A0A3Q7K6N0_SCHMA Loading...

Putative translation initiation factor IF-2

AlphaFold DB , UniProt , Accession A0A3Q7K6N0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 263 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	50.2	Low	51.5	Low	174 Å²	174	113.8 Å²	113.8	86%	0.857	58%	0.582	S	S	*	*				0	-58.1	0	-166.1	177.9	-76.6	0	0	111.6	E3 A4 I5	M1-E3 VanDerWaalsContact C-N 3.32Å; M1-E3 PolarHBondContact O-N 2.67Å; M1-A4 PolarHBondContact O-N 2.72Å; M1-A4 VanDerWaalsContact O-N 3.11Å; M1-I5 PolarHBondContact O-N 3.03Å
2	I	48.4	Very low	51.4	Low	134 Å²	134	109.2 Å²	109.2	69%	0.687	56%	0.56	S	S	*	*	H	α-helix	trans	-52	-44	-178.5	-62.9	173	0	0	0	113	A4 I5 N6	I2-A4 VanDerWaalsContact C-N 3.33Å; I2-A4 PolarHBondContact O-N 2.61Å; I2-I5 WeakPolarHBondContact O-CB 3.47Å; I2-I5 PolarHBondContact O-N 2.89Å; I2-I5 VanDerWaalsContact O-N 3.12Å; I2-N6 PolarHBondContact O-N 3.05Å
3	E	51.6	Low	51.4	Low	153 Å²	153	110.7 Å²	110.7	72%	0.715	56%	0.563	S	S	*	*	H	α-helix	trans	-60.2	-38.4	179.5	-64.6	171.4	121	0	0	113.6	M1 I5 N6 I7	M1-E3 VanDerWaalsContact C-N 3.32Å; M1-E3 PolarHBondContact O-N 2.67Å; E3-I5 VanDerWaalsContact C-N 3.29Å; E3-I5 PolarHBondContact O-N 3.09Å; E3-N6 PolarHBondContact O-N 3.19Å; E3-I7 VanDerWaalsContact O-CG1 3.3Å; E3-I7 WeakPolarHBondContact O-CG1 3.24Å; E3-I7 PolarHBondContact O-N 2.97Å
4	A	48.6	Very low	51.3	Low	65 Å²	65	107 Å²	107	54%	0.537	55%	0.552	S	S	.	*	H	α-helix	trans	-66.1	-33.3	177.7	0	0	0	0	0	111.9	M1 I2 S8	M1-A4 PolarHBondContact O-N 2.72Å; M1-A4 VanDerWaalsContact O-N 3.11Å; I2-A4 VanDerWaalsContact C-N 3.33Å; I2-A4 PolarHBondContact O-N 2.61Å; A4-S8 WeakPolarHBondContact O-CB 3.34Å; A4-S8 PolarHBondContact O-N 3.22Å
5	I	53.6	Low	51.2	Low	95 Å²	95	104.9 Å²	104.9	49%	0.487	55%	0.546	S	S	.	.	H	α-helix	trans	-68.5	-47.2	174.1	-60.4	171.6	0	0	0	109.7	M1 I2 E3 I7 S8 Q9	M1-I5 PolarHBondContact O-N 3.03Å; I2-I5 WeakPolarHBondContact O-CB 3.47Å; I2-I5 PolarHBondContact O-N 2.89Å; I2-I5 VanDerWaalsContact O-N 3.12Å; E3-I5 VanDerWaalsContact C-N 3.29Å; E3-I5 PolarHBondContact O-N 3.09Å; I5-I7 PolarHBondContact O-N 2.83Å; I5-S8 PolarHBondContact O-N 3.49Å; I5-Q9 PolarHBondContact O-N 3.22Å
6	N	51.7	Low	50.9	Low	90 Å²	90	100.4 Å²	100.4	48%	0.481	53%	0.527	S	S	.	.	H	α-helix	trans	-60	-42.4	176.5	-100	-25.6	0	0	0	112.9	I2 E3 Q9 R10	I2-N6 PolarHBondContact O-N 3.05Å; E3-N6 PolarHBondContact O-N 3.19Å; N6-Q9 PolarHBondContact O-N 2.92Å; N6-R10 WeakPolarHBondContact O-CG 3.14Å; N6-R10 PolarHBondContact O-N 3.46Å
7	I	54	Low	50.7	Low	111 Å²	111	102.5 Å²	102.5	57%	0.569	53%	0.533	S	S	*	.	H	α-helix	trans	-63.2	-45.9	174.6	-69.1	165.5	0	0	0	110	E3 I5 Q9 R10 V11	E3-I7 VanDerWaalsContact O-CG1 3.3Å; E3-I7 WeakPolarHBondContact O-CG1 3.24Å; E3-I7 PolarHBondContact O-N 2.97Å; I5-I7 PolarHBondContact O-N 2.83Å; I7-Q9 VanDerWaalsContact C-N 3.31Å; I7-Q9 PolarHBondContact O-N 2.96Å; I7-R10 PolarHBondContact O-N 2.67Å; I7-V11 HydrophobicContact CG2-CG2 4.33Å; I7-V11 WeakPolarHBondContact O-CB 3.18Å; I7-V11 WeakPolarHBondContact O-CG2 3.16Å; I7-V11 PolarHBondContact O-N 3.02Å
8	S	51.3	Low	50.5	Low	51 Å²	51	107.3 Å²	107.3	36%	0.357	54%	0.543	S	S	.	.	H	α-helix	trans	-61.8	-36	178.3	-167.5	0	0	0	0	112.9	A4 I5 N12	A4-S8 WeakPolarHBondContact O-CB 3.34Å; A4-S8 PolarHBondContact O-N 3.22Å; I5-S8 PolarHBondContact O-N 3.49Å; S8-N12 WeakPolarHBondContact O-CB 3.46Å; S8-N12 PolarHBondContact O-N 3.17Å
9	Q	52.3	Low	50.3	Low	110 Å²	110	104.7 Å²	104.7	51%	0.514	53%	0.533	S	S	.	.	H	α-helix	trans	-68.8	-51	175.3	-74	179.2	-63.5	0	0	111.5	I5 N6 I7 V11 N12 E13	I5-Q9 PolarHBondContact O-N 3.22Å; N6-Q9 PolarHBondContact O-N 2.92Å; I7-Q9 VanDerWaalsContact C-N 3.31Å; I7-Q9 PolarHBondContact O-N 2.96Å; Q9-V11 VanDerWaalsContact C-N 3.32Å; Q9-V11 PolarHBondContact O-N 2.71Å; Q9-N12 WeakPolarHBondContact O-CB 3.21Å; Q9-N12 PolarHBondContact O-N 3.26Å; Q9-E13 PolarHBondContact O-N 3.4Å
10	R	51.2	Low	50	Low	188 Å²	188	101.7 Å²	101.7	71%	0.709	52%	0.518	S	S	*	.	H	α-helix	trans	-62.6	-35.4	-178.6	-69.4	-177	70.7	-168.4	1.9	113.3	N6 I7 S14	N6-R10 WeakPolarHBondContact O-CG 3.14Å; N6-R10 PolarHBondContact O-N 3.46Å; I7-R10 PolarHBondContact O-N 2.67Å; R10-S14 WeakPolarHBondContact O-CB 3.37Å; R10-S14 PolarHBondContact O-N 2.63Å; R10-S14 PolarHBondContact O-OG 2.83Å
11	V	53.9	Low	49.8	Very low	81 Å²	81	103 Å²	103	49%	0.491	52%	0.522	S	S	.	.	H	α-helix	trans	-67.4	-38.7	173.6	171.5	0	0	0	0	111.1	I7 Q9 S14 T15	I7-V11 HydrophobicContact CG2-CG2 4.33Å; I7-V11 WeakPolarHBondContact O-CB 3.18Å; I7-V11 WeakPolarHBondContact O-CG2 3.16Å; I7-V11 PolarHBondContact O-N 3.02Å; Q9-V11 VanDerWaalsContact C-N 3.32Å; Q9-V11 PolarHBondContact O-N 2.71Å; V11-S14 PolarHBondContact O-OG 2.75Å; V11-T15 VanDerWaalsContact O-CB 3.25Å; V11-T15 WeakPolarHBondContact O-CB 3.11Å; V11-T15 PolarHBondContact O-N 3.01Å; V11-T15 PolarHBondContact O-OG1 3.23Å
12	N	49.7	Very low	49.5	Very low	58 Å²	58	97.8 Å²	97.8	31%	0.31	50%	0.503	S	S	.	.	H	α-helix	trans	-67.9	-45.2	-178.9	-164	36.4	0	0	0	112.4	S8 Q9 S16 V232	S8-N12 WeakPolarHBondContact O-CB 3.46Å; S8-N12 PolarHBondContact O-N 3.17Å; Q9-N12 WeakPolarHBondContact O-CB 3.21Å; Q9-N12 PolarHBondContact O-N 3.26Å; N12-S16 VanDerWaalsContact O-CB 3.3Å; N12-S16 WeakPolarHBondContact O-CB 3.02Å; N12-S16 PolarHBondContact O-N 3.33Å; N12-S16 PolarHBondContact O-OG 3.33Å; N12-V232 WeakPolarHBondContact ND2-CG1 3.03Å; N12-V232 VanDerWaalsContact OD1-CG1 3.31Å; N12-V232 WeakPolarHBondContact OD1-CG1 3.22Å; N12-V232 WeakPolarHBondContact OD1-CG2 3.5Å
13	E	52.4	Low	49.4	Very low	129 Å²	129	93.8 Å²	93.8	60%	0.603	49%	0.485	S	S	*	.	H	α-helix	trans	-62.4	-52.4	176.4	-67.9	177.9	134.4	0	0	111.8	Q9 T15 S16 Q17	Q9-E13 PolarHBondContact O-N 3.4Å; E13-T15 VanDerWaalsContact C-N 3.33Å; E13-T15 PolarHBondContact O-N 3.14Å; E13-S16 PolarHBondContact O-N 3.15Å; E13-Q17 PolarHBondContact O-N 2.96Å
14	S	49.7	Very low	48.9	Very low	59 Å²	59	89.2 Å²	89.2	41%	0.413	47%	0.469	S	S	.	.	H	α-helix	trans	-67.4	-30	-176.5	56.8	0	0	0	0	113.6	R10 V11 R18	R10-S14 WeakPolarHBondContact O-CB 3.37Å; R10-S14 PolarHBondContact O-N 2.63Å; R10-S14 PolarHBondContact O-OG 2.83Å; V11-S14 PolarHBondContact O-OG 2.75Å; S14-R18 WeakPolarHBondContact O-CG 3.25Å; S14-R18 PolarHBondContact O-N 3.14Å
15	T	49.2	Very low	48.7	Very low	75 Å²	75	92.5 Å²	92.5	46%	0.46	47%	0.474	S	S	.	.	H	α-helix	trans	-72.2	-45	171.9	-54.6	0	0	0	0	110.9	V11 E13 Q17 R18 V19	V11-T15 VanDerWaalsContact O-CB 3.25Å; V11-T15 WeakPolarHBondContact O-CB 3.11Å; V11-T15 PolarHBondContact O-N 3.01Å; V11-T15 PolarHBondContact O-OG1 3.23Å; E13-T15 VanDerWaalsContact C-N 3.33Å; E13-T15 PolarHBondContact O-N 3.14Å; T15-Q17 PolarHBondContact O-N 2.88Å; T15-R18 PolarHBondContact O-N 3.32Å; T15-V19 HydrophobicContact CG2-CG2 4.36Å; T15-V19 WeakPolarHBondContact O-CG2 3.25Å; T15-V19 PolarHBondContact O-N 3.17Å; T15-V19 VanDerWaalsContact O-N 3.08Å
16	S	47.1	Very low	48.1	Very low	34 Å²	34	96.9 Å²	96.9	24%	0.238	48%	0.484	C	S	.	.	H	α-helix	trans	-62.8	-44.2	-178.3	-59.6	0	0	0	0	112.3	N12 E13 N20	N12-S16 VanDerWaalsContact O-CB 3.3Å; N12-S16 WeakPolarHBondContact O-CB 3.02Å; N12-S16 PolarHBondContact O-N 3.33Å; N12-S16 PolarHBondContact O-OG 3.33Å; E13-S16 PolarHBondContact O-N 3.15Å; S16-N20 WeakPolarHBondContact O-CB 3.36Å; S16-N20 PolarHBondContact O-N 3.02Å; S16-N20 VanDerWaalsContact O-N 3.1Å
17	Q	47.5	Very low	47.7	Very low	136 Å²	136	94.8 Å²	94.8	64%	0.636	48%	0.475	S	S	*	.	H	α-helix	trans	-59.9	-52.7	176.5	-75.5	-177.9	-28.6	0	0	111.9	E13 T15 V19 N20 E21	E13-Q17 PolarHBondContact O-N 2.96Å; T15-Q17 PolarHBondContact O-N 2.88Å; Q17-V19 VanDerWaalsContact C-N 3.33Å; Q17-V19 PolarHBondContact O-N 3.21Å; Q17-N20 PolarHBondContact O-N 2.87Å; Q17-E21 PolarHBondContact O-N 2.72Å
18	R	45.8	Very low	47	Very low	189 Å²	189	92.5 Å²	92.5	71%	0.713	46%	0.464	S	S	*	.	H	α-helix	trans	-65.5	-33.4	-175.7	-69.5	-173.7	69	179	1.2	113.4	S14 T15 S22	S14-R18 WeakPolarHBondContact O-CG 3.25Å; S14-R18 PolarHBondContact O-N 3.14Å; T15-R18 PolarHBondContact O-N 3.32Å; R18-S22 WeakPolarHBondContact O-CB 3.33Å; R18-S22 PolarHBondContact O-N 2.97Å; R18-S22 PolarHBondContact O-OG 3.24Å
19	V	47.3	Very low	46.6	Very low	58 Å²	58	96.4 Å²	96.4	35%	0.352	48%	0.476	S	S	.	.	H	α-helix	trans	-69.8	-43.1	174.7	172	0	0	0	0	110.8	T15 Q17 T23	T15-V19 HydrophobicContact CG2-CG2 4.36Å; T15-V19 WeakPolarHBondContact O-CG2 3.25Å; T15-V19 PolarHBondContact O-N 3.17Å; T15-V19 VanDerWaalsContact O-N 3.08Å; Q17-V19 VanDerWaalsContact C-N 3.33Å; Q17-V19 PolarHBondContact O-N 3.21Å; V19-T23 VanDerWaalsContact O-CB 3.22Å; V19-T23 WeakPolarHBondContact O-CB 3.29Å; V19-T23 PolarHBondContact O-N 3.28Å; V19-T23 PolarHBondContact O-OG1 3.08Å
20	N	44.6	Very low	46.1	Very low	44 Å²	44	94.5 Å²	94.5	24%	0.235	48%	0.475	C	S	.	.	H	α-helix	trans	-65.7	-44.3	179	-85.6	4	0	0	0	112.7	S16 Q17 S24 N225	S16-N20 WeakPolarHBondContact O-CB 3.36Å; S16-N20 PolarHBondContact O-N 3.02Å; S16-N20 VanDerWaalsContact O-N 3.1Å; Q17-N20 PolarHBondContact O-N 2.87Å; N20-S24 VanDerWaalsContact O-CB 3.24Å; N20-S24 WeakPolarHBondContact O-CB 3.34Å; N20-S24 PolarHBondContact O-N 3.29Å; N20-S24 PolarHBondContact O-OG 3.02Å; N20-N225 PolarHBondContact ND2-OD1 2.87Å
21	E	45.9	Very low	45.6	Very low	130 Å²	130	87.9 Å²	87.9	61%	0.607	46%	0.455	S	S	*	.	H	α-helix	trans	-61.5	-53.9	177.2	-72.4	-174.9	124.2	0	0	112.2	Q17 T23 S24 Q25	Q17-E21 PolarHBondContact O-N 2.72Å; E21-T23 VanDerWaalsContact C-N 3.33Å; E21-T23 PolarHBondContact O-N 3.34Å; E21-S24 PolarHBondContact O-N 3.23Å; E21-Q25 PolarHBondContact O-N 2.57Å
22	S	44.4	Very low	45	Very low	64 Å²	64	86.5 Å²	86.5	45%	0.448	45%	0.45	S	S	.	.	H	α-helix	trans	-69.3	-28.3	-174.5	59.3	0	0	0	0	113.6	R18 R26	R18-S22 WeakPolarHBondContact O-CB 3.33Å; R18-S22 PolarHBondContact O-N 2.97Å; R18-S22 PolarHBondContact O-OG 3.24Å; S22-R26 WeakPolarHBondContact O-CG 3.32Å
23	T	44.7	Very low	44.6	Very low	50 Å²	50	90.4 Å²	90.4	31%	0.307	47%	0.466	S	S	.	.	H	α-helix	trans	-72.7	-45.3	171.1	-53.8	0	0	0	0	110.9	V19 E21 Q25 R26 V27 V224	V19-T23 VanDerWaalsContact O-CB 3.22Å; V19-T23 WeakPolarHBondContact O-CB 3.29Å; V19-T23 PolarHBondContact O-N 3.28Å; V19-T23 PolarHBondContact O-OG1 3.08Å; E21-T23 VanDerWaalsContact C-N 3.33Å; E21-T23 PolarHBondContact O-N 3.34Å; T23-Q25 PolarHBondContact O-N 3.02Å; T23-R26 PolarHBondContact O-N 3.4Å; T23-V27 HydrophobicContact CG2-CG2 4.29Å; T23-V27 WeakPolarHBondContact O-CG2 3.47Å; T23-V27 PolarHBondContact O-N 3.48Å; T23-V224 HydrophobicContact CG2-CG2 4.48Å
24	S	42.1	Very low	43.9	Very low	56 Å²	56	93.1 Å²	93.1	39%	0.392	47%	0.471	S	S	.	.	H	α-helix	trans	-62.4	-43.7	-177.6	-59.5	0	0	0	0	112.4	N20 E21 N28	N20-S24 VanDerWaalsContact O-CB 3.24Å; N20-S24 WeakPolarHBondContact O-CB 3.34Å; N20-S24 PolarHBondContact O-N 3.29Å; N20-S24 PolarHBondContact O-OG 3.02Å; E21-S24 PolarHBondContact O-N 3.23Å; S24-N28 WeakPolarHBondContact O-CB 3.38Å; S24-N28 VanDerWaalsContact O-CG 3.24Å; S24-N28 PolarHBondContact O-N 2.9Å; S24-N28 PolarHBondContact O-ND2 2.62Å
25	Q	43.9	Very low	43.4	Very low	134 Å²	134	92.4 Å²	92.4	63%	0.626	46%	0.464	S	S	*	.	H	α-helix	trans	-60.2	-51.8	177	-73.4	-179.5	-15.4	0	0	111.8	E21 T23 V27 N28 E29	E21-Q25 PolarHBondContact O-N 2.57Å; T23-Q25 PolarHBondContact O-N 3.02Å; Q25-V27 PolarHBondContact O-N 2.92Å; Q25-N28 PolarHBondContact O-N 3.09Å; Q25-E29 PolarHBondContact O-N 3.26Å; Q25-E29 VanDerWaalsContact O-N 3.15Å
26	R	41.5	Very low	43	Very low	188 Å²	188	92.3 Å²	92.3	71%	0.709	46%	0.46	S	S	*	.	H	α-helix	trans	-66.8	-34.1	-176.2	-69.3	-170.1	68.3	170.7	1.4	113.5	S22 T23 S30	S22-R26 WeakPolarHBondContact O-CG 3.32Å; T23-R26 PolarHBondContact O-N 3.4Å; R26-S30 VanDerWaalsContact O-CB 3.29Å; R26-S30 WeakPolarHBondContact O-CB 3.3Å; R26-S30 PolarHBondContact O-N 3.27Å; R26-S30 PolarHBondContact O-OG 3.46Å
27	V	43	Very low	42.7	Very low	46 Å²	46	97 Å²	97	28%	0.279	48%	0.479	S	S	.	.	H	α-helix	trans	-71.8	-39.4	175.6	176.9	0	0	0	0	111.1	T23 Q25 T31 T220	T23-V27 HydrophobicContact CG2-CG2 4.29Å; T23-V27 WeakPolarHBondContact O-CG2 3.47Å; T23-V27 PolarHBondContact O-N 3.48Å; Q25-V27 PolarHBondContact O-N 2.92Å; V27-T31 VanDerWaalsContact O-CB 3.22Å; V27-T31 WeakPolarHBondContact O-CB 3.48Å; V27-T31 PolarHBondContact O-N 2.97Å; V27-T31 PolarHBondContact O-OG1 3.4Å; V27-T220 HydrophobicContact CG1-CG2 4.26Å
28	N	40.6	Very low	42.2	Very low	63 Å²	63	93.7 Å²	93.7	34%	0.337	47%	0.47	S	S	.	.	H	α-helix	trans	-60	-49.9	177.2	-79.1	-18.3	0	0	0	112.2	S24 Q25 S32 N217	S24-N28 WeakPolarHBondContact O-CB 3.38Å; S24-N28 VanDerWaalsContact O-CG 3.24Å; S24-N28 PolarHBondContact O-N 2.9Å; S24-N28 PolarHBondContact O-ND2 2.62Å; Q25-N28 PolarHBondContact O-N 3.09Å; N28-S32 VanDerWaalsContact O-CB 3.23Å; N28-S32 WeakPolarHBondContact O-CB 3.15Å; N28-S32 PolarHBondContact O-N 3.06Å; N28-S32 PolarHBondContact O-OG 3.06Å; N28-N217 PolarHBondContact OD1-ND2 3.45Å; N28-N217 PolarHBondContact OD1-OD1 3.41Å
29	E	42.8	Very low	41.9	Very low	132 Å²	132	87.1 Å²	87.1	62%	0.617	45%	0.451	S	S	*	.	H	α-helix	trans	-62.7	-51.6	178.4	-69	-175.5	124.8	0	0	111.9	Q25 T31 S32 Q33	Q25-E29 PolarHBondContact O-N 3.26Å; Q25-E29 VanDerWaalsContact O-N 3.15Å; E29-T31 VanDerWaalsContact C-N 3.27Å; E29-T31 PolarHBondContact O-N 3.15Å; E29-S32 PolarHBondContact O-N 3.44Å; E29-Q33 PolarHBondContact O-N 3.35Å
30	S	41.1	Very low	41.5	Very low	71 Å²	71	87.5 Å²	87.5	50%	0.497	46%	0.457	S	S	.	.	H	α-helix	trans	-60.2	-36.7	-176.9	-55.7	0	0	0	0	112.7	R26	R26-S30 VanDerWaalsContact O-CB 3.29Å; R26-S30 WeakPolarHBondContact O-CB 3.3Å; R26-S30 PolarHBondContact O-N 3.27Å; R26-S30 PolarHBondContact O-OG 3.46Å
31	T	40.7	Very low	41.3	Very low	48 Å²	48	92 Å²	92	29%	0.294	48%	0.476	S	S	.	.	H	α-helix	trans	-81.7	-42	-178	-49.1	0	0	0	0	111.1	V27 E29 Q33 R34 V35 V216	V27-T31 VanDerWaalsContact O-CB 3.22Å; V27-T31 WeakPolarHBondContact O-CB 3.48Å; V27-T31 PolarHBondContact O-N 2.97Å; V27-T31 PolarHBondContact O-OG1 3.4Å; E29-T31 VanDerWaalsContact C-N 3.27Å; E29-T31 PolarHBondContact O-N 3.15Å; T31-Q33 VanDerWaalsContact C-N 3.34Å; T31-Q33 PolarHBondContact O-N 2.65Å; T31-R34 PolarHBondContact O-N 2.92Å; T31-V35 HydrophobicContact CG2-CG2 3.83Å; T31-V35 VanDerWaalsContact O-CB 3.32Å; T31-V35 WeakPolarHBondContact O-CB 3.31Å; T31-V35 VanDerWaalsContact O-CG2 3.28Å; T31-V35 WeakPolarHBondContact O-CG2 3.46Å; T31-V35 PolarHBondContact O-N 2.86Å; T31-V216 HydrophobicContact CG2-CG1 4.28Å
32	S	40.3	Very low	40.8	Very low	53 Å²	53	94.3 Å²	94.3	37%	0.371	48%	0.479	S	S	.	.	H	α-helix	trans	-62.4	-39.3	-178.7	-58	0	0	0	0	112.4	N28 E29 N36	N28-S32 VanDerWaalsContact O-CB 3.23Å; N28-S32 WeakPolarHBondContact O-CB 3.15Å; N28-S32 PolarHBondContact O-N 3.06Å; N28-S32 PolarHBondContact O-OG 3.06Å; E29-S32 PolarHBondContact O-N 3.44Å; S32-N36 WeakPolarHBondContact O-CB 3.02Å; S32-N36 PolarHBondContact O-N 3.49Å; S32-N36 VanDerWaalsContact O-N 3.15Å; S32-N36 PolarHBondContact O-ND2 3.09Å; S32-N36 VanDerWaalsContact O-ND2 3.15Å
33	Q	41.3	Very low	40.5	Very low	139 Å²	139	94.5 Å²	94.5	65%	0.65	48%	0.477	S	S	*	.	H	α-helix	trans	-64.4	-54.9	175	-71.4	-176.8	-12	0	0	111.6	E29 T31 V35 N36 E37	E29-Q33 PolarHBondContact O-N 3.35Å; T31-Q33 VanDerWaalsContact C-N 3.34Å; T31-Q33 PolarHBondContact O-N 2.65Å; Q33-V35 PolarHBondContact O-N 2.75Å; Q33-N36 PolarHBondContact O-N 3.39Å; Q33-E37 PolarHBondContact O-N 2.71Å; Q33-E37 VanDerWaalsContact O-N 3.14Å
34	R	38	Very low	40.2	Very low	186 Å²	186	97 Å²	97	70%	0.702	49%	0.489	S	S	*	.	H	α-helix	trans	-67.3	-32.6	-175.5	-65.9	-169.1	71.1	169.6	2.9	113.6	T31 S38	T31-R34 PolarHBondContact O-N 2.92Å; R34-S38 VanDerWaalsContact O-CB 3.23Å; R34-S38 WeakPolarHBondContact O-CB 3.44Å; R34-S38 PolarHBondContact O-N 3.38Å; R34-S38 VanDerWaalsContact O-N 3.11Å; R34-S38 PolarHBondContact O-OG 2.71Å
35	V	40.4	Very low	40.1	Very low	44 Å²	44	100.5 Å²	100.5	27%	0.267	50%	0.499	S	S	.	.	H	α-helix	trans	-70.9	-42.1	175.3	172.3	0	0	0	0	110.8	T31 Q33 T39	T31-V35 HydrophobicContact CG2-CG2 3.83Å; T31-V35 VanDerWaalsContact O-CB 3.32Å; T31-V35 WeakPolarHBondContact O-CB 3.31Å; T31-V35 VanDerWaalsContact O-CG2 3.28Å; T31-V35 WeakPolarHBondContact O-CG2 3.46Å; T31-V35 PolarHBondContact O-N 2.86Å; Q33-V35 PolarHBondContact O-N 2.75Å; V35-T39 WeakPolarHBondContact O-CB 3.13Å; V35-T39 PolarHBondContact O-N 2.67Å; V35-T39 PolarHBondContact O-OG1 2.98Å
36	N	39.3	Very low	39.8	Very low	73 Å²	73	96.8 Å²	96.8	39%	0.39	49%	0.488	S	S	.	.	H	α-helix	trans	-62.1	-46.2	177.5	-82.5	-32.5	0	0	0	112.1	S32 Q33 S40 N209	S32-N36 WeakPolarHBondContact O-CB 3.02Å; S32-N36 PolarHBondContact O-N 3.49Å; S32-N36 VanDerWaalsContact O-N 3.15Å; S32-N36 PolarHBondContact O-ND2 3.09Å; S32-N36 VanDerWaalsContact O-ND2 3.15Å; Q33-N36 PolarHBondContact O-N 3.39Å; N36-S40 WeakPolarHBondContact O-CB 3.2Å; N36-S40 PolarHBondContact O-N 3.12Å; N36-S40 PolarHBondContact O-OG 3.45Å; N36-N209 PolarHBondContact OD1-ND2 2.97Å; N36-N209 VanDerWaalsContact OD1-ND2 3.15Å
37	E	40.8	Very low	39.7	Very low	134 Å²	134	91 Å²	91	63%	0.626	47%	0.473	S	S	*	.	H	α-helix	trans	-63.7	-52.4	176.8	-70.8	-173.7	125.8	0	0	112.1	Q33 T39 S40 Q41	Q33-E37 PolarHBondContact O-N 2.71Å; Q33-E37 VanDerWaalsContact O-N 3.14Å; E37-T39 VanDerWaalsContact C-N 3.29Å; E37-T39 PolarHBondContact O-N 3.25Å; E37-S40 PolarHBondContact O-N 2.73Å; E37-Q41 PolarHBondContact O-N 3.41Å; E37-Q41 VanDerWaalsContact O-N 3.09Å
38	S	38.8	Very low	39.5	Very low	65 Å²	65	92.3 Å²	92.3	46%	0.455	49%	0.485	S	S	.	.	H	α-helix	trans	-62.1	-37.3	-176.7	-54.9	0	0	0	0	112.4	R34 R42	R34-S38 VanDerWaalsContact O-CB 3.23Å; R34-S38 WeakPolarHBondContact O-CB 3.44Å; R34-S38 PolarHBondContact O-N 3.38Å; R34-S38 VanDerWaalsContact O-N 3.11Å; R34-S38 PolarHBondContact O-OG 2.71Å; S38-R42 WeakPolarHBondContact O-CB 3.07Å; S38-R42 WeakPolarHBondContact O-CG 3.39Å; S38-R42 PolarHBondContact O-N 2.65Å
39	T	39.4	Very low	39.3	Very low	51 Å²	51	95.5 Å²	95.5	31%	0.313	50%	0.497	S	S	.	.	H	α-helix	trans	-77.9	-43.4	-179.6	-51.4	0	0	0	0	110.6	V35 E37 Q41 R42 V43	V35-T39 WeakPolarHBondContact O-CB 3.13Å; V35-T39 PolarHBondContact O-N 2.67Å; V35-T39 PolarHBondContact O-OG1 2.98Å; E37-T39 VanDerWaalsContact C-N 3.29Å; E37-T39 PolarHBondContact O-N 3.25Å; T39-Q41 PolarHBondContact O-N 3.35Å; T39-R42 PolarHBondContact O-N 3.44Å; T39-V43 HydrophobicContact CG2-CG2 3.68Å; T39-V43 WeakPolarHBondContact O-CB 3.33Å; T39-V43 WeakPolarHBondContact O-CG2 2.91Å; T39-V43 PolarHBondContact O-N 3.15Å
40	S	38.9	Very low	39	Very low	67 Å²	67	97.6 Å²	97.6	47%	0.469	50%	0.5	S	S	.	.	H	α-helix	trans	-62.1	-41.4	179.9	-58.4	0	0	0	0	112.2	N36 E37 N44	N36-S40 WeakPolarHBondContact O-CB 3.2Å; N36-S40 PolarHBondContact O-N 3.12Å; N36-S40 PolarHBondContact O-OG 3.45Å; E37-S40 PolarHBondContact O-N 2.73Å; S40-N44 WeakPolarHBondContact O-CB 3.34Å; S40-N44 VanDerWaalsContact O-CG 3.31Å; S40-N44 PolarHBondContact O-N 2.97Å; S40-N44 VanDerWaalsContact O-N 3.14Å; S40-N44 PolarHBondContact O-ND2 3.38Å
41	Q	39.6	Very low	38.8	Very low	137 Å²	137	97.8 Å²	97.8	64%	0.64	50%	0.498	S	S	*	.	H	α-helix	trans	-67.1	-53.6	175.6	-71.1	-175.9	-11.1	0	0	111.6	E37 T39 V43 N44 E45	E37-Q41 PolarHBondContact O-N 3.41Å; E37-Q41 VanDerWaalsContact O-N 3.09Å; T39-Q41 PolarHBondContact O-N 3.35Å; Q41-V43 PolarHBondContact O-N 2.89Å; Q41-N44 PolarHBondContact O-N 3.09Å; Q41-E45 PolarHBondContact O-N 3.18Å
42	R	36.1	Very low	38.6	Very low	180 Å²	180	100.7 Å²	100.7	68%	0.679	51%	0.512	S	S	*	.	H	α-helix	trans	-69	-31.1	-176	-67.7	-168.8	71.2	167.1	3.6	113.6	S38 T39 S46	S38-R42 WeakPolarHBondContact O-CB 3.07Å; S38-R42 WeakPolarHBondContact O-CG 3.39Å; S38-R42 PolarHBondContact O-N 2.65Å; T39-R42 PolarHBondContact O-N 3.44Å; R42-S46 WeakPolarHBondContact O-CB 3.38Å; R42-S46 PolarHBondContact O-N 3.2Å; R42-S46 PolarHBondContact O-OG 2.81Å
43	V	38.2	Very low	38.4	Very low	67 Å²	67	104.2 Å²	104.2	41%	0.406	52%	0.522	S	S	.	.	H	α-helix	trans	-71.5	-40.8	174.1	172.5	0	0	0	0	110.3	T39 Q41 T47	T39-V43 HydrophobicContact CG2-CG2 3.68Å; T39-V43 WeakPolarHBondContact O-CB 3.33Å; T39-V43 WeakPolarHBondContact O-CG2 2.91Å; T39-V43 PolarHBondContact O-N 3.15Å; Q41-V43 PolarHBondContact O-N 2.89Å; V43-T47 WeakPolarHBondContact O-CA 3.29Å; V43-T47 WeakPolarHBondContact O-CB 3.4Å; V43-T47 PolarHBondContact O-N 2.91Å; V43-T47 PolarHBondContact O-OG1 2.86Å
44	N	37.7	Very low	38.2	Very low	102 Å²	102	100.2 Å²	100.2	55%	0.545	51%	0.51	S	S	.	.	H	α-helix	trans	-61.7	-51.4	174.9	-79.3	-19.8	0	0	0	111.6	S40 Q41 S48	S40-N44 WeakPolarHBondContact O-CB 3.34Å; S40-N44 VanDerWaalsContact O-CG 3.31Å; S40-N44 PolarHBondContact O-N 2.97Å; S40-N44 VanDerWaalsContact O-N 3.14Å; S40-N44 PolarHBondContact O-ND2 3.38Å; Q41-N44 PolarHBondContact O-N 3.09Å; N44-S48 VanDerWaalsContact O-CB 3.23Å; N44-S48 WeakPolarHBondContact O-CB 3.15Å; N44-S48 PolarHBondContact O-N 3.28Å; N44-S48 PolarHBondContact O-OG 3.17Å; N44-S48 VanDerWaalsContact O-OG 3.11Å
45	E	39.4	Very low	38.1	Very low	131 Å²	131	94.6 Å²	94.6	61%	0.612	50%	0.496	S	S	*	.	H	α-helix	trans	-63.3	-49.7	178.1	-70.6	-172.3	125.7	0	0	112.6	Q41 T47 S48 Q49	Q41-E45 PolarHBondContact O-N 3.18Å; E45-T47 VanDerWaalsContact C-N 3.32Å; E45-T47 PolarHBondContact O-N 3.05Å; E45-S48 PolarHBondContact O-N 3.15Å; E45-Q49 WeakPolarHBondContact O-CB 3.35Å; E45-Q49 WeakPolarHBondContact O-CG 3.21Å; E45-Q49 PolarHBondContact O-N 3.39Å
46	S	37.7	Very low	37.9	Very low	56 Å²	56	96.1 Å²	96.1	39%	0.392	51%	0.508	S	S	.	.	H	α-helix	trans	-66.5	-34.2	-176.8	-53.6	0	0	0	0	112.3	R42 R50	R42-S46 WeakPolarHBondContact O-CB 3.38Å; R42-S46 PolarHBondContact O-N 3.2Å; R42-S46 PolarHBondContact O-OG 2.81Å; S46-R50 WeakPolarHBondContact O-CB 3.3Å; S46-R50 VanDerWaalsContact O-CG 3.28Å; S46-R50 WeakPolarHBondContact O-CG 3.31Å; S46-R50 PolarHBondContact O-N 3.42Å
47	T	38.7	Very low	37.8	Very low	65 Å²	65	99 Å²	99	40%	0.399	52%	0.52	S	S	.	.	H	α-helix	trans	-79	-44.4	178.9	-51.1	0	0	0	0	110.3	V43 E45 Q49 R50 V51	V43-T47 WeakPolarHBondContact O-CA 3.29Å; V43-T47 WeakPolarHBondContact O-CB 3.4Å; V43-T47 PolarHBondContact O-N 2.91Å; V43-T47 PolarHBondContact O-OG1 2.86Å; E45-T47 VanDerWaalsContact C-N 3.32Å; E45-T47 PolarHBondContact O-N 3.05Å; T47-Q49 VanDerWaalsContact C-N 3.33Å; T47-Q49 PolarHBondContact O-N 3.45Å; T47-R50 PolarHBondContact O-N 3.07Å; T47-V51 HydrophobicContact CG2-CG2 3.57Å; T47-V51 WeakPolarHBondContact O-CA 3.27Å; T47-V51 WeakPolarHBondContact O-CB 3.06Å; T47-V51 WeakPolarHBondContact O-CG2 3.23Å; T47-V51 PolarHBondContact O-N 3.17Å
48	S	38.8	Very low	37.5	Very low	74 Å²	74	101 Å²	101	52%	0.517	52%	0.522	S	S	.	.	H	α-helix	trans	-61.5	-38.9	175.9	-68.4	0	0	0	0	112.6	N44 E45 N52	N44-S48 VanDerWaalsContact O-CB 3.23Å; N44-S48 WeakPolarHBondContact O-CB 3.15Å; N44-S48 PolarHBondContact O-N 3.28Å; N44-S48 PolarHBondContact O-OG 3.17Å; N44-S48 VanDerWaalsContact O-OG 3.11Å; E45-S48 PolarHBondContact O-N 3.15Å; S48-N52 WeakPolarHBondContact O-CB 3.24Å; S48-N52 VanDerWaalsContact O-CG 3.25Å; S48-N52 PolarHBondContact O-N 3.23Å; S48-N52 PolarHBondContact O-ND2 3.13Å; S48-N52 VanDerWaalsContact O-ND2 3.14Å
49	Q	37.9	Very low	37.3	Very low	130 Å²	130	101.5 Å²	101.5	61%	0.607	52%	0.522	S	S	*	.	H	α-helix	trans	-72.8	-53.4	174.7	-70.4	-176.8	-7.5	0	0	112	E45 T47 V51 N52 E53	E45-Q49 WeakPolarHBondContact O-CB 3.35Å; E45-Q49 WeakPolarHBondContact O-CG 3.21Å; E45-Q49 PolarHBondContact O-N 3.39Å; T47-Q49 VanDerWaalsContact C-N 3.33Å; T47-Q49 PolarHBondContact O-N 3.45Å; Q49-V51 PolarHBondContact O-N 3.22Å; Q49-N52 PolarHBondContact O-N 3.49Å; Q49-E53 PolarHBondContact O-N 3.43Å
50	R	35	Very low	37.1	Very low	176 Å²	176	104.4 Å²	104.4	66%	0.664	54%	0.535	S	S	*	.	H	α-helix	trans	-73.1	-26.9	-174.9	-63.4	-170.7	72.3	162.9	5	113.9	S46 T47 S54	S46-R50 WeakPolarHBondContact O-CB 3.3Å; S46-R50 VanDerWaalsContact O-CG 3.28Å; S46-R50 WeakPolarHBondContact O-CG 3.31Å; S46-R50 PolarHBondContact O-N 3.42Å; T47-R50 PolarHBondContact O-N 3.07Å; R50-S54 WeakPolarHBondContact O-CA 3.32Å; R50-S54 WeakPolarHBondContact O-CB 3.32Å; R50-S54 PolarHBondContact O-N 3.32Å; R50-S54 PolarHBondContact O-OG 3.34Å
51	V	37.2	Very low	36.9	Very low	75 Å²	75	107.6 Å²	107.6	46%	0.455	54%	0.543	S	S	.	.	H	α-helix	trans	-71.7	-40.3	171.3	174.8	0	0	0	0	110	T47 Q49 T55	T47-V51 HydrophobicContact CG2-CG2 3.57Å; T47-V51 WeakPolarHBondContact O-CA 3.27Å; T47-V51 WeakPolarHBondContact O-CB 3.06Å; T47-V51 WeakPolarHBondContact O-CG2 3.23Å; T47-V51 PolarHBondContact O-N 3.17Å; Q49-V51 PolarHBondContact O-N 3.22Å; V51-T55 WeakPolarHBondContact O-CA 3.45Å; V51-T55 WeakPolarHBondContact O-CB 3.42Å; V51-T55 PolarHBondContact O-N 2.7Å; V51-T55 PolarHBondContact O-OG1 2.88Å
52	N	36.8	Very low	36.7	Very low	110 Å²	110	103.7 Å²	103.7	59%	0.588	53%	0.531	S	S	*	.	H	α-helix	trans	-61.8	-54.3	173.8	-77.6	-19.4	0	0	0	111.3	S48 Q49 S56	S48-N52 WeakPolarHBondContact O-CB 3.24Å; S48-N52 VanDerWaalsContact O-CG 3.25Å; S48-N52 PolarHBondContact O-N 3.23Å; S48-N52 PolarHBondContact O-ND2 3.13Å; S48-N52 VanDerWaalsContact O-ND2 3.14Å; Q49-N52 PolarHBondContact O-N 3.49Å; N52-S56 WeakPolarHBondContact O-CB 3.1Å; N52-S56 PolarHBondContact O-N 2.83Å; N52-S56 PolarHBondContact O-OG 3.43Å; N52-S56 VanDerWaalsContact O-OG 3.12Å
53	E	37	Very low	36.7	Very low	127 Å²	127	97.9 Å²	97.9	59%	0.593	52%	0.515	S	S	*	.	H	α-helix	trans	-65.3	-47.2	-179.7	-69.1	-171.7	129.1	0	0	113.1	Q49 T55 Q57	Q49-E53 PolarHBondContact O-N 3.43Å; E53-T55 PolarHBondContact O-N 2.96Å; E53-Q57 WeakPolarHBondContact O-CB 3.5Å; E53-Q57 WeakPolarHBondContact O-CG 3.1Å; E53-Q57 PolarHBondContact O-N 3.42Å
54	S	35.8	Very low	36.5	Very low	55 Å²	55	98 Å²	98	39%	0.385	52%	0.519	S	S	.	.	H	α-helix	trans	-70.2	-32.2	-176.8	-49.9	0	0	0	0	112.3	R50 R58	R50-S54 WeakPolarHBondContact O-CA 3.32Å; R50-S54 WeakPolarHBondContact O-CB 3.32Å; R50-S54 PolarHBondContact O-N 3.32Å; R50-S54 PolarHBondContact O-OG 3.34Å; S54-R58 WeakPolarHBondContact O-CB 3.23Å; S54-R58 WeakPolarHBondContact O-CG 3.08Å; S54-R58 PolarHBondContact O-N 2.98Å
55	T	36.6	Very low	36.4	Very low	68 Å²	68	99.7 Å²	99.7	42%	0.417	52%	0.524	S	S	.	.	H	α-helix	trans	-76.6	-47.9	175.8	-49.9	0	0	0	0	109.9	V51 E53 Q57 V59	V51-T55 WeakPolarHBondContact O-CA 3.45Å; V51-T55 WeakPolarHBondContact O-CB 3.42Å; V51-T55 PolarHBondContact O-N 2.7Å; V51-T55 PolarHBondContact O-OG1 2.88Å; E53-T55 PolarHBondContact O-N 2.96Å; T55-Q57 VanDerWaalsContact C-N 3.26Å; T55-Q57 PolarHBondContact O-N 2.82Å; T55-V59 HydrophobicContact CG2-CG2 3.57Å; T55-V59 WeakPolarHBondContact O-CB 2.96Å; T55-V59 VanDerWaalsContact O-CG2 3.27Å; T55-V59 WeakPolarHBondContact O-CG2 3.28Å; T55-V59 PolarHBondContact O-N 3.24Å
56	S	36.8	Very low	36.1	Very low	75 Å²	75	102.3 Å²	102.3	52%	0.524	53%	0.528	S	S	.	.	H	α-helix	trans	-63.9	-26.1	178.2	-66.8	0	0	0	0	113.8	N52 N60	N52-S56 WeakPolarHBondContact O-CB 3.1Å; N52-S56 PolarHBondContact O-N 2.83Å; N52-S56 PolarHBondContact O-OG 3.43Å; N52-S56 VanDerWaalsContact O-OG 3.12Å; S56-N60 WeakPolarHBondContact O-CB 3.41Å; S56-N60 PolarHBondContact O-ND2 3.34Å
57	Q	36	Very low	35.9	Very low	135 Å²	135	102.4 Å²	102.4	63%	0.631	53%	0.526	S	S	*	.	H	α-helix	trans	-87.3	-52.7	171.3	-69.1	-175.1	-6.1	0	0	112.4	E53 T55 V59 N60 E61	E53-Q57 WeakPolarHBondContact O-CB 3.5Å; E53-Q57 WeakPolarHBondContact O-CG 3.1Å; E53-Q57 PolarHBondContact O-N 3.42Å; T55-Q57 VanDerWaalsContact C-N 3.26Å; T55-Q57 PolarHBondContact O-N 2.82Å; Q57-V59 PolarHBondContact O-N 2.93Å; Q57-N60 PolarHBondContact O-N 2.94Å; Q57-N60 VanDerWaalsContact O-N 3.16Å; Q57-E61 PolarHBondContact O-N 3.47Å
58	R	34.3	Very low	35.7	Very low	176 Å²	176	104.6 Å²	104.6	66%	0.664	54%	0.535	S	S	*	.	H	α-helix	trans	-72.7	-26.6	-174.3	-61.2	-168.2	71.5	158.9	4.2	113.9	S54 S62	S54-R58 WeakPolarHBondContact O-CB 3.23Å; S54-R58 WeakPolarHBondContact O-CG 3.08Å; S54-R58 PolarHBondContact O-N 2.98Å; R58-S62 WeakPolarHBondContact O-CB 3.33Å; R58-S62 PolarHBondContact O-N 3.49Å; R58-S62 PolarHBondContact O-OG 3.23Å
59	V	35.8	Very low	35.5	Very low	75 Å²	75	108.4 Å²	108.4	46%	0.455	55%	0.545	S	S	.	.	H	α-helix	trans	-71	-38.7	170.4	177.5	0	0	0	0	110.3	T55 Q57 T63	T55-V59 HydrophobicContact CG2-CG2 3.57Å; T55-V59 WeakPolarHBondContact O-CB 2.96Å; T55-V59 VanDerWaalsContact O-CG2 3.27Å; T55-V59 WeakPolarHBondContact O-CG2 3.28Å; T55-V59 PolarHBondContact O-N 3.24Å; Q57-V59 PolarHBondContact O-N 2.93Å; V59-T63 WeakPolarHBondContact O-CB 3.38Å; V59-T63 PolarHBondContact O-N 3.33Å; V59-T63 VanDerWaalsContact O-N 3.11Å; V59-T63 PolarHBondContact O-OG1 3.21Å
60	N	34.5	Very low	35.4	Very low	111 Å²	111	106.1 Å²	106.1	59%	0.594	54%	0.543	S	S	*	.	H	α-helix	trans	-65.7	-43.9	177.2	-85.5	-35.3	0	0	0	112.7	S56 Q57 S64	S56-N60 WeakPolarHBondContact O-CB 3.41Å; S56-N60 PolarHBondContact O-ND2 3.34Å; Q57-N60 PolarHBondContact O-N 2.94Å; Q57-N60 VanDerWaalsContact O-N 3.16Å; N60-S64 WeakPolarHBondContact O-CB 3.42Å; N60-S64 PolarHBondContact O-N 3.34Å; N60-S64 PolarHBondContact O-OG 3.44Å
61	E	35.2	Very low	35.3	Very low	134 Å²	134	98.7 Å²	98.7	63%	0.626	52%	0.518	S	S	*	.	H	α-helix	trans	-76.9	-48.3	176.8	-71.7	-171.6	127.8	0	0	113.3	Q57 T63 S64 Q65	Q57-E61 PolarHBondContact O-N 3.47Å; E61-T63 VanDerWaalsContact C-N 3.34Å; E61-T63 PolarHBondContact O-N 2.97Å; E61-S64 PolarHBondContact O-N 2.75Å; E61-Q65 PolarHBondContact O-N 2.81Å; E61-Q65 VanDerWaalsContact O-N 3.08Å
62	S	35.7	Very low	35.2	Very low	56 Å²	56	97.9 Å²	97.9	39%	0.392	52%	0.515	S	S	.	.	H	α-helix	trans	-68.2	-34.1	-173.1	-47.6	0	0	0	0	112.4	R58 R66	R58-S62 WeakPolarHBondContact O-CB 3.33Å; R58-S62 PolarHBondContact O-N 3.49Å; R58-S62 PolarHBondContact O-OG 3.23Å; S62-R66 WeakPolarHBondContact O-CB 3.08Å; S62-R66 PolarHBondContact O-N 2.62Å; S62-R66 VanDerWaalsContact O-N 3.15Å
63	T	35.3	Very low	35.1	Very low	57 Å²	57	99.8 Å²	99.8	35%	0.35	52%	0.521	S	S	.	.	H	α-helix	trans	-76.4	-40.9	176.9	-44.1	0	0	0	0	110.6	V59 E61 Q65 V67	V59-T63 WeakPolarHBondContact O-CB 3.38Å; V59-T63 PolarHBondContact O-N 3.33Å; V59-T63 VanDerWaalsContact O-N 3.11Å; V59-T63 PolarHBondContact O-OG1 3.21Å; E61-T63 VanDerWaalsContact C-N 3.34Å; E61-T63 PolarHBondContact O-N 2.97Å; T63-Q65 VanDerWaalsContact C-N 3.32Å; T63-Q65 PolarHBondContact O-N 3.27Å; T63-V67 HydrophobicContact CG2-CG2 3.74Å; T63-V67 VanDerWaalsContact O-CB 3.24Å; T63-V67 WeakPolarHBondContact O-CB 3.46Å; T63-V67 VanDerWaalsContact O-CG2 3.25Å; T63-V67 WeakPolarHBondContact O-CG2 3.07Å; T63-V67 PolarHBondContact O-N 2.94Å
64	S	34.7	Very low	35	Very low	70 Å²	70	104.1 Å²	104.1	49%	0.49	53%	0.531	S	S	.	.	H	α-helix	trans	-66.6	-29.8	-179.6	-60.7	0	0	0	0	113.6	N60 E61 N68	N60-S64 WeakPolarHBondContact O-CB 3.42Å; N60-S64 PolarHBondContact O-N 3.34Å; N60-S64 PolarHBondContact O-OG 3.44Å; E61-S64 PolarHBondContact O-N 2.75Å; S64-N68 PolarHBondContact O-ND2 2.86Å
65	Q	34.4	Very low	34.7	Very low	137 Å²	137	103.2 Å²	103.2	64%	0.64	52%	0.523	S	S	*	.	H	α-helix	trans	-92	-49.3	178	-68.9	-174.6	-8.8	0	0	113.1	E61 T63 V67 N68	E61-Q65 PolarHBondContact O-N 2.81Å; E61-Q65 VanDerWaalsContact O-N 3.08Å; T63-Q65 VanDerWaalsContact C-N 3.32Å; T63-Q65 PolarHBondContact O-N 3.27Å; Q65-V67 PolarHBondContact O-N 3.24Å; Q65-N68 PolarHBondContact O-N 2.73Å
66	R	33.9	Very low	34.6	Very low	187 Å²	187	104.5 Å²	104.5	71%	0.706	53%	0.528	S	S	*	.	H	α-helix	trans	-74.9	-25.1	-173.7	-61.4	-163.5	71.6	150.3	2.9	114.2	S62 S70	S62-R66 WeakPolarHBondContact O-CB 3.08Å; S62-R66 PolarHBondContact O-N 2.62Å; S62-R66 VanDerWaalsContact O-N 3.15Å; R66-S70 WeakPolarHBondContact O-CB 3.48Å; R66-S70 PolarHBondContact O-N 2.81Å; R66-S70 PolarHBondContact O-OG 3.32Å
67	V	34.3	Very low	34.5	Very low	57 Å²	57	109 Å²	109	35%	0.345	54%	0.541	S	S	.	.	H	α-helix	trans	-74.8	-29.5	174.2	-177.9	0	0	0	0	111.2	T63 Q65 T71	T63-V67 HydrophobicContact CG2-CG2 3.74Å; T63-V67 VanDerWaalsContact O-CB 3.24Å; T63-V67 WeakPolarHBondContact O-CB 3.46Å; T63-V67 VanDerWaalsContact O-CG2 3.25Å; T63-V67 WeakPolarHBondContact O-CG2 3.07Å; T63-V67 PolarHBondContact O-N 2.94Å; Q65-V67 PolarHBondContact O-N 3.24Å; V67-T71 WeakPolarHBondContact O-CB 3.37Å; V67-T71 PolarHBondContact O-OG1 3.44Å
68	N	33	Very low	34.3	Very low	111 Å²	111	105.8 Å²	105.8	59%	0.594	53%	0.533	S	S	*	.	H	α-helix	trans	-72.2	-38.1	-179.5	-88.9	-53.7	0	0	0	113.8	S64 Q65 S72	S64-N68 PolarHBondContact O-ND2 2.86Å; Q65-N68 PolarHBondContact O-N 2.73Å; N68-S72 WeakPolarHBondContact O-CB 3.34Å; N68-S72 PolarHBondContact O-OG 2.93Å
69	E	35.7	Very low	34.1	Very low	154 Å²	154	98.8 Å²	98.8	72%	0.72	51%	0.51	S	S	*	.	H	α-helix	trans	-86.9	-40	-178.5	-69.3	-172.9	131.9	0	0	114.1	T71	E69-T71 VanDerWaalsContact C-N 3.33Å; E69-T71 PolarHBondContact O-N 3.39Å
70	S	36	Very low	34.1	Very low	82 Å²	82	98.1 Å²	98.1	57%	0.573	51%	0.508	S	S	*	.	H	α-helix	trans	-78	-18.7	-175	-59.5	0	0	0	0	113.8	R66	R66-S70 WeakPolarHBondContact O-CB 3.48Å; R66-S70 PolarHBondContact O-N 2.81Å; R66-S70 PolarHBondContact O-OG 3.32Å
71	T	33.1	Very low	34.1	Very low	21 Å²	21	100.4 Å²	100.4	13%	0.129	52%	0.515	C	S	.	.	H	α-helix	trans	-107.4	-26.2	-166	-42.2	0	0	0	0	112.3	V67 E69 N177	V67-T71 WeakPolarHBondContact O-CB 3.37Å; V67-T71 PolarHBondContact O-OG1 3.44Å; E69-T71 VanDerWaalsContact C-N 3.33Å; E69-T71 PolarHBondContact O-N 3.39Å; T71-N177 HydrophobicContact CG2-CB 3.6Å; T71-N177 VanDerWaalsContact CG2-CG 3.46Å; T71-N177 VanDerWaalsContact CG2-ND2 3.28Å; T71-N177 WeakPolarHBondContact CG2-ND2 3.35Å; T71-N177 WeakPolarHBondContact CG2-O 3.29Å; T71-N177 PolarHBondContact O-ND2 3.31Å
72	S	33.5	Very low	34.1	Very low	57 Å²	57	102 Å²	102	40%	0.399	52%	0.516	S	S	.	.	H	α-helix	trans	-96.6	-19.1	-171.7	-56.2	0	0	0	0	115	N68	N68-S72 WeakPolarHBondContact O-CB 3.34Å; N68-S72 PolarHBondContact O-OG 2.93Å
73	Q	35.7	Very low	34	Very low	151 Å²	151	101 Å²	101	71%	0.706	51%	0.507	S	S	*	.	S	Bend	trans	-93.9	-40.6	-176.7	-73	-169.4	-8.9	0	0	114.6	V75 N76	Q73-V75 VanDerWaalsContact C-N 3.29Å; Q73-V75 PolarHBondContact O-N 2.72Å; Q73-N76 PolarHBondContact O-N 2.7Å
74	R	34	Very low	33.8	Very low	218 Å²	218	104.6 Å²	104.6	82%	0.823	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	3	-176.2	-62.5	-153.5	73.8	152.8	5.4	115.5
75	V	31.3	Very low	33.7	Very low	35 Å²	35	107.1 Å²	107.1	21%	0.212	53%	0.528	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.9	40.3	169.3	-135.2	0	0	0	0	110.8	Q73 S173 Q174 N177	Q73-V75 VanDerWaalsContact C-N 3.29Å; Q73-V75 PolarHBondContact O-N 2.72Å; V75-S173 WeakPolarHBondContact CB-O 3.08Å; V75-S173 WeakPolarHBondContact CG1-O 3.23Å; V75-S173 CarbonylContact O-C 3.2Å; V75-S173 WeakPolarHBondContact O-CB 3.06Å; V75-S173 PolarHBondContact O-OG 3.34Å; V75-Q174 PolarHBondContact O-N 3.42Å; V75-N177 HydrophobicContact CG2-CB 4.13Å; V75-N177 WeakPolarHBondContact CG2-ND2 3.23Å
76	N	34.3	Very low	33.7	Very low	95 Å²	95	104.3 Å²	104.3	51%	0.508	52%	0.524	S	S	.	.	S	Bend	trans	-118.8	3.7	165.4	-123.6	10.4	0	0	0	112.9	Q73 Q174	Q73-N76 PolarHBondContact O-N 2.7Å; N76-Q174 PolarHBondContact ND2-NE2 3.49Å; N76-Q174 WeakPolarHBondContact OD1-CG 3.43Å; N76-Q174 PolarHBondContact OD1-NE2 3.37Å; N76-Q174 VanDerWaalsContact OD1-NE2 3.15Å
77	E	33.3	Very low	34	Very low	171 Å²	171	101.2 Å²	101.2	80%	0.799	53%	0.526	S	S	*	.	S	Bend	trans	-139	34.2	-166.7	-157.7	177.1	-134.7	0	0	112.1
78	S	32	Very low	33.9	Very low	67 Å²	67	102.5 Å²	102.5	47%	0.469	54%	0.537	S	S	.	.	S	Bend	trans	-150.4	-39.2	174.7	-74.2	0	0	0	0	114.3	S80 Q81 R82	S78-S80 VanDerWaalsContact C-N 3.29Å; S78-S80 PolarHBondContact O-N 2.75Å; S78-Q81 PolarHBondContact O-N 3.18Å; S78-R82 PolarHBondContact O-N 3.38Å
79	T	31.4	Very low	33.8	Very low	29 Å²	29	105 Å²	105	18%	0.178	55%	0.546	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	22.3	-179.7	-15.9	0	0	0	0	115	V83 N169 E170 T172 S173	T79-V83 HydrophobicContact CG2-CG2 3.86Å; T79-N169 CarbonylContact O-C 3.41Å; T79-E170 PolarHBondContact O-N 3.37Å; T79-T172 VanDerWaalsContact CB-C 3.48Å; T79-T172 WeakPolarHBondContact CB-O 3.47Å; T79-T172 HydrophobicContact CG2-CG2 4.05Å; T79-T172 VanDerWaalsContact CG2-O 3.32Å; T79-T172 WeakPolarHBondContact CG2-O 3.34Å; T79-T172 PolarHBondContact OG1-O 3.25Å; T79-S173 PolarHBondContact N-OG 2.82Å; T79-S173 WeakPolarHBondContact OG1-CA 3.19Å; T79-S173 WeakPolarHBondContact OG1-CB 3.14Å; T79-S173 PolarHBondContact OG1-OG 3.15Å
80	S	34.2	Very low	33.7	Very low	60 Å²	60	107.9 Å²	107.9	42%	0.42	55%	0.55	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	8.8	154.6	-50.4	0	0	0	0	113.1	S78 N169	S78-S80 VanDerWaalsContact C-N 3.29Å; S78-S80 PolarHBondContact O-N 2.75Å; S80-N169 WeakPolarHBondContact CA-O 3.47Å
81	Q	34.9	Very low	33.7	Very low	159 Å²	159	108.9 Å²	108.9	74%	0.743	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.8	-41.2	174.6	-70.4	-167.6	-8.1	0	0	114.9	S78 V83 N84	S78-Q81 PolarHBondContact O-N 3.18Å; Q81-V83 VanDerWaalsContact C-N 3.33Å; Q81-V83 PolarHBondContact O-N 3.25Å; Q81-N84 PolarHBondContact O-N 3.44Å
82	R	35	Very low	33.6	Very low	168 Å²	168	114.4 Å²	114.4	63%	0.634	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-84	6.6	-174.4	-65.1	-158.9	85.6	163.2	2.9	116.3	S78 N84 E85	S78-R82 PolarHBondContact O-N 3.38Å; R82-N84 PolarHBondContact O-N 3.44Å; R82-E85 IonicContact CZ-OE2 3.3Å; R82-E85 VanDerWaalsContact CZ-OE2 3.3Å; R82-E85 IonicContact NE-OE2 2.75Å; R82-E85 PolarHBondContact NE-OE2 2.66Å; R82-E85 VanDerWaalsContact NE-OE2 3.17Å; R82-E85 IonicContact NH2-OE2 2.65Å; R82-E85 PolarHBondContact NH2-OE2 3.21Å; R82-E85 PolarHBondContact O-N 3.22Å
83	V	34.1	Very low	33.6	Very low	35 Å²	35	118.8 Å²	118.8	21%	0.212	60%	0.595	C	S	.	*	G	3₁₀ helix	trans	-69.3	-12.3	162.2	144.2	0	0	0	0	112.1	T79 Q81 E85 V168 N169	T79-V83 HydrophobicContact CG2-CG2 3.86Å; Q81-V83 VanDerWaalsContact C-N 3.33Å; Q81-V83 PolarHBondContact O-N 3.25Å; V83-E85 VanDerWaalsContact C-N 3.27Å; V83-E85 PolarHBondContact O-N 2.94Å; V83-V168 HydrophobicContact CB-CG1 4.47Å; V83-V168 HydrophobicContact CG1-CB 4.33Å; V83-V168 HydrophobicContact CG1-CG1 3.74Å; V83-V168 HydrophobicContact CG2-CG1 3.85Å; V83-N169 HydrophobicContact CB-CB 4.16Å; V83-N169 VanDerWaalsContact CB-OD1 3.32Å; V83-N169 WeakPolarHBondContact CB-OD1 3.01Å; V83-N169 HydrophobicContact CG1-CB 3.59Å; V83-N169 VanDerWaalsContact CG1-CG 3.45Å
84	N	31.1	Very low	33.5	Very low	132 Å²	132	116 Å²	116	71%	0.706	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-77.5	-2.3	169.1	-75.8	0.4	0	0	0	114.6	Q81 R82 N169	Q81-N84 PolarHBondContact O-N 3.44Å; R82-N84 PolarHBondContact O-N 3.44Å; N84-N169 PolarHBondContact OD1-ND2 3.3Å
85	E	32.1	Very low	33.7	Very low	123 Å²	123	109.5 Å²	109.5	58%	0.575	58%	0.577	S	S	*	*	S	Bend	trans	-115.9	85.3	170.5	-81.1	-176.5	126.9	0	0	112.3	R82 V83	R82-E85 IonicContact CZ-OE2 3.3Å; R82-E85 VanDerWaalsContact CZ-OE2 3.3Å; R82-E85 IonicContact NE-OE2 2.75Å; R82-E85 PolarHBondContact NE-OE2 2.66Å; R82-E85 VanDerWaalsContact NE-OE2 3.17Å; R82-E85 IonicContact NH2-OE2 2.65Å; R82-E85 PolarHBondContact NH2-OE2 3.21Å; R82-E85 PolarHBondContact O-N 3.22Å; V83-E85 VanDerWaalsContact C-N 3.27Å; V83-E85 PolarHBondContact O-N 2.94Å
86	S	35.3	Very low	33.8	Very low	78 Å²	78	112 Å²	112	55%	0.545	60%	0.596	S	S	.	*			trans	63.4	90.7	147.9	-61	0	0	0	0	116.2	S88	S86-S88 VanDerWaalsContact CB-OG 3.31Å; S86-S88 WeakPolarHBondContact CB-OG 3.23Å; S86-S88 PolarHBondContact O-N 3.39Å; S86-S88 PolarHBondContact OG-OG 3.17Å
87	T	39.6	Very low	33.9	Very low	123 Å²	123	114.8 Å²	114.8	76%	0.755	61%	0.606	S	S	*	*	S	Bend	cis	53	2	33.6	-48.6	0	0	0	0	113.9
88	S	31.6	Very low	33.9	Very low	84 Å²	84	114.4 Å²	114.4	59%	0.587	60%	0.597	S	S	*	*	S	Bend	trans	-143	-1.1	-170.6	-41.7	0	0	0	0	116.6	S86	S86-S88 VanDerWaalsContact CB-OG 3.31Å; S86-S88 WeakPolarHBondContact CB-OG 3.23Å; S86-S88 PolarHBondContact O-N 3.39Å; S86-S88 PolarHBondContact OG-OG 3.17Å
89	Q	31.6	Very low	34.4	Very low	164 Å²	164	113.8 Å²	113.8	77%	0.766	59%	0.59	S	S	*	*	S	Bend	trans	-133.3	-56.1	-179.5	-72.9	-169.9	-15.5	0	0	115.5	V91	Q89-V91 VanDerWaalsContact C-N 3.27Å; Q89-V91 PolarHBondContact O-N 2.65Å
90	R	32.9	Very low	34.6	Very low	214 Å²	214	115.9 Å²	115.9	81%	0.808	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-81.4	4.3	-170.3	-54.5	-159.2	78.9	154.1	6.1	116	N92	R90-N92 VanDerWaalsContact C-N 3.26Å; R90-N92 PolarHBondContact O-N 3.09Å
91	V	36.4	Very low	34.8	Very low	102 Å²	102	118 Å²	118	62%	0.618	60%	0.604	S	S	*	*	G	3₁₀ helix	trans	-70	-21.8	175	176.2	0	0	0	0	112.2	Q89 T95	Q89-V91 VanDerWaalsContact C-N 3.27Å; Q89-V91 PolarHBondContact O-N 2.65Å; V91-T95 PolarHBondContact O-OG1 3.4Å
92	N	30.9	Very low	34.9	Very low	138 Å²	138	114.6 Å²	114.6	74%	0.738	60%	0.598	S	S	*	*	G	3₁₀ helix	trans	-95.4	-10.6	-167.9	-77.4	-3.2	0	0	0	116.8	R90	R90-N92 VanDerWaalsContact C-N 3.26Å; R90-N92 PolarHBondContact O-N 3.09Å
93	E	34.2	Very low	35.2	Very low	148 Å²	148	106.8 Å²	106.8	69%	0.692	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121	-21.9	-157.9	-145	172.2	-143.6	0	0	117
94	S	32.4	Very low	35.5	Very low	93 Å²	93	109 Å²	109	65%	0.65	59%	0.586	S	S	*	*	S	Bend	trans	-111	-15.8	-179.6	-56.9	0	0	0	0	114.8	S96	S94-S96 PolarHBondContact O-N 3.05Å; S94-S96 VanDerWaalsContact O-N 3.15Å
95	T	38.4	Very low	35.7	Very low	81 Å²	81	108.5 Å²	108.5	50%	0.497	58%	0.579	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.7	-19.2	170	-43.2	0	0	0	0	112.4	V91	V91-T95 PolarHBondContact O-OG1 3.4Å
96	S	34	Very low	35.7	Very low	89 Å²	89	107.2 Å²	107.2	62%	0.622	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.2	6.8	-162.7	-46.9	0	0	0	0	116	S94	S94-S96 PolarHBondContact O-N 3.05Å; S94-S96 VanDerWaalsContact O-N 3.15Å
97	Q	36.3	Very low	36.2	Very low	153 Å²	153	106 Å²	106	72%	0.715	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.9	-51.5	-174.7	-74	-164.8	-10.2	0	0	117.8
98	R	33.2	Very low	36.1	Very low	162 Å²	162	101.3 Å²	101.3	61%	0.611	53%	0.528	S	S	*	.	S	Bend	trans	-113.1	14.7	-173.8	-67.2	-177	78.5	99	-2.2	115.6	N100 E101	R98-N100 PolarHBondContact O-N 2.88Å; R98-E101 IonicContact CZ-OE1 3.02Å; R98-E101 IonicContact CZ-OE2 3.21Å; R98-E101 IonicContact NE-OE2 3.47Å; R98-E101 IonicContact NH1-OE1 2.71Å; R98-E101 PolarHBondContact NH1-OE1 3.14Å; R98-E101 IonicContact NH1-OE2 3.7Å; R98-E101 PolarHBondContact NH1-OE2 3.26Å; R98-E101 VanDerWaalsContact NH2-CD 3.27Å; R98-E101 IonicContact NH2-OE1 3.59Å; R98-E101 PolarHBondContact NH2-OE1 3.37Å; R98-E101 IonicContact NH2-OE2 3.09Å; R98-E101 PolarHBondContact NH2-OE2 3.11Å
99	V	41.8	Very low	36.3	Very low	54 Å²	54	101.7 Å²	101.7	33%	0.327	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-15.9	155.4	175.4	0	0	0	0	111.1	T103	V99-T103 WeakPolarHBondContact O-CB 3.18Å; V99-T103 WeakPolarHBondContact O-CG2 3.19Å; V99-T103 PolarHBondContact O-OG1 2.95Å
100	N	37.3	Very low	36.4	Very low	74 Å²	74	95.3 Å²	95.3	40%	0.396	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-24.7	-178.6	-65.1	43	0	0	0	115.4	R98 T103 S104 E146	R98-N100 PolarHBondContact O-N 2.88Å; N100-T103 VanDerWaalsContact C-CB 3.47Å; N100-T103 CarbonylContact O-C 3.13Å; N100-T103 WeakPolarHBondContact O-CA 3.34Å; N100-T103 WeakPolarHBondContact O-CB 3.35Å; N100-T103 PolarHBondContact O-N 3.39Å; N100-S104 PolarHBondContact O-N 2.89Å; N100-E146 PolarHBondContact ND2-OE1 3.38Å
101	E	37.8	Very low	37	Very low	105 Å²	105	89.7 Å²	89.7	49%	0.491	48%	0.484	S	S	.	.	G	3₁₀ helix	trans	-91.9	-35.6	-174.4	-95.2	168.9	87.2	0	0	114.5	R98 T103 S104	R98-E101 IonicContact CZ-OE1 3.02Å; R98-E101 IonicContact CZ-OE2 3.21Å; R98-E101 IonicContact NE-OE2 3.47Å; R98-E101 IonicContact NH1-OE1 2.71Å; R98-E101 PolarHBondContact NH1-OE1 3.14Å; R98-E101 IonicContact NH1-OE2 3.7Å; R98-E101 PolarHBondContact NH1-OE2 3.26Å; R98-E101 VanDerWaalsContact NH2-CD 3.27Å; R98-E101 IonicContact NH2-OE1 3.59Å; R98-E101 PolarHBondContact NH2-OE1 3.37Å; R98-E101 IonicContact NH2-OE2 3.09Å; R98-E101 PolarHBondContact NH2-OE2 3.11Å; E101-T103 PolarHBondContact O-N 3.48Å; E101-S104 PolarHBondContact O-N 3.12Å
102	S	36	Very low	37.2	Very low	87 Å²	87	89.2 Å²	89.2	61%	0.608	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-73.2	27.6	159.8	-59.7	0	0	0	0	111.9	Q142 N145	S102-Q142 PolarHBondContact O-NE2 2.95Å; S102-Q142 PolarHBondContact O-OE1 3.44Å; S102-Q142 VanDerWaalsContact O-OE1 3.09Å; S102-N145 PolarHBondContact O-ND2 3.36Å
103	T	42.4	Very low	37.4	Very low	4 Å²	4	90.1 Å²	90.1	3%	0.025	49%	0.485	C	S	.	.	G	3₁₀ helix	trans	-152.6	17.6	-165.7	-71.2	0	0	0	0	111	V99 N100 E101 Q142 N145 E146	V99-T103 WeakPolarHBondContact O-CB 3.18Å; V99-T103 WeakPolarHBondContact O-CG2 3.19Å; V99-T103 PolarHBondContact O-OG1 2.95Å; N100-T103 VanDerWaalsContact C-CB 3.47Å; N100-T103 CarbonylContact O-C 3.13Å; N100-T103 WeakPolarHBondContact O-CA 3.34Å; N100-T103 WeakPolarHBondContact O-CB 3.35Å; N100-T103 PolarHBondContact O-N 3.39Å; E101-T103 PolarHBondContact O-N 3.48Å; T103-Q142 CarbonylContact O-C 3.16Å; T103-Q142 WeakPolarHBondContact O-CA 3.09Å; T103-N145 HydrophobicContact CG2-CB 3.48Å; T103-N145 VanDerWaalsContact CG2-CB 3.48Å; T103-N145 WeakPolarHBondContact OG1-CB 3.43Å; T103-N145 PolarHBondContact OG1-ND2 3.14Å; T103-E146 HydrophobicContact CG2-CB 3.6Å; T103-E146 HydrophobicContact CG2-CG 4.16Å; T103-E146 VanDerWaalsContact CG2-N 3.28Å
104	S	39.6	Very low	37.4	Very low	82 Å²	82	90.3 Å²	90.3	57%	0.573	48%	0.479	S	S	*	.	S	Bend	trans	-111.9	-9.7	154.3	-62.1	0	0	0	0	118.2	N100 E101 Q142	N100-S104 PolarHBondContact O-N 2.89Å; E101-S104 PolarHBondContact O-N 3.12Å; S104-Q142 CarbonylContact C-O 3.2Å; S104-Q142 VanDerWaalsContact CA-O 3.25Å; S104-Q142 WeakPolarHBondContact CA-O 3.28Å
105	Q	36.3	Very low	38	Very low	121 Å²	121	92.5 Å²	92.5	57%	0.565	49%	0.489	S	S	*	.	S	Bend	trans	-131.3	-16.3	-167.4	-75.7	-171.2	-15.7	0	0	128.9	E138 S139 T140	Q105-E138 CarbonylContact O-C 3.25Å; Q105-E138 VanDerWaalsContact O-C 3.25Å; Q105-S139 CarbonylContact O-C 3.54Å; Q105-S139 PolarHBondContact O-N 3.11Å; Q105-S139 VanDerWaalsContact O-N 3.08Å; Q105-T140 PolarHBondContact O-N 3.37Å
106	R	31.2	Very low	37.9	Very low	95 Å²	95	93.2 Å²	93.2	36%	0.358	49%	0.49	S	S	.	.	S	Bend	trans	-140	114.4	-170.5	-46.2	-160.2	70.2	80.7	-5.3	118.8	Q134 N137 E138 T140 S141 Q142	R106-Q134 PolarHBondContact NH2-O 2.77Å; R106-N137 VanDerWaalsContact CA-O 3.31Å; R106-N137 WeakPolarHBondContact CA-O 3.47Å; R106-N137 HydrophobicContact CB-CB 4.24Å; R106-N137 VanDerWaalsContact CB-O 3.3Å; R106-N137 WeakPolarHBondContact CB-O 3.06Å; R106-N137 WeakPolarHBondContact CB-OD1 3.28Å; R106-N137 WeakPolarHBondContact CG-O 3.47Å; R106-N137 PolarHBondContact NE-O 3.16Å; R106-N137 PolarHBondContact NH1-O 3.15Å; R106-E138 IonicContact CZ-OE1 3.49Å; R106-E138 VanDerWaalsContact CZ-OE1 3.3Å; R106-E138 IonicContact NH1-OE1 2.98Å; R106-E138 PolarHBondContact NH1-OE1 3.46Å; R106-E138 IonicContact NH2-OE1 3.06Å; R106-E138 PolarHBondContact NH2-OE1 2.68Å; R106-T140 VanDerWaalsContact C-C 3.46Å; R106-S141 WeakPolarHBondContact O-CA 3.48Å; R106-S141 WeakPolarHBondContact O-CB 3.23Å; R106-S141 PolarHBondContact O-N 2.94Å; R106-S141 PolarHBondContact O-OG 3.38Å; R106-Q142 PolarHBondContact O-NE2 2.87Å
107	V	45.6	Very low	38	Very low	52 Å²	52	95.5 Å²	95.5	32%	0.315	49%	0.49	S	S	.	.	S	Bend	trans	124.2	-64.9	-157.2	158.6	0	0	0	0	125.3	T111 V136 N137 T140 S141	V107-T111 PolarHBondContact O-N 2.87Å; V107-T111 PolarHBondContact O-OG1 2.65Å; V107-V136 WeakPolarHBondContact CG2-O 3.36Å; V107-N137 WeakPolarHBondContact CG2-OD1 2.99Å; V107-N137 PolarHBondContact N-OD1 2.65Å; V107-T140 VanDerWaalsContact C-CB 3.48Å; V107-T140 HydrophobicContact CB-CG2 4.16Å; V107-T140 HydrophobicContact CG2-CG2 3.88Å; V107-T140 VanDerWaalsContact N-C 3.35Å; V107-T140 WeakPolarHBondContact O-CG2 3.22Å; V107-S141 VanDerWaalsContact C-N 3.27Å; V107-S141 WeakPolarHBondContact CA-OG 3.12Å
108	N	38.6	Very low	38.2	Very low	25 Å²	25	92.3 Å²	92.3	13%	0.134	49%	0.485	C	S	.	.	H	α-helix	trans	-47.6	-65.2	-175.3	-71.1	-8.7	0	0	0	117.2	S110 T111 S112 T140 S141 Q142 R143 V144	N108-S110 PolarHBondContact O-N 2.64Å; N108-T111 CarbonylContact O-C 3.59Å; N108-T111 WeakPolarHBondContact O-CA 3.13Å; N108-T111 WeakPolarHBondContact O-CB 3.25Å; N108-T111 PolarHBondContact O-N 3.15Å; N108-S112 WeakPolarHBondContact O-CB 3.09Å; N108-S112 PolarHBondContact O-N 2.94Å; N108-S112 PolarHBondContact O-OG 3.38Å; N108-T140 WeakPolarHBondContact CB-O 3.11Å; N108-T140 PolarHBondContact N-O 2.68Å; N108-T140 PolarHBondContact ND2-O 3.32Å; N108-S141 VanDerWaalsContact CG-C 3.42Å; N108-S141 WeakPolarHBondContact OD1-CA 3.47Å; N108-S141 PolarHBondContact OD1-O 3.4Å; N108-Q142 VanDerWaalsContact CG-N 3.32Å; N108-Q142 PolarHBondContact ND2-N 3.5Å; N108-Q142 PolarHBondContact OD1-N 3.44Å; N108-R143 PolarHBondContact ND2-N 3.32Å; N108-R143 VanDerWaalsContact ND2-N 3.14Å; N108-V144 VanDerWaalsContact OD1-CG2 3.25Å; N108-V144 WeakPolarHBondContact OD1-CG2 3.01Å
109	E	35.5	Very low	38.3	Very low	93 Å²	93	91.8 Å²	91.8	44%	0.435	50%	0.5	S	S	.	.	H	α-helix	trans	-48.5	-43.6	-177.7	173.6	-178.9	-121.5	0	0	112.2	S112 Q113 S139 T140	E109-S112 CarbonylContact O-C 3.57Å; E109-S112 WeakPolarHBondContact O-CA 3.24Å; E109-S112 WeakPolarHBondContact O-CB 3.5Å; E109-S112 PolarHBondContact O-N 3.14Å; E109-Q113 PolarHBondContact O-N 3.32Å; E109-S139 VanDerWaalsContact CD-CB 3.47Å; E109-S139 PolarHBondContact OE1-OG 3.24Å; E109-S139 WeakPolarHBondContact OE2-CB 3.39Å; E109-S139 PolarHBondContact OE2-OG 3.41Å; E109-T140 HydrophobicContact CB-CG2 3.86Å; E109-T140 PolarHBondContact OE2-OG1 2.78Å
110	S	33.8	Very low	37.8	Very low	29 Å²	29	93.3 Å²	93.3	20%	0.203	51%	0.513	C	S	.	.	H	α-helix	trans	-83.3	-12.3	175.1	-51.4	0	0	0	0	113.8	N108 V136	N108-S110 PolarHBondContact O-N 2.64Å; S110-V136 WeakPolarHBondContact CB-O 3.16Å; S110-V136 VanDerWaalsContact OG-CG1 3.24Å; S110-V136 WeakPolarHBondContact OG-CG1 3.27Å; S110-V136 PolarHBondContact OG-O 2.92Å; S110-V136 VanDerWaalsContact OG-O 3.05Å
111	T	46.2	Very low	37.8	Very low	97 Å²	97	96.6 Å²	96.6	60%	0.595	53%	0.526	S	S	*	.	H	α-helix	trans	-78.2	-22.7	156	-54.1	0	0	0	0	111.6	V107 N108 Q113	V107-T111 PolarHBondContact O-N 2.87Å; V107-T111 PolarHBondContact O-OG1 2.65Å; N108-T111 CarbonylContact O-C 3.59Å; N108-T111 WeakPolarHBondContact O-CA 3.13Å; N108-T111 WeakPolarHBondContact O-CB 3.25Å; N108-T111 PolarHBondContact O-N 3.15Å; T111-Q113 VanDerWaalsContact C-N 3.32Å
112	S	39.7	Very low	37.6	Very low	92 Å²	92	101.9 Å²	101.9	64%	0.643	54%	0.541	S	S	*	.	H	α-helix	trans	-79.8	-20.7	-177.6	-51.2	0	0	0	0	110.8	N108 E109	N108-S112 WeakPolarHBondContact O-CB 3.09Å; N108-S112 PolarHBondContact O-N 2.94Å; N108-S112 PolarHBondContact O-OG 3.38Å; E109-S112 CarbonylContact O-C 3.57Å; E109-S112 WeakPolarHBondContact O-CA 3.24Å; E109-S112 WeakPolarHBondContact O-CB 3.5Å; E109-S112 PolarHBondContact O-N 3.14Å
113	Q	35.6	Very low	37.6	Very low	157 Å²	157	103.2 Å²	103.2	73%	0.734	55%	0.546	S	S	*	.	S	Bend	trans	-135.5	101.1	165.5	-64.8	-165.3	14.6	0	0	112.9	E109 T111	E109-Q113 PolarHBondContact O-N 3.32Å; T111-Q113 VanDerWaalsContact C-N 3.32Å
114	R	33.5	Very low	37	Very low	151 Å²	151	109 Å²	109	57%	0.57	58%	0.576	S	S	*	*			trans	66.1	81.8	145.9	-52.1	179.4	87.1	112.4	-6.8	116.5	N116 E117	R114-N116 VanDerWaalsContact CA-N 3.31Å; R114-N116 HydrophobicContact CB-CB 3.95Å; R114-N116 HydrophobicContact CG-CB 4.2Å; R114-E117 IonicContact CZ-OE1 2.92Å; R114-E117 VanDerWaalsContact CZ-OE1 3.3Å; R114-E117 IonicContact NE-OE1 2.67Å; R114-E117 PolarHBondContact NE-OE1 2.91Å; R114-E117 VanDerWaalsContact NE-OE1 3.09Å; R114-E117 IonicContact NH2-OE1 3.3Å; R114-E117 PolarHBondContact NH2-OE1 2.87Å; R114-E117 IonicContact NH2-OE2 2.71Å
115	V	45	Very low	36.6	Very low	139 Å²	139	111.1 Å²	111.1	84%	0.842	58%	0.581	S	S	*	*			trans	-84.6	30.8	131	-166.5	0	0	0	0	109.8
116	N	37	Very low	36.4	Very low	97 Å²	97	113.4 Å²	113.4	52%	0.519	59%	0.592	S	S	.	*			trans	-70.1	166.5	149.7	-56.6	3.1	0	0	0	107.2	R114	R114-N116 VanDerWaalsContact CA-N 3.31Å; R114-N116 HydrophobicContact CB-CB 3.95Å; R114-N116 HydrophobicContact CG-CB 4.2Å
117	E	36.5	Very low	36.6	Very low	137 Å²	137	119.8 Å²	119.8	64%	0.64	62%	0.616	S	S	*	*	S	Bend	trans	56.5	50	-177.6	-66	121.3	-94.3	0	0	111.7	R114	R114-E117 IonicContact CZ-OE1 2.92Å; R114-E117 VanDerWaalsContact CZ-OE1 3.3Å; R114-E117 IonicContact NE-OE1 2.67Å; R114-E117 PolarHBondContact NE-OE1 2.91Å; R114-E117 VanDerWaalsContact NE-OE1 3.09Å; R114-E117 IonicContact NH2-OE1 3.3Å; R114-E117 PolarHBondContact NH2-OE1 2.87Å; R114-E117 IonicContact NH2-OE2 2.71Å
118	S	39.3	Very low	36.3	Very low	86 Å²	86	123.9 Å²	123.9	60%	0.601	64%	0.641	S	S	*	*				66.7	76.7	90	-56	0	0	0	0	113.5	S120	S118-S120 PolarHBondContact O-N 2.68Å
119	T	35.9	Very low	36.2	Very low	151 Å²	151	129.5 Å²	129.5	93%	0.926	67%	0.671	S	S	*	*			trans	-70.7	41.6	147	-35.8	0	0	0	0	111
120	S	31.9	Very low	36.2	Very low	86 Å²	86	133.1 Å²	133.1	60%	0.601	69%	0.688	S	S	*	*			trans	-77.8	132.7	155.6	-75.9	0	0	0	0	106.7	S118	S118-S120 PolarHBondContact O-N 2.68Å
121	Q	35.4	Very low	36.1	Very low	143 Å²	143	137.5 Å²	137.5	67%	0.668	72%	0.718	S	S	*	*	S	Bend	trans	74	116.3	180	-46.3	-172.2	40.4	0	0	112.5
122	R	33.8	Very low	35.6	Very low	215 Å²	215	138.7 Å²	138.7	81%	0.811	73%	0.726	S	S	*	*				87.4	136.4	98.8	-79.4	179	158.1	153.4	-12.6	112.3
123	V	36	Very low	35.5	Very low	115 Å²	115	138.5 Å²	138.5	70%	0.697	72%	0.724	S	S	*	*			cis	-157.9	150.5	-6.3	102.7	0	0	0	0	109.6
124	N	30.3	Very low	35.5	Very low	126 Å²	126	139.2 Å²	139.2	67%	0.674	73%	0.728	S	S	*	*			trans	53.2	147.7	160.8	-80.9	46.5	0	0	0	123.4
125	D	31.2	Very low	35.7	Very low	126 Å²	126	141.4 Å²	141.4	67%	0.674	74%	0.736	S	S	*	*			trans	64	107	139.9	-64.9	-40.8	0	0	0	121.8
126	Q	32.7	Very low	35.5	Very low	170 Å²	170	138.6 Å²	138.6	79%	0.794	72%	0.719	S	S	*	*			trans	78.4	105.8	142.1	-58.4	-169.6	13	0	0	119.8
127	R	35.4	Very low	35.6	Very low	229 Å²	229	135.9 Å²	135.9	86%	0.864	70%	0.704	S	S	*	*			trans	75.6	104.1	147.1	-71.2	-179.5	160	-176.3	-6.1	119.3
128	V	38.9	Very low	35.7	Very low	138 Å²	138	132.5 Å²	132.5	84%	0.836	69%	0.689	S	S	*	*				77.3	104.1	127.2	178.5	0	0	0	0	116.9
129	N	36.6	Very low	35.7	Very low	142 Å²	142	131.4 Å²	131.4	76%	0.759	68%	0.681	S	S	*	*			trans	-53.5	164.2	154.1	-74.3	-13.5	0	0	0	110.6
130	E	35.9	Very low	36	Very low	170 Å²	170	124.2 Å²	124.2	79%	0.794	64%	0.637	S	S	*	*			cis	-169.3	128.8	46.2	-166.7	161.3	-123.2	0	0	112.1
131	S	32.3	Very low	36.4	Very low	120 Å²	120	121.4 Å²	121.4	84%	0.839	62%	0.617	S	S	*	*	S	Bend	trans	-154.8	18	177.1	53.1	0	0	0	0	115.5
132	T	35	Very low	36.6	Very low	123 Å²	123	115.8 Å²	115.8	76%	0.755	59%	0.591	S	S	*	*			trans	-143.4	104.4	-176.6	-44.7	0	0	0	0	112.2
133	S	38.1	Very low	36.8	Very low	87 Å²	87	115.2 Å²	115.2	61%	0.608	59%	0.589	S	S	*	*			trans	-167.2	-38.9	167.3	-91.1	0	0	0	0	118.1	R135	S133-R135 PolarHBondContact O-N 2.8Å
134	Q	35.5	Very low	37.1	Very low	172 Å²	172	113.3 Å²	113.3	80%	0.804	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	-30.4	-152	-76.1	-168.5	-8	0	0	118.2	R106	R106-Q134 PolarHBondContact NH2-O 2.77Å
135	R	36.2	Very low	37.5	Very low	197 Å²	197	109.8 Å²	109.8	74%	0.743	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	-6.3	-174.8	-67.3	-157.9	72.7	169.5	-0.6	116.4	S133 N137 E138	S133-R135 PolarHBondContact O-N 2.8Å; R135-N137 PolarHBondContact O-N 2.68Å; R135-E138 WeakPolarHBondContact CG-OE2 3.33Å; R135-E138 IonicContact CZ-OE2 3.77Å; R135-E138 IonicContact NE-OE2 2.67Å; R135-E138 PolarHBondContact NE-OE2 2.82Å; R135-E138 IonicContact NH2-OE2 3.3Å; R135-E138 PolarHBondContact NH2-OE2 3.45Å
136	V	40.9	Very low	37.9	Very low	81 Å²	81	108.1 Å²	108.1	49%	0.491	55%	0.547	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	32.7	178.8	179.9	0	0	0	0	110.7	V107 S110 T140	V107-V136 WeakPolarHBondContact CG2-O 3.36Å; S110-V136 WeakPolarHBondContact CB-O 3.16Å; S110-V136 VanDerWaalsContact OG-CG1 3.24Å; S110-V136 WeakPolarHBondContact OG-CG1 3.27Å; S110-V136 PolarHBondContact OG-O 2.92Å; S110-V136 VanDerWaalsContact OG-O 3.05Å; V136-T140 WeakPolarHBondContact O-CG2 3.18Å
137	N	39.7	Very low	38.3	Very low	39 Å²	39	104 Å²	104	21%	0.209	54%	0.536	C	S	.	.	T	Hydrogen-bonded Turn	trans	-163.7	6.7	-147.5	-94.8	-67.8	0	0	0	115.3	R106 V107 R135 S139 T140	R106-N137 VanDerWaalsContact CA-O 3.31Å; R106-N137 WeakPolarHBondContact CA-O 3.47Å; R106-N137 HydrophobicContact CB-CB 4.24Å; R106-N137 VanDerWaalsContact CB-O 3.3Å; R106-N137 WeakPolarHBondContact CB-O 3.06Å; R106-N137 WeakPolarHBondContact CB-OD1 3.28Å; R106-N137 WeakPolarHBondContact CG-O 3.47Å; R106-N137 PolarHBondContact NE-O 3.16Å; R106-N137 PolarHBondContact NH1-O 3.15Å; V107-N137 WeakPolarHBondContact CG2-OD1 2.99Å; V107-N137 PolarHBondContact N-OD1 2.65Å; R135-N137 PolarHBondContact O-N 2.68Å; N137-S139 PolarHBondContact O-N 3.36Å; N137-T140 WeakPolarHBondContact CA-OG1 3.21Å
138	E	38	Very low	38.6	Very low	67 Å²	67	96.3 Å²	96.3	31%	0.313	52%	0.515	S	S	.	.	S	Bend	trans	-75.3	-19.2	-176.2	-107.2	71.5	-83.9	0	0	115.8	Q105 R106 R135 T140	Q105-E138 CarbonylContact O-C 3.25Å; Q105-E138 VanDerWaalsContact O-C 3.25Å; R106-E138 IonicContact CZ-OE1 3.49Å; R106-E138 VanDerWaalsContact CZ-OE1 3.3Å; R106-E138 IonicContact NH1-OE1 2.98Å; R106-E138 PolarHBondContact NH1-OE1 3.46Å; R106-E138 IonicContact NH2-OE1 3.06Å; R106-E138 PolarHBondContact NH2-OE1 2.68Å; R135-E138 WeakPolarHBondContact CG-OE2 3.33Å; R135-E138 IonicContact CZ-OE2 3.77Å; R135-E138 IonicContact NE-OE2 2.67Å; R135-E138 PolarHBondContact NE-OE2 2.82Å; R135-E138 IonicContact NH2-OE2 3.3Å; R135-E138 PolarHBondContact NH2-OE2 3.45Å; E138-T140 PolarHBondContact N-OG1 3.33Å
139	S	39.2	Very low	38.5	Very low	62 Å²	62	91.3 Å²	91.3	43%	0.434	49%	0.487	S	S	.	.	S	Bend	trans	-143.8	24.9	-154.3	-17.1	0	0	0	0	112.8	Q105 E109 N137	Q105-S139 CarbonylContact O-C 3.54Å; Q105-S139 PolarHBondContact O-N 3.11Å; Q105-S139 VanDerWaalsContact O-N 3.08Å; E109-S139 VanDerWaalsContact CD-CB 3.47Å; E109-S139 PolarHBondContact OE1-OG 3.24Å; E109-S139 WeakPolarHBondContact OE2-CB 3.39Å; E109-S139 PolarHBondContact OE2-OG 3.41Å; N137-S139 PolarHBondContact O-N 3.36Å
140	T	42.1	Very low	38.6	Very low	1 Å²	1	91.5 Å²	91.5	1%	0.006	48%	0.483	C	S	.	.			trans	-121.2	-133.1	-133.6	-32.1	0	0	0	0	108.9	Q105 R106 V107 N108 E109 V136 N137 E138 Q142	Q105-T140 PolarHBondContact O-N 3.37Å; R106-T140 VanDerWaalsContact C-C 3.46Å; V107-T140 VanDerWaalsContact C-CB 3.48Å; V107-T140 HydrophobicContact CB-CG2 4.16Å; V107-T140 HydrophobicContact CG2-CG2 3.88Å; V107-T140 VanDerWaalsContact N-C 3.35Å; V107-T140 WeakPolarHBondContact O-CG2 3.22Å; N108-T140 WeakPolarHBondContact CB-O 3.11Å; N108-T140 PolarHBondContact N-O 2.68Å; N108-T140 PolarHBondContact ND2-O 3.32Å; E109-T140 HydrophobicContact CB-CG2 3.86Å; E109-T140 PolarHBondContact OE2-OG1 2.78Å; V136-T140 WeakPolarHBondContact O-CG2 3.18Å; N137-T140 WeakPolarHBondContact CA-OG1 3.21Å; E138-T140 PolarHBondContact N-OG1 3.33Å; T140-Q142 PolarHBondContact O-N 2.66Å
141	S	40.7	Very low	38.8	Very low	27 Å²	27	92.9 Å²	92.9	19%	0.189	48%	0.481	C	S	.	.	S	Bend	trans	-52.3	7.3	-143.2	-52.1	0	0	0	0	118.7	R106 V107 N108 R143 V144 N145	R106-S141 WeakPolarHBondContact O-CA 3.48Å; R106-S141 WeakPolarHBondContact O-CB 3.23Å; R106-S141 PolarHBondContact O-N 2.94Å; R106-S141 PolarHBondContact O-OG 3.38Å; V107-S141 VanDerWaalsContact C-N 3.27Å; V107-S141 WeakPolarHBondContact CA-OG 3.12Å; N108-S141 VanDerWaalsContact CG-C 3.42Å; N108-S141 WeakPolarHBondContact OD1-CA 3.47Å; N108-S141 PolarHBondContact OD1-O 3.4Å; S141-R143 PolarHBondContact O-N 3.27Å; S141-V144 CarbonylContact O-C 3.58Å; S141-V144 WeakPolarHBondContact O-CA 3.37Å; S141-V144 WeakPolarHBondContact O-CB 3.39Å; S141-V144 PolarHBondContact O-N 2.92Å; S141-N145 PolarHBondContact O-N 2.97Å
142	Q	39.2	Very low	39.1	Very low	25 Å²	25	90.5 Å²	90.5	12%	0.117	46%	0.461	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.2	48	-133.8	-72.3	-163.5	9.4	0	0	105.3	S102 T103 S104 R106 N108 T140	S102-Q142 PolarHBondContact O-NE2 2.95Å; S102-Q142 PolarHBondContact O-OE1 3.44Å; S102-Q142 VanDerWaalsContact O-OE1 3.09Å; T103-Q142 CarbonylContact O-C 3.16Å; T103-Q142 WeakPolarHBondContact O-CA 3.09Å; S104-Q142 CarbonylContact C-O 3.2Å; S104-Q142 VanDerWaalsContact CA-O 3.25Å; S104-Q142 WeakPolarHBondContact CA-O 3.28Å; R106-Q142 PolarHBondContact O-NE2 2.87Å; N108-Q142 VanDerWaalsContact CG-N 3.32Å; N108-Q142 PolarHBondContact ND2-N 3.5Å; N108-Q142 PolarHBondContact OD1-N 3.44Å; T140-Q142 PolarHBondContact O-N 2.66Å
143	R	39.5	Very low	39.3	Very low	202 Å²	202	88.3 Å²	88.3	76%	0.762	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.4	-16.5	141.6	-64.3	173.8	66	164.5	-0.2	108.6	N108 S141 S147	N108-R143 PolarHBondContact ND2-N 3.32Å; N108-R143 VanDerWaalsContact ND2-N 3.14Å; S141-R143 PolarHBondContact O-N 3.27Å; R143-S147 PolarHBondContact O-OG 2.94Å
144	V	42.6	Very low	39.3	Very low	75 Å²	75	91.4 Å²	91.4	46%	0.455	45%	0.45	S	S	.	.	H	α-helix	trans	-74.8	-46.6	171.7	175	0	0	0	0	111.6	N108 S141 E146 S147 T148	N108-V144 VanDerWaalsContact OD1-CG2 3.25Å; N108-V144 WeakPolarHBondContact OD1-CG2 3.01Å; S141-V144 CarbonylContact O-C 3.58Å; S141-V144 WeakPolarHBondContact O-CA 3.37Å; S141-V144 WeakPolarHBondContact O-CB 3.39Å; S141-V144 PolarHBondContact O-N 2.92Å; V144-E146 VanDerWaalsContact C-N 3.32Å; V144-E146 PolarHBondContact O-N 3.27Å; V144-S147 PolarHBondContact O-N 3.39Å; V144-T148 VanDerWaalsContact O-CB 3.29Å; V144-T148 WeakPolarHBondContact O-CB 3.18Å; V144-T148 PolarHBondContact O-N 3.15Å; V144-T148 PolarHBondContact O-OG1 2.66Å
145	N	38.4	Very low	39.6	Very low	53 Å²	53	87 Å²	87	28%	0.283	44%	0.438	S	S	.	.	H	α-helix	trans	-55.1	-45.5	177.4	-82.4	4.3	0	0	0	112.1	S102 T103 S141 S147 T148 S149	S102-N145 PolarHBondContact O-ND2 3.36Å; T103-N145 HydrophobicContact CG2-CB 3.48Å; T103-N145 VanDerWaalsContact CG2-CB 3.48Å; T103-N145 WeakPolarHBondContact OG1-CB 3.43Å; T103-N145 PolarHBondContact OG1-ND2 3.14Å; S141-N145 PolarHBondContact O-N 2.97Å; N145-S147 VanDerWaalsContact C-N 3.29Å; N145-S147 PolarHBondContact O-N 3.19Å; N145-T148 PolarHBondContact O-N 2.69Å; N145-T148 VanDerWaalsContact O-N 3.14Å; N145-S149 WeakPolarHBondContact O-CB 3.49Å; N145-S149 PolarHBondContact O-N 2.85Å; N145-S149 PolarHBondContact O-OG 3.26Å
146	E	39.3	Very low	39.6	Very low	90 Å²	90	80.9 Å²	80.9	42%	0.421	42%	0.422	S	S	.	.	H	α-helix	trans	-64.7	-35.2	-176.5	-153	167.3	-137.1	0	0	112	N100 T103 V144	N100-E146 PolarHBondContact ND2-OE1 3.38Å; T103-E146 HydrophobicContact CG2-CB 3.6Å; T103-E146 HydrophobicContact CG2-CG 4.16Å; T103-E146 VanDerWaalsContact CG2-N 3.28Å; V144-E146 VanDerWaalsContact C-N 3.32Å; V144-E146 PolarHBondContact O-N 3.27Å
147	S	40.5	Very low	39.6	Very low	83 Å²	83	80.3 Å²	80.3	58%	0.58	42%	0.422	S	S	*	.	H	α-helix	trans	-77.9	-28.1	175.6	-54	0	0	0	0	113.4	R143 V144 N145	R143-S147 PolarHBondContact O-OG 2.94Å; V144-S147 PolarHBondContact O-N 3.39Å; N145-S147 VanDerWaalsContact C-N 3.29Å; N145-S147 PolarHBondContact O-N 3.19Å
148	T	40.9	Very low	39.5	Very low	68 Å²	68	86 Å²	86	42%	0.417	45%	0.447	S	S	.	.	H	α-helix	trans	-90	-41.1	-174.6	-53.7	0	0	0	0	111.8	V144 N145 Q150 R151 V152	V144-T148 VanDerWaalsContact O-CB 3.29Å; V144-T148 WeakPolarHBondContact O-CB 3.18Å; V144-T148 PolarHBondContact O-N 3.15Å; V144-T148 PolarHBondContact O-OG1 2.66Å; N145-T148 PolarHBondContact O-N 2.69Å; N145-T148 VanDerWaalsContact O-N 3.14Å; T148-Q150 VanDerWaalsContact C-N 3.28Å; T148-Q150 PolarHBondContact O-N 2.89Å; T148-R151 PolarHBondContact O-N 2.88Å; T148-V152 HydrophobicContact CG2-CG2 4.05Å; T148-V152 WeakPolarHBondContact O-CG2 3.4Å; T148-V152 PolarHBondContact O-N 2.79Å; T148-V152 VanDerWaalsContact O-N 3.17Å
149	S	38	Very low	39.5	Very low	34 Å²	34	91.8 Å²	91.8	24%	0.238	47%	0.466	C	S	.	.	H	α-helix	trans	-61.3	-32.9	-177.8	-70.4	0	0	0	0	113.1	N145 N153	N145-S149 WeakPolarHBondContact O-CB 3.49Å; N145-S149 PolarHBondContact O-N 2.85Å; N145-S149 PolarHBondContact O-OG 3.26Å; S149-N153 WeakPolarHBondContact O-CB 3.44Å; S149-N153 PolarHBondContact O-N 2.66Å; S149-N153 PolarHBondContact O-ND2 3.41Å
150	Q	39.5	Very low	39.4	Very low	146 Å²	146	92 Å²	92	68%	0.682	47%	0.465	S	S	*	.	H	α-helix	trans	-65	-46	175.8	-68.7	-171.5	-9.3	0	0	112.3	T148	T148-Q150 VanDerWaalsContact C-N 3.28Å; T148-Q150 PolarHBondContact O-N 2.89Å
151	R	38.8	Very low	39.2	Very low	198 Å²	198	97.6 Å²	97.6	75%	0.747	49%	0.494	S	S	*	.	H	α-helix	trans	-78	-25.3	-175.1	-62.3	-169	68.9	151.3	1.9	114.3	T148 S155	T148-R151 PolarHBondContact O-N 2.88Å; R151-S155 PolarHBondContact O-OG 3.02Å
152	V	39.2	Very low	39.1	Very low	70 Å²	70	104 Å²	104	42%	0.424	52%	0.521	S	S	.	.	H	α-helix	trans	-78.7	-37.3	176.3	177.4	0	0	0	0	111.4	T148 E154 S155 T156	T148-V152 HydrophobicContact CG2-CG2 4.05Å; T148-V152 WeakPolarHBondContact O-CG2 3.4Å; T148-V152 PolarHBondContact O-N 2.79Å; T148-V152 VanDerWaalsContact O-N 3.17Å; V152-E154 PolarHBondContact O-N 2.67Å; V152-S155 PolarHBondContact O-N 2.94Å; V152-S155 VanDerWaalsContact O-N 3.15Å; V152-T156 PolarHBondContact O-N 3.16Å; V152-T156 PolarHBondContact O-OG1 3.08Å
153	N	38.5	Very low	39	Very low	77 Å²	77	106.9 Å²	106.9	41%	0.412	55%	0.545	S	S	.	.	H	α-helix	trans	-59.9	-40.7	-177.1	-82.5	-4.9	0	0	0	113.4	S149 S157	S149-N153 WeakPolarHBondContact O-CB 3.44Å; S149-N153 PolarHBondContact O-N 2.66Å; S149-N153 PolarHBondContact O-ND2 3.41Å; N153-S157 VanDerWaalsContact O-CB 3.29Å; N153-S157 WeakPolarHBondContact O-CB 3.11Å; N153-S157 PolarHBondContact O-N 3.33Å; N153-S157 PolarHBondContact O-OG 2.93Å
154	E	39.6	Very low	38.7	Very low	153 Å²	153	99.6 Å²	99.6	72%	0.715	52%	0.523	S	S	*	.	H	α-helix	trans	-68.8	-42.8	174.6	-65.5	-176	123.5	0	0	112	V152	V152-E154 PolarHBondContact O-N 2.67Å
155	S	39.9	Very low	38.6	Very low	79 Å²	79	100.8 Å²	100.8	55%	0.552	53%	0.534	S	S	*	.	H	α-helix	trans	-71.3	-35.3	-172.2	-56.7	0	0	0	0	113.9	R151 V152	R151-S155 PolarHBondContact O-OG 3.02Å; V152-S155 PolarHBondContact O-N 2.94Å; V152-S155 VanDerWaalsContact O-N 3.15Å
156	T	37.7	Very low	38.5	Very low	68 Å²	68	106.9 Å²	106.9	42%	0.417	56%	0.561	S	S	.	*	H	α-helix	trans	-90.4	-34.2	-175.3	-60.4	0	0	0	0	112.5	V152 Q158 R159 V160	V152-T156 PolarHBondContact O-N 3.16Å; V152-T156 PolarHBondContact O-OG1 3.08Å; T156-Q158 VanDerWaalsContact C-N 3.26Å; T156-Q158 PolarHBondContact O-N 3.37Å; T156-R159 PolarHBondContact O-N 2.64Å; T156-R159 VanDerWaalsContact O-N 3.09Å; T156-V160 HydrophobicContact CG2-CG2 3.62Å; T156-V160 PolarHBondContact O-N 3.11Å; T156-V160 VanDerWaalsContact O-N 3.12Å
157	S	39.5	Very low	38.3	Very low	69 Å²	69	112 Å²	112	48%	0.483	58%	0.576	S	S	.	*	H	α-helix	trans	-60.9	-33.1	-176.7	-60.7	0	0	0	0	113.2	N153	N153-S157 VanDerWaalsContact O-CB 3.29Å; N153-S157 WeakPolarHBondContact O-CB 3.11Å; N153-S157 PolarHBondContact O-N 3.33Å; N153-S157 PolarHBondContact O-OG 2.93Å
158	Q	39.1	Very low	38.1	Very low	158 Å²	158	111.1 Å²	111.1	74%	0.738	57%	0.567	S	S	*	*	H	α-helix	trans	-71.2	-33.6	176.6	-68.1	-173.4	-12.6	0	0	113.1	T156	T156-Q158 VanDerWaalsContact C-N 3.26Å; T156-Q158 PolarHBondContact O-N 3.37Å
159	R	37.9	Very low	38	Very low	189 Å²	189	110.2 Å²	110.2	71%	0.713	56%	0.56	S	S	*	*	H	α-helix	trans	-92.2	-24.5	-173.1	-61.6	-170.2	69.3	149.9	2	114.4	T156 S163	T156-R159 PolarHBondContact O-N 2.64Å; T156-R159 VanDerWaalsContact O-N 3.09Å; R159-S163 WeakPolarHBondContact O-CB 3.22Å; R159-S163 PolarHBondContact O-N 3.36Å; R159-S163 PolarHBondContact O-OG 3.15Å
160	V	36.1	Very low	37.8	Very low	67 Å²	67	115.8 Å²	115.8	41%	0.406	58%	0.582	S	S	.	*	H	α-helix	trans	-80.1	-35.1	179.4	176.3	0	0	0	0	111.8	T156 E162 S163 T164	T156-V160 HydrophobicContact CG2-CG2 3.62Å; T156-V160 PolarHBondContact O-N 3.11Å; T156-V160 VanDerWaalsContact O-N 3.12Å; V160-E162 VanDerWaalsContact C-N 3.31Å; V160-E162 PolarHBondContact O-N 2.67Å; V160-S163 PolarHBondContact O-N 3.22Å; V160-S163 VanDerWaalsContact O-N 3.09Å; V160-T164 PolarHBondContact O-N 3.38Å; V160-T164 PolarHBondContact O-OG1 3.15Å
161	N	39.3	Very low	37.7	Very low	118 Å²	118	113.4 Å²	113.4	63%	0.631	58%	0.582	S	S	*	*	H	α-helix	trans	-61	-36.8	176.7	-80.7	-12.3	0	0	0	112.8	S165	N161-S165 WeakPolarHBondContact O-CB 3.17Å; N161-S165 PolarHBondContact O-OG 3.15Å
162	E	37	Very low	37.5	Very low	162 Å²	162	107.3 Å²	107.3	76%	0.757	57%	0.567	S	S	*	*	H	α-helix	trans	-75	-32.7	172.7	-65.1	-173.7	131.5	0	0	112.8	V160	V160-E162 VanDerWaalsContact C-N 3.31Å; V160-E162 PolarHBondContact O-N 2.67Å
163	S	37.5	Very low	37.3	Very low	86 Å²	86	104.1 Å²	104.1	60%	0.601	55%	0.548	S	S	*	.	H	α-helix	trans	-90.9	-20.1	-170.3	-55.8	0	0	0	0	115.2	R159 V160	R159-S163 WeakPolarHBondContact O-CB 3.22Å; R159-S163 PolarHBondContact O-N 3.36Å; R159-S163 PolarHBondContact O-OG 3.15Å; V160-S163 PolarHBondContact O-N 3.22Å; V160-S163 VanDerWaalsContact O-N 3.09Å
164	T	33.3	Very low	37.1	Very low	49 Å²	49	105.2 Å²	105.2	30%	0.301	55%	0.55	S	S	.	*	H	α-helix	trans	-123.1	-3.3	-175.4	-28	0	0	0	0	113.8	V160 Q166 R167 V168	V160-T164 PolarHBondContact O-N 3.38Å; V160-T164 PolarHBondContact O-OG1 3.15Å; T164-Q166 PolarHBondContact O-N 2.68Å; T164-R167 HydrophobicContact CG2-CB 3.95Å; T164-R167 PolarHBondContact O-N 2.98Å; T164-V168 HydrophobicContact CG2-CG2 3.69Å; T164-V168 VanDerWaalsContact O-CG2 3.3Å; T164-V168 WeakPolarHBondContact O-CG2 3.02Å; T164-V168 PolarHBondContact O-N 3.43Å
165	S	40.5	Very low	36.9	Very low	100 Å²	100	106.1 Å²	106.1	70%	0.699	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-8.6	161	-65	0	0	0	0	113.6	N161	N161-S165 WeakPolarHBondContact O-CB 3.17Å; N161-S165 PolarHBondContact O-OG 3.15Å
166	Q	35.9	Very low	36.6	Very low	180 Å²	180	106.8 Å²	106.8	84%	0.841	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.8	4.8	170.8	-64.2	-175.9	-12.1	0	0	114.6	T164	T164-Q166 PolarHBondContact O-N 2.68Å
167	R	35.5	Very low	36.4	Very low	197 Å²	197	106.1 Å²	106.1	74%	0.743	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141.8	-7	178.6	-62.8	-167.6	77	160.5	4.6	116.8	T164 N169	T164-R167 HydrophobicContact CG2-CB 3.95Å; T164-R167 PolarHBondContact O-N 2.98Å; R167-N169 PolarHBondContact O-N 3.24Å
168	V	36.2	Very low	36.2	Very low	65 Å²	65	107.6 Å²	107.6	39%	0.394	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-19.5	-179.7	168	0	0	0	0	113.3	V83 T164 E170 T172	V83-V168 HydrophobicContact CB-CG1 4.47Å; V83-V168 HydrophobicContact CG1-CB 4.33Å; V83-V168 HydrophobicContact CG1-CG1 3.74Å; V83-V168 HydrophobicContact CG2-CG1 3.85Å; T164-V168 HydrophobicContact CG2-CG2 3.69Å; T164-V168 VanDerWaalsContact O-CG2 3.3Å; T164-V168 WeakPolarHBondContact O-CG2 3.02Å; T164-V168 PolarHBondContact O-N 3.43Å; V168-E170 PolarHBondContact O-N 2.79Å; V168-T172 PolarHBondContact O-OG1 2.94Å
169	N	38.9	Very low	36	Very low	50 Å²	50	104 Å²	104	27%	0.267	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	29.1	-164.9	-149.9	-8.4	0	0	0	115	T79 S80 V83 N84 R167	T79-N169 CarbonylContact O-C 3.41Å; S80-N169 WeakPolarHBondContact CA-O 3.47Å; V83-N169 HydrophobicContact CB-CB 4.16Å; V83-N169 VanDerWaalsContact CB-OD1 3.32Å; V83-N169 WeakPolarHBondContact CB-OD1 3.01Å; V83-N169 HydrophobicContact CG1-CB 3.59Å; V83-N169 VanDerWaalsContact CG1-CG 3.45Å; N84-N169 PolarHBondContact OD1-ND2 3.3Å; R167-N169 PolarHBondContact O-N 3.24Å
170	E	34.1	Very low	35.7	Very low	150 Å²	150	99 Å²	99	70%	0.701	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-152	-30.5	-177.2	-151.3	169.1	-136.6	0	0	116.5	T79 V168	T79-E170 PolarHBondContact O-N 3.37Å; V168-E170 PolarHBondContact O-N 2.79Å
171	S	37	Very low	35.5	Very low	97 Å²	97	98 Å²	98	68%	0.678	52%	0.52	S	S	*	.	S	Bend	trans	-104.1	-9.3	-179.9	-51.7	0	0	0	0	114.5	S173	S171-S173 PolarHBondContact O-N 2.87Å
172	T	35.6	Very low	35.3	Very low	70 Å²	70	99.4 Å²	99.4	43%	0.429	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	23.6	-173.8	-43.5	0	0	0	0	112.6	T79 V168	T79-T172 VanDerWaalsContact CB-C 3.48Å; T79-T172 WeakPolarHBondContact CB-O 3.47Å; T79-T172 HydrophobicContact CG2-CG2 4.05Å; T79-T172 VanDerWaalsContact CG2-O 3.32Å; T79-T172 WeakPolarHBondContact CG2-O 3.34Å; T79-T172 PolarHBondContact OG1-O 3.25Å; V168-T172 PolarHBondContact O-OG1 2.94Å
173	S	34.9	Very low	35	Very low	3 Å²	3	101.3 Å²	101.3	2%	0.021	52%	0.523	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	-71.7	-173.8	-148.2	0	0	0	0	109.9	V75 T79 S171 R175	V75-S173 WeakPolarHBondContact CB-O 3.08Å; V75-S173 WeakPolarHBondContact CG1-O 3.23Å; V75-S173 CarbonylContact O-C 3.2Å; V75-S173 WeakPolarHBondContact O-CB 3.06Å; V75-S173 PolarHBondContact O-OG 3.34Å; T79-S173 PolarHBondContact N-OG 2.82Å; T79-S173 WeakPolarHBondContact OG1-CA 3.19Å; T79-S173 WeakPolarHBondContact OG1-CB 3.14Å; T79-S173 PolarHBondContact OG1-OG 3.15Å; S171-S173 PolarHBondContact O-N 2.87Å; S173-R175 PolarHBondContact O-N 3.38Å
174	Q	33.9	Very low	34.8	Very low	100 Å²	100	101.1 Å²	101.1	47%	0.467	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-44.5	-165.1	-63.1	-175.6	-57.7	0	0	116.1	V75 N76	V75-Q174 PolarHBondContact O-N 3.42Å; N76-Q174 PolarHBondContact ND2-NE2 3.49Å; N76-Q174 WeakPolarHBondContact OD1-CG 3.43Å; N76-Q174 PolarHBondContact OD1-NE2 3.37Å; N76-Q174 VanDerWaalsContact OD1-NE2 3.15Å
175	R	34.7	Very low	34.8	Very low	172 Å²	172	103.2 Å²	103.2	65%	0.649	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-9	-160.5	-54.7	-150	76.7	172.6	6.4	116.9	S173 N177 E178	S173-R175 PolarHBondContact O-N 3.38Å; R175-N177 PolarHBondContact O-N 2.68Å; R175-E178 IonicContact CZ-OE2 3.34Å; R175-E178 IonicContact NE-OE2 3.17Å; R175-E178 PolarHBondContact NE-OE2 3.28Å; R175-E178 IonicContact NH2-OE1 2.73Å; R175-E178 IonicContact NH2-OE2 2.81Å; R175-E178 PolarHBondContact NH2-OE2 3.4Å
176	V	35	Very low	34.4	Very low	93 Å²	93	105.8 Å²	105.8	56%	0.564	53%	0.528	S	S	*	.	H	α-helix	trans	-60.5	-27.7	170.3	178.3	0	0	0	0	110.9	T180	V176-T180 PolarHBondContact O-OG1 2.97Å
177	N	33	Very low	34.3	Very low	54 Å²	54	101.2 Å²	101.2	29%	0.289	52%	0.516	S	S	.	.	H	α-helix	trans	-87.2	-24	-169.3	-133.8	24.7	0	0	0	113.6	T71 V75 R175 S181	T71-N177 HydrophobicContact CG2-CB 3.6Å; T71-N177 VanDerWaalsContact CG2-CG 3.46Å; T71-N177 VanDerWaalsContact CG2-ND2 3.28Å; T71-N177 WeakPolarHBondContact CG2-ND2 3.35Å; T71-N177 WeakPolarHBondContact CG2-O 3.29Å; T71-N177 PolarHBondContact O-ND2 3.31Å; V75-N177 HydrophobicContact CG2-CB 4.13Å; V75-N177 WeakPolarHBondContact CG2-ND2 3.23Å; R175-N177 PolarHBondContact O-N 2.68Å; N177-S181 PolarHBondContact O-OG 3.05Å
178	E	34.6	Very low	34.3	Very low	99 Å²	99	95.3 Å²	95.3	46%	0.463	50%	0.502	S	S	.	.	H	α-helix	trans	-75.1	-48.7	171.6	-66.8	-179.1	112	0	0	111.9	R175 T180 S181	R175-E178 IonicContact CZ-OE2 3.34Å; R175-E178 IonicContact NE-OE2 3.17Å; R175-E178 PolarHBondContact NE-OE2 3.28Å; R175-E178 IonicContact NH2-OE1 2.73Å; R175-E178 IonicContact NH2-OE2 2.81Å; R175-E178 PolarHBondContact NH2-OE2 3.4Å; E178-T180 VanDerWaalsContact C-N 3.32Å; E178-T180 PolarHBondContact O-N 3.26Å; E178-S181 PolarHBondContact O-N 3.46Å
179	S	34.4	Very low	34.2	Very low	84 Å²	84	94.9 Å²	94.9	59%	0.587	50%	0.502	S	S	*	.	H	α-helix	trans	-68.8	-28.8	-167.3	-57.6	0	0	0	0	113.7
180	T	32.8	Very low	33.9	Very low	84 Å²	84	99.6 Å²	99.6	52%	0.515	52%	0.523	S	S	.	.	H	α-helix	trans	-76.3	-36.8	-178.6	-51.4	0	0	0	0	111.7	V176 E178 Q182	V176-T180 PolarHBondContact O-OG1 2.97Å; E178-T180 VanDerWaalsContact C-N 3.32Å; E178-T180 PolarHBondContact O-N 3.26Å; T180-Q182 PolarHBondContact O-N 3.4Å
181	S	32.4	Very low	33.8	Very low	46 Å²	46	101.9 Å²	101.9	32%	0.322	53%	0.525	S	S	.	.	H	α-helix	trans	-69	-29.9	-173.4	-61	0	0	0	0	114.2	N177 E178 N185	N177-S181 PolarHBondContact O-OG 3.05Å; E178-S181 PolarHBondContact O-N 3.46Å; S181-N185 PolarHBondContact O-ND2 3.27Å
182	Q	33.9	Very low	33.8	Very low	147 Å²	147	100.4 Å²	100.4	69%	0.687	51%	0.512	S	S	*	.	H	α-helix	trans	-81.1	-46.3	-177.8	-70.3	-175.8	-18.7	0	0	113.1	T180 V184 N185	T180-Q182 PolarHBondContact O-N 3.4Å; Q182-V184 PolarHBondContact O-N 3.06Å; Q182-N185 PolarHBondContact O-N 2.71Å
183	R	31.1	Very low	33.8	Very low	202 Å²	202	101.9 Å²	101.9	76%	0.762	52%	0.517	S	S	*	.	H	α-helix	trans	-75.1	-23.7	-172.1	-62	-167.7	70.8	161.7	2.4	114.5	S187	R183-S187 PolarHBondContact O-OG 3.19Å
184	V	33.1	Very low	33.8	Very low	82 Å²	82	108.7 Å²	108.7	50%	0.497	55%	0.548	S	S	.	.	H	α-helix	trans	-70.9	-42.3	169.9	177.9	0	0	0	0	110.2	Q182 E186 T188	Q182-V184 PolarHBondContact O-N 3.06Å; V184-E186 PolarHBondContact O-N 3.03Å; V184-T188 VanDerWaalsContact O-CB 3.24Å; V184-T188 WeakPolarHBondContact O-CB 3.5Å; V184-T188 PolarHBondContact O-N 3.37Å; V184-T188 PolarHBondContact O-OG1 3.35Å; V184-T188 VanDerWaalsContact O-OG1 3.13Å
185	N	32.8	Very low	33.8	Very low	93 Å²	93	107.1 Å²	107.1	50%	0.497	55%	0.548	S	S	.	.	H	α-helix	trans	-58.7	-50.8	-174.5	-88.2	-14	0	0	0	113.4	S181 Q182 S189	S181-N185 PolarHBondContact O-ND2 3.27Å; Q182-N185 PolarHBondContact O-N 2.71Å; N185-S189 WeakPolarHBondContact O-CB 3.3Å; N185-S189 PolarHBondContact O-N 2.69Å; N185-S189 PolarHBondContact O-OG 2.94Å
186	E	33.6	Very low	34	Very low	153 Å²	153	101.9 Å²	101.9	72%	0.715	54%	0.536	S	S	*	.	H	α-helix	trans	-67.7	-47.5	-178.3	-65.5	-176.6	122.6	0	0	112.5	V184 T188 S189 Q190	V184-E186 PolarHBondContact O-N 3.03Å; E186-T188 VanDerWaalsContact C-N 3.33Å; E186-T188 PolarHBondContact O-N 3.22Å; E186-S189 PolarHBondContact O-N 3.38Å; E186-Q190 PolarHBondContact O-N 3.46Å; E186-Q190 VanDerWaalsContact O-N 3.15Å
187	S	33.3	Very low	34	Very low	85 Å²	85	100.5 Å²	100.5	59%	0.594	53%	0.53	S	S	*	.	H	α-helix	trans	-60.8	-41.1	-177.9	-49.7	0	0	0	0	112.2	R183	R183-S187 PolarHBondContact O-OG 3.19Å
188	T	34.4	Very low	34.2	Very low	72 Å²	72	104.7 Å²	104.7	44%	0.442	55%	0.548	S	S	.	.	H	α-helix	trans	-73.5	-44.2	174.1	-62.9	0	0	0	0	110.6	V184 E186 Q190 R191 V192	V184-T188 VanDerWaalsContact O-CB 3.24Å; V184-T188 WeakPolarHBondContact O-CB 3.5Å; V184-T188 PolarHBondContact O-N 3.37Å; V184-T188 PolarHBondContact O-OG1 3.35Å; V184-T188 VanDerWaalsContact O-OG1 3.13Å; E186-T188 VanDerWaalsContact C-N 3.33Å; E186-T188 PolarHBondContact O-N 3.22Å; T188-Q190 PolarHBondContact O-N 2.93Å; T188-R191 PolarHBondContact O-N 3.49Å; T188-V192 HydrophobicContact CG2-CB 4.41Å; T188-V192 HydrophobicContact CG2-CG2 3.55Å; T188-V192 WeakPolarHBondContact O-CB 3.22Å; T188-V192 VanDerWaalsContact O-CG2 3.23Å; T188-V192 WeakPolarHBondContact O-CG2 3.45Å; T188-V192 PolarHBondContact O-N 3.33Å
189	S	34	Very low	34.2	Very low	56 Å²	56	108.7 Å²	108.7	39%	0.392	56%	0.559	S	S	.	*	H	α-helix	trans	-59.8	-37.6	-175	-66.2	0	0	0	0	113.9	N185 E186 N193	N185-S189 WeakPolarHBondContact O-CB 3.3Å; N185-S189 PolarHBondContact O-N 2.69Å; N185-S189 PolarHBondContact O-OG 2.94Å; E186-S189 PolarHBondContact O-N 3.38Å; S189-N193 WeakPolarHBondContact O-CA 3.38Å; S189-N193 WeakPolarHBondContact O-CB 3.29Å; S189-N193 PolarHBondContact O-N 3.31Å
190	Q	33.6	Very low	34.4	Very low	150 Å²	150	108 Å²	108	70%	0.701	55%	0.551	S	S	*	*	H	α-helix	trans	-70.4	-51.7	178.8	-72.5	-171.2	-11.9	0	0	112.7	E186 T188 V192 N193 E194	E186-Q190 PolarHBondContact O-N 3.46Å; E186-Q190 VanDerWaalsContact O-N 3.15Å; T188-Q190 PolarHBondContact O-N 2.93Å; Q190-V192 VanDerWaalsContact C-N 3.32Å; Q190-V192 PolarHBondContact O-N 3.1Å; Q190-N193 PolarHBondContact O-N 2.81Å; Q190-E194 PolarHBondContact O-N 2.91Å
191	R	32.7	Very low	34.6	Very low	197 Å²	197	108.3 Å²	108.3	74%	0.743	55%	0.549	S	S	*	.	H	α-helix	trans	-69.8	-30	-179.9	-63.6	-167.6	72.8	163.3	3	112.7	T188 S195	T188-R191 PolarHBondContact O-N 3.49Å; R191-S195 VanDerWaalsContact O-CB 3.27Å; R191-S195 WeakPolarHBondContact O-CB 3.28Å; R191-S195 PolarHBondContact O-N 2.66Å; R191-S195 PolarHBondContact O-OG 2.73Å
192	V	36.4	Very low	34.9	Very low	67 Å²	67	112 Å²	112	41%	0.406	56%	0.561	S	S	.	*	H	α-helix	trans	-72.3	-39.4	170.3	174.3	0	0	0	0	110.6	T188 Q190 S195 T196	T188-V192 HydrophobicContact CG2-CB 4.41Å; T188-V192 HydrophobicContact CG2-CG2 3.55Å; T188-V192 WeakPolarHBondContact O-CB 3.22Å; T188-V192 VanDerWaalsContact O-CG2 3.23Å; T188-V192 WeakPolarHBondContact O-CG2 3.45Å; T188-V192 PolarHBondContact O-N 3.33Å; Q190-V192 VanDerWaalsContact C-N 3.32Å; Q190-V192 PolarHBondContact O-N 3.1Å; V192-S195 PolarHBondContact O-N 2.71Å; V192-T196 WeakPolarHBondContact CG1-OG1 3.37Å; V192-T196 WeakPolarHBondContact O-CA 3.37Å; V192-T196 WeakPolarHBondContact O-CB 3.22Å; V192-T196 PolarHBondContact O-N 2.69Å; V192-T196 PolarHBondContact O-OG1 3.1Å
193	N	35	Very low	35.1	Very low	100 Å²	100	108 Å²	108	54%	0.535	55%	0.55	S	S	.	.	H	α-helix	trans	-62.8	-46.2	176.2	-83.6	-8.7	0	0	0	112.4	S189 Q190 S197	S189-N193 WeakPolarHBondContact O-CA 3.38Å; S189-N193 WeakPolarHBondContact O-CB 3.29Å; S189-N193 PolarHBondContact O-N 3.31Å; Q190-N193 PolarHBondContact O-N 2.81Å; N193-S197 WeakPolarHBondContact O-CA 3.19Å; N193-S197 WeakPolarHBondContact O-CB 3.21Å; N193-S197 PolarHBondContact O-N 3.47Å; N193-S197 PolarHBondContact O-OG 3.03Å
194	E	34.4	Very low	35.6	Very low	146 Å²	146	101.7 Å²	101.7	68%	0.682	53%	0.534	S	S	*	.	H	α-helix	trans	-64	-49.3	176.6	-69.5	-173.7	128.3	0	0	111.8	Q190 T196 Q198	Q190-E194 PolarHBondContact O-N 2.91Å; E194-T196 VanDerWaalsContact C-N 3.3Å; E194-T196 PolarHBondContact O-N 3.33Å; E194-Q198 PolarHBondContact O-N 3.02Å; E194-Q198 VanDerWaalsContact O-N 3.07Å
195	S	35.5	Very low	35.9	Very low	67 Å²	67	101 Å²	101	47%	0.469	53%	0.533	S	S	.	.	H	α-helix	trans	-64.4	-33.2	-178.7	-52.4	0	0	0	0	113.1	R191 V192 R199	R191-S195 VanDerWaalsContact O-CB 3.27Å; R191-S195 WeakPolarHBondContact O-CB 3.28Å; R191-S195 PolarHBondContact O-N 2.66Å; R191-S195 PolarHBondContact O-OG 2.73Å; V192-S195 PolarHBondContact O-N 2.71Å; S195-R199 WeakPolarHBondContact O-CB 3.32Å; S195-R199 VanDerWaalsContact O-CG 3.28Å; S195-R199 WeakPolarHBondContact O-CG 3.48Å; S195-R199 PolarHBondContact O-N 2.66Å
196	T	37.2	Very low	36.2	Very low	63 Å²	63	102.7 Å²	102.7	39%	0.387	54%	0.538	S	S	.	.	H	α-helix	trans	-89	-39.3	-177.8	-53.5	0	0	0	0	110.6	V192 E194 Q198 R199 V200	V192-T196 WeakPolarHBondContact CG1-OG1 3.37Å; V192-T196 WeakPolarHBondContact O-CA 3.37Å; V192-T196 WeakPolarHBondContact O-CB 3.22Å; V192-T196 PolarHBondContact O-N 2.69Å; V192-T196 PolarHBondContact O-OG1 3.1Å; E194-T196 VanDerWaalsContact C-N 3.3Å; E194-T196 PolarHBondContact O-N 3.33Å; T196-Q198 VanDerWaalsContact C-N 3.33Å; T196-Q198 PolarHBondContact O-N 3.35Å; T196-R199 PolarHBondContact O-N 2.92Å; T196-V200 HydrophobicContact CG2-CG2 3.55Å; T196-V200 WeakPolarHBondContact O-CA 3.19Å; T196-V200 WeakPolarHBondContact O-CB 3.43Å; T196-V200 VanDerWaalsContact O-CG2 3.23Å; T196-V200 WeakPolarHBondContact O-CG2 3.24Å; T196-V200 PolarHBondContact O-N 3Å
197	S	36.5	Very low	36.4	Very low	64 Å²	64	104 Å²	104	45%	0.448	54%	0.536	S	S	.	.	H	α-helix	trans	-62.4	-39.3	174	-67.9	0	0	0	0	111.6	N193 N201	N193-S197 WeakPolarHBondContact O-CA 3.19Å; N193-S197 WeakPolarHBondContact O-CB 3.21Å; N193-S197 PolarHBondContact O-N 3.47Å; N193-S197 PolarHBondContact O-OG 3.03Å; S197-N201 WeakPolarHBondContact O-CB 3.22Å; S197-N201 VanDerWaalsContact O-CG 3.23Å; S197-N201 PolarHBondContact O-N 3.2Å
198	Q	35.8	Very low	36.9	Very low	141 Å²	141	102.9 Å²	102.9	66%	0.659	53%	0.526	S	S	*	.	H	α-helix	trans	-64.1	-57.2	171.8	-72.3	-175.1	-11	0	0	111.3	E194 T196 V200 N201 E202	E194-Q198 PolarHBondContact O-N 3.02Å; E194-Q198 VanDerWaalsContact O-N 3.07Å; T196-Q198 VanDerWaalsContact C-N 3.33Å; T196-Q198 PolarHBondContact O-N 3.35Å; Q198-V200 VanDerWaalsContact C-N 3.34Å; Q198-V200 PolarHBondContact O-N 3.08Å; Q198-N201 PolarHBondContact O-N 2.67Å; Q198-E202 PolarHBondContact O-N 3.01Å
199	R	35.2	Very low	37.2	Very low	183 Å²	183	102.1 Å²	102.1	69%	0.691	52%	0.519	S	S	*	.	H	α-helix	trans	-66.3	-30.8	-175.8	-67.9	-174.2	72.2	167.7	3.7	114.1	S195 T196 S203	S195-R199 WeakPolarHBondContact O-CB 3.32Å; S195-R199 VanDerWaalsContact O-CG 3.28Å; S195-R199 WeakPolarHBondContact O-CG 3.48Å; S195-R199 PolarHBondContact O-N 2.66Å; T196-R199 PolarHBondContact O-N 2.92Å; R199-S203 WeakPolarHBondContact O-CB 3.27Å; R199-S203 PolarHBondContact O-N 3.1Å; R199-S203 PolarHBondContact O-OG 3.39Å
200	V	39.5	Very low	37.5	Very low	71 Å²	71	105.2 Å²	105.2	43%	0.43	53%	0.527	S	S	.	.	H	α-helix	trans	-79.7	-36.1	175.5	174.3	0	0	0	0	110.9	T196 Q198 T204	T196-V200 HydrophobicContact CG2-CG2 3.55Å; T196-V200 WeakPolarHBondContact O-CA 3.19Å; T196-V200 WeakPolarHBondContact O-CB 3.43Å; T196-V200 VanDerWaalsContact O-CG2 3.23Å; T196-V200 WeakPolarHBondContact O-CG2 3.24Å; T196-V200 PolarHBondContact O-N 3Å; Q198-V200 VanDerWaalsContact C-N 3.34Å; Q198-V200 PolarHBondContact O-N 3.08Å; V200-T204 WeakPolarHBondContact CG1-OG1 3.34Å; V200-T204 WeakPolarHBondContact O-CA 3.22Å; V200-T204 WeakPolarHBondContact O-CB 3.28Å; V200-T204 PolarHBondContact O-N 2.89Å; V200-T204 PolarHBondContact O-OG1 3.18Å
201	N	36.8	Very low	37.8	Very low	90 Å²	90	101.1 Å²	101.1	48%	0.481	52%	0.515	S	S	.	.	H	α-helix	trans	-64.3	-43.3	171.3	-80.7	-8.9	0	0	0	111	S197 Q198 S205	S197-N201 WeakPolarHBondContact O-CB 3.22Å; S197-N201 VanDerWaalsContact O-CG 3.23Å; S197-N201 PolarHBondContact O-N 3.2Å; Q198-N201 PolarHBondContact O-N 2.67Å; N201-S205 WeakPolarHBondContact O-CB 3.34Å; N201-S205 PolarHBondContact O-N 2.93Å; N201-S205 PolarHBondContact O-OG 3.37Å
202	E	38	Very low	38.4	Very low	122 Å²	122	94.3 Å²	94.3	57%	0.57	50%	0.495	S	S	*	.	H	α-helix	trans	-62.4	-54.3	173.9	-70.9	-174.8	126.7	0	0	111.6	Q198 T204 S205 Q206	Q198-E202 PolarHBondContact O-N 3.01Å; E202-T204 VanDerWaalsContact C-N 3.31Å; E202-T204 PolarHBondContact O-N 3.34Å; E202-S205 PolarHBondContact O-N 2.91Å; E202-Q206 WeakPolarHBondContact O-CB 3.27Å; E202-Q206 WeakPolarHBondContact O-CG 3.35Å; E202-Q206 PolarHBondContact O-N 2.67Å
203	S	39.1	Very low	38.6	Very low	64 Å²	64	93.6 Å²	93.6	45%	0.448	49%	0.493	S	S	.	.	H	α-helix	trans	-61.9	-37.5	-177.4	-57.7	0	0	0	0	112.8	R199 R207	R199-S203 WeakPolarHBondContact O-CB 3.27Å; R199-S203 PolarHBondContact O-N 3.1Å; R199-S203 PolarHBondContact O-OG 3.39Å; S203-R207 WeakPolarHBondContact O-CB 3.46Å; S203-R207 VanDerWaalsContact O-CG 3.3Å; S203-R207 WeakPolarHBondContact O-CG 3.4Å; S203-R207 PolarHBondContact O-N 2.7Å; S203-R207 VanDerWaalsContact O-N 3.15Å
204	T	40.4	Very low	39	Very low	69 Å²	69	94.7 Å²	94.7	42%	0.423	50%	0.495	S	S	.	.	H	α-helix	trans	-78.9	-42.2	-179.4	-50.8	0	0	0	0	110.7	V200 E202 Q206 R207 V208	V200-T204 WeakPolarHBondContact CG1-OG1 3.34Å; V200-T204 WeakPolarHBondContact O-CA 3.22Å; V200-T204 WeakPolarHBondContact O-CB 3.28Å; V200-T204 PolarHBondContact O-N 2.89Å; V200-T204 PolarHBondContact O-OG1 3.18Å; E202-T204 VanDerWaalsContact C-N 3.31Å; E202-T204 PolarHBondContact O-N 3.34Å; T204-Q206 PolarHBondContact O-N 3.46Å; T204-R207 PolarHBondContact O-N 3.49Å; T204-V208 HydrophobicContact CG2-CG2 3.96Å; T204-V208 VanDerWaalsContact O-CB 3.23Å; T204-V208 WeakPolarHBondContact O-CB 3.38Å; T204-V208 WeakPolarHBondContact O-CG2 3.19Å; T204-V208 PolarHBondContact O-N 2.75Å
205	S	39.2	Very low	39.3	Very low	69 Å²	69	96.5 Å²	96.5	48%	0.483	50%	0.496	S	S	.	.	H	α-helix	trans	-64.2	-41.4	177.4	-56.1	0	0	0	0	111.5	N201 E202 N209	N201-S205 WeakPolarHBondContact O-CB 3.34Å; N201-S205 PolarHBondContact O-N 2.93Å; N201-S205 PolarHBondContact O-OG 3.37Å; E202-S205 PolarHBondContact O-N 2.91Å; S205-N209 VanDerWaalsContact O-CB 3.29Å; S205-N209 WeakPolarHBondContact O-CB 3.48Å; S205-N209 PolarHBondContact O-N 2.98Å
206	Q	40.3	Very low	39.8	Very low	127 Å²	127	95.6 Å²	95.6	59%	0.593	49%	0.488	S	S	*	.	H	α-helix	trans	-60.7	-56	173.3	-73.7	178	-3.6	0	0	111.1	E202 T204 V208 N209 E210	E202-Q206 WeakPolarHBondContact O-CB 3.27Å; E202-Q206 WeakPolarHBondContact O-CG 3.35Å; E202-Q206 PolarHBondContact O-N 2.67Å; T204-Q206 PolarHBondContact O-N 3.46Å; Q206-V208 VanDerWaalsContact C-N 3.34Å; Q206-V208 PolarHBondContact O-N 3.2Å; Q206-N209 PolarHBondContact O-N 2.95Å; Q206-E210 WeakPolarHBondContact O-CG 3.26Å; Q206-E210 PolarHBondContact O-N 3.24Å
207	R	37.6	Very low	40	Very low	182 Å²	182	95.4 Å²	95.4	69%	0.687	48%	0.484	S	S	*	.	H	α-helix	trans	-65	-33.6	-177.3	-71	-174.1	69.8	171.9	2.6	113.7	S203 T204 S211	S203-R207 WeakPolarHBondContact O-CB 3.46Å; S203-R207 VanDerWaalsContact O-CG 3.3Å; S203-R207 WeakPolarHBondContact O-CG 3.4Å; S203-R207 PolarHBondContact O-N 2.7Å; S203-R207 VanDerWaalsContact O-N 3.15Å; T204-R207 PolarHBondContact O-N 3.49Å; R207-S211 VanDerWaalsContact O-CB 3.22Å; R207-S211 WeakPolarHBondContact O-CB 3.34Å; R207-S211 PolarHBondContact O-N 3.29Å; R207-S211 PolarHBondContact O-OG 3.44Å
208	V	43.9	Very low	40.5	Very low	61 Å²	61	98.2 Å²	98.2	37%	0.37	49%	0.49	S	S	.	.	H	α-helix	trans	-72.3	-42.3	175.7	171.3	0	0	0	0	110.7	T204 Q206 T212	T204-V208 HydrophobicContact CG2-CG2 3.96Å; T204-V208 VanDerWaalsContact O-CB 3.23Å; T204-V208 WeakPolarHBondContact O-CB 3.38Å; T204-V208 WeakPolarHBondContact O-CG2 3.19Å; T204-V208 PolarHBondContact O-N 2.75Å; Q206-V208 VanDerWaalsContact C-N 3.34Å; Q206-V208 PolarHBondContact O-N 3.2Å; V208-T212 WeakPolarHBondContact O-CB 3.25Å; V208-T212 PolarHBondContact O-N 3.27Å; V208-T212 PolarHBondContact O-OG1 2.69Å
209	N	40	Very low	41	Very low	56 Å²	56	94.6 Å²	94.6	30%	0.299	48%	0.481	S	S	.	.	H	α-helix	trans	-65	-46.1	174.9	-85.6	-5.2	0	0	0	111.6	N36 S205 Q206 S211 T212 S213	N36-N209 PolarHBondContact OD1-ND2 2.97Å; N36-N209 VanDerWaalsContact OD1-ND2 3.15Å; S205-N209 VanDerWaalsContact O-CB 3.29Å; S205-N209 WeakPolarHBondContact O-CB 3.48Å; S205-N209 PolarHBondContact O-N 2.98Å; Q206-N209 PolarHBondContact O-N 2.95Å; N209-S211 PolarHBondContact O-N 3.31Å; N209-T212 PolarHBondContact O-N 3.41Å; N209-S213 WeakPolarHBondContact O-CB 3.35Å; N209-S213 PolarHBondContact O-N 3.02Å; N209-S213 PolarHBondContact O-OG 3.22Å; N209-S213 VanDerWaalsContact O-OG 3.1Å
210	E	40.2	Very low	41.7	Very low	120 Å²	120	88 Å²	88	56%	0.561	46%	0.461	S	S	*	.	H	α-helix	trans	-56.9	-51.9	174.4	-73.3	-173.2	129.1	0	0	112	Q206 T212 S213 Q214	Q206-E210 WeakPolarHBondContact O-CG 3.26Å; Q206-E210 PolarHBondContact O-N 3.24Å; E210-T212 VanDerWaalsContact C-N 3.29Å; E210-T212 PolarHBondContact O-N 3.37Å; E210-S213 PolarHBondContact O-N 3Å; E210-Q214 WeakPolarHBondContact O-CB 3.34Å; E210-Q214 VanDerWaalsContact O-CG 3.28Å; E210-Q214 WeakPolarHBondContact O-CG 3.49Å; E210-Q214 PolarHBondContact O-N 3.22Å
211	S	41	Very low	42.1	Very low	65 Å²	65	87.3 Å²	87.3	46%	0.455	46%	0.459	S	S	.	.	H	α-helix	trans	-63.1	-34.6	-178.2	-56.8	0	0	0	0	112.7	R207 N209 R215	R207-S211 VanDerWaalsContact O-CB 3.22Å; R207-S211 WeakPolarHBondContact O-CB 3.34Å; R207-S211 PolarHBondContact O-N 3.29Å; R207-S211 PolarHBondContact O-OG 3.44Å; N209-S211 PolarHBondContact O-N 3.31Å; S211-R215 WeakPolarHBondContact O-CG 3.44Å; S211-R215 PolarHBondContact O-N 3.38Å
212	T	44.2	Very low	42.9	Very low	53 Å²	53	89 Å²	89	33%	0.325	46%	0.464	S	S	.	.	H	α-helix	trans	-79.7	-47	-179.3	-53.8	0	0	0	0	110.8	V208 N209 E210 Q214 R215 V216	V208-T212 WeakPolarHBondContact O-CB 3.25Å; V208-T212 PolarHBondContact O-N 3.27Å; V208-T212 PolarHBondContact O-OG1 2.69Å; N209-T212 PolarHBondContact O-N 3.41Å; E210-T212 VanDerWaalsContact C-N 3.29Å; E210-T212 PolarHBondContact O-N 3.37Å; T212-Q214 PolarHBondContact O-N 3.03Å; T212-R215 PolarHBondContact O-N 2.99Å; T212-V216 HydrophobicContact CG2-CG2 4.24Å; T212-V216 WeakPolarHBondContact O-CB 3.33Å; T212-V216 VanDerWaalsContact O-CG2 3.27Å; T212-V216 WeakPolarHBondContact O-CG2 3.3Å; T212-V216 PolarHBondContact O-N 2.9Å
213	S	40.8	Very low	43.6	Very low	52 Å²	52	91.9 Å²	91.9	36%	0.364	47%	0.469	S	S	.	.	H	α-helix	trans	-61	-42	177	-67.7	0	0	0	0	112	N209 E210 N217	N209-S213 WeakPolarHBondContact O-CB 3.35Å; N209-S213 PolarHBondContact O-N 3.02Å; N209-S213 PolarHBondContact O-OG 3.22Å; N209-S213 VanDerWaalsContact O-OG 3.1Å; E210-S213 PolarHBondContact O-N 3Å; S213-N217 WeakPolarHBondContact O-CB 3.39Å; S213-N217 PolarHBondContact O-N 3.33Å; S213-N217 PolarHBondContact O-OD1 3.33Å
214	Q	42.7	Very low	44.4	Very low	123 Å²	123	90.5 Å²	90.5	58%	0.575	46%	0.458	S	S	*	.	H	α-helix	trans	-60	-55.4	174.9	-74.6	176.4	1.8	0	0	111.3	E210 T212 V216 N217 E218	E210-Q214 WeakPolarHBondContact O-CB 3.34Å; E210-Q214 VanDerWaalsContact O-CG 3.28Å; E210-Q214 WeakPolarHBondContact O-CG 3.49Å; E210-Q214 PolarHBondContact O-N 3.22Å; T212-Q214 PolarHBondContact O-N 3.03Å; Q214-V216 VanDerWaalsContact C-N 3.34Å; Q214-V216 PolarHBondContact O-N 2.69Å; Q214-N217 PolarHBondContact O-N 3.11Å; Q214-E218 WeakPolarHBondContact O-CG 3.32Å; Q214-E218 PolarHBondContact O-N 3.43Å
215	R	40.8	Very low	45.1	Very low	184 Å²	184	90.9 Å²	90.9	69%	0.694	46%	0.458	S	S	*	.	H	α-helix	trans	-63.4	-36.3	-177.3	-71.6	-174.1	67.9	-179.1	0.8	113.5	S211 T212 S219	S211-R215 WeakPolarHBondContact O-CG 3.44Å; S211-R215 PolarHBondContact O-N 3.38Å; T212-R215 PolarHBondContact O-N 2.99Å; R215-S219 VanDerWaalsContact O-CB 3.26Å; R215-S219 WeakPolarHBondContact O-CB 3.3Å; R215-S219 PolarHBondContact O-N 3.04Å; R215-S219 VanDerWaalsContact O-N 3.1Å; R215-S219 PolarHBondContact O-OG 2.73Å
216	V	46.6	Very low	46.1	Very low	49 Å²	49	93.2 Å²	93.2	30%	0.297	46%	0.461	S	S	.	.	H	α-helix	trans	-69.8	-41.3	175.8	171.1	0	0	0	0	110.8	T31 T212 Q214 T220	T31-V216 HydrophobicContact CG2-CG1 4.28Å; T212-V216 HydrophobicContact CG2-CG2 4.24Å; T212-V216 WeakPolarHBondContact O-CB 3.33Å; T212-V216 VanDerWaalsContact O-CG2 3.27Å; T212-V216 WeakPolarHBondContact O-CG2 3.3Å; T212-V216 PolarHBondContact O-N 2.9Å; Q214-V216 VanDerWaalsContact C-N 3.34Å; Q214-V216 PolarHBondContact O-N 2.69Å; V216-T220 VanDerWaalsContact O-CB 3.27Å; V216-T220 WeakPolarHBondContact O-CB 3.38Å; V216-T220 PolarHBondContact O-N 3.4Å; V216-T220 PolarHBondContact O-OG1 3.46Å
217	N	42.2	Very low	47.1	Very low	59 Å²	59	90.3 Å²	90.3	32%	0.316	46%	0.455	S	S	.	.	H	α-helix	trans	-68.5	-41.7	179.7	-72.3	6.3	0	0	0	111.9	N28 S213 Q214 S221	N28-N217 PolarHBondContact OD1-ND2 3.45Å; N28-N217 PolarHBondContact OD1-OD1 3.41Å; S213-N217 WeakPolarHBondContact O-CB 3.39Å; S213-N217 PolarHBondContact O-N 3.33Å; S213-N217 PolarHBondContact O-OD1 3.33Å; Q214-N217 PolarHBondContact O-N 3.11Å; N217-S221 WeakPolarHBondContact O-CB 3.35Å; N217-S221 PolarHBondContact O-N 2.98Å; N217-S221 PolarHBondContact O-OG 3.3Å
218	E	45.9	Very low	48.5	Very low	122 Å²	122	83.2 Å²	83.2	57%	0.57	43%	0.432	S	S	*	.	H	α-helix	trans	-60.3	-53.5	172.8	-71.5	-177.7	140.1	0	0	111.4	Q214 T220 S221 Q222	Q214-E218 WeakPolarHBondContact O-CG 3.32Å; Q214-E218 PolarHBondContact O-N 3.43Å; E218-T220 VanDerWaalsContact C-N 3.26Å; E218-T220 PolarHBondContact O-N 2.88Å; E218-S221 PolarHBondContact O-N 2.97Å; E218-Q222 WeakPolarHBondContact O-CG 3.33Å; E218-Q222 PolarHBondContact O-N 2.9Å
219	S	46.1	Very low	49.5	Very low	66 Å²	66	83.4 Å²	83.4	46%	0.462	44%	0.436	S	S	.	.	H	α-helix	trans	-60.5	-35.2	-177.8	-57	0	0	0	0	112.6	R215 R223	R215-S219 VanDerWaalsContact O-CB 3.26Å; R215-S219 WeakPolarHBondContact O-CB 3.3Å; R215-S219 PolarHBondContact O-N 3.04Å; R215-S219 VanDerWaalsContact O-N 3.1Å; R215-S219 PolarHBondContact O-OG 2.73Å; S219-R223 WeakPolarHBondContact O-CG 3.3Å
220	T	49.5	Very low	50.8	Low	45 Å²	45	86.8 Å²	86.8	28%	0.276	45%	0.45	S	S	.	.	H	α-helix	trans	-76.1	-46.4	177.5	-54.7	0	0	0	0	111	V27 V216 E218 Q222 R223 V224	V27-T220 HydrophobicContact CG1-CG2 4.26Å; V216-T220 VanDerWaalsContact O-CB 3.27Å; V216-T220 WeakPolarHBondContact O-CB 3.38Å; V216-T220 PolarHBondContact O-N 3.4Å; V216-T220 PolarHBondContact O-OG1 3.46Å; E218-T220 VanDerWaalsContact C-N 3.26Å; E218-T220 PolarHBondContact O-N 2.88Å; T220-Q222 VanDerWaalsContact C-N 3.34Å; T220-Q222 PolarHBondContact O-N 2.69Å; T220-R223 PolarHBondContact O-N 3.22Å; T220-V224 HydrophobicContact CG2-CG2 4.23Å; T220-V224 WeakPolarHBondContact O-CG2 3.25Å; T220-V224 PolarHBondContact O-N 3.18Å
221	S	49.4	Very low	52.4	Low	56 Å²	56	90.4 Å²	90.4	39%	0.392	46%	0.458	S	S	.	.	H	α-helix	trans	-62	-40.6	-178.1	-58.7	0	0	0	0	112.1	N217 E218 N225	N217-S221 WeakPolarHBondContact O-CB 3.35Å; N217-S221 PolarHBondContact O-N 2.98Å; N217-S221 PolarHBondContact O-OG 3.3Å; E218-S221 PolarHBondContact O-N 2.97Å; S221-N225 WeakPolarHBondContact O-CB 3.48Å; S221-N225 PolarHBondContact O-N 3.03Å
222	Q	52.1	Low	54.1	Low	124 Å²	124	88.8 Å²	88.8	58%	0.579	45%	0.445	S	S	*	.	H	α-helix	trans	-59.6	-55	174.4	-73.1	175.5	-4	0	0	111	E218 T220 V224 N225 E226	E218-Q222 WeakPolarHBondContact O-CG 3.33Å; E218-Q222 PolarHBondContact O-N 2.9Å; T220-Q222 VanDerWaalsContact C-N 3.34Å; T220-Q222 PolarHBondContact O-N 2.69Å; Q222-V224 VanDerWaalsContact C-N 3.32Å; Q222-V224 PolarHBondContact O-N 3.25Å; Q222-N225 PolarHBondContact O-N 3.37Å; Q222-E226 WeakPolarHBondContact O-CG 3.33Å; Q222-E226 PolarHBondContact O-N 3.44Å
223	R	53.1	Low	55.7	Low	183 Å²	183	90.6 Å²	90.6	69%	0.691	45%	0.453	S	S	*	.	H	α-helix	trans	-62.5	-34.8	-178.1	-69.1	-178.1	68.4	-172.2	0.5	113.5	S219 T220 S227	S219-R223 WeakPolarHBondContact O-CG 3.3Å; T220-R223 PolarHBondContact O-N 3.22Å; R223-S227 VanDerWaalsContact O-CB 3.3Å; R223-S227 WeakPolarHBondContact O-CB 3.31Å; R223-S227 PolarHBondContact O-N 3Å; R223-S227 VanDerWaalsContact O-N 3.11Å; R223-S227 PolarHBondContact O-OG 3.41Å
224	V	56.6	Low	57.6	Low	36 Å²	36	93 Å²	93	22%	0.218	46%	0.462	C	S	.	.	H	α-helix	trans	-70.7	-44.1	175.8	172.1	0	0	0	0	111.1	T23 T220 Q222 T228	T23-V224 HydrophobicContact CG2-CG2 4.48Å; T220-V224 HydrophobicContact CG2-CG2 4.23Å; T220-V224 WeakPolarHBondContact O-CG2 3.25Å; T220-V224 PolarHBondContact O-N 3.18Å; Q222-V224 VanDerWaalsContact C-N 3.32Å; Q222-V224 PolarHBondContact O-N 3.25Å; V224-T228 VanDerWaalsContact O-CB 3.3Å; V224-T228 WeakPolarHBondContact O-CB 3.4Å; V224-T228 PolarHBondContact O-N 3.05Å; V224-T228 PolarHBondContact O-OG1 3.04Å
225	N	55	Low	59.6	Low	77 Å²	77	93.6 Å²	93.6	41%	0.412	46%	0.46	S	S	.	.	H	α-helix	trans	-64.2	-42.9	176.6	-83.6	-18.3	0	0	0	112.2	N20 S221 Q222 T228 S229	N20-N225 PolarHBondContact ND2-OD1 2.87Å; S221-N225 WeakPolarHBondContact O-CB 3.48Å; S221-N225 PolarHBondContact O-N 3.03Å; Q222-N225 PolarHBondContact O-N 3.37Å; N225-T228 PolarHBondContact O-N 3.42Å; N225-S229 VanDerWaalsContact O-CB 3.25Å; N225-S229 WeakPolarHBondContact O-CB 3.41Å; N225-S229 PolarHBondContact O-N 3.21Å; N225-S229 PolarHBondContact O-OG 3.37Å
226	E	59.8	Low	61.6	Low	118 Å²	118	87.4 Å²	87.4	55%	0.551	44%	0.44	S	S	*	.	H	α-helix	trans	-60.2	-52.5	175.6	-73.5	176	167.5	0	0	111.5	Q222 T228 S229 Q230	Q222-E226 WeakPolarHBondContact O-CG 3.33Å; Q222-E226 PolarHBondContact O-N 3.44Å; E226-T228 VanDerWaalsContact C-N 3.27Å; E226-T228 PolarHBondContact O-N 2.91Å; E226-S229 PolarHBondContact O-N 3.4Å; E226-Q230 WeakPolarHBondContact O-CG 3.41Å; E226-Q230 PolarHBondContact O-N 3.42Å
227	S	61.9	Low	63.3	Low	66 Å²	66	90.1 Å²	90.1	46%	0.462	45%	0.452	S	S	.	.	H	α-helix	trans	-60.7	-36.3	-179.5	-56.7	0	0	0	0	112.4	R223 R231	R223-S227 VanDerWaalsContact O-CB 3.3Å; R223-S227 WeakPolarHBondContact O-CB 3.31Å; R223-S227 PolarHBondContact O-N 3Å; R223-S227 VanDerWaalsContact O-N 3.11Å; R223-S227 PolarHBondContact O-OG 3.41Å; S227-R231 WeakPolarHBondContact O-CG 3.49Å; S227-R231 PolarHBondContact O-N 3.28Å
228	T	66.6	Low	65.3	Low	33 Å²	33	92.9 Å²	92.9	20%	0.202	46%	0.463	C	S	.	.	H	α-helix	trans	-73.4	-44.3	177.6	-55.9	0	0	0	0	110.9	V224 N225 E226 Q230 R231 V232	V224-T228 VanDerWaalsContact O-CB 3.3Å; V224-T228 WeakPolarHBondContact O-CB 3.4Å; V224-T228 PolarHBondContact O-N 3.05Å; V224-T228 PolarHBondContact O-OG1 3.04Å; N225-T228 PolarHBondContact O-N 3.42Å; E226-T228 VanDerWaalsContact C-N 3.27Å; E226-T228 PolarHBondContact O-N 2.91Å; T228-Q230 PolarHBondContact O-N 2.94Å; T228-R231 PolarHBondContact O-N 3.3Å; T228-V232 HydrophobicContact CG2-CG2 4.48Å; T228-V232 WeakPolarHBondContact O-CB 3.43Å; T228-V232 WeakPolarHBondContact O-CG2 3.4Å; T228-V232 PolarHBondContact O-N 3.48Å
229	S	65.4	Low	67.2	Low	64 Å²	64	90 Å²	90	45%	0.448	45%	0.452	S	S	.	.	H	α-helix	trans	-63	-39.3	179.5	-59	0	0	0	0	112.5	N225 E226 N233	N225-S229 VanDerWaalsContact O-CB 3.25Å; N225-S229 WeakPolarHBondContact O-CB 3.41Å; N225-S229 PolarHBondContact O-N 3.21Å; N225-S229 PolarHBondContact O-OG 3.37Å; E226-S229 PolarHBondContact O-N 3.4Å; S229-N233 WeakPolarHBondContact O-CB 3.3Å; S229-N233 PolarHBondContact O-N 3.25Å; S229-N233 PolarHBondContact O-ND2 3.19Å
230	Q	67.7	Low	69.1	Low	127 Å²	127	93.5 Å²	93.5	59%	0.593	46%	0.458	S	S	*	.	H	α-helix	trans	-60.9	-53.9	174.3	-73	174.4	0.1	0	0	111.1	E226 T228 V232 N233 D234	E226-Q230 WeakPolarHBondContact O-CG 3.41Å; E226-Q230 PolarHBondContact O-N 3.42Å; T228-Q230 PolarHBondContact O-N 2.94Å; Q230-V232 VanDerWaalsContact C-N 3.28Å; Q230-V232 PolarHBondContact O-N 3.05Å; Q230-N233 PolarHBondContact O-N 2.93Å; Q230-D234 PolarHBondContact O-N 3.04Å
231	R	72.2	Confident	70.9	Confident	196 Å²	196	94.5 Å²	94.5	74%	0.74	47%	0.467	S	S	*	.	H	α-helix	trans	-60.1	-35	180	-69.4	176.8	66.1	-165	-0.9	113.5	S227 T228 Y235	S227-R231 WeakPolarHBondContact O-CG 3.49Å; S227-R231 PolarHBondContact O-N 3.28Å; T228-R231 PolarHBondContact O-N 3.3Å; R231-Y235 WeakPolarHBondContact O-CB 3.35Å; R231-Y235 PolarHBondContact O-N 3.04Å
232	V	76.5	Confident	72.6	Confident	31 Å²	31	97.5 Å²	97.5	19%	0.188	48%	0.476	C	S	.	.	H	α-helix	trans	-66.1	-44.8	173.9	163.7	0	0	0	0	111.2	N12 T228 Q230 Y235 I236	N12-V232 WeakPolarHBondContact ND2-CG1 3.03Å; N12-V232 VanDerWaalsContact OD1-CG1 3.31Å; N12-V232 WeakPolarHBondContact OD1-CG1 3.22Å; N12-V232 WeakPolarHBondContact OD1-CG2 3.5Å; T228-V232 HydrophobicContact CG2-CG2 4.48Å; T228-V232 WeakPolarHBondContact O-CB 3.43Å; T228-V232 WeakPolarHBondContact O-CG2 3.4Å; T228-V232 PolarHBondContact O-N 3.48Å; Q230-V232 VanDerWaalsContact C-N 3.28Å; Q230-V232 PolarHBondContact O-N 3.05Å; V232-Y235 PolarHBondContact O-N 2.96Å; V232-I236 HydrophobicContact CG1-CD1 3.88Å; V232-I236 VanDerWaalsContact O-CG1 3.31Å; V232-I236 WeakPolarHBondContact O-CG1 3.31Å; V232-I236 PolarHBondContact O-N 3.34Å
233	N	78	Confident	74.2	Confident	92 Å²	92	95.7 Å²	95.7	49%	0.492	47%	0.471	S	S	.	.	H	α-helix	trans	-65	-42.6	177.7	-77	-42.1	0	0	0	112.3	S229 Q230 Y235 I236 L237	S229-N233 WeakPolarHBondContact O-CB 3.3Å; S229-N233 PolarHBondContact O-N 3.25Å; S229-N233 PolarHBondContact O-ND2 3.19Å; Q230-N233 PolarHBondContact O-N 2.93Å; N233-Y235 VanDerWaalsContact C-N 3.32Å; N233-Y235 PolarHBondContact O-N 3.25Å; N233-I236 PolarHBondContact O-N 3.11Å; N233-L237 WeakPolarHBondContact O-CG 3.44Å; N233-L237 PolarHBondContact O-N 2.95Å
234	D	81.2	Confident	75.7	Confident	101 Å²	101	94.7 Å²	94.7	54%	0.54	47%	0.468	S	S	.	.	H	α-helix	trans	-58.5	-44.1	176.1	-66.9	-25.9	0	0	0	111.5	Q230 L237 Q238	Q230-D234 PolarHBondContact O-N 3.04Å; D234-L237 PolarHBondContact O-N 3.45Å; D234-Q238 PolarHBondContact O-N 3.32Å
235	Y	83.8	Confident	77.1	Confident	137 Å²	137	97.1 Å²	97.1	54%	0.537	48%	0.479	S	S	.	.	H	α-helix	trans	-65.3	-39.3	177.2	-171	-113	0	0	0	112.4	R231 V232 N233 L237 Q238 L239	R231-Y235 WeakPolarHBondContact O-CB 3.35Å; R231-Y235 PolarHBondContact O-N 3.04Å; V232-Y235 PolarHBondContact O-N 2.96Å; N233-Y235 VanDerWaalsContact C-N 3.32Å; N233-Y235 PolarHBondContact O-N 3.25Å; Y235-L237 VanDerWaalsContact C-N 3.34Å; Y235-L237 PolarHBondContact O-N 3.03Å; Y235-Q238 PolarHBondContact O-N 3.12Å; Y235-L239 HydrophobicContact CD1-CD1 3.96Å; Y235-L239 HydrophobicContact CD1-CG 4.48Å; Y235-L239 HydrophobicContact CE1-CD1 3.62Å; Y235-L239 HydrophobicContact CE1-CG 4.2Å; Y235-L239 WeakPolarHBondContact O-CG 3.34Å; Y235-L239 PolarHBondContact O-N 3.45Å
236	I	83	Confident	78.6	Confident	54 Å²	54	99.6 Å²	99.6	28%	0.277	49%	0.486	S	S	.	.	H	α-helix	trans	-63.7	-38.8	174.1	-70.2	165.7	0	0	0	111.3	V232 N233 K240	V232-I236 HydrophobicContact CG1-CD1 3.88Å; V232-I236 VanDerWaalsContact O-CG1 3.31Å; V232-I236 WeakPolarHBondContact O-CG1 3.31Å; V232-I236 PolarHBondContact O-N 3.34Å; N233-I236 PolarHBondContact O-N 3.11Å; I236-K240 HydrophobicContact CG2-CD 4.35Å; I236-K240 WeakPolarHBondContact O-CG 3.45Å; I236-K240 PolarHBondContact O-N 2.98Å
237	L	83.8	Confident	79.8	Confident	106 Å²	106	97.1 Å²	97.1	56%	0.555	48%	0.477	S	S	*	.	H	α-helix	trans	-66.8	-41.3	174.7	-70.1	171.3	0	0	0	111.7	N233 D234 Y235 K240 S241	N233-L237 WeakPolarHBondContact O-CG 3.44Å; N233-L237 PolarHBondContact O-N 2.95Å; D234-L237 PolarHBondContact O-N 3.45Å; Y235-L237 VanDerWaalsContact C-N 3.34Å; Y235-L237 PolarHBondContact O-N 3.03Å; L237-K240 PolarHBondContact O-N 3.26Å; L237-S241 PolarHBondContact O-N 3.48Å
238	Q	83.6	Confident	81	Confident	117 Å²	117	96.8 Å²	96.8	55%	0.547	47%	0.469	S	S	.	.	H	α-helix	trans	-61.3	-45.6	175.5	-167.6	176.7	24.7	0	0	111.8	D234 Y235 K240 S241 M242	D234-Q238 PolarHBondContact O-N 3.32Å; Y235-Q238 PolarHBondContact O-N 3.12Å; Q238-K240 PolarHBondContact O-N 2.93Å; Q238-S241 WeakPolarHBondContact O-CB 3.4Å; Q238-S241 PolarHBondContact O-N 3.06Å; Q238-M242 WeakPolarHBondContact O-CG 3.4Å; Q238-M242 PolarHBondContact O-N 3.25Å
239	L	85.4	Confident	81.9	Confident	62 Å²	62	99.5 Å²	99.5	33%	0.325	48%	0.482	S	S	.	.	H	α-helix	trans	-62.5	-40.3	175.9	-72.5	176.6	0	0	0	112.7	Y235 M242 N243	Y235-L239 HydrophobicContact CD1-CD1 3.96Å; Y235-L239 HydrophobicContact CD1-CG 4.48Å; Y235-L239 HydrophobicContact CE1-CD1 3.62Å; Y235-L239 HydrophobicContact CE1-CG 4.2Å; Y235-L239 WeakPolarHBondContact O-CG 3.34Å; Y235-L239 PolarHBondContact O-N 3.45Å; L239-M242 PolarHBondContact O-N 2.94Å; L239-N243 WeakPolarHBondContact O-CB 3.47Å; L239-N243 PolarHBondContact O-N 2.91Å
240	K	86.6	Confident	82.8	Confident	138 Å²	138	100.7 Å²	100.7	60%	0.6	48%	0.484	S	S	*	.	H	α-helix	trans	-61.7	-43.6	173.9	-76	172.8	179.4	178.1	0	111.7	I236 L237 Q238 N243 Y244	I236-K240 HydrophobicContact CG2-CD 4.35Å; I236-K240 WeakPolarHBondContact O-CG 3.45Å; I236-K240 PolarHBondContact O-N 2.98Å; L237-K240 PolarHBondContact O-N 3.26Å; Q238-K240 PolarHBondContact O-N 2.93Å; K240-N243 PolarHBondContact O-N 3.29Å; K240-Y244 PolarHBondContact O-N 3.47Å
241	S	86.3	Confident	83.6	Confident	66 Å²	66	97.8 Å²	97.8	46%	0.462	48%	0.477	S	S	.	.	H	α-helix	trans	-61.5	-48.4	176.2	-175.4	0	0	0	0	111.9	L237 Q238 N243 Y244 I245	L237-S241 PolarHBondContact O-N 3.48Å; Q238-S241 WeakPolarHBondContact O-CB 3.4Å; Q238-S241 PolarHBondContact O-N 3.06Å; S241-N243 VanDerWaalsContact C-N 3.32Å; S241-N243 PolarHBondContact O-N 3.01Å; S241-Y244 PolarHBondContact O-N 2.89Å; S241-I245 WeakPolarHBondContact O-CG1 3.38Å; S241-I245 PolarHBondContact O-N 3.44Å
242	M	85.2	Confident	84.2	Confident	119 Å²	119	96.7 Å²	96.7	59%	0.586	47%	0.473	S	S	*	.	H	α-helix	trans	-59.1	-41.7	175.6	-71.7	178.6	67	0	0	112.4	Q238 L239 I245 F246	Q238-M242 WeakPolarHBondContact O-CG 3.4Å; Q238-M242 PolarHBondContact O-N 3.25Å; L239-M242 PolarHBondContact O-N 2.94Å; M242-I245 PolarHBondContact O-N 3.35Å; M242-F246 WeakPolarHBondContact O-CB 3.43Å; M242-F246 PolarHBondContact O-N 2.95Å
243	N	86	Confident	84.6	Confident	87 Å²	87	98.3 Å²	98.3	47%	0.465	49%	0.486	S	S	.	.	H	α-helix	trans	-66.4	-39.9	177.9	-166.7	-97.5	0	0	0	112.1	L239 K240 S241 F246 N247	L239-N243 WeakPolarHBondContact O-CB 3.47Å; L239-N243 PolarHBondContact O-N 2.91Å; K240-N243 PolarHBondContact O-N 3.29Å; S241-N243 VanDerWaalsContact C-N 3.32Å; S241-N243 PolarHBondContact O-N 3.01Å; N243-F246 PolarHBondContact O-N 3.46Å; N243-N247 PolarHBondContact O-N 3.38Å; N243-N247 PolarHBondContact O-ND2 3.26Å; N243-N247 PolarHBondContact OD1-ND2 3.01Å
244	Y	84.3	Confident	84.9	Confident	162 Å²	162	97.4 Å²	97.4	64%	0.635	48%	0.484	S	S	*	.	H	α-helix	trans	-62	-46.5	175.3	-176.3	-109.3	0	0	0	111.9	K240 S241 F246 N247 I248	K240-Y244 PolarHBondContact O-N 3.47Å; S241-Y244 PolarHBondContact O-N 2.89Å; Y244-F246 VanDerWaalsContact C-N 3.34Å; Y244-F246 PolarHBondContact O-N 3.01Å; Y244-N247 PolarHBondContact O-N 3.35Å; Y244-I248 HydrophobicContact CD1-CD1 3.89Å; Y244-I248 HydrophobicContact CE1-CD1 3.42Å; Y244-I248 VanDerWaalsContact CE1-CD1 3.42Å; Y244-I248 HydrophobicContact CE2-CD1 4.4Å; Y244-I248 PolarHBondContact O-N 3.47Å
245	I	86.1	Confident	85	Confident	86 Å²	86	97.2 Å²	97.2	44%	0.441	48%	0.482	S	S	.	.	H	α-helix	trans	-60.6	-42.7	175.6	-66.4	165.5	0	0	0	111.2	S241 M242 I248 N249	S241-I245 WeakPolarHBondContact O-CG1 3.38Å; S241-I245 PolarHBondContact O-N 3.44Å; M242-I245 PolarHBondContact O-N 3.35Å; I245-I248 PolarHBondContact O-N 3.39Å; I245-N249 PolarHBondContact O-N 2.91Å; I245-N249 PolarHBondContact O-ND2 3.46Å
246	F	87.3	Confident	85	Confident	130 Å²	130	93.2 Å²	93.2	57%	0.57	47%	0.474	S	S	*	.	H	α-helix	trans	-60.5	-45.8	176.7	-178.6	-93.5	0	0	0	112.2	M242 N243 Y244 I248 N249 L250	M242-F246 WeakPolarHBondContact O-CB 3.43Å; M242-F246 PolarHBondContact O-N 2.95Å; N243-F246 PolarHBondContact O-N 3.46Å; Y244-F246 VanDerWaalsContact C-N 3.34Å; Y244-F246 PolarHBondContact O-N 3.01Å; F246-I248 PolarHBondContact O-N 3.23Å; F246-N249 PolarHBondContact O-N 2.97Å; F246-L250 HydrophobicContact CE1-CD2 4.33Å; F246-L250 WeakPolarHBondContact O-CB 3.47Å; F246-L250 PolarHBondContact O-N 2.78Å
247	N	84.9	Confident	85	Confident	65 Å²	65	97.1 Å²	97.1	35%	0.348	49%	0.49	S	S	.	.	H	α-helix	trans	-64.7	-37	177.7	-75.5	-71.3	0	0	0	112.6	N243 Y244 S251	N243-N247 PolarHBondContact O-N 3.38Å; N243-N247 PolarHBondContact O-ND2 3.26Å; N243-N247 PolarHBondContact OD1-ND2 3.01Å; Y244-N247 PolarHBondContact O-N 3.35Å; N247-S251 WeakPolarHBondContact O-CB 3.38Å; N247-S251 PolarHBondContact O-N 2.93Å; N247-S251 PolarHBondContact O-OG 3.44Å
248	I	86.6	Confident	84.9	Confident	60 Å²	60	97.2 Å²	97.2	31%	0.308	49%	0.491	S	S	.	.	H	α-helix	trans	-62.2	-46.7	172.9	-73.5	173.3	0	0	0	110.9	Y244 I245 F246 S251 R252	Y244-I248 HydrophobicContact CD1-CD1 3.89Å; Y244-I248 HydrophobicContact CE1-CD1 3.42Å; Y244-I248 VanDerWaalsContact CE1-CD1 3.42Å; Y244-I248 HydrophobicContact CE2-CD1 4.4Å; Y244-I248 PolarHBondContact O-N 3.47Å; I245-I248 PolarHBondContact O-N 3.39Å; F246-I248 PolarHBondContact O-N 3.23Å; I248-S251 PolarHBondContact O-N 3.33Å; I248-R252 WeakPolarHBondContact O-CB 3.42Å; I248-R252 WeakPolarHBondContact O-CG 3.39Å; I248-R252 PolarHBondContact O-N 2.94Å
249	N	85.6	Confident	84.9	Confident	89 Å²	89	96.7 Å²	96.7	48%	0.476	49%	0.491	S	S	.	.	H	α-helix	trans	-66.9	-39.6	-179.1	-71.9	-20.9	0	0	0	112.1	I245 F246 R252 S253	I245-N249 PolarHBondContact O-N 2.91Å; I245-N249 PolarHBondContact O-ND2 3.46Å; F246-N249 PolarHBondContact O-N 2.97Å; N249-R252 PolarHBondContact O-N 3.22Å; N249-S253 WeakPolarHBondContact O-CB 3.32Å; N249-S253 PolarHBondContact O-N 3.13Å
250	L	84.1	Confident	84.7	Confident	90 Å²	90	100.6 Å²	100.6	47%	0.471	51%	0.506	S	S	.	.	H	α-helix	trans	-61.7	-46.8	172.6	-176.2	62	0	0	0	111.2	F246 R252 S253 T254	F246-L250 HydrophobicContact CE1-CD2 4.33Å; F246-L250 WeakPolarHBondContact O-CB 3.47Å; F246-L250 PolarHBondContact O-N 2.78Å; L250-R252 PolarHBondContact O-N 3.16Å; L250-S253 WeakPolarHBondContact O-CB 3.4Å; L250-S253 PolarHBondContact O-N 3.45Å; L250-S253 VanDerWaalsContact O-N 3.16Å; L250-T254 PolarHBondContact O-N 3.04Å; L250-T254 PolarHBondContact O-OG1 2.95Å; L250-T254 VanDerWaalsContact O-OG1 3.13Å
251	S	85.7	Confident	84.4	Confident	65 Å²	65	98.2 Å²	98.2	46%	0.455	51%	0.507	S	S	.	.	H	α-helix	trans	-60.7	-43.2	177.9	-56.9	0	0	0	0	112.1	N247 I248 T254 I255	N247-S251 WeakPolarHBondContact O-CB 3.38Å; N247-S251 PolarHBondContact O-N 2.93Å; N247-S251 PolarHBondContact O-OG 3.44Å; I248-S251 PolarHBondContact O-N 3.33Å; S251-T254 PolarHBondContact O-N 2.71Å; S251-I255 WeakPolarHBondContact O-CD1 3.32Å; S251-I255 VanDerWaalsContact O-CG1 3.27Å; S251-I255 WeakPolarHBondContact O-CG1 3.47Å; S251-I255 PolarHBondContact O-N 3.38Å
252	R	85	Confident	83.8	Confident	173 Å²	173	99.6 Å²	99.6	65%	0.653	52%	0.516	S	S	*	.	H	α-helix	trans	-62	-40.4	174.1	-76.6	176.6	169.1	-169.5	-4.9	112.3	I248 N249 L250 S256	I248-R252 WeakPolarHBondContact O-CB 3.42Å; I248-R252 WeakPolarHBondContact O-CG 3.39Å; I248-R252 PolarHBondContact O-N 2.94Å; N249-R252 PolarHBondContact O-N 3.22Å; L250-R252 PolarHBondContact O-N 3.16Å; R252-S256 WeakPolarHBondContact O-CB 3.5Å; R252-S256 PolarHBondContact O-N 3.27Å
253	S	84.6	Confident	82.9	Confident	65 Å²	65	104.6 Å²	104.6	46%	0.455	54%	0.538	S	S	.	.	H	α-helix	trans	-62.2	-48.8	175.5	-167.9	0	0	0	0	111.4	N249 L250 I255 S256 H257	N249-S253 WeakPolarHBondContact O-CB 3.32Å; N249-S253 PolarHBondContact O-N 3.13Å; L250-S253 WeakPolarHBondContact O-CB 3.4Å; L250-S253 PolarHBondContact O-N 3.45Å; L250-S253 VanDerWaalsContact O-N 3.16Å; S253-I255 PolarHBondContact O-N 3Å; S253-S256 PolarHBondContact O-N 2.9Å; S253-H257 PolarHBondContact O-N 3.33Å
254	T	84.4	Confident	82.8	Confident	74 Å²	74	105.5 Å²	105.5	45%	0.454	54%	0.542	S	S	.	.	H	α-helix	trans	-60.2	-44.8	177.1	-55.1	0	0	0	0	112.1	L250 S251 S256 H257 L258	L250-T254 PolarHBondContact O-N 3.04Å; L250-T254 PolarHBondContact O-OG1 2.95Å; L250-T254 VanDerWaalsContact O-OG1 3.13Å; S251-T254 PolarHBondContact O-N 2.71Å; T254-S256 PolarHBondContact O-N 3.44Å; T254-H257 PolarHBondContact O-N 2.94Å; T254-L258 HydrophobicContact CG2-CD1 4.15Å; T254-L258 WeakPolarHBondContact O-CG 3.27Å; T254-L258 PolarHBondContact O-N 2.74Å
255	I	83.1	Confident	82.7	Confident	97 Å²	97	102.5 Å²	102.5	50%	0.497	54%	0.537	S	S	.	.	H	α-helix	trans	-62.8	-42.6	176.5	-68.4	164.2	0	0	0	111	S251 S253 H257 L258 L259	S251-I255 WeakPolarHBondContact O-CD1 3.32Å; S251-I255 VanDerWaalsContact O-CG1 3.27Å; S251-I255 WeakPolarHBondContact O-CG1 3.47Å; S251-I255 PolarHBondContact O-N 3.38Å; S253-I255 PolarHBondContact O-N 3Å; I255-H257 VanDerWaalsContact C-N 3.32Å; I255-H257 PolarHBondContact O-N 3.49Å; I255-L258 PolarHBondContact O-N 3.35Å; I255-L259 HydrophobicContact CG2-CD1 4.01Å; I255-L259 WeakPolarHBondContact O-CG 3.37Å; I255-L259 PolarHBondContact O-N 3.19Å
256	S	83.7	Confident	82.5	Confident	53 Å²	53	103.4 Å²	103.4	37%	0.371	54%	0.542	S	S	.	.	H	α-helix	trans	-64.8	-35	176.5	-175.1	0	0	0	0	112.7	R252 S253 T254 K260	R252-S256 WeakPolarHBondContact O-CB 3.5Å; R252-S256 PolarHBondContact O-N 3.27Å; S253-S256 PolarHBondContact O-N 2.9Å; T254-S256 PolarHBondContact O-N 3.44Å; S256-K260 VanDerWaalsContact O-CG 3.32Å; S256-K260 WeakPolarHBondContact O-CG 3.43Å; S256-K260 PolarHBondContact O-N 3.26Å
257	H	82.8	Confident	82.2	Confident	135 Å²	135	101.9 Å²	101.9	63%	0.625	54%	0.541	S	S	*	.	H	α-helix	trans	-68.2	-42.8	173.3	-107.6	-78.3	0	0	0	112.5	S253 T254 I255 K260 S261	S253-H257 PolarHBondContact O-N 3.33Å; T254-H257 PolarHBondContact O-N 2.94Å; I255-H257 VanDerWaalsContact C-N 3.32Å; I255-H257 PolarHBondContact O-N 3.49Å; H257-K260 PolarHBondContact O-N 3.02Å; H257-S261 PolarHBondContact O-N 3.31Å; H257-S261 PolarHBondContact O-OG 2.95Å
258	L	82.4	Confident	82.1	Confident	108 Å²	108	104.2 Å²	104.2	57%	0.565	55%	0.553	S	S	*	*	H	α-helix	trans	-62.5	-46.5	178.5	-74	168.4	0	0	0	111.6	T254 I255 K260 S261 S262	T254-L258 HydrophobicContact CG2-CD1 4.15Å; T254-L258 WeakPolarHBondContact O-CG 3.27Å; T254-L258 PolarHBondContact O-N 2.74Å; I255-L258 PolarHBondContact O-N 3.35Å; L258-K260 VanDerWaalsContact C-N 3.34Å; L258-K260 PolarHBondContact O-N 3.2Å; L258-S261 WeakPolarHBondContact CA-OG 3.49Å; L258-S261 CarbonylContact O-C 3.58Å; L258-S261 WeakPolarHBondContact O-CA 3.37Å; L258-S261 PolarHBondContact O-N 3.41Å; L258-S261 PolarHBondContact O-OG 3.13Å; L258-S262 PolarHBondContact O-N 3.29Å; L258-S262 PolarHBondContact O-OG 3.45Å
259	L	81.9	Confident	81.8	Confident	106 Å²	106	107.1 Å²	107.1	56%	0.555	57%	0.569	S	S	*	*	H	α-helix	trans	-58.7	-43.7	177	-70.8	168.5	0	0	0	112.1	I255 S261 S262	I255-L259 HydrophobicContact CG2-CD1 4.01Å; I255-L259 WeakPolarHBondContact O-CG 3.37Å; I255-L259 PolarHBondContact O-N 3.19Å; L259-S261 PolarHBondContact O-N 2.82Å; L259-S262 PolarHBondContact O-N 2.92Å; L259-S262 VanDerWaalsContact O-N 3.13Å; L259-S262 PolarHBondContact O-OG 2.98Å
260	K	82.7	Confident	81.5	Confident	145 Å²	145	108.4 Å²	108.4	63%	0.63	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	-6.6	174.7	-72.5	176.2	177.4	179.2	0	114.9	S256 H257 L258	S256-K260 VanDerWaalsContact O-CG 3.32Å; S256-K260 WeakPolarHBondContact O-CG 3.43Å; S256-K260 PolarHBondContact O-N 3.26Å; H257-K260 PolarHBondContact O-N 3.02Å; L258-K260 VanDerWaalsContact C-N 3.34Å; L258-K260 PolarHBondContact O-N 3.2Å
261	S	79.9	Confident	81.3	Confident	88 Å²	88	109.8 Å²	109.8	62%	0.615	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.6	4	174.1	65	0	0	0	0	113.1	H257 L258 L259	H257-S261 PolarHBondContact O-N 3.31Å; H257-S261 PolarHBondContact O-OG 2.95Å; L258-S261 WeakPolarHBondContact CA-OG 3.49Å; L258-S261 CarbonylContact O-C 3.58Å; L258-S261 WeakPolarHBondContact O-CA 3.37Å; L258-S261 PolarHBondContact O-N 3.41Å; L258-S261 PolarHBondContact O-OG 3.13Å; L259-S261 PolarHBondContact O-N 2.82Å
262	S	74.1	Confident	80.9	Confident	95 Å²	95	113.6 Å²	113.6	66%	0.664	59%	0.594	S	S	*	*			trans	-111.7	6.2	172.8	53	0	0	0	0	113.4	L258 L259	L258-S262 PolarHBondContact O-N 3.29Å; L258-S262 PolarHBondContact O-OG 3.45Å; L259-S262 PolarHBondContact O-N 2.92Å; L259-S262 VanDerWaalsContact O-N 3.13Å; L259-S262 PolarHBondContact O-OG 2.98Å
263	E	66.8	Low	80.6	Confident	224 Å²	224	108.2 Å²	108.2	100%	1.047	59%	0.589	S	S	*	*			trans	-105.3	0	170	-65.8	-180	152.1	0	0	109.7

Retrieved 263 of 263 residues in 140.4 ms (Link to these results)

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