A0A5K4FGK4_SCHMA Loading...

Kinesin-like protein

AlphaFold DB , UniProt , Accession A0A5K4FGK4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 274 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	55	Low	64.5	Low	236 Å²	236	115.5 Å²	115.5	100%	1.163	64%	0.638	S	S	*	*				0	10	0	-105.3	-175	-84.9	0	0	112.4
2	E	60.9	Low	66	Low	169 Å²	169	111.1 Å²	111.1	79%	0.79	61%	0.611	S	S	*	*			trans	-96.1	-23	-169.2	-160.1	158.3	-166.5	0	0	113.4	N4 A5	E2-N4 PolarHBondContact O-N 3.19Å; E2-A5 PolarHBondContact O-N 3.32Å
3	A	62	Low	67.4	Low	78 Å²	78	108.2 Å²	108.2	65%	0.645	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	-14	-179.4	0	0	0	0	0	114.9
4	N	62.8	Low	68.8	Low	109 Å²	109	107 Å²	107	58%	0.583	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	-21.5	179.1	-71.5	0.2	0	0	0	112.7	E2 D6 L7 E8	E2-N4 PolarHBondContact O-N 3.19Å; N4-D6 VanDerWaalsContact C-N 3.3Å; N4-D6 PolarHBondContact O-N 3.34Å; N4-L7 WeakPolarHBondContact O-CB 3.09Å; N4-L7 PolarHBondContact O-N 3.23Å; N4-L7 VanDerWaalsContact O-N 3.08Å; N4-E8 PolarHBondContact O-N 3.33Å
5	A	61.5	Low	70.2	Confident	57 Å²	57	106.1 Å²	106.1	47%	0.471	58%	0.578	S	S	.	*	G	3₁₀ helix	trans	-67.8	-33.9	-178.6	0	0	0	0	0	111.6	E2 L7 E8	E2-A5 PolarHBondContact O-N 3.32Å; A5-L7 PolarHBondContact O-N 3.11Å; A5-E8 PolarHBondContact O-N 3.33Å
6	D	61.1	Low	71.4	Confident	114 Å²	114	103.6 Å²	103.6	61%	0.61	56%	0.563	S	S	*	*	G	3₁₀ helix	trans	-70.2	-17	174.1	-62.4	-21.3	0	0	0	112.6	N4 I12	N4-D6 VanDerWaalsContact C-N 3.3Å; N4-D6 PolarHBondContact O-N 3.34Å; D6-I12 WeakPolarHBondContact O-CD1 3.48Å
7	L	59.6	Low	72.6	Confident	92 Å²	92	105.9 Å²	105.9	48%	0.482	56%	0.563	S	S	.	*	G	3₁₀ helix	trans	-90.2	-12.9	175.5	-66.1	170.6	0	0	0	112.8	N4 A5 D9 I16	N4-L7 WeakPolarHBondContact O-CB 3.09Å; N4-L7 PolarHBondContact O-N 3.23Å; N4-L7 VanDerWaalsContact O-N 3.08Å; A5-L7 PolarHBondContact O-N 3.11Å; L7-D9 VanDerWaalsContact C-N 3.33Å; L7-I16 HydrophobicContact CD2-CD1 4.43Å
8	E	58.7	Low	73.6	Confident	157 Å²	157	106.2 Å²	106.2	73%	0.734	56%	0.56	S	S	*	*	S	Bend	trans	-87.4	-2.3	173.7	-69.7	-179.2	-175.8	0	0	112.5	N4 A5 D10	N4-E8 PolarHBondContact O-N 3.33Å; A5-E8 PolarHBondContact O-N 3.33Å; E8-D10 PolarHBondContact O-N 3.45Å; E8-D10 VanDerWaalsContact O-N 3.11Å
9	D	70.3	Confident	74.7	Confident	94 Å²	94	105.2 Å²	105.2	50%	0.503	56%	0.559	S	S	.	*			trans	-69.3	104.9	167.1	-175.2	18.4	0	0	0	108.7	L7 G11 I12 M13	L7-D9 VanDerWaalsContact C-N 3.33Å; D9-G11 PolarHBondContact O-N 3.47Å; D9-I12 HydrophobicContact CB-CB 4.44Å; D9-I12 HydrophobicContact CB-CD1 4.06Å; D9-I12 HydrophobicContact CB-CG1 4.24Å; D9-I12 PolarHBondContact O-N 3.39Å; D9-M13 PolarHBondContact O-N 3.08Å
10	D	75	Confident	75.6	Confident	132 Å²	132	104.5 Å²	104.5	71%	0.706	56%	0.555	S	S	*	*	H	α-helix	trans	-44.9	-34	-178.4	-75.1	-28.4	0	0	0	112.3	E8 I14	E8-D10 PolarHBondContact O-N 3.45Å; E8-D10 VanDerWaalsContact O-N 3.11Å; D10-I14 VanDerWaalsContact O-CD1 3.31Å; D10-I14 WeakPolarHBondContact O-CD1 3.34Å; D10-I14 WeakPolarHBondContact O-CG1 3.17Å; D10-I14 PolarHBondContact O-N 3.12Å; D10-I14 VanDerWaalsContact O-N 3.1Å
11	G	82.7	Confident	76.5	Confident	32 Å²	32	106 Å²	106	33%	0.33	56%	0.559	S	S	.	*	H	α-helix	trans	-66.6	-40	176.9	0	0	0	0	0	114.6	D9 N15	D9-G11 PolarHBondContact O-N 3.47Å; G11-N15 PolarHBondContact O-N 3.1Å; G11-N15 VanDerWaalsContact O-N 3.12Å; G11-N15 PolarHBondContact O-ND2 3.28Å; G11-N15 PolarHBondContact O-OD1 3.42Å
12	I	83	Confident	78.4	Confident	63 Å²	63	99 Å²	99	32%	0.323	53%	0.526	S	S	.	.	H	α-helix	trans	-67.5	-43.1	178.4	-69.7	172.8	0	0	0	109.9	D6 D9 N15 I16	D6-I12 WeakPolarHBondContact O-CD1 3.48Å; D9-I12 HydrophobicContact CB-CB 4.44Å; D9-I12 HydrophobicContact CB-CD1 4.06Å; D9-I12 HydrophobicContact CB-CG1 4.24Å; D9-I12 PolarHBondContact O-N 3.39Å; I12-N15 PolarHBondContact O-N 2.83Å; I12-I16 HydrophobicContact CG2-CD1 3.92Å; I12-I16 WeakPolarHBondContact O-CG1 3.28Å; I12-I16 PolarHBondContact O-N 2.96Å
13	M	83.5	Confident	80	Confident	73 Å²	73	95.5 Å²	95.5	36%	0.36	51%	0.509	S	S	.	.	H	α-helix	trans	-65.3	-42.5	179.7	-165	65	-165.2	0	0	112	D9 N15 I16 Y17	D9-M13 PolarHBondContact O-N 3.08Å; M13-N15 VanDerWaalsContact C-N 3.34Å; M13-N15 PolarHBondContact O-N 2.91Å; M13-I16 PolarHBondContact O-N 3.34Å; M13-Y17 HydrophobicContact CE-CD2 3.93Å; M13-Y17 HydrophobicContact CE-CE1 4.05Å; M13-Y17 HydrophobicContact CE-CE2 3.17Å; M13-Y17 VanDerWaalsContact CE-OH 3.24Å; M13-Y17 WeakPolarHBondContact CE-OH 3.48Å; M13-Y17 HydrophobicContact CG-CD2 3.86Å; M13-Y17 HydrophobicContact CG-CE2 3.53Å; M13-Y17 WeakPolarHBondContact O-CD2 3.31Å; M13-Y17 PolarHBondContact O-N 2.78Å; M13-Y17 HydrophobicContact SD-CE2 4.14Å
14	I	87.8	Confident	81.6	Confident	92 Å²	92	96.5 Å²	96.5	47%	0.472	50%	0.503	S	S	.	.	H	α-helix	trans	-57.4	-47	174	-70.4	164.3	0	0	0	110.6	D10 I16 Y17 E18	D10-I14 VanDerWaalsContact O-CD1 3.31Å; D10-I14 WeakPolarHBondContact O-CD1 3.34Å; D10-I14 WeakPolarHBondContact O-CG1 3.17Å; D10-I14 PolarHBondContact O-N 3.12Å; D10-I14 VanDerWaalsContact O-N 3.1Å; I14-I16 VanDerWaalsContact C-N 3.34Å; I14-I16 PolarHBondContact O-N 3.45Å; I14-Y17 PolarHBondContact O-N 3.3Å; I14-E18 HydrophobicContact CG2-CG 4.41Å; I14-E18 WeakPolarHBondContact O-CG 3.17Å; I14-E18 PolarHBondContact O-N 3.39Å
15	N	89.6	Confident	83.2	Confident	94 Å²	94	98 Å²	98	50%	0.503	50%	0.502	S	S	.	.	H	α-helix	trans	-63.5	-37.4	179.7	-69.5	-12.1	0	0	0	112.8	G11 I12 M13 T19	G11-N15 PolarHBondContact O-N 3.1Å; G11-N15 VanDerWaalsContact O-N 3.12Å; G11-N15 PolarHBondContact O-ND2 3.28Å; G11-N15 PolarHBondContact O-OD1 3.42Å; I12-N15 PolarHBondContact O-N 2.83Å; M13-N15 VanDerWaalsContact C-N 3.34Å; M13-N15 PolarHBondContact O-N 2.91Å; N15-T19 WeakPolarHBondContact O-CB 3.4Å; N15-T19 PolarHBondContact O-N 3.34Å; N15-T19 PolarHBondContact O-OG1 3.02Å
16	I	89	Confident	84.9	Confident	65 Å²	65	102.6 Å²	102.6	33%	0.333	51%	0.508	S	S	.	.	H	α-helix	trans	-64.2	-45.3	174.7	-68.3	166.3	0	0	0	110	L7 I12 M13 I14 T19 I20	L7-I16 HydrophobicContact CD2-CD1 4.43Å; I12-I16 HydrophobicContact CG2-CD1 3.92Å; I12-I16 WeakPolarHBondContact O-CG1 3.28Å; I12-I16 PolarHBondContact O-N 2.96Å; M13-I16 PolarHBondContact O-N 3.34Å; I14-I16 VanDerWaalsContact C-N 3.34Å; I14-I16 PolarHBondContact O-N 3.45Å; I16-T19 PolarHBondContact O-N 3.28Å; I16-I20 HydrophobicContact CG2-CD1 3.65Å; I16-I20 HydrophobicContact CG2-CG1 4.36Å; I16-I20 WeakPolarHBondContact O-CB 3.44Å; I16-I20 VanDerWaalsContact O-CG1 3.28Å; I16-I20 WeakPolarHBondContact O-CG1 3.01Å; I16-I20 PolarHBondContact O-N 3.45Å
17	Y	91	Very high	86.6	Confident	144 Å²	144	103.3 Å²	103.3	57%	0.565	51%	0.506	S	S	*	.	H	α-helix	trans	-62.4	-43.4	177	-80.2	-60.2	0	0	0	112.5	M13 I14 I20 Q21	M13-Y17 HydrophobicContact CE-CD2 3.93Å; M13-Y17 HydrophobicContact CE-CE1 4.05Å; M13-Y17 HydrophobicContact CE-CE2 3.17Å; M13-Y17 VanDerWaalsContact CE-OH 3.24Å; M13-Y17 WeakPolarHBondContact CE-OH 3.48Å; M13-Y17 HydrophobicContact CG-CD2 3.86Å; M13-Y17 HydrophobicContact CG-CE2 3.53Å; M13-Y17 WeakPolarHBondContact O-CD2 3.31Å; M13-Y17 PolarHBondContact O-N 2.78Å; M13-Y17 HydrophobicContact SD-CE2 4.14Å; I14-Y17 PolarHBondContact O-N 3.3Å; Y17-I20 PolarHBondContact O-N 2.89Å; Y17-Q21 VanDerWaalsContact O-CB 3.25Å; Y17-Q21 WeakPolarHBondContact O-CB 3.41Å; Y17-Q21 PolarHBondContact O-N 3.18Å
18	E	92	Very high	88.4	Confident	110 Å²	110	102 Å²	102	51%	0.514	50%	0.499	S	S	.	.	H	α-helix	trans	-60.3	-46	175.2	-73	-177.1	172.3	0	0	111.2	I14 I20 Q21 D22	I14-E18 HydrophobicContact CG2-CG 4.41Å; I14-E18 WeakPolarHBondContact O-CG 3.17Å; I14-E18 PolarHBondContact O-N 3.39Å; E18-I20 PolarHBondContact O-N 2.92Å; E18-Q21 PolarHBondContact O-N 2.99Å; E18-D22 WeakPolarHBondContact O-CB 3.36Å; E18-D22 PolarHBondContact O-N 3.4Å
19	T	93	Very high	90.2	Very high	88 Å²	88	100.5 Å²	100.5	54%	0.54	49%	0.49	S	S	.	.	H	α-helix	trans	-61.5	-45.4	178.2	-56.9	0	0	0	0	112	N15 I16 Q21 D22 E23	N15-T19 WeakPolarHBondContact O-CB 3.4Å; N15-T19 PolarHBondContact O-N 3.34Å; N15-T19 PolarHBondContact O-OG1 3.02Å; I16-T19 PolarHBondContact O-N 3.28Å; T19-Q21 VanDerWaalsContact C-N 3.35Å; T19-D22 PolarHBondContact O-N 2.88Å; T19-E23 WeakPolarHBondContact O-CB 3.42Å; T19-E23 PolarHBondContact O-N 3.25Å
20	I	93.7	Very high	91.4	Very high	91 Å²	91	98.7 Å²	98.7	47%	0.467	49%	0.488	S	S	.	.	H	α-helix	trans	-65.6	-40	178	-69.2	169.5	0	0	0	110.6	I16 Y17 E18 E23 L24	I16-I20 HydrophobicContact CG2-CD1 3.65Å; I16-I20 HydrophobicContact CG2-CG1 4.36Å; I16-I20 WeakPolarHBondContact O-CB 3.44Å; I16-I20 VanDerWaalsContact O-CG1 3.28Å; I16-I20 WeakPolarHBondContact O-CG1 3.01Å; I16-I20 PolarHBondContact O-N 3.45Å; Y17-I20 PolarHBondContact O-N 2.89Å; E18-I20 PolarHBondContact O-N 2.92Å; I20-E23 PolarHBondContact O-N 3.46Å; I20-L24 WeakPolarHBondContact O-CB 3.24Å; I20-L24 PolarHBondContact O-N 2.87Å
21	Q	93.9	Very high	92.5	Very high	137 Å²	137	96.5 Å²	96.5	64%	0.64	48%	0.476	S	S	*	.	H	α-helix	trans	-64.6	-43.5	178	-175.6	176.2	-54.7	0	0	111.4	Y17 E18 T19 L24 Y25	Y17-Q21 VanDerWaalsContact O-CB 3.25Å; Y17-Q21 WeakPolarHBondContact O-CB 3.41Å; Y17-Q21 PolarHBondContact O-N 3.18Å; E18-Q21 PolarHBondContact O-N 2.99Å; T19-Q21 VanDerWaalsContact C-N 3.35Å; Q21-L24 PolarHBondContact O-N 2.88Å; Q21-Y25 WeakPolarHBondContact O-CB 3.46Å; Q21-Y25 PolarHBondContact O-N 3.13Å
22	D	94.9	Very high	93.2	Very high	89 Å²	89	103.7 Å²	103.7	48%	0.476	49%	0.493	S	S	.	.	H	α-helix	trans	-62.4	-48.1	175	-80.4	-8.6	0	0	0	111	E18 T19 L24 Y25 Y26	E18-D22 WeakPolarHBondContact O-CB 3.36Å; E18-D22 PolarHBondContact O-N 3.4Å; T19-D22 PolarHBondContact O-N 2.88Å; D22-L24 VanDerWaalsContact C-N 3.33Å; D22-L24 PolarHBondContact O-N 3.43Å; D22-Y25 WeakPolarHBondContact O-CB 3.25Å; D22-Y25 PolarHBondContact O-N 3.42Å; D22-Y25 VanDerWaalsContact O-N 3.13Å; D22-Y26 HydrophobicContact CB-CD2 4.49Å; D22-Y26 HydrophobicContact CB-CE2 4.3Å; D22-Y26 WeakPolarHBondContact O-CD2 3.44Å; D22-Y26 PolarHBondContact O-N 2.86Å
23	E	94.8	Very high	93.8	Very high	95 Å²	95	104 Å²	104	44%	0.444	50%	0.501	S	S	.	.	H	α-helix	trans	-59.2	-44.6	177.1	-169.2	-173.3	160.7	0	0	111.7	T19 I20 Y25 Y26 K27	T19-E23 WeakPolarHBondContact O-CB 3.42Å; T19-E23 PolarHBondContact O-N 3.25Å; I20-E23 PolarHBondContact O-N 3.46Å; E23-Y25 VanDerWaalsContact C-N 3.32Å; E23-Y25 PolarHBondContact O-N 3.45Å; E23-Y26 PolarHBondContact O-N 2.6Å; E23-K27 HydrophobicContact CG-CD 4.18Å; E23-K27 WeakPolarHBondContact O-CB 3.38Å; E23-K27 WeakPolarHBondContact O-CG 3.37Å; E23-K27 PolarHBondContact O-N 3.48Å; E23-K27 WeakPolarHBondContact OE1-CE 3.29Å; E23-K27 IonicContact OE1-NZ 2.6Å; E23-K27 PolarHBondContact OE1-NZ 3.49Å
24	L	96.4	Very high	94.5	Very high	99 Å²	99	105.7 Å²	105.7	52%	0.518	51%	0.508	S	S	.	.	H	α-helix	trans	-62.7	-39.2	176.3	-176.3	150.3	0	0	0	111.4	I20 Q21 D22 N28	I20-L24 WeakPolarHBondContact O-CB 3.24Å; I20-L24 PolarHBondContact O-N 2.87Å; Q21-L24 PolarHBondContact O-N 2.88Å; D22-L24 VanDerWaalsContact C-N 3.33Å; D22-L24 PolarHBondContact O-N 3.43Å; L24-N28 WeakPolarHBondContact CD2-ND2 3.1Å; L24-N28 VanDerWaalsContact O-CB 3.29Å; L24-N28 WeakPolarHBondContact O-CB 3.21Å; L24-N28 PolarHBondContact O-N 3.19Å; L24-N28 PolarHBondContact O-ND2 3.41Å
25	Y	96.4	Very high	94.9	Very high	141 Å²	141	107.8 Å²	107.8	55%	0.553	51%	0.514	S	S	*	.	H	α-helix	trans	-63.4	-48.6	174.8	176.5	-93.4	0	0	0	111.3	Q21 D22 E23 N28 K29	Q21-Y25 WeakPolarHBondContact O-CB 3.46Å; Q21-Y25 PolarHBondContact O-N 3.13Å; D22-Y25 WeakPolarHBondContact O-CB 3.25Å; D22-Y25 PolarHBondContact O-N 3.42Å; D22-Y25 VanDerWaalsContact O-N 3.13Å; E23-Y25 VanDerWaalsContact C-N 3.32Å; E23-Y25 PolarHBondContact O-N 3.45Å; Y25-N28 PolarHBondContact O-N 2.92Å; Y25-K29 HydrophobicContact CE1-CD 4.32Å; Y25-K29 WeakPolarHBondContact O-CB 3.36Å; Y25-K29 PolarHBondContact O-N 2.87Å
26	Y	96.2	Very high	95.3	Very high	152 Å²	152	109 Å²	109	60%	0.596	52%	0.517	S	S	*	.	H	α-helix	trans	-62.6	-43.6	177.7	-73.8	-65.3	0	0	0	112.2	D22 E23 K29 A30	D22-Y26 HydrophobicContact CB-CD2 4.49Å; D22-Y26 HydrophobicContact CB-CE2 4.3Å; D22-Y26 WeakPolarHBondContact O-CD2 3.44Å; D22-Y26 PolarHBondContact O-N 2.86Å; E23-Y26 PolarHBondContact O-N 2.6Å; Y26-K29 PolarHBondContact O-N 3.27Å; Y26-A30 WeakPolarHBondContact O-CB 3.16Å; Y26-A30 PolarHBondContact O-N 3.37Å
27	K	97.3	Very high	95.7	Very high	130 Å²	130	111.5 Å²	111.5	57%	0.565	53%	0.525	S	S	*	.	H	α-helix	trans	-62.6	-43.9	175.8	-77.8	177.5	169.3	173	0	111.9	E23 K29 A30 L31	E23-K27 HydrophobicContact CG-CD 4.18Å; E23-K27 WeakPolarHBondContact O-CB 3.38Å; E23-K27 WeakPolarHBondContact O-CG 3.37Å; E23-K27 PolarHBondContact O-N 3.48Å; E23-K27 WeakPolarHBondContact OE1-CE 3.29Å; E23-K27 IonicContact OE1-NZ 2.6Å; E23-K27 PolarHBondContact OE1-NZ 3.49Å; K27-K29 PolarHBondContact O-N 3.38Å; K27-A30 PolarHBondContact O-N 3.35Å; K27-L31 WeakPolarHBondContact O-CB 3.46Å; K27-L31 PolarHBondContact O-N 2.92Å
28	N	96.4	Very high	96.1	Very high	64 Å²	64	108.2 Å²	108.2	34%	0.342	52%	0.52	S	S	.	.	H	α-helix	trans	-64.4	-39.2	175.2	-87.7	-58.9	0	0	0	112.4	L24 Y25 L31 R32	L24-N28 WeakPolarHBondContact CD2-ND2 3.1Å; L24-N28 VanDerWaalsContact O-CB 3.29Å; L24-N28 WeakPolarHBondContact O-CB 3.21Å; L24-N28 PolarHBondContact O-N 3.19Å; L24-N28 PolarHBondContact O-ND2 3.41Å; Y25-N28 PolarHBondContact O-N 2.92Å; N28-L31 PolarHBondContact O-N 2.86Å; N28-R32 VanDerWaalsContact O-CG 3.29Å; N28-R32 WeakPolarHBondContact O-CG 3.44Å; N28-R32 PolarHBondContact O-N 2.99Å
29	K	96.6	Very high	96.3	Very high	126 Å²	126	108.2 Å²	108.2	55%	0.548	52%	0.519	S	S	.	.	H	α-helix	trans	-63.7	-45.2	175.4	-173.6	177.8	179.9	179.1	0	111.4	Y25 Y26 K27 R32 S33	Y25-K29 HydrophobicContact CE1-CD 4.32Å; Y25-K29 WeakPolarHBondContact O-CB 3.36Å; Y25-K29 PolarHBondContact O-N 2.87Å; Y26-K29 PolarHBondContact O-N 3.27Å; K27-K29 PolarHBondContact O-N 3.38Å; K29-R32 PolarHBondContact O-N 3.33Å; K29-S33 PolarHBondContact O-N 2.88Å
30	A	96.3	Very high	96.6	Very high	55 Å²	55	108.7 Å²	108.7	46%	0.455	52%	0.516	S	S	.	.	H	α-helix	trans	-61.5	-45.1	174.9	0	0	0	0	0	111.5	Y26 K27 R32 S33 Q34	Y26-A30 WeakPolarHBondContact O-CB 3.16Å; Y26-A30 PolarHBondContact O-N 3.37Å; K27-A30 PolarHBondContact O-N 3.35Å; A30-R32 PolarHBondContact O-N 3.24Å; A30-S33 PolarHBondContact O-N 3.46Å; A30-Q34 WeakPolarHBondContact O-CG 3.4Å; A30-Q34 PolarHBondContact O-N 2.87Å
31	L	97.6	Very high	96.8	Very high	87 Å²	87	108.2 Å²	108.2	46%	0.455	51%	0.513	S	S	.	.	H	α-helix	trans	-59.7	-44	176.6	179.4	62.4	0	0	0	112.1	K27 N28 Q34 K35	K27-L31 WeakPolarHBondContact O-CB 3.46Å; K27-L31 PolarHBondContact O-N 2.92Å; N28-L31 PolarHBondContact O-N 2.86Å; L31-Q34 PolarHBondContact O-N 3.43Å; L31-K35 HydrophobicContact CD1-CG 4.41Å; L31-K35 HydrophobicContact CG-CD 4.36Å; L31-K35 WeakPolarHBondContact O-CB 3.36Å; L31-K35 WeakPolarHBondContact O-CG 3.23Å; L31-K35 PolarHBondContact O-N 3.03Å
32	R	97.1	Very high	97	Very high	182 Å²	182	107.1 Å²	107.1	69%	0.687	51%	0.508	S	S	*	.	H	α-helix	trans	-61.1	-44.6	175.8	-73.3	174	-170.7	-178.6	3.9	111.5	N28 K29 A30 Q34 K35 Q36	N28-R32 VanDerWaalsContact O-CG 3.29Å; N28-R32 WeakPolarHBondContact O-CG 3.44Å; N28-R32 PolarHBondContact O-N 2.99Å; K29-R32 PolarHBondContact O-N 3.33Å; A30-R32 PolarHBondContact O-N 3.24Å; R32-Q34 PolarHBondContact O-N 3.14Å; R32-K35 PolarHBondContact O-N 3.03Å; R32-Q36 PolarHBondContact O-N 3.37Å
33	S	96.8	Very high	97.1	Very high	70 Å²	70	107.4 Å²	107.4	49%	0.49	51%	0.509	S	S	.	.	H	α-helix	trans	-61.3	-43.3	176.6	178.6	0	0	0	0	112.1	K29 A30 Q36 K37	K29-S33 PolarHBondContact O-N 2.88Å; A30-S33 PolarHBondContact O-N 3.46Å; S33-Q36 PolarHBondContact O-N 3.36Å; S33-K37 PolarHBondContact O-N 3.29Å
34	Q	97.2	Very high	97.3	Very high	108 Å²	108	108.4 Å²	108.4	51%	0.505	51%	0.513	S	S	.	.	H	α-helix	trans	-67.4	-40.2	176.5	-64.7	-56.3	-25.6	0	0	112.3	A30 L31 R32 Q36 K37 V38	A30-Q34 WeakPolarHBondContact O-CG 3.4Å; A30-Q34 PolarHBondContact O-N 2.87Å; L31-Q34 PolarHBondContact O-N 3.43Å; R32-Q34 PolarHBondContact O-N 3.14Å; Q34-Q36 VanDerWaalsContact C-N 3.31Å; Q34-Q36 PolarHBondContact O-N 3.15Å; Q34-K37 PolarHBondContact O-N 3.43Å; Q34-V38 WeakPolarHBondContact O-CG2 3.49Å; Q34-V38 PolarHBondContact O-N 3.45Å
35	K	97.6	Very high	97.3	Very high	136 Å²	136	108.2 Å²	108.2	59%	0.591	51%	0.512	S	S	*	.	H	α-helix	trans	-60	-41.5	174	-77	-179	176.9	-175	0	112	L31 R32 V38 H39	L31-K35 HydrophobicContact CD1-CG 4.41Å; L31-K35 HydrophobicContact CG-CD 4.36Å; L31-K35 WeakPolarHBondContact O-CB 3.36Å; L31-K35 WeakPolarHBondContact O-CG 3.23Å; L31-K35 PolarHBondContact O-N 3.03Å; R32-K35 PolarHBondContact O-N 3.03Å; K35-V38 PolarHBondContact O-N 2.87Å; K35-H39 WeakPolarHBondContact O-CB 3.35Å; K35-H39 PolarHBondContact O-N 3.38Å
36	Q	97.6	Very high	97.4	Very high	121 Å²	121	108.8 Å²	108.8	57%	0.565	52%	0.518	S	S	*	.	H	α-helix	trans	-62.8	-47	175	-179	178.8	-11.3	0	0	111.1	R32 S33 Q34 V38 H39 E40	R32-Q36 PolarHBondContact O-N 3.37Å; S33-Q36 PolarHBondContact O-N 3.36Å; Q34-Q36 VanDerWaalsContact C-N 3.31Å; Q34-Q36 PolarHBondContact O-N 3.15Å; Q36-V38 VanDerWaalsContact C-N 3.34Å; Q36-V38 PolarHBondContact O-N 3.21Å; Q36-H39 WeakPolarHBondContact O-CB 3.46Å; Q36-H39 PolarHBondContact O-N 3.3Å; Q36-H39 VanDerWaalsContact O-N 3.1Å; Q36-E40 WeakPolarHBondContact CG-OE1 3.45Å; Q36-E40 PolarHBondContact NE2-OE1 3.5Å; Q36-E40 WeakPolarHBondContact O-CG 3.31Å; Q36-E40 PolarHBondContact O-N 3.46Å
37	K	97.7	Very high	97.5	Very high	116 Å²	116	105.4 Å²	105.4	50%	0.504	51%	0.51	S	S	.	.	H	α-helix	trans	-60.4	-41.8	177.3	-172.7	174.6	-176.7	177.7	0	112.6	S33 Q34 H39 E40 L41	S33-K37 PolarHBondContact O-N 3.29Å; Q34-K37 PolarHBondContact O-N 3.43Å; K37-H39 VanDerWaalsContact C-N 3.31Å; K37-H39 PolarHBondContact O-N 2.93Å; K37-E40 PolarHBondContact O-N 3.42Å; K37-L41 HydrophobicContact CG-CD1 4.25Å; K37-L41 WeakPolarHBondContact O-CB 3.44Å; K37-L41 VanDerWaalsContact O-CG 3.31Å; K37-L41 WeakPolarHBondContact O-CG 3.35Å; K37-L41 PolarHBondContact O-N 3.26Å
38	V	97.9	Very high	97.5	Very high	76 Å²	76	101.8 Å²	101.8	46%	0.461	50%	0.498	S	S	.	.	H	α-helix	trans	-61.8	-41.7	174.7	169	0	0	0	0	110.6	Q34 K35 Q36 L41 Q42	Q34-V38 WeakPolarHBondContact O-CG2 3.49Å; Q34-V38 PolarHBondContact O-N 3.45Å; K35-V38 PolarHBondContact O-N 2.87Å; Q36-V38 VanDerWaalsContact C-N 3.34Å; Q36-V38 PolarHBondContact O-N 3.21Å; V38-L41 PolarHBondContact O-N 3.12Å; V38-Q42 HydrophobicContact CG1-CG 4.45Å; V38-Q42 WeakPolarHBondContact O-CB 3.29Å; V38-Q42 VanDerWaalsContact O-CG 3.23Å; V38-Q42 WeakPolarHBondContact O-CG 3.34Å; V38-Q42 PolarHBondContact O-N 2.91Å
39	H	97.9	Very high	97.6	Very high	109 Å²	109	104.1 Å²	104.1	51%	0.505	51%	0.507	S	S	.	.	H	α-helix	trans	-64.7	-43.2	176.9	-174.6	58.7	0	0	0	112.5	K35 Q36 K37 Q42 I43	K35-H39 WeakPolarHBondContact O-CB 3.35Å; K35-H39 PolarHBondContact O-N 3.38Å; Q36-H39 WeakPolarHBondContact O-CB 3.46Å; Q36-H39 PolarHBondContact O-N 3.3Å; Q36-H39 VanDerWaalsContact O-N 3.1Å; K37-H39 VanDerWaalsContact C-N 3.31Å; K37-H39 PolarHBondContact O-N 2.93Å; H39-Q42 WeakPolarHBondContact O-CB 3.29Å; H39-Q42 PolarHBondContact O-N 3.42Å; H39-I43 WeakPolarHBondContact O-CG1 3.31Å; H39-I43 PolarHBondContact O-N 3Å
40	E	97.7	Very high	97.7	Very high	99 Å²	99	101.6 Å²	101.6	46%	0.463	51%	0.505	S	S	.	.	H	α-helix	trans	-60.3	-46.6	175.2	-72.2	169.1	-171.8	0	0	111.4	Q36 K37 Q42 I43 E44	Q36-E40 WeakPolarHBondContact CG-OE1 3.45Å; Q36-E40 PolarHBondContact NE2-OE1 3.5Å; Q36-E40 WeakPolarHBondContact O-CG 3.31Å; Q36-E40 PolarHBondContact O-N 3.46Å; K37-E40 PolarHBondContact O-N 3.42Å; E40-Q42 VanDerWaalsContact C-N 3.33Å; E40-Q42 PolarHBondContact O-N 2.94Å; E40-I43 WeakPolarHBondContact O-CB 3.42Å; E40-I43 PolarHBondContact O-N 3.46Å; E40-E44 PolarHBondContact O-N 3.46Å
41	L	98	Very high	97.8	Very high	80 Å²	80	102.5 Å²	102.5	42%	0.419	50%	0.5	S	S	.	.	H	α-helix	trans	-64.3	-35.9	176.2	-70.4	171.3	0	0	0	112.6	K37 V38 I43 E44 I45	K37-L41 HydrophobicContact CG-CD1 4.25Å; K37-L41 WeakPolarHBondContact O-CB 3.44Å; K37-L41 VanDerWaalsContact O-CG 3.31Å; K37-L41 WeakPolarHBondContact O-CG 3.35Å; K37-L41 PolarHBondContact O-N 3.26Å; V38-L41 PolarHBondContact O-N 3.12Å; L41-I43 VanDerWaalsContact C-N 3.32Å; L41-E44 PolarHBondContact O-N 2.85Å; L41-I45 WeakPolarHBondContact O-CB 3.46Å; L41-I45 VanDerWaalsContact O-CG1 3.25Å; L41-I45 WeakPolarHBondContact O-CG1 3.45Å; L41-I45 PolarHBondContact O-N 2.98Å
42	Q	98.2	Very high	97.8	Very high	114 Å²	114	105 Å²	105	53%	0.533	51%	0.508	S	S	.	.	H	α-helix	trans	-64.3	-38.3	174.6	-77.9	172.7	-14	0	0	112	V38 H39 E40 K46	V38-Q42 HydrophobicContact CG1-CG 4.45Å; V38-Q42 WeakPolarHBondContact O-CB 3.29Å; V38-Q42 VanDerWaalsContact O-CG 3.23Å; V38-Q42 WeakPolarHBondContact O-CG 3.34Å; V38-Q42 PolarHBondContact O-N 2.91Å; H39-Q42 WeakPolarHBondContact O-CB 3.29Å; H39-Q42 PolarHBondContact O-N 3.42Å; E40-Q42 VanDerWaalsContact C-N 3.33Å; E40-Q42 PolarHBondContact O-N 2.94Å; Q42-K46 WeakPolarHBondContact O-CB 3.32Å; Q42-K46 PolarHBondContact O-N 3.46Å; Q42-K46 VanDerWaalsContact O-N 3.12Å
43	I	97.9	Very high	97.9	Very high	95 Å²	95	102.6 Å²	102.6	49%	0.487	50%	0.504	S	S	.	.	H	α-helix	trans	-65.7	-45.7	174.2	-67.1	166.3	0	0	0	110	H39 E40 L41 I45 K46 D47	H39-I43 WeakPolarHBondContact O-CG1 3.31Å; H39-I43 PolarHBondContact O-N 3Å; E40-I43 WeakPolarHBondContact O-CB 3.42Å; E40-I43 PolarHBondContact O-N 3.46Å; L41-I43 VanDerWaalsContact C-N 3.32Å; I43-I45 PolarHBondContact O-N 3.43Å; I43-K46 WeakPolarHBondContact O-CB 3.37Å; I43-K46 PolarHBondContact O-N 3.02Å; I43-K46 VanDerWaalsContact O-N 3.17Å; I43-D47 WeakPolarHBondContact O-CB 3.49Å; I43-D47 PolarHBondContact O-N 3.43Å
44	E	97.8	Very high	97.9	Very high	116 Å²	116	104.1 Å²	104.1	54%	0.542	50%	0.504	S	S	.	.	H	α-helix	trans	-60.6	-44.3	178.1	-174.2	177	-174.6	0	0	111.9	E40 L41 K46 D47 V48	E40-E44 PolarHBondContact O-N 3.46Å; L41-E44 PolarHBondContact O-N 2.85Å; E44-K46 VanDerWaalsContact C-N 3.29Å; E44-K46 PolarHBondContact O-N 2.88Å; E44-D47 PolarHBondContact O-N 2.9Å; E44-V48 WeakPolarHBondContact O-CB 3.48Å; E44-V48 VanDerWaalsContact O-CG2 3.3Å; E44-V48 WeakPolarHBondContact O-CG2 3.4Å; E44-V48 PolarHBondContact O-N 3.24Å
45	I	98.1	Very high	98	Very high	96 Å²	96	102.6 Å²	102.6	49%	0.492	50%	0.499	S	S	.	.	H	α-helix	trans	-58.2	-44.3	174.9	-71.9	166.6	0	0	0	110.7	L41 I43 Q49	L41-I45 WeakPolarHBondContact O-CB 3.46Å; L41-I45 VanDerWaalsContact O-CG1 3.25Å; L41-I45 WeakPolarHBondContact O-CG1 3.45Å; L41-I45 PolarHBondContact O-N 2.98Å; I43-I45 PolarHBondContact O-N 3.43Å; I45-Q49 HydrophobicContact CG2-CG 4.45Å; I45-Q49 WeakPolarHBondContact O-CB 3.3Å; I45-Q49 VanDerWaalsContact O-CG 3.23Å; I45-Q49 WeakPolarHBondContact O-CG 3.23Å; I45-Q49 PolarHBondContact O-N 3.05Å
46	K	98.1	Very high	98	Very high	153 Å²	153	104.3 Å²	104.3	67%	0.665	50%	0.502	S	S	*	.	H	α-helix	trans	-65.7	-41.2	179.3	-176.4	-177.8	175.9	-175.8	0	111.9	Q42 I43 E44 Q49 S50	Q42-K46 WeakPolarHBondContact O-CB 3.32Å; Q42-K46 PolarHBondContact O-N 3.46Å; Q42-K46 VanDerWaalsContact O-N 3.12Å; I43-K46 WeakPolarHBondContact O-CB 3.37Å; I43-K46 PolarHBondContact O-N 3.02Å; I43-K46 VanDerWaalsContact O-N 3.17Å; E44-K46 VanDerWaalsContact C-N 3.29Å; E44-K46 PolarHBondContact O-N 2.88Å; K46-Q49 PolarHBondContact O-N 3.35Å; K46-S50 PolarHBondContact O-N 2.87Å
47	D	97.9	Very high	98	Very high	80 Å²	80	101.4 Å²	101.4	43%	0.428	50%	0.495	S	S	.	.	H	α-helix	trans	-61.2	-51	177	-169.4	47	0	0	0	110.5	I43 E44 Q49 S50 E51	I43-D47 WeakPolarHBondContact O-CB 3.49Å; I43-D47 PolarHBondContact O-N 3.43Å; E44-D47 PolarHBondContact O-N 2.9Å; D47-Q49 VanDerWaalsContact C-N 3.33Å; D47-Q49 PolarHBondContact O-N 3.5Å; D47-S50 WeakPolarHBondContact O-CB 3.43Å; D47-S50 PolarHBondContact O-N 3.36Å; D47-S50 VanDerWaalsContact O-N 3.08Å; D47-E51 PolarHBondContact O-N 3.36Å
48	V	98.2	Very high	98.1	Very high	54 Å²	54	99.7 Å²	99.7	33%	0.327	49%	0.491	S	S	.	.	H	α-helix	trans	-59.5	-41.7	176.9	169.5	0	0	0	0	111.8	E44 S50 E51 F52	E44-V48 WeakPolarHBondContact O-CB 3.48Å; E44-V48 VanDerWaalsContact O-CG2 3.3Å; E44-V48 WeakPolarHBondContact O-CG2 3.4Å; E44-V48 PolarHBondContact O-N 3.24Å; V48-S50 PolarHBondContact O-N 2.95Å; V48-E51 PolarHBondContact O-N 3.33Å; V48-F52 HydrophobicContact CG1-CD2 3.57Å; V48-F52 HydrophobicContact CG1-CE2 3.27Å; V48-F52 HydrophobicContact CG1-CZ 4.37Å; V48-F52 WeakPolarHBondContact O-CD2 3.49Å; V48-F52 PolarHBondContact O-N 2.89Å
49	Q	98.3	Very high	98.1	Very high	113 Å²	113	103.7 Å²	103.7	53%	0.528	50%	0.499	S	S	.	.	H	α-helix	trans	-62.1	-42.1	174.9	-77.2	174.1	-13.3	0	0	112.1	I45 K46 D47 F52 E53	I45-Q49 HydrophobicContact CG2-CG 4.45Å; I45-Q49 WeakPolarHBondContact O-CB 3.3Å; I45-Q49 VanDerWaalsContact O-CG 3.23Å; I45-Q49 WeakPolarHBondContact O-CG 3.23Å; I45-Q49 PolarHBondContact O-N 3.05Å; K46-Q49 PolarHBondContact O-N 3.35Å; D47-Q49 VanDerWaalsContact C-N 3.33Å; D47-Q49 PolarHBondContact O-N 3.5Å; Q49-F52 PolarHBondContact O-N 3.14Å; Q49-E53 WeakPolarHBondContact O-CG 3.49Å; Q49-E53 PolarHBondContact O-N 3.18Å
50	S	97.8	Very high	98.1	Very high	73 Å²	73	101.9 Å²	101.9	51%	0.51	49%	0.493	S	S	.	.	H	α-helix	trans	-65.3	-40.3	176	-169.6	0	0	0	0	112	K46 D47 V48 E53 Q54	K46-S50 PolarHBondContact O-N 2.87Å; D47-S50 WeakPolarHBondContact O-CB 3.43Å; D47-S50 PolarHBondContact O-N 3.36Å; D47-S50 VanDerWaalsContact O-N 3.08Å; V48-S50 PolarHBondContact O-N 2.95Å; S50-E53 PolarHBondContact O-N 3.39Å; S50-Q54 WeakPolarHBondContact O-CB 3.25Å; S50-Q54 PolarHBondContact O-N 3.37Å
51	E	98.1	Very high	98.2	Very high	75 Å²	75	101.9 Å²	101.9	35%	0.35	49%	0.493	S	S	.	.	H	α-helix	trans	-59.6	-47.8	173.3	-72.1	-176.2	164.8	0	0	110.3	D47 V48 E53 Q54 D55 R179	D47-E51 PolarHBondContact O-N 3.36Å; V48-E51 PolarHBondContact O-N 3.33Å; E51-E53 PolarHBondContact O-N 3.24Å; E51-Q54 PolarHBondContact O-N 3.49Å; E51-D55 PolarHBondContact O-N 3.16Å; E51-R179 IonicContact OE1-CZ 3.54Å; E51-R179 IonicContact OE1-NH1 2.9Å; E51-R179 PolarHBondContact OE1-NH1 3.12Å; E51-R179 IonicContact OE1-NH2 3.26Å; E51-R179 PolarHBondContact OE1-NH2 3.29Å; E51-R179 IonicContact OE2-NH1 3.83Å
52	F	98.2	Very high	98.2	Very high	139 Å²	139	100.3 Å²	100.3	61%	0.61	49%	0.487	S	S	*	.	H	α-helix	trans	-62.7	-38.7	178.3	-80.8	-59.1	0	0	0	113.8	V48 Q49 R56	V48-F52 HydrophobicContact CG1-CD2 3.57Å; V48-F52 HydrophobicContact CG1-CE2 3.27Å; V48-F52 HydrophobicContact CG1-CZ 4.37Å; V48-F52 WeakPolarHBondContact O-CD2 3.49Å; V48-F52 PolarHBondContact O-N 2.89Å; Q49-F52 PolarHBondContact O-N 3.14Å; F52-R56 VanDerWaalsContact O-CB 3.24Å; F52-R56 WeakPolarHBondContact O-CB 3.39Å; F52-R56 PolarHBondContact O-N 3.22Å
53	E	98.2	Very high	98.2	Very high	131 Å²	131	98.6 Å²	98.6	61%	0.612	48%	0.48	S	S	*	.	H	α-helix	trans	-67.3	-37.6	176.6	-75	-179.7	-173.6	0	0	112.2	Q49 S50 E51 S57	Q49-E53 WeakPolarHBondContact O-CG 3.49Å; Q49-E53 PolarHBondContact O-N 3.18Å; S50-E53 PolarHBondContact O-N 3.39Å; E51-E53 PolarHBondContact O-N 3.24Å; E53-S57 PolarHBondContact O-N 3.26Å; E53-S57 PolarHBondContact O-OG 3.45Å
54	Q	98.1	Very high	98.2	Very high	102 Å²	102	99.8 Å²	99.8	48%	0.477	48%	0.479	S	S	.	.	H	α-helix	trans	-65.6	-51.5	174.7	-178.8	57.5	43.8	0	0	110.9	S50 E51 R56 S57 D58	S50-Q54 WeakPolarHBondContact O-CB 3.25Å; S50-Q54 PolarHBondContact O-N 3.37Å; E51-Q54 PolarHBondContact O-N 3.49Å; Q54-R56 VanDerWaalsContact C-N 3.3Å; Q54-R56 PolarHBondContact O-N 3.34Å; Q54-S57 WeakPolarHBondContact O-CA 3.3Å; Q54-S57 WeakPolarHBondContact O-CB 3.49Å; Q54-S57 PolarHBondContact O-N 2.86Å; Q54-D58 VanDerWaalsContact NE2-CG 3.29Å; Q54-D58 PolarHBondContact NE2-OD1 2.88Å; Q54-D58 PolarHBondContact NE2-OD2 3.1Å; Q54-D58 PolarHBondContact O-N 3.38Å
55	D	98.4	Very high	98.3	Very high	76 Å²	76	101.6 Å²	101.6	41%	0.406	48%	0.481	S	S	.	.	H	α-helix	trans	-57.8	-43.6	178	-76.2	-10	0	0	0	111.5	E51 S57 D58 Y59	E51-D55 PolarHBondContact O-N 3.16Å; D55-S57 VanDerWaalsContact C-N 3.28Å; D55-S57 PolarHBondContact O-N 3.14Å; D55-D58 PolarHBondContact O-N 3.49Å; D55-Y59 HydrophobicContact CB-CD2 4.5Å; D55-Y59 HydrophobicContact CB-CE2 4.23Å; D55-Y59 WeakPolarHBondContact O-CD2 3.49Å; D55-Y59 PolarHBondContact O-N 2.98Å
56	R	98.4	Very high	98.3	Very high	172 Å²	172	101.8 Å²	101.8	65%	0.649	48%	0.479	S	S	*	.	H	α-helix	trans	-57.7	-42.7	174.4	178	-179.5	170.8	-131.1	-3.4	111.4	F52 Q54 L60	F52-R56 VanDerWaalsContact O-CB 3.24Å; F52-R56 WeakPolarHBondContact O-CB 3.39Å; F52-R56 PolarHBondContact O-N 3.22Å; Q54-R56 VanDerWaalsContact C-N 3.3Å; Q54-R56 PolarHBondContact O-N 3.34Å; R56-L60 HydrophobicContact CG-CD1 4.39Å; R56-L60 VanDerWaalsContact O-CG 3.28Å; R56-L60 WeakPolarHBondContact O-CG 3.29Å; R56-L60 PolarHBondContact O-N 3.01Å; R56-L60 VanDerWaalsContact O-N 3.08Å
57	S	97.9	Very high	98.3	Very high	61 Å²	61	99.6 Å²	99.6	43%	0.427	47%	0.471	S	S	.	.	H	α-helix	trans	-66	-41.1	178.5	-59.9	0	0	0	0	111.6	E53 Q54 D55 L60 E61	E53-S57 PolarHBondContact O-N 3.26Å; E53-S57 PolarHBondContact O-OG 3.45Å; Q54-S57 WeakPolarHBondContact O-CA 3.3Å; Q54-S57 WeakPolarHBondContact O-CB 3.49Å; Q54-S57 PolarHBondContact O-N 2.86Å; D55-S57 VanDerWaalsContact C-N 3.28Å; D55-S57 PolarHBondContact O-N 3.14Å; S57-L60 PolarHBondContact O-N 2.96Å; S57-E61 PolarHBondContact O-N 3.45Å
58	D	98.4	Very high	98.3	Very high	79 Å²	79	101.9 Å²	101.9	42%	0.422	48%	0.48	S	S	.	.	H	α-helix	trans	-68.5	-37.7	178.5	-69.1	-24.7	0	0	0	112.6	Q54 D55 E61 T62	Q54-D58 VanDerWaalsContact NE2-CG 3.29Å; Q54-D58 PolarHBondContact NE2-OD1 2.88Å; Q54-D58 PolarHBondContact NE2-OD2 3.1Å; Q54-D58 PolarHBondContact O-N 3.38Å; D55-D58 PolarHBondContact O-N 3.49Å; D58-E61 PolarHBondContact O-N 2.92Å; D58-T62 WeakPolarHBondContact O-CB 3.3Å; D58-T62 PolarHBondContact O-N 2.85Å; D58-T62 PolarHBondContact O-OG1 2.96Å
59	Y	98.5	Very high	98.3	Very high	161 Å²	161	104.9 Å²	104.9	63%	0.631	49%	0.49	S	S	*	.	H	α-helix	trans	-64	-44.7	171.7	-73.2	-51.2	0	0	0	111.8	D55 E61 T62 I63	D55-Y59 HydrophobicContact CB-CD2 4.5Å; D55-Y59 HydrophobicContact CB-CE2 4.23Å; D55-Y59 WeakPolarHBondContact O-CD2 3.49Å; D55-Y59 PolarHBondContact O-N 2.98Å; Y59-E61 VanDerWaalsContact C-N 3.31Å; Y59-E61 PolarHBondContact O-N 2.86Å; Y59-T62 WeakPolarHBondContact O-CB 3.15Å; Y59-T62 PolarHBondContact O-N 2.92Å; Y59-I63 WeakPolarHBondContact O-CG1 3.09Å; Y59-I63 PolarHBondContact O-N 3.34Å
60	L	98.6	Very high	98.3	Very high	71 Å²	71	103.9 Å²	103.9	37%	0.372	49%	0.488	S	S	.	.	H	α-helix	trans	-62.2	-40	176.1	-71.7	174.3	0	0	0	111.6	R56 S57 I63 R64	R56-L60 HydrophobicContact CG-CD1 4.39Å; R56-L60 VanDerWaalsContact O-CG 3.28Å; R56-L60 WeakPolarHBondContact O-CG 3.29Å; R56-L60 PolarHBondContact O-N 3.01Å; R56-L60 VanDerWaalsContact O-N 3.08Å; S57-L60 PolarHBondContact O-N 2.96Å; L60-I63 PolarHBondContact O-N 3.19Å; L60-R64 WeakPolarHBondContact O-CG 3.38Å; L60-R64 PolarHBondContact O-N 3.41Å
61	E	98.5	Very high	98.3	Very high	98 Å²	98	105 Å²	105	46%	0.458	49%	0.488	S	S	.	.	H	α-helix	trans	-66.1	-38.6	175.7	-169.9	56	-153.6	0	0	112.2	S57 D58 Y59 I63 R64 R65	S57-E61 PolarHBondContact O-N 3.45Å; D58-E61 PolarHBondContact O-N 2.92Å; Y59-E61 VanDerWaalsContact C-N 3.31Å; Y59-E61 PolarHBondContact O-N 2.86Å; E61-I63 PolarHBondContact O-N 3.46Å; E61-R64 PolarHBondContact O-N 2.92Å; E61-R64 IonicContact OE2-CZ 3.45Å; E61-R64 IonicContact OE2-NH1 2.68Å; E61-R64 PolarHBondContact OE2-NH1 3.3Å; E61-R65 WeakPolarHBondContact O-CB 3.23Å; E61-R65 PolarHBondContact O-N 3.43Å
62	T	98.6	Very high	98.4	Very high	48 Å²	48	106.2 Å²	106.2	29%	0.294	50%	0.496	S	S	.	.	H	α-helix	trans	-60.9	-44.5	173.9	-62.3	0	0	0	0	111.5	D58 Y59 R65 Q66	D58-T62 WeakPolarHBondContact O-CB 3.3Å; D58-T62 PolarHBondContact O-N 2.85Å; D58-T62 PolarHBondContact O-OG1 2.96Å; Y59-T62 WeakPolarHBondContact O-CB 3.15Å; Y59-T62 PolarHBondContact O-N 2.92Å; T62-R65 PolarHBondContact O-N 3.25Å; T62-Q66 HydrophobicContact CG2-CG 4.4Å; T62-Q66 WeakPolarHBondContact O-CB 3.42Å; T62-Q66 VanDerWaalsContact O-CG 3.25Å; T62-Q66 WeakPolarHBondContact O-CG 3.5Å; T62-Q66 PolarHBondContact O-N 3.38Å
63	I	98.4	Very high	98.3	Very high	78 Å²	78	104.2 Å²	104.2	40%	0.4	49%	0.491	S	S	.	.	H	α-helix	trans	-61.4	-48.4	176.1	-67.9	166	0	0	0	110.3	Y59 L60 E61 R65 Q66 E67	Y59-I63 WeakPolarHBondContact O-CG1 3.09Å; Y59-I63 PolarHBondContact O-N 3.34Å; L60-I63 PolarHBondContact O-N 3.19Å; E61-I63 PolarHBondContact O-N 3.46Å; I63-R65 VanDerWaalsContact C-N 3.32Å; I63-R65 PolarHBondContact O-N 3.27Å; I63-Q66 PolarHBondContact O-N 3.37Å; I63-Q66 VanDerWaalsContact O-N 3.15Å; I63-E67 HydrophobicContact CG2-CG 4.23Å; I63-E67 WeakPolarHBondContact O-CB 3.27Å; I63-E67 WeakPolarHBondContact O-CG 3.49Å; I63-E67 PolarHBondContact O-N 3.01Å
64	R	98.5	Very high	98.2	Very high	120 Å²	120	101 Å²	101	45%	0.453	48%	0.478	S	S	.	.	H	α-helix	trans	-56.9	-45.3	177.4	-70.8	177.4	-162.6	125.2	3.8	112	L60 E61 E67 Q68	L60-R64 WeakPolarHBondContact O-CG 3.38Å; L60-R64 PolarHBondContact O-N 3.41Å; E61-R64 PolarHBondContact O-N 2.92Å; E61-R64 IonicContact OE2-CZ 3.45Å; E61-R64 IonicContact OE2-NH1 2.68Å; E61-R64 PolarHBondContact OE2-NH1 3.3Å; R64-E67 PolarHBondContact O-N 2.96Å; R64-Q68 VanDerWaalsContact O-CG 3.26Å; R64-Q68 WeakPolarHBondContact O-CG 3.39Å; R64-Q68 PolarHBondContact O-N 3.04Å
65	R	98.5	Very high	98.2	Very high	154 Å²	154	101.9 Å²	101.9	58%	0.581	48%	0.484	S	S	*	.	H	α-helix	trans	-64.1	-41.4	177.7	-174.5	-179.4	64.2	167.8	-2.7	111.8	E61 T62 I63 Q68 Q69	E61-R65 WeakPolarHBondContact O-CB 3.23Å; E61-R65 PolarHBondContact O-N 3.43Å; T62-R65 PolarHBondContact O-N 3.25Å; I63-R65 VanDerWaalsContact C-N 3.32Å; I63-R65 PolarHBondContact O-N 3.27Å; R65-Q68 PolarHBondContact O-N 2.89Å; R65-Q69 WeakPolarHBondContact O-CB 3.48Å; R65-Q69 PolarHBondContact O-N 3.12Å
66	Q	98.6	Very high	98.2	Very high	99 Å²	99	102.4 Å²	102.4	46%	0.463	49%	0.486	S	S	.	.	H	α-helix	trans	-64.8	-43.7	175.9	-75.1	172	-16.9	0	0	111.6	T62 I63 Q68 Q69 I70	T62-Q66 HydrophobicContact CG2-CG 4.4Å; T62-Q66 WeakPolarHBondContact O-CB 3.42Å; T62-Q66 VanDerWaalsContact O-CG 3.25Å; T62-Q66 WeakPolarHBondContact O-CG 3.5Å; T62-Q66 PolarHBondContact O-N 3.38Å; I63-Q66 PolarHBondContact O-N 3.37Å; I63-Q66 VanDerWaalsContact O-N 3.15Å; Q66-Q68 PolarHBondContact O-N 2.94Å; Q66-Q69 PolarHBondContact O-N 3.06Å; Q66-I70 WeakPolarHBondContact O-CB 3.3Å; Q66-I70 VanDerWaalsContact O-CG1 3.27Å; Q66-I70 WeakPolarHBondContact O-CG1 3.41Å; Q66-I70 PolarHBondContact O-N 3.03Å
67	E	98.5	Very high	98	Very high	107 Å²	107	97.2 Å²	97.2	50%	0.5	47%	0.47	S	S	.	.	H	α-helix	trans	-60.4	-44.2	175.3	-73.3	175.7	160.2	0	0	111.5	I63 R64 Q69 I70 N71	I63-E67 HydrophobicContact CG2-CG 4.23Å; I63-E67 WeakPolarHBondContact O-CB 3.27Å; I63-E67 WeakPolarHBondContact O-CG 3.49Å; I63-E67 PolarHBondContact O-N 3.01Å; R64-E67 PolarHBondContact O-N 2.96Å; E67-Q69 VanDerWaalsContact C-N 3.33Å; E67-Q69 PolarHBondContact O-N 3.46Å; E67-I70 PolarHBondContact O-N 3.2Å; E67-N71 WeakPolarHBondContact O-CB 3.35Å; E67-N71 PolarHBondContact O-N 2.9Å; E67-N71 PolarHBondContact O-ND2 3.3Å
68	Q	98.3	Very high	97.8	Very high	129 Å²	129	101 Å²	101	60%	0.603	48%	0.481	S	S	*	.	H	α-helix	trans	-58.8	-44.2	173.6	-73	171.8	10.1	0	0	111.8	R64 R65 Q66 N71 L72	R64-Q68 VanDerWaalsContact O-CG 3.26Å; R64-Q68 WeakPolarHBondContact O-CG 3.39Å; R64-Q68 PolarHBondContact O-N 3.04Å; R65-Q68 PolarHBondContact O-N 2.89Å; Q66-Q68 PolarHBondContact O-N 2.94Å; Q68-N71 PolarHBondContact O-N 2.87Å; Q68-L72 PolarHBondContact O-N 3.08Å
69	Q	98.4	Very high	97.7	Very high	116 Å²	116	105 Å²	105	54%	0.542	50%	0.495	S	S	.	.	H	α-helix	trans	-65.6	-42.9	177.7	-174.3	177.1	-2.1	0	0	112	R65 Q66 E67 N71 L72 L73	R65-Q69 WeakPolarHBondContact O-CB 3.48Å; R65-Q69 PolarHBondContact O-N 3.12Å; Q66-Q69 PolarHBondContact O-N 3.06Å; E67-Q69 VanDerWaalsContact C-N 3.33Å; E67-Q69 PolarHBondContact O-N 3.46Å; Q69-N71 VanDerWaalsContact C-N 3.33Å; Q69-N71 PolarHBondContact O-N 2.84Å; Q69-L72 PolarHBondContact O-N 3.18Å; Q69-L73 HydrophobicContact CG-CD1 4.31Å; Q69-L73 WeakPolarHBondContact O-CG 3.28Å; Q69-L73 PolarHBondContact O-N 3.36Å
70	I	98	Very high	97.4	Very high	93 Å²	93	100.8 Å²	100.8	48%	0.477	49%	0.486	S	S	.	.	H	α-helix	trans	-61.2	-43.6	175.6	-70.6	164.3	0	0	0	110.3	Q66 E67 L73 N74	Q66-I70 WeakPolarHBondContact O-CB 3.3Å; Q66-I70 VanDerWaalsContact O-CG1 3.27Å; Q66-I70 WeakPolarHBondContact O-CG1 3.41Å; Q66-I70 PolarHBondContact O-N 3.03Å; E67-I70 PolarHBondContact O-N 3.2Å; I70-L73 PolarHBondContact O-N 2.88Å; I70-N74 WeakPolarHBondContact O-CB 3.24Å; I70-N74 PolarHBondContact O-N 3.48Å; I70-N74 PolarHBondContact O-ND2 3.26Å
71	N	98.3	Very high	97.1	Very high	96 Å²	96	100.4 Å²	100.4	51%	0.513	48%	0.482	S	S	.	.	H	α-helix	trans	-61.8	-45.2	177.1	-71.9	-21.8	0	0	0	111.7	E67 Q68 Q69 L73 N74 M75	E67-N71 WeakPolarHBondContact O-CB 3.35Å; E67-N71 PolarHBondContact O-N 2.9Å; E67-N71 PolarHBondContact O-ND2 3.3Å; Q68-N71 PolarHBondContact O-N 2.87Å; Q69-N71 VanDerWaalsContact C-N 3.33Å; Q69-N71 PolarHBondContact O-N 2.84Å; N71-L73 PolarHBondContact O-N 3.17Å; N71-N74 PolarHBondContact O-N 2.92Å; N71-M75 WeakPolarHBondContact O-CG 3.41Å; N71-M75 PolarHBondContact O-N 3.34Å
72	L	98.4	Very high	96.7	Very high	101 Å²	101	99.1 Å²	99.1	53%	0.529	48%	0.482	S	S	.	.	H	α-helix	trans	-59	-47.3	174.7	176	63.8	0	0	0	111.7	Q68 Q69 N74 M75 I76	Q68-L72 PolarHBondContact O-N 3.08Å; Q69-L72 PolarHBondContact O-N 3.18Å; L72-N74 VanDerWaalsContact C-N 3.34Å; L72-N74 PolarHBondContact O-N 3.43Å; L72-M75 PolarHBondContact O-N 3.5Å; L72-I76 HydrophobicContact CD1-CD1 4.1Å; L72-I76 HydrophobicContact CD1-CG1 4.39Å; L72-I76 HydrophobicContact CG-CD1 3.99Å; L72-I76 WeakPolarHBondContact O-CG1 3.06Å; L72-I76 PolarHBondContact O-N 3.15Å
73	L	97.5	Very high	96.4	Very high	97 Å²	97	105.1 Å²	105.1	51%	0.508	51%	0.505	S	S	.	.	H	α-helix	trans	-62.2	-40.4	178.4	-71.7	173.1	0	0	0	111.9	Q69 I70 N71 I76 L77	Q69-L73 HydrophobicContact CG-CD1 4.31Å; Q69-L73 WeakPolarHBondContact O-CG 3.28Å; Q69-L73 PolarHBondContact O-N 3.36Å; I70-L73 PolarHBondContact O-N 2.88Å; N71-L73 PolarHBondContact O-N 3.17Å; L73-I76 PolarHBondContact O-N 3.26Å; L73-L77 VanDerWaalsContact O-CB 3.29Å; L73-L77 WeakPolarHBondContact O-CB 3.41Å; L73-L77 PolarHBondContact O-N 3.27Å
74	N	96.4	Very high	96.1	Very high	63 Å²	63	103.5 Å²	103.5	34%	0.337	50%	0.496	S	S	.	.	H	α-helix	trans	-62.5	-44.6	174.1	-77	-36.5	0	0	0	111.6	I70 N71 L72 I76 L77 E78	I70-N74 WeakPolarHBondContact O-CB 3.24Å; I70-N74 PolarHBondContact O-N 3.48Å; I70-N74 PolarHBondContact O-ND2 3.26Å; N71-N74 PolarHBondContact O-N 2.92Å; L72-N74 VanDerWaalsContact C-N 3.34Å; L72-N74 PolarHBondContact O-N 3.43Å; N74-I76 PolarHBondContact O-N 3.3Å; N74-L77 WeakPolarHBondContact O-CB 3.43Å; N74-L77 PolarHBondContact O-N 3.33Å; N74-E78 WeakPolarHBondContact O-CG 3.34Å; N74-E78 PolarHBondContact O-N 3.41Å
75	M	97.4	Very high	95.7	Very high	121 Å²	121	104.8 Å²	104.8	60%	0.596	50%	0.501	S	S	*	.	H	α-helix	trans	-61.5	-42.8	176.2	-71.8	-180	68.6	0	0	112.2	N71 L72 L77 E78 K79	N71-M75 WeakPolarHBondContact O-CG 3.41Å; N71-M75 PolarHBondContact O-N 3.34Å; L72-M75 PolarHBondContact O-N 3.5Å; M75-L77 VanDerWaalsContact C-N 3.35Å; M75-E78 PolarHBondContact O-N 2.94Å; M75-K79 WeakPolarHBondContact O-CG 3.39Å; M75-K79 PolarHBondContact O-N 2.99Å
76	I	97.5	Very high	95.3	Very high	86 Å²	86	104.9 Å²	104.9	44%	0.441	50%	0.502	S	S	.	.	H	α-helix	trans	-61.8	-46.4	175.4	-68.8	167.5	0	0	0	110	L72 L73 N74 E78 K79 V80	L72-I76 HydrophobicContact CD1-CD1 4.1Å; L72-I76 HydrophobicContact CD1-CG1 4.39Å; L72-I76 HydrophobicContact CG-CD1 3.99Å; L72-I76 WeakPolarHBondContact O-CG1 3.06Å; L72-I76 PolarHBondContact O-N 3.15Å; L73-I76 PolarHBondContact O-N 3.26Å; N74-I76 PolarHBondContact O-N 3.3Å; I76-E78 VanDerWaalsContact C-N 3.35Å; I76-E78 PolarHBondContact O-N 2.81Å; I76-K79 PolarHBondContact O-N 3.21Å; I76-K79 VanDerWaalsContact O-N 3.12Å; I76-V80 HydrophobicContact CG2-CG2 4.17Å; I76-V80 WeakPolarHBondContact O-CG2 3.45Å; I76-V80 PolarHBondContact O-N 2.88Å
77	L	94.5	Very high	94.9	Very high	63 Å²	63	102.3 Å²	102.3	33%	0.33	49%	0.491	S	S	.	.	H	α-helix	trans	-59.2	-44.3	179.6	-171.6	66.2	0	0	0	111.9	L73 N74 M75 K79 V80 Q81 I93	L73-L77 VanDerWaalsContact O-CB 3.29Å; L73-L77 WeakPolarHBondContact O-CB 3.41Å; L73-L77 PolarHBondContact O-N 3.27Å; N74-L77 WeakPolarHBondContact O-CB 3.43Å; N74-L77 PolarHBondContact O-N 3.33Å; M75-L77 VanDerWaalsContact C-N 3.35Å; L77-K79 VanDerWaalsContact C-N 3.28Å; L77-K79 PolarHBondContact O-N 3.23Å; L77-V80 PolarHBondContact O-N 3.45Å; L77-Q81 VanDerWaalsContact O-CB 3.27Å; L77-Q81 WeakPolarHBondContact O-CB 3.28Å; L77-Q81 PolarHBondContact O-N 2.93Å; L77-I93 HydrophobicContact CD1-CD1 3.68Å; L77-I93 HydrophobicContact CD2-CD1 4.43Å; L77-I93 HydrophobicContact CD2-CG2 4.22Å; L77-I93 HydrophobicContact CG-CD1 3.94Å
78	E	94	Very high	94.6	Very high	140 Å²	140	97.9 Å²	97.9	65%	0.654	47%	0.472	S	S	*	.	H	α-helix	trans	-60.2	-36.8	175.5	-74.8	175.4	-175.2	0	0	112.6	N74 M75 I76 P82	N74-E78 WeakPolarHBondContact O-CG 3.34Å; N74-E78 PolarHBondContact O-N 3.41Å; M75-E78 PolarHBondContact O-N 2.94Å; I76-E78 VanDerWaalsContact C-N 3.35Å; I76-E78 PolarHBondContact O-N 2.81Å; E78-P82 WeakPolarHBondContact O-CD 3.33Å
79	K	95.4	Very high	94.3	Very high	163 Å²	163	93.5 Å²	93.5	71%	0.709	45%	0.453	S	S	*	.	H	α-helix	trans	-74	-35	176	-65.8	-63.4	-179.1	-174.2	0	112.7	M75 I76 L77 F83	M75-K79 WeakPolarHBondContact O-CG 3.39Å; M75-K79 PolarHBondContact O-N 2.99Å; I76-K79 PolarHBondContact O-N 3.21Å; I76-K79 VanDerWaalsContact O-N 3.12Å; L77-K79 VanDerWaalsContact C-N 3.28Å; L77-K79 PolarHBondContact O-N 3.23Å; K79-F83 WeakPolarHBondContact O-CD2 3.45Å; K79-F83 WeakPolarHBondContact O-CE2 3.32Å
80	V	94.2	Very high	94	Very high	73 Å²	73	90.8 Å²	90.8	44%	0.442	44%	0.438	S	S	.	.	H	α-helix	trans	-83.4	-30	-176.9	174.5	0	0	0	0	112.4	I76 L77 P82 F83	I76-V80 HydrophobicContact CG2-CG2 4.17Å; I76-V80 WeakPolarHBondContact O-CG2 3.45Å; I76-V80 PolarHBondContact O-N 2.88Å; L77-V80 PolarHBondContact O-N 3.45Å; V80-P82 VanDerWaalsContact C-CD 3.45Å; V80-F83 WeakPolarHBondContact O-CB 3.31Å; V80-F83 PolarHBondContact O-N 2.99Å
81	Q	91.6	Very high	93.7	Very high	63 Å²	63	90 Å²	90	29%	0.294	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-52.4	-40.5	-174	-174.4	-92.9	-18.2	0	0	114.9	L77 F83 I84 Y91 I93	L77-Q81 VanDerWaalsContact O-CB 3.27Å; L77-Q81 WeakPolarHBondContact O-CB 3.28Å; L77-Q81 PolarHBondContact O-N 2.93Å; Q81-F83 PolarHBondContact O-N 3.35Å; Q81-I84 WeakPolarHBondContact O-CB 3.33Å; Q81-I84 PolarHBondContact O-N 2.9Å; Q81-Y91 PolarHBondContact NE2-O 3.35Å; Q81-Y91 VanDerWaalsContact NE2-O 3.16Å; Q81-I93 HydrophobicContact CB-CD1 3.75Å; Q81-I93 HydrophobicContact CG-CD1 3.41Å; Q81-I93 VanDerWaalsContact CG-CD1 3.41Å; Q81-I93 HydrophobicContact CG-CG1 3.97Å
82	P	90.7	Very high	93.3	Very high	71 Å²	71	88.9 Å²	88.9	46%	0.461	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-63.9	-24.6	177.6	-24.9	36	0	0	0	114.6	E78 V80 I84 R86	E78-P82 WeakPolarHBondContact O-CD 3.33Å; V80-P82 VanDerWaalsContact C-CD 3.45Å; P82-I84 VanDerWaalsContact C-N 3.31Å; P82-R86 PolarHBondContact O-NH1 2.97Å
83	F	92.1	Very high	93	Very high	175 Å²	175	85.2 Å²	85.2	77%	0.768	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-83.6	-5.9	-179.4	-58.4	-77.1	0	0	0	113.2	K79 V80 Q81	K79-F83 WeakPolarHBondContact O-CD2 3.45Å; K79-F83 WeakPolarHBondContact O-CE2 3.32Å; V80-F83 WeakPolarHBondContact O-CB 3.31Å; V80-F83 PolarHBondContact O-N 2.99Å; Q81-F83 PolarHBondContact O-N 3.35Å
84	I	91.2	Very high	92.7	Very high	43 Å²	43	85.2 Å²	85.2	22%	0.221	41%	0.405	C	S	.	.	S	Bend	trans	-73.7	132.1	174.7	-57.3	175.1	0	0	0	109.2	Q81 P82 I93	Q81-I84 WeakPolarHBondContact O-CB 3.33Å; Q81-I84 PolarHBondContact O-N 2.9Å; P82-I84 VanDerWaalsContact C-N 3.31Å; I84-I93 HydrophobicContact CD1-CD1 3.94Å; I84-I93 HydrophobicContact CD1-CG1 4.32Å
85	R	90.7	Very high	92.6	Very high	148 Å²	148	87.8 Å²	87.8	56%	0.558	41%	0.413	S	S	*	.			trans	-59.1	140.7	179.5	-60.5	167.2	54.5	148.5	-0	111.3	D87 S88	R85-D87 VanDerWaalsContact C-N 3.26Å; R85-D87 WeakPolarHBondContact CB-OD1 3.25Å; R85-D87 IonicContact CZ-OD1 2.82Å; R85-D87 IonicContact CZ-OD2 3.88Å; R85-D87 IonicContact NE-OD1 3.46Å; R85-D87 PolarHBondContact NE-OD1 3.06Å; R85-D87 IonicContact NE-OD2 3.77Å; R85-D87 PolarHBondContact NE-OD2 3.44Å; R85-D87 IonicContact NH2-OD1 2.98Å; R85-D87 IonicContact NH2-OD2 3.73Å; R85-D87 PolarHBondContact NH2-OD2 2.85Å; R85-D87 PolarHBondContact O-N 3.23Å; R85-S88 PolarHBondContact O-N 3.07Å
86	R	90.6	Very high	92.4	Very high	156 Å²	156	82.5 Å²	82.5	59%	0.589	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-21.3	-176.8	-63.3	-58.3	-163.4	-116.6	11.3	114.3	P82 S88 Y91	P82-R86 PolarHBondContact O-NH1 2.97Å; R86-S88 VanDerWaalsContact C-N 3.32Å; R86-Y91 PolarHBondContact NE-OH 3.38Å; R86-Y91 PolarHBondContact NH2-OH 3.35Å
87	D	90.3	Very high	92.2	Very high	44 Å²	44	83.8 Å²	83.8	24%	0.235	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-3.1	178.5	59.3	-11.5	0	0	0	113.5	R85 I116 E117	R85-D87 VanDerWaalsContact C-N 3.26Å; R85-D87 WeakPolarHBondContact CB-OD1 3.25Å; R85-D87 IonicContact CZ-OD1 2.82Å; R85-D87 IonicContact CZ-OD2 3.88Å; R85-D87 IonicContact NE-OD1 3.46Å; R85-D87 PolarHBondContact NE-OD1 3.06Å; R85-D87 IonicContact NE-OD2 3.77Å; R85-D87 PolarHBondContact NE-OD2 3.44Å; R85-D87 IonicContact NH2-OD1 2.98Å; R85-D87 IonicContact NH2-OD2 3.73Å; R85-D87 PolarHBondContact NH2-OD2 2.85Å; R85-D87 PolarHBondContact O-N 3.23Å; D87-I116 HydrophobicContact CB-CG2 4.19Å; D87-I116 CarbonylContact O-C 3.57Å; D87-I116 WeakPolarHBondContact O-CA 3.48Å; D87-I116 WeakPolarHBondContact OD2-CG2 3.48Å; D87-E117 WeakPolarHBondContact CB-O 3.41Å; D87-E117 PolarHBondContact O-N 2.89Å
88	S	90.9	Very high	92.1	Very high	15 Å²	15	89.2 Å²	89.2	11%	0.105	41%	0.405	C	S	.	.	B	Isolated β-bridge	trans	-91.2	140	175.9	179.1	0	0	0	0	111.6	R85 R86 Y90 Y91	R85-S88 PolarHBondContact O-N 3.07Å; R86-S88 VanDerWaalsContact C-N 3.32Å; S88-Y90 PolarHBondContact O-N 3.08Å; S88-Y90 VanDerWaalsContact O-N 3.13Å; S88-Y90 PolarHBondContact OG-N 3.11Å; S88-Y91 VanDerWaalsContact O-CB 3.26Å; S88-Y91 WeakPolarHBondContact O-CB 3.48Å; S88-Y91 PolarHBondContact O-N 3.47Å
89	N	91.4	Very high	92.1	Very high	37 Å²	37	86 Å²	86	20%	0.198	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-58.1	-23.9	170.3	64.4	-30	0	0	0	113.4	Y91 Q113 M114 V115	N89-Y91 VanDerWaalsContact C-N 3.28Å; N89-Y91 PolarHBondContact O-N 3.25Å; N89-Q113 PolarHBondContact ND2-O 2.95Å; N89-M114 WeakPolarHBondContact OD1-CA 3.34Å; N89-V115 PolarHBondContact N-O 2.89Å; N89-V115 VanDerWaalsContact N-O 3.12Å; N89-V115 PolarHBondContact OD1-N 2.89Å; N89-V115 PolarHBondContact OD1-O 3.37Å
90	Y	92.5	Very high	92	Very high	58 Å²	58	79.1 Å²	79.1	23%	0.227	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-77.1	-7.1	176.2	-81.6	-97.3	0	0	0	114.4	S88 N92 I93 I96 L111 P112 M114	S88-Y90 PolarHBondContact O-N 3.08Å; S88-Y90 VanDerWaalsContact O-N 3.13Å; S88-Y90 PolarHBondContact OG-N 3.11Å; Y90-N92 PolarHBondContact O-N 3.4Å; Y90-I93 WeakPolarHBondContact O-CG1 3.44Å; Y90-I96 HydrophobicContact CD1-CD1 4.46Å; Y90-I96 HydrophobicContact CD1-CG1 3.94Å; Y90-I96 HydrophobicContact CD1-CG2 4.29Å; Y90-I96 HydrophobicContact CD2-CD1 4.35Å; Y90-I96 HydrophobicContact CE1-CD1 4.43Å; Y90-I96 HydrophobicContact CE1-CG1 4.14Å; Y90-I96 HydrophobicContact CE1-CG2 3.78Å; Y90-I96 HydrophobicContact CE2-CD1 4.27Å; Y90-I96 HydrophobicContact CG-CD1 4.42Å; Y90-I96 HydrophobicContact CG-CG1 4.18Å; Y90-L111 WeakPolarHBondContact OH-CB 3.49Å; Y90-P112 WeakPolarHBondContact CE2-O 3.49Å; Y90-P112 PolarHBondContact OH-O 3.15Å; Y90-M114 HydrophobicContact CD2-CB 4.16Å; Y90-M114 HydrophobicContact CD2-CG 4.14Å; Y90-M114 HydrophobicContact CE2-CB 3.99Å; Y90-M114 HydrophobicContact CE2-CG 4.47Å
91	Y	91.9	Very high	92	Very high	78 Å²	78	83 Å²	83	31%	0.306	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-56.7	-37.7	173.9	174.2	-120.2	0	0	0	111.8	Q81 R86 S88 N89	Q81-Y91 PolarHBondContact NE2-O 3.35Å; Q81-Y91 VanDerWaalsContact NE2-O 3.16Å; R86-Y91 PolarHBondContact NE-OH 3.38Å; R86-Y91 PolarHBondContact NH2-OH 3.35Å; S88-Y91 VanDerWaalsContact O-CB 3.26Å; S88-Y91 WeakPolarHBondContact O-CB 3.48Å; S88-Y91 PolarHBondContact O-N 3.47Å; N89-Y91 VanDerWaalsContact C-N 3.28Å; N89-Y91 PolarHBondContact O-N 3.25Å
92	N	91.1	Very high	92.2	Very high	71 Å²	71	84.7 Å²	84.7	38%	0.38	39%	0.386	S	S	.	.	S	Bend	trans	-98.6	85.2	172.4	-170.4	-26.7	0	0	0	110.5	Y90 D94 K95 I96	Y90-N92 PolarHBondContact O-N 3.4Å; N92-D94 PolarHBondContact O-N 2.89Å; N92-D94 PolarHBondContact OD1-N 3.15Å; N92-K95 HydrophobicContact CB-CB 4.07Å; N92-K95 WeakPolarHBondContact O-CB 3.37Å; N92-K95 PolarHBondContact O-N 3.35Å; N92-K95 VanDerWaalsContact O-N 3.08Å; N92-K95 PolarHBondContact OD1-N 3.04Å; N92-I96 PolarHBondContact O-N 3Å
93	I	92	Very high	92.5	Very high	25 Å²	25	82.9 Å²	82.9	13%	0.128	37%	0.372	C	S	.	.	H	α-helix	trans	-61.9	-32	-178.7	-52.3	-179.2	0	0	0	111.5	L77 Q81 I84 Y90 K95 I96 K97	L77-I93 HydrophobicContact CD1-CD1 3.68Å; L77-I93 HydrophobicContact CD2-CD1 4.43Å; L77-I93 HydrophobicContact CD2-CG2 4.22Å; L77-I93 HydrophobicContact CG-CD1 3.94Å; Q81-I93 HydrophobicContact CB-CD1 3.75Å; Q81-I93 HydrophobicContact CG-CD1 3.41Å; Q81-I93 VanDerWaalsContact CG-CD1 3.41Å; Q81-I93 HydrophobicContact CG-CG1 3.97Å; I84-I93 HydrophobicContact CD1-CD1 3.94Å; I84-I93 HydrophobicContact CD1-CG1 4.32Å; Y90-I93 WeakPolarHBondContact O-CG1 3.44Å; I93-K95 VanDerWaalsContact C-N 3.28Å; I93-K95 PolarHBondContact O-N 3.13Å; I93-I96 WeakPolarHBondContact O-CB 3.39Å; I93-I96 PolarHBondContact O-N 3.01Å; I93-I96 VanDerWaalsContact O-N 3.12Å; I93-K97 HydrophobicContact CG2-CD 4.49Å; I93-K97 HydrophobicContact CG2-CG 4.39Å; I93-K97 WeakPolarHBondContact O-CG 3.49Å; I93-K97 PolarHBondContact O-N 2.86Å
94	D	91.4	Very high	92.6	Very high	97 Å²	97	78.4 Å²	78.4	52%	0.519	37%	0.368	S	S	.	.	H	α-helix	trans	-66.4	-31.9	177.3	-62.2	-42	0	0	0	112.3	N92 R98	N92-D94 PolarHBondContact O-N 2.89Å; N92-D94 PolarHBondContact OD1-N 3.15Å; D94-R98 WeakPolarHBondContact O-CG 3.49Å; D94-R98 PolarHBondContact O-N 3.22Å; D94-R98 PolarHBondContact O-NE 2.85Å
95	K	92.5	Very high	92.8	Very high	116 Å²	116	85.3 Å²	85.3	50%	0.504	40%	0.399	S	S	.	.	H	α-helix	trans	-66.7	-41.3	171.6	-173.6	-177.1	177.1	-175.1	0	110.6	N92 I93 R98 T99	N92-K95 HydrophobicContact CB-CB 4.07Å; N92-K95 WeakPolarHBondContact O-CB 3.37Å; N92-K95 PolarHBondContact O-N 3.35Å; N92-K95 VanDerWaalsContact O-N 3.08Å; N92-K95 PolarHBondContact OD1-N 3.04Å; I93-K95 VanDerWaalsContact C-N 3.28Å; I93-K95 PolarHBondContact O-N 3.13Å; K95-R98 PolarHBondContact O-N 2.9Å; K95-T99 WeakPolarHBondContact O-CG2 3.36Å; K95-T99 PolarHBondContact O-N 2.96Å; K95-T99 PolarHBondContact O-OG1 3.32Å
96	I	93.8	Very high	93	Very high	11 Å²	11	84.9 Å²	84.9	6%	0.056	40%	0.401	C	S	.	.	H	α-helix	trans	-63.5	-48.5	175.8	-62.3	-58.7	0	0	0	110.9	Y90 N92 I93 R98 T99 A100 L111 P112	Y90-I96 HydrophobicContact CD1-CD1 4.46Å; Y90-I96 HydrophobicContact CD1-CG1 3.94Å; Y90-I96 HydrophobicContact CD1-CG2 4.29Å; Y90-I96 HydrophobicContact CD2-CD1 4.35Å; Y90-I96 HydrophobicContact CE1-CD1 4.43Å; Y90-I96 HydrophobicContact CE1-CG1 4.14Å; Y90-I96 HydrophobicContact CE1-CG2 3.78Å; Y90-I96 HydrophobicContact CE2-CD1 4.27Å; Y90-I96 HydrophobicContact CG-CD1 4.42Å; Y90-I96 HydrophobicContact CG-CG1 4.18Å; N92-I96 PolarHBondContact O-N 3Å; I93-I96 WeakPolarHBondContact O-CB 3.39Å; I93-I96 PolarHBondContact O-N 3.01Å; I93-I96 VanDerWaalsContact O-N 3.12Å; I96-R98 VanDerWaalsContact C-N 3.26Å; I96-R98 PolarHBondContact O-N 3.36Å; I96-T99 PolarHBondContact O-N 3.07Å; I96-T99 PolarHBondContact O-OG1 3.48Å; I96-T99 VanDerWaalsContact O-OG1 3.11Å; I96-A100 WeakPolarHBondContact O-CB 3.48Å; I96-A100 PolarHBondContact O-N 3.21Å; I96-L111 HydrophobicContact CG2-CD2 4.14Å; I96-P112 HydrophobicContact CD1-CB 4.29Å; I96-P112 HydrophobicContact CD1-CG 4.06Å
97	K	93.2	Very high	93.1	Very high	113 Å²	113	83.5 Å²	83.5	49%	0.491	41%	0.406	S	S	.	.	H	α-helix	trans	-54.9	-40.2	177	-73.6	176.6	177.6	177.8	0	112.8	I93	I93-K97 HydrophobicContact CG2-CD 4.49Å; I93-K97 HydrophobicContact CG2-CG 4.39Å; I93-K97 WeakPolarHBondContact O-CG 3.49Å; I93-K97 PolarHBondContact O-N 2.86Å
98	R	93.4	Very high	93.4	Very high	177 Å²	177	87.3 Å²	87.3	67%	0.668	42%	0.422	S	S	*	.	H	α-helix	trans	-73.1	-24.6	178.7	-77.7	178	-81.9	128.4	-9.4	114.4	D94 K95 I96	D94-R98 WeakPolarHBondContact O-CG 3.49Å; D94-R98 PolarHBondContact O-N 3.22Å; D94-R98 PolarHBondContact O-NE 2.85Å; K95-R98 PolarHBondContact O-N 2.9Å; I96-R98 VanDerWaalsContact C-N 3.26Å; I96-R98 PolarHBondContact O-N 3.36Å
99	T	93	Very high	93.6	Very high	73 Å²	73	94.7 Å²	94.7	45%	0.448	45%	0.448	S	S	.	.	H	α-helix	trans	-99.7	-14.1	-177.8	50.1	0	0	0	0	112.9	K95 I96 P112	K95-T99 WeakPolarHBondContact O-CG2 3.36Å; K95-T99 PolarHBondContact O-N 2.96Å; K95-T99 PolarHBondContact O-OG1 3.32Å; I96-T99 PolarHBondContact O-N 3.07Å; I96-T99 PolarHBondContact O-OG1 3.48Å; I96-T99 VanDerWaalsContact O-OG1 3.11Å; T99-P112 WeakPolarHBondContact OG1-CG 3.26Å
100	A	93.9	Very high	93.8	Very high	17 Å²	17	97.5 Å²	97.5	14%	0.14	46%	0.462	C	S	.	.			trans	-60.9	141.6	172.5	0	0	0	0	0	111.3	I96 W109 I110 L111	I96-A100 WeakPolarHBondContact O-CB 3.48Å; I96-A100 PolarHBondContact O-N 3.21Å; A100-W109 HydrophobicContact CB-CE3 4.06Å; A100-W109 HydrophobicContact CB-CZ3 4.47Å; A100-I110 WeakPolarHBondContact CA-O 3.27Å; A100-L111 HydrophobicContact CB-CD2 3.82Å
101	K	94.7	Very high	93.8	Very high	156 Å²	156	99.4 Å²	99.4	68%	0.678	48%	0.475	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.7	136.5	177.9	-66.4	-177.9	179.7	-179.7	0	109.3	I110	K101-I110 PolarHBondContact N-O 3.01Å; K101-I110 PolarHBondContact O-N 3.08Å
102	F	95.9	Very high	93.8	Very high	98 Å²	98	97.4 Å²	97.4	43%	0.43	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	123.6	173.9	-174.4	-106	0	0	0	109.7	A104 N107 W109	F102-A104 HydrophobicContact CD1-CB 4.45Å; F102-A104 HydrophobicContact CE1-CB 4.24Å; F102-N107 WeakPolarHBondContact CZ-OD1 3.43Å; F102-W109 HydrophobicContact CB-CD2 4.28Å; F102-W109 HydrophobicContact CB-CE3 4.02Å; F102-W109 HydrophobicContact CB-CH2 4.1Å; F102-W109 HydrophobicContact CB-CZ2 4.34Å; F102-W109 HydrophobicContact CB-CZ3 3.94Å; F102-W109 AromaticContact CD2-CD2 3.97Å; F102-W109 HydrophobicContact CD2-CD2 3.97Å; F102-W109 AromaticContact CD2-CE2 3.79Å; F102-W109 HydrophobicContact CD2-CG 4.17Å; F102-W109 HydrophobicContact CD2-CZ2 4.24Å; F102-W109 AromaticContact CD2-NE1 3.84Å
103	D	95.7	Very high	93.8	Very high	32 Å²	32	101.7 Å²	101.7	17%	0.171	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	105.6	172.8	-174.9	-11.6	0	0	0	108.6	E105 K106 N107 E108 I110	D103-E105 VanDerWaalsContact C-N 3.3Å; D103-E105 PolarHBondContact O-N 2.76Å; D103-E105 PolarHBondContact OD1-N 2.87Å; D103-E105 VanDerWaalsContact OD1-N 3.07Å; D103-K106 HydrophobicContact CB-CB 4.46Å; D103-K106 PolarHBondContact OD1-N 3.19Å; D103-K106 WeakPolarHBondContact OD2-CD 3.47Å; D103-N107 VanDerWaalsContact O-CA 3.32Å; D103-N107 WeakPolarHBondContact O-CA 3.48Å; D103-N107 PolarHBondContact O-N 3.34Å; D103-E108 PolarHBondContact N-O 3.39Å; D103-E108 PolarHBondContact O-N 3.39Å; D103-I110 HydrophobicContact CB-CD1 3.77Å; D103-I110 HydrophobicContact CB-CG1 4.01Å
104	A	95.2	Very high	93.7	Very high	81 Å²	81	106 Å²	106	67%	0.669	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-25.1	-177.7	0	0	0	0	0	113	F102	F102-A104 HydrophobicContact CD1-CB 4.45Å; F102-A104 HydrophobicContact CE1-CB 4.24Å
105	E	95.4	Very high	93.6	Very high	188 Å²	188	105 Å²	105	88%	0.879	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-37	179.8	-64.3	-176.7	176	0	0	111	D103	D103-E105 VanDerWaalsContact C-N 3.3Å; D103-E105 PolarHBondContact O-N 2.76Å; D103-E105 PolarHBondContact OD1-N 2.87Å; D103-E105 VanDerWaalsContact OD1-N 3.07Å
106	K	94.7	Very high	93.5	Very high	140 Å²	140	102.4 Å²	102.4	61%	0.609	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-13.1	177.7	-62.5	-177.6	-171.6	167.1	0	113.8	D103 E108	D103-K106 HydrophobicContact CB-CB 4.46Å; D103-K106 PolarHBondContact OD1-N 3.19Å; D103-K106 WeakPolarHBondContact OD2-CD 3.47Å; K106-E108 VanDerWaalsContact C-N 3.29Å; K106-E108 HydrophobicContact CB-CB 4.37Å; K106-E108 PolarHBondContact O-N 3.24Å
107	N	93.1	Very high	93	Very high	126 Å²	126	108.2 Å²	108.2	67%	0.674	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	58	39.9	-173.5	-164.1	45.3	0	0	0	112.6	F102 D103	F102-N107 WeakPolarHBondContact CZ-OD1 3.43Å; D103-N107 VanDerWaalsContact O-CA 3.32Å; D103-N107 WeakPolarHBondContact O-CA 3.48Å; D103-N107 PolarHBondContact O-N 3.34Å
108	E	94.9	Very high	92.4	Very high	125 Å²	125	109.6 Å²	109.6	58%	0.584	53%	0.534	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134	151.9	-174.3	-72.4	-179.8	171	0	0	111.9	D103 K106	D103-E108 PolarHBondContact N-O 3.39Å; D103-E108 PolarHBondContact O-N 3.39Å; K106-E108 VanDerWaalsContact C-N 3.29Å; K106-E108 HydrophobicContact CB-CB 4.37Å; K106-E108 PolarHBondContact O-N 3.24Å
109	W	95.8	Very high	91.4	Very high	169 Å²	169	107.2 Å²	107.2	64%	0.64	54%	0.539	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.3	119.9	172	-74.5	94.4	0	0	0	110.5	A100 F102 L111	A100-W109 HydrophobicContact CB-CE3 4.06Å; A100-W109 HydrophobicContact CB-CZ3 4.47Å; F102-W109 HydrophobicContact CB-CD2 4.28Å; F102-W109 HydrophobicContact CB-CE3 4.02Å; F102-W109 HydrophobicContact CB-CH2 4.1Å; F102-W109 HydrophobicContact CB-CZ2 4.34Å; F102-W109 HydrophobicContact CB-CZ3 3.94Å; F102-W109 AromaticContact CD2-CD2 3.97Å; F102-W109 HydrophobicContact CD2-CD2 3.97Å; F102-W109 AromaticContact CD2-CE2 3.79Å; F102-W109 HydrophobicContact CD2-CG 4.17Å; F102-W109 HydrophobicContact CD2-CZ2 4.24Å; F102-W109 AromaticContact CD2-NE1 3.84Å; W109-L111 PolarHBondContact O-N 3.39Å
110	I	95.1	Very high	90.5	Very high	97 Å²	97	111.7 Å²	111.7	50%	0.497	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-83.1	111.7	171.4	-56.4	175.7	0	0	0	108.5	A100 K101 D103	A100-I110 WeakPolarHBondContact CA-O 3.27Å; K101-I110 PolarHBondContact N-O 3.01Å; K101-I110 PolarHBondContact O-N 3.08Å; D103-I110 HydrophobicContact CB-CD1 3.77Å; D103-I110 HydrophobicContact CB-CG1 4.01Å
111	L	94	Very high	89.7	Confident	97 Å²	97	117.9 Å²	117.9	51%	0.508	59%	0.585	S	S	.	*	P	Polyproline II helix	trans	-93.8	150.3	176.7	-60.2	175.2	0	0	0	111.4	Y90 I96 A100 W109	Y90-L111 WeakPolarHBondContact OH-CB 3.49Å; I96-L111 HydrophobicContact CG2-CD2 4.14Å; A100-L111 HydrophobicContact CB-CD2 3.82Å; W109-L111 PolarHBondContact O-N 3.39Å
112	P	91.5	Very high	88.6	Confident	37 Å²	37	116.2 Å²	116.2	24%	0.24	59%	0.59	C	S	.	*	P	Polyproline II helix	trans	-59.6	144.5	171.2	-20.7	32	0	0	0	112.3	Y90 I96 T99	Y90-P112 WeakPolarHBondContact CE2-O 3.49Å; Y90-P112 PolarHBondContact OH-O 3.15Å; I96-P112 HydrophobicContact CD1-CB 4.29Å; I96-P112 HydrophobicContact CD1-CG 4.06Å; T99-P112 WeakPolarHBondContact OG1-CG 3.26Å
113	Q	90.3	Very high	87.2	Confident	161 Å²	161	116.4 Å²	116.4	75%	0.752	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-59.4	141.8	175	-171.8	61	27.5	0	0	111.1	N89 V115	N89-Q113 PolarHBondContact ND2-O 2.95Å; Q113-V115 PolarHBondContact O-N 3.24Å
114	M	90.2	Very high	85.4	Confident	115 Å²	115	118.9 Å²	118.9	57%	0.567	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-67.3	126.4	174	-174.7	-179.8	70.5	0	0	110.2	N89 Y90	N89-M114 WeakPolarHBondContact OD1-CA 3.34Å; Y90-M114 HydrophobicContact CD2-CB 4.16Å; Y90-M114 HydrophobicContact CD2-CG 4.14Å; Y90-M114 HydrophobicContact CE2-CB 3.99Å; Y90-M114 HydrophobicContact CE2-CG 4.47Å
115	V	89.6	Confident	83.5	Confident	77 Å²	77	121.9 Å²	121.9	47%	0.467	63%	0.633	S	S	.	*			trans	-127.3	134	176.8	-179.3	0	0	0	0	108.3	N89 Q113	N89-V115 PolarHBondContact N-O 2.89Å; N89-V115 VanDerWaalsContact N-O 3.12Å; N89-V115 PolarHBondContact OD1-N 2.89Å; N89-V115 PolarHBondContact OD1-O 3.37Å; Q113-V115 PolarHBondContact O-N 3.24Å
116	I	89.8	Confident	81.4	Confident	61 Å²	61	120.1 Å²	120.1	31%	0.313	63%	0.629	S	S	.	*	B	Isolated β-bridge	trans	-108.9	114.1	176.5	-59	175.3	0	0	0	107.5	D87 H118	D87-I116 HydrophobicContact CB-CG2 4.19Å; D87-I116 CarbonylContact O-C 3.57Å; D87-I116 WeakPolarHBondContact O-CA 3.48Å; D87-I116 WeakPolarHBondContact OD2-CG2 3.48Å; I116-H118 PolarHBondContact O-N 3.24Å
117	E	83.9	Confident	79.3	Confident	133 Å²	133	120.3 Å²	120.3	62%	0.621	64%	0.637	S	S	*	*			trans	-86.4	105.6	178.4	-68.6	179.7	-168.9	0	0	109.6	D87 T119	D87-E117 WeakPolarHBondContact CB-O 3.41Å; D87-E117 PolarHBondContact O-N 2.89Å; E117-T119 PolarHBondContact O-N 2.92Å
118	H	80.8	Confident	77	Confident	141 Å²	141	120.8 Å²	120.8	65%	0.653	64%	0.639	S	S	*	*			trans	-80.5	98.2	171.5	-67.3	-63.5	0	0	0	109.9	I116 Q120	I116-H118 PolarHBondContact O-N 3.24Å; H118-Q120 PolarHBondContact O-N 3.4Å
119	T	72.3	Confident	74.6	Confident	128 Å²	128	119.8 Å²	119.8	79%	0.785	65%	0.646	S	S	*	*			trans	-71.4	99.9	168.9	-48.5	0	0	0	0	108.9	E117	E117-T119 PolarHBondContact O-N 2.92Å
120	Q	74.8	Confident	72.4	Confident	166 Å²	166	116.4 Å²	116.4	78%	0.776	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-85.2	131.8	161.6	-63.9	-171	5.8	0	0	108	H118	H118-Q120 PolarHBondContact O-N 3.4Å
121	L	75.8	Confident	70.1	Confident	147 Å²	147	117 Å²	117	77%	0.77	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-62.4	142	169	-67.5	171.3	0	0	0	108.1	S123	L121-S123 PolarHBondContact O-N 3.45Å
122	P	72.5	Confident	67.6	Low	121 Å²	121	122.7 Å²	122.7	79%	0.786	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-53.1	116.3	169.4	-17.6	28.2	0	0	0	107	A124	P122-A124 PolarHBondContact O-N 3.46Å
123	S	66	Low	65.6	Low	103 Å²	103	131 Å²	131	72%	0.72	70%	0.695	S	S	*	*			trans	-55.6	114.4	174.3	-58.7	0	0	0	0	106.5	L121 N125	L121-S123 PolarHBondContact O-N 3.45Å; S123-N125 VanDerWaalsContact C-N 3.29Å; S123-N125 PolarHBondContact O-N 3.34Å
124	A	58.3	Low	63.3	Low	83 Å²	83	130 Å²	130	69%	0.686	70%	0.695	S	S	*	*			trans	-58.9	104.7	167.8	0	0	0	0	0	105	P122 L126	P122-A124 PolarHBondContact O-N 3.46Å; A124-L126 PolarHBondContact O-N 3.36Å
125	N	54.3	Low	61.4	Low	145 Å²	145	129.2 Å²	129.2	78%	0.775	70%	0.701	S	S	*	*			trans	-57.8	90	164.3	-89.3	-7.6	0	0	0	105.2	S123 N127	S123-N125 VanDerWaalsContact C-N 3.29Å; S123-N125 PolarHBondContact O-N 3.34Å; N125-N127 PolarHBondContact O-N 2.99Å; N125-N127 PolarHBondContact O-OD1 3.05Å
126	L	52.5	Low	59.2	Low	151 Å²	151	132.1 Å²	132.1	79%	0.791	71%	0.714	S	S	*	*			trans	-72.1	81.1	162.6	-125.4	81.3	0	0	0	105	A124 N128	A124-L126 PolarHBondContact O-N 3.36Å; L126-N128 PolarHBondContact O-N 2.97Å
127	N	49.3	Very low	57.3	Low	143 Å²	143	138.9 Å²	138.9	77%	0.765	74%	0.737	S	S	*	*			trans	-56.9	75.7	151.2	43.2	-12.1	0	0	0	108.9	N125	N125-N127 PolarHBondContact O-N 2.99Å; N125-N127 PolarHBondContact O-OD1 3.05Å
128	N	46.4	Very low	55.1	Low	136 Å²	136	140.9 Å²	140.9	73%	0.727	75%	0.746	S	S	*	*			trans	-174.6	113.3	141.8	-101.8	-2.2	0	0	0	111.3	L126	L126-N128 PolarHBondContact O-N 2.97Å
129	S	44	Very low	53.4	Low	105 Å²	105	139.9 Å²	139.9	73%	0.734	75%	0.75	S	S	*	*			trans	28.2	123.3	139.4	66.6	0	0	0	0	119
130	S	49.8	Very low	51.8	Low	97 Å²	97	139.5 Å²	139.5	68%	0.678	75%	0.748	S	S	*	*			trans	113.8	119.8	134.3	-153.6	0	0	0	0	115.7
131	N	45.1	Very low	50.3	Low	109 Å²	109	139.2 Å²	139.2	58%	0.583	75%	0.752	S	S	*	*			trans	78.7	96.6	157.4	-56.9	-27	0	0	0	116.1
132	R	41.9	Very low	48.5	Very low	218 Å²	218	134.9 Å²	134.9	82%	0.823	74%	0.742	S	S	*	*				53	104.5	91.4	-69.1	-176.6	-174	-156.8	1.2	109.9
133	Y	50.3	Low	47.4	Very low	212 Å²	212	136.9 Å²	136.9	83%	0.831	75%	0.746	S	S	*	*				-164.2	113.7	126.1	-55.2	-62.4	0	0	0	107.4
134	D	42.7	Very low	46.7	Very low	140 Å²	140	136.4 Å²	136.4	75%	0.749	75%	0.749	S	S	*	*			trans	-68.2	133	169	-170.6	-0.9	0	0	0	108.9
135	S	50.1	Low	46.3	Very low	97 Å²	97	140 Å²	140	68%	0.678	75%	0.751	S	S	*	*			trans	-156.6	77.4	171.6	172.3	0	0	0	0	109.5	Y137	S135-Y137 PolarHBondContact O-N 2.89Å
136	N	43.3	Very low	46.4	Very low	139 Å²	139	136.6 Å²	136.6	74%	0.743	74%	0.738	S	S	*	*			trans	-55.3	114.3	156.8	-64.4	-46.8	0	0	0	109.5
137	Y	48.4	Very low	46.7	Very low	202 Å²	202	134.8 Å²	134.8	79%	0.792	73%	0.729	S	S	*	*			trans	-107.5	86.1	156.5	63.9	-82.5	0	0	0	107.5	S135 T139	S135-Y137 PolarHBondContact O-N 2.89Å; Y137-T139 PolarHBondContact O-N 3.13Å
138	E	38.9	Very low	47.2	Very low	176 Å²	176	132.8 Å²	132.8	82%	0.822	72%	0.722	S	S	*	*			trans	-79.7	101.9	159.6	-168.3	169.3	-160.2	0	0	105.8
139	T	45.9	Very low	48.2	Very low	119 Å²	119	131.4 Å²	131.4	73%	0.73	71%	0.714	S	S	*	*			trans	-114.3	93.6	170	-48.6	0	0	0	0	108.3	Y137	Y137-T139 PolarHBondContact O-N 3.13Å
140	T	38.1	Very low	49.3	Very low	121 Å²	121	132.2 Å²	132.2	74%	0.742	70%	0.704	S	S	*	*			trans	-54.8	123.4	154.7	44.4	0	0	0	0	110.4
141	D	43.2	Very low	50.3	Low	160 Å²	160	133.4 Å²	133.4	86%	0.856	70%	0.702	S	S	*	*			trans	-129.5	98.2	151.5	-168.9	3.5	0	0	0	107.9
142	G	37.5	Very low	51.7	Low	56 Å²	56	134.3 Å²	134.3	58%	0.577	71%	0.707	S	S	*	*			trans	-100.7	125.2	172	0	0	0	0	0	109.1
143	N	48.6	Very low	53.3	Low	162 Å²	162	131.9 Å²	131.9	87%	0.866	70%	0.702	S	S	*	*	S	Bend	trans	166.3	-0.4	138.7	-92.6	-20.3	0	0	0	115.5
144	A	51.5	Low	54	Low	94 Å²	94	130 Å²	130	78%	0.777	69%	0.693	S	S	*	*	S	Bend	trans	-85.8	-12	-178.4	0	0	0	0	0	115.4	C146	A144-C146 PolarHBondContact O-N 3.41Å
145	E	51.1	Low	55.5	Low	158 Å²	158	125.9 Å²	125.9	74%	0.738	68%	0.679	S	S	*	*	H	α-helix	trans	-86	-4.8	-168.8	-141.8	173.9	-172.7	0	0	114.5	I149	E145-I149 HydrophobicContact CG-CD1 4.33Å; E145-I149 WeakPolarHBondContact O-CD1 3.44Å; E145-I149 WeakPolarHBondContact O-CG1 3.33Å
146	C	56	Low	57	Low	73 Å²	73	124.9 Å²	124.9	49%	0.493	67%	0.672	S	S	.	*	H	α-helix	trans	-79.1	-30.6	-174.1	-168.1	0	0	0	0	114	A144 K150	A144-C146 PolarHBondContact O-N 3.41Å; C146-K150 WeakPolarHBondContact O-CG 3.43Å
147	D	58.2	Low	58.8	Low	114 Å²	114	123.8 Å²	123.8	61%	0.61	66%	0.661	S	S	*	*	H	α-helix	trans	-84.9	-37.4	-174.5	-75.6	-18.6	0	0	0	112.8	I149 K150 D151	D147-I149 VanDerWaalsContact C-N 3.33Å; D147-I149 PolarHBondContact O-N 2.97Å; D147-K150 PolarHBondContact O-N 3.12Å; D147-D151 PolarHBondContact O-N 3.38Å; D147-D151 VanDerWaalsContact O-N 3.17Å
148	V	60.4	Low	60.4	Low	101 Å²	101	120.6 Å²	120.6	61%	0.612	65%	0.651	S	S	*	*	H	α-helix	trans	-64.3	-38.6	178.2	-174	0	0	0	0	111.4	D151 L152	V148-D151 PolarHBondContact O-N 3.34Å; V148-L152 PolarHBondContact O-N 3.45Å; V148-L152 VanDerWaalsContact O-N 3.11Å
149	I	67.3	Low	62.4	Low	107 Å²	107	117.3 Å²	117.3	55%	0.549	64%	0.636	S	S	.	*	H	α-helix	trans	-68	-36.4	179.4	-63	174.5	0	0	0	111.4	E145 D147 K153	E145-I149 HydrophobicContact CG-CD1 4.33Å; E145-I149 WeakPolarHBondContact O-CD1 3.44Å; E145-I149 WeakPolarHBondContact O-CG1 3.33Å; D147-I149 VanDerWaalsContact C-N 3.33Å; D147-I149 PolarHBondContact O-N 2.97Å; I149-K153 WeakPolarHBondContact O-CB 3.46Å; I149-K153 PolarHBondContact O-N 3.47Å; I149-K153 VanDerWaalsContact O-N 3.13Å
150	K	68	Low	64.1	Low	122 Å²	122	115 Å²	115	53%	0.53	62%	0.624	S	S	.	*	H	α-helix	trans	-67.8	-43	177.7	-75.6	173.8	-172.5	162.8	0	111.9	C146 D147 K153 W154	C146-K150 WeakPolarHBondContact O-CG 3.43Å; D147-K150 PolarHBondContact O-N 3.12Å; K150-K153 PolarHBondContact O-N 3.01Å; K150-W154 PolarHBondContact O-N 2.93Å
151	D	70.6	Confident	66.2	Low	121 Å²	121	115.8 Å²	115.8	65%	0.647	61%	0.614	S	S	*	*	H	α-helix	trans	-65.2	-40.9	178.6	-81.4	-3.2	0	0	0	111.8	D147 V148 K153 W154 A155	D147-D151 PolarHBondContact O-N 3.38Å; D147-D151 VanDerWaalsContact O-N 3.17Å; V148-D151 PolarHBondContact O-N 3.34Å; D151-K153 VanDerWaalsContact C-N 3.33Å; D151-K153 PolarHBondContact O-N 3.04Å; D151-W154 PolarHBondContact O-N 3.35Å; D151-A155 WeakPolarHBondContact O-CB 3.4Å; D151-A155 PolarHBondContact O-N 2.99Å
152	L	73.4	Confident	68	Low	129 Å²	129	113.1 Å²	113.1	68%	0.675	60%	0.599	S	S	*	*	H	α-helix	trans	-62.6	-40.6	175.9	-142.2	75	0	0	0	111.8	V148 A155 S156	V148-L152 PolarHBondContact O-N 3.45Å; V148-L152 VanDerWaalsContact O-N 3.11Å; L152-A155 PolarHBondContact O-N 3.33Å; L152-S156 WeakPolarHBondContact O-CB 3.46Å; L152-S156 PolarHBondContact O-N 3.48Å
153	K	75.1	Confident	70	Confident	167 Å²	167	118 Å²	118	73%	0.726	60%	0.601	S	S	*	*	H	α-helix	trans	-67.7	-36.9	177	-166	179.2	-176.7	179.7	0	112.3	I149 K150 D151 K157	I149-K153 WeakPolarHBondContact O-CB 3.46Å; I149-K153 PolarHBondContact O-N 3.47Å; I149-K153 VanDerWaalsContact O-N 3.13Å; K150-K153 PolarHBondContact O-N 3.01Å; D151-K153 VanDerWaalsContact C-N 3.33Å; D151-K153 PolarHBondContact O-N 3.04Å; K153-K157 WeakPolarHBondContact O-CB 3.32Å; K153-K157 PolarHBondContact O-N 3.15Å; K153-K157 VanDerWaalsContact O-N 3.13Å
154	W	65.7	Low	71.5	Confident	171 Å²	171	114 Å²	114	65%	0.648	58%	0.582	S	S	*	*	H	α-helix	trans	-68.2	-42.6	175.5	-179.3	-100.4	0	0	0	112.1	K150 D151 K157 K158	K150-W154 PolarHBondContact O-N 2.93Å; D151-W154 PolarHBondContact O-N 3.35Å; W154-K157 PolarHBondContact O-N 2.82Å; W154-K158 PolarHBondContact O-N 2.81Å
155	A	75.2	Confident	72.9	Confident	54 Å²	54	116.5 Å²	116.5	45%	0.446	58%	0.576	S	S	.	*	H	α-helix	trans	-60.2	-48.2	176	0	0	0	0	0	111.6	D151 L152 K157 K158 E159	D151-A155 WeakPolarHBondContact O-CB 3.4Å; D151-A155 PolarHBondContact O-N 2.99Å; L152-A155 PolarHBondContact O-N 3.33Å; A155-K157 VanDerWaalsContact C-N 3.34Å; A155-K157 PolarHBondContact O-N 3.4Å; A155-K158 WeakPolarHBondContact O-CB 3.46Å; A155-K158 PolarHBondContact O-N 2.82Å; A155-K158 VanDerWaalsContact O-N 3.12Å; A155-E159 PolarHBondContact O-N 3.48Å
156	S	80.9	Confident	74.1	Confident	77 Å²	77	113.9 Å²	113.9	54%	0.538	57%	0.566	S	S	.	*	H	α-helix	trans	-59.9	-40.8	176.9	-179	0	0	0	0	112.6	L152 K158 E159 S160	L152-S156 WeakPolarHBondContact O-CB 3.46Å; L152-S156 PolarHBondContact O-N 3.48Å; S156-K158 PolarHBondContact O-N 3.19Å; S156-E159 PolarHBondContact O-N 2.95Å; S156-S160 PolarHBondContact O-N 3.4Å
157	K	81.4	Confident	75.1	Confident	116 Å²	116	114.3 Å²	114.3	50%	0.504	56%	0.564	S	S	.	*	H	α-helix	trans	-66.4	-35	175.7	-172.1	172.6	-175.4	173	0	112.8	K153 W154 A155 R161	K153-K157 WeakPolarHBondContact O-CB 3.32Å; K153-K157 PolarHBondContact O-N 3.15Å; K153-K157 VanDerWaalsContact O-N 3.13Å; W154-K157 PolarHBondContact O-N 2.82Å; A155-K157 VanDerWaalsContact C-N 3.34Å; A155-K157 PolarHBondContact O-N 3.4Å; K157-R161 WeakPolarHBondContact O-CG 3.49Å; K157-R161 PolarHBondContact O-N 3.11Å
158	K	81	Confident	75.9	Confident	134 Å²	134	113.4 Å²	113.4	58%	0.583	56%	0.559	S	S	*	*	H	α-helix	trans	-69.6	-41.6	176.9	-174.4	-179	178	-175.4	0	111.1	W154 A155 S156 R161 L162	W154-K158 PolarHBondContact O-N 2.81Å; A155-K158 WeakPolarHBondContact O-CB 3.46Å; A155-K158 PolarHBondContact O-N 2.82Å; A155-K158 VanDerWaalsContact O-N 3.12Å; S156-K158 PolarHBondContact O-N 3.19Å; K158-R161 PolarHBondContact O-N 2.85Å; K158-L162 PolarHBondContact O-N 3.19Å
159	E	80.4	Confident	76.5	Confident	108 Å²	108	117.2 Å²	117.2	51%	0.505	56%	0.562	S	S	.	*	H	α-helix	trans	-65.3	-47	178.3	-174.1	166.9	-149.3	0	0	111.9	A155 S156 R161 L162 Y163	A155-E159 PolarHBondContact O-N 3.48Å; S156-E159 PolarHBondContact O-N 2.95Å; E159-R161 VanDerWaalsContact C-N 3.26Å; E159-R161 PolarHBondContact O-N 3.04Å; E159-L162 WeakPolarHBondContact O-CB 3.44Å; E159-L162 PolarHBondContact O-N 3.24Å; E159-Y163 HydrophobicContact CG-CD2 3.98Å; E159-Y163 HydrophobicContact CG-CE2 3.61Å; E159-Y163 WeakPolarHBondContact O-CD2 3.38Å; E159-Y163 PolarHBondContact O-N 3.43Å; E159-Y163 VanDerWaalsContact O-N 3.15Å
160	S	82.6	Confident	76.7	Confident	70 Å²	70	116.1 Å²	116.1	49%	0.49	56%	0.557	S	S	.	*	H	α-helix	trans	-55.1	-40.8	174.4	173.6	0	0	0	0	112.5	S156 L162 Y163 T164	S156-S160 PolarHBondContact O-N 3.4Å; S160-L162 VanDerWaalsContact C-N 3.31Å; S160-L162 PolarHBondContact O-N 2.87Å; S160-Y163 PolarHBondContact O-N 2.62Å; S160-T164 PolarHBondContact O-N 3.26Å; S160-T164 VanDerWaalsContact O-N 3.13Å; S160-T164 PolarHBondContact O-OG1 2.94Å; S160-T164 VanDerWaalsContact O-OG1 3.11Å
161	R	81.9	Confident	76.7	Confident	138 Å²	138	116.6 Å²	116.6	52%	0.521	56%	0.561	S	S	.	*	H	α-helix	trans	-66.5	-28	176	-74.7	171.5	169	-178.1	-5.7	113.9	K157 K158 E159 K165	K157-R161 WeakPolarHBondContact O-CG 3.49Å; K157-R161 PolarHBondContact O-N 3.11Å; K158-R161 PolarHBondContact O-N 2.85Å; E159-R161 VanDerWaalsContact C-N 3.26Å; E159-R161 PolarHBondContact O-N 3.04Å; R161-K165 VanDerWaalsContact O-CG 3.31Å; R161-K165 WeakPolarHBondContact O-CG 3.35Å; R161-K165 PolarHBondContact O-N 3.3Å
162	L	80.6	Confident	76.5	Confident	104 Å²	104	114.3 Å²	114.3	55%	0.545	55%	0.554	S	S	.	*	H	α-helix	trans	-74.7	-42.1	176.9	-71.6	172.2	0	0	0	110.7	K158 E159 S160 K165 L166	K158-L162 PolarHBondContact O-N 3.19Å; E159-L162 WeakPolarHBondContact O-CB 3.44Å; E159-L162 PolarHBondContact O-N 3.24Å; S160-L162 VanDerWaalsContact C-N 3.31Å; S160-L162 PolarHBondContact O-N 2.87Å; L162-K165 PolarHBondContact O-N 3.47Å; L162-L166 WeakPolarHBondContact O-CB 3.42Å; L162-L166 PolarHBondContact O-N 3.11Å
163	Y	79.6	Confident	76.2	Confident	159 Å²	159	112.6 Å²	112.6	62%	0.624	55%	0.546	S	S	*	.	H	α-helix	trans	-63.5	-43.2	176.4	-76.3	-72.2	0	0	0	112.4	E159 S160 K165 L166 D167	E159-Y163 HydrophobicContact CG-CD2 3.98Å; E159-Y163 HydrophobicContact CG-CE2 3.61Å; E159-Y163 WeakPolarHBondContact O-CD2 3.38Å; E159-Y163 PolarHBondContact O-N 3.43Å; E159-Y163 VanDerWaalsContact O-N 3.15Å; S160-Y163 PolarHBondContact O-N 2.62Å; Y163-K165 VanDerWaalsContact C-N 3.35Å; Y163-K165 PolarHBondContact O-N 3.13Å; Y163-L166 PolarHBondContact O-N 3.18Å; Y163-L166 VanDerWaalsContact O-N 3.15Å; Y163-D167 WeakPolarHBondContact O-CB 3.34Å; Y163-D167 PolarHBondContact O-N 2.84Å
164	T	80.5	Confident	75.7	Confident	76 Å²	76	112.7 Å²	112.7	47%	0.466	54%	0.543	S	S	.	.	H	α-helix	trans	-58.9	-44.6	175.1	-51.2	0	0	0	0	112.1	S160 L166 D167 D168	S160-T164 PolarHBondContact O-N 3.26Å; S160-T164 VanDerWaalsContact O-N 3.13Å; S160-T164 PolarHBondContact O-OG1 2.94Å; S160-T164 VanDerWaalsContact O-OG1 3.11Å; T164-L166 VanDerWaalsContact C-N 3.26Å; T164-L166 PolarHBondContact O-N 2.97Å; T164-D167 PolarHBondContact O-N 3.43Å; T164-D168 VanDerWaalsContact O-CG 3.3Å; T164-D168 PolarHBondContact O-N 2.88Å
165	K	80.2	Confident	75.2	Confident	147 Å²	147	112.5 Å²	112.5	64%	0.639	55%	0.547	S	S	*	.	H	α-helix	trans	-65.3	-31.3	178.1	-74.3	177.1	178.8	-171.7	0	113.1	R161 L162 Y163 R169	R161-K165 VanDerWaalsContact O-CG 3.31Å; R161-K165 WeakPolarHBondContact O-CG 3.35Å; R161-K165 PolarHBondContact O-N 3.3Å; L162-K165 PolarHBondContact O-N 3.47Å; Y163-K165 VanDerWaalsContact C-N 3.35Å; Y163-K165 PolarHBondContact O-N 3.13Å; K165-R169 WeakPolarHBondContact O-CB 3.35Å; K165-R169 PolarHBondContact O-N 3.46Å
166	L	76.6	Confident	74.8	Confident	104 Å²	104	113.3 Å²	113.3	55%	0.545	55%	0.549	S	S	.	.	H	α-helix	trans	-77.5	-38.2	-179.8	-152.6	137	0	0	0	110.2	L162 Y163 T164 R169 I170	L162-L166 WeakPolarHBondContact O-CB 3.42Å; L162-L166 PolarHBondContact O-N 3.11Å; Y163-L166 PolarHBondContact O-N 3.18Å; Y163-L166 VanDerWaalsContact O-N 3.15Å; T164-L166 VanDerWaalsContact C-N 3.26Å; T164-L166 PolarHBondContact O-N 2.97Å; L166-R169 PolarHBondContact O-N 3.31Å; L166-I170 HydrophobicContact CD2-CD1 3.53Å; L166-I170 HydrophobicContact CD2-CG1 4.26Å; L166-I170 VanDerWaalsContact O-CG1 3.28Å; L166-I170 WeakPolarHBondContact O-CG1 3.33Å; L166-I170 PolarHBondContact O-N 2.94Å
167	D	78.4	Confident	74.1	Confident	82 Å²	82	112.7 Å²	112.7	44%	0.439	55%	0.545	S	S	.	.	H	α-helix	trans	-63.9	-46.3	172.6	-165.3	33.4	0	0	0	111.5	Y163 T164 R169 I170 Q171	Y163-D167 WeakPolarHBondContact O-CB 3.34Å; Y163-D167 PolarHBondContact O-N 2.84Å; T164-D167 PolarHBondContact O-N 3.43Å; D167-R169 VanDerWaalsContact C-N 3.26Å; D167-R169 PolarHBondContact O-N 3.31Å; D167-I170 PolarHBondContact O-N 3.49Å; D167-Q171 VanDerWaalsContact CG-NE2 3.25Å; D167-Q171 WeakPolarHBondContact O-CB 3.29Å; D167-Q171 VanDerWaalsContact O-CG 3.3Å; D167-Q171 WeakPolarHBondContact O-CG 3.38Å; D167-Q171 PolarHBondContact O-N 3.24Å; D167-Q171 PolarHBondContact OD1-NE2 3.33Å; D167-Q171 PolarHBondContact OD2-NE2 3.49Å
168	D	74.9	Confident	73.2	Confident	94 Å²	94	117.5 Å²	117.5	50%	0.503	56%	0.56	S	S	.	*	H	α-helix	trans	-56.9	-40.6	174.2	-71	-24.1	0	0	0	111.9	T164 S172	T164-D168 VanDerWaalsContact O-CG 3.3Å; T164-D168 PolarHBondContact O-N 2.88Å; D168-S172 VanDerWaalsContact O-CB 3.29Å; D168-S172 WeakPolarHBondContact O-CB 3.33Å; D168-S172 PolarHBondContact O-N 2.97Å; D168-S172 PolarHBondContact O-OG 3.33Å
169	R	72.1	Confident	72.8	Confident	182 Å²	182	117.5 Å²	117.5	69%	0.687	56%	0.556	S	S	*	*	H	α-helix	trans	-73.5	-37.4	179.9	-174.1	178.8	176	-164.7	-2.1	112.5	K165 L166 D167 N173	K165-R169 WeakPolarHBondContact O-CB 3.35Å; K165-R169 PolarHBondContact O-N 3.46Å; L166-R169 PolarHBondContact O-N 3.31Å; D167-R169 VanDerWaalsContact C-N 3.26Å; D167-R169 PolarHBondContact O-N 3.31Å; R169-N173 VanDerWaalsContact O-CB 3.3Å; R169-N173 WeakPolarHBondContact O-CB 3.38Å; R169-N173 PolarHBondContact O-N 3.45Å
170	I	71.3	Confident	72.6	Confident	84 Å²	84	114.6 Å²	114.6	43%	0.431	55%	0.551	S	S	.	*	H	α-helix	trans	-66.3	-52.6	174.2	-70.5	172.1	0	0	0	108.2	L166 D167 S172 N173 Y174	L166-I170 HydrophobicContact CD2-CD1 3.53Å; L166-I170 HydrophobicContact CD2-CG1 4.26Å; L166-I170 VanDerWaalsContact O-CG1 3.28Å; L166-I170 WeakPolarHBondContact O-CG1 3.33Å; L166-I170 PolarHBondContact O-N 2.94Å; D167-I170 PolarHBondContact O-N 3.49Å; I170-S172 VanDerWaalsContact C-N 3.33Å; I170-S172 PolarHBondContact O-N 3.39Å; I170-N173 PolarHBondContact O-N 3.26Å; I170-Y174 HydrophobicContact CG2-CD2 4.15Å; I170-Y174 WeakPolarHBondContact O-CB 3.35Å; I170-Y174 PolarHBondContact O-N 3.47Å
171	Q	68.1	Low	72.2	Confident	132 Å²	132	115 Å²	115	62%	0.617	55%	0.547	S	S	*	.	H	α-helix	trans	-60.5	-38.4	-178.3	-68.5	-177.6	16.6	0	0	113	D167	D167-Q171 VanDerWaalsContact CG-NE2 3.25Å; D167-Q171 WeakPolarHBondContact O-CB 3.29Å; D167-Q171 VanDerWaalsContact O-CG 3.3Å; D167-Q171 WeakPolarHBondContact O-CG 3.38Å; D167-Q171 PolarHBondContact O-N 3.24Å; D167-Q171 PolarHBondContact OD1-NE2 3.33Å; D167-Q171 PolarHBondContact OD2-NE2 3.49Å
172	S	65.6	Low	72	Confident	73 Å²	73	113.7 Å²	113.7	51%	0.51	55%	0.547	S	S	.	.	H	α-helix	trans	-75.1	-27.8	179	80.5	0	0	0	0	113.8	D168 I170 S176	D168-S172 VanDerWaalsContact O-CB 3.29Å; D168-S172 WeakPolarHBondContact O-CB 3.33Å; D168-S172 PolarHBondContact O-N 2.97Å; D168-S172 PolarHBondContact O-OG 3.33Å; I170-S172 VanDerWaalsContact C-N 3.33Å; I170-S172 PolarHBondContact O-N 3.39Å; S172-S176 PolarHBondContact O-OG 2.88Å; S172-S176 VanDerWaalsContact O-OG 3.06Å
173	N	69.2	Low	71.9	Confident	93 Å²	93	113.6 Å²	113.6	50%	0.497	55%	0.546	S	S	.	.	H	α-helix	trans	-115	-6.8	-169.6	-64.7	-4.4	0	0	0	115.6	R169 I170 F175 S176	R169-N173 VanDerWaalsContact O-CB 3.3Å; R169-N173 WeakPolarHBondContact O-CB 3.38Å; R169-N173 PolarHBondContact O-N 3.45Å; I170-N173 PolarHBondContact O-N 3.26Å; N173-F175 PolarHBondContact O-N 3.28Å; N173-S176 VanDerWaalsContact CA-OG 3.3Å; N173-S176 WeakPolarHBondContact CA-OG 3.46Å
174	Y	64	Low	71.8	Confident	169 Å²	169	111.8 Å²	111.8	66%	0.663	55%	0.546	S	S	*	.	S	Bend	trans	-66.9	-35.6	-176.3	-162.7	-99.5	0	0	0	113	I170	I170-Y174 HydrophobicContact CG2-CD2 4.15Å; I170-Y174 WeakPolarHBondContact O-CB 3.35Å; I170-Y174 PolarHBondContact O-N 3.47Å
175	F	55.3	Low	71.8	Confident	166 Å²	166	116.7 Å²	116.7	73%	0.728	56%	0.556	S	S	*	*	S	Bend	trans	-105.5	-7.3	-179.3	-68.3	-74.6	0	0	0	114.8	N173 S177	N173-F175 PolarHBondContact O-N 3.28Å; F175-S177 PolarHBondContact O-N 3.12Å
176	S	65.6	Low	71.8	Confident	71 Å²	71	113.4 Å²	113.4	50%	0.497	55%	0.546	S	S	.	.			trans	-87	15.9	-179.4	45	0	0	0	0	113.3	S172 N173 R178	S172-S176 PolarHBondContact O-OG 2.88Å; S172-S176 VanDerWaalsContact O-OG 3.06Å; N173-S176 VanDerWaalsContact CA-OG 3.3Å; N173-S176 WeakPolarHBondContact CA-OG 3.46Å; S176-R178 PolarHBondContact O-N 3.44Å
177	S	65.8	Low	71.8	Confident	64 Å²	64	111 Å²	111	45%	0.448	54%	0.54	S	S	.	.			trans	-61.7	100	166.1	-177.6	0	0	0	0	108.9	F175 R179 A180 D181	F175-S177 PolarHBondContact O-N 3.12Å; S177-R179 PolarHBondContact O-N 2.97Å; S177-A180 WeakPolarHBondContact O-CB 3.35Å; S177-A180 PolarHBondContact O-N 3.21Å; S177-D181 PolarHBondContact O-N 3.13Å
178	R	64.6	Low	71.7	Confident	217 Å²	217	110 Å²	110	82%	0.819	54%	0.544	S	S	*	.	H	α-helix	trans	-50	-24.2	178.9	-157.7	173.4	179.2	-177.5	-0.7	112.6	S176 Q182	S176-R178 PolarHBondContact O-N 3.44Å; R178-Q182 VanDerWaalsContact O-CB 3.31Å; R178-Q182 WeakPolarHBondContact O-CB 3.47Å; R178-Q182 PolarHBondContact O-N 3.28Å
179	R	72.3	Confident	71.6	Confident	135 Å²	135	114 Å²	114	51%	0.509	55%	0.552	S	S	.	*	H	α-helix	trans	-72.8	-42.8	174.6	-162.7	-175.4	-167.2	-171.2	9.7	112.5	E51 S177 Q182 I183	E51-R179 IonicContact OE1-CZ 3.54Å; E51-R179 IonicContact OE1-NH1 2.9Å; E51-R179 PolarHBondContact OE1-NH1 3.12Å; E51-R179 IonicContact OE1-NH2 3.26Å; E51-R179 PolarHBondContact OE1-NH2 3.29Å; E51-R179 IonicContact OE2-NH1 3.83Å; S177-R179 PolarHBondContact O-N 2.97Å; R179-Q182 PolarHBondContact O-N 3.31Å; R179-Q182 VanDerWaalsContact O-N 3.14Å; R179-I183 HydrophobicContact CG-CD1 4.1Å; R179-I183 WeakPolarHBondContact O-CG1 3.44Å; R179-I183 PolarHBondContact O-N 2.96Å
180	A	75.2	Confident	71.3	Confident	47 Å²	47	108.2 Å²	108.2	39%	0.388	54%	0.539	S	S	.	.	H	α-helix	trans	-63.3	-46.2	179.8	0	0	0	0	0	111.2	S177 Q182 I183 L184	S177-A180 WeakPolarHBondContact O-CB 3.35Å; S177-A180 PolarHBondContact O-N 3.21Å; A180-Q182 VanDerWaalsContact C-N 3.26Å; A180-Q182 PolarHBondContact O-N 3.38Å; A180-I183 PolarHBondContact O-N 3Å; A180-L184 WeakPolarHBondContact O-CG 3.39Å; A180-L184 PolarHBondContact O-N 3.28Å
181	D	73.9	Confident	70.8	Confident	77 Å²	77	111 Å²	111	41%	0.412	55%	0.55	S	S	.	.	H	α-helix	trans	-59.4	-37.5	172.4	-84.4	-24.3	0	0	0	112.3	S177 R185	S177-D181 PolarHBondContact O-N 3.13Å; D181-R185 WeakPolarHBondContact O-CB 3.26Å; D181-R185 VanDerWaalsContact O-CG 3.23Å; D181-R185 WeakPolarHBondContact O-CG 3.33Å; D181-R185 PolarHBondContact O-N 3.17Å
182	Q	78.6	Confident	70.4	Confident	112 Å²	112	108.8 Å²	108.8	52%	0.523	55%	0.55	S	S	.	.	H	α-helix	trans	-71.1	-38.3	179	-169.1	141.8	25	0	0	112.2	R178 R179 A180 R185 N186	R178-Q182 VanDerWaalsContact O-CB 3.31Å; R178-Q182 WeakPolarHBondContact O-CB 3.47Å; R178-Q182 PolarHBondContact O-N 3.28Å; R179-Q182 PolarHBondContact O-N 3.31Å; R179-Q182 VanDerWaalsContact O-N 3.14Å; A180-Q182 VanDerWaalsContact C-N 3.26Å; A180-Q182 PolarHBondContact O-N 3.38Å; Q182-R185 PolarHBondContact O-N 3.49Å; Q182-N186 VanDerWaalsContact O-CB 3.29Å; Q182-N186 WeakPolarHBondContact O-CB 3.27Å; Q182-N186 PolarHBondContact O-N 2.89Å; Q182-N186 PolarHBondContact O-ND2 3.08Å; Q182-N186 PolarHBondContact O-OD1 3.12Å
183	I	78.9	Confident	70	Confident	102 Å²	102	112 Å²	112	52%	0.523	56%	0.557	S	S	.	*	H	α-helix	trans	-62.5	-46.7	173.4	-68.4	159.8	0	0	0	110.2	R179 A180 R185 N186 A187	R179-I183 HydrophobicContact CG-CD1 4.1Å; R179-I183 WeakPolarHBondContact O-CG1 3.44Å; R179-I183 PolarHBondContact O-N 2.96Å; A180-I183 PolarHBondContact O-N 3Å; I183-R185 PolarHBondContact O-N 3.39Å; I183-N186 PolarHBondContact O-N 2.91Å; I183-A187 WeakPolarHBondContact O-CB 3.42Å; I183-A187 PolarHBondContact O-N 3.43Å
184	L	77.3	Confident	69.3	Low	120 Å²	120	117.1 Å²	117.1	63%	0.628	57%	0.569	S	S	*	*	H	α-helix	trans	-61.9	-42.9	178.2	-70.8	173.3	0	0	0	112.3	A180 A187 A188	A180-L184 WeakPolarHBondContact O-CG 3.39Å; A180-L184 PolarHBondContact O-N 3.28Å; L184-A187 PolarHBondContact O-N 3.4Å; L184-A188 WeakPolarHBondContact O-CB 3.2Å; L184-A188 PolarHBondContact O-N 3.25Å
185	R	80.1	Confident	68.8	Low	179 Å²	179	118.6 Å²	118.6	68%	0.675	58%	0.575	S	S	*	*	H	α-helix	trans	-65.2	-38.6	176.1	-72.7	174.9	-171.6	-160.1	3.8	112.5	D181 Q182 I183 R189	D181-R185 WeakPolarHBondContact O-CB 3.26Å; D181-R185 VanDerWaalsContact O-CG 3.23Å; D181-R185 WeakPolarHBondContact O-CG 3.33Å; D181-R185 PolarHBondContact O-N 3.17Å; Q182-R185 PolarHBondContact O-N 3.49Å; I183-R185 PolarHBondContact O-N 3.39Å; R185-R189 PolarHBondContact O-N 3.23Å; R185-R189 VanDerWaalsContact O-N 3.12Å
186	N	80.7	Confident	68.6	Low	79 Å²	79	120.9 Å²	120.9	42%	0.422	58%	0.578	S	S	.	*	H	α-helix	trans	-72.6	-36.2	179	-70.5	-8.3	0	0	0	111.8	Q182 I183 R189 S190	Q182-N186 VanDerWaalsContact O-CB 3.29Å; Q182-N186 WeakPolarHBondContact O-CB 3.27Å; Q182-N186 PolarHBondContact O-N 2.89Å; Q182-N186 PolarHBondContact O-ND2 3.08Å; Q182-N186 PolarHBondContact O-OD1 3.12Å; I183-N186 PolarHBondContact O-N 2.91Å; N186-R189 PolarHBondContact O-N 2.94Å; N186-S190 WeakPolarHBondContact O-CB 3.37Å; N186-S190 PolarHBondContact O-N 3.33Å; N186-S190 PolarHBondContact O-OG 3.26Å
187	A	76.8	Confident	67.9	Low	52 Å²	52	122.6 Å²	122.6	43%	0.43	59%	0.59	S	S	.	*	H	α-helix	trans	-62.9	-47.1	172.9	0	0	0	0	0	111.4	I183 L184 R189 S190 E191	I183-A187 WeakPolarHBondContact O-CB 3.42Å; I183-A187 PolarHBondContact O-N 3.43Å; L184-A187 PolarHBondContact O-N 3.4Å; A187-R189 VanDerWaalsContact C-N 3.31Å; A187-R189 PolarHBondContact O-N 3.27Å; A187-S190 PolarHBondContact O-N 2.94Å; A187-S190 VanDerWaalsContact O-N 3.15Å; A187-E191 PolarHBondContact O-N 3.46Å; A187-E191 VanDerWaalsContact O-N 3.14Å
188	A	75.3	Confident	67.2	Low	61 Å²	61	124.3 Å²	124.3	50%	0.504	60%	0.602	S	S	.	*	H	α-helix	trans	-62.5	-35.1	177.2	0	0	0	0	0	113.1	L184 S192	L184-A188 WeakPolarHBondContact O-CB 3.2Å; L184-A188 PolarHBondContact O-N 3.25Å; A188-S192 PolarHBondContact O-N 3.38Å
189	R	72.1	Confident	66.3	Low	180 Å²	180	120.4 Å²	120.4	68%	0.679	60%	0.598	S	S	*	*	H	α-helix	trans	-68.4	-40.4	173.7	-80.4	-178.7	168.1	178.5	-4.6	112.4	R185 N186 A187 E191 S192 E193	R185-R189 PolarHBondContact O-N 3.23Å; R185-R189 VanDerWaalsContact O-N 3.12Å; N186-R189 PolarHBondContact O-N 2.94Å; A187-R189 VanDerWaalsContact C-N 3.31Å; A187-R189 PolarHBondContact O-N 3.27Å; R189-E191 VanDerWaalsContact C-N 3.34Å; R189-E191 PolarHBondContact O-N 2.92Å; R189-S192 PolarHBondContact O-N 2.84Å; R189-E193 PolarHBondContact O-N 3.21Å
190	S	66.2	Low	64.9	Low	59 Å²	59	122.6 Å²	122.6	41%	0.413	61%	0.613	S	S	.	*	H	α-helix	trans	-68.1	-31	-178.6	-60.1	0	0	0	0	113.2	N186 A187 R194	N186-S190 WeakPolarHBondContact O-CB 3.37Å; N186-S190 PolarHBondContact O-N 3.33Å; N186-S190 PolarHBondContact O-OG 3.26Å; A187-S190 PolarHBondContact O-N 2.94Å; A187-S190 VanDerWaalsContact O-N 3.15Å; S190-R194 WeakPolarHBondContact O-CG 3.01Å
191	E	61.9	Low	63.3	Low	142 Å²	142	127 Å²	127	66%	0.664	64%	0.636	S	S	*	*	H	α-helix	trans	-73.3	-36.6	173	-74.2	-173.8	161.1	0	0	112.6	A187 R189 E193 R194	A187-E191 PolarHBondContact O-N 3.46Å; A187-E191 VanDerWaalsContact O-N 3.14Å; R189-E191 VanDerWaalsContact C-N 3.34Å; R189-E191 PolarHBondContact O-N 2.92Å; E191-E193 PolarHBondContact O-N 3.04Å; E191-R194 PolarHBondContact O-N 2.85Å
192	S	59.2	Low	61.7	Low	87 Å²	87	127.7 Å²	127.7	61%	0.608	65%	0.652	S	S	*	*	H	α-helix	trans	-70	-31	-179.8	-141.7	0	0	0	0	113	A188 R189	A188-S192 PolarHBondContact O-N 3.38Å; R189-S192 PolarHBondContact O-N 2.84Å
193	E	57.7	Low	59.8	Low	141 Å²	141	134 Å²	134	66%	0.659	67%	0.671	S	S	*	*	H	α-helix	trans	-76.9	-27.7	178.4	-71.7	-178.5	177.6	0	0	113.5	R189 E191 Y195 R196 S197	R189-E193 PolarHBondContact O-N 3.21Å; E191-E193 PolarHBondContact O-N 3.04Å; E193-Y195 VanDerWaalsContact C-N 3.28Å; E193-Y195 PolarHBondContact O-N 3.01Å; E193-R196 PolarHBondContact O-N 3.16Å; E193-S197 PolarHBondContact O-N 3.46Å
194	R	54.3	Low	58.2	Low	200 Å²	200	136.3 Å²	136.3	76%	0.755	68%	0.684	S	S	*	*	H	α-helix	trans	-67.1	-27.4	176.7	-71.2	-178.7	-160.7	-171.6	6.3	113.1	S190 E191	S190-R194 WeakPolarHBondContact O-CG 3.01Å; E191-R194 PolarHBondContact O-N 2.85Å
195	Y	52.9	Low	56.6	Low	199 Å²	199	137 Å²	137	78%	0.78	69%	0.688	S	S	*	*	H	α-helix	trans	-84.4	-20.3	175.9	-84.8	-83.6	0	0	0	114	E193	E193-Y195 VanDerWaalsContact C-N 3.28Å; E193-Y195 PolarHBondContact O-N 3.01Å
196	R	50.8	Low	54.8	Low	215 Å²	215	135.7 Å²	135.7	81%	0.811	69%	0.694	S	S	*	*	H	α-helix	trans	-89.8	-24.3	-175.5	-140.9	176.3	-171.2	-176	2.1	114	E193	E193-R196 PolarHBondContact O-N 3.16Å
197	S	51.6	Low	53.1	Low	107 Å²	107	142.2 Å²	142.2	75%	0.748	72%	0.719	S	S	*	*	G	3₁₀ helix	trans	-82.2	-12.1	-177.2	-151.2	0	0	0	0	114.3	E193 N199	E193-S197 PolarHBondContact O-N 3.46Å; S197-N199 VanDerWaalsContact C-N 3.35Å; S197-N199 PolarHBondContact O-N 2.98Å
198	S	51.6	Low	51.2	Low	99 Å²	99	144.9 Å²	144.9	69%	0.692	74%	0.735	S	S	*	*	G	3₁₀ helix	trans	-83.9	0.6	-175.8	-133.3	0	0	0	0	115.2
199	N	45.7	Very low	49.4	Very low	136 Å²	136	148 Å²	148	73%	0.727	75%	0.752	S	S	*	*	G	3₁₀ helix	trans	-112.3	16.4	-168.2	-71.4	-31.1	0	0	0	116.4	S197	S197-N199 VanDerWaalsContact C-N 3.35Å; S197-N199 PolarHBondContact O-N 2.98Å
200	H	42.1	Very low	47.7	Very low	180 Å²	180	148.5 Å²	148.5	83%	0.833	76%	0.759	S	S	*	*	S	Bend	trans	-112.5	11.3	-175.6	-98.6	-70.4	0	0	0	117.6
201	T	41.9	Very low	46.4	Very low	141 Å²	141	153.9 Å²	153.9	87%	0.865	78%	0.782	S	S	*	*			trans	-122	71.7	178.1	59.8	0	0	0	0	112.5
202	A	40.1	Very low	45.1	Very low	91 Å²	91	152.6 Å²	152.6	75%	0.752	78%	0.784	S	S	*	*			trans	-159.7	91.2	166.5	0	0	0	0	0	111.5
203	R	39.1	Very low	44.3	Very low	243 Å²	243	155 Å²	155	92%	0.917	80%	0.795	S	S	*	*			trans	157.1	111.6	149.9	-94.9	169.9	167.8	-171.9	-3.6	108.1
204	L	44.3	Very low	43.4	Very low	151 Å²	151	151.2 Å²	151.2	79%	0.791	79%	0.794	S	S	*	*				-179.8	117.1	113	-85.1	176.4	0	0	0	109.4
205	N	43.6	Very low	42.8	Very low	135 Å²	135	149.3 Å²	149.3	72%	0.722	80%	0.799	S	S	*	*			trans	72	95.8	137	-57.5	-6.7	0	0	0	121.1
206	N	43.1	Very low	42.5	Very low	151 Å²	151	145.4 Å²	145.4	81%	0.807	80%	0.796	S	S	*	*				10.1	109.1	124.6	-70.4	-11.9	0	0	0	117.6
207	F	45.2	Very low	42.1	Very low	216 Å²	216	143.7 Å²	143.7	95%	0.947	80%	0.797	S	S	*	*				-144.7	134.6	127.4	-90.3	-75.9	0	0	0	109.1
208	S	35.7	Very low	41.5	Very low	109 Å²	109	144.5 Å²	144.5	76%	0.762	80%	0.803	S	S	*	*			trans	-93.5	125.6	-168.8	151.4	0	0	0	0	110.9
209	C	37.5	Very low	41.2	Very low	126 Å²	126	146.4 Å²	146.4	85%	0.851	81%	0.81	S	S	*	*			trans	-142	117.2	156	31.1	0	0	0	0	109.6
210	K	37.8	Very low	41.1	Very low	191 Å²	191	145.3 Å²	145.3	83%	0.83	81%	0.814	S	S	*	*			trans	-77	137	175.5	-65.7	174.8	176.1	178.4	0	108.9
211	L	38.9	Very low	41.1	Very low	171 Å²	171	145.5 Å²	145.5	90%	0.895	82%	0.82	S	S	*	*			trans	-159	135.8	141.7	-99.9	148.3	0	0	0	109.4
212	T	34.9	Very low	41.2	Very low	116 Å²	116	144.2 Å²	144.2	71%	0.712	82%	0.816	S	S	*	*			trans	-65.9	145.9	-177.4	55.5	0	0	0	0	110.5
213	T	40.7	Very low	41	Very low	136 Å²	136	145.2 Å²	145.2	83%	0.834	82%	0.818	S	S	*	*				178.3	141.5	88.4	42.5	0	0	0	0	111.9
214	G	38.6	Very low	41.1	Very low	63 Å²	63	139.3 Å²	139.3	65%	0.649	81%	0.813	S	S	*	*			trans	82.1	103.2	151	0	0	0	0	0	117.2
215	N	42.2	Very low	41.1	Very low	159 Å²	159	139.9 Å²	139.9	85%	0.85	81%	0.811	S	S	*	*				65.8	117.3	95	-68.1	20.1	0	0	0	111.3
216	T	46.4	Very low	41.1	Very low	117 Å²	117	140.4 Å²	140.4	72%	0.718	82%	0.819	S	S	*	*			cis	-172.2	147.4	43.9	36.2	0	0	0	0	110.9
217	E	42.4	Very low	41.3	Very low	180 Å²	180	141.7 Å²	141.7	84%	0.841	82%	0.817	S	S	*	*			trans	69.1	98.8	143.2	-67	173.2	-165.2	0	0	120.8
218	S	38.7	Very low	41.1	Very low	124 Å²	124	136.6 Å²	136.6	87%	0.867	81%	0.809	S	S	*	*			trans	-83.7	127.7	155.5	-30.1	0	0	0	0	109.3
219	T	46.5	Very low	41.6	Very low	138 Å²	138	136.6 Å²	136.6	85%	0.847	81%	0.809	S	S	*	*			trans	-120.4	118.9	157.9	30.6	0	0	0	0	109.4
220	S	43.7	Very low	42.1	Very low	114 Å²	114	138.9 Å²	138.9	80%	0.797	81%	0.809	S	S	*	*			trans	-64.2	132.9	176.8	47.7	0	0	0	0	111.9	S222	S220-S222 PolarHBondContact O-N 3.45Å
221	L	40.9	Very low	42.1	Very low	184 Å²	184	137.1 Å²	137.1	96%	0.963	81%	0.809	S	S	*	*			trans	-67.5	114.9	168.5	-71.4	162.5	0	0	0	109.8
222	S	44	Very low	42.4	Very low	113 Å²	113	132.7 Å²	132.7	79%	0.79	80%	0.797	S	S	*	*			trans	-95.3	129.6	167.1	-178.4	0	0	0	0	109.5	S220	S220-S222 PolarHBondContact O-N 3.45Å
223	S	36.2	Very low	42.8	Very low	113 Å²	113	137.3 Å²	137.3	79%	0.79	80%	0.803	S	S	*	*			trans	-55.3	135.6	171.2	-167.8	0	0	0	0	111.6
224	C	41.4	Very low	42.8	Very low	119 Å²	119	138.8 Å²	138.8	80%	0.804	81%	0.805	S	S	*	*			trans	-131.9	131.5	160	55.3	0	0	0	0	110.4
225	E	44	Very low	43.4	Very low	163 Å²	163	143.4 Å²	143.4	76%	0.762	81%	0.809	S	S	*	*			trans	-68.2	136.1	-170.8	-61.2	167.2	145	0	0	112	K227	E225-K227 PolarHBondContact O-N 2.96Å
226	V	45	Very low	43.6	Very low	146 Å²	146	146 Å²	146	89%	0.885	81%	0.809	S	S	*	*			trans	-78.4	100.9	168.2	-175.6	0	0	0	0	108
227	K	47.7	Very low	44	Very low	177 Å²	177	145.7 Å²	145.7	77%	0.77	81%	0.808	S	S	*	*			trans	-87.2	108.2	163.4	-72.9	-177.1	-179.2	174.8	0	108.8	E225 S229	E225-K227 PolarHBondContact O-N 2.96Å; K227-S229 PolarHBondContact O-N 3.22Å
228	S	39.5	Very low	44.2	Very low	110 Å²	110	144.2 Å²	144.2	77%	0.769	81%	0.806	S	S	*	*			trans	-62.7	112.9	165.2	-175.9	0	0	0	0	109
229	S	47.5	Very low	44.5	Very low	108 Å²	108	144.3 Å²	144.3	76%	0.755	80%	0.801	S	S	*	*			trans	-120.8	90.9	167.4	-172.1	0	0	0	0	107.2	K227 D231	K227-S229 PolarHBondContact O-N 3.22Å; S229-D231 PolarHBondContact O-N 3.18Å
230	M	46.8	Very low	44.6	Very low	174 Å²	174	149.3 Å²	149.3	86%	0.857	81%	0.805	S	S	*	*			trans	-92.5	79.6	175.9	-168.4	146.8	177.1	0	0	107.7
231	D	38.8	Very low	45	Very low	154 Å²	154	153.7 Å²	153.7	82%	0.824	81%	0.809	S	S	*	*			trans	-158.2	89.4	173	-89.2	-38	0	0	0	109.5	S229	S229-D231 PolarHBondContact O-N 3.18Å
232	A	45.1	Very low	45.9	Very low	79 Å²	79	154.3 Å²	154.3	65%	0.653	80%	0.804	S	S	*	*			trans	-179.4	147.6	150.6	0	0	0	0	0	109.9
233	Y	41.9	Very low	46.9	Very low	213 Å²	213	155 Å²	155	84%	0.835	81%	0.806	S	S	*	*			trans	95	70	166.3	-52.6	-74.8	0	0	0	118.1
234	L	42.3	Very low	48.2	Very low	167 Å²	167	158.1 Å²	158.1	87%	0.874	81%	0.81	S	S	*	*			trans	-114.3	78.4	135.6	-87	167.5	0	0	0	108.4
235	H	50.8	Low	49	Very low	160 Å²	160	161.8 Å²	161.8	74%	0.741	81%	0.812	S	S	*	*			trans	-126.3	105.2	165.5	-170	75.5	0	0	0	107.5	P237	H235-P237 VanDerWaalsContact O-CD 3.27Å; H235-P237 WeakPolarHBondContact O-CD 3.45Å
236	Y	45.1	Very low	49.4	Very low	214 Å²	214	161.9 Å²	161.9	84%	0.839	82%	0.817	S	S	*	*			trans	-68.5	119.9	173.3	-88	-95.1	0	0	0	109.6
237	P	55.5	Low	50	Low	110 Å²	110	162 Å²	162	71%	0.714	81%	0.813	S	S	*	*			trans	-97.4	137.8	163	24.3	-6.3	0	0	0	110.7	H235	H235-P237 VanDerWaalsContact O-CD 3.27Å; H235-P237 WeakPolarHBondContact O-CD 3.45Å
238	D	47.1	Very low	50.3	Low	149 Å²	149	159 Å²	159	80%	0.797	81%	0.812	S	S	*	*			trans	-40	148.6	177	-164.8	6.9	0	0	0	116.5	R240	D238-R240 PolarHBondContact O-N 3.47Å
239	V	45.3	Very low	50.6	Low	126 Å²	126	162.7 Å²	162.7	76%	0.764	82%	0.819	S	S	*	*	S	Bend	trans	-76.5	96.3	-170.7	-155	0	0	0	0	109.1
240	R	47.2	Very low	50.5	Low	242 Å²	242	162.2 Å²	162.2	91%	0.913	82%	0.816	S	S	*	*			trans	173.6	74.2	155.7	-99.8	172.7	-104.7	-158.4	-3.4	111.6	D238	D238-R240 PolarHBondContact O-N 3.47Å
241	K	53.7	Low	50.2	Low	206 Å²	206	161.9 Å²	161.9	90%	0.896	81%	0.812	S	S	*	*			trans	-130.7	123.5	161.6	-72.2	-172.2	-179.1	177	0	110.3
242	K	60	Low	50.4	Low	198 Å²	198	164.1 Å²	164.1	86%	0.861	82%	0.815	S	S	*	*			trans	-53.9	148.5	175.6	-68.5	170.8	178	175.8	0	109.7	M244	K242-M244 PolarHBondContact O-N 3.21Å
243	P	63.5	Low	50.3	Low	126 Å²	126	164.5 Å²	164.5	82%	0.818	82%	0.818	S	S	*	*			trans	-56.6	129	179.4	23.9	-33.3	0	0	0	110	K245	P243-K245 PolarHBondContact O-N 2.68Å; P243-K245 VanDerWaalsContact O-N 3.08Å
244	M	64.5	Low	50.6	Low	179 Å²	179	162 Å²	162	88%	0.882	82%	0.818	S	S	*	*			trans	-59.2	112.9	167.7	-84.4	174.3	69	0	0	107.4	K242 L246	K242-M244 PolarHBondContact O-N 3.21Å; M244-L246 PolarHBondContact O-N 3.24Å; M244-L246 VanDerWaalsContact O-N 3.15Å
245	K	58.8	Low	50.4	Low	196 Å²	196	161 Å²	161	85%	0.852	81%	0.814	S	S	*	*			trans	-62.2	113.1	164	-74.6	-178.5	174.4	-178.7	0	106.7	P243 N247	P243-K245 PolarHBondContact O-N 2.68Å; P243-K245 VanDerWaalsContact O-N 3.08Å; K245-N247 PolarHBondContact O-N 3.47Å
246	L	51.3	Low	49.8	Very low	165 Å²	165	158.7 Å²	158.7	86%	0.864	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-64.1	117.9	164.4	-74.6	165	0	0	0	107	M244	M244-L246 PolarHBondContact O-N 3.24Å; M244-L246 VanDerWaalsContact O-N 3.15Å
247	N	57	Low	49.9	Very low	148 Å²	148	154.6 Å²	154.6	79%	0.791	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-62.7	129.3	169.3	-79.4	-24.4	0	0	0	108	K245 M249	K245-N247 PolarHBondContact O-N 3.47Å; N247-M249 PolarHBondContact O-N 3.19Å
248	P	54.2	Low	49.4	Very low	116 Å²	116	156.9 Å²	156.9	75%	0.753	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-63.2	131.4	164.9	27.7	-30.7	0	0	0	107.4	S250	P248-S250 PolarHBondContact O-N 3.18Å
249	M	46.6	Very low	49.3	Very low	187 Å²	187	154.9 Å²	154.9	92%	0.921	81%	0.807	S	S	*	*			trans	-52.6	109.1	173.9	-72.6	-157.8	72.7	0	0	109.8	N247	N247-M249 PolarHBondContact O-N 3.19Å
250	S	44.9	Very low	49.2	Very low	98 Å²	98	158.6 Å²	158.6	69%	0.685	81%	0.809	S	S	*	*			trans	-87.1	151.4	157.3	57.5	0	0	0	0	108.7	P248	P248-S250 PolarHBondContact O-N 3.18Å
251	E	41.2	Very low	49	Very low	167 Å²	167	154.4 Å²	154.4	78%	0.78	80%	0.8	S	S	*	*			trans	89.2	93.1	178.7	-57.3	-175.7	153.9	0	0	115
252	F	42.1	Very low	48.3	Very low	200 Å²	200	154.1 Å²	154.1	88%	0.877	80%	0.801	S	S	*	*				-158.2	91.2	102.9	-93.5	-75.7	0	0	0	107.9	L254	F252-L254 PolarHBondContact O-N 2.83Å
253	A	43.4	Very low	47.6	Very low	88 Å²	88	151.6 Å²	151.6	73%	0.727	79%	0.793	S	S	*	*			trans	-74.9	98.8	165	0	0	0	0	0	108	N255	A253-N255 VanDerWaalsContact C-N 3.26Å; A253-N255 PolarHBondContact O-N 3.48Å; A253-N255 VanDerWaalsContact O-N 3.16Å
254	L	47.7	Very low	46.6	Very low	160 Å²	160	150.7 Å²	150.7	84%	0.838	79%	0.79	S	S	*	*			trans	-79.7	82.8	159.8	-74	175.4	0	0	0	108.2	F252 S256	F252-L254 PolarHBondContact O-N 2.83Å; L254-S256 VanDerWaalsContact C-N 3.28Å; L254-S256 PolarHBondContact O-N 2.95Å; L254-S256 VanDerWaalsContact O-N 3.14Å
255	N	38.6	Very low	45.7	Very low	145 Å²	145	151.4 Å²	151.4	78%	0.775	79%	0.788	S	S	*	*			trans	-75.7	87.3	158.6	-76.7	-10.7	0	0	0	107.8	A253 T257	A253-N255 VanDerWaalsContact C-N 3.26Å; A253-N255 PolarHBondContact O-N 3.48Å; A253-N255 VanDerWaalsContact O-N 3.16Å; N255-T257 PolarHBondContact O-N 2.82Å
256	S	38.8	Very low	45.2	Very low	112 Å²	112	149.1 Å²	149.1	78%	0.783	78%	0.78	S	S	*	*			trans	-93.7	81.5	161.8	-171.9	0	0	0	0	108	L254 H258	L254-S256 VanDerWaalsContact C-N 3.28Å; L254-S256 PolarHBondContact O-N 2.95Å; L254-S256 VanDerWaalsContact O-N 3.14Å; S256-H258 PolarHBondContact O-N 2.7Å
257	T	46.8	Very low	45.1	Very low	129 Å²	129	149.3 Å²	149.3	79%	0.791	77%	0.774	S	S	*	*			trans	-62.6	96.3	163.7	14.2	0	0	0	0	108.6	N255	N255-T257 PolarHBondContact O-N 2.82Å
258	H	44.8	Very low	44.9	Very low	158 Å²	158	148 Å²	148	73%	0.731	77%	0.771	S	S	*	*			trans	-87.5	108.9	158.4	-165.2	46.8	0	0	0	107.8	S256 Y260	S256-H258 PolarHBondContact O-N 2.7Å; H258-Y260 PolarHBondContact O-N 2.93Å
259	V	45.4	Very low	45.2	Very low	107 Å²	107	150.4 Å²	150.4	65%	0.648	77%	0.77	S	S	*	*			trans	-61.7	113.4	171.3	174.8	0	0	0	0	108	E261	V259-E261 HydrophobicContact CG1-CG 4.26Å
260	Y	43.8	Very low	46	Very low	203 Å²	203	152.7 Å²	152.7	80%	0.796	77%	0.768	S	S	*	*			trans	-98.5	104.9	158.4	-115	-86	0	0	0	106.8	H258 Q262	H258-Y260 PolarHBondContact O-N 2.93Å; Y260-Q262 PolarHBondContact O-N 2.86Å
261	E	42.5	Very low	46.6	Very low	155 Å²	155	156.9 Å²	156.9	72%	0.724	77%	0.771	S	S	*	*			trans	-57	110.9	166.7	-78.6	166.5	152	0	0	109.1	V259 E263	V259-E261 HydrophobicContact CG1-CG 4.26Å; E261-E263 VanDerWaalsContact C-N 3.34Å; E261-E263 PolarHBondContact O-N 2.91Å
262	Q	38.7	Very low	47.7	Very low	199 Å²	199	154.7 Å²	154.7	93%	0.93	77%	0.774	S	S	*	*			trans	-85.5	83	154.1	-88.7	-178.5	-52.9	0	0	107.2	Y260	Y260-Q262 PolarHBondContact O-N 2.86Å
263	E	45.8	Very low	48.4	Very low	145 Å²	145	154.8 Å²	154.8	68%	0.678	77%	0.774	S	S	*	*			trans	-88.4	118.2	161.1	-78.2	-162.6	155.9	0	0	109.9	E261 F265	E261-E263 VanDerWaalsContact C-N 3.34Å; E261-E263 PolarHBondContact O-N 2.91Å; E263-F265 PolarHBondContact O-N 3.24Å
264	S	42	Very low	48.8	Very low	108 Å²	108	163 Å²	163	76%	0.755	80%	0.8	S	S	*	*			trans	-51.2	121.4	165.6	49.6	0	0	0	0	112.1
265	F	45.4	Very low	48.9	Very low	193 Å²	193	163.1 Å²	163.1	85%	0.846	80%	0.798	S	S	*	*			trans	-120.2	115.2	151.9	-91.2	-83.7	0	0	0	110.4	E263	E263-F265 PolarHBondContact O-N 3.24Å
266	E	48.6	Very low	49.4	Very low	148 Å²	148	164.1 Å²	164.1	69%	0.692	80%	0.799	S	S	*	*			trans	-58.3	148.2	172.5	-72.8	-177	98.5	0	0	112.8
267	K	48.7	Very low	50	Low	170 Å²	170	166.9 Å²	166.9	74%	0.739	80%	0.8	S	S	*	*			trans	49.4	106.4	143.5	-66.9	167.1	-177.1	137.2	0	117.4
268	V	52.3	Low	50.2	Low	119 Å²	119	169.2 Å²	169.2	72%	0.721	80%	0.801	S	S	*	*				-147.1	114.2	119.1	-165	0	0	0	0	109.9	W270	V268-W270 HydrophobicContact CG1-CG 4.3Å; V268-W270 VanDerWaalsContact CG1-NE1 3.32Å
269	K	60.5	Low	50.5	Low	167 Å²	167	169.9 Å²	169.9	73%	0.726	81%	0.805	S	S	*	*			trans	-103.3	102.4	172.2	-162.5	-178.7	-163.4	-174.7	0	107.2	Y271	K269-Y271 HydrophobicContact CD-CD2 4.14Å; K269-Y271 HydrophobicContact CD-CE2 3.81Å; K269-Y271 HydrophobicContact CG-CD2 4.2Å; K269-Y271 HydrophobicContact CG-CE2 4.21Å
270	W	63.9	Low	50.9	Low	235 Å²	235	174.1 Å²	174.1	89%	0.89	82%	0.815	S	S	*	*			trans	-84.7	109.8	169.2	-72.5	100.9	0	0	0	108.9	V268	V268-W270 HydrophobicContact CG1-CG 4.3Å; V268-W270 VanDerWaalsContact CG1-NE1 3.32Å
271	Y	58.7	Low	51.4	Low	187 Å²	187	172 Å²	172	73%	0.733	82%	0.817	S	S	*	*			trans	-98	117.1	158.6	-91.3	-76.2	0	0	0	107.9	K269	K269-Y271 HydrophobicContact CD-CD2 4.14Å; K269-Y271 HydrophobicContact CD-CE2 3.81Å; K269-Y271 HydrophobicContact CG-CD2 4.2Å; K269-Y271 HydrophobicContact CG-CE2 4.21Å
272	S	62.8	Low	52.1	Low	121 Å²	121	173.3 Å²	173.3	85%	0.846	82%	0.824	S	S	*	*			trans	-96.3	118.5	162.7	-169.3	0	0	0	0	108.2
273	K	56.4	Low	53.2	Low	202 Å²	202	171.2 Å²	171.2	88%	0.878	82%	0.815	S	S	*	*			trans	-146.6	94.8	166.6	-170.2	168.4	-173.5	172.9	0	108.6
274	M	53	Low	53.9	Low	259 Å²	259	173.5 Å²	173.5	100%	1.276	83%	0.828	S	S	*	*			trans	-154.8	0	139.8	-100.5	-167.8	177.2	0	0	107.3

Retrieved 274 of 274 residues in 135.9 ms (Link to these results)

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