å; T281-N286 PolarHBondContact O-ND2 3Å
282	P	57.6	Low	70.1	Confident	125 Å²	125	99.5 Å²	99.5	81%	0.812	53%	0.527	S	S	*	.			trans	-73.3	96.3	-176.7	29.4	-33.9	0	0	0	110.8	S280	S280-P282 WeakPolarHBondContact O-CD 3.19Å
283	T	60.2	Low	68.7	Low	84 Å²	84	100.9 Å²	100.9	52%	0.515	53%	0.53	S	S	.	.			trans	-107.3	147	168	-46.1	0	0	0	0	107.6	T281 A285 N286 E287	T281-T283 PolarHBondContact O-N 3.02Å; T283-A285 PolarHBondContact O-N 2.81Å; T283-N286 WeakPolarHBondContact O-CB 3.25Å; T283-N286 PolarHBondContact O-N 2.91Å; T283-E287 PolarHBondContact O-N 3.17Å
284	R	58.2	Low	67.2	Low	230 Å²	230	105.3 Å²	105.3	87%	0.868	55%	0.548	S	S	*	.	H	α-helix	trans	-52.8	-23.5	-177.1	-171.8	176.3	173.4	-169.5	-2.3	114.8
285	A	58.6	Low	65.8	Low	61 Å²	61	105.3 Å²	105.3	50%	0.504	55%	0.55	S	S	.	*	H	α-helix	trans	-78	-30.4	173.2	0	0	0	0	0	114.1	T283 A288 L289	T283-A285 PolarHBondContact O-N 2.81Å; A285-A288 PolarHBondContact O-N 2.81Å; A285-L289 PolarHBondContact O-N 3.34Å
286	N	59	Low	64.2	Low	29 Å²	29	104.3 Å²	104.3	16%	0.155	55%	0.552	C	S	.	*	H	α-helix	trans	-75.1	-33.4	-179.6	-73.4	-13.8	0	0	0	112.4	T278 T281 T283 A288 L289 G290	T278-N286 PolarHBondContact O-ND2 2.93Å; T281-N286 PolarHBondContact O-ND2 3Å; T283-N286 WeakPolarHBondContact O-CB 3.25Å; T283-N286 PolarHBondContact O-N 2.91Å; N286-A288 VanDerWaalsContact C-N 3.3Å; N286-A288 PolarHBondContact O-N 3.42Å; N286-L289 PolarHBondContact O-N 2.8Å; N286-G290 PolarHBondContact O-N 3.23Å
287	E	63.7	Low	62.8	Low	117 Å²	117	103.5 Å²	103.5	55%	0.547	56%	0.558	S	S	.	*	H	α-helix	trans	-62.8	-38.5	170.4	-72.2	-170.7	121.2	0	0	111.6	T283 R291	T283-E287 PolarHBondContact O-N 3.17Å; E287-R291 WeakPolarHBondContact O-CB 3.41Å; E287-R291 VanDerWaalsContact O-CG 3.3Å; E287-R291 WeakPolarHBondContact O-CG 3.38Å; E287-R291 PolarHBondContact O-N 2.87Å
288	A	59.1	Low	61.3	Low	51 Å²	51	101.6 Å²	101.6	42%	0.421	57%	0.565	S	S	.	*	H	α-helix	trans	-67.9	-43.5	176.6	0	0	0	0	0	112.1	A285 N286 R291 L292	A285-A288 PolarHBondContact O-N 2.81Å; N286-A288 VanDerWaalsContact C-N 3.3Å; N286-A288 PolarHBondContact O-N 3.42Å; A288-R291 PolarHBondContact O-N 3.28Å; A288-L292 WeakPolarHBondContact O-CB 3.42Å; A288-L292 WeakPolarHBondContact O-CG 3.47Å; A288-L292 PolarHBondContact O-N 3.41Å
289	L	62	Low	60	Low	86 Å²	86	103.5 Å²	103.5	45%	0.45	58%	0.578	S	S	.	*	H	α-helix	trans	-66	-40	174.8	-79.4	164.8	0	0	0	112.6	A285 N286 L292 I293	A285-L289 PolarHBondContact O-N 3.34Å; N286-L289 PolarHBondContact O-N 2.8Å; L289-L292 PolarHBondContact O-N 3.21Å; L289-I293 VanDerWaalsContact O-CG1 3.31Å; L289-I293 WeakPolarHBondContact O-CG1 3.44Å; L289-I293 PolarHBondContact O-N 2.91Å
290	G	63.7	Low	59.3	Low	33 Å²	33	107 Å²	107	34%	0.34	60%	0.596	S	S	.	*	H	α-helix	trans	-61.7	-44.9	175.1	0	0	0	0	0	111.8	N286 I293 F294	N286-G290 PolarHBondContact O-N 3.23Å; G290-I293 PolarHBondContact O-N 3.49Å; G290-F294 WeakPolarHBondContact O-CD2 3.32Å; G290-F294 PolarHBondContact O-N 3.01Å; G290-F294 VanDerWaalsContact O-N 3.09Å
291	R	64.8	Low	58.8	Low	150 Å²	150	110.6 Å²	110.6	57%	0.566	60%	0.603	S	S	*	*	H	α-helix	trans	-59.8	-50.6	172.7	-73.8	177.7	-163.9	-163.6	4.8	111.5	E287 A288 I293 F294 E295	E287-R291 WeakPolarHBondContact O-CB 3.41Å; E287-R291 VanDerWaalsContact O-CG 3.3Å; E287-R291 WeakPolarHBondContact O-CG 3.38Å; E287-R291 PolarHBondContact O-N 2.87Å; A288-R291 PolarHBondContact O-N 3.28Å; R291-I293 VanDerWaalsContact C-N 3.26Å; R291-I293 PolarHBondContact O-N 2.94Å; R291-F294 PolarHBondContact O-N 3.36Å; R291-F294 VanDerWaalsContact O-N 3.12Å; R291-E295 WeakPolarHBondContact O-CB 3.21Å; R291-E295 VanDerWaalsContact O-CG 3.24Å; R291-E295 WeakPolarHBondContact O-CG 3.45Å; R291-E295 PolarHBondContact O-N 3.01Å
292	L	60.3	Low	58.4	Low	114 Å²	114	114.1 Å²	114.1	60%	0.597	62%	0.618	S	S	*	*	H	α-helix	trans	-56.3	-34.5	177.8	-83.8	160	0	0	0	114.3	A288 L289	A288-L292 WeakPolarHBondContact O-CB 3.42Å; A288-L292 WeakPolarHBondContact O-CG 3.47Å; A288-L292 PolarHBondContact O-N 3.41Å; L289-L292 PolarHBondContact O-N 3.21Å
293	I	63.5	Low	58.5	Low	119 Å²	119	116.7 Å²	116.7	61%	0.61	62%	0.617	S	S	*	*	H	α-helix	trans	-77.7	-35.9	178.5	-67.9	166.7	0	0	0	111.8	L289 G290 R291	L289-I293 VanDerWaalsContact O-CG1 3.31Å; L289-I293 WeakPolarHBondContact O-CG1 3.44Å; L289-I293 PolarHBondContact O-N 2.91Å; G290-I293 PolarHBondContact O-N 3.49Å; R291-I293 VanDerWaalsContact C-N 3.26Å; R291-I293 PolarHBondContact O-N 2.94Å
294	F	59.4	Low	58.3	Low	184 Å²	184	118 Å²	118	81%	0.807	63%	0.627	S	S	*	*	H	α-helix	trans	-85.1	-23.7	177.8	-84	-84.4	0	0	0	114	G290 R291 S296	G290-F294 WeakPolarHBondContact O-CD2 3.32Å; G290-F294 PolarHBondContact O-N 3.01Å; G290-F294 VanDerWaalsContact O-N 3.09Å; R291-F294 PolarHBondContact O-N 3.36Å; R291-F294 VanDerWaalsContact O-N 3.12Å; F294-S296 VanDerWaalsContact C-N 3.3Å
295	E	60.7	Low	57.9	Low	141 Å²	141	112.3 Å²	112.3	66%	0.659	62%	0.619	S	S	*	*	S	Bend	trans	-82.1	-6.5	176	-71.3	169.5	-174.5	0	0	113	R291 P297	R291-E295 WeakPolarHBondContact O-CB 3.21Å; R291-E295 VanDerWaalsContact O-CG 3.24Å; R291-E295 WeakPolarHBondContact O-CG 3.45Å; R291-E295 PolarHBondContact O-N 3.01Å; E295-P297 VanDerWaalsContact C-CD 3.49Å; E295-P297 WeakPolarHBondContact O-CD 3.33Å
296	S	51.7	Low	57.6	Low	85 Å²	85	118.6 Å²	118.6	59%	0.594	64%	0.638	S	S	*	*	S	Bend	trans	-117	79.4	172.7	-169.7	0	0	0	0	111.2	F294 A298	F294-S296 VanDerWaalsContact C-N 3.3Å; S296-A298 PolarHBondContact O-N 3.28Å
297	P	55.1	Low	57.3	Low	107 Å²	107	124.5 Å²	124.5	70%	0.695	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-57.7	129.4	167.2	-17.7	30.1	0	0	0	109.2	E295	E295-P297 VanDerWaalsContact C-CD 3.49Å; E295-P297 WeakPolarHBondContact O-CD 3.33Å
298	A	51.8	Low	56.6	Low	82 Å²	82	128.3 Å²	128.3	68%	0.678	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-56.9	132.7	172	0	0	0	0	0	109.3	S296 L300	S296-A298 PolarHBondContact O-N 3.28Å; A298-L300 PolarHBondContact O-N 3.32Å; A298-L300 VanDerWaalsContact O-N 3.1Å
299	P	50.9	Low	56.3	Low	99 Å²	99	132.9 Å²	132.9	64%	0.643	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-63.5	118.2	-177	24.9	-33.1	0	0	0	109.7	E301	P299-E301 PolarHBondContact O-N 3.42Å
300	L	54.9	Low	55.6	Low	184 Å²	184	134 Å²	134	96%	0.963	71%	0.712	S	S	*	*	S	Bend	trans	-68.2	-2.7	-177.8	-75.9	166.5	0	0	0	113.9	A298	A298-L300 PolarHBondContact O-N 3.32Å; A298-L300 VanDerWaalsContact O-N 3.1Å
301	E	58	Low	55.1	Low	162 Å²	162	137.1 Å²	137.1	76%	0.757	73%	0.734	S	S	*	*			trans	-125.5	77.2	175.2	-66.8	-171.2	178.9	0	0	111.3	P299 K303	P299-E301 PolarHBondContact O-N 3.42Å; E301-K303 PolarHBondContact O-N 3.42Å; E301-K303 VanDerWaalsContact O-N 3.12Å
302	L	53.3	Low	54.5	Low	154 Å²	154	138.9 Å²	138.9	81%	0.806	75%	0.748	S	S	*	*			trans	-71.4	98.6	159.8	-70.7	175.1	0	0	0	108.7
303	K	59.1	Low	54	Low	179 Å²	179	136.8 Å²	136.8	78%	0.778	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-58.2	135.9	167	-70.7	-175.7	177.9	-179.9	0	109.2	E301	E301-K303 PolarHBondContact O-N 3.42Å; E301-K303 VanDerWaalsContact O-N 3.12Å
304	P	56.2	Low	53.4	Low	112 Å²	112	138.6 Å²	138.6	73%	0.727	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-60.9	141.2	179.3	25.3	-33.7	0	0	0	110.2	H306	P304-H306 PolarHBondContact O-N 3.15Å
305	P	49.8	Very low	53.1	Low	109 Å²	109	136.4 Å²	136.4	71%	0.708	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-67.2	125	-178.1	26.8	-33.5	0	0	0	110.6	L307	P305-L307 PolarHBondContact O-N 3.5Å
306	H	52.3	Low	53	Low	194 Å²	194	136.5 Å²	136.5	90%	0.898	77%	0.765	S	S	*	*			trans	-66.2	101	167.2	-99.6	-74.3	0	0	0	109.3	P304	P304-H306 PolarHBondContact O-N 3.15Å
307	L	52.8	Low	53.4	Low	153 Å²	153	137.1 Å²	137.1	80%	0.801	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-78.3	134.2	165.3	-63.9	173.7	0	0	0	108.5	P305 Q309	P305-L307 PolarHBondContact O-N 3.5Å; L307-Q309 PolarHBondContact O-N 3.45Å
308	H	49.7	Very low	53.6	Low	196 Å²	196	139.8 Å²	139.8	91%	0.907	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-66.6	128.5	173.6	-84.7	-57.5	0	0	0	110.3
309	Q	52.8	Low	54	Low	147 Å²	147	142.5 Å²	142.5	69%	0.687	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-71	128.5	177.4	-157.6	174.3	25.3	0	0	109.9	L307 D315	L307-Q309 PolarHBondContact O-N 3.45Å; Q309-D315 PolarHBondContact NE2-OD1 3.49Å
310	P	47.6	Very low	54.3	Low	111 Å²	111	142.8 Å²	142.8	72%	0.721	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-66.6	138.7	174.4	-19.3	32.5	0	0	0	111.2	H312	P310-H312 VanDerWaalsContact C-N 3.26Å; P310-H312 PolarHBondContact O-N 2.83Å
311	A	53.4	Low	54.2	Low	98 Å²	98	139.8 Å²	139.8	81%	0.81	76%	0.756	S	S	*	*	S	Bend	trans	-77.8	72.6	175.8	0	0	0	0	0	111.4
312	H	50.8	Low	53.9	Low	186 Å²	186	140.4 Å²	140.4	86%	0.861	75%	0.753	S	S	*	*	S	Bend	trans	166.4	118.8	149.6	-88.7	-59.4	0	0	0	111.2	P310	P310-H312 VanDerWaalsContact C-N 3.26Å; P310-H312 PolarHBondContact O-N 2.83Å
313	G	49.9	Very low	53.6	Low	70 Å²	70	140.6 Å²	140.6	72%	0.722	76%	0.755	S	S	*	*	S	Bend	trans	88.2	114.1	151.2	0	0	0	0	0	117.9
314	D	50.8	Low	53	Low	158 Å²	158	138.9 Å²	138.9	85%	0.845	75%	0.752	S	S	*	*			trans	60.7	105.6	158.7	-54.3	-14.5	0	0	0	118.8	I316	D314-I316 PolarHBondContact O-N 2.83Å
315	D	53.3	Low	52.6	Low	138 Å²	138	137.9 Å²	137.9	74%	0.738	75%	0.754	S	S	*	*			trans	-65.2	117.2	167.1	-80.7	-31.7	0	0	0	110.5	Q309 D317	Q309-D315 PolarHBondContact NE2-OD1 3.49Å; D315-D317 PolarHBondContact O-N 2.94Å
316	I	58.8	Low	52.3	Low	142 Å²	142	138.6 Å²	138.6	73%	0.728	76%	0.756	S	S	*	*			trans	-87.5	99	173	-57.4	176	0	0	0	108.6	D314 L318	D314-I316 PolarHBondContact O-N 2.83Å; I316-L318 HydrophobicContact CG2-CD2 4.01Å; I316-L318 HydrophobicContact CG2-CG 4.44Å; I316-L318 PolarHBondContact O-N 3.25Å; I316-L318 VanDerWaalsContact O-N 3.14Å
317	D	60.7	Low	51.9	Low	99 Å²	99	135 Å²	135	53%	0.529	75%	0.75	S	S	.	*			trans	-72	103	170.2	-177.4	11.3	0	0	0	110.7	D315 N319 M320	D315-D317 PolarHBondContact O-N 2.94Å; D317-N319 PolarHBondContact O-N 3.02Å; D317-N319 WeakPolarHBondContact OD1-CA 3.22Å; D317-N319 VanDerWaalsContact OD1-CB 3.29Å; D317-N319 WeakPolarHBondContact OD1-CB 3.23Å; D317-N319 PolarHBondContact OD1-N 3.4Å; D317-M320 HydrophobicContact CB-CG 4.24Å; D317-M320 PolarHBondContact O-N 3.08Å
318	L	59.1	Low	51.1	Low	163 Å²	163	135.3 Å²	135.3	85%	0.853	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	1.2	176.8	-66.7	174	0	0	0	113.7	I316	I316-L318 HydrophobicContact CG2-CD2 4.01Å; I316-L318 HydrophobicContact CG2-CG 4.44Å; I316-L318 PolarHBondContact O-N 3.25Å; I316-L318 VanDerWaalsContact O-N 3.14Å
319	N	58.7	Low	50.6	Low	138 Å²	138	133.9 Å²	133.9	74%	0.738	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.7	2.9	175.2	-120.8	14.9	0	0	0	113.7	D317 T321	D317-N319 PolarHBondContact O-N 3.02Å; D317-N319 WeakPolarHBondContact OD1-CA 3.22Å; D317-N319 VanDerWaalsContact OD1-CB 3.29Å; D317-N319 WeakPolarHBondContact OD1-CB 3.23Å; D317-N319 PolarHBondContact OD1-N 3.4Å; N319-T321 PolarHBondContact O-N 2.75Å
320	M	57.7	Low	49.9	Very low	105 Å²	105	130.7 Å²	130.7	52%	0.517	75%	0.751	S	S	.	*			trans	-63	99.2	173.2	-88.1	178.9	54.6	0	0	111.6	D317 Y322	D317-M320 HydrophobicContact CB-CG 4.24Å; D317-M320 PolarHBondContact O-N 3.08Å; M320-Y322 HydrophobicContact CB-CE2 4.43Å; M320-Y322 HydrophobicContact CE-CE1 4Å; M320-Y322 HydrophobicContact CE-CE2 4.27Å; M320-Y322 WeakPolarHBondContact CE-OH 3.33Å; M320-Y322 PolarHBondContact O-N 2.66Å
321	T	53	Low	49.4	Very low	122 Å²	122	131 Å²	131	75%	0.748	76%	0.756	S	S	*	*			trans	-76.6	113	169.1	-58.1	0	0	0	0	108.8	N319 D323	N319-T321 PolarHBondContact O-N 2.75Å; T321-D323 PolarHBondContact O-N 3.42Å
322	Y	51.1	Low	48.8	Very low	174 Å²	174	136.1 Å²	136.1	68%	0.682	76%	0.759	S	S	*	*			trans	-82.8	101.3	173.3	-71	-88.9	0	0	0	110.1	M320 I324	M320-Y322 HydrophobicContact CB-CE2 4.43Å; M320-Y322 HydrophobicContact CE-CE1 4Å; M320-Y322 HydrophobicContact CE-CE2 4.27Å; M320-Y322 WeakPolarHBondContact CE-OH 3.33Å; M320-Y322 PolarHBondContact O-N 2.66Å; Y322-I324 PolarHBondContact O-N 2.92Å
323	D	48.9	Very low	48	Very low	159 Å²	159	139 Å²	139	85%	0.85	76%	0.763	S	S	*	*			trans	-69.7	81.1	166.6	-85.1	-26.8	0	0	0	110.2	T321 A325	T321-D323 PolarHBondContact O-N 3.42Å; D323-A325 PolarHBondContact O-N 3.07Å; D323-A325 VanDerWaalsContact O-N 3.14Å
324	I	44.6	Very low	47.6	Very low	142 Å²	142	141.6 Å²	141.6	73%	0.728	77%	0.766	S	S	*	*			trans	-78	96.6	170.3	-56.7	178.2	0	0	0	107.9	Y322 T326	Y322-I324 PolarHBondContact O-N 2.92Å; I324-T326 PolarHBondContact O-N 3.12Å
325	A	47.9	Very low	46.6	Very low	92 Å²	92	138.6 Å²	138.6	76%	0.76	76%	0.764	S	S	*	*			trans	-56.3	111.9	169.4	0	0	0	0	0	109.8	D323	D323-A325 PolarHBondContact O-N 3.07Å; D323-A325 VanDerWaalsContact O-N 3.14Å
326	T	43.8	Very low	45.6	Very low	123 Å²	123	141 Å²	141	76%	0.755	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-75.8	128.6	174.1	-57.9	0	0	0	0	108.4	I324	I324-T326 PolarHBondContact O-N 3.12Å
327	P	43.9	Very low	44.4	Very low	118 Å²	118	141 Å²	141	77%	0.766	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-62.7	137.2	179.9	-22.6	33.6	0	0	0	112.4	D329	P327-D329 PolarHBondContact O-N 2.93Å
328	D	36.8	Very low	43.3	Very low	160 Å²	160	141.6 Å²	141.6	86%	0.856	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-60.7	127.2	175.8	-81.5	-51.9	0	0	0	112	A330	D328-A330 PolarHBondContact O-N 2.78Å
329	D	39.3	Very low	42	Very low	167 Å²	167	138.9 Å²	138.9	89%	0.893	78%	0.781	S	S	*	*			trans	-77.3	104.5	172.6	-170.1	16.8	0	0	0	110.2	P327 S331	P327-D329 PolarHBondContact O-N 2.93Å; D329-S331 PolarHBondContact O-N 2.81Å
330	A	37.8	Very low	40.7	Very low	80 Å²	80	142.7 Å²	142.7	66%	0.661	79%	0.791	S	S	*	*			trans	-79.3	117.5	-169	0	0	0	0	0	113.2	D328	D328-A330 PolarHBondContact O-N 2.78Å
331	S	37.4	Very low	39.5	Very low	118 Å²	118	146.7 Å²	146.7	83%	0.825	81%	0.805	S	S	*	*			trans	75.8	113.3	152.5	75.2	0	0	0	0	119.4	D329	D329-S331 PolarHBondContact O-N 2.81Å
332	K	40.5	Very low	38.4	Very low	204 Å²	204	150.1 Å²	150.1	89%	0.887	82%	0.815	S	S	*	*			trans	-70.6	149.9	161.9	-57.3	164	-179	169.6	0	110.7
333	R	33.3	Very low	37.4	Very low	248 Å²	248	152.7 Å²	152.7	94%	0.936	82%	0.824	S	S	*	*				-157.8	150.5	125.5	-111.3	173.9	-170.1	-155.5	2.8	113.5
334	P	41.3	Very low	36.3	Very low	123 Å²	123	151.3 Å²	151.3	80%	0.799	82%	0.816	S	S	*	*			trans	-121.6	164.3	-164.6	42	-29.6	0	0	0	115.9
335	A	29.7	Very low	35.4	Very low	96 Å²	96	152.2 Å²	152.2	79%	0.793	82%	0.817	S	S	*	*			trans	-152.8	103	153.8	0	0	0	0	0	108.3
336	Q	33.8	Very low	34.3	Very low	189 Å²	189	158.6 Å²	158.6	88%	0.883	82%	0.821	S	S	*	*				81.1	93.5	77.5	-162.7	-173.5	47.7	0	0	114.3
337	V	32.2	Very low	34.3	Very low	140 Å²	140	158.2 Å²	158.2	85%	0.848	82%	0.821	S	S	*	*			trans	-142.9	134.2	155.6	-172.2	0	0	0	0	108.6
338	P	37.8	Very low	33.4	Very low	112 Å²	112	155.4 Å²	155.4	73%	0.727	81%	0.813	S	S	*	*			trans	-90.6	132.5	-170.7	33.1	-34.8	0	0	0	115.9
339	S	32	Very low	32.9	Very low	106 Å²	106	154.3 Å²	154.3	74%	0.741	81%	0.812	S	S	*	*			trans	30.6	116.2	133.5	-57.7	0	0	0	0	121.3
340	K	32.8	Very low	32.3	Very low	218 Å²	218	151 Å²	151	95%	0.948	80%	0.803	S	S	*	*				-144.7	131.7	117.6	-127.5	171.3	-174.9	175.7	0	111.6
341	K	31.6	Very low	31.7	Very low	190 Å²	190	151.3 Å²	151.3	83%	0.826	80%	0.8	S	S	*	*			trans	-95.2	140.7	-172.5	-59.6	175.2	178.8	177.9	0	111.1
342	M	29.3	Very low	31.3	Very low	194 Å²	194	147.4 Å²	147.4	96%	0.956	77%	0.772	S	S	*	*			trans	-134.9	160.3	134.4	-76.7	-165.8	69.7	0	0	108.5
343	R	30	Very low	30.9	Very low	227 Å²	227	139.6 Å²	139.6	86%	0.857	74%	0.739	S	S	*	*			trans	-120.7	138.3	-142	174.2	-179.5	-178.3	-171	1.6	113
344	L	26.9	Very low	30.8	Very low	130 Å²	130	133.6 Å²	133.6	68%	0.681	72%	0.716	S	S	*	*			trans	33	130.7	147.9	-118.5	56.7	0	0	0	118.6
345	E	25.2	Very low	30.1	Very low	161 Å²	161	130.9 Å²	130.9	75%	0.752	71%	0.71	S	S	*	*				-160.8	164.2	69.6	-86.3	-65.6	157.7	0	0	113.5
346	R	25.7	Very low	30.1	Very low	226 Å²	226	131.1 Å²	131.1	85%	0.853	70%	0.695	S	S	*	*			trans	-167.2	170.4	178.6	-136.7	-156.3	172.8	153.2	-0.5	108.5
347	P	42.8	Very low	29.9	Very low	115 Å²	115	129.8 Å²	129.8	75%	0.747	69%	0.686	S	S	*	*			cis	-129.3	175.6	-18.1	26.7	-4	0	0	0	115.1
348	G	25	Very low	29.8	Very low	59 Å²	59	129.9 Å²	129.9	61%	0.608	68%	0.681	S	S	*	*			trans	-171	113.1	159.3	0	0	0	0	0	110.6
349	T	25.8	Very low	29.3	Very low	137 Å²	137	128.8 Å²	128.8	84%	0.84	68%	0.676	S	S	*	*				83.1	133.1	89.5	50	0	0	0	0	116.3
350	S	26.3	Very low	29.3	Very low	99 Å²	99	128.9 Å²	128.9	69%	0.692	68%	0.677	S	S	*	*			trans	62.4	126	157.3	51.2	0	0	0	0	119.1
351	S	25.8	Very low	29.2	Very low	86 Å²	86	126.6 Å²	126.6	60%	0.601	67%	0.674	S	S	*	*				89.3	156.8	53.2	-61.1	0	0	0	0	114.6
352	S	29.6	Very low	29.2	Very low	35 Å²	35	122.8 Å²	122.8	25%	0.245	67%	0.672	C	S	.	*			trans	72.4	145.9	170.3	-78	0	0	0	0	120.3	Q255 L258 A259 D262	Q255-S352 VanDerWaalsContact CG-C 3.43Å; Q255-S352 VanDerWaalsContact CG-CA 3.43Å; Q255-S352 VanDerWaalsContact CG-N 3.31Å; Q255-S352 PolarHBondContact NE2-O 3.12Å; L258-S352 WeakPolarHBondContact CD2-OG 3.31Å; A259-S352 WeakPolarHBondContact CB-OG 3.31Å; A259-S352 PolarHBondContact N-OG 2.91Å; D262-S352 PolarHBondContact OD2-OG 3.49Å
353	K	31.8	Very low	29.2	Very low	41 Å²	41	123.8 Å²	123.8	18%	0.178	67%	0.671	C	S	.	*			cis	-173.4	152.9	-22.3	-149.6	114.4	-68.5	-134.1	0	118.6	L254 Q255 K256 L258 A259	L254-K353 VanDerWaalsContact C-NZ 3.25Å; L254-K353 PolarHBondContact O-NZ 3.38Å; Q255-K353 WeakPolarHBondContact O-CA 3.41Å; Q255-K353 WeakPolarHBondContact O-CE 3.29Å; Q255-K353 WeakPolarHBondContact O-CG 3.39Å; K256-K353 VanDerWaalsContact C-NZ 3.25Å; K256-K353 VanDerWaalsContact O-CD 3.29Å; K256-K353 WeakPolarHBondContact O-CD 3.41Å; L258-K353 HydrophobicContact CB-CD 4.42Å; L258-K353 VanDerWaalsContact CB-NZ 3.35Å; A259-K353 HydrophobicContact CB-CB 3.55Å; A259-K353 HydrophobicContact CB-CD 3.51Å; A259-K353 HydrophobicContact CB-CG 3.72Å
354	R	32.1	Very low	29.1	Very low	122 Å²	122	119 Å²	119	46%	0.46	67%	0.672	S	S	.	*			trans	71.1	144.5	151.6	-83.5	160.3	-168.2	-141	-11.9	119.3	Q255 K256 G260	Q255-R354 PolarHBondContact O-N 3.39Å; K256-R354 HydrophobicContact CG-CG 4.11Å; K256-R354 PolarHBondContact O-NE 3.02Å; K256-R354 PolarHBondContact O-NH2 2.82Å; G260-R354 VanDerWaalsContact CA-CZ 3.41Å
355	G	26.1	Very low	29.3	Very low	66 Å²	66	117.4 Å²	117.4	68%	0.68	68%	0.678	S	S	*	*			cis	-168.7	-161	3	0	0	0	0	0	110.4
356	E	30	Very low	29.6	Very low	100 Å²	100	119.1 Å²	119.1	47%	0.467	69%	0.686	S	S	.	*			cis	-170.5	127.7	-7.2	-110.9	-78.1	78.4	0	0	109.5	K256	K256-E356 WeakPolarHBondContact CE-OE1 3.46Å; K256-E356 IonicContact NZ-OE1 3Å; K256-E356 PolarHBondContact NZ-OE1 3.45Å
357	K	30.1	Very low	29.8	Very low	161 Å²	161	115.5 Å²	115.5	70%	0.7	68%	0.683	S	S	*	*			trans	71.5	150.1	151.3	-68.3	176.2	171.9	150.5	0	121.1
358	L	29	Very low	29.3	Very low	142 Å²	142	118.6 Å²	118.6	74%	0.743	69%	0.688	S	S	*	*			cis	-163.1	155.4	3.5	-117	164.6	0	0	0	113.5
359	S	28.5	Very low	29.5	Very low	90 Å²	90	123 Å²	123	63%	0.629	70%	0.697	S	S	*	*			trans	38	124.2	153.4	53.7	0	0	0	0	122.4
360	S	31.4	Very low	29.7	Very low	108 Å²	108	121.7 Å²	121.7	76%	0.755	69%	0.693	S	S	*	*				75.8	137.9	59	81.1	0	0	0	0	114.5
361	L	30.9	Very low	29.9	Very low	169 Å²	169	121 Å²	121	89%	0.885	69%	0.694	S	S	*	*			cis	-156.6	178.9	44.1	-100.2	159.9	0	0	0	113.9
362	S	31.2	Very low	30.3	Very low	111 Å²	111	124 Å²	124	78%	0.776	70%	0.703	S	S	*	*			trans	-122.5	175.8	-169.7	56.7	0	0	0	0	116
363	K	29.2	Very low	30.5	Very low	215 Å²	215	132.5 Å²	132.5	94%	0.935	73%	0.731	S	S	*	*			trans	-142.5	153.5	170.7	-84.4	-170.9	175.3	-177.9	0	112.8
364	S	28.5	Very low	31.1	Very low	127 Å²	127	135 Å²	135	89%	0.888	75%	0.751	S	S	*	*			trans	-114.9	175.9	-179.9	54.4	0	0	0	0	113
365	A	30.8	Very low	31.1	Very low	96 Å²	96	139 Å²	139	79%	0.793	77%	0.773	S	S	*	*			trans	-130.6	161.1	-171.5	0	0	0	0	0	113.1
366	Q	31.1	Very low	31.7	Very low	197 Å²	197	143.8 Å²	143.8	92%	0.921	78%	0.781	S	S	*	*			trans	-147.9	158.4	163.1	-76.9	-160.1	-46.1	0	0	111.7
367	N	29.9	Very low	32.2	Very low	149 Å²	149	149.9 Å²	149.9	80%	0.797	80%	0.8	S	S	*	*			trans	-99.3	164.7	176.9	-71.7	-29.4	0	0	0	111.7
368	E	32.3	Very low	32.9	Very low	181 Å²	181	149.3 Å²	149.3	85%	0.846	81%	0.805	S	S	*	*				176.9	172.2	117.3	-89.4	-55.6	121.6	0	0	109.8
369	D	30.1	Very low	33.2	Very low	152 Å²	152	147.9 Å²	147.9	81%	0.813	81%	0.807	S	S	*	*			trans	-124.1	171.7	-143.8	-154.6	0.3	0	0	0	117.2
370	S	28.9	Very low	33.7	Very low	108 Å²	108	151.9 Å²	151.9	76%	0.755	82%	0.82	S	S	*	*			trans	81.6	117.3	152.4	-156	0	0	0	0	122.6
371	A	31.3	Very low	34.1	Very low	86 Å²	86	154.1 Å²	154.1	71%	0.711	82%	0.823	S	S	*	*				167	113.4	120.3	0	0	0	0	0	117
372	L	34.2	Very low	34.5	Very low	149 Å²	149	155.9 Å²	155.9	78%	0.78	82%	0.824	S	S	*	*			trans	65.9	109.2	142.1	-50.5	177.4	0	0	0	126.2
373	Y	33.2	Very low	34.8	Very low	212 Å²	212	162.3 Å²	162.3	83%	0.831	83%	0.831	S	S	*	*				59.7	163.8	129.4	-75.7	-92.5	0	0	0	122.8
374	P	43.5	Very low	35.2	Very low	93 Å²	93	161.7 Å²	161.7	60%	0.604	83%	0.828	S	S	*	*				-143.6	119.7	-60.5	38.1	-17.9	0	0	0	115.8
375	F	32.9	Very low	35.4	Very low	208 Å²	208	165.8 Å²	165.8	91%	0.912	83%	0.83	S	S	*	*			trans	-144.4	164.5	165.1	-89.9	-81	0	0	0	113.3
376	L	39	Very low	35.5	Very low	165 Å²	165	167.4 Å²	167.4	86%	0.864	83%	0.83	S	S	*	*			trans	80	66.2	176.3	-50.6	-177.7	0	0	0	117.1
377	R	39.9	Very low	35.6	Very low	228 Å²	228	168.3 Å²	168.3	86%	0.86	83%	0.832	S	S	*	*			trans	-54.8	145.2	139.4	-163.8	-176.5	-164.4	-168.5	4.8	109.3
378	N	46	Very low	36	Very low	150 Å²	150	165.1 Å²	165.1	80%	0.802	83%	0.833	S	S	*	*			trans	103.9	89.7	172.2	-52.6	-26.6	0	0	0	116.9
379	S	33.9	Very low	36	Very low	112 Å²	112	162 Å²	162	78%	0.783	83%	0.832	S	S	*	*			trans	-151.1	121.4	140.1	56.4	0	0	0	0	111
380	L	40.1	Very low	36.6	Very low	174 Å²	174	163.1 Å²	163.1	91%	0.911	83%	0.834	S	S	*	*			trans	-100.9	98.4	179.7	-71.6	167	0	0	0	109.1
381	L	39.4	Very low	37	Very low	154 Å²	154	166.4 Å²	166.4	81%	0.806	84%	0.842	S	S	*	*			trans	-129.4	41.7	178.4	-72.4	179.2	0	0	0	114.5
382	F	39.3	Very low	37.1	Very low	207 Å²	207	171 Å²	171	91%	0.908	85%	0.849	S	S	*	*			trans	-132.9	76	158.5	-72	-68.2	0	0	0	112.1
383	R	38.2	Very low	37.2	Very low	246 Å²	246	169.7 Å²	169.7	93%	0.928	85%	0.85	S	S	*	*			trans	-129.5	117.5	152.3	-114.8	-171.6	174.7	-154.3	-3	110.1
384	K	35.8	Very low	37.3	Very low	202 Å²	202	168.3 Å²	168.3	88%	0.878	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-59.1	137.7	174.5	-73.9	175.8	173.9	174.9	0	109.6	T386	K384-T386 PolarHBondContact O-N 3.49Å
385	K	33.3	Very low	36.9	Very low	212 Å²	212	173.5 Å²	173.5	92%	0.922	86%	0.864	S	S	*	*	P	Polyproline II helix	trans	-69.3	116.2	169.2	-68.4	-179.4	178.3	178.9	0	109.3
386	T	32.7	Very low	37	Very low	131 Å²	131	173.2 Å²	173.2	80%	0.804	86%	0.862	S	S	*	*	P	Polyproline II helix	trans	-97.5	156.8	153.7	47.2	0	0	0	0	109	K384	K384-T386 PolarHBondContact O-N 3.49Å
387	F	32.9	Very low	37	Very low	216 Å²	216	170.2 Å²	170.2	95%	0.947	86%	0.861	S	S	*	*	P	Polyproline II helix	trans	-55.6	151.2	-175.9	-90.9	-110.4	0	0	0	113.1
388	G	39.6	Very low	36.9	Very low	81 Å²	81	162.7 Å²	162.7	84%	0.835	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-71.7	153	-171.9	0	0	0	0	0	114.5
389	S	32.5	Very low	37	Very low	116 Å²	116	161.8 Å²	161.8	81%	0.811	85%	0.854	S	S	*	*			trans	-138.3	139.9	154.9	-174.6	0	0	0	0	107.3
390	M	41.5	Very low	37.3	Very low	175 Å²	175	161.2 Å²	161.2	86%	0.862	84%	0.842	S	S	*	*			trans	-65.9	136	162.2	-70.5	-179.5	62.3	0	0	108.9
391	L	38	Very low	38	Very low	177 Å²	177	160.2 Å²	160.2	93%	0.927	83%	0.832	S	S	*	*			trans	164.2	155.3	139.5	-87	169.3	0	0	0	109.4
392	E	33.2	Very low	38.9	Very low	184 Å²	184	156.7 Å²	156.7	86%	0.86	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-90.8	144.9	-158.9	-160	163.5	-178.6	0	0	113.3
393	P	37.1	Very low	40.1	Very low	121 Å²	121	147.9 Å²	147.9	79%	0.786	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-91.8	116.8	-168.7	1.2	18.8	0	0	0	113.3
394	Q	34	Very low	40.9	Very low	183 Å²	183	143.6 Å²	143.6	86%	0.855	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-70.5	141.6	164	-98.1	-152.7	-10.8	0	0	112.2
395	K	34.6	Very low	42.3	Very low	202 Å²	202	137.5 Å²	137.5	88%	0.878	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-87.8	126.6	177	-62.7	173.5	-179.1	172.7	0	111.5
396	K	36.7	Very low	43.6	Very low	202 Å²	202	130 Å²	130	88%	0.878	73%	0.73	S	S	*	*			trans	-138.7	136.1	149.7	-71.8	-168.1	178.7	179.9	0	109.3
397	A	37.4	Very low	44.8	Very low	101 Å²	101	131.8 Å²	131.8	84%	0.835	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-96.7	134.8	-177	0	0	0	0	0	111
398	G	39.4	Very low	45.8	Very low	70 Å²	70	124.3 Å²	124.3	72%	0.722	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-79.9	136.7	171.8	0	0	0	0	0	111.6
399	V	46.5	Very low	46.6	Very low	132 Å²	132	121.7 Å²	121.7	80%	0.8	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-81.7	137.1	179.3	179.2	0	0	0	0	110.3
400	L	41.8	Very low	47.7	Very low	100 Å²	100	125.8 Å²	125.8	52%	0.524	69%	0.688	S	S	.	*			trans	-105.8	125.2	178.9	-97.2	157.5	0	0	0	110.2	K412 I414	L400-K412 HydrophobicContact CD2-CB 4.15Å; L400-I414 HydrophobicContact CD2-CD1 4.29Å; L400-I414 HydrophobicContact CD2-CG1 3.56Å; L400-I414 HydrophobicContact CG-CG1 4.02Å
401	Q	54	Low	48.6	Very low	153 Å²	153	121.2 Å²	121.2	72%	0.715	67%	0.67	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-117.5	148.3	179.5	-159.4	164.6	0.8	0	0	111.7	K412 F413	Q401-K412 WeakPolarHBondContact O-CA 3.43Å; Q401-F413 PolarHBondContact O-N 3.03Å
402	T	59.2	Low	49.7	Very low	79 Å²	79	119.6 Å²	119.6	49%	0.485	66%	0.655	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.8	124.6	178.1	44	0	0	0	0	110.9	K412	T402-K412 HydrophobicContact CG2-CD 3.77Å; T402-K412 VanDerWaalsContact CG2-CE 3.44Å; T402-K412 HydrophobicContact CG2-CG 3.59Å
403	G	63	Low	51	Low	23 Å²	23	117.1 Å²	117.1	24%	0.237	64%	0.642	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.4	158.9	171.2	0	0	0	0	0	111.9	R410 T411	G403-R410 CarbonylContact O-C 3.6Å; G403-R410 WeakPolarHBondContact O-CA 3.5Å; G403-T411 PolarHBondContact N-O 3.19Å; G403-T411 PolarHBondContact O-N 3.32Å
404	Y	55.9	Low	51.8	Low	156 Å²	156	117.2 Å²	117.2	61%	0.612	64%	0.635	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-81.9	130.8	171.2	-174.8	-106	0	0	0	109.4	G408 G409 R410	Y404-G408 WeakPolarHBondContact OH-CA 3.3Å; Y404-G408 PolarHBondContact OH-N 3.09Å; Y404-G409 WeakPolarHBondContact CA-O 3.48Å; Y404-G409 WeakPolarHBondContact CD2-O 3.35Å; Y404-R410 HydrophobicContact CD2-CG 4.04Å
405	D	65.4	Low	52.3	Low	73 Å²	73	116.2 Å²	116.2	39%	0.39	63%	0.63	S	S	.	*			trans	-94.1	5.6	-170.5	53.4	38.6	0	0	0	114.4	L407 G409 T411	D405-L407 PolarHBondContact O-N 3.37Å; D405-L407 PolarHBondContact OD1-N 2.97Å; D405-G409 PolarHBondContact N-O 3.37Å; D405-G409 VanDerWaalsContact OD1-CA 3.27Å; D405-G409 WeakPolarHBondContact OD1-CA 3.46Å; D405-G409 PolarHBondContact OD1-N 3.12Å; D405-G409 VanDerWaalsContact OD2-C 3.3Å; D405-G409 WeakPolarHBondContact OD2-CA 3.2Å; D405-T411 PolarHBondContact OD2-OG1 3.1Å
406	G	59.8	Low	52.7	Low	55 Å²	55	112.1 Å²	112.1	57%	0.567	62%	0.624	S	S	*	*	S	Bend	trans	79.9	-4.5	175.2	0	0	0	0	0	114.9
407	L	58.5	Low	53.1	Low	168 Å²	168	107.5 Å²	107.5	88%	0.88	62%	0.617	S	S	*	*	S	Bend	trans	-114.6	22.1	179.4	-62.1	178.2	0	0	0	113	D405	D405-L407 PolarHBondContact O-N 3.37Å; D405-L407 PolarHBondContact OD1-N 2.97Å
408	G	54.2	Low	53.2	Low	60 Å²	60	107.9 Å²	107.9	62%	0.619	61%	0.611	S	S	*	*	S	Bend	trans	92.5	-4.7	-176.7	0	0	0	0	0	114.7	Y404	Y404-G408 WeakPolarHBondContact OH-CA 3.3Å; Y404-G408 PolarHBondContact OH-N 3.09Å
409	G	56.6	Low	53.3	Low	25 Å²	25	112.7 Å²	112.7	26%	0.258	62%	0.62	S	S	.	*			trans	-102.3	161.8	-177.6	0	0	0	0	0	114.6	Y404 D405	Y404-G409 WeakPolarHBondContact CA-O 3.48Å; Y404-G409 WeakPolarHBondContact CD2-O 3.35Å; D405-G409 PolarHBondContact N-O 3.37Å; D405-G409 VanDerWaalsContact OD1-CA 3.27Å; D405-G409 WeakPolarHBondContact OD1-CA 3.46Å; D405-G409 PolarHBondContact OD1-N 3.12Å; D405-G409 VanDerWaalsContact OD2-C 3.3Å; D405-G409 WeakPolarHBondContact OD2-CA 3.2Å
410	R	54.1	Low	53.2	Low	203 Å²	203	111.2 Å²	111.2	77%	0.766	62%	0.615	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-118.6	114	162.8	-75.4	-174.2	178.4	173.5	0.5	109.8	G403 Y404	G403-R410 CarbonylContact O-C 3.6Å; G403-R410 WeakPolarHBondContact O-CA 3.5Å; Y404-R410 HydrophobicContact CD2-CG 4.04Å
411	T	61.2	Low	53.2	Low	78 Å²	78	115.2 Å²	115.2	48%	0.479	63%	0.631	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.3	147	-174.6	-63.8	0	0	0	0	110.6	G403 D405	G403-T411 PolarHBondContact N-O 3.19Å; G403-T411 PolarHBondContact O-N 3.32Å; D405-T411 PolarHBondContact OD2-OG1 3.1Å
412	K	61	Low	52.5	Low	143 Å²	143	115.3 Å²	115.3	62%	0.622	64%	0.635	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-97.4	131.2	-179.9	-50.5	-160.4	-172.4	-164	0	110.5	L400 Q401 T402	L400-K412 HydrophobicContact CD2-CB 4.15Å; Q401-K412 WeakPolarHBondContact O-CA 3.43Å; T402-K412 HydrophobicContact CG2-CD 3.77Å; T402-K412 VanDerWaalsContact CG2-CE 3.44Å; T402-K412 HydrophobicContact CG2-CG 3.59Å
413	F	60	Low	51.7	Low	133 Å²	133	123 Å²	123	58%	0.583	66%	0.655	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-133.4	163.2	175.9	60.3	-92.1	0	0	0	111.7	Q401	Q401-F413 PolarHBondContact O-N 3.03Å
414	I	54.3	Low	50.7	Low	122 Å²	122	127.9 Å²	127.9	63%	0.626	68%	0.683	S	S	*	*			trans	-110.1	119.7	178.7	-56.6	174.7	0	0	0	107.1	L400 P416	L400-I414 HydrophobicContact CD2-CD1 4.29Å; L400-I414 HydrophobicContact CD2-CG1 3.56Å; L400-I414 HydrophobicContact CG-CG1 4.02Å; I414-P416 WeakPolarHBondContact O-CD 3.24Å
415	Q	45.7	Very low	49.6	Very low	163 Å²	163	129 Å²	129	76%	0.762	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-75.6	124.9	178.2	-174.9	174.4	-6.7	0	0	110.3
416	P	43	Very low	48.3	Very low	116 Å²	116	133.8 Å²	133.8	75%	0.753	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-70.1	141.4	174.3	-17.9	32.1	0	0	0	112	I414	I414-P416 WeakPolarHBondContact O-CD 3.24Å
417	S	44.6	Very low	47.5	Very low	105 Å²	105	141.1 Å²	141.1	73%	0.734	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-71.3	159.4	172.7	-57.7	0	0	0	0	112.4
418	P	39.9	Very low	46.4	Very low	109 Å²	109	138 Å²	138	71%	0.708	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-67.2	152.3	-169.2	-20.6	33.8	0	0	0	115.1	S420	P418-S420 PolarHBondContact O-N 2.99Å
419	L	39.9	Very low	45.6	Very low	171 Å²	171	145.2 Å²	145.2	90%	0.895	75%	0.752	S	S	*	*	S	Bend	trans	-75.6	23.4	-172.8	-64.4	173.3	0	0	0	115.6
420	S	44.6	Very low	44.7	Very low	101 Å²	101	155.9 Å²	155.9	71%	0.706	78%	0.784	S	S	*	*			trans	-90.9	2.5	-169.9	41.7	0	0	0	0	116.1	P418	P418-S420 PolarHBondContact O-N 2.99Å
421	E	42.7	Very low	43.9	Very low	184 Å²	184	156 Å²	156	86%	0.86	79%	0.79	S	S	*	*			trans	-121.5	42.3	-168.4	-63.3	-170.3	170.8	0	0	115.8
422	I	39.8	Very low	42.9	Very low	155 Å²	155	162.2 Å²	162.2	80%	0.795	81%	0.811	S	S	*	*			trans	-115.5	111.6	175	-53	-179.9	0	0	0	111.1
423	R	41.7	Very low	41.8	Very low	239 Å²	239	162.1 Å²	162.1	90%	0.902	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-99.9	150.3	173.3	-104.7	-175.3	-176.8	173.5	3.2	112.3
424	P	41.2	Very low	40.8	Very low	127 Å²	127	162.4 Å²	162.4	83%	0.825	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-83.5	151.1	-176.3	-7.3	26.2	0	0	0	114
425	L	34.3	Very low	40.2	Very low	178 Å²	178	168 Å²	168	93%	0.932	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-86.9	147.9	179.1	-80.7	163.2	0	0	0	114
426	L	36.8	Very low	40.1	Very low	175 Å²	175	165.4 Å²	165.4	92%	0.916	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-83.2	153.8	-178.6	-76.4	161.8	0	0	0	113.9
427	K	43.9	Very low	40.2	Very low	209 Å²	209	166.2 Å²	166.2	91%	0.909	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-81.4	137.7	-176.4	-62.7	175.9	179.5	174.4	0	112.9
428	A	34.9	Very low	40	Very low	101 Å²	101	166.1 Å²	166.1	84%	0.835	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-97	145.3	172.2	0	0	0	0	0	113.1
429	K	36.6	Very low	40.1	Very low	213 Å²	213	170.9 Å²	170.9	93%	0.926	86%	0.86	S	S	*	*	P	Polyproline II helix	trans	-81.4	142.7	-177	-70.7	-179.7	176.3	177.2	0	112.9
430	R	39.3	Very low	40.4	Very low	249 Å²	249	169.7 Å²	169.7	94%	0.94	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-76.9	140.3	173.1	-72.2	177.1	166.8	173.8	-5.6	112
431	K	35.9	Very low	40.4	Very low	205 Å²	205	170.6 Å²	170.6	89%	0.891	86%	0.856	S	S	*	*	P	Polyproline II helix	trans	-89.1	142.9	159.6	-78.8	-174.4	174.6	-178.4	0	110
432	K	41	Very low	40.5	Very low	209 Å²	209	173.5 Å²	173.5	91%	0.909	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-82.6	143.2	175	-68	-177.8	177.4	-178.8	0	110.4
433	V	37.3	Very low	40.7	Very low	141 Å²	141	172 Å²	172	86%	0.855	86%	0.861	S	S	*	*			trans	-131.6	125.3	167.2	178.9	0	0	0	0	107.6
434	T	40.2	Very low	41.1	Very low	139 Å²	139	168.4 Å²	168.4	85%	0.853	86%	0.859	S	S	*	*			trans	-90.9	143	175.4	31.3	0	0	0	0	110.7
435	R	41.7	Very low	42	Very low	238 Å²	238	167.5 Å²	167.5	90%	0.898	85%	0.851	S	S	*	*			trans	-115.1	136.8	-179.7	-168.7	-178.4	-171.6	-172.5	2.6	109.3
436	P	42.5	Very low	42.7	Very low	109 Å²	109	166.9 Å²	166.9	71%	0.708	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-71.5	155.4	176	30.1	-34.8	0	0	0	111.7
437	P	44.7	Very low	43.6	Very low	133 Å²	133	165.3 Å²	165.3	86%	0.864	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-77.6	134.8	-171.1	30.4	-35	0	0	0	113.2
438	S	40.1	Very low	44.2	Very low	103 Å²	103	160.5 Å²	160.5	72%	0.72	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-87.6	130.4	170.3	51	0	0	0	0	111.2
439	K	42.1	Very low	44.7	Very low	210 Å²	210	164.9 Å²	164.9	91%	0.913	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-66	132.2	172.2	-64.3	178.7	178.9	179.6	0	110.1
440	I	47.1	Very low	45.3	Very low	146 Å²	146	163 Å²	163	75%	0.749	83%	0.832	S	S	*	*			trans	-105.5	124.2	179.5	-62.1	169	0	0	0	108.9
441	P	44.6	Very low	45.3	Very low	119 Å²	119	164.2 Å²	164.2	77%	0.773	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-72.7	133.9	160.7	-9.1	26.2	0	0	0	109.4	C443	P441-C443 PolarHBondContact O-N 3.46Å
442	R	44.3	Very low	45.8	Very low	246 Å²	246	162.2 Å²	162.2	93%	0.928	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-64.5	129.3	-178.5	-68.7	177.2	176.1	171.6	-3.2	110.8
443	C	45.1	Very low	46	Very low	123 Å²	123	159.7 Å²	159.7	83%	0.831	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-87	134.2	164.9	-158.3	0	0	0	0	108.3	P441	P441-C443 PolarHBondContact O-N 3.46Å
444	L	50.3	Low	46.5	Very low	164 Å²	164	160.7 Å²	160.7	86%	0.859	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-78.4	132	-179.9	-65.7	166.4	0	0	0	109.8
445	T	58.9	Low	46.9	Very low	108 Å²	108	162 Å²	162	66%	0.663	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-95.7	156.8	172.2	49.1	0	0	0	0	111	D447	T445-D447 PolarHBondContact O-N 2.76Å
446	L	50.5	Low	47.2	Very low	165 Å²	165	157.3 Å²	157.3	86%	0.864	84%	0.839	S	S	*	*	S	Bend	trans	-79.1	45.4	-168.8	-78.2	161.9	0	0	0	114.3
447	D	55.3	Low	47.5	Very low	142 Å²	142	160.5 Å²	160.5	76%	0.759	85%	0.847	S	S	*	*			trans	-118.6	25.1	179.5	-58.3	-59.7	0	0	0	112.3	T445	T445-D447 PolarHBondContact O-N 2.76Å
448	S	55.3	Low	47.7	Very low	107 Å²	107	162.4 Å²	162.4	75%	0.748	85%	0.846	S	S	*	*			trans	-125.5	29	-178.7	-52.5	0	0	0	0	113.4
449	F	46.8	Very low	48.3	Very low	193 Å²	193	167 Å²	167	85%	0.846	86%	0.856	S	S	*	*	S	Bend	trans	-117	81	164.8	-90.8	-91.4	0	0	0	108.3
450	L	48	Very low	48.8	Very low	174 Å²	174	163.4 Å²	163.4	91%	0.911	85%	0.851	S	S	*	*			trans	163.5	71.3	153.5	-90.2	169.5	0	0	0	110.4
451	E	39.7	Very low	49	Very low	274 Å²	274	165 Å²	165	100%	1.28	86%	0.86	S	S	*	*			trans	-164.1	0	145.2	-113	176	-178.3	0	0	109.7

Retrieved 451 of 451 residues in 282.5 ms (Link to these results)

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