A0A5K4F3D5_SCHMA Loading...

HAUS augmin-like complex subunit

AlphaFold DB , UniProt , Accession A0A5K4F3D5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 433 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	37.6	Very low	42.3	Very low	76 Å²	76	89.9 Å²	89.9	37%	0.374	40%	0.397	S	S	.	.				0	-61.8	0	-103.8	-166.9	-176.4	0	0	115.1	R3 L4 E5 L359 L362 K363	M1-R3 PolarHBondContact O-N 3.14Å; M1-L4 PolarHBondContact O-N 3.34Å; M1-E5 PolarHBondContact O-N 2.92Å; M1-L359 HydrophobicContact CB-CD2 4.46Å; M1-L359 HydrophobicContact CE-CD1 4.34Å; M1-L359 HydrophobicContact CE-CD2 4.03Å; M1-L359 HydrophobicContact CE-CG 3.58Å; M1-L359 HydrophobicContact CG-CD1 4.49Å; M1-L359 HydrophobicContact CG-CD2 3.86Å; M1-L359 HydrophobicContact CG-CG 4.16Å; M1-L359 HydrophobicContact SD-CD2 3.72Å; M1-L359 HydrophobicContact SD-CG 3.98Å; M1-L362 HydrophobicContact CE-CB 3.33Å; M1-L362 HydrophobicContact CE-CD2 3.58Å; M1-L362 HydrophobicContact CE-CG 4.09Å; M1-K363 HydrophobicContact SD-CB 4.11Å
2	K	40.8	Very low	42.7	Very low	61 Å²	61	83.3 Å²	83.3	27%	0.265	37%	0.369	S	S	.	.	H	α-helix	trans	-51.8	-33.3	178.9	-74.3	-175.2	173.7	-171.6	0	114	R6 D370	K2-R6 VanDerWaalsContact O-CB 3.3Å; K2-R6 WeakPolarHBondContact O-CB 3.47Å; K2-R6 WeakPolarHBondContact O-CG 3.39Å; K2-R6 PolarHBondContact O-N 3.45Å; K2-D370 VanDerWaalsContact CE-CG 3.43Å; K2-D370 WeakPolarHBondContact CE-OD1 3.4Å; K2-D370 VanDerWaalsContact NZ-CB 3.34Å; K2-D370 PolarHBondContact NZ-O 2.84Å; K2-D370 IonicContact NZ-OD1 3.94Å; K2-D370 PolarHBondContact NZ-OD1 3.25Å; K2-D370 IonicContact NZ-OD2 3.57Å; K2-D370 PolarHBondContact NZ-OD2 2.84Å
3	R	37.3	Very low	43.6	Very low	167 Å²	167	81 Å²	81	63%	0.63	37%	0.369	S	S	*	.	H	α-helix	trans	-65.2	-39.3	176.6	-165.3	176.3	-177.3	175.3	1.7	112.6	M1 R7	M1-R3 PolarHBondContact O-N 3.14Å; R3-R7 VanDerWaalsContact O-CB 3.22Å; R3-R7 WeakPolarHBondContact O-CB 3.34Å; R3-R7 PolarHBondContact O-N 2.9Å
4	L	36.6	Very low	43.8	Very low	88 Å²	88	77 Å²	77	46%	0.461	36%	0.356	S	S	.	.	H	α-helix	trans	-74.1	-39.9	176.1	-109.3	151.6	0	0	0	111.3	M1 R6 R7 N8	M1-L4 PolarHBondContact O-N 3.34Å; L4-R6 VanDerWaalsContact C-N 3.34Å; L4-R6 PolarHBondContact O-N 3.45Å; L4-R7 PolarHBondContact O-N 2.89Å; L4-N8 VanDerWaalsContact O-CB 3.27Å; L4-N8 WeakPolarHBondContact O-CB 3.47Å; L4-N8 PolarHBondContact O-N 3.06Å
5	E	41	Very low	43.9	Very low	53 Å²	53	75.3 Å²	75.3	25%	0.248	36%	0.355	C	S	.	.	H	α-helix	trans	-61.1	-41.8	171	-72	178.1	148.6	0	0	111.9	M1 A9 L359	M1-E5 PolarHBondContact O-N 2.92Å; E5-A9 WeakPolarHBondContact O-CB 3.46Å; E5-A9 PolarHBondContact O-N 3.47Å; E5-L359 VanDerWaalsContact CD-CD2 3.49Å; E5-L359 HydrophobicContact CG-CD2 3.38Å; E5-L359 WeakPolarHBondContact OE1-CD2 3.01Å
6	R	47.9	Very low	44.2	Very low	107 Å²	107	75.9 Å²	75.9	40%	0.404	36%	0.358	S	S	.	.	H	α-helix	trans	-69.1	-36.4	174.3	-73.5	174.5	-170.8	172	2.4	112.5	K2 L4 R10	K2-R6 VanDerWaalsContact O-CB 3.3Å; K2-R6 WeakPolarHBondContact O-CB 3.47Å; K2-R6 WeakPolarHBondContact O-CG 3.39Å; K2-R6 PolarHBondContact O-N 3.45Å; L4-R6 VanDerWaalsContact C-N 3.34Å; L4-R6 PolarHBondContact O-N 3.45Å; R6-R10 WeakPolarHBondContact O-CB 3.33Å; R6-R10 VanDerWaalsContact O-CG 3.23Å; R6-R10 WeakPolarHBondContact O-CG 3.4Å; R6-R10 PolarHBondContact O-N 3.19Å; R6-R10 PolarHBondContact O-NE 3.26Å
7	R	38.6	Very low	44.7	Very low	138 Å²	138	76.3 Å²	76.3	52%	0.521	36%	0.363	S	S	.	.	H	α-helix	trans	-67.7	-46.1	176.8	-174.2	173.8	166.1	174.5	-5.3	109.8	R3 L4 R10 L11	R3-R7 VanDerWaalsContact O-CB 3.22Å; R3-R7 WeakPolarHBondContact O-CB 3.34Å; R3-R7 PolarHBondContact O-N 2.9Å; L4-R7 PolarHBondContact O-N 2.89Å; R7-R10 PolarHBondContact O-N 3.15Å; R7-L11 HydrophobicContact CG-CD1 4.15Å; R7-L11 WeakPolarHBondContact O-CB 3.36Å; R7-L11 PolarHBondContact O-N 2.79Å
8	N	41.5	Very low	44.8	Very low	35 Å²	35	72.8 Å²	72.8	19%	0.187	35%	0.349	C	S	.	.	H	α-helix	trans	-64.3	-48.5	174	-165.2	-2.6	0	0	0	110.8	L4 R10 L11 T12	L4-N8 VanDerWaalsContact O-CB 3.27Å; L4-N8 WeakPolarHBondContact O-CB 3.47Å; L4-N8 PolarHBondContact O-N 3.06Å; N8-R10 VanDerWaalsContact C-N 3.31Å; N8-R10 PolarHBondContact O-N 3.26Å; N8-L11 PolarHBondContact O-N 3.31Å; N8-T12 WeakPolarHBondContact O-CB 3.3Å; N8-T12 PolarHBondContact O-N 3.06Å; N8-T12 PolarHBondContact O-OG1 3.37Å; N8-T12 PolarHBondContact OD1-OG1 3.1Å
9	A	52.7	Low	44.8	Very low	43 Å²	43	71.6 Å²	71.6	36%	0.355	35%	0.346	S	S	.	.	H	α-helix	trans	-59.9	-37.9	176.3	0	0	0	0	0	113.1	E5 S13	E5-A9 WeakPolarHBondContact O-CB 3.46Å; E5-A9 PolarHBondContact O-N 3.47Å; A9-S13 WeakPolarHBondContact O-CB 3.33Å; A9-S13 PolarHBondContact O-N 2.98Å
10	R	46.6	Very low	45.1	Very low	163 Å²	163	74.3 Å²	74.3	62%	0.615	36%	0.358	S	S	*	.	H	α-helix	trans	-69.3	-44.6	174.6	-79.4	-174.7	-81.4	-174.3	-2.2	112.1	R6 R7 N8 S13 S14	R6-R10 WeakPolarHBondContact O-CB 3.33Å; R6-R10 VanDerWaalsContact O-CG 3.23Å; R6-R10 WeakPolarHBondContact O-CG 3.4Å; R6-R10 PolarHBondContact O-N 3.19Å; R6-R10 PolarHBondContact O-NE 3.26Å; R7-R10 PolarHBondContact O-N 3.15Å; N8-R10 VanDerWaalsContact C-N 3.31Å; N8-R10 PolarHBondContact O-N 3.26Å; R10-S13 PolarHBondContact O-N 2.89Å; R10-S14 WeakPolarHBondContact O-CB 3.29Å; R10-S14 PolarHBondContact O-N 3.49Å
11	L	44.4	Very low	45.2	Very low	58 Å²	58	74.7 Å²	74.7	30%	0.304	36%	0.36	S	S	.	.	H	α-helix	trans	-62	-47.5	173.2	-105.2	132.8	0	0	0	111.3	R7 N8 S13 S14 C15 E236	R7-L11 HydrophobicContact CG-CD1 4.15Å; R7-L11 WeakPolarHBondContact O-CB 3.36Å; R7-L11 PolarHBondContact O-N 2.79Å; N8-L11 PolarHBondContact O-N 3.31Å; L11-S13 VanDerWaalsContact C-N 3.34Å; L11-S13 PolarHBondContact O-N 2.92Å; L11-S14 PolarHBondContact O-N 3.42Å; L11-C15 WeakPolarHBondContact O-CB 3.48Å; L11-C15 PolarHBondContact O-N 2.92Å; L11-C15 PolarHBondContact O-SG 3.27Å; L11-E236 WeakPolarHBondContact CD2-OE1 3.38Å
12	T	47.9	Very low	45.5	Very low	10 Å²	10	74 Å²	74	6%	0.061	36%	0.357	C	S	.	.	H	α-helix	trans	-56.5	-48.8	175.1	-46.5	0	0	0	0	110.6	N8 S14 Q16 I352	N8-T12 WeakPolarHBondContact O-CB 3.3Å; N8-T12 PolarHBondContact O-N 3.06Å; N8-T12 PolarHBondContact O-OG1 3.37Å; N8-T12 PolarHBondContact OD1-OG1 3.1Å; T12-S14 VanDerWaalsContact C-N 3.35Å; T12-Q16 VanDerWaalsContact O-CB 3.29Å; T12-Q16 WeakPolarHBondContact O-CB 3.46Å; T12-Q16 WeakPolarHBondContact O-CG 3.32Å; T12-Q16 PolarHBondContact O-N 2.86Å; T12-I352 HydrophobicContact CG2-CD1 4.15Å
13	S	54.1	Low	45.8	Very low	54 Å²	54	73.2 Å²	73.2	38%	0.378	36%	0.36	S	S	.	.	H	α-helix	trans	-65.6	-37.5	178.2	-175.2	0	0	0	0	112	A9 R10 L11 Q16 N17	A9-S13 WeakPolarHBondContact O-CB 3.33Å; A9-S13 PolarHBondContact O-N 2.98Å; R10-S13 PolarHBondContact O-N 2.89Å; L11-S13 VanDerWaalsContact C-N 3.34Å; L11-S13 PolarHBondContact O-N 2.92Å; S13-Q16 PolarHBondContact O-N 3.5Å; S13-N17 VanDerWaalsContact O-CB 3.29Å; S13-N17 WeakPolarHBondContact O-CB 3.45Å; S13-N17 PolarHBondContact O-N 2.88Å; S13-N17 PolarHBondContact O-ND2 3.36Å; S13-N17 PolarHBondContact O-OD1 3.04Å
14	S	46.8	Very low	46.5	Very low	25 Å²	25	72.2 Å²	72.2	18%	0.175	36%	0.36	C	S	.	.	H	α-helix	trans	-70.2	-44.4	179.5	-169.5	0	0	0	0	111	R10 L11 T12 N17 A18	R10-S14 WeakPolarHBondContact O-CB 3.29Å; R10-S14 PolarHBondContact O-N 3.49Å; L11-S14 PolarHBondContact O-N 3.42Å; T12-S14 VanDerWaalsContact C-N 3.35Å; S14-N17 PolarHBondContact O-N 3.36Å; S14-A18 WeakPolarHBondContact O-CB 3.3Å; S14-A18 PolarHBondContact O-N 2.86Å
15	C	44.4	Very low	47	Very low	51 Å²	51	68.8 Å²	68.8	35%	0.345	34%	0.342	S	S	.	.	H	α-helix	trans	-61.7	-44.7	172.2	-67.4	0	0	0	0	110.5	L11 N17 A18 T19	L11-C15 WeakPolarHBondContact O-CB 3.48Å; L11-C15 PolarHBondContact O-N 2.92Å; L11-C15 PolarHBondContact O-SG 3.27Å; C15-N17 PolarHBondContact O-N 3.4Å; C15-A18 PolarHBondContact O-N 3.04Å; C15-T19 WeakPolarHBondContact O-CB 3.22Å; C15-T19 PolarHBondContact O-N 2.99Å; C15-T19 PolarHBondContact O-OG1 2.68Å
16	Q	49.5	Very low	47.1	Very low	86 Å²	86	67.8 Å²	67.8	40%	0.402	34%	0.338	S	S	.	.	H	α-helix	trans	-62	-43.8	176.2	-77	174.4	-5.7	0	0	112.3	T12 S13 Q20	T12-Q16 VanDerWaalsContact O-CB 3.29Å; T12-Q16 WeakPolarHBondContact O-CB 3.46Å; T12-Q16 WeakPolarHBondContact O-CG 3.32Å; T12-Q16 PolarHBondContact O-N 2.86Å; S13-Q16 PolarHBondContact O-N 3.5Å; Q16-Q20 WeakPolarHBondContact O-CB 3.37Å; Q16-Q20 VanDerWaalsContact O-CG 3.29Å; Q16-Q20 WeakPolarHBondContact O-CG 3.45Å; Q16-Q20 PolarHBondContact O-N 2.79Å
17	N	52.3	Low	47.4	Very low	82 Å²	82	70.9 Å²	70.9	44%	0.439	35%	0.35	S	S	.	.	H	α-helix	trans	-64.2	-46.6	176.2	-72.8	-6.4	0	0	0	110.9	S13 S14 C15 Q20 E21	S13-N17 VanDerWaalsContact O-CB 3.29Å; S13-N17 WeakPolarHBondContact O-CB 3.45Å; S13-N17 PolarHBondContact O-N 2.88Å; S13-N17 PolarHBondContact O-ND2 3.36Å; S13-N17 PolarHBondContact O-OD1 3.04Å; S14-N17 PolarHBondContact O-N 3.36Å; C15-N17 PolarHBondContact O-N 3.4Å; N17-Q20 CarbonylContact O-C 3.6Å; N17-Q20 WeakPolarHBondContact O-CB 3.35Å; N17-Q20 PolarHBondContact O-N 2.89Å; N17-Q20 VanDerWaalsContact O-N 3.17Å; N17-E21 WeakPolarHBondContact O-CG 3.49Å; N17-E21 PolarHBondContact O-N 2.82Å
18	A	46.2	Very low	48	Very low	14 Å²	14	66 Å²	66	12%	0.116	34%	0.342	C	S	.	.	H	α-helix	trans	-59.5	-47.7	176.4	0	0	0	0	0	111.8	S14 C15 Q20 E21 L22 I78	S14-A18 WeakPolarHBondContact O-CB 3.3Å; S14-A18 PolarHBondContact O-N 2.86Å; C15-A18 PolarHBondContact O-N 3.04Å; A18-Q20 VanDerWaalsContact C-N 3.3Å; A18-Q20 PolarHBondContact O-N 3.3Å; A18-E21 PolarHBondContact O-N 3.38Å; A18-L22 WeakPolarHBondContact O-CB 3.44Å; A18-L22 PolarHBondContact O-N 3.02Å; A18-I78 HydrophobicContact CB-CD1 3.57Å; A18-I78 HydrophobicContact CB-CG1 3.68Å
19	T	45.4	Very low	48.2	Very low	49 Å²	49	67 Å²	67	30%	0.301	35%	0.345	S	S	.	.	H	α-helix	trans	-62.1	-38.2	175.5	-56.2	0	0	0	0	111.3	C15 S23	C15-T19 WeakPolarHBondContact O-CB 3.22Å; C15-T19 PolarHBondContact O-N 2.99Å; C15-T19 PolarHBondContact O-OG1 2.68Å; T19-S23 WeakPolarHBondContact O-CB 3.33Å; T19-S23 PolarHBondContact O-N 3.03Å; T19-S23 PolarHBondContact O-OG 3.46Å
20	Q	49.7	Very low	47.8	Very low	126 Å²	126	66.3 Å²	66.3	59%	0.589	34%	0.336	S	S	*	.	H	α-helix	trans	-66.4	-45.2	174.6	-79.2	-179.3	6.5	0	0	112.3	Q16 N17 A18 S23 F24	Q16-Q20 WeakPolarHBondContact O-CB 3.37Å; Q16-Q20 VanDerWaalsContact O-CG 3.29Å; Q16-Q20 WeakPolarHBondContact O-CG 3.45Å; Q16-Q20 PolarHBondContact O-N 2.79Å; N17-Q20 CarbonylContact O-C 3.6Å; N17-Q20 WeakPolarHBondContact O-CB 3.35Å; N17-Q20 PolarHBondContact O-N 2.89Å; N17-Q20 VanDerWaalsContact O-N 3.17Å; A18-Q20 VanDerWaalsContact C-N 3.3Å; A18-Q20 PolarHBondContact O-N 3.3Å; Q20-S23 WeakPolarHBondContact CA-OG 3.34Å; Q20-S23 PolarHBondContact O-N 3.44Å; Q20-S23 PolarHBondContact O-OG 3.42Å; Q20-F24 WeakPolarHBondContact O-CB 3.47Å; Q20-F24 PolarHBondContact O-N 2.96Å
21	E	48	Very low	48.1	Very low	82 Å²	82	64.3 Å²	64.3	38%	0.383	33%	0.332	S	S	.	.	H	α-helix	trans	-61.4	-48.3	176.1	-76.6	-176.9	179.8	0	0	111.1	N17 A18 S23 F24 L25 A74	N17-E21 WeakPolarHBondContact O-CG 3.49Å; N17-E21 PolarHBondContact O-N 2.82Å; A18-E21 PolarHBondContact O-N 3.38Å; E21-S23 VanDerWaalsContact C-N 3.3Å; E21-S23 PolarHBondContact O-N 3.45Å; E21-F24 CarbonylContact O-C 3.55Å; E21-F24 WeakPolarHBondContact O-CA 3.49Å; E21-F24 WeakPolarHBondContact O-CB 3.48Å; E21-F24 PolarHBondContact O-N 3.25Å; E21-L25 WeakPolarHBondContact O-CG 3.49Å; E21-L25 PolarHBondContact O-N 2.7Å; E21-A74 HydrophobicContact CB-CB 4.45Å; E21-A74 VanDerWaalsContact OE2-CB 3.31Å; E21-A74 WeakPolarHBondContact OE2-CB 3.36Å
22	L	44.3	Very low	48.2	Very low	61 Å²	61	63.3 Å²	63.3	32%	0.319	33%	0.325	S	S	.	.	H	α-helix	trans	-60.6	-40.6	175.2	-122.3	142.8	0	0	0	111.4	A18 F24 L25 L26	A18-L22 WeakPolarHBondContact O-CB 3.44Å; A18-L22 PolarHBondContact O-N 3.02Å; L22-F24 VanDerWaalsContact C-N 3.31Å; L22-F24 PolarHBondContact O-N 3.47Å; L22-L25 PolarHBondContact O-N 3.36Å; L22-L26 HydrophobicContact CD2-CD1 4.2Å; L22-L26 HydrophobicContact CD2-CG 4.42Å; L22-L26 WeakPolarHBondContact O-CB 3.32Å; L22-L26 VanDerWaalsContact O-CG 3.27Å; L22-L26 WeakPolarHBondContact O-CG 3.49Å; L22-L26 PolarHBondContact O-N 3.46Å
23	S	47.5	Very low	48	Very low	46 Å²	46	65.2 Å²	65.2	32%	0.322	33%	0.334	S	S	.	.	H	α-helix	trans	-65.2	-34.9	174.5	80.8	0	0	0	0	112.6	T19 Q20 E21 R27	T19-S23 WeakPolarHBondContact O-CB 3.33Å; T19-S23 PolarHBondContact O-N 3.03Å; T19-S23 PolarHBondContact O-OG 3.46Å; Q20-S23 WeakPolarHBondContact CA-OG 3.34Å; Q20-S23 PolarHBondContact O-N 3.44Å; Q20-S23 PolarHBondContact O-OG 3.42Å; E21-S23 VanDerWaalsContact C-N 3.3Å; E21-S23 PolarHBondContact O-N 3.45Å; S23-R27 WeakPolarHBondContact O-CB 3.44Å; S23-R27 PolarHBondContact O-N 2.88Å
24	F	52.1	Low	47.7	Very low	145 Å²	145	66.5 Å²	66.5	64%	0.636	33%	0.334	S	S	*	.	H	α-helix	trans	-69.2	-41.7	175.8	-172.8	-91.3	0	0	0	110.7	Q20 E21 L22 R27 G28	Q20-F24 WeakPolarHBondContact O-CB 3.47Å; Q20-F24 PolarHBondContact O-N 2.96Å; E21-F24 CarbonylContact O-C 3.55Å; E21-F24 WeakPolarHBondContact O-CA 3.49Å; E21-F24 WeakPolarHBondContact O-CB 3.48Å; E21-F24 PolarHBondContact O-N 3.25Å; L22-F24 VanDerWaalsContact C-N 3.31Å; L22-F24 PolarHBondContact O-N 3.47Å; F24-R27 PolarHBondContact O-N 2.93Å; F24-G28 PolarHBondContact O-N 2.93Å
25	L	45.2	Very low	47.8	Very low	16 Å²	16	73.6 Å²	73.6	8%	0.084	36%	0.357	C	S	.	.	H	α-helix	trans	-61.1	-51	173.4	-68.7	171.8	0	0	0	111.5	E21 L22 R27 G28 F29 L67 K70	E21-L25 WeakPolarHBondContact O-CG 3.49Å; E21-L25 PolarHBondContact O-N 2.7Å; L22-L25 PolarHBondContact O-N 3.36Å; L25-R27 VanDerWaalsContact C-N 3.28Å; L25-R27 PolarHBondContact O-N 3.3Å; L25-G28 PolarHBondContact O-N 3.46Å; L25-G28 VanDerWaalsContact O-N 3.14Å; L25-F29 WeakPolarHBondContact O-CB 3.34Å; L25-F29 PolarHBondContact O-N 3.09Å; L25-L67 HydrophobicContact CB-CD1 3.89Å; L25-L67 HydrophobicContact CD2-CD1 3.49Å; L25-L67 VanDerWaalsContact CD2-CD1 3.49Å; L25-L67 HydrophobicContact CD2-CG 4.19Å; L25-L67 HydrophobicContact CG-CD1 4.29Å; L25-K70 HydrophobicContact CD1-CB 4.44Å; L25-K70 HydrophobicContact CD2-CB 3.47Å; L25-K70 VanDerWaalsContact CD2-CB 3.47Å; L25-K70 HydrophobicContact CD2-CD 3.97Å; L25-K70 HydrophobicContact CD2-CG 4.36Å
26	L	45	Very low	47.8	Very low	33 Å²	33	74.5 Å²	74.5	17%	0.173	36%	0.356	C	S	.	.	H	α-helix	trans	-60.1	-38.9	177.1	-72.1	171.3	0	0	0	111.7	L22 T30 L334 Q338	L22-L26 HydrophobicContact CD2-CD1 4.2Å; L22-L26 HydrophobicContact CD2-CG 4.42Å; L22-L26 WeakPolarHBondContact O-CB 3.32Å; L22-L26 VanDerWaalsContact O-CG 3.27Å; L22-L26 WeakPolarHBondContact O-CG 3.49Å; L22-L26 PolarHBondContact O-N 3.46Å; L26-T30 VanDerWaalsContact O-CB 3.27Å; L26-T30 WeakPolarHBondContact O-CB 3.36Å; L26-T30 PolarHBondContact O-N 3.41Å; L26-T30 PolarHBondContact O-OG1 3.2Å; L26-L334 HydrophobicContact CD2-CD1 4Å; L26-L334 HydrophobicContact CD2-CD2 3.85Å; L26-L334 HydrophobicContact CD2-CG 4.01Å; L26-Q338 HydrophobicContact CD1-CB 4.18Å; L26-Q338 HydrophobicContact CD1-CG 3.95Å
27	R	52.3	Low	47.6	Very low	172 Å²	172	75.6 Å²	75.6	65%	0.649	36%	0.363	S	S	*	.	H	α-helix	trans	-70	-38.2	175.8	-168.1	179.1	-135.3	179.9	5.9	112.3	S23 F24 L25 T30 K31	S23-R27 WeakPolarHBondContact O-CB 3.44Å; S23-R27 PolarHBondContact O-N 2.88Å; F24-R27 PolarHBondContact O-N 2.93Å; L25-R27 VanDerWaalsContact C-N 3.28Å; L25-R27 PolarHBondContact O-N 3.3Å; R27-T30 PolarHBondContact O-N 3.14Å; R27-K31 WeakPolarHBondContact O-CB 3.44Å; R27-K31 WeakPolarHBondContact O-CG 3.47Å; R27-K31 PolarHBondContact O-N 3.07Å
28	G	52.2	Low	47.3	Very low	34 Å²	34	77.8 Å²	77.8	35%	0.351	38%	0.375	S	S	.	.	H	α-helix	trans	-60.1	-51.1	173.5	0	0	0	0	0	110.8	F24 L25 T30 K31 Y32	F24-G28 PolarHBondContact O-N 2.93Å; L25-G28 PolarHBondContact O-N 3.46Å; L25-G28 VanDerWaalsContact O-N 3.14Å; G28-T30 VanDerWaalsContact C-N 3.35Å; G28-T30 PolarHBondContact O-N 3.31Å; G28-K31 PolarHBondContact O-N 3.23Å; G28-Y32 VanDerWaalsContact O-CB 3.31Å; G28-Y32 WeakPolarHBondContact O-CB 3.42Å; G28-Y32 PolarHBondContact O-N 3.14Å
29	F	45.4	Very low	46.8	Very low	58 Å²	58	83.9 Å²	83.9	25%	0.254	40%	0.401	S	S	.	.	H	α-helix	trans	-62.8	-39	176.3	-169.6	-109.5	0	0	0	112.8	L25 Y32 I33 L67	L25-F29 WeakPolarHBondContact O-CB 3.34Å; L25-F29 PolarHBondContact O-N 3.09Å; F29-Y32 WeakPolarHBondContact O-CB 3.46Å; F29-Y32 PolarHBondContact O-N 3.01Å; F29-I33 HydrophobicContact CD1-CD1 3.74Å; F29-I33 HydrophobicContact CE1-CD1 3.37Å; F29-I33 HydrophobicContact CE1-CG1 4.27Å; F29-I33 HydrophobicContact CZ-CD1 3.9Å; F29-I33 HydrophobicContact CZ-CG1 4.43Å; F29-I33 WeakPolarHBondContact O-CG1 3.36Å; F29-I33 PolarHBondContact O-N 3.43Å; F29-L67 HydrophobicContact CB-CD2 4.01Å; F29-L67 HydrophobicContact CD2-CD2 3.74Å; F29-L67 HydrophobicContact CG-CD2 4.1Å
30	T	45.2	Very low	46.4	Very low	27 Å²	27	85 Å²	85	17%	0.166	41%	0.411	C	S	.	.	H	α-helix	trans	-64.5	-46	175.6	-60.8	0	0	0	0	111.7	L26 R27 G28 Y32 I33 E34	L26-T30 VanDerWaalsContact O-CB 3.27Å; L26-T30 WeakPolarHBondContact O-CB 3.36Å; L26-T30 PolarHBondContact O-N 3.41Å; L26-T30 PolarHBondContact O-OG1 3.2Å; R27-T30 PolarHBondContact O-N 3.14Å; G28-T30 VanDerWaalsContact C-N 3.35Å; G28-T30 PolarHBondContact O-N 3.31Å; T30-Y32 VanDerWaalsContact C-N 3.27Å; T30-Y32 PolarHBondContact O-N 3.49Å; T30-I33 PolarHBondContact O-N 3.2Å; T30-E34 WeakPolarHBondContact CG2-OE1 3.49Å; T30-E34 WeakPolarHBondContact O-CB 3.41Å; T30-E34 WeakPolarHBondContact O-CG 3.48Å; T30-E34 PolarHBondContact O-N 3.42Å
31	K	51.3	Low	45.8	Very low	122 Å²	122	82.4 Å²	82.4	53%	0.53	41%	0.405	S	S	.	.	H	α-helix	trans	-63.4	-34.1	174.8	-79.7	-176.5	176.5	-175.8	0	112.4	R27 G28 E34 R35	R27-K31 WeakPolarHBondContact O-CB 3.44Å; R27-K31 WeakPolarHBondContact O-CG 3.47Å; R27-K31 PolarHBondContact O-N 3.07Å; G28-K31 PolarHBondContact O-N 3.23Å; K31-E34 PolarHBondContact O-N 2.9Å; K31-R35 WeakPolarHBondContact O-CB 3.4Å; K31-R35 WeakPolarHBondContact O-CG 3.46Å; K31-R35 PolarHBondContact O-N 2.73Å
32	Y	47	Very low	45.7	Very low	37 Å²	37	84.4 Å²	84.4	15%	0.145	42%	0.423	C	S	.	.	H	α-helix	trans	-63.7	-51.2	175.1	174.4	-94.5	0	0	0	111.1	G28 F29 T30 E34 R35 H36 I59 I60 D63	G28-Y32 VanDerWaalsContact O-CB 3.31Å; G28-Y32 WeakPolarHBondContact O-CB 3.42Å; G28-Y32 PolarHBondContact O-N 3.14Å; F29-Y32 WeakPolarHBondContact O-CB 3.46Å; F29-Y32 PolarHBondContact O-N 3.01Å; T30-Y32 VanDerWaalsContact C-N 3.27Å; T30-Y32 PolarHBondContact O-N 3.49Å; Y32-E34 VanDerWaalsContact C-N 3.28Å; Y32-E34 PolarHBondContact O-N 3.05Å; Y32-R35 PolarHBondContact O-N 3.47Å; Y32-H36 AromaticContact CD2-CD2 3.97Å; Y32-H36 AromaticContact CE1-CD2 3.92Å; Y32-H36 AromaticContact CE2-CD2 3.44Å; Y32-H36 VanDerWaalsContact CE2-CD2 3.44Å; Y32-H36 WeakPolarHBondContact CE2-CD2 3.4Å; Y32-H36 AromaticContact CE2-NE2 3.32Å; Y32-H36 VanDerWaalsContact CE2-NE2 3.32Å; Y32-H36 WeakPolarHBondContact CE2-NE2 3.2Å; Y32-H36 AromaticContact CZ-CD2 3.39Å; Y32-H36 AromaticContact CZ-NE2 3.51Å; Y32-H36 PolarHBondContact O-CD2 3.43Å; Y32-H36 PolarHBondContact O-N 2.8Å; Y32-H36 VanDerWaalsContact O-N 3.15Å; Y32-H36 PolarHBondContact OH-NE2 2.94Å; Y32-I59 HydrophobicContact CE2-CG2 3.87Å; Y32-I60 HydrophobicContact CE1-CG1 4.42Å; Y32-I60 WeakPolarHBondContact OH-CG1 3.33Å; Y32-D63 HydrophobicContact CD2-CB 4.43Å; Y32-D63 HydrophobicContact CE2-CB 4.36Å
33	I	44.3	Very low	45.5	Very low	49 Å²	49	88.9 Å²	88.9	25%	0.251	45%	0.447	S	S	.	.	H	α-helix	trans	-57.3	-43.6	173.3	-69.2	170.6	0	0	0	110.5	F29 T30 H36 I37	F29-I33 HydrophobicContact CD1-CD1 3.74Å; F29-I33 HydrophobicContact CE1-CD1 3.37Å; F29-I33 HydrophobicContact CE1-CG1 4.27Å; F29-I33 HydrophobicContact CZ-CD1 3.9Å; F29-I33 HydrophobicContact CZ-CG1 4.43Å; F29-I33 WeakPolarHBondContact O-CG1 3.36Å; F29-I33 PolarHBondContact O-N 3.43Å; T30-I33 PolarHBondContact O-N 3.2Å; I33-H36 PolarHBondContact O-N 2.9Å; I33-I37 HydrophobicContact CG2-CD1 3.62Å; I33-I37 HydrophobicContact CG2-CG1 4.37Å; I33-I37 VanDerWaalsContact O-CG1 3.23Å; I33-I37 WeakPolarHBondContact O-CG1 3.44Å; I33-I37 PolarHBondContact O-N 3.45Å
34	E	48	Very low	44.8	Very low	82 Å²	82	88.9 Å²	88.9	38%	0.383	44%	0.443	S	S	.	.	H	α-helix	trans	-64.1	-44.7	178.6	-77	166.4	-172.4	0	0	112.8	T30 K31 Y32 H36 I37 D38 K331	T30-E34 WeakPolarHBondContact CG2-OE1 3.49Å; T30-E34 WeakPolarHBondContact O-CB 3.41Å; T30-E34 WeakPolarHBondContact O-CG 3.48Å; T30-E34 PolarHBondContact O-N 3.42Å; K31-E34 PolarHBondContact O-N 2.9Å; Y32-E34 VanDerWaalsContact C-N 3.28Å; Y32-E34 PolarHBondContact O-N 3.05Å; E34-H36 VanDerWaalsContact C-N 3.29Å; E34-H36 PolarHBondContact O-N 2.9Å; E34-I37 PolarHBondContact O-N 3.39Å; E34-D38 WeakPolarHBondContact O-CB 3.46Å; E34-D38 PolarHBondContact O-N 3.4Å; E34-K331 IonicContact OE1-NZ 2.86Å; E34-K331 PolarHBondContact OE1-NZ 3.06Å
35	R	48.2	Very low	44.2	Very low	174 Å²	174	86 Å²	86	66%	0.657	44%	0.441	S	S	*	.	H	α-helix	trans	-59.2	-39.2	176.6	-84.3	-176.9	178.7	175.7	-1.2	112.4	K31 Y32 D38 H39	K31-R35 WeakPolarHBondContact O-CB 3.4Å; K31-R35 WeakPolarHBondContact O-CG 3.46Å; K31-R35 PolarHBondContact O-N 2.73Å; Y32-R35 PolarHBondContact O-N 3.47Å; R35-D38 PolarHBondContact O-N 2.93Å; R35-H39 VanDerWaalsContact O-CB 3.31Å; R35-H39 WeakPolarHBondContact O-CB 3.31Å; R35-H39 PolarHBondContact O-N 2.89Å; R35-H39 PolarHBondContact O-ND1 3.3Å
36	H	45.4	Very low	44.3	Very low	69 Å²	69	90 Å²	90	32%	0.319	46%	0.462	S	S	.	.	H	α-helix	trans	-79.9	-25.6	180	-79.7	-69.7	0	0	0	113.7	Y32 I33 E34	Y32-H36 AromaticContact CD2-CD2 3.97Å; Y32-H36 AromaticContact CE1-CD2 3.92Å; Y32-H36 AromaticContact CE2-CD2 3.44Å; Y32-H36 VanDerWaalsContact CE2-CD2 3.44Å; Y32-H36 WeakPolarHBondContact CE2-CD2 3.4Å; Y32-H36 AromaticContact CE2-NE2 3.32Å; Y32-H36 VanDerWaalsContact CE2-NE2 3.32Å; Y32-H36 WeakPolarHBondContact CE2-NE2 3.2Å; Y32-H36 AromaticContact CZ-CD2 3.39Å; Y32-H36 AromaticContact CZ-NE2 3.51Å; Y32-H36 PolarHBondContact O-CD2 3.43Å; Y32-H36 PolarHBondContact O-N 2.8Å; Y32-H36 VanDerWaalsContact O-N 3.15Å; Y32-H36 PolarHBondContact OH-NE2 2.94Å; I33-H36 PolarHBondContact O-N 2.9Å; E34-H36 VanDerWaalsContact C-N 3.29Å; E34-H36 PolarHBondContact O-N 2.9Å
37	I	45.7	Very low	44	Very low	109 Å²	109	91 Å²	91	56%	0.559	48%	0.481	S	S	*	.	H	α-helix	trans	-68.4	-42.7	167.1	-67.7	167.7	0	0	0	110	I33 E34	I33-I37 HydrophobicContact CG2-CD1 3.62Å; I33-I37 HydrophobicContact CG2-CG1 4.37Å; I33-I37 VanDerWaalsContact O-CG1 3.23Å; I33-I37 WeakPolarHBondContact O-CG1 3.44Å; I33-I37 PolarHBondContact O-N 3.45Å; E34-I37 PolarHBondContact O-N 3.39Å
38	D	44.4	Very low	43.4	Very low	128 Å²	128	86.6 Å²	86.6	68%	0.684	47%	0.47	S	S	*	.	H	α-helix	trans	-82	-32.6	-174.1	-72.1	-17.5	0	0	0	114.3	E34 R35 S40	E34-D38 WeakPolarHBondContact O-CB 3.46Å; E34-D38 PolarHBondContact O-N 3.4Å; R35-D38 PolarHBondContact O-N 2.93Å; D38-S40 PolarHBondContact O-N 3Å
39	H	37	Very low	42.8	Very low	142 Å²	142	92 Å²	92	66%	0.657	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	30.6	177.3	-64.1	74.6	0	0	0	112.7	R35 P41	R35-H39 VanDerWaalsContact O-CB 3.31Å; R35-H39 WeakPolarHBondContact O-CB 3.31Å; R35-H39 PolarHBondContact O-N 2.89Å; R35-H39 PolarHBondContact O-ND1 3.3Å; H39-P41 WeakPolarHBondContact O-CD 3.42Å
40	S	37.3	Very low	42.6	Very low	73 Å²	73	93.7 Å²	93.7	51%	0.51	49%	0.49	S	S	.	.			trans	-88.4	86.4	159.4	151.4	0	0	0	0	107.8	D38 T42	D38-S40 PolarHBondContact O-N 3Å; S40-T42 PolarHBondContact O-N 3.09Å
41	P	35.8	Very low	42.5	Very low	72 Å²	72	95.9 Å²	95.9	47%	0.468	51%	0.506	S	S	.	.			trans	-63.5	116.4	165.1	23.1	-25.7	0	0	0	107	H39 D43 L44	H39-P41 WeakPolarHBondContact O-CD 3.42Å; P41-D43 PolarHBondContact O-N 2.98Å; P41-L44 HydrophobicContact CG-CD1 3.73Å; P41-L44 HydrophobicContact CG-CD2 4.13Å; P41-L44 HydrophobicContact CG-CG 3.85Å
42	T	47.2	Very low	42	Very low	123 Å²	123	93.1 Å²	93.1	76%	0.755	50%	0.497	S	S	*	.	S	Bend	trans	-58.8	-13.2	-172.9	9.6	0	0	0	0	114	S40	S40-T42 PolarHBondContact O-N 3.09Å
43	D	39.2	Very low	41.8	Very low	156 Å²	156	97.3 Å²	97.3	83%	0.834	52%	0.52	S	S	*	.			trans	-123.8	72.5	-178.3	-67.1	-37.7	0	0	0	111.2	P41	P41-D43 PolarHBondContact O-N 2.98Å
44	L	32.5	Very low	41.9	Very low	45 Å²	45	97.3 Å²	97.3	24%	0.236	52%	0.522	C	S	.	.			trans	-101.1	118.1	170.3	-76.5	160.4	0	0	0	110.8	P41 D48 R49 N52	P41-L44 HydrophobicContact CG-CD1 3.73Å; P41-L44 HydrophobicContact CG-CD2 4.13Å; P41-L44 HydrophobicContact CG-CG 3.85Å; L44-D48 HydrophobicContact CD2-CB 3.68Å; L44-R49 HydrophobicContact CB-CG 4.37Å; L44-N52 VanDerWaalsContact CD1-ND2 3.27Å; L44-N52 WeakPolarHBondContact CD1-ND2 3.45Å
45	S	40.6	Very low	41.6	Very low	84 Å²	84	97.6 Å²	97.6	59%	0.587	53%	0.526	S	S	*	.			trans	-57.4	148.1	165.4	80.1	0	0	0	0	111	G47 D48	S45-G47 VanDerWaalsContact C-N 3.25Å; S45-G47 PolarHBondContact O-N 3.49Å; S45-D48 PolarHBondContact O-N 3.35Å
46	N	45.9	Very low	41.3	Very low	100 Å²	100	91.5 Å²	91.5	54%	0.535	51%	0.508	S	S	.	.	H	α-helix	trans	-62.1	-21	-161.2	-76.8	-24.4	0	0	0	116.4
47	G	38.3	Very low	41.2	Very low	55 Å²	55	89.7 Å²	89.7	57%	0.567	50%	0.503	S	S	*	.	H	α-helix	trans	-69.4	-32.1	175.5	0	0	0	0	0	113	S45	S45-G47 VanDerWaalsContact C-N 3.25Å; S45-G47 PolarHBondContact O-N 3.49Å
48	D	40.2	Very low	41	Very low	79 Å²	79	89.5 Å²	89.5	42%	0.422	50%	0.5	S	S	.	.	H	α-helix	trans	-80.4	-22.3	-178.5	-64.8	-37.1	0	0	0	112.6	L44 S45 N52	L44-D48 HydrophobicContact CD2-CB 3.68Å; S45-D48 PolarHBondContact O-N 3.35Å; D48-N52 WeakPolarHBondContact O-CB 3.46Å; D48-N52 PolarHBondContact O-N 3.38Å; D48-N52 PolarHBondContact O-ND2 2.81Å
49	R	40.8	Very low	40.8	Very low	147 Å²	147	85.8 Å²	85.8	56%	0.555	48%	0.479	S	S	*	.	H	α-helix	trans	-66.8	-40.3	-179.4	-74.6	-173.5	-178.7	-167	-1.5	113.3	L44 N52 M53	L44-R49 HydrophobicContact CB-CG 4.37Å; R49-N52 PolarHBondContact O-N 2.9Å; R49-M53 WeakPolarHBondContact O-CB 3.41Å; R49-M53 WeakPolarHBondContact O-CG 3.33Å; R49-M53 PolarHBondContact O-N 3.37Å
50	M	40.7	Very low	41	Very low	94 Å²	94	82 Å²	82	46%	0.463	46%	0.463	S	S	.	.	H	α-helix	trans	-70.2	-44.8	178.4	-157.2	87.3	-179.7	0	0	110.1	N52 M53 V54 Y272	M50-N52 VanDerWaalsContact C-N 3.31Å; M50-N52 PolarHBondContact O-N 3.22Å; M50-M53 PolarHBondContact O-N 3.14Å; M50-V54 WeakPolarHBondContact O-CB 3.12Å; M50-V54 WeakPolarHBondContact O-CG2 3.34Å; M50-V54 PolarHBondContact O-N 3.49Å; M50-Y272 HydrophobicContact CE-CE2 3.87Å; M50-Y272 WeakPolarHBondContact CE-OH 3.27Å; M50-Y272 WeakPolarHBondContact CG-OH 3.5Å
51	S	42.3	Very low	41.3	Very low	74 Å²	74	81.6 Å²	81.6	52%	0.517	45%	0.454	S	S	.	.	H	α-helix	trans	-58.2	-44.3	172.8	-59.8	0	0	0	0	111.1	L55	S51-L55 WeakPolarHBondContact O-CB 3.46Å; S51-L55 PolarHBondContact O-N 3.47Å
52	N	40.8	Very low	41.7	Very low	63 Å²	63	85.1 Å²	85.1	34%	0.337	46%	0.464	S	S	.	.	H	α-helix	trans	-69.3	-33.5	176.3	-74.2	-19.2	0	0	0	113	L44 D48 R49 M50 V56	L44-N52 VanDerWaalsContact CD1-ND2 3.27Å; L44-N52 WeakPolarHBondContact CD1-ND2 3.45Å; D48-N52 WeakPolarHBondContact O-CB 3.46Å; D48-N52 PolarHBondContact O-N 3.38Å; D48-N52 PolarHBondContact O-ND2 2.81Å; R49-N52 PolarHBondContact O-N 2.9Å; M50-N52 VanDerWaalsContact C-N 3.31Å; M50-N52 PolarHBondContact O-N 3.22Å; N52-V56 WeakPolarHBondContact O-CA 3.5Å; N52-V56 WeakPolarHBondContact O-CB 3.44Å; N52-V56 WeakPolarHBondContact O-CG2 3.46Å; N52-V56 PolarHBondContact O-N 2.78Å
53	M	44.3	Very low	41.5	Very low	125 Å²	125	82.7 Å²	82.7	62%	0.616	45%	0.447	S	S	*	.	H	α-helix	trans	-74.3	-38.4	176.6	-81.5	-170	132.5	0	0	112.4	R49 M50 V56 S57	R49-M53 WeakPolarHBondContact O-CB 3.41Å; R49-M53 WeakPolarHBondContact O-CG 3.33Å; R49-M53 PolarHBondContact O-N 3.37Å; M50-M53 PolarHBondContact O-N 3.14Å; M53-V56 PolarHBondContact O-N 2.98Å; M53-S57 WeakPolarHBondContact O-CB 3.37Å; M53-S57 PolarHBondContact O-N 3.47Å; M53-S57 PolarHBondContact O-OG 3.03Å
54	V	44.7	Very low	41.7	Very low	49 Å²	49	76.9 Å²	76.9	30%	0.297	42%	0.415	S	S	.	.	H	α-helix	trans	-64	-48.3	170.7	173.2	0	0	0	0	109.2	M50 V56 S57 E58	M50-V54 WeakPolarHBondContact O-CB 3.12Å; M50-V54 WeakPolarHBondContact O-CG2 3.34Å; M50-V54 PolarHBondContact O-N 3.49Å; V54-V56 VanDerWaalsContact C-N 3.34Å; V54-V56 PolarHBondContact O-N 3.23Å; V54-S57 CarbonylContact O-C 3.53Å; V54-S57 PolarHBondContact O-N 3.5Å; V54-S57 PolarHBondContact O-OG 3.31Å; V54-E58 HydrophobicContact CG1-CG 4.25Å; V54-E58 WeakPolarHBondContact O-CB 3.32Å; V54-E58 WeakPolarHBondContact O-CG 3.3Å; V54-E58 PolarHBondContact O-N 3.39Å
55	L	42.8	Very low	42.4	Very low	88 Å²	88	79.7 Å²	79.7	46%	0.461	43%	0.426	S	S	.	.	H	α-helix	trans	-60.4	-41.5	175.6	-160	93.9	0	0	0	111.6	S51 E58 I59	S51-L55 WeakPolarHBondContact O-CB 3.46Å; S51-L55 PolarHBondContact O-N 3.47Å; L55-E58 PolarHBondContact O-N 2.92Å; L55-I59 HydrophobicContact CD2-CD1 3.69Å; L55-I59 HydrophobicContact CG-CD1 3.65Å; L55-I59 HydrophobicContact CG-CG1 4.31Å; L55-I59 WeakPolarHBondContact O-CB 3.26Å; L55-I59 WeakPolarHBondContact O-CD1 3.45Å; L55-I59 WeakPolarHBondContact O-CG1 2.89Å; L55-I59 PolarHBondContact O-N 3.47Å
56	V	41.1	Very low	42.7	Very low	47 Å²	47	78.9 Å²	78.9	29%	0.285	42%	0.415	S	S	.	.	H	α-helix	trans	-63.7	-42.9	173.6	165.3	0	0	0	0	109.8	N52 M53 V54 I60	N52-V56 WeakPolarHBondContact O-CA 3.5Å; N52-V56 WeakPolarHBondContact O-CB 3.44Å; N52-V56 WeakPolarHBondContact O-CG2 3.46Å; N52-V56 PolarHBondContact O-N 2.78Å; M53-V56 PolarHBondContact O-N 2.98Å; V54-V56 VanDerWaalsContact C-N 3.34Å; V54-V56 PolarHBondContact O-N 3.23Å; V56-I60 HydrophobicContact CG1-CD1 3.47Å; V56-I60 VanDerWaalsContact CG1-CD1 3.47Å; V56-I60 HydrophobicContact CG1-CG1 3.97Å; V56-I60 WeakPolarHBondContact O-CA 3.27Å; V56-I60 WeakPolarHBondContact O-CB 3.33Å; V56-I60 WeakPolarHBondContact O-CG1 3.48Å; V56-I60 PolarHBondContact O-N 3.35Å
57	S	43.6	Very low	42.6	Very low	30 Å²	30	76.1 Å²	76.1	21%	0.21	40%	0.4	C	S	.	.	H	α-helix	trans	-66.7	-38.7	176.9	76.8	0	0	0	0	112.9	M53 V54 M61	M53-S57 WeakPolarHBondContact O-CB 3.37Å; M53-S57 PolarHBondContact O-N 3.47Å; M53-S57 PolarHBondContact O-OG 3.03Å; V54-S57 CarbonylContact O-C 3.53Å; V54-S57 PolarHBondContact O-N 3.5Å; V54-S57 PolarHBondContact O-OG 3.31Å; S57-M61 VanDerWaalsContact O-CB 3.31Å; S57-M61 WeakPolarHBondContact O-CB 3.17Å; S57-M61 VanDerWaalsContact O-CG 3.29Å; S57-M61 WeakPolarHBondContact O-CG 3.24Å; S57-M61 PolarHBondContact O-N 3.36Å
58	E	42.1	Very low	42.8	Very low	106 Å²	106	75.7 Å²	75.7	50%	0.495	38%	0.384	S	S	.	.	H	α-helix	trans	-68.8	-44.7	177.7	-74.9	177.3	170.2	0	0	110.7	V54 L55 M61 E62	V54-E58 HydrophobicContact CG1-CG 4.25Å; V54-E58 WeakPolarHBondContact O-CB 3.32Å; V54-E58 WeakPolarHBondContact O-CG 3.3Å; V54-E58 PolarHBondContact O-N 3.39Å; L55-E58 PolarHBondContact O-N 2.92Å; E58-M61 PolarHBondContact O-N 2.92Å; E58-E62 WeakPolarHBondContact O-CB 3.32Å; E58-E62 PolarHBondContact O-N 3.39Å
59	I	39.4	Very low	43	Very low	50 Å²	50	75.4 Å²	75.4	26%	0.256	39%	0.388	S	S	.	.	H	α-helix	trans	-71	-41.5	176.3	-62.9	168.3	0	0	0	110.8	Y32 L55 M61 E62 D63	Y32-I59 HydrophobicContact CE2-CG2 3.87Å; L55-I59 HydrophobicContact CD2-CD1 3.69Å; L55-I59 HydrophobicContact CG-CD1 3.65Å; L55-I59 HydrophobicContact CG-CG1 4.31Å; L55-I59 WeakPolarHBondContact O-CB 3.26Å; L55-I59 WeakPolarHBondContact O-CD1 3.45Å; L55-I59 WeakPolarHBondContact O-CG1 2.89Å; L55-I59 PolarHBondContact O-N 3.47Å; I59-M61 VanDerWaalsContact C-N 3.29Å; I59-M61 PolarHBondContact O-N 2.92Å; I59-E62 PolarHBondContact O-N 2.94Å; I59-D63 WeakPolarHBondContact CG2-OD2 3.27Å; I59-D63 VanDerWaalsContact O-CB 3.25Å; I59-D63 WeakPolarHBondContact O-CB 3.41Å; I59-D63 PolarHBondContact O-N 3.08Å
60	I	41.7	Very low	43.2	Very low	63 Å²	63	72.7 Å²	72.7	32%	0.323	38%	0.381	S	S	.	.	H	α-helix	trans	-54.4	-50.9	171.2	-78.6	174.6	0	0	0	107.8	Y32 V56 L64	Y32-I60 HydrophobicContact CE1-CG1 4.42Å; Y32-I60 WeakPolarHBondContact OH-CG1 3.33Å; V56-I60 HydrophobicContact CG1-CD1 3.47Å; V56-I60 VanDerWaalsContact CG1-CD1 3.47Å; V56-I60 HydrophobicContact CG1-CG1 3.97Å; V56-I60 WeakPolarHBondContact O-CA 3.27Å; V56-I60 WeakPolarHBondContact O-CB 3.33Å; V56-I60 WeakPolarHBondContact O-CG1 3.48Å; V56-I60 PolarHBondContact O-N 3.35Å; I60-L64 HydrophobicContact CB-CD1 4.3Å; I60-L64 HydrophobicContact CG2-CD1 3.33Å; I60-L64 WeakPolarHBondContact O-CA 3.49Å; I60-L64 WeakPolarHBondContact O-CB 3.41Å; I60-L64 WeakPolarHBondContact O-CD1 3.3Å; I60-L64 PolarHBondContact O-N 3.2Å
61	M	43.8	Very low	43.4	Very low	64 Å²	64	70.9 Å²	70.9	32%	0.315	37%	0.369	S	S	.	.	H	α-helix	trans	-62	-54.2	179.6	-78.6	-155.9	-70.4	0	0	111	S57 E58 I59 D63 L64 F65 L265	S57-M61 VanDerWaalsContact O-CB 3.31Å; S57-M61 WeakPolarHBondContact O-CB 3.17Å; S57-M61 VanDerWaalsContact O-CG 3.29Å; S57-M61 WeakPolarHBondContact O-CG 3.24Å; S57-M61 PolarHBondContact O-N 3.36Å; E58-M61 PolarHBondContact O-N 2.92Å; I59-M61 VanDerWaalsContact C-N 3.29Å; I59-M61 PolarHBondContact O-N 2.92Å; M61-D63 PolarHBondContact O-N 2.97Å; M61-L64 PolarHBondContact O-N 3.31Å; M61-F65 HydrophobicContact CB-CD2 4.1Å; M61-F65 HydrophobicContact CB-CE2 4.15Å; M61-F65 HydrophobicContact CG-CE2 4.3Å; M61-F65 WeakPolarHBondContact O-CB 3.18Å; M61-F65 WeakPolarHBondContact O-CD2 3.44Å; M61-F65 WeakPolarHBondContact O-CG 3.3Å; M61-F65 PolarHBondContact O-N 3.03Å; M61-F65 HydrophobicContact SD-CE2 4.28Å; M61-L265 HydrophobicContact CE-CD1 3.68Å; M61-L265 HydrophobicContact SD-CD1 3.8Å
62	E	43.8	Very low	43.5	Very low	145 Å²	145	72.6 Å²	72.6	68%	0.678	37%	0.369	S	S	*	.	H	α-helix	trans	-61.1	-47.7	-176.6	-164.4	173.9	-173.6	0	0	112.2	E58 I59 F65 D66	E58-E62 WeakPolarHBondContact O-CB 3.32Å; E58-E62 PolarHBondContact O-N 3.39Å; I59-E62 PolarHBondContact O-N 2.94Å; E62-F65 PolarHBondContact O-N 3.41Å; E62-D66 VanDerWaalsContact O-CB 3.31Å; E62-D66 WeakPolarHBondContact O-CB 3.47Å; E62-D66 PolarHBondContact O-N 3.11Å
63	D	43.7	Very low	43.7	Very low	73 Å²	73	75.1 Å²	75.1	39%	0.39	38%	0.378	S	S	.	.	H	α-helix	trans	-75.9	-34	-179	-73.5	-22.9	0	0	0	112.8	Y32 I59 M61 L67	Y32-D63 HydrophobicContact CD2-CB 4.43Å; Y32-D63 HydrophobicContact CE2-CB 4.36Å; I59-D63 WeakPolarHBondContact CG2-OD2 3.27Å; I59-D63 VanDerWaalsContact O-CB 3.25Å; I59-D63 WeakPolarHBondContact O-CB 3.41Å; I59-D63 PolarHBondContact O-N 3.08Å; M61-D63 PolarHBondContact O-N 2.97Å; D63-L67 VanDerWaalsContact O-CB 3.24Å; D63-L67 WeakPolarHBondContact O-CB 3.39Å; D63-L67 PolarHBondContact O-N 3.47Å
64	L	43.6	Very low	43.7	Very low	34 Å²	34	69.3 Å²	69.3	18%	0.178	35%	0.35	C	S	.	.	H	α-helix	trans	-70.8	-36.7	170.8	-92.1	131.5	0	0	0	111.6	I60 M61 D66 L67 L68 L254	I60-L64 HydrophobicContact CB-CD1 4.3Å; I60-L64 HydrophobicContact CG2-CD1 3.33Å; I60-L64 WeakPolarHBondContact O-CA 3.49Å; I60-L64 WeakPolarHBondContact O-CB 3.41Å; I60-L64 WeakPolarHBondContact O-CD1 3.3Å; I60-L64 PolarHBondContact O-N 3.2Å; M61-L64 PolarHBondContact O-N 3.31Å; L64-D66 VanDerWaalsContact C-N 3.35Å; L64-L67 PolarHBondContact O-N 3.35Å; L64-L68 WeakPolarHBondContact O-CB 3.37Å; L64-L68 WeakPolarHBondContact O-CD1 3.39Å; L64-L68 WeakPolarHBondContact O-CG 2.98Å; L64-L68 PolarHBondContact O-N 2.96Å; L64-L254 HydrophobicContact CD2-CD2 4.48Å
65	F	46.8	Very low	43.5	Very low	104 Å²	104	68.7 Å²	68.7	46%	0.456	35%	0.348	S	S	.	.	H	α-helix	trans	-66.6	-39.2	173.7	-81.9	-62.6	0	0	0	110.7	M61 E62 S69	M61-F65 HydrophobicContact CB-CD2 4.1Å; M61-F65 HydrophobicContact CB-CE2 4.15Å; M61-F65 HydrophobicContact CG-CE2 4.3Å; M61-F65 WeakPolarHBondContact O-CB 3.18Å; M61-F65 WeakPolarHBondContact O-CD2 3.44Å; M61-F65 WeakPolarHBondContact O-CG 3.3Å; M61-F65 PolarHBondContact O-N 3.03Å; M61-F65 HydrophobicContact SD-CE2 4.28Å; E62-F65 PolarHBondContact O-N 3.41Å; F65-S69 WeakPolarHBondContact O-CA 3.46Å; F65-S69 WeakPolarHBondContact O-CB 3.23Å; F65-S69 PolarHBondContact O-N 3.35Å
66	D	46.6	Very low	43.2	Very low	67 Å²	67	66 Å²	66	36%	0.358	34%	0.342	S	S	.	.	H	α-helix	trans	-64.4	-42.4	172	-177.6	46.7	0	0	0	111.5	E62 L64 S69 K70	E62-D66 VanDerWaalsContact O-CB 3.31Å; E62-D66 WeakPolarHBondContact O-CB 3.47Å; E62-D66 PolarHBondContact O-N 3.11Å; L64-D66 VanDerWaalsContact C-N 3.35Å; D66-S69 PolarHBondContact O-N 3.31Å; D66-K70 WeakPolarHBondContact O-CB 3.32Å; D66-K70 VanDerWaalsContact O-CG 3.25Å; D66-K70 WeakPolarHBondContact O-CG 3.37Å; D66-K70 PolarHBondContact O-N 2.99Å; D66-K70 WeakPolarHBondContact OD1-CE 3.26Å; D66-K70 IonicContact OD1-NZ 2.87Å; D66-K70 PolarHBondContact OD1-NZ 3.43Å; D66-K70 WeakPolarHBondContact OD2-CE 3.4Å; D66-K70 IonicContact OD2-NZ 3.56Å; D66-K70 PolarHBondContact OD2-NZ 2.93Å
67	L	43.9	Very low	43.3	Very low	42 Å²	42	66.5 Å²	66.5	22%	0.22	34%	0.343	C	S	.	.	H	α-helix	trans	-66	-44.6	176.5	-163.7	82.4	0	0	0	112.2	L25 F29 D63 L64 K70 Y71	L25-L67 HydrophobicContact CB-CD1 3.89Å; L25-L67 HydrophobicContact CD2-CD1 3.49Å; L25-L67 VanDerWaalsContact CD2-CD1 3.49Å; L25-L67 HydrophobicContact CD2-CG 4.19Å; L25-L67 HydrophobicContact CG-CD1 4.29Å; F29-L67 HydrophobicContact CB-CD2 4.01Å; F29-L67 HydrophobicContact CD2-CD2 3.74Å; F29-L67 HydrophobicContact CG-CD2 4.1Å; D63-L67 VanDerWaalsContact O-CB 3.24Å; D63-L67 WeakPolarHBondContact O-CB 3.39Å; D63-L67 PolarHBondContact O-N 3.47Å; L64-L67 PolarHBondContact O-N 3.35Å; L67-K70 PolarHBondContact O-N 3.48Å; L67-Y71 WeakPolarHBondContact O-CB 3.26Å; L67-Y71 PolarHBondContact O-N 3.02Å
68	L	41.7	Very low	43.2	Very low	45 Å²	45	68 Å²	68	24%	0.236	35%	0.348	C	S	.	.	H	α-helix	trans	-62.3	-43.9	173.9	-85.5	158.7	0	0	0	110.4	L64 Y71 H72 L254	L64-L68 WeakPolarHBondContact O-CB 3.37Å; L64-L68 WeakPolarHBondContact O-CD1 3.39Å; L64-L68 WeakPolarHBondContact O-CG 2.98Å; L64-L68 PolarHBondContact O-N 2.96Å; L68-Y71 PolarHBondContact O-N 2.95Å; L68-H72 VanDerWaalsContact O-CB 3.31Å; L68-H72 WeakPolarHBondContact O-CB 3.35Å; L68-H72 PolarHBondContact O-CD2 3.49Å; L68-H72 PolarHBondContact O-N 2.99Å; L68-L254 HydrophobicContact CD2-CD1 4.5Å
69	S	45.5	Very low	42.9	Very low	73 Å²	73	68.8 Å²	68.8	51%	0.51	36%	0.355	S	S	.	.	H	α-helix	trans	-61.8	-48.7	177.3	-179.6	0	0	0	0	111	F65 D66 Y71 H72 H73	F65-S69 WeakPolarHBondContact O-CA 3.46Å; F65-S69 WeakPolarHBondContact O-CB 3.23Å; F65-S69 PolarHBondContact O-N 3.35Å; D66-S69 PolarHBondContact O-N 3.31Å; S69-Y71 PolarHBondContact O-N 2.93Å; S69-H72 PolarHBondContact O-N 3.21Å; S69-H73 WeakPolarHBondContact O-CB 3.48Å; S69-H73 PolarHBondContact O-N 2.96Å
70	K	44.3	Very low	42.8	Very low	90 Å²	90	72.5 Å²	72.5	39%	0.391	37%	0.369	S	S	.	.	H	α-helix	trans	-65.6	-35.7	175.8	-70.7	168.7	175.6	163.2	0	112.6	L25 D66 L67 H73 A74	L25-K70 HydrophobicContact CD1-CB 4.44Å; L25-K70 HydrophobicContact CD2-CB 3.47Å; L25-K70 VanDerWaalsContact CD2-CB 3.47Å; L25-K70 HydrophobicContact CD2-CD 3.97Å; L25-K70 HydrophobicContact CD2-CG 4.36Å; D66-K70 WeakPolarHBondContact O-CB 3.32Å; D66-K70 VanDerWaalsContact O-CG 3.25Å; D66-K70 WeakPolarHBondContact O-CG 3.37Å; D66-K70 PolarHBondContact O-N 2.99Å; D66-K70 WeakPolarHBondContact OD1-CE 3.26Å; D66-K70 IonicContact OD1-NZ 2.87Å; D66-K70 PolarHBondContact OD1-NZ 3.43Å; D66-K70 WeakPolarHBondContact OD2-CE 3.4Å; D66-K70 IonicContact OD2-NZ 3.56Å; D66-K70 PolarHBondContact OD2-NZ 2.93Å; L67-K70 PolarHBondContact O-N 3.48Å; K70-H73 PolarHBondContact O-N 3.25Å; K70-A74 WeakPolarHBondContact O-CB 3.11Å; K70-A74 PolarHBondContact O-N 2.79Å
71	Y	45.5	Very low	42.7	Very low	56 Å²	56	74.4 Å²	74.4	22%	0.22	38%	0.378	C	S	.	.	H	α-helix	trans	-66.3	-44.6	172.7	169.2	-94	0	0	0	111.9	L67 L68 S69 H73 A74 S75 L247	L67-Y71 WeakPolarHBondContact O-CB 3.26Å; L67-Y71 PolarHBondContact O-N 3.02Å; L68-Y71 PolarHBondContact O-N 2.95Å; S69-Y71 PolarHBondContact O-N 2.93Å; Y71-H73 VanDerWaalsContact C-N 3.26Å; Y71-H73 PolarHBondContact O-N 3.37Å; Y71-A74 PolarHBondContact O-N 3Å; Y71-S75 VanDerWaalsContact O-CB 3.32Å; Y71-S75 WeakPolarHBondContact O-CB 3.39Å; Y71-S75 PolarHBondContact O-N 3.38Å; Y71-S75 PolarHBondContact O-OG 3.29Å; Y71-L247 HydrophobicContact CE2-CD2 3.89Å; Y71-L247 VanDerWaalsContact OH-CD2 3.31Å; Y71-L247 WeakPolarHBondContact OH-CD2 3.41Å
72	H	43.8	Very low	42.3	Very low	110 Å²	110	75 Å²	75	51%	0.509	39%	0.388	S	S	.	.	H	α-helix	trans	-63.1	-34.8	173.3	-78.1	-57.4	0	0	0	111.3	L68 S69 S75 G76	L68-H72 VanDerWaalsContact O-CB 3.31Å; L68-H72 WeakPolarHBondContact O-CB 3.35Å; L68-H72 PolarHBondContact O-CD2 3.49Å; L68-H72 PolarHBondContact O-N 2.99Å; S69-H72 PolarHBondContact O-N 3.21Å; H72-S75 VanDerWaalsContact CA-OG 3.31Å; H72-S75 WeakPolarHBondContact CA-OG 3.4Å; H72-S75 PolarHBondContact O-OG 3.16Å; H72-G76 WeakPolarHBondContact O-CA 3.47Å; H72-G76 PolarHBondContact O-N 3.36Å
73	H	45.8	Very low	42	Very low	116 Å²	116	72.4 Å²	72.4	54%	0.537	38%	0.382	S	S	.	.	H	α-helix	trans	-69.9	-45.6	174.4	-165.2	71.5	0	0	0	112	S69 K70 Y71 G76 N77	S69-H73 WeakPolarHBondContact O-CB 3.48Å; S69-H73 PolarHBondContact O-N 2.96Å; K70-H73 PolarHBondContact O-N 3.25Å; Y71-H73 VanDerWaalsContact C-N 3.26Å; Y71-H73 PolarHBondContact O-N 3.37Å; H73-G76 PolarHBondContact O-N 2.98Å; H73-N77 PolarHBondContact CD2-ND2 3.36Å; H73-N77 PolarHBondContact NE2-ND2 2.94Å; H73-N77 VanDerWaalsContact NE2-ND2 3.15Å; H73-N77 VanDerWaalsContact O-CB 3.31Å; H73-N77 WeakPolarHBondContact O-CB 3.32Å; H73-N77 PolarHBondContact O-N 3.03Å; H73-N77 PolarHBondContact O-ND2 3.22Å
74	A	43.4	Very low	41.3	Very low	3 Å²	3	74.7 Å²	74.7	3%	0.025	39%	0.39	C	S	.	.	H	α-helix	trans	-64.6	-48.3	177.4	0	0	0	0	0	111.5	E21 K70 Y71 G76 N77 I78	E21-A74 HydrophobicContact CB-CB 4.45Å; E21-A74 VanDerWaalsContact OE2-CB 3.31Å; E21-A74 WeakPolarHBondContact OE2-CB 3.36Å; K70-A74 WeakPolarHBondContact O-CB 3.11Å; K70-A74 PolarHBondContact O-N 2.79Å; Y71-A74 PolarHBondContact O-N 3Å; A74-G76 VanDerWaalsContact C-N 3.35Å; A74-N77 PolarHBondContact O-N 3.39Å; A74-I78 WeakPolarHBondContact O-CD1 3.37Å; A74-I78 VanDerWaalsContact O-CG1 3.23Å; A74-I78 WeakPolarHBondContact O-CG1 3.45Å; A74-I78 PolarHBondContact O-N 2.97Å
75	S	40.2	Very low	40.7	Very low	37 Å²	37	77.7 Å²	77.7	26%	0.259	40%	0.404	S	S	.	.	H	α-helix	trans	-63.1	-40.7	174.5	56	0	0	0	0	111.8	Y71 H72 I78 L79	Y71-S75 VanDerWaalsContact O-CB 3.32Å; Y71-S75 WeakPolarHBondContact O-CB 3.39Å; Y71-S75 PolarHBondContact O-N 3.38Å; Y71-S75 PolarHBondContact O-OG 3.29Å; H72-S75 VanDerWaalsContact CA-OG 3.31Å; H72-S75 WeakPolarHBondContact CA-OG 3.4Å; H72-S75 PolarHBondContact O-OG 3.16Å; S75-I78 PolarHBondContact O-N 3.37Å; S75-L79 WeakPolarHBondContact O-CB 3.14Å; S75-L79 PolarHBondContact O-N 2.93Å
76	G	37.3	Very low	40	Very low	32 Å²	32	79.2 Å²	79.2	33%	0.33	41%	0.413	S	S	.	.	H	α-helix	trans	-62.5	-39	173.3	0	0	0	0	0	112.7	H72 H73 A74 L79 K80	H72-G76 WeakPolarHBondContact O-CA 3.47Å; H72-G76 PolarHBondContact O-N 3.36Å; H73-G76 PolarHBondContact O-N 2.98Å; A74-G76 VanDerWaalsContact C-N 3.35Å; G76-L79 PolarHBondContact O-N 3.47Å; G76-K80 WeakPolarHBondContact O-CB 3.34Å; G76-K80 PolarHBondContact O-N 3.44Å
77	N	43.3	Very low	39.1	Very low	57 Å²	57	80 Å²	80	31%	0.305	41%	0.414	S	S	.	.	H	α-helix	trans	-68.3	-41.8	174.7	-76.4	-21.5	0	0	0	111.6	H73 A74 K80 M81	H73-N77 PolarHBondContact CD2-ND2 3.36Å; H73-N77 PolarHBondContact NE2-ND2 2.94Å; H73-N77 VanDerWaalsContact NE2-ND2 3.15Å; H73-N77 VanDerWaalsContact O-CB 3.31Å; H73-N77 WeakPolarHBondContact O-CB 3.32Å; H73-N77 PolarHBondContact O-N 3.03Å; H73-N77 PolarHBondContact O-ND2 3.22Å; A74-N77 PolarHBondContact O-N 3.39Å; N77-K80 PolarHBondContact O-N 3.31Å; N77-M81 WeakPolarHBondContact O-CB 3.15Å; N77-M81 WeakPolarHBondContact O-CG 3.23Å; N77-M81 PolarHBondContact O-N 2.87Å
78	I	40.2	Very low	38.4	Very low	61 Å²	61	83.1 Å²	83.1	31%	0.313	44%	0.437	S	S	.	.	H	α-helix	trans	-61.4	-48.7	173.3	-65.1	161.4	0	0	0	109.6	A18 A74 S75 M81 C82	A18-I78 HydrophobicContact CB-CD1 3.57Å; A18-I78 HydrophobicContact CB-CG1 3.68Å; A74-I78 WeakPolarHBondContact O-CD1 3.37Å; A74-I78 VanDerWaalsContact O-CG1 3.23Å; A74-I78 WeakPolarHBondContact O-CG1 3.45Å; A74-I78 PolarHBondContact O-N 2.97Å; S75-I78 PolarHBondContact O-N 3.37Å; I78-M81 PolarHBondContact O-N 2.9Å; I78-C82 VanDerWaalsContact O-CB 3.29Å; I78-C82 WeakPolarHBondContact O-CB 3.23Å; I78-C82 PolarHBondContact O-N 2.98Å; I78-C82 PolarHBondContact O-SG 2.93Å
79	L	35.7	Very low	37.8	Very low	123 Å²	123	87.9 Å²	87.9	64%	0.644	46%	0.461	S	S	*	.	H	α-helix	trans	-60.7	-49.3	178.9	-150.3	97.5	0	0	0	110.3	S75 G76 M81 C82 T83	S75-L79 WeakPolarHBondContact O-CB 3.14Å; S75-L79 PolarHBondContact O-N 2.93Å; G76-L79 PolarHBondContact O-N 3.47Å; L79-M81 VanDerWaalsContact C-N 3.34Å; L79-M81 PolarHBondContact O-N 3.33Å; L79-C82 CarbonylContact O-C 3.36Å; L79-C82 PolarHBondContact O-N 3.35Å; L79-T83 WeakPolarHBondContact O-CB 3.2Å; L79-T83 VanDerWaalsContact O-CG2 3.27Å; L79-T83 WeakPolarHBondContact O-CG2 3.22Å; L79-T83 PolarHBondContact O-N 2.94Å; L79-T83 PolarHBondContact O-OG1 3.31Å
80	K	38.3	Very low	36.8	Very low	127 Å²	127	91.4 Å²	91.4	55%	0.552	47%	0.474	S	S	*	.	H	α-helix	trans	-63	-35	178.1	-165.7	174.4	-173	173.4	0	112.3	G76 N77 T83 Q84	G76-K80 WeakPolarHBondContact O-CB 3.34Å; G76-K80 PolarHBondContact O-N 3.44Å; N77-K80 PolarHBondContact O-N 3.31Å; K80-T83 WeakPolarHBondContact CA-OG1 3.27Å; K80-T83 PolarHBondContact O-OG1 2.64Å; K80-Q84 HydrophobicContact CG-CG 4.48Å; K80-Q84 WeakPolarHBondContact O-CA 3.5Å; K80-Q84 WeakPolarHBondContact O-CB 3.43Å; K80-Q84 WeakPolarHBondContact O-CG 3.45Å; K80-Q84 PolarHBondContact O-N 2.98Å
81	M	39.5	Very low	36.1	Very low	103 Å²	103	92 Å²	92	51%	0.507	49%	0.49	S	S	.	.	H	α-helix	trans	-76.3	-35	175.6	-70.9	-108.5	97.9	0	0	112.1	N77 I78 L79 Q84	N77-M81 WeakPolarHBondContact O-CB 3.15Å; N77-M81 WeakPolarHBondContact O-CG 3.23Å; N77-M81 PolarHBondContact O-N 2.87Å; I78-M81 PolarHBondContact O-N 2.9Å; L79-M81 VanDerWaalsContact C-N 3.34Å; L79-M81 PolarHBondContact O-N 3.33Å; M81-Q84 VanDerWaalsContact CE-OE1 3.22Å
82	C	36.3	Very low	35.4	Very low	77 Å²	77	93.4 Å²	93.4	52%	0.52	51%	0.507	S	S	.	.	H	α-helix	trans	-71.4	-30.5	173	-69.4	0	0	0	0	112	I78 L79	I78-C82 VanDerWaalsContact O-CB 3.29Å; I78-C82 WeakPolarHBondContact O-CB 3.23Å; I78-C82 PolarHBondContact O-N 2.98Å; I78-C82 PolarHBondContact O-SG 2.93Å; L79-C82 CarbonylContact O-C 3.36Å; L79-C82 PolarHBondContact O-N 3.35Å
83	T	36.2	Very low	34.8	Very low	90 Å²	90	95 Å²	95	55%	0.552	52%	0.52	S	S	*	.	H	α-helix	trans	-94.9	-12.1	177.2	61.6	0	0	0	0	113.9	L79 K80 M85	L79-T83 WeakPolarHBondContact O-CB 3.2Å; L79-T83 VanDerWaalsContact O-CG2 3.27Å; L79-T83 WeakPolarHBondContact O-CG2 3.22Å; L79-T83 PolarHBondContact O-N 2.94Å; L79-T83 PolarHBondContact O-OG1 3.31Å; K80-T83 WeakPolarHBondContact CA-OG1 3.27Å; K80-T83 PolarHBondContact O-OG1 2.64Å; T83-M85 PolarHBondContact O-N 2.97Å
84	Q	28.7	Very low	33.9	Very low	121 Å²	121	95.1 Å²	95.1	57%	0.565	52%	0.523	S	S	*	.			trans	-70.6	83.5	170.5	-92.3	178	11.6	0	0	110.2	K80 M81	K80-Q84 HydrophobicContact CG-CG 4.48Å; K80-Q84 WeakPolarHBondContact O-CA 3.5Å; K80-Q84 WeakPolarHBondContact O-CB 3.43Å; K80-Q84 WeakPolarHBondContact O-CG 3.45Å; K80-Q84 PolarHBondContact O-N 2.98Å; M81-Q84 VanDerWaalsContact CE-OE1 3.22Å
85	M	31.2	Very low	33.2	Very low	97 Å²	97	100.1 Å²	100.1	48%	0.478	56%	0.558	S	S	.	*			trans	-117.8	141.8	-176.1	-120.4	-70.5	-165.8	0	0	104.7	T83	T83-M85 PolarHBondContact O-N 2.97Å
86	H	32.1	Very low	32.7	Very low	137 Å²	137	103.2 Å²	103.2	63%	0.634	58%	0.58	S	S	*	*			trans	98.6	118.4	157.6	-57.3	49.9	0	0	0	119.8
87	Q	28.8	Very low	32.2	Very low	83 Å²	83	108.3 Å²	108.3	39%	0.388	60%	0.599	S	S	.	*				-126.7	136.5	122.1	-110.7	-172.5	-24.8	0	0	108.3	C375 D376 P378	Q87-C375 PolarHBondContact OE1-O 3.39Å; Q87-D376 PolarHBondContact NE2-O 3.04Å; Q87-P378 HydrophobicContact CG-CG 3.97Å
88	P	29	Very low	31.4	Very low	108 Å²	108	109.9 Å²	109.9	70%	0.701	61%	0.613	S	S	*	*			trans	-75.8	159.1	-176	31.2	-33	0	0	0	112.4
89	I	28.1	Very low	30.6	Very low	145 Å²	145	115.1 Å²	115.1	74%	0.744	64%	0.642	S	S	*	*			trans	-87.5	127.5	168.8	-65.2	171.4	0	0	0	106.9	S91	I89-S91 PolarHBondContact O-N 3.15Å; I89-S91 VanDerWaalsContact O-N 3.09Å
90	D	26.1	Very low	30.2	Very low	147 Å²	147	118.9 Å²	118.9	79%	0.786	65%	0.649	S	S	*	*			trans	-54.5	111	167.1	-78.1	-42.6	0	0	0	109.7	S92	D90-S92 PolarHBondContact O-N 3.12Å
91	S	29	Very low	29.5	Very low	103 Å²	103	119.1 Å²	119.1	72%	0.72	66%	0.656	S	S	*	*			trans	-85.4	34.9	176.7	62.6	0	0	0	0	112.1	I89	I89-S91 PolarHBondContact O-N 3.15Å; I89-S91 VanDerWaalsContact O-N 3.09Å
92	S	31.5	Very low	29.2	Very low	84 Å²	84	121.2 Å²	121.2	59%	0.587	66%	0.663	S	S	*	*			trans	-85.5	-8.6	-178.9	57	0	0	0	0	114.6	D90	D90-S92 PolarHBondContact O-N 3.12Å
93	D	29.7	Very low	29	Very low	143 Å²	143	123.1 Å²	123.1	77%	0.765	67%	0.672	S	S	*	*	S	Bend	trans	-104.7	3.6	-178.8	-79	-9.5	0	0	0	115.1
94	I	28.5	Very low	28.8	Very low	120 Å²	120	128.6 Å²	128.6	62%	0.615	69%	0.688	S	S	*	*	S	Bend	trans	-102.3	-8.7	179	-58	173.3	0	0	0	112.5	S96 L97	I94-S96 PolarHBondContact O-N 2.72Å; I94-L97 PolarHBondContact O-N 3.01Å; I94-L97 VanDerWaalsContact O-N 3.15Å
95	S	28.4	Very low	28.9	Very low	107 Å²	107	124.6 Å²	124.6	75%	0.748	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	-4.3	177.5	58.9	0	0	0	0	114.5
96	S	28.6	Very low	29	Very low	103 Å²	103	124 Å²	124	72%	0.72	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.1	6.7	174.1	75.9	0	0	0	0	115.1	I94	I94-S96 PolarHBondContact O-N 2.72Å
97	L	27.3	Very low	29.2	Very low	139 Å²	139	121.6 Å²	121.6	73%	0.728	68%	0.679	S	S	*	*	S	Bend	trans	-114.3	0.7	-177.4	-113.1	141.3	0	0	0	115.1	I94	I94-L97 PolarHBondContact O-N 3.01Å; I94-L97 VanDerWaalsContact O-N 3.15Å
98	C	25.9	Very low	29.4	Very low	89 Å²	89	124.8 Å²	124.8	60%	0.601	70%	0.695	S	S	*	*			trans	-127.6	45.8	-178.5	-61.5	0	0	0	0	113.4	Y100	C98-Y100 PolarHBondContact O-N 3.33Å; C98-Y100 VanDerWaalsContact O-N 3.12Å
99	D	23.5	Very low	29.4	Very low	172 Å²	172	121.5 Å²	121.5	92%	0.92	68%	0.68	S	S	*	*			trans	-80.4	48.2	158.9	-94.4	-14.9	0	0	0	110.7
100	Y	27.5	Very low	29.6	Very low	202 Å²	202	121.6 Å²	121.6	79%	0.792	68%	0.675	S	S	*	*			trans	-108.4	119.8	170.6	-110.1	-89.5	0	0	0	109.4	C98 F102	C98-Y100 PolarHBondContact O-N 3.33Å; C98-Y100 VanDerWaalsContact O-N 3.12Å; Y100-F102 WeakPolarHBondContact O-CD2 3.49Å; Y100-F102 PolarHBondContact O-N 2.99Å
101	D	24.9	Very low	30	Very low	131 Å²	131	121.1 Å²	121.1	70%	0.701	67%	0.672	S	S	*	*			trans	-67.9	95.8	-170.8	-162.2	-14.4	0	0	0	111.4	T103	D101-T103 PolarHBondContact O-N 2.96Å; D101-T103 VanDerWaalsContact O-N 3.15Å; D101-T103 WeakPolarHBondContact OD1-CG2 3.1Å; D101-T103 PolarHBondContact OD1-OG1 3.24Å
102	F	32.8	Very low	30.1	Very low	148 Å²	148	123 Å²	123	65%	0.649	67%	0.674	S	S	*	*			trans	-74	13.1	-178.6	-86.9	-82.7	0	0	0	114.7	Y100 K104	Y100-F102 WeakPolarHBondContact O-CD2 3.49Å; Y100-F102 PolarHBondContact O-N 2.99Å; F102-K104 PolarHBondContact O-N 3.38Å; F102-K104 VanDerWaalsContact O-N 3.12Å
103	T	30.7	Very low	30	Very low	116 Å²	116	125.2 Å²	125.2	71%	0.712	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	8	-172.4	52.7	0	0	0	0	115.9	D101	D101-T103 PolarHBondContact O-N 2.96Å; D101-T103 VanDerWaalsContact O-N 3.15Å; D101-T103 WeakPolarHBondContact OD1-CG2 3.1Å; D101-T103 PolarHBondContact OD1-OG1 3.24Å
104	K	32	Very low	30.3	Very low	205 Å²	205	123.9 Å²	123.9	89%	0.891	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.1	9.6	-173.1	-82.9	-172.3	177.8	178	0	118.7	F102	F102-K104 PolarHBondContact O-N 3.38Å; F102-K104 VanDerWaalsContact O-N 3.12Å
105	G	32.3	Very low	31	Very low	38 Å²	38	125.4 Å²	125.4	39%	0.392	68%	0.683	S	S	.	*	S	Bend	trans	-177.4	143.4	171.5	0	0	0	0	0	112.6
106	S	33.3	Very low	31.5	Very low	83 Å²	83	124.5 Å²	124.5	58%	0.58	67%	0.67	S	S	*	*			trans	-64.9	137.5	178.5	55.9	0	0	0	0	110.9	E108 G109	S106-E108 PolarHBondContact O-N 3.24Å; S106-G109 PolarHBondContact O-N 2.97Å
107	V	35.6	Very low	32	Very low	87 Å²	87	126.8 Å²	126.8	53%	0.527	67%	0.669	S	S	.	*	T	Hydrogen-bonded Turn	trans	-56.2	-31.1	-179.7	177.2	0	0	0	0	112.1	G109 F110 L111	V107-G109 PolarHBondContact O-N 3.37Å; V107-F110 PolarHBondContact O-N 3.31Å; V107-F110 VanDerWaalsContact O-N 3.08Å; V107-L111 HydrophobicContact CG1-CD1 4.1Å; V107-L111 PolarHBondContact O-N 2.98Å
108	E	32.8	Very low	32.6	Very low	151 Å²	151	126.9 Å²	126.9	71%	0.706	66%	0.664	S	S	*	*	H	α-helix	trans	-58.3	-32.2	173.4	-85.2	170.1	152.5	0	0	113.2	S106 F110	S106-E108 PolarHBondContact O-N 3.24Å; E108-F110 VanDerWaalsContact C-N 3.3Å; E108-F110 PolarHBondContact O-N 3.05Å
109	G	30.1	Very low	33.4	Very low	39 Å²	39	130.1 Å²	130.1	40%	0.402	66%	0.664	S	S	.	*	H	α-helix	trans	-73	-18.8	176.9	0	0	0	0	0	114.5	S106 V107	S106-G109 PolarHBondContact O-N 2.97Å; V107-G109 PolarHBondContact O-N 3.37Å
110	F	31.5	Very low	34.4	Very low	146 Å²	146	128 Å²	128	64%	0.64	65%	0.647	S	S	*	*	H	α-helix	trans	-95.1	-28.1	-175.7	-74.5	-80.7	0	0	0	113.6	V107 E108	V107-F110 PolarHBondContact O-N 3.31Å; V107-F110 VanDerWaalsContact O-N 3.08Å; E108-F110 VanDerWaalsContact C-N 3.3Å; E108-F110 PolarHBondContact O-N 3.05Å
111	L	33.4	Very low	35.1	Very low	137 Å²	137	123.3 Å²	123.3	72%	0.717	64%	0.635	S	S	*	*	H	α-helix	trans	-86	-31.7	-178.9	-68.9	171.3	0	0	0	112.9	V107	V107-L111 HydrophobicContact CG1-CD1 4.1Å; V107-L111 PolarHBondContact O-N 2.98Å
112	D	32	Very low	36	Very low	142 Å²	142	122.8 Å²	122.8	76%	0.759	63%	0.628	S	S	*	*	S	Bend	trans	-88	-0.9	-179.3	-82	-18.6	0	0	0	114	P114	D112-P114 WeakPolarHBondContact O-CD 3.1Å
113	Q	29.2	Very low	36.5	Very low	131 Å²	131	120.7 Å²	120.7	61%	0.612	62%	0.62	S	S	*	*	S	Bend	trans	-82.4	119.4	165.6	-74.4	-172.4	3.1	0	0	108.5	L115	Q113-L115 PolarHBondContact O-N 2.87Å
114	P	36.4	Very low	37.1	Very low	115 Å²	115	120.3 Å²	120.3	75%	0.747	61%	0.613	S	S	*	*			trans	-52.6	122.7	164.9	22.9	-30.6	0	0	0	106.4	D112 D116	D112-P114 WeakPolarHBondContact O-CD 3.1Å; P114-D116 WeakPolarHBondContact O-CA 3.44Å; P114-D116 PolarHBondContact O-N 3.25Å
115	L	42.8	Very low	37.7	Very low	152 Å²	152	117.9 Å²	117.9	80%	0.796	60%	0.603	S	S	*	*			trans	-31.3	105.7	177	-101.7	137.3	0	0	0	107.5	Q113 E117	Q113-L115 PolarHBondContact O-N 2.87Å; L115-E117 PolarHBondContact O-N 3.45Å
116	D	39.2	Very low	38.3	Very low	89 Å²	89	118.1 Å²	118.1	48%	0.476	60%	0.598	S	S	.	*			trans	-61.1	96.3	-167	-175	6.1	0	0	0	106.4	P114 K118 Y119 F120	P114-D116 WeakPolarHBondContact O-CA 3.44Å; P114-D116 PolarHBondContact O-N 3.25Å; D116-K118 CarbonylContact O-C 3.6Å; D116-K118 PolarHBondContact O-N 3.09Å; D116-K118 WeakPolarHBondContact OD1-CB 3.4Å; D116-K118 PolarHBondContact OD1-N 3.21Å; D116-Y119 WeakPolarHBondContact O-CA 3.49Å; D116-Y119 WeakPolarHBondContact O-CB 3.45Å; D116-Y119 PolarHBondContact O-N 3.32Å; D116-F120 PolarHBondContact O-N 2.96Å
117	E	38.4	Very low	38.7	Very low	151 Å²	151	116.8 Å²	116.8	71%	0.706	59%	0.589	S	S	*	*	H	α-helix	trans	-56.4	-26.1	-175.5	-159.7	176.8	-164.1	0	0	108.2	L115 I121	L115-E117 PolarHBondContact O-N 3.45Å; E117-I121 HydrophobicContact CG-CD1 4.2Å; E117-I121 VanDerWaalsContact O-CB 3.23Å; E117-I121 WeakPolarHBondContact O-CB 3.37Å; E117-I121 WeakPolarHBondContact O-CD1 3.12Å; E117-I121 WeakPolarHBondContact O-CG1 3.48Å; E117-I121 PolarHBondContact O-N 3.31Å
118	K	40.6	Very low	39.3	Very low	140 Å²	140	115.6 Å²	115.6	61%	0.609	58%	0.582	S	S	*	*	H	α-helix	trans	-67	-45.2	170.5	-154.2	-178.7	177.7	-173.9	0	113.5	D116 F120 E122	D116-K118 CarbonylContact O-C 3.6Å; D116-K118 PolarHBondContact O-N 3.09Å; D116-K118 WeakPolarHBondContact OD1-CB 3.4Å; D116-K118 PolarHBondContact OD1-N 3.21Å; K118-F120 VanDerWaalsContact C-N 3.33Å; K118-E122 VanDerWaalsContact O-CB 3.24Å; K118-E122 WeakPolarHBondContact O-CB 3.26Å; K118-E122 WeakPolarHBondContact O-CG 3.21Å; K118-E122 PolarHBondContact O-N 2.96Å
119	Y	42.2	Very low	39.8	Very low	158 Å²	158	116.2 Å²	116.2	62%	0.62	58%	0.578	S	S	*	*	H	α-helix	trans	-62.8	-41.2	172.7	-175.9	-93.2	0	0	0	111	D116 E122 H123	D116-Y119 WeakPolarHBondContact O-CA 3.49Å; D116-Y119 WeakPolarHBondContact O-CB 3.45Å; D116-Y119 PolarHBondContact O-N 3.32Å; Y119-E122 PolarHBondContact O-N 3.37Å; Y119-H123 WeakPolarHBondContact O-CB 3.48Å; Y119-H123 PolarHBondContact O-N 2.88Å
120	F	44.2	Very low	40.5	Very low	127 Å²	127	119.1 Å²	119.1	56%	0.557	58%	0.583	S	S	*	*	H	α-helix	trans	-67.6	-42.9	179.1	-150.8	-89.9	0	0	0	111.9	D116 K118 H123 L124	D116-F120 PolarHBondContact O-N 2.96Å; K118-F120 VanDerWaalsContact C-N 3.33Å; F120-H123 PolarHBondContact O-N 2.84Å; F120-L124 WeakPolarHBondContact O-CB 3.39Å; F120-L124 PolarHBondContact O-N 2.91Å
121	I	43	Very low	41.1	Very low	104 Å²	104	119.4 Å²	119.4	53%	0.533	58%	0.58	S	S	.	*	H	α-helix	trans	-66.4	-42.5	173.4	-70.8	169.2	0	0	0	110.6	E117 H123 L124 F125	E117-I121 HydrophobicContact CG-CD1 4.2Å; E117-I121 VanDerWaalsContact O-CB 3.23Å; E117-I121 WeakPolarHBondContact O-CB 3.37Å; E117-I121 WeakPolarHBondContact O-CD1 3.12Å; E117-I121 WeakPolarHBondContact O-CG1 3.48Å; E117-I121 PolarHBondContact O-N 3.31Å; I121-H123 VanDerWaalsContact C-N 3.34Å; I121-H123 PolarHBondContact O-N 3.37Å; I121-L124 PolarHBondContact O-N 2.71Å; I121-F125 WeakPolarHBondContact O-CB 3.38Å; I121-F125 PolarHBondContact O-N 3.19Å
122	E	42.7	Very low	41.5	Very low	119 Å²	119	120 Å²	120	56%	0.556	57%	0.574	S	S	*	*	H	α-helix	trans	-62.4	-39.9	175.1	-83.1	-176.8	177.2	0	0	111.6	K118 Y119 F125 S126	K118-E122 VanDerWaalsContact O-CB 3.24Å; K118-E122 WeakPolarHBondContact O-CB 3.26Å; K118-E122 WeakPolarHBondContact O-CG 3.21Å; K118-E122 PolarHBondContact O-N 2.96Å; Y119-E122 PolarHBondContact O-N 3.37Å; E122-F125 PolarHBondContact O-N 2.86Å; E122-S126 VanDerWaalsContact O-CB 3.3Å; E122-S126 WeakPolarHBondContact O-CB 3.06Å; E122-S126 PolarHBondContact O-N 2.89Å
123	H	43.4	Very low	42.1	Very low	104 Å²	104	118.4 Å²	118.4	48%	0.481	56%	0.563	S	S	.	*	H	α-helix	trans	-66.7	-47.8	177	-161.3	65.2	0	0	0	111.2	Y119 F120 I121 F125 S126 C127	Y119-H123 WeakPolarHBondContact O-CB 3.48Å; Y119-H123 PolarHBondContact O-N 2.88Å; F120-H123 PolarHBondContact O-N 2.84Å; I121-H123 VanDerWaalsContact C-N 3.34Å; I121-H123 PolarHBondContact O-N 3.37Å; H123-F125 VanDerWaalsContact C-N 3.3Å; H123-F125 PolarHBondContact O-N 2.98Å; H123-S126 PolarHBondContact O-N 3.36Å; H123-S126 VanDerWaalsContact O-N 3.12Å; H123-S126 PolarHBondContact O-OG 3.07Å; H123-C127 PolarHBondContact O-N 3.18Å; H123-C127 PolarHBondContact O-SG 3.29Å; H123-C127 VanDerWaalsContact O-SG 3.36Å
124	L	44.6	Very low	42.9	Very low	109 Å²	109	116.3 Å²	116.3	57%	0.571	56%	0.556	S	S	*	*	H	α-helix	trans	-60.8	-39.7	175.8	-154.1	111.1	0	0	0	111.7	F120 I121 C127 T128	F120-L124 WeakPolarHBondContact O-CB 3.39Å; F120-L124 PolarHBondContact O-N 2.91Å; I121-L124 PolarHBondContact O-N 2.71Å; L124-C127 PolarHBondContact O-N 3.15Å; L124-T128 VanDerWaalsContact O-CB 3.3Å; L124-T128 WeakPolarHBondContact O-CB 3.28Å; L124-T128 PolarHBondContact O-N 3.12Å; L124-T128 PolarHBondContact O-OG1 2.86Å
125	F	44.6	Very low	43.6	Very low	153 Å²	153	115.4 Å²	115.4	67%	0.671	54%	0.542	S	S	*	.	H	α-helix	trans	-67.3	-37.8	175.5	-156	-89.7	0	0	0	111.5	I121 E122 H123 T128 R129	I121-F125 WeakPolarHBondContact O-CB 3.38Å; I121-F125 PolarHBondContact O-N 3.19Å; E122-F125 PolarHBondContact O-N 2.86Å; H123-F125 VanDerWaalsContact C-N 3.3Å; H123-F125 PolarHBondContact O-N 2.98Å; F125-T128 PolarHBondContact O-N 2.68Å; F125-R129 VanDerWaalsContact O-CB 3.26Å; F125-R129 WeakPolarHBondContact O-CB 3.2Å; F125-R129 PolarHBondContact O-N 3.48Å
126	S	44.3	Very low	44.2	Very low	43 Å²	43	112.3 Å²	112.3	30%	0.301	53%	0.529	S	S	.	.	H	α-helix	trans	-66.3	-42.7	175.8	82.1	0	0	0	0	112.2	E122 H123 R129 L130	E122-S126 VanDerWaalsContact O-CB 3.3Å; E122-S126 WeakPolarHBondContact O-CB 3.06Å; E122-S126 PolarHBondContact O-N 2.89Å; H123-S126 PolarHBondContact O-N 3.36Å; H123-S126 VanDerWaalsContact O-N 3.12Å; H123-S126 PolarHBondContact O-OG 3.07Å; S126-R129 PolarHBondContact O-N 2.91Å; S126-L130 WeakPolarHBondContact O-CB 3.08Å; S126-L130 PolarHBondContact O-N 3.47Å
127	C	41.2	Very low	44.7	Very low	56 Å²	56	110.7 Å²	110.7	38%	0.378	53%	0.525	S	S	.	.	H	α-helix	trans	-66.3	-41.9	176	-68.7	0	0	0	0	111.2	H123 L124 L130 R131	H123-C127 PolarHBondContact O-N 3.18Å; H123-C127 PolarHBondContact O-SG 3.29Å; H123-C127 VanDerWaalsContact O-SG 3.36Å; L124-C127 PolarHBondContact O-N 3.15Å; C127-L130 PolarHBondContact O-N 3.32Å; C127-R131 PolarHBondContact O-N 3.23Å
128	T	48.5	Very low	45.3	Very low	62 Å²	62	107 Å²	107	38%	0.38	51%	0.507	S	S	.	.	H	α-helix	trans	-64.3	-42.2	175.2	-56.3	0	0	0	0	110.9	L124 F125 R131 Y132	L124-T128 VanDerWaalsContact O-CB 3.3Å; L124-T128 WeakPolarHBondContact O-CB 3.28Å; L124-T128 PolarHBondContact O-N 3.12Å; L124-T128 PolarHBondContact O-OG1 2.86Å; F125-T128 PolarHBondContact O-N 2.68Å; T128-R131 PolarHBondContact O-N 3.06Å; T128-Y132 HydrophobicContact CG2-CD2 3.87Å; T128-Y132 HydrophobicContact CG2-CE2 3.8Å; T128-Y132 WeakPolarHBondContact O-CD2 3.44Å; T128-Y132 PolarHBondContact O-N 2.91Å
129	R	44.3	Very low	46	Very low	163 Å²	163	102 Å²	102	62%	0.615	49%	0.494	S	S	*	.	H	α-helix	trans	-63.3	-42.5	175.3	-167.3	179.2	77.4	168.4	2.8	112.1	F125 S126 R131 Y132 M133	F125-R129 VanDerWaalsContact O-CB 3.26Å; F125-R129 WeakPolarHBondContact O-CB 3.2Å; F125-R129 PolarHBondContact O-N 3.48Å; S126-R129 PolarHBondContact O-N 2.91Å; R129-R131 VanDerWaalsContact C-N 3.35Å; R129-Y132 PolarHBondContact O-N 3.48Å; R129-M133 WeakPolarHBondContact O-CB 3.44Å; R129-M133 WeakPolarHBondContact O-CG 3.4Å; R129-M133 PolarHBondContact O-N 3.23Å
130	L	43.3	Very low	46.7	Very low	100 Å²	100	100.8 Å²	100.8	52%	0.524	50%	0.498	S	S	.	.	H	α-helix	trans	-60.3	-44.1	174.7	-95	161.3	0	0	0	111.6	S126 C127 M133 L134	S126-L130 WeakPolarHBondContact O-CB 3.08Å; S126-L130 PolarHBondContact O-N 3.47Å; C127-L130 PolarHBondContact O-N 3.32Å; L130-M133 PolarHBondContact O-N 2.91Å; L130-L134 WeakPolarHBondContact O-CB 3.27Å; L130-L134 WeakPolarHBondContact O-CG 3.47Å; L130-L134 PolarHBondContact O-N 3.48Å
131	R	44	Very low	47.1	Very low	152 Å²	152	101 Å²	101	57%	0.574	50%	0.501	S	S	*	.	H	α-helix	trans	-59.8	-48.1	174.6	-179.6	-179.1	164.4	-176.6	-6.3	111.6	C127 T128 R129 M133 L134 E135	C127-R131 PolarHBondContact O-N 3.23Å; T128-R131 PolarHBondContact O-N 3.06Å; R129-R131 VanDerWaalsContact C-N 3.35Å; R131-M133 PolarHBondContact O-N 3.14Å; R131-L134 PolarHBondContact O-N 3.49Å; R131-E135 IonicContact CZ-OE1 3.55Å; R131-E135 IonicContact NE-OE1 3.82Å; R131-E135 PolarHBondContact NE-OE1 3.12Å; R131-E135 IonicContact NH2-OE1 3.04Å; R131-E135 PolarHBondContact NH2-OE1 2.73Å; R131-E135 WeakPolarHBondContact O-CG 3.47Å; R131-E135 PolarHBondContact O-N 3.43Å
132	Y	43.7	Very low	47.7	Very low	150 Å²	150	101.9 Å²	101.9	59%	0.588	50%	0.503	S	S	*	.	H	α-helix	trans	-62.3	-40.1	177.4	-88.7	-69.2	0	0	0	112.7	T128 R129 E135 T136	T128-Y132 HydrophobicContact CG2-CD2 3.87Å; T128-Y132 HydrophobicContact CG2-CE2 3.8Å; T128-Y132 WeakPolarHBondContact O-CD2 3.44Å; T128-Y132 PolarHBondContact O-N 2.91Å; R129-Y132 PolarHBondContact O-N 3.48Å; Y132-E135 PolarHBondContact O-N 2.93Å; Y132-T136 PolarHBondContact O-N 3.47Å; Y132-T136 PolarHBondContact O-OG1 2.82Å
133	M	44.5	Very low	48.8	Very low	109 Å²	109	99 Å²	99	54%	0.537	50%	0.499	S	S	.	.	H	α-helix	trans	-63.6	-40.1	175.3	-78.2	-179.9	52.9	0	0	112.3	R129 L130 R131 T136 S137	R129-M133 WeakPolarHBondContact O-CB 3.44Å; R129-M133 WeakPolarHBondContact O-CG 3.4Å; R129-M133 PolarHBondContact O-N 3.23Å; L130-M133 PolarHBondContact O-N 2.91Å; R131-M133 PolarHBondContact O-N 3.14Å; M133-T136 WeakPolarHBondContact CA-OG1 3.37Å; M133-T136 PolarHBondContact O-OG1 3.38Å; M133-S137 VanDerWaalsContact O-CB 3.31Å; M133-S137 WeakPolarHBondContact O-CB 3.48Å; M133-S137 PolarHBondContact O-N 2.81Å; M133-S137 PolarHBondContact O-OG 3.08Å
134	L	44.5	Very low	49.8	Very low	87 Å²	87	95.6 Å²	95.6	46%	0.455	49%	0.493	S	S	.	.	H	α-helix	trans	-66.5	-48.6	175.5	-72.3	168.2	0	0	0	110.5	L130 R131 T136 S137 F138	L130-L134 WeakPolarHBondContact O-CB 3.27Å; L130-L134 WeakPolarHBondContact O-CG 3.47Å; L130-L134 PolarHBondContact O-N 3.48Å; R131-L134 PolarHBondContact O-N 3.49Å; L134-T136 VanDerWaalsContact C-N 3.35Å; L134-T136 PolarHBondContact O-N 3.41Å; L134-S137 WeakPolarHBondContact CA-OG 3.19Å; L134-S137 PolarHBondContact O-N 3.44Å; L134-S137 PolarHBondContact O-OG 2.82Å; L134-F138 WeakPolarHBondContact O-CD2 3.35Å; L134-F138 PolarHBondContact O-N 3.32Å
135	E	52.1	Low	50.5	Low	95 Å²	95	93.6 Å²	93.6	44%	0.444	48%	0.482	S	S	.	.	H	α-helix	trans	-59.3	-42.1	178	-74.1	176	-173.1	0	0	112.4	R131 Y132 G139	R131-E135 IonicContact CZ-OE1 3.55Å; R131-E135 IonicContact NE-OE1 3.82Å; R131-E135 PolarHBondContact NE-OE1 3.12Å; R131-E135 IonicContact NH2-OE1 3.04Å; R131-E135 PolarHBondContact NH2-OE1 2.73Å; R131-E135 WeakPolarHBondContact O-CG 3.47Å; R131-E135 PolarHBondContact O-N 3.43Å; Y132-E135 PolarHBondContact O-N 2.93Å; E135-G139 PolarHBondContact O-N 3.31Å
136	T	54.9	Low	51.6	Low	88 Å²	88	91 Å²	91	54%	0.54	47%	0.474	S	S	.	.	H	α-helix	trans	-71.4	-39.3	177.5	34.7	0	0	0	0	113.6	Y132 M133 L134 G139 L140	Y132-T136 PolarHBondContact O-N 3.47Å; Y132-T136 PolarHBondContact O-OG1 2.82Å; M133-T136 WeakPolarHBondContact CA-OG1 3.37Å; M133-T136 PolarHBondContact O-OG1 3.38Å; L134-T136 VanDerWaalsContact C-N 3.35Å; L134-T136 PolarHBondContact O-N 3.41Å; T136-G139 PolarHBondContact O-N 3.38Å; T136-L140 WeakPolarHBondContact O-CG 3.4Å; T136-L140 PolarHBondContact O-N 3.4Å
137	S	49.6	Very low	52.5	Low	55 Å²	55	92.8 Å²	92.8	39%	0.385	49%	0.487	S	S	.	.	H	α-helix	trans	-66.5	-38.5	176.9	54.6	0	0	0	0	112.3	M133 L134 L140 Q141	M133-S137 VanDerWaalsContact O-CB 3.31Å; M133-S137 WeakPolarHBondContact O-CB 3.48Å; M133-S137 PolarHBondContact O-N 2.81Å; M133-S137 PolarHBondContact O-OG 3.08Å; L134-S137 WeakPolarHBondContact CA-OG 3.19Å; L134-S137 PolarHBondContact O-N 3.44Å; L134-S137 PolarHBondContact O-OG 2.82Å; S137-L140 PolarHBondContact O-N 2.86Å; S137-Q141 PolarHBondContact O-N 2.98Å; S137-Q141 VanDerWaalsContact O-N 3.16Å
138	F	50.8	Low	53.7	Low	73 Å²	73	95.9 Å²	95.9	32%	0.32	50%	0.496	S	S	.	.	H	α-helix	trans	-66	-44.1	171.8	-84.3	-70.3	0	0	0	112.1	L134 L140 Q141 E142	L134-F138 WeakPolarHBondContact O-CD2 3.35Å; L134-F138 PolarHBondContact O-N 3.32Å; F138-L140 VanDerWaalsContact C-N 3.3Å; F138-L140 PolarHBondContact O-N 3.5Å; F138-Q141 PolarHBondContact O-N 2.95Å; F138-E142 WeakPolarHBondContact O-CB 3.16Å; F138-E142 PolarHBondContact O-N 2.87Å
139	G	55.5	Low	54.6	Low	34 Å²	34	96.8 Å²	96.8	35%	0.351	50%	0.498	S	S	.	.	H	α-helix	trans	-60.5	-36.9	176.5	0	0	0	0	0	113.4	E135 T136 A143	E135-G139 PolarHBondContact O-N 3.31Å; T136-G139 PolarHBondContact O-N 3.38Å; G139-A143 WeakPolarHBondContact O-CB 3.06Å; G139-A143 PolarHBondContact O-N 2.95Å
140	L	57.4	Low	55.6	Low	134 Å²	134	92.8 Å²	92.8	70%	0.702	50%	0.495	S	S	*	.	H	α-helix	trans	-66.8	-41.9	174.7	-80.6	163.9	0	0	0	112.5	T136 S137 F138 G144	T136-L140 WeakPolarHBondContact O-CG 3.4Å; T136-L140 PolarHBondContact O-N 3.4Å; S137-L140 PolarHBondContact O-N 2.86Å; F138-L140 VanDerWaalsContact C-N 3.3Å; F138-L140 PolarHBondContact O-N 3.5Å; L140-G144 PolarHBondContact O-N 3.07Å
141	Q	52.1	Low	56.5	Low	130 Å²	130	94.8 Å²	94.8	61%	0.607	50%	0.499	S	S	*	.	H	α-helix	trans	-67.1	-40.8	176.8	-75.4	-174.3	-16.3	0	0	111.9	S137 F138 G144 L145	S137-Q141 PolarHBondContact O-N 2.98Å; S137-Q141 VanDerWaalsContact O-N 3.16Å; F138-Q141 PolarHBondContact O-N 2.95Å; Q141-G144 PolarHBondContact O-N 3.11Å; Q141-L145 WeakPolarHBondContact O-CG 3.21Å; Q141-L145 PolarHBondContact O-N 2.62Å
142	E	56.6	Low	57.1	Low	123 Å²	123	92 Å²	92	58%	0.575	50%	0.496	S	S	*	.	H	α-helix	trans	-61.5	-45.9	175.5	-173.7	175.3	-170.7	0	0	111.5	F138 G144 L145 L146	F138-E142 WeakPolarHBondContact O-CB 3.16Å; F138-E142 PolarHBondContact O-N 2.87Å; E142-G144 VanDerWaalsContact C-N 3.33Å; E142-G144 PolarHBondContact O-N 3.05Å; E142-L145 PolarHBondContact O-N 2.75Å; E142-L146 HydrophobicContact CG-CD1 4.19Å; E142-L146 WeakPolarHBondContact O-CG 3.07Å; E142-L146 PolarHBondContact O-N 3.43Å
143	A	64.8	Low	58	Low	59 Å²	59	91.7 Å²	91.7	49%	0.488	50%	0.497	S	S	.	.	H	α-helix	trans	-62.4	-38.8	176.1	0	0	0	0	0	112.6	G139 S147	G139-A143 WeakPolarHBondContact O-CB 3.06Å; G139-A143 PolarHBondContact O-N 2.95Å; A143-S147 WeakPolarHBondContact O-CB 3.38Å; A143-S147 PolarHBondContact O-N 2.98Å; A143-S147 VanDerWaalsContact O-N 3.08Å
144	G	65	Low	58.4	Low	33 Å²	33	88.2 Å²	88.2	34%	0.34	49%	0.489	S	S	.	.	H	α-helix	trans	-62.3	-44.3	175.3	0	0	0	0	0	112.9	L140 Q141 E142 S147 Q148	L140-G144 PolarHBondContact O-N 3.07Å; Q141-G144 PolarHBondContact O-N 3.11Å; E142-G144 VanDerWaalsContact C-N 3.33Å; E142-G144 PolarHBondContact O-N 3.05Å; G144-S147 PolarHBondContact O-N 3.29Å; G144-Q148 WeakPolarHBondContact O-CG 3.27Å; G144-Q148 PolarHBondContact O-N 3.1Å; G144-Q148 VanDerWaalsContact O-N 3.11Å
145	L	58.9	Low	58.9	Low	66 Å²	66	88.2 Å²	88.2	35%	0.346	49%	0.489	S	S	.	.	H	α-helix	trans	-67.4	-42.7	177.8	-72.1	169.1	0	0	0	112.2	Q141 E142 S147 Q148 I149	Q141-L145 WeakPolarHBondContact O-CG 3.21Å; Q141-L145 PolarHBondContact O-N 2.62Å; E142-L145 PolarHBondContact O-N 2.75Å; L145-S147 VanDerWaalsContact C-N 3.27Å; L145-S147 PolarHBondContact O-N 3.13Å; L145-Q148 PolarHBondContact O-N 3.34Å; L145-I149 VanDerWaalsContact O-CG1 3.32Å; L145-I149 WeakPolarHBondContact O-CG1 3.37Å; L145-I149 PolarHBondContact O-N 2.83Å
146	L	67.4	Low	58.7	Low	98 Å²	98	87.9 Å²	87.9	51%	0.513	50%	0.497	S	S	.	.	H	α-helix	trans	-61.8	-35.8	176.3	-74.8	170.2	0	0	0	112.3	E142 S150	E142-L146 HydrophobicContact CG-CD1 4.19Å; E142-L146 WeakPolarHBondContact O-CG 3.07Å; E142-L146 PolarHBondContact O-N 3.43Å; L146-S150 WeakPolarHBondContact O-CB 3.5Å; L146-S150 PolarHBondContact O-N 2.93Å; L146-S150 PolarHBondContact O-OG 2.98Å
147	S	64.3	Low	58.4	Low	81 Å²	81	89.1 Å²	89.1	57%	0.566	50%	0.504	S	S	*	.	H	α-helix	trans	-65.6	-45.4	173.7	-176.2	0	0	0	0	111.9	A143 G144 L145 S150 F151	A143-S147 WeakPolarHBondContact O-CB 3.38Å; A143-S147 PolarHBondContact O-N 2.98Å; A143-S147 VanDerWaalsContact O-N 3.08Å; G144-S147 PolarHBondContact O-N 3.29Å; L145-S147 VanDerWaalsContact C-N 3.27Å; L145-S147 PolarHBondContact O-N 3.13Å; S147-S150 PolarHBondContact O-N 3.41Å; S147-F151 WeakPolarHBondContact O-CB 3.33Å; S147-F151 PolarHBondContact O-N 3.28Å
148	Q	66.4	Low	58.4	Low	121 Å²	121	91.5 Å²	91.5	57%	0.565	52%	0.517	S	S	*	.	H	α-helix	trans	-63.7	-41.8	176.5	-71.9	177	1.3	0	0	112.5	G144 L145 S150 F151 L152	G144-Q148 WeakPolarHBondContact O-CG 3.27Å; G144-Q148 PolarHBondContact O-N 3.1Å; G144-Q148 VanDerWaalsContact O-N 3.11Å; L145-Q148 PolarHBondContact O-N 3.34Å; Q148-S150 VanDerWaalsContact C-N 3.32Å; Q148-S150 PolarHBondContact O-N 3.03Å; Q148-F151 WeakPolarHBondContact O-CB 3.16Å; Q148-F151 PolarHBondContact O-N 3.02Å; Q148-L152 WeakPolarHBondContact O-CG 3.41Å; Q148-L152 PolarHBondContact O-N 3.4Å
149	I	65.8	Low	57.9	Low	82 Å²	82	96.6 Å²	96.6	42%	0.421	53%	0.534	S	S	.	.	H	α-helix	trans	-62.2	-41.6	174.5	-68.8	165.4	0	0	0	110.7	L145 L152 K153	L145-I149 VanDerWaalsContact O-CG1 3.32Å; L145-I149 WeakPolarHBondContact O-CG1 3.37Å; L145-I149 PolarHBondContact O-N 2.83Å; I149-L152 PolarHBondContact O-N 3.34Å; I149-K153 WeakPolarHBondContact O-CG 3.39Å; I149-K153 PolarHBondContact O-N 2.81Å
150	S	66.9	Low	57.2	Low	78 Å²	78	103.5 Å²	103.5	55%	0.545	56%	0.557	S	S	.	*	H	α-helix	trans	-65.6	-39.1	177.4	-60.6	0	0	0	0	111.9	L146 S147 Q148 K153 G154	L146-S150 WeakPolarHBondContact O-CB 3.5Å; L146-S150 PolarHBondContact O-N 2.93Å; L146-S150 PolarHBondContact O-OG 2.98Å; S147-S150 PolarHBondContact O-N 3.41Å; Q148-S150 VanDerWaalsContact C-N 3.32Å; Q148-S150 PolarHBondContact O-N 3.03Å; S150-K153 PolarHBondContact O-N 2.93Å; S150-G154 PolarHBondContact O-N 3.47Å
151	F	62	Low	56.5	Low	143 Å²	143	106.5 Å²	106.5	63%	0.627	57%	0.567	S	S	*	*	H	α-helix	trans	-62.4	-46.4	173.4	178	-101.2	0	0	0	112	S147 Q148 K153 G154 I155	S147-F151 WeakPolarHBondContact O-CB 3.33Å; S147-F151 PolarHBondContact O-N 3.28Å; Q148-F151 WeakPolarHBondContact O-CB 3.16Å; Q148-F151 PolarHBondContact O-N 3.02Å; F151-K153 VanDerWaalsContact C-N 3.35Å; F151-K153 PolarHBondContact O-N 3.47Å; F151-G154 WeakPolarHBondContact O-CA 3.48Å; F151-G154 PolarHBondContact O-N 2.98Å; F151-G154 VanDerWaalsContact O-N 3.09Å; F151-I155 HydrophobicContact CD1-CD1 3.9Å; F151-I155 HydrophobicContact CE1-CD1 3.36Å; F151-I155 HydrophobicContact CE1-CG1 4.38Å; F151-I155 HydrophobicContact CE2-CD1 4.5Å; F151-I155 HydrophobicContact CZ-CD1 3.71Å; F151-I155 HydrophobicContact CZ-CG1 4.44Å; F151-I155 PolarHBondContact O-N 2.77Å; F151-I155 VanDerWaalsContact O-N 3.09Å
152	L	56.4	Low	56	Low	94 Å²	94	107.2 Å²	107.2	49%	0.492	57%	0.574	S	S	.	*	H	α-helix	trans	-62.1	-40.4	176.5	-73.3	168.5	0	0	0	112.2	Q148 I149 G154 I155 S156	Q148-L152 WeakPolarHBondContact O-CG 3.41Å; Q148-L152 PolarHBondContact O-N 3.4Å; I149-L152 PolarHBondContact O-N 3.34Å; L152-G154 VanDerWaalsContact C-N 3.31Å; L152-G154 PolarHBondContact O-N 2.79Å; L152-I155 PolarHBondContact O-N 3.42Å; L152-S156 PolarHBondContact O-N 2.99Å; L152-S156 VanDerWaalsContact O-N 3.14Å
153	K	62.8	Low	55.2	Low	143 Å²	143	106 Å²	106	62%	0.622	58%	0.579	S	S	*	*	H	α-helix	trans	-61.2	-40	172.2	-78.8	-176.8	177.1	-179.6	0	111.9	I149 S150 F151 I155 S156 T157	I149-K153 WeakPolarHBondContact O-CG 3.39Å; I149-K153 PolarHBondContact O-N 2.81Å; S150-K153 PolarHBondContact O-N 2.93Å; F151-K153 VanDerWaalsContact C-N 3.35Å; F151-K153 PolarHBondContact O-N 3.47Å; K153-I155 PolarHBondContact O-N 2.73Å; K153-S156 PolarHBondContact O-N 3.18Å; K153-S156 PolarHBondContact O-OG 3.42Å; K153-T157 PolarHBondContact O-N 3.03Å; K153-T157 PolarHBondContact O-OG1 3.24Å
154	G	52.2	Low	54.6	Low	35 Å²	35	108.6 Å²	108.6	36%	0.361	59%	0.594	S	S	.	*	H	α-helix	trans	-61.2	-38.9	175.7	0	0	0	0	0	113.8	S150 F151 L152 T157	S150-G154 PolarHBondContact O-N 3.47Å; F151-G154 WeakPolarHBondContact O-CA 3.48Å; F151-G154 PolarHBondContact O-N 2.98Å; F151-G154 VanDerWaalsContact O-N 3.09Å; L152-G154 VanDerWaalsContact C-N 3.31Å; L152-G154 PolarHBondContact O-N 2.79Å; G154-T157 PolarHBondContact O-N 3.45Å; G154-T157 PolarHBondContact O-OG1 2.88Å
155	I	54.3	Low	53.8	Low	88 Å²	88	114 Å²	114	45%	0.451	62%	0.615	S	S	.	*	H	α-helix	trans	-68.3	-39.8	176.3	-65.2	170.2	0	0	0	111.3	F151 L152 K153 T157 T158	F151-I155 HydrophobicContact CD1-CD1 3.9Å; F151-I155 HydrophobicContact CE1-CD1 3.36Å; F151-I155 HydrophobicContact CE1-CG1 4.38Å; F151-I155 HydrophobicContact CE2-CD1 4.5Å; F151-I155 HydrophobicContact CZ-CD1 3.71Å; F151-I155 HydrophobicContact CZ-CG1 4.44Å; F151-I155 PolarHBondContact O-N 2.77Å; F151-I155 VanDerWaalsContact O-N 3.09Å; L152-I155 PolarHBondContact O-N 3.42Å; K153-I155 PolarHBondContact O-N 2.73Å; I155-T157 PolarHBondContact O-N 2.91Å; I155-T158 PolarHBondContact O-N 3.25Å; I155-T158 PolarHBondContact O-OG1 2.98Å; I155-T158 VanDerWaalsContact O-OG1 3.14Å
156	S	49	Very low	53.6	Low	88 Å²	88	115.6 Å²	115.6	62%	0.615	62%	0.622	S	S	*	*	H	α-helix	trans	-63.6	-23.4	179.4	68.9	0	0	0	0	113.4	L152 K153	L152-S156 PolarHBondContact O-N 2.99Å; L152-S156 VanDerWaalsContact O-N 3.14Å; K153-S156 PolarHBondContact O-N 3.18Å; K153-S156 PolarHBondContact O-OG 3.42Å
157	T	47.5	Very low	53.4	Low	114 Å²	114	114.9 Å²	114.9	70%	0.699	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	-9.7	175.4	42.1	0	0	0	0	114.6	K153 G154 I155	K153-T157 PolarHBondContact O-N 3.03Å; K153-T157 PolarHBondContact O-OG1 3.24Å; G154-T157 PolarHBondContact O-N 3.45Å; G154-T157 PolarHBondContact O-OG1 2.88Å; I155-T157 PolarHBondContact O-N 2.91Å
158	T	51.2	Low	53.7	Low	105 Å²	105	118.5 Å²	118.5	64%	0.644	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.9	35.1	-178.3	52.6	0	0	0	0	113.2	I155 E160	I155-T158 PolarHBondContact O-N 3.25Å; I155-T158 PolarHBondContact O-OG1 2.98Å; I155-T158 VanDerWaalsContact O-OG1 3.14Å; T158-E160 PolarHBondContact O-N 3.49Å
159	R	40.5	Very low	54.1	Low	179 Å²	179	119.2 Å²	119.2	68%	0.675	63%	0.634	S	S	*	*			trans	-93.5	89.6	166.1	-128.4	178.2	-165.7	-173.6	6.2	109.2	E177	R159-E177 IonicContact NH2-OE2 3.12Å; R159-E177 PolarHBondContact NH2-OE2 2.78Å
160	E	40	Very low	54.3	Low	180 Å²	180	119.7 Å²	119.7	84%	0.841	63%	0.631	S	S	*	*			trans	-59.4	160.2	169.1	-73.8	176.2	154.2	0	0	112.1	T158	T158-E160 PolarHBondContact O-N 3.49Å
161	E	42	Very low	54.6	Low	197 Å²	197	120.7 Å²	120.7	92%	0.921	63%	0.629	S	S	*	*			trans	-48	131.6	-170.1	-65.9	170	155.4	0	0	114.7	S163	E161-S163 PolarHBondContact O-N 3.32Å; E161-S163 VanDerWaalsContact O-N 3.15Å
162	I	41	Very low	55.3	Low	144 Å²	144	120.9 Å²	120.9	74%	0.738	63%	0.626	S	S	*	*			trans	-70.1	107	-179.8	-61.4	164	0	0	0	109
163	S	40.6	Very low	56.4	Low	97 Å²	97	122.7 Å²	122.7	68%	0.678	63%	0.632	S	S	*	*			trans	-65	137.4	167.3	171.2	0	0	0	0	110.8	E161 D165	E161-S163 PolarHBondContact O-N 3.32Å; E161-S163 VanDerWaalsContact O-N 3.15Å; S163-D165 PolarHBondContact O-N 3.36Å
164	S	53.4	Low	57.1	Low	115 Å²	115	118.5 Å²	118.5	80%	0.804	62%	0.616	S	S	*	*	S	Bend	trans	-86.5	17.1	-168.7	51.5	0	0	0	0	116.3
165	D	48	Very low	58.4	Low	147 Å²	147	123.2 Å²	123.2	79%	0.786	63%	0.629	S	S	*	*			trans	-103.2	75	169.5	-93.6	-23.3	0	0	0	110.2	S163 T167	S163-D165 PolarHBondContact O-N 3.36Å; D165-T167 PolarHBondContact O-N 3.44Å; D165-T167 VanDerWaalsContact O-N 3.14Å
166	I	53.2	Low	59.7	Low	98 Å²	98	123.7 Å²	123.7	50%	0.503	64%	0.636	S	S	.	*			trans	-76.2	98.5	174.3	-62.2	168.1	0	0	0	107.9	Y170 L171	I166-Y170 HydrophobicContact CG1-CD1 4.47Å; I166-Y170 HydrophobicContact CG2-CD1 4.06Å; I166-L171 HydrophobicContact CG2-CD1 4.24Å; I166-L171 HydrophobicContact CG2-CD2 4.02Å; I166-L171 HydrophobicContact CG2-CG 3.75Å
167	T	64.2	Low	61.3	Low	84 Å²	84	124.6 Å²	124.6	52%	0.515	63%	0.63	S	S	.	*			trans	-74.6	151.7	167.9	47.4	0	0	0	0	110.3	D165 E169 Y170 L171	D165-T167 PolarHBondContact O-N 3.44Å; D165-T167 VanDerWaalsContact O-N 3.14Å; T167-E169 PolarHBondContact O-N 3.42Å; T167-Y170 WeakPolarHBondContact O-CA 3.5Å; T167-Y170 WeakPolarHBondContact O-CB 3.46Å; T167-Y170 PolarHBondContact O-N 3.41Å; T167-L171 PolarHBondContact O-N 3.41Å
168	E	70.4	Confident	62.8	Low	156 Å²	156	122.6 Å²	122.6	73%	0.729	62%	0.62	S	S	*	*	H	α-helix	trans	-54.9	-25.6	172.9	-170.9	176.6	-173.4	0	0	112.2	L171 R172	E168-L171 PolarHBondContact O-N 3.18Å; E168-R172 PolarHBondContact O-N 3.14Å
169	E	75.1	Confident	64.3	Low	136 Å²	136	121.8 Å²	121.8	64%	0.636	62%	0.615	S	S	*	*	H	α-helix	trans	-67.6	-42.1	172.8	-145.6	150.5	-146.5	0	0	112.3	T167 L171 R172 E173	T167-E169 PolarHBondContact O-N 3.42Å; E169-L171 VanDerWaalsContact C-N 3.33Å; E169-L171 PolarHBondContact O-N 2.94Å; E169-R172 PolarHBondContact O-N 2.85Å; E169-E173 WeakPolarHBondContact O-CB 3.25Å; E169-E173 PolarHBondContact O-N 3.29Å
170	Y	70.8	Confident	66.4	Low	93 Å²	93	119.2 Å²	119.2	37%	0.365	61%	0.609	S	S	.	*	H	α-helix	trans	-63.2	-38	172.3	-175	-97.9	0	0	0	112.1	I166 T167 E173 L174	I166-Y170 HydrophobicContact CG1-CD1 4.47Å; I166-Y170 HydrophobicContact CG2-CD1 4.06Å; T167-Y170 WeakPolarHBondContact O-CA 3.5Å; T167-Y170 WeakPolarHBondContact O-CB 3.46Å; T167-Y170 PolarHBondContact O-N 3.41Å; Y170-E173 PolarHBondContact O-N 3.08Å; Y170-L174 VanDerWaalsContact O-CB 3.29Å; Y170-L174 WeakPolarHBondContact O-CB 3.4Å; Y170-L174 PolarHBondContact O-N 3.28Å
171	L	71.5	Confident	68.5	Low	98 Å²	98	116.1 Å²	116.1	51%	0.513	60%	0.597	S	S	.	*	H	α-helix	trans	-64.5	-41.1	174.6	-73	173.2	0	0	0	112.1	I166 T167 E168 E169 L174 E175	I166-L171 HydrophobicContact CG2-CD1 4.24Å; I166-L171 HydrophobicContact CG2-CD2 4.02Å; I166-L171 HydrophobicContact CG2-CG 3.75Å; T167-L171 PolarHBondContact O-N 3.41Å; E168-L171 PolarHBondContact O-N 3.18Å; E169-L171 VanDerWaalsContact C-N 3.33Å; E169-L171 PolarHBondContact O-N 2.94Å; L171-L174 PolarHBondContact O-N 3.01Å; L171-E175 WeakPolarHBondContact O-CB 3.43Å; L171-E175 PolarHBondContact O-N 3.48Å
172	R	76.5	Confident	70.3	Confident	148 Å²	148	109.5 Å²	109.5	56%	0.558	58%	0.576	S	S	*	*	H	α-helix	trans	-65.6	-40.3	173.7	-85.5	-168	-73.3	168.5	-0.7	112.4	E168 E169 L174 E175 V176	E168-R172 PolarHBondContact O-N 3.14Å; E169-R172 PolarHBondContact O-N 2.85Å; R172-L174 VanDerWaalsContact C-N 3.34Å; R172-E175 PolarHBondContact O-N 2.77Å; R172-V176 WeakPolarHBondContact O-CG2 3.33Å; R172-V176 PolarHBondContact O-N 3.03Å
173	E	81.2	Confident	72.3	Confident	131 Å²	131	105.7 Å²	105.7	61%	0.612	56%	0.562	S	S	*	*	H	α-helix	trans	-65.3	-40.5	177.2	-157.5	168.9	-150.5	0	0	111.1	E169 Y170 E175 V176 E177	E169-E173 WeakPolarHBondContact O-CB 3.25Å; E169-E173 PolarHBondContact O-N 3.29Å; Y170-E173 PolarHBondContact O-N 3.08Å; E173-E175 PolarHBondContact O-N 3.33Å; E173-V176 PolarHBondContact O-N 2.88Å; E173-E177 PolarHBondContact O-N 2.83Å
174	L	77	Confident	74.4	Confident	56 Å²	56	105.1 Å²	105.1	29%	0.293	55%	0.549	S	S	.	.	H	α-helix	trans	-64.1	-38.1	172.7	-166.5	73.9	0	0	0	112	Y170 L171 R172 E177 C178	Y170-L174 VanDerWaalsContact O-CB 3.29Å; Y170-L174 WeakPolarHBondContact O-CB 3.4Å; Y170-L174 PolarHBondContact O-N 3.28Å; L171-L174 PolarHBondContact O-N 3.01Å; R172-L174 VanDerWaalsContact C-N 3.34Å; L174-E177 PolarHBondContact O-N 2.96Å; L174-C178 WeakPolarHBondContact O-CB 3.44Å; L174-C178 PolarHBondContact O-N 3.48Å; L174-C178 PolarHBondContact O-SG 3.48Å
175	E	78.6	Confident	75.7	Confident	134 Å²	134	105.5 Å²	105.5	63%	0.626	54%	0.541	S	S	*	.	H	α-helix	trans	-64.4	-40	174.7	-167.1	175.8	-168.8	0	0	111.6	L171 R172 E173 C178 T179	L171-E175 WeakPolarHBondContact O-CB 3.43Å; L171-E175 PolarHBondContact O-N 3.48Å; R172-E175 PolarHBondContact O-N 2.77Å; E173-E175 PolarHBondContact O-N 3.33Å; E175-C178 PolarHBondContact O-N 2.89Å; E175-T179 WeakPolarHBondContact O-CG2 3.31Å; E175-T179 PolarHBondContact O-N 3.12Å; E175-T179 PolarHBondContact O-OG1 3.35Å; E175-T179 VanDerWaalsContact O-OG1 3.1Å
176	V	82.7	Confident	77.4	Confident	98 Å²	98	101.1 Å²	101.1	59%	0.594	53%	0.526	S	S	*	.	H	α-helix	trans	-65.2	-42.3	172.4	174.6	0	0	0	0	111.4	R172 E173 T179 K180	R172-V176 WeakPolarHBondContact O-CG2 3.33Å; R172-V176 PolarHBondContact O-N 3.03Å; E173-V176 PolarHBondContact O-N 2.88Å; V176-T179 WeakPolarHBondContact CA-OG1 3.29Å; V176-T179 PolarHBondContact O-N 2.99Å; V176-T179 PolarHBondContact O-OG1 3.09Å; V176-K180 WeakPolarHBondContact O-CB 3.4Å; V176-K180 PolarHBondContact O-N 3.26Å
177	E	81.7	Confident	78.9	Confident	106 Å²	106	100.2 Å²	100.2	50%	0.495	53%	0.525	S	S	.	.	H	α-helix	trans	-63	-42	173.3	-76.2	-154.6	146.6	0	0	111.9	R159 E173 L174 T179 K180 L181	R159-E177 IonicContact NH2-OE2 3.12Å; R159-E177 PolarHBondContact NH2-OE2 2.78Å; E173-E177 PolarHBondContact O-N 2.83Å; L174-E177 PolarHBondContact O-N 2.96Å; E177-T179 PolarHBondContact O-N 2.64Å; E177-K180 PolarHBondContact O-N 3.12Å; E177-L181 WeakPolarHBondContact O-CB 3.29Å; E177-L181 PolarHBondContact O-N 2.79Å
178	C	80	Confident	79.8	Confident	73 Å²	73	100.8 Å²	100.8	49%	0.493	52%	0.524	S	S	.	.	H	α-helix	trans	-63.9	-40.7	177.9	-76.8	0	0	0	0	111.8	L174 E175 A182	L174-C178 WeakPolarHBondContact O-CB 3.44Å; L174-C178 PolarHBondContact O-N 3.48Å; L174-C178 PolarHBondContact O-SG 3.48Å; E175-C178 PolarHBondContact O-N 2.89Å; C178-A182 VanDerWaalsContact O-CB 3.3Å; C178-A182 WeakPolarHBondContact O-CB 3.2Å; C178-A182 PolarHBondContact O-N 3.49Å
179	T	81.3	Confident	80.5	Confident	87 Å²	87	98 Å²	98	53%	0.534	51%	0.514	S	S	.	.	H	α-helix	trans	-69.1	-37.1	175.2	52.9	0	0	0	0	112.1	E175 V176 E177 A182 S183	E175-T179 WeakPolarHBondContact O-CG2 3.31Å; E175-T179 PolarHBondContact O-N 3.12Å; E175-T179 PolarHBondContact O-OG1 3.35Å; E175-T179 VanDerWaalsContact O-OG1 3.1Å; V176-T179 WeakPolarHBondContact CA-OG1 3.29Å; V176-T179 PolarHBondContact O-N 2.99Å; V176-T179 PolarHBondContact O-OG1 3.09Å; E177-T179 PolarHBondContact O-N 2.64Å; T179-A182 PolarHBondContact O-N 2.79Å; T179-S183 PolarHBondContact O-N 3.46Å
180	K	86.2	Confident	81	Confident	126 Å²	126	98 Å²	98	55%	0.548	51%	0.514	S	S	.	.	H	α-helix	trans	-62.7	-49.8	172.1	-172.3	-175.7	176.8	-164	0	111.1	V176 E177 A182 S183 E184	V176-K180 WeakPolarHBondContact O-CB 3.4Å; V176-K180 PolarHBondContact O-N 3.26Å; E177-K180 PolarHBondContact O-N 3.12Å; K180-A182 VanDerWaalsContact C-N 3.28Å; K180-A182 PolarHBondContact O-N 3.43Å; K180-S183 PolarHBondContact O-N 3.25Å; K180-S183 PolarHBondContact O-OG 2.64Å; K180-E184 VanDerWaalsContact CE-OE1 3.22Å; K180-E184 WeakPolarHBondContact CE-OE1 3.42Å; K180-E184 IonicContact NZ-OE1 2.62Å; K180-E184 PolarHBondContact O-N 3.44Å
181	L	83.3	Confident	81.6	Confident	114 Å²	114	98.5 Å²	98.5	60%	0.597	52%	0.523	S	S	*	.	H	α-helix	trans	-59.8	-39.5	176.9	-164.9	80.5	0	0	0	111.2	E177 S183 E184 L185	E177-L181 WeakPolarHBondContact O-CB 3.29Å; E177-L181 PolarHBondContact O-N 2.79Å; L181-S183 VanDerWaalsContact C-N 3.32Å; L181-S183 PolarHBondContact O-N 2.8Å; L181-E184 PolarHBondContact O-N 3.14Å; L181-L185 VanDerWaalsContact O-CB 3.3Å; L181-L185 WeakPolarHBondContact O-CB 3.19Å; L181-L185 PolarHBondContact O-N 2.76Å
182	A	80.2	Confident	82.2	Confident	59 Å²	59	99 Å²	99	49%	0.488	52%	0.522	S	S	.	.	H	α-helix	trans	-62.9	-37.7	174.7	0	0	0	0	0	112.3	C178 T179 K180 A186	C178-A182 VanDerWaalsContact O-CB 3.3Å; C178-A182 WeakPolarHBondContact O-CB 3.2Å; C178-A182 PolarHBondContact O-N 3.49Å; T179-A182 PolarHBondContact O-N 2.79Å; K180-A182 VanDerWaalsContact C-N 3.28Å; K180-A182 PolarHBondContact O-N 3.43Å; A182-A186 WeakPolarHBondContact O-CB 3.38Å; A182-A186 PolarHBondContact O-N 3.31Å
183	S	82	Confident	82.6	Confident	63 Å²	63	95.4 Å²	95.4	44%	0.441	52%	0.517	S	S	.	.	H	α-helix	trans	-72.6	-38.2	175.4	69	0	0	0	0	113.1	T179 K180 L181 L185 A186 T187	T179-S183 PolarHBondContact O-N 3.46Å; K180-S183 PolarHBondContact O-N 3.25Å; K180-S183 PolarHBondContact O-OG 2.64Å; L181-S183 VanDerWaalsContact C-N 3.32Å; L181-S183 PolarHBondContact O-N 2.8Å; S183-L185 VanDerWaalsContact C-N 3.34Å; S183-A186 WeakPolarHBondContact O-CB 3.36Å; S183-A186 PolarHBondContact O-N 2.77Å; S183-T187 WeakPolarHBondContact O-CG2 3.33Å; S183-T187 PolarHBondContact O-N 3.48Å; S183-T187 PolarHBondContact O-OG1 2.76Å
184	E	85	Confident	82.8	Confident	85 Å²	85	92.6 Å²	92.6	40%	0.397	51%	0.509	S	S	.	.	H	α-helix	trans	-64.6	-37.8	171.5	-72	177.3	-172.3	0	0	111.8	K180 L181 A186 T187 L188	K180-E184 VanDerWaalsContact CE-OE1 3.22Å; K180-E184 WeakPolarHBondContact CE-OE1 3.42Å; K180-E184 IonicContact NZ-OE1 2.62Å; K180-E184 PolarHBondContact O-N 3.44Å; L181-E184 PolarHBondContact O-N 3.14Å; E184-A186 VanDerWaalsContact C-N 3.33Å; E184-T187 WeakPolarHBondContact CA-OG1 3.34Å; E184-T187 PolarHBondContact O-N 2.93Å; E184-T187 PolarHBondContact O-OG1 2.88Å; E184-L188 VanDerWaalsContact O-CB 3.32Å; E184-L188 WeakPolarHBondContact O-CB 3.5Å; E184-L188 PolarHBondContact O-N 2.87Å
185	L	81.6	Confident	83.2	Confident	123 Å²	123	95.2 Å²	95.2	64%	0.644	52%	0.519	S	S	*	.	H	α-helix	trans	-65.5	-38.6	173.5	-162	83.3	0	0	0	111	L181 S183 L188 N189	L181-L185 VanDerWaalsContact O-CB 3.3Å; L181-L185 WeakPolarHBondContact O-CB 3.19Å; L181-L185 PolarHBondContact O-N 2.76Å; S183-L185 VanDerWaalsContact C-N 3.34Å; L185-L188 PolarHBondContact O-N 3.44Å; L185-N189 WeakPolarHBondContact O-CB 3.49Å; L185-N189 PolarHBondContact O-N 2.91Å
186	A	82.8	Confident	83.3	Confident	56 Å²	56	92.4 Å²	92.4	46%	0.463	51%	0.512	S	S	.	.	H	α-helix	trans	-66.1	-41	176.2	0	0	0	0	0	112.3	A182 S183 E184 N189 Q190	A182-A186 WeakPolarHBondContact O-CB 3.38Å; A182-A186 PolarHBondContact O-N 3.31Å; S183-A186 WeakPolarHBondContact O-CB 3.36Å; S183-A186 PolarHBondContact O-N 2.77Å; E184-A186 VanDerWaalsContact C-N 3.33Å; A186-N189 PolarHBondContact O-N 3.45Å; A186-Q190 PolarHBondContact O-N 2.84Å
187	T	85	Confident	83.4	Confident	79 Å²	79	93 Å²	93	49%	0.485	51%	0.508	S	S	.	.	H	α-helix	trans	-68.5	-38.7	175.6	58	0	0	0	0	111.8	S183 E184 Q190 L191	S183-T187 WeakPolarHBondContact O-CG2 3.33Å; S183-T187 PolarHBondContact O-N 3.48Å; S183-T187 PolarHBondContact O-OG1 2.76Å; E184-T187 WeakPolarHBondContact CA-OG1 3.34Å; E184-T187 PolarHBondContact O-N 2.93Å; E184-T187 PolarHBondContact O-OG1 2.88Å; T187-Q190 PolarHBondContact O-N 3.06Å; T187-L191 WeakPolarHBondContact O-CG 3.31Å; T187-L191 PolarHBondContact O-N 2.81Å
188	L	83.6	Confident	83.6	Confident	95 Å²	95	89.4 Å²	89.4	50%	0.497	50%	0.495	S	S	.	.	H	α-helix	trans	-63.4	-41.9	174.9	-168.3	139.5	0	0	0	111.5	E184 L185 Q190 L191 E192	E184-L188 VanDerWaalsContact O-CB 3.32Å; E184-L188 WeakPolarHBondContact O-CB 3.5Å; E184-L188 PolarHBondContact O-N 2.87Å; L185-L188 PolarHBondContact O-N 3.44Å; L188-Q190 VanDerWaalsContact C-N 3.31Å; L188-Q190 PolarHBondContact O-N 2.83Å; L188-L191 PolarHBondContact O-N 2.65Å; L188-E192 PolarHBondContact O-N 3.15Å
189	N	84	Confident	83.7	Confident	98 Å²	98	94.7 Å²	94.7	52%	0.524	50%	0.504	S	S	.	.	H	α-helix	trans	-61.9	-38.9	173.7	-166.2	27.2	0	0	0	111.6	L185 A186 E192 V193	L185-N189 WeakPolarHBondContact O-CB 3.49Å; L185-N189 PolarHBondContact O-N 2.91Å; A186-N189 PolarHBondContact O-N 3.45Å; N189-E192 PolarHBondContact O-N 3.4Å; N189-V193 WeakPolarHBondContact O-CG2 3.37Å; N189-V193 PolarHBondContact O-N 3.4Å
190	Q	85.8	Confident	83.9	Confident	135 Å²	135	95.3 Å²	95.3	63%	0.631	50%	0.504	S	S	*	.	H	α-helix	trans	-68.4	-36.4	175.5	-170.3	170.3	5.8	0	0	113	A186 T187 L188 V193 T194	A186-Q190 PolarHBondContact O-N 2.84Å; T187-Q190 PolarHBondContact O-N 3.06Å; L188-Q190 VanDerWaalsContact C-N 3.31Å; L188-Q190 PolarHBondContact O-N 2.83Å; Q190-V193 PolarHBondContact O-N 2.98Å; Q190-T194 PolarHBondContact O-N 3.2Å; Q190-T194 PolarHBondContact O-OG1 3.32Å
191	L	84.5	Confident	83.9	Confident	104 Å²	104	96 Å²	96	55%	0.545	51%	0.507	S	S	.	.	H	α-helix	trans	-66.7	-40.9	173.5	-75.4	171.3	0	0	0	111.6	T187 L188 V193 T194 Q195	T187-L191 WeakPolarHBondContact O-CG 3.31Å; T187-L191 PolarHBondContact O-N 2.81Å; L188-L191 PolarHBondContact O-N 2.65Å; L191-V193 PolarHBondContact O-N 3.03Å; L191-T194 CarbonylContact O-C 3.58Å; L191-T194 WeakPolarHBondContact O-CB 3.23Å; L191-T194 PolarHBondContact O-N 3.29Å; L191-T194 VanDerWaalsContact O-N 3.14Å; L191-Q195 WeakPolarHBondContact O-CB 3.47Å; L191-Q195 PolarHBondContact O-N 2.87Å
192	E	82.2	Confident	83.9	Confident	108 Å²	108	93.8 Å²	93.8	51%	0.505	50%	0.496	S	S	.	.	H	α-helix	trans	-59.9	-45.5	174.6	-172.5	175	-174.6	0	0	111	L188 N189 T194 Q195 V196	L188-E192 PolarHBondContact O-N 3.15Å; N189-E192 PolarHBondContact O-N 3.4Å; E192-T194 VanDerWaalsContact C-N 3.31Å; E192-T194 PolarHBondContact O-N 3.06Å; E192-Q195 PolarHBondContact O-N 3.37Å; E192-V196 WeakPolarHBondContact O-CG2 3.35Å; E192-V196 PolarHBondContact O-N 3.13Å
193	V	85.4	Confident	84.1	Confident	74 Å²	74	93.9 Å²	93.9	45%	0.448	49%	0.49	S	S	.	.	H	α-helix	trans	-58.2	-43.1	173.1	171.7	0	0	0	0	111.4	N189 Q190 L191 V196 Q197	N189-V193 WeakPolarHBondContact O-CG2 3.37Å; N189-V193 PolarHBondContact O-N 3.4Å; Q190-V193 PolarHBondContact O-N 2.98Å; L191-V193 PolarHBondContact O-N 3.03Å; V193-V196 PolarHBondContact O-N 2.96Å; V193-Q197 WeakPolarHBondContact O-CG 3.33Å; V193-Q197 PolarHBondContact O-N 3.43Å
194	T	85.6	Confident	84	Confident	71 Å²	71	96 Å²	96	44%	0.436	49%	0.493	S	S	.	.	H	α-helix	trans	-67.2	-37.1	179.2	-52.7	0	0	0	0	111.8	Q190 L191 E192 Q197 S198	Q190-T194 PolarHBondContact O-N 3.2Å; Q190-T194 PolarHBondContact O-OG1 3.32Å; L191-T194 CarbonylContact O-C 3.58Å; L191-T194 WeakPolarHBondContact O-CB 3.23Å; L191-T194 PolarHBondContact O-N 3.29Å; L191-T194 VanDerWaalsContact O-N 3.14Å; E192-T194 VanDerWaalsContact C-N 3.31Å; E192-T194 PolarHBondContact O-N 3.06Å; T194-Q197 PolarHBondContact O-N 2.99Å; T194-S198 PolarHBondContact O-N 3.02Å; T194-S198 PolarHBondContact O-OG 3.33Å
195	Q	85.1	Confident	84	Confident	111 Å²	111	98 Å²	98	52%	0.519	50%	0.501	S	S	.	.	H	α-helix	trans	-67.3	-40.9	175.2	-173.6	-177.5	7.7	0	0	111.6	L191 E192 Q197 S198 R199	L191-Q195 WeakPolarHBondContact O-CB 3.47Å; L191-Q195 PolarHBondContact O-N 2.87Å; E192-Q195 PolarHBondContact O-N 3.37Å; Q195-Q197 VanDerWaalsContact C-N 3.32Å; Q195-Q197 PolarHBondContact O-N 2.95Å; Q195-S198 WeakPolarHBondContact CA-OG 3.4Å; Q195-S198 PolarHBondContact O-N 3.38Å; Q195-S198 PolarHBondContact O-OG 2.93Å; Q195-R199 WeakPolarHBondContact O-CB 3.29Å; Q195-R199 PolarHBondContact O-N 3.02Å
196	V	82.2	Confident	84	Confident	76 Å²	76	97.7 Å²	97.7	46%	0.461	50%	0.495	S	S	.	.	H	α-helix	trans	-62.7	-41.8	173.5	172.3	0	0	0	0	110.3	E192 V193 R199 N200	E192-V196 WeakPolarHBondContact O-CG2 3.35Å; E192-V196 PolarHBondContact O-N 3.13Å; V193-V196 PolarHBondContact O-N 2.96Å; V196-R199 PolarHBondContact O-N 3.13Å; V196-N200 WeakPolarHBondContact O-CB 3.22Å; V196-N200 PolarHBondContact O-N 2.98Å; V196-N200 PolarHBondContact O-ND2 3.22Å
197	Q	84.9	Confident	83.9	Confident	109 Å²	109	99.8 Å²	99.8	51%	0.509	50%	0.499	S	S	.	.	H	α-helix	trans	-63	-42.1	175.2	-73.1	177.1	2.2	0	0	112.9	V193 T194 Q195 N200 K201	V193-Q197 WeakPolarHBondContact O-CG 3.33Å; V193-Q197 PolarHBondContact O-N 3.43Å; T194-Q197 PolarHBondContact O-N 2.99Å; Q195-Q197 VanDerWaalsContact C-N 3.32Å; Q195-Q197 PolarHBondContact O-N 2.95Å; Q197-N200 PolarHBondContact O-N 3.33Å; Q197-K201 WeakPolarHBondContact O-CG 3.44Å; Q197-K201 PolarHBondContact O-N 3.15Å
198	S	83.9	Confident	83.5	Confident	32 Å²	32	100.3 Å²	100.3	22%	0.224	50%	0.496	C	S	.	.	H	α-helix	trans	-69.7	-38.3	179.1	69.1	0	0	0	0	112	T194 Q195 K201 L202	T194-S198 PolarHBondContact O-N 3.02Å; T194-S198 PolarHBondContact O-OG 3.33Å; Q195-S198 WeakPolarHBondContact CA-OG 3.4Å; Q195-S198 PolarHBondContact O-N 3.38Å; Q195-S198 PolarHBondContact O-OG 2.93Å; S198-K201 PolarHBondContact O-N 3.32Å; S198-L202 PolarHBondContact O-N 2.88Å
199	R	83.2	Confident	83.1	Confident	183 Å²	183	99.8 Å²	99.8	69%	0.691	49%	0.493	S	S	*	.	H	α-helix	trans	-61.8	-42.7	171.5	-172.7	177.1	176.1	103	-0.4	111.6	Q195 V196 K201 L202 V203	Q195-R199 WeakPolarHBondContact O-CB 3.29Å; Q195-R199 PolarHBondContact O-N 3.02Å; V196-R199 PolarHBondContact O-N 3.13Å; R199-K201 PolarHBondContact O-N 3Å; R199-L202 PolarHBondContact O-N 3.41Å; R199-V203 WeakPolarHBondContact O-CG2 3.49Å; R199-V203 PolarHBondContact O-N 3.48Å
200	N	85.2	Confident	82.8	Confident	101 Å²	101	101.5 Å²	101.5	54%	0.54	50%	0.496	S	S	.	.	H	α-helix	trans	-61.3	-43.6	175.3	-72.5	-15	0	0	0	111.7	V196 Q197 L202 V203 E204	V196-N200 WeakPolarHBondContact O-CB 3.22Å; V196-N200 PolarHBondContact O-N 2.98Å; V196-N200 PolarHBondContact O-ND2 3.22Å; Q197-N200 PolarHBondContact O-N 3.33Å; N200-L202 PolarHBondContact O-N 2.99Å; N200-V203 PolarHBondContact O-N 2.87Å; N200-E204 PolarHBondContact O-N 2.75Å
201	K	87.3	Confident	82.1	Confident	140 Å²	140	101 Å²	101	61%	0.609	49%	0.494	S	S	*	.	H	α-helix	trans	-63	-38.8	174.4	-72.9	179.5	-178.2	179.6	0	112.8	Q197 S198 R199 E204 K205	Q197-K201 WeakPolarHBondContact O-CG 3.44Å; Q197-K201 PolarHBondContact O-N 3.15Å; S198-K201 PolarHBondContact O-N 3.32Å; R199-K201 PolarHBondContact O-N 3Å; K201-E204 WeakPolarHBondContact O-CB 3.29Å; K201-E204 PolarHBondContact O-N 3.4Å; K201-K205 WeakPolarHBondContact O-CG 3.49Å; K201-K205 PolarHBondContact O-N 2.73Å
202	L	82.4	Confident	81.2	Confident	68 Å²	68	101.6 Å²	101.6	36%	0.356	50%	0.495	S	S	.	.	H	α-helix	trans	-63.7	-44.7	176.6	-179.1	66.6	0	0	0	111.3	S198 R199 N200 E204 K205 Q206	S198-L202 PolarHBondContact O-N 2.88Å; R199-L202 PolarHBondContact O-N 3.41Å; N200-L202 PolarHBondContact O-N 2.99Å; L202-E204 VanDerWaalsContact C-N 3.31Å; L202-E204 PolarHBondContact O-N 3.32Å; L202-K205 PolarHBondContact O-N 2.93Å; L202-Q206 WeakPolarHBondContact O-CG 3.34Å; L202-Q206 PolarHBondContact O-N 3.49Å
203	V	84.7	Confident	80.9	Confident	61 Å²	61	100.1 Å²	100.1	37%	0.37	49%	0.49	S	S	.	.	H	α-helix	trans	-61.2	-42	175.5	171.8	0	0	0	0	110.6	R199 N200 K205 Q206 N207	R199-V203 WeakPolarHBondContact O-CG2 3.49Å; R199-V203 PolarHBondContact O-N 3.48Å; N200-V203 PolarHBondContact O-N 2.87Å; V203-K205 PolarHBondContact O-N 2.85Å; V203-Q206 PolarHBondContact O-N 3.23Å; V203-N207 VanDerWaalsContact O-CG 3.26Å; V203-N207 PolarHBondContact O-N 3.26Å; V203-N207 PolarHBondContact O-ND2 3.41Å
204	E	80.5	Confident	80.1	Confident	107 Å²	107	100.7 Å²	100.7	50%	0.5	49%	0.491	S	S	.	.	H	α-helix	trans	-59.5	-44.7	174.3	-169.4	-173.8	172.6	0	0	112	N200 K201 L202 N207 Q208	N200-E204 PolarHBondContact O-N 2.75Å; K201-E204 WeakPolarHBondContact O-CB 3.29Å; K201-E204 PolarHBondContact O-N 3.4Å; L202-E204 VanDerWaalsContact C-N 3.31Å; L202-E204 PolarHBondContact O-N 3.32Å; E204-N207 PolarHBondContact O-N 3.49Å; E204-Q208 WeakPolarHBondContact O-CG 3.45Å; E204-Q208 PolarHBondContact O-N 3.45Å
205	K	83.6	Confident	78.8	Confident	128 Å²	128	100 Å²	100	56%	0.557	49%	0.487	S	S	*	.	H	α-helix	trans	-66.8	-36.9	176.3	-68.8	-57.9	178.6	-173.8	0	113.4	K201 L202 V203 N207 Q208 L209	K201-K205 WeakPolarHBondContact O-CG 3.49Å; K201-K205 PolarHBondContact O-N 2.73Å; L202-K205 PolarHBondContact O-N 2.93Å; V203-K205 PolarHBondContact O-N 2.85Å; K205-N207 VanDerWaalsContact C-N 3.33Å; K205-Q208 VanDerWaalsContact CD-OE1 3.25Å; K205-Q208 PolarHBondContact O-N 2.86Å; K205-L209 PolarHBondContact O-N 2.79Å
206	Q	81.8	Confident	77.4	Confident	115 Å²	115	100 Å²	100	54%	0.537	49%	0.487	S	S	.	.	H	α-helix	trans	-64.3	-39.7	172.9	-75.5	178.1	-18.1	0	0	111.7	L202 V203 L209 K210	L202-Q206 WeakPolarHBondContact O-CG 3.34Å; L202-Q206 PolarHBondContact O-N 3.49Å; V203-Q206 PolarHBondContact O-N 3.23Å; Q206-L209 PolarHBondContact O-N 2.9Å; Q206-K210 WeakPolarHBondContact O-CB 3.42Å; Q206-K210 PolarHBondContact O-N 3.24Å
207	N	80.7	Confident	76.5	Confident	101 Å²	101	99.8 Å²	99.8	54%	0.54	48%	0.48	S	S	.	.	H	α-helix	trans	-64.9	-41.4	174.6	-70.7	-21.7	0	0	0	111.8	V203 E204 K205 K210 H211	V203-N207 VanDerWaalsContact O-CG 3.26Å; V203-N207 PolarHBondContact O-N 3.26Å; V203-N207 PolarHBondContact O-ND2 3.41Å; E204-N207 PolarHBondContact O-N 3.49Å; K205-N207 VanDerWaalsContact C-N 3.33Å; N207-K210 PolarHBondContact O-N 3.24Å; N207-H211 PolarHBondContact O-N 3.14Å
208	Q	77.3	Confident	75.2	Confident	89 Å²	89	99.4 Å²	99.4	42%	0.416	48%	0.481	S	S	.	.	H	α-helix	trans	-61.1	-43.3	174	-73.4	175	0.5	0	0	111.9	E204 K205 H211 M212	E204-Q208 WeakPolarHBondContact O-CG 3.45Å; E204-Q208 PolarHBondContact O-N 3.45Å; K205-Q208 VanDerWaalsContact CD-OE1 3.25Å; K205-Q208 PolarHBondContact O-N 2.86Å; Q208-H211 PolarHBondContact O-N 2.77Å; Q208-M212 PolarHBondContact O-N 3.45Å
209	L	75.2	Confident	73.7	Confident	84 Å²	84	102 Å²	102	44%	0.44	49%	0.492	S	S	.	.	H	α-helix	trans	-66.5	-39.9	178.3	-166.4	116.2	0	0	0	112.2	K205 Q206 H211 M212 N213	K205-L209 PolarHBondContact O-N 2.79Å; Q206-L209 PolarHBondContact O-N 2.9Å; L209-H211 VanDerWaalsContact C-N 3.34Å; L209-M212 PolarHBondContact O-N 3.04Å; L209-N213 PolarHBondContact O-N 2.79Å
210	K	78.4	Confident	72.6	Confident	135 Å²	135	100.5 Å²	100.5	59%	0.587	49%	0.486	S	S	*	.	H	α-helix	trans	-59.6	-46.7	173.5	-174.9	-178.7	175.6	-174.1	0	111	Q206 N207 M212 N213 D214	Q206-K210 WeakPolarHBondContact O-CB 3.42Å; Q206-K210 PolarHBondContact O-N 3.24Å; N207-K210 PolarHBondContact O-N 3.24Å; K210-M212 VanDerWaalsContact C-N 3.3Å; K210-M212 PolarHBondContact O-N 2.83Å; K210-N213 PolarHBondContact O-N 3.42Å; K210-D214 VanDerWaalsContact O-CG 3.28Å; K210-D214 PolarHBondContact O-N 3.29Å
211	H	69.6	Low	71.3	Confident	125 Å²	125	98.9 Å²	98.9	58%	0.579	48%	0.475	S	S	*	.	H	α-helix	trans	-59.6	-40.5	176.1	-172	-28.5	0	0	0	111.8	N207 Q208 L209 D214 V215	N207-H211 PolarHBondContact O-N 3.14Å; Q208-H211 PolarHBondContact O-N 2.77Å; L209-H211 VanDerWaalsContact C-N 3.34Å; H211-D214 PolarHBondContact O-N 2.94Å; H211-V215 WeakPolarHBondContact ND1-CG2 3.12Å; H211-V215 WeakPolarHBondContact O-CG2 3.32Å; H211-V215 PolarHBondContact O-N 2.97Å
212	M	67	Low	69.7	Low	116 Å²	116	97.1 Å²	97.1	57%	0.571	47%	0.469	S	S	*	.	H	α-helix	trans	-63.7	-41.7	178	-170.1	180	73.2	0	0	112.2	Q208 L209 K210 D214 V215 E216	Q208-M212 PolarHBondContact O-N 3.45Å; L209-M212 PolarHBondContact O-N 3.04Å; K210-M212 VanDerWaalsContact C-N 3.3Å; K210-M212 PolarHBondContact O-N 2.83Å; M212-D214 VanDerWaalsContact C-N 3.34Å; M212-V215 PolarHBondContact O-N 3.06Å; M212-E216 PolarHBondContact O-N 3.43Å
213	N	74.5	Confident	68.4	Low	76 Å²	76	97.9 Å²	97.9	41%	0.406	47%	0.474	S	S	.	.	H	α-helix	trans	-65	-37.9	175	-69.8	-8.1	0	0	0	112	L209 K210 V215 E216 E217	L209-N213 PolarHBondContact O-N 2.79Å; K210-N213 PolarHBondContact O-N 3.42Å; N213-V215 VanDerWaalsContact C-N 3.3Å; N213-V215 PolarHBondContact O-N 2.86Å; N213-E216 PolarHBondContact O-N 3.18Å; N213-E217 PolarHBondContact O-N 3.38Å
214	D	68.4	Low	67	Low	87 Å²	87	98.1 Å²	98.1	47%	0.465	48%	0.478	S	S	.	.	H	α-helix	trans	-63.3	-39	174.8	-65	-25.7	0	0	0	110.7	K210 H211 M212 I218	K210-D214 VanDerWaalsContact O-CG 3.28Å; K210-D214 PolarHBondContact O-N 3.29Å; H211-D214 PolarHBondContact O-N 2.94Å; M212-D214 VanDerWaalsContact C-N 3.34Å; D214-I218 WeakPolarHBondContact O-CD1 3.35Å; D214-I218 VanDerWaalsContact O-CG1 3.27Å; D214-I218 WeakPolarHBondContact O-CG1 3.38Å; D214-I218 PolarHBondContact O-N 3.21Å
215	V	59.3	Low	65.6	Low	57 Å²	57	97.5 Å²	97.5	35%	0.345	47%	0.471	S	S	.	.	H	α-helix	trans	-66.9	-40.9	174.4	172.1	0	0	0	0	111.8	H211 M212 N213 E217 I218 L219	H211-V215 WeakPolarHBondContact ND1-CG2 3.12Å; H211-V215 WeakPolarHBondContact O-CG2 3.32Å; H211-V215 PolarHBondContact O-N 2.97Å; M212-V215 PolarHBondContact O-N 3.06Å; N213-V215 VanDerWaalsContact C-N 3.3Å; N213-V215 PolarHBondContact O-N 2.86Å; V215-E217 VanDerWaalsContact C-N 3.35Å; V215-E217 PolarHBondContact O-N 3.39Å; V215-I218 WeakPolarHBondContact O-CB 3.48Å; V215-I218 PolarHBondContact O-N 2.91Å; V215-L219 HydrophobicContact CG1-CD1 4.04Å; V215-L219 HydrophobicContact CG1-CG 4.32Å; V215-L219 WeakPolarHBondContact O-CG 3.21Å; V215-L219 PolarHBondContact O-N 3.27Å
216	E	56	Low	64.1	Low	111 Å²	111	95.7 Å²	95.7	52%	0.519	47%	0.467	S	S	.	.	H	α-helix	trans	-58.9	-45.5	175.6	-173.4	-167.3	160	0	0	111.6	M212 N213 I218 L219 R220	M212-E216 PolarHBondContact O-N 3.43Å; N213-E216 PolarHBondContact O-N 3.18Å; E216-I218 VanDerWaalsContact C-N 3.3Å; E216-I218 PolarHBondContact O-N 2.9Å; E216-L219 PolarHBondContact O-N 2.95Å; E216-R220 WeakPolarHBondContact O-CB 3.31Å; E216-R220 PolarHBondContact O-N 3.23Å
217	E	62.1	Low	62.7	Low	70 Å²	70	99 Å²	99	33%	0.327	48%	0.475	S	S	.	.	H	α-helix	trans	-60.8	-41.2	177	-176.6	60.2	-142.3	0	0	111.4	N213 V215 R220 Q221	N213-E217 PolarHBondContact O-N 3.38Å; V215-E217 VanDerWaalsContact C-N 3.35Å; V215-E217 PolarHBondContact O-N 3.39Å; E217-R220 PolarHBondContact O-N 3.19Å; E217-R220 IonicContact OE1-CZ 2.74Å; E217-R220 IonicContact OE1-NE 3.33Å; E217-R220 IonicContact OE1-NH2 2.62Å; E217-R220 PolarHBondContact OE1-NH2 3.01Å; E217-R220 IonicContact OE2-CZ 3.81Å; E217-R220 IonicContact OE2-NE 3.54Å; E217-R220 IonicContact OE2-NH1 3.61Å; E217-R220 IonicContact OE2-NH2 3.02Å; E217-R220 PolarHBondContact OE2-NH2 3.46Å; E217-Q221 WeakPolarHBondContact O-CG 3.5Å; E217-Q221 PolarHBondContact O-N 2.91Å; E217-Q221 PolarHBondContact OE1-NE2 3.33Å; E217-Q221 VanDerWaalsContact OE1-NE2 3.1Å
218	I	59	Low	61.1	Low	102 Å²	102	97 Å²	97	52%	0.523	47%	0.468	S	S	.	.	H	α-helix	trans	-62.6	-49.4	175.8	-67.7	164.3	0	0	0	110.7	D214 V215 E216 R220 Q221 E222	D214-I218 WeakPolarHBondContact O-CD1 3.35Å; D214-I218 VanDerWaalsContact O-CG1 3.27Å; D214-I218 WeakPolarHBondContact O-CG1 3.38Å; D214-I218 PolarHBondContact O-N 3.21Å; V215-I218 WeakPolarHBondContact O-CB 3.48Å; V215-I218 PolarHBondContact O-N 2.91Å; E216-I218 VanDerWaalsContact C-N 3.3Å; E216-I218 PolarHBondContact O-N 2.9Å; I218-R220 VanDerWaalsContact C-N 3.28Å; I218-R220 PolarHBondContact O-N 2.96Å; I218-Q221 WeakPolarHBondContact O-CB 3.35Å; I218-Q221 PolarHBondContact O-N 3.3Å; I218-Q221 VanDerWaalsContact O-N 3.13Å; I218-E222 PolarHBondContact O-N 3.25Å
219	L	51.7	Low	59.6	Low	87 Å²	87	96.1 Å²	96.1	46%	0.455	47%	0.466	S	S	.	.	H	α-helix	trans	-62.6	-34.7	179.9	-72.1	174.1	0	0	0	112.3	V215 E216 N223	V215-L219 HydrophobicContact CG1-CD1 4.04Å; V215-L219 HydrophobicContact CG1-CG 4.32Å; V215-L219 WeakPolarHBondContact O-CG 3.21Å; V215-L219 PolarHBondContact O-N 3.27Å; E216-L219 PolarHBondContact O-N 2.95Å; L219-N223 WeakPolarHBondContact O-CB 3.25Å; L219-N223 PolarHBondContact O-N 3.38Å; L219-N223 PolarHBondContact O-ND2 3.11Å
220	R	59.5	Low	58.6	Low	151 Å²	151	95.7 Å²	95.7	57%	0.57	47%	0.467	S	S	*	.	H	α-helix	trans	-66.8	-42.5	174.4	-168.7	179.6	72.5	-165	1.6	111.4	E216 E217 I218 S224	E216-R220 WeakPolarHBondContact O-CB 3.31Å; E216-R220 PolarHBondContact O-N 3.23Å; E217-R220 PolarHBondContact O-N 3.19Å; E217-R220 IonicContact OE1-CZ 2.74Å; E217-R220 IonicContact OE1-NE 3.33Å; E217-R220 IonicContact OE1-NH2 2.62Å; E217-R220 PolarHBondContact OE1-NH2 3.01Å; E217-R220 IonicContact OE2-CZ 3.81Å; E217-R220 IonicContact OE2-NE 3.54Å; E217-R220 IonicContact OE2-NH1 3.61Å; E217-R220 IonicContact OE2-NH2 3.02Å; E217-R220 PolarHBondContact OE2-NH2 3.46Å; I218-R220 VanDerWaalsContact C-N 3.28Å; I218-R220 PolarHBondContact O-N 2.96Å; R220-S224 PolarHBondContact O-N 3.44Å; R220-S224 VanDerWaalsContact O-N 3.12Å
221	Q	58	Low	57.2	Low	66 Å²	66	92.5 Å²	92.5	31%	0.308	46%	0.461	S	S	.	.	H	α-helix	trans	-64.7	-44.7	175.2	-71.6	177.5	17.5	0	0	111	E217 I218 N223 S224 W225	E217-Q221 WeakPolarHBondContact O-CG 3.5Å; E217-Q221 PolarHBondContact O-N 2.91Å; E217-Q221 PolarHBondContact OE1-NE2 3.33Å; E217-Q221 VanDerWaalsContact OE1-NE2 3.1Å; I218-Q221 WeakPolarHBondContact O-CB 3.35Å; I218-Q221 PolarHBondContact O-N 3.3Å; I218-Q221 VanDerWaalsContact O-N 3.13Å; Q221-N223 PolarHBondContact O-N 3.31Å; Q221-S224 WeakPolarHBondContact O-CB 3.34Å; Q221-S224 PolarHBondContact O-N 2.88Å; Q221-S224 VanDerWaalsContact O-N 3.09Å; Q221-S224 PolarHBondContact O-OG 2.74Å; Q221-W225 PolarHBondContact O-N 2.88Å
222	E	53.8	Low	56.2	Low	104 Å²	104	89.9 Å²	89.9	49%	0.486	45%	0.451	S	S	.	.	H	α-helix	trans	-59.1	-44.6	177	-172	171.7	-172.4	0	0	111.9	I218 S224 W225 L226	I218-E222 PolarHBondContact O-N 3.25Å; E222-S224 VanDerWaalsContact C-N 3.3Å; E222-S224 PolarHBondContact O-N 3.11Å; E222-W225 WeakPolarHBondContact O-CB 3.05Å; E222-W225 PolarHBondContact O-N 2.93Å; E222-W225 VanDerWaalsContact O-N 3.12Å; E222-L226 WeakPolarHBondContact O-CG 3.32Å; E222-L226 PolarHBondContact O-N 3.32Å
223	N	55.5	Low	55.5	Low	84 Å²	84	88.9 Å²	88.9	45%	0.449	45%	0.447	S	S	.	.	H	α-helix	trans	-59.7	-37.9	173.5	-89	-66.8	0	0	0	113.2	L219 Q221 W225 L226 R227	L219-N223 WeakPolarHBondContact O-CB 3.25Å; L219-N223 PolarHBondContact O-N 3.38Å; L219-N223 PolarHBondContact O-ND2 3.11Å; Q221-N223 PolarHBondContact O-N 3.31Å; N223-W225 VanDerWaalsContact C-N 3.35Å; N223-L226 PolarHBondContact O-N 3.41Å; N223-R227 PolarHBondContact O-N 3.15Å; N223-R227 VanDerWaalsContact O-N 3.14Å
224	S	55	Low	54.5	Low	65 Å²	65	89.3 Å²	89.3	46%	0.455	45%	0.449	S	S	.	.	H	α-helix	trans	-67	-36.9	175.5	75.9	0	0	0	0	112.4	R220 Q221 E222 C228	R220-S224 PolarHBondContact O-N 3.44Å; R220-S224 VanDerWaalsContact O-N 3.12Å; Q221-S224 WeakPolarHBondContact O-CB 3.34Å; Q221-S224 PolarHBondContact O-N 2.88Å; Q221-S224 VanDerWaalsContact O-N 3.09Å; Q221-S224 PolarHBondContact O-OG 2.74Å; E222-S224 VanDerWaalsContact C-N 3.3Å; E222-S224 PolarHBondContact O-N 3.11Å; S224-C228 PolarHBondContact O-N 3.49Å; S224-C228 VanDerWaalsContact O-N 3.14Å
225	W	51.4	Low	53.7	Low	94 Å²	94	90.7 Å²	90.7	36%	0.356	46%	0.456	S	S	.	.	H	α-helix	trans	-66.4	-43.7	174.4	-79.3	110.4	0	0	0	112.1	Q221 E222 N223 R227 C228 L229 L362	Q221-W225 PolarHBondContact O-N 2.88Å; E222-W225 WeakPolarHBondContact O-CB 3.05Å; E222-W225 PolarHBondContact O-N 2.93Å; E222-W225 VanDerWaalsContact O-N 3.12Å; N223-W225 VanDerWaalsContact C-N 3.35Å; W225-R227 PolarHBondContact O-N 3.3Å; W225-C228 PolarHBondContact O-N 3.03Å; W225-L229 WeakPolarHBondContact O-CB 3.48Å; W225-L229 PolarHBondContact O-N 3.5Å; W225-L362 HydrophobicContact CZ2-CD1 4.22Å; W225-L362 HydrophobicContact CZ2-CD2 4.08Å
226	L	51.4	Low	53.2	Low	91 Å²	91	91.7 Å²	91.7	48%	0.476	46%	0.457	S	S	.	.	H	α-helix	trans	-59.1	-46.4	176.9	-72.6	173	0	0	0	111.3	E222 N223 C228 L229 T230	E222-L226 WeakPolarHBondContact O-CG 3.32Å; E222-L226 PolarHBondContact O-N 3.32Å; N223-L226 PolarHBondContact O-N 3.41Å; L226-C228 PolarHBondContact O-N 3.33Å; L226-L229 PolarHBondContact O-N 3.4Å; L226-T230 PolarHBondContact O-N 3.39Å; L226-T230 PolarHBondContact O-OG1 3.3Å; L226-T230 VanDerWaalsContact O-OG1 3.04Å
227	R	52.3	Low	53.1	Low	184 Å²	184	92 Å²	92	69%	0.694	46%	0.458	S	S	*	.	H	α-helix	trans	-60.1	-42.9	175.5	-72.8	-178.2	-175.2	144.6	2.8	112.8	N223 W225 T230 S231	N223-R227 PolarHBondContact O-N 3.15Å; N223-R227 VanDerWaalsContact O-N 3.14Å; W225-R227 PolarHBondContact O-N 3.3Å; R227-T230 PolarHBondContact O-N 2.87Å; R227-S231 PolarHBondContact O-N 3.19Å; R227-S231 PolarHBondContact O-OG 3.42Å
228	C	48.5	Very low	52.8	Low	60 Å²	60	93.3 Å²	93.3	41%	0.405	47%	0.467	S	S	.	.	H	α-helix	trans	-63.7	-42.5	177.6	-178.2	0	0	0	0	111.8	S224 W225 L226 S231 I232	S224-C228 PolarHBondContact O-N 3.49Å; S224-C228 VanDerWaalsContact O-N 3.14Å; W225-C228 PolarHBondContact O-N 3.03Å; L226-C228 PolarHBondContact O-N 3.33Å; C228-S231 PolarHBondContact O-N 2.82Å; C228-I232 WeakPolarHBondContact O-CG1 3.31Å; C228-I232 PolarHBondContact O-N 3.16Å
229	L	45.6	Very low	52.5	Low	69 Å²	69	92.1 Å²	92.1	36%	0.361	47%	0.468	S	S	.	.	H	α-helix	trans	-60.6	-45.8	174.9	-83.1	157.1	0	0	0	111.6	W225 L226 S231 I232 I233	W225-L229 WeakPolarHBondContact O-CB 3.48Å; W225-L229 PolarHBondContact O-N 3.5Å; L226-L229 PolarHBondContact O-N 3.4Å; L229-S231 PolarHBondContact O-N 3.48Å; L229-I232 PolarHBondContact O-N 3.01Å; L229-I233 WeakPolarHBondContact O-CG1 3.24Å; L229-I233 PolarHBondContact O-N 3.41Å
230	T	53.2	Low	52.3	Low	76 Å²	76	91.3 Å²	91.3	47%	0.466	47%	0.469	S	S	.	.	H	α-helix	trans	-57.2	-47.8	175.7	-55.4	0	0	0	0	111.2	L226 R227 I232 I233 D234	L226-T230 PolarHBondContact O-N 3.39Å; L226-T230 PolarHBondContact O-OG1 3.3Å; L226-T230 VanDerWaalsContact O-OG1 3.04Å; R227-T230 PolarHBondContact O-N 2.87Å; T230-I232 VanDerWaalsContact C-N 3.32Å; T230-I232 PolarHBondContact O-N 3.39Å; T230-I233 PolarHBondContact O-N 3.3Å; T230-D234 VanDerWaalsContact O-CG 3.29Å; T230-D234 PolarHBondContact O-N 2.82Å
231	S	49.1	Very low	52.3	Low	67 Å²	67	89.3 Å²	89.3	47%	0.469	46%	0.464	S	S	.	.	H	α-helix	trans	-63.3	-34.3	178.5	-58.5	0	0	0	0	113.9	R227 C228 L229 L235	R227-S231 PolarHBondContact O-N 3.19Å; R227-S231 PolarHBondContact O-OG 3.42Å; C228-S231 PolarHBondContact O-N 2.82Å; L229-S231 PolarHBondContact O-N 3.48Å; S231-L235 VanDerWaalsContact O-CG 3.32Å; S231-L235 WeakPolarHBondContact O-CG 3.28Å; S231-L235 PolarHBondContact O-N 2.74Å; S231-L235 VanDerWaalsContact O-N 3.09Å
232	I	48.6	Very low	52.4	Low	71 Å²	71	91.7 Å²	91.7	36%	0.364	48%	0.476	S	S	.	.	H	α-helix	trans	-68	-44	175.1	-68.5	167.8	0	0	0	110.2	C228 L229 T230 D234 L235 E236 I355	C228-I232 WeakPolarHBondContact O-CG1 3.31Å; C228-I232 PolarHBondContact O-N 3.16Å; L229-I232 PolarHBondContact O-N 3.01Å; T230-I232 VanDerWaalsContact C-N 3.32Å; T230-I232 PolarHBondContact O-N 3.39Å; I232-D234 VanDerWaalsContact C-N 3.32Å; I232-D234 PolarHBondContact O-N 3.33Å; I232-L235 PolarHBondContact O-N 2.89Å; I232-E236 WeakPolarHBondContact O-CB 3.31Å; I232-E236 PolarHBondContact O-N 3.39Å; I232-I355 HydrophobicContact CD1-CD1 4.34Å
233	I	52.1	Low	52.3	Low	95 Å²	95	89 Å²	89	49%	0.487	47%	0.471	S	S	.	.	H	α-helix	trans	-62	-42.1	177.6	-67.7	167	0	0	0	110.3	L229 T230 L235 E236 H237	L229-I233 WeakPolarHBondContact O-CG1 3.24Å; L229-I233 PolarHBondContact O-N 3.41Å; T230-I233 PolarHBondContact O-N 3.3Å; I233-L235 PolarHBondContact O-N 2.92Å; I233-E236 PolarHBondContact O-N 2.95Å; I233-H237 VanDerWaalsContact O-CB 3.22Å; I233-H237 WeakPolarHBondContact O-CB 3.32Å; I233-H237 PolarHBondContact O-N 2.77Å
234	D	54.3	Low	52.1	Low	84 Å²	84	89.8 Å²	89.8	45%	0.449	48%	0.475	S	S	.	.	H	α-helix	trans	-63.7	-41.5	177.6	-67.7	-25.9	0	0	0	112	T230 I232 N238	T230-D234 VanDerWaalsContact O-CG 3.29Å; T230-D234 PolarHBondContact O-N 2.82Å; I232-D234 VanDerWaalsContact C-N 3.32Å; I232-D234 PolarHBondContact O-N 3.33Å; D234-N238 WeakPolarHBondContact O-CB 3.36Å; D234-N238 PolarHBondContact O-N 3.17Å; D234-N238 PolarHBondContact O-ND2 2.77Å
235	L	51.6	Low	52.5	Low	117 Å²	117	92 Å²	92	61%	0.613	48%	0.478	S	S	*	.	H	α-helix	trans	-65.5	-46.1	176.2	-75.5	169.5	0	0	0	111.6	S231 I232 I233 N238 S239	S231-L235 VanDerWaalsContact O-CG 3.32Å; S231-L235 WeakPolarHBondContact O-CG 3.28Å; S231-L235 PolarHBondContact O-N 2.74Å; S231-L235 VanDerWaalsContact O-N 3.09Å; I232-L235 PolarHBondContact O-N 2.89Å; I233-L235 PolarHBondContact O-N 2.92Å; L235-N238 PolarHBondContact O-N 3.28Å; L235-S239 WeakPolarHBondContact O-CB 3.23Å; L235-S239 PolarHBondContact O-N 3.4Å; L235-S239 PolarHBondContact O-OG 3.26Å
236	E	49.4	Very low	52.7	Low	77 Å²	77	92.1 Å²	92.1	36%	0.36	48%	0.482	S	S	.	.	H	α-helix	trans	-63.3	-44.1	177.9	-169.8	175	-175	0	0	111	L11 I232 I233 N238 S239 C240	L11-E236 WeakPolarHBondContact CD2-OE1 3.38Å; I232-E236 WeakPolarHBondContact O-CB 3.31Å; I232-E236 PolarHBondContact O-N 3.39Å; I233-E236 PolarHBondContact O-N 2.95Å; E236-N238 PolarHBondContact O-N 3.15Å; E236-S239 PolarHBondContact O-N 2.9Å; E236-C240 VanDerWaalsContact O-CB 3.28Å; E236-C240 WeakPolarHBondContact O-CB 3.4Å; E236-C240 PolarHBondContact O-N 2.89Å; E236-C240 PolarHBondContact O-SG 3.33Å; E236-C240 VanDerWaalsContact O-SG 3.36Å
237	H	52.3	Low	52.6	Low	118 Å²	118	90.3 Å²	90.3	55%	0.546	47%	0.473	S	S	.	.	H	α-helix	trans	-58.8	-46.5	175.6	-178.6	72.9	0	0	0	111.6	I233 C240 K241	I233-H237 VanDerWaalsContact O-CB 3.22Å; I233-H237 WeakPolarHBondContact O-CB 3.32Å; I233-H237 PolarHBondContact O-N 2.77Å; H237-C240 PolarHBondContact O-N 3.3Å; H237-K241 VanDerWaalsContact O-CB 3.23Å; H237-K241 WeakPolarHBondContact O-CB 3.49Å; H237-K241 PolarHBondContact O-N 3.23Å
238	N	56.2	Low	53.1	Low	97 Å²	97	85.4 Å²	85.4	52%	0.519	46%	0.459	S	S	.	.	H	α-helix	trans	-65.7	-43.2	179.2	-73.6	-36.5	0	0	0	112.3	D234 L235 E236 K241 Q242	D234-N238 WeakPolarHBondContact O-CB 3.36Å; D234-N238 PolarHBondContact O-N 3.17Å; D234-N238 PolarHBondContact O-ND2 2.77Å; L235-N238 PolarHBondContact O-N 3.28Å; E236-N238 PolarHBondContact O-N 3.15Å; N238-K241 PolarHBondContact O-N 3.24Å; N238-Q242 PolarHBondContact O-N 3.36Å
239	S	52.7	Low	53.7	Low	77 Å²	77	85 Å²	85	54%	0.538	46%	0.458	S	S	.	.	H	α-helix	trans	-65.3	-42.9	176.3	-66.1	0	0	0	0	112.3	L235 E236 Q242 A243	L235-S239 WeakPolarHBondContact O-CB 3.23Å; L235-S239 PolarHBondContact O-N 3.4Å; L235-S239 PolarHBondContact O-OG 3.26Å; E236-S239 PolarHBondContact O-N 2.9Å; S239-Q242 PolarHBondContact O-N 3.33Å; S239-A243 WeakPolarHBondContact O-CB 3.18Å; S239-A243 PolarHBondContact O-N 2.8Å
240	C	47.5	Very low	54.2	Low	70 Å²	70	85.8 Å²	85.8	47%	0.473	46%	0.461	S	S	.	.	H	α-helix	trans	-64.4	-40.2	175.6	-75.7	0	0	0	0	111.7	E236 H237 A243 L244	E236-C240 VanDerWaalsContact O-CB 3.28Å; E236-C240 WeakPolarHBondContact O-CB 3.4Å; E236-C240 PolarHBondContact O-N 2.89Å; E236-C240 PolarHBondContact O-SG 3.33Å; E236-C240 VanDerWaalsContact O-SG 3.36Å; H237-C240 PolarHBondContact O-N 3.3Å; C240-A243 PolarHBondContact O-N 3.48Å; C240-L244 VanDerWaalsContact O-CB 3.24Å; C240-L244 WeakPolarHBondContact O-CB 3.43Å; C240-L244 PolarHBondContact O-N 3.05Å
241	K	59.1	Low	54.2	Low	109 Å²	109	84.4 Å²	84.4	47%	0.474	46%	0.455	S	S	.	.	H	α-helix	trans	-61.8	-46.7	175.9	-176.4	178.1	177.1	-178.6	0	111.4	H237 N238 L244 E245	H237-K241 VanDerWaalsContact O-CB 3.23Å; H237-K241 WeakPolarHBondContact O-CB 3.49Å; H237-K241 PolarHBondContact O-N 3.23Å; N238-K241 PolarHBondContact O-N 3.24Å; K241-L244 PolarHBondContact O-N 3.19Å; K241-E245 VanDerWaalsContact CE-OE1 3.28Å; K241-E245 WeakPolarHBondContact CE-OE1 3.49Å; K241-E245 WeakPolarHBondContact O-CG 3.21Å; K241-E245 PolarHBondContact O-N 3.39Å
242	Q	60.9	Low	54.8	Low	117 Å²	117	87 Å²	87	55%	0.547	46%	0.46	S	S	.	.	H	α-helix	trans	-63.5	-44.5	177.7	-172.8	179.4	-5.9	0	0	111.9	N238 S239 L244 E245 E246	N238-Q242 PolarHBondContact O-N 3.36Å; S239-Q242 PolarHBondContact O-N 3.33Å; Q242-L244 VanDerWaalsContact C-N 3.3Å; Q242-L244 PolarHBondContact O-N 2.9Å; Q242-E245 PolarHBondContact O-N 3.34Å; Q242-E246 PolarHBondContact O-N 3.18Å
243	A	52	Low	55.1	Low	47 Å²	47	86 Å²	86	39%	0.388	46%	0.458	S	S	.	.	H	α-helix	trans	-62	-39.5	175.7	0	0	0	0	0	111.7	S239 C240 E246 L247	S239-A243 WeakPolarHBondContact O-CB 3.18Å; S239-A243 PolarHBondContact O-N 2.8Å; C240-A243 PolarHBondContact O-N 3.48Å; A243-E246 PolarHBondContact O-N 3.46Å; A243-L247 WeakPolarHBondContact O-CB 3.49Å; A243-L247 WeakPolarHBondContact O-CG 3.32Å; A243-L247 PolarHBondContact O-N 2.81Å
244	L	51.8	Low	55	Low	101 Å²	101	84.3 Å²	84.3	53%	0.529	45%	0.45	S	S	.	.	H	α-helix	trans	-64.8	-42.3	176.5	-176.2	66.1	0	0	0	111.5	C240 K241 Q242 L247 I248	C240-L244 VanDerWaalsContact O-CB 3.24Å; C240-L244 WeakPolarHBondContact O-CB 3.43Å; C240-L244 PolarHBondContact O-N 3.05Å; K241-L244 PolarHBondContact O-N 3.19Å; Q242-L244 VanDerWaalsContact C-N 3.3Å; Q242-L244 PolarHBondContact O-N 2.9Å; L244-L247 PolarHBondContact O-N 3.17Å; L244-I248 HydrophobicContact CD1-CD1 4.25Å; L244-I248 HydrophobicContact CD1-CG1 4.33Å; L244-I248 HydrophobicContact CD2-CD1 4.45Å; L244-I248 HydrophobicContact CG-CD1 3.86Å; L244-I248 HydrophobicContact CG-CG1 4.36Å; L244-I248 WeakPolarHBondContact O-CB 3.27Å; L244-I248 VanDerWaalsContact O-CG1 3.23Å; L244-I248 WeakPolarHBondContact O-CG1 3.37Å; L244-I248 PolarHBondContact O-N 2.88Å
245	E	61.9	Low	55	Low	112 Å²	112	85.2 Å²	85.2	52%	0.523	45%	0.451	S	S	.	.	H	α-helix	trans	-60.9	-44.5	175.7	-74.2	172.9	-173.1	0	0	111.6	K241 Q242 S249	K241-E245 VanDerWaalsContact CE-OE1 3.28Å; K241-E245 WeakPolarHBondContact CE-OE1 3.49Å; K241-E245 WeakPolarHBondContact O-CG 3.21Å; K241-E245 PolarHBondContact O-N 3.39Å; Q242-E245 PolarHBondContact O-N 3.34Å; E245-S249 PolarHBondContact O-N 3.42Å; E245-S249 VanDerWaalsContact O-N 3.07Å
246	E	57	Low	55.3	Low	95 Å²	95	82 Å²	82	44%	0.444	44%	0.437	S	S	.	.	H	α-helix	trans	-63.8	-41.8	174.7	-71.5	-178	-169.5	0	0	112	Q242 A243 S249 I250	Q242-E246 PolarHBondContact O-N 3.18Å; A243-E246 PolarHBondContact O-N 3.46Å; E246-S249 WeakPolarHBondContact O-CB 3.4Å; E246-S249 PolarHBondContact O-N 3.49Å; E246-I250 WeakPolarHBondContact O-CG1 3.19Å; E246-I250 PolarHBondContact O-N 2.8Å
247	L	48	Very low	55.2	Low	53 Å²	53	82.1 Å²	82.1	28%	0.277	44%	0.439	S	S	.	.	H	α-helix	trans	-68.5	-38.9	178.5	-74.4	174.6	0	0	0	112.9	Y71 A243 L244 S249 I250 S251	Y71-L247 HydrophobicContact CE2-CD2 3.89Å; Y71-L247 VanDerWaalsContact OH-CD2 3.31Å; Y71-L247 WeakPolarHBondContact OH-CD2 3.41Å; A243-L247 WeakPolarHBondContact O-CB 3.49Å; A243-L247 WeakPolarHBondContact O-CG 3.32Å; A243-L247 PolarHBondContact O-N 2.81Å; L244-L247 PolarHBondContact O-N 3.17Å; L247-S249 VanDerWaalsContact C-N 3.29Å; L247-S249 PolarHBondContact O-N 3.09Å; L247-I250 PolarHBondContact O-N 3.38Å; L247-S251 WeakPolarHBondContact O-CB 2.96Å; L247-S251 PolarHBondContact O-N 2.88Å
248	I	63.2	Low	55.2	Low	81 Å²	81	80.4 Å²	80.4	42%	0.415	43%	0.431	S	S	.	.	H	α-helix	trans	-60.8	-43.3	172.9	-72.1	167.5	0	0	0	109.3	L244 I250 S251 Q252	L244-I248 HydrophobicContact CD1-CD1 4.25Å; L244-I248 HydrophobicContact CD1-CG1 4.33Å; L244-I248 HydrophobicContact CD2-CD1 4.45Å; L244-I248 HydrophobicContact CG-CD1 3.86Å; L244-I248 HydrophobicContact CG-CG1 4.36Å; L244-I248 WeakPolarHBondContact O-CB 3.27Å; L244-I248 VanDerWaalsContact O-CG1 3.23Å; L244-I248 WeakPolarHBondContact O-CG1 3.37Å; L244-I248 PolarHBondContact O-N 2.88Å; I248-I250 PolarHBondContact O-N 3.48Å; I248-S251 PolarHBondContact O-N 3.06Å; I248-Q252 HydrophobicContact CG2-CG 4.33Å; I248-Q252 WeakPolarHBondContact O-CB 3.4Å; I248-Q252 VanDerWaalsContact O-CG 3.28Å; I248-Q252 WeakPolarHBondContact O-CG 3.38Å; I248-Q252 PolarHBondContact O-N 3.17Å
249	S	61.9	Low	55.2	Low	53 Å²	53	79.8 Å²	79.8	37%	0.371	43%	0.427	S	S	.	.	H	α-helix	trans	-61.1	-42.5	176.6	-173.6	0	0	0	0	112.5	E245 E246 L247 S253	E245-S249 PolarHBondContact O-N 3.42Å; E245-S249 VanDerWaalsContact O-N 3.07Å; E246-S249 WeakPolarHBondContact O-CB 3.4Å; E246-S249 PolarHBondContact O-N 3.49Å; L247-S249 VanDerWaalsContact C-N 3.29Å; L247-S249 PolarHBondContact O-N 3.09Å; S249-S253 WeakPolarHBondContact O-CB 3.31Å; S249-S253 PolarHBondContact O-N 3.13Å; S249-S253 VanDerWaalsContact O-N 3.09Å; S249-S253 PolarHBondContact O-OG 3.17Å
250	I	55.6	Low	55.1	Low	84 Å²	84	78.5 Å²	78.5	43%	0.431	41%	0.411	S	S	.	.	H	α-helix	trans	-65.9	-46	175.5	-67.3	166.5	0	0	0	110.7	E246 L247 I248 Q252 S253 L254	E246-I250 WeakPolarHBondContact O-CG1 3.19Å; E246-I250 PolarHBondContact O-N 2.8Å; L247-I250 PolarHBondContact O-N 3.38Å; I248-I250 PolarHBondContact O-N 3.48Å; I250-Q252 PolarHBondContact O-N 3.39Å; I250-S253 WeakPolarHBondContact O-CB 3.24Å; I250-S253 PolarHBondContact O-N 3.22Å; I250-S253 VanDerWaalsContact O-N 3.15Å; I250-L254 HydrophobicContact CG2-CD1 4.01Å; I250-L254 HydrophobicContact CG2-CG 4.39Å; I250-L254 WeakPolarHBondContact O-CG 3.46Å; I250-L254 PolarHBondContact O-N 2.62Å
251	S	52.3	Low	55.1	Low	48 Å²	48	77.2 Å²	77.2	34%	0.336	40%	0.403	S	S	.	.	H	α-helix	trans	-61.9	-42.6	179.7	-177	0	0	0	0	112	L247 I248 S253 L254 H255	L247-S251 WeakPolarHBondContact O-CB 2.96Å; L247-S251 PolarHBondContact O-N 2.88Å; I248-S251 PolarHBondContact O-N 3.06Å; S251-S253 VanDerWaalsContact C-N 3.31Å; S251-S253 PolarHBondContact O-N 3.41Å; S251-L254 PolarHBondContact O-N 3.33Å; S251-H255 PolarHBondContact O-N 2.88Å
252	Q	61.7	Low	55	Low	122 Å²	122	74.9 Å²	74.9	57%	0.57	40%	0.397	S	S	*	.	H	α-helix	trans	-61.7	-41.8	174.5	-74.8	173.3	-7.7	0	0	111.1	I248 I250 L254 H255 T256	I248-Q252 HydrophobicContact CG2-CG 4.33Å; I248-Q252 WeakPolarHBondContact O-CB 3.4Å; I248-Q252 VanDerWaalsContact O-CG 3.28Å; I248-Q252 WeakPolarHBondContact O-CG 3.38Å; I248-Q252 PolarHBondContact O-N 3.17Å; I250-Q252 PolarHBondContact O-N 3.39Å; Q252-L254 VanDerWaalsContact C-N 3.33Å; Q252-L254 PolarHBondContact O-N 3.31Å; Q252-H255 PolarHBondContact O-N 2.81Å; Q252-T256 WeakPolarHBondContact O-CB 3.39Å; Q252-T256 PolarHBondContact O-N 3.43Å; Q252-T256 PolarHBondContact O-OG1 3.08Å
253	S	55	Low	54.6	Low	48 Å²	48	73.5 Å²	73.5	34%	0.336	39%	0.391	S	S	.	.	H	α-helix	trans	-62.9	-39.4	175.9	-57	0	0	0	0	111.9	S249 I250 S251 L257	S249-S253 WeakPolarHBondContact O-CB 3.31Å; S249-S253 PolarHBondContact O-N 3.13Å; S249-S253 VanDerWaalsContact O-N 3.09Å; S249-S253 PolarHBondContact O-OG 3.17Å; I250-S253 WeakPolarHBondContact O-CB 3.24Å; I250-S253 PolarHBondContact O-N 3.22Å; I250-S253 VanDerWaalsContact O-N 3.15Å; S251-S253 VanDerWaalsContact C-N 3.31Å; S251-S253 PolarHBondContact O-N 3.41Å; S253-L257 PolarHBondContact O-N 2.94Å
254	L	50	Low	54.4	Low	61 Å²	61	74.1 Å²	74.1	32%	0.319	39%	0.387	S	S	.	.	H	α-helix	trans	-71.7	-39.5	176.6	-71.5	173.9	0	0	0	113	L64 L68 I250 S251 Q252 T256 L257 K258	L64-L254 HydrophobicContact CD2-CD2 4.48Å; L68-L254 HydrophobicContact CD2-CD1 4.5Å; I250-L254 HydrophobicContact CG2-CD1 4.01Å; I250-L254 HydrophobicContact CG2-CG 4.39Å; I250-L254 WeakPolarHBondContact O-CG 3.46Å; I250-L254 PolarHBondContact O-N 2.62Å; S251-L254 PolarHBondContact O-N 3.33Å; Q252-L254 VanDerWaalsContact C-N 3.33Å; Q252-L254 PolarHBondContact O-N 3.31Å; L254-T256 VanDerWaalsContact C-N 3.32Å; L254-L257 WeakPolarHBondContact O-CB 3.19Å; L254-L257 PolarHBondContact O-N 2.79Å; L254-K258 PolarHBondContact O-N 2.86Å
255	H	55.5	Low	54.4	Low	102 Å²	102	71.8 Å²	71.8	47%	0.472	38%	0.375	S	S	.	.	H	α-helix	trans	-63.8	-42.3	175.4	-122.5	79.9	0	0	0	111.1	S251 Q252 L257 K258 D259	S251-H255 PolarHBondContact O-N 2.88Å; Q252-H255 PolarHBondContact O-N 2.81Å; H255-L257 VanDerWaalsContact C-N 3.3Å; H255-L257 PolarHBondContact O-N 2.82Å; H255-K258 WeakPolarHBondContact O-CB 3.31Å; H255-K258 PolarHBondContact O-N 2.83Å; H255-K258 VanDerWaalsContact O-N 3.12Å; H255-D259 PolarHBondContact O-N 3.38Å
256	T	56.3	Low	54	Low	50 Å²	50	72.2 Å²	72.2	31%	0.307	38%	0.377	S	S	.	.	H	α-helix	trans	-57.4	-46.4	173.1	-54.1	0	0	0	0	110.4	Q252 L254 K258 D259 Y260	Q252-T256 WeakPolarHBondContact O-CB 3.39Å; Q252-T256 PolarHBondContact O-N 3.43Å; Q252-T256 PolarHBondContact O-OG1 3.08Å; L254-T256 VanDerWaalsContact C-N 3.32Å; T256-K258 VanDerWaalsContact C-N 3.34Å; T256-K258 PolarHBondContact O-N 3.35Å; T256-D259 PolarHBondContact O-N 3.46Å; T256-Y260 HydrophobicContact CG2-CD2 3.87Å; T256-Y260 HydrophobicContact CG2-CE2 3.46Å; T256-Y260 VanDerWaalsContact CG2-CE2 3.46Å; T256-Y260 WeakPolarHBondContact O-CD2 3.35Å; T256-Y260 PolarHBondContact O-N 3.32Å
257	L	48.7	Very low	53.7	Low	79 Å²	79	72.9 Å²	72.9	41%	0.414	38%	0.379	S	S	.	.	H	α-helix	trans	-59.9	-41.8	175.1	-168.2	80.1	0	0	0	112.3	S253 L254 H255 Y260 S261 L299	S253-L257 PolarHBondContact O-N 2.94Å; L254-L257 WeakPolarHBondContact O-CB 3.19Å; L254-L257 PolarHBondContact O-N 2.79Å; H255-L257 VanDerWaalsContact C-N 3.3Å; H255-L257 PolarHBondContact O-N 2.82Å; L257-Y260 PolarHBondContact O-N 3.49Å; L257-S261 PolarHBondContact O-N 2.82Å; L257-L299 HydrophobicContact CD1-CD1 4.02Å; L257-L299 HydrophobicContact CD1-CD2 3.94Å
258	K	51.2	Low	53.7	Low	83 Å²	83	72 Å²	72	36%	0.361	38%	0.377	S	S	.	.	H	α-helix	trans	-62.5	-51.5	178	-178.3	-172.7	173.9	-171.3	0	111.6	L254 H255 T256 Y260 S261 V262	L254-K258 PolarHBondContact O-N 2.86Å; H255-K258 WeakPolarHBondContact O-CB 3.31Å; H255-K258 PolarHBondContact O-N 2.83Å; H255-K258 VanDerWaalsContact O-N 3.12Å; T256-K258 VanDerWaalsContact C-N 3.34Å; T256-K258 PolarHBondContact O-N 3.35Å; K258-Y260 PolarHBondContact O-N 2.81Å; K258-S261 WeakPolarHBondContact CA-OG 3.18Å; K258-S261 PolarHBondContact O-N 2.76Å; K258-S261 PolarHBondContact O-OG 3.02Å; K258-V262 WeakPolarHBondContact O-CG2 3.4Å; K258-V262 PolarHBondContact O-N 3.3Å
259	D	56.8	Low	53.2	Low	84 Å²	84	70.9 Å²	70.9	45%	0.449	38%	0.376	S	S	.	.	H	α-helix	trans	-58.3	-38.3	-179	-71.2	-15.5	0	0	0	111.3	H255 T256 V262 Q263	H255-D259 PolarHBondContact O-N 3.38Å; T256-D259 PolarHBondContact O-N 3.46Å; D259-V262 PolarHBondContact O-N 2.75Å; D259-Q263 WeakPolarHBondContact O-CG 3.19Å; D259-Q263 PolarHBondContact O-N 2.84Å
260	Y	50.2	Low	52.6	Low	49 Å²	49	72 Å²	72	19%	0.192	39%	0.385	C	S	.	.	H	α-helix	trans	-70.9	-38.2	174.4	-71.9	-57.4	0	0	0	113.4	T256 L257 K258 V262 Q263 L264 T295 L299	T256-Y260 HydrophobicContact CG2-CD2 3.87Å; T256-Y260 HydrophobicContact CG2-CE2 3.46Å; T256-Y260 VanDerWaalsContact CG2-CE2 3.46Å; T256-Y260 WeakPolarHBondContact O-CD2 3.35Å; T256-Y260 PolarHBondContact O-N 3.32Å; L257-Y260 PolarHBondContact O-N 3.49Å; K258-Y260 PolarHBondContact O-N 2.81Å; Y260-V262 VanDerWaalsContact C-N 3.28Å; Y260-V262 PolarHBondContact O-N 2.72Å; Y260-Q263 PolarHBondContact O-N 3.44Å; Y260-L264 WeakPolarHBondContact O-CB 3.23Å; Y260-L264 PolarHBondContact O-N 3.39Å; Y260-T295 HydrophobicContact CD1-CG2 4.29Å; Y260-L299 HydrophobicContact CD2-CB 4.07Å; Y260-L299 HydrophobicContact CD2-CD1 3.33Å; Y260-L299 HydrophobicContact CD2-CG 3.54Å; Y260-L299 HydrophobicContact CE2-CB 4.17Å; Y260-L299 HydrophobicContact CE2-CD1 4.23Å; Y260-L299 HydrophobicContact CE2-CG 3.96Å; Y260-L299 HydrophobicContact CG-CD1 3.68Å; Y260-L299 HydrophobicContact CG-CG 4.31Å
261	S	47.8	Very low	52.2	Low	44 Å²	44	71.6 Å²	71.6	31%	0.308	38%	0.383	S	S	.	.	H	α-helix	trans	-61.3	-38.4	174.2	71.9	0	0	0	0	111.9	L257 K258 L264 L265	L257-S261 PolarHBondContact O-N 2.82Å; K258-S261 WeakPolarHBondContact CA-OG 3.18Å; K258-S261 PolarHBondContact O-N 2.76Å; K258-S261 PolarHBondContact O-OG 3.02Å; S261-L264 PolarHBondContact O-N 2.79Å; S261-L265 WeakPolarHBondContact O-CB 3.42Å; S261-L265 WeakPolarHBondContact O-CG 3.28Å; S261-L265 PolarHBondContact O-N 3.44Å
262	V	57.7	Low	51.8	Low	59 Å²	59	75.8 Å²	75.8	36%	0.358	39%	0.392	S	S	.	.	H	α-helix	trans	-66.1	-47.3	174.2	174.3	0	0	0	0	110.6	K258 D259 Y260 L264 L265 E266	K258-V262 WeakPolarHBondContact O-CG2 3.4Å; K258-V262 PolarHBondContact O-N 3.3Å; D259-V262 PolarHBondContact O-N 2.75Å; Y260-V262 VanDerWaalsContact C-N 3.28Å; Y260-V262 PolarHBondContact O-N 2.72Å; V262-L264 PolarHBondContact O-N 3.36Å; V262-L265 CarbonylContact O-C 3.59Å; V262-L265 WeakPolarHBondContact O-CB 3.4Å; V262-L265 PolarHBondContact O-N 2.83Å; V262-L265 VanDerWaalsContact O-N 3.13Å; V262-E266 HydrophobicContact CG1-CG 4.4Å; V262-E266 WeakPolarHBondContact O-CG 3.33Å; V262-E266 PolarHBondContact O-N 2.93Å
263	Q	52	Low	50.9	Low	88 Å²	88	77.9 Å²	77.9	41%	0.411	40%	0.402	S	S	.	.	H	α-helix	trans	-60.2	-35.6	175.9	-74	174.7	40.6	0	0	112.5	D259 Y260 K267	D259-Q263 WeakPolarHBondContact O-CG 3.19Å; D259-Q263 PolarHBondContact O-N 2.84Å; Y260-Q263 PolarHBondContact O-N 3.44Å; Q263-K267 WeakPolarHBondContact O-CB 3.39Å; Q263-K267 WeakPolarHBondContact O-CG 3.33Å; Q263-K267 PolarHBondContact O-N 2.99Å
264	L	48.1	Very low	50.4	Low	60 Å²	60	79 Å²	79	31%	0.314	41%	0.41	S	S	.	.	H	α-helix	trans	-68.3	-43.5	175.8	-155.8	101.9	0	0	0	111.2	Y260 S261 V262 K267 S268 F292	Y260-L264 WeakPolarHBondContact O-CB 3.23Å; Y260-L264 PolarHBondContact O-N 3.39Å; S261-L264 PolarHBondContact O-N 2.79Å; V262-L264 PolarHBondContact O-N 3.36Å; L264-K267 PolarHBondContact O-N 2.93Å; L264-S268 WeakPolarHBondContact O-CB 3.39Å; L264-S268 PolarHBondContact O-N 3.45Å; L264-S268 PolarHBondContact O-OG 3.06Å; L264-F292 HydrophobicContact CD1-CD2 3.38Å; L264-F292 HydrophobicContact CD1-CE2 3.94Å; L264-F292 HydrophobicContact CD1-CG 4.33Å; L264-F292 HydrophobicContact CD2-CD2 3.58Å; L264-F292 HydrophobicContact CD2-CE2 3.61Å; L264-F292 HydrophobicContact CG-CD2 4.05Å; L264-F292 HydrophobicContact CG-CE2 4.39Å
265	L	51.5	Low	50.2	Low	52 Å²	52	84.2 Å²	84.2	27%	0.272	44%	0.438	S	S	.	.	H	α-helix	trans	-62.8	-45.8	175.7	-80.8	164.4	0	0	0	111.5	M61 S261 V262 K267 S268 S269	M61-L265 HydrophobicContact CE-CD1 3.68Å; M61-L265 HydrophobicContact SD-CD1 3.8Å; S261-L265 WeakPolarHBondContact O-CB 3.42Å; S261-L265 WeakPolarHBondContact O-CG 3.28Å; S261-L265 PolarHBondContact O-N 3.44Å; V262-L265 CarbonylContact O-C 3.59Å; V262-L265 WeakPolarHBondContact O-CB 3.4Å; V262-L265 PolarHBondContact O-N 2.83Å; V262-L265 VanDerWaalsContact O-N 3.13Å; L265-K267 VanDerWaalsContact C-N 3.35Å; L265-K267 PolarHBondContact O-N 3.48Å; L265-S268 WeakPolarHBondContact CA-OG 3.46Å; L265-S268 CarbonylContact O-C 3.56Å; L265-S268 PolarHBondContact O-N 3.35Å; L265-S268 VanDerWaalsContact O-N 3.1Å; L265-S268 PolarHBondContact O-OG 2.69Å; L265-S269 WeakPolarHBondContact O-CB 3.36Å; L265-S269 PolarHBondContact O-N 3.4Å; L265-S269 PolarHBondContact O-OG 2.98Å; L265-S269 VanDerWaalsContact O-OG 3.14Å
266	E	54.2	Low	49.5	Very low	121 Å²	121	81.9 Å²	81.9	57%	0.565	44%	0.442	S	S	*	.	H	α-helix	trans	-59.6	-43.4	175.3	-75.8	-177.5	168.6	0	0	112.1	V262 S268 S269 S270	V262-E266 HydrophobicContact CG1-CG 4.4Å; V262-E266 WeakPolarHBondContact O-CG 3.33Å; V262-E266 PolarHBondContact O-N 2.93Å; E266-S268 VanDerWaalsContact C-N 3.31Å; E266-S268 PolarHBondContact O-N 3.44Å; E266-S269 WeakPolarHBondContact CA-OG 3.34Å; E266-S269 PolarHBondContact O-N 2.92Å; E266-S269 PolarHBondContact O-OG 3.06Å; E266-S270 PolarHBondContact O-N 3.18Å; E266-S270 PolarHBondContact O-OG 3.35Å
267	K	50.4	Low	48.6	Very low	110 Å²	110	84.9 Å²	84.9	48%	0.478	46%	0.462	S	S	.	.	H	α-helix	trans	-66.7	-34.4	174.4	-75.1	-179	-179.4	-179.8	0	112	Q263 L264 L265 S270 H291	Q263-K267 WeakPolarHBondContact O-CB 3.39Å; Q263-K267 WeakPolarHBondContact O-CG 3.33Å; Q263-K267 PolarHBondContact O-N 2.99Å; L264-K267 PolarHBondContact O-N 2.93Å; L265-K267 VanDerWaalsContact C-N 3.35Å; L265-K267 PolarHBondContact O-N 3.48Å; K267-S270 PolarHBondContact O-OG 2.85Å; K267-H291 PolarHBondContact NZ-NE2 2.82Å
268	S	48.1	Very low	48.2	Very low	35 Å²	35	87.7 Å²	87.7	25%	0.245	48%	0.476	C	S	.	.	H	α-helix	trans	-73.3	-36.9	175.4	76.4	0	0	0	0	112.9	L264 L265 E266 L271 Y272	L264-S268 WeakPolarHBondContact O-CB 3.39Å; L264-S268 PolarHBondContact O-N 3.45Å; L264-S268 PolarHBondContact O-OG 3.06Å; L265-S268 WeakPolarHBondContact CA-OG 3.46Å; L265-S268 CarbonylContact O-C 3.56Å; L265-S268 PolarHBondContact O-N 3.35Å; L265-S268 VanDerWaalsContact O-N 3.1Å; L265-S268 PolarHBondContact O-OG 2.69Å; E266-S268 VanDerWaalsContact C-N 3.31Å; E266-S268 PolarHBondContact O-N 3.44Å; S268-L271 VanDerWaalsContact O-CB 3.28Å; S268-L271 WeakPolarHBondContact O-CB 3.31Å; S268-L271 PolarHBondContact O-N 3.26Å; S268-L271 VanDerWaalsContact O-N 3.14Å; S268-Y272 WeakPolarHBondContact O-CD2 3.48Å
269	S	51.4	Low	48.1	Very low	56 Å²	56	91.7 Å²	91.7	39%	0.392	50%	0.496	S	S	.	.	H	α-helix	trans	-74.5	-31.7	-178.7	62	0	0	0	0	112.3	L265 E266 L271 Y272 Q273	L265-S269 WeakPolarHBondContact O-CB 3.36Å; L265-S269 PolarHBondContact O-N 3.4Å; L265-S269 PolarHBondContact O-OG 2.98Å; L265-S269 VanDerWaalsContact O-OG 3.14Å; E266-S269 WeakPolarHBondContact CA-OG 3.34Å; E266-S269 PolarHBondContact O-N 2.92Å; E266-S269 PolarHBondContact O-OG 3.06Å; S269-L271 PolarHBondContact O-N 3.26Å; S269-Y272 PolarHBondContact O-N 3.34Å; S269-Q273 PolarHBondContact O-N 3.33Å
270	S	50	Low	47.5	Very low	78 Å²	78	92.4 Å²	92.4	55%	0.545	51%	0.507	S	S	.	.	H	α-helix	trans	-61.3	-19.9	168.3	61.4	0	0	0	0	113.6	E266 K267	E266-S270 PolarHBondContact O-N 3.18Å; E266-S270 PolarHBondContact O-OG 3.35Å; K267-S270 PolarHBondContact O-OG 2.85Å
271	L	47.3	Very low	47.5	Very low	75 Å²	75	95.8 Å²	95.8	39%	0.393	53%	0.528	S	S	.	.	H	α-helix	trans	-78.5	-33.8	170.5	-62.3	162.2	0	0	0	111.9	S268 S269 S274 V284 V288	S268-L271 VanDerWaalsContact O-CB 3.28Å; S268-L271 WeakPolarHBondContact O-CB 3.31Å; S268-L271 PolarHBondContact O-N 3.26Å; S268-L271 VanDerWaalsContact O-N 3.14Å; S269-L271 PolarHBondContact O-N 3.26Å; L271-S274 PolarHBondContact O-OG 2.84Å; L271-S274 VanDerWaalsContact O-OG 3.08Å; L271-V284 HydrophobicContact CD2-CG1 4.06Å; L271-V288 HydrophobicContact CD1-CG2 3.85Å
272	Y	45	Very low	47.8	Very low	136 Å²	136	100.2 Å²	100.2	53%	0.533	54%	0.544	S	S	.	.	H	α-helix	trans	-77.6	-19.2	-179	-80.8	-79.2	0	0	0	114.6	M50 S268 S269 S274	M50-Y272 HydrophobicContact CE-CE2 3.87Å; M50-Y272 WeakPolarHBondContact CE-OH 3.27Å; M50-Y272 WeakPolarHBondContact CG-OH 3.5Å; S268-Y272 WeakPolarHBondContact O-CD2 3.48Å; S269-Y272 PolarHBondContact O-N 3.34Å; Y272-S274 PolarHBondContact O-N 3.39Å
273	Q	42.5	Very low	47.7	Very low	165 Å²	165	101 Å²	101	77%	0.771	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-3.4	175	-73.2	-172.9	4	0	0	113.9	S269 D275	S269-Q273 PolarHBondContact O-N 3.33Å; Q273-D275 PolarHBondContact O-N 2.8Å
274	S	44.4	Very low	47.6	Very low	73 Å²	73	100 Å²	100	51%	0.51	55%	0.551	S	S	.	*			trans	-79.2	98.8	166.9	70.7	0	0	0	0	108.7	L271 Y272 G276	L271-S274 PolarHBondContact O-OG 2.84Å; L271-S274 VanDerWaalsContact O-OG 3.08Å; Y272-S274 PolarHBondContact O-N 3.39Å; S274-G276 PolarHBondContact O-N 3.37Å
275	D	44.7	Very low	47.8	Very low	169 Å²	169	103.2 Å²	103.2	90%	0.904	56%	0.56	S	S	*	*			trans	-67.1	43	170	-82.5	-31.6	0	0	0	111.6	Q273	Q273-D275 PolarHBondContact O-N 2.8Å
276	G	40.9	Very low	48.2	Very low	54 Å²	54	105.4 Å²	105.4	56%	0.557	57%	0.572	S	S	*	*			trans	-99.7	120.9	178	0	0	0	0	0	110.2	S274	S274-G276 PolarHBondContact O-N 3.37Å
277	P	38.7	Very low	48.3	Very low	112 Å²	112	104.6 Å²	104.6	73%	0.727	57%	0.571	S	S	*	*			trans	-74.2	137.6	168.5	31.8	-30.1	0	0	0	109.4
278	I	40.1	Very low	48.5	Very low	139 Å²	139	102.7 Å²	102.7	71%	0.713	57%	0.569	S	S	*	*	S	Bend	trans	83.4	129.1	156.1	-52.1	154.2	0	0	0	116.2	C280	I278-C280 PolarHBondContact O-N 3.38Å
279	E	49.1	Very low	48.9	Very low	166 Å²	166	103.8 Å²	103.8	78%	0.776	58%	0.576	S	S	*	*			trans	54.6	47.3	157.2	-68.8	171.4	165	0	0	118	D281	E279-D281 VanDerWaalsContact C-N 3.26Å; E279-D281 PolarHBondContact O-N 2.87Å
280	C	44.1	Very low	49.5	Very low	100 Å²	100	107 Å²	107	68%	0.676	58%	0.583	S	S	*	*			trans	-69	93.1	154.3	-73.3	0	0	0	0	109.6	I278	I278-C280 PolarHBondContact O-N 3.38Å
281	D	50.3	Low	49.8	Very low	120 Å²	120	107.8 Å²	107.8	64%	0.642	58%	0.578	S	S	*	*			trans	-42.1	148.4	-174	-82.8	-45.4	0	0	0	116.9	E279 S283 V284	E279-D281 VanDerWaalsContact C-N 3.26Å; E279-D281 PolarHBondContact O-N 2.87Å; D281-S283 PolarHBondContact O-N 2.86Å; D281-V284 PolarHBondContact O-N 2.9Å
282	E	54.1	Low	50.1	Low	136 Å²	136	108.2 Å²	108.2	64%	0.636	58%	0.577	S	S	*	*	H	α-helix	trans	-35.5	-28.8	172.2	-166.8	171.2	-169.9	0	0	116.2	R285 N286	E282-R285 WeakPolarHBondContact O-CB 3.48Å; E282-R285 PolarHBondContact O-N 2.86Å; E282-N286 WeakPolarHBondContact O-CB 3.37Å; E282-N286 PolarHBondContact O-N 3.39Å
283	S	54.3	Low	50.8	Low	76 Å²	76	104.3 Å²	104.3	53%	0.531	56%	0.564	S	S	.	*	H	α-helix	trans	-58.7	-49.3	172.9	-173.3	0	0	0	0	112.7	D281 R285 N286 D287	D281-S283 PolarHBondContact O-N 2.86Å; S283-R285 PolarHBondContact O-N 3.47Å; S283-N286 PolarHBondContact O-N 3.21Å; S283-D287 WeakPolarHBondContact O-CB 3.41Å; S283-D287 PolarHBondContact O-N 3.42Å
284	V	50.6	Low	51.5	Low	66 Å²	66	99.2 Å²	99.2	40%	0.4	54%	0.542	S	S	.	.	H	α-helix	trans	-64.1	-35	-179.5	-178.6	0	0	0	0	109.8	L271 D281 V288	L271-V284 HydrophobicContact CD2-CG1 4.06Å; D281-V284 PolarHBondContact O-N 2.9Å; V284-V288 WeakPolarHBondContact O-CB 3.21Å; V284-V288 WeakPolarHBondContact O-CG2 3.42Å; V284-V288 PolarHBondContact O-N 3.02Å
285	R	51.8	Low	52	Low	129 Å²	129	97 Å²	97	49%	0.487	53%	0.525	S	S	.	.	H	α-helix	trans	-70.5	-42.5	178.6	-163	-175.9	-49.1	-173.4	5.5	112.9	E282 S283 V288 S289	E282-R285 WeakPolarHBondContact O-CB 3.48Å; E282-R285 PolarHBondContact O-N 2.86Å; S283-R285 PolarHBondContact O-N 3.47Å; R285-V288 PolarHBondContact O-N 2.83Å; R285-S289 PolarHBondContact O-N 3.38Å
286	N	59.9	Low	52.4	Low	98 Å²	98	90.2 Å²	90.2	52%	0.524	49%	0.49	S	S	.	.	H	α-helix	trans	-67	-38.8	175.2	-77.7	-21.4	0	0	0	111.5	E282 S283 V288 S289 K290	E282-N286 WeakPolarHBondContact O-CB 3.37Å; E282-N286 PolarHBondContact O-N 3.39Å; S283-N286 PolarHBondContact O-N 3.21Å; N286-V288 VanDerWaalsContact C-N 3.35Å; N286-S289 PolarHBondContact O-N 3.42Å; N286-K290 WeakPolarHBondContact O-CB 3.08Å; N286-K290 PolarHBondContact O-N 3.43Å
287	D	57.7	Low	53.2	Low	103 Å²	103	88.6 Å²	88.6	55%	0.551	47%	0.468	S	S	*	.	H	α-helix	trans	-61.8	-43.4	172.8	-74.1	-23.7	0	0	0	110.9	S283 K290 H291	S283-D287 WeakPolarHBondContact O-CB 3.41Å; S283-D287 PolarHBondContact O-N 3.42Å; D287-K290 PolarHBondContact O-N 3.27Å; D287-H291 VanDerWaalsContact O-CB 3.26Å; D287-H291 WeakPolarHBondContact O-CB 3.42Å; D287-H291 PolarHBondContact O-N 2.75Å
288	V	52.6	Low	53.9	Low	71 Å²	71	88.5 Å²	88.5	43%	0.43	46%	0.457	S	S	.	.	H	α-helix	trans	-64	-43.8	175	170.8	0	0	0	0	112.1	L271 V284 R285 N286 H291 F292	L271-V288 HydrophobicContact CD1-CG2 3.85Å; V284-V288 WeakPolarHBondContact O-CB 3.21Å; V284-V288 WeakPolarHBondContact O-CG2 3.42Å; V284-V288 PolarHBondContact O-N 3.02Å; R285-V288 PolarHBondContact O-N 2.83Å; N286-V288 VanDerWaalsContact C-N 3.35Å; V288-H291 PolarHBondContact O-N 2.8Å; V288-F292 WeakPolarHBondContact O-CB 3.25Å; V288-F292 PolarHBondContact O-N 2.89Å
289	S	58.3	Low	54.3	Low	58 Å²	58	83.1 Å²	83.1	41%	0.406	43%	0.43	S	S	.	.	H	α-helix	trans	-63.1	-43.1	178	-167.9	0	0	0	0	111.6	R285 N286 F292 E293	R285-S289 PolarHBondContact O-N 3.38Å; N286-S289 PolarHBondContact O-N 3.42Å; S289-F292 WeakPolarHBondContact O-CB 3.29Å; S289-F292 PolarHBondContact O-N 3.29Å; S289-E293 WeakPolarHBondContact O-CG 3.09Å; S289-E293 PolarHBondContact O-N 3.3Å
290	K	62.5	Low	54.4	Low	123 Å²	123	75.8 Å²	75.8	54%	0.535	40%	0.396	S	S	.	.	H	α-helix	trans	-65.6	-40.8	175.8	-173.3	178.2	177.9	-175.8	0	111.3	N286 D287 F292 E293 D294	N286-K290 WeakPolarHBondContact O-CB 3.08Å; N286-K290 PolarHBondContact O-N 3.43Å; D287-K290 PolarHBondContact O-N 3.27Å; K290-F292 VanDerWaalsContact C-N 3.33Å; K290-F292 PolarHBondContact O-N 3.42Å; K290-E293 PolarHBondContact O-N 3.48Å; K290-D294 WeakPolarHBondContact O-CB 3.37Å; K290-D294 PolarHBondContact O-N 2.95Å
291	H	55.9	Low	54.9	Low	94 Å²	94	74.4 Å²	74.4	44%	0.435	38%	0.382	S	S	.	.	H	α-helix	trans	-65.6	-36.6	176.1	-148.8	80.1	0	0	0	111.6	K267 D287 V288 T295	K267-H291 PolarHBondContact NZ-NE2 2.82Å; D287-H291 VanDerWaalsContact O-CB 3.26Å; D287-H291 WeakPolarHBondContact O-CB 3.42Å; D287-H291 PolarHBondContact O-N 2.75Å; V288-H291 PolarHBondContact O-N 2.8Å; H291-T295 VanDerWaalsContact O-CB 3.28Å; H291-T295 WeakPolarHBondContact O-CB 3.46Å; H291-T295 PolarHBondContact O-N 3.04Å; H291-T295 PolarHBondContact O-OG1 3.34Å
292	F	55.5	Low	54.8	Low	85 Å²	85	72.3 Å²	72.3	37%	0.373	37%	0.373	S	S	.	.	H	α-helix	trans	-63.2	-50.8	172.3	-178	-88.8	0	0	0	110.9	L264 V288 S289 K290 D294 T295 V296	L264-F292 HydrophobicContact CD1-CD2 3.38Å; L264-F292 HydrophobicContact CD1-CE2 3.94Å; L264-F292 HydrophobicContact CD1-CG 4.33Å; L264-F292 HydrophobicContact CD2-CD2 3.58Å; L264-F292 HydrophobicContact CD2-CE2 3.61Å; L264-F292 HydrophobicContact CG-CD2 4.05Å; L264-F292 HydrophobicContact CG-CE2 4.39Å; V288-F292 WeakPolarHBondContact O-CB 3.25Å; V288-F292 PolarHBondContact O-N 2.89Å; S289-F292 WeakPolarHBondContact O-CB 3.29Å; S289-F292 PolarHBondContact O-N 3.29Å; K290-F292 VanDerWaalsContact C-N 3.33Å; K290-F292 PolarHBondContact O-N 3.42Å; F292-D294 PolarHBondContact O-N 3Å; F292-T295 WeakPolarHBondContact O-CB 3.31Å; F292-T295 PolarHBondContact O-N 3.41Å; F292-T295 VanDerWaalsContact O-N 3.14Å; F292-V296 HydrophobicContact CD1-CG2 3.95Å; F292-V296 HydrophobicContact CE1-CG2 3.57Å; F292-V296 HydrophobicContact CE2-CG2 4.46Å; F292-V296 HydrophobicContact CZ-CG2 3.84Å; F292-V296 WeakPolarHBondContact O-CG2 3.36Å; F292-V296 PolarHBondContact O-N 2.81Å
293	E	57.7	Low	54.6	Low	54 Å²	54	67.2 Å²	67.2	25%	0.252	35%	0.353	S	S	.	.	H	α-helix	trans	-59.2	-44.5	176.9	-73.9	178.7	-167.9	0	0	112.3	S289 K290 T295 V296 I297	S289-E293 WeakPolarHBondContact O-CG 3.09Å; S289-E293 PolarHBondContact O-N 3.3Å; K290-E293 PolarHBondContact O-N 3.48Å; E293-T295 VanDerWaalsContact C-N 3.31Å; E293-T295 PolarHBondContact O-N 2.81Å; E293-V296 PolarHBondContact O-N 2.86Å; E293-I297 VanDerWaalsContact O-CG1 3.31Å; E293-I297 WeakPolarHBondContact O-CG1 3.4Å; E293-I297 PolarHBondContact O-N 2.87Å
294	D	58.5	Low	54.4	Low	58 Å²	58	68.4 Å²	68.4	31%	0.31	36%	0.359	S	S	.	.	H	α-helix	trans	-62.8	-38.7	175.4	-78.5	-31.4	0	0	0	111.3	K290 F292 H298 R319	K290-D294 WeakPolarHBondContact O-CB 3.37Å; K290-D294 PolarHBondContact O-N 2.95Å; F292-D294 PolarHBondContact O-N 3Å; D294-H298 VanDerWaalsContact O-CB 3.3Å; D294-H298 WeakPolarHBondContact O-CB 3.4Å; D294-H298 PolarHBondContact O-N 2.93Å; D294-R319 IonicContact OD1-CZ 3.33Å; D294-R319 IonicContact OD1-NH1 2.64Å; D294-R319 PolarHBondContact OD1-NH1 2.9Å; D294-R319 IonicContact OD1-NH2 3.34Å; D294-R319 PolarHBondContact OD1-NH2 3.44Å; D294-R319 IonicContact OD2-NH1 3.99Å
295	T	53.9	Low	54.5	Low	27 Å²	27	66.4 Å²	66.4	17%	0.166	35%	0.346	C	S	.	.	H	α-helix	trans	-66.2	-43.7	175.8	-56.7	0	0	0	0	111	Y260 H291 F292 E293 H298 L299	Y260-T295 HydrophobicContact CD1-CG2 4.29Å; H291-T295 VanDerWaalsContact O-CB 3.28Å; H291-T295 WeakPolarHBondContact O-CB 3.46Å; H291-T295 PolarHBondContact O-N 3.04Å; H291-T295 PolarHBondContact O-OG1 3.34Å; F292-T295 WeakPolarHBondContact O-CB 3.31Å; F292-T295 PolarHBondContact O-N 3.41Å; F292-T295 VanDerWaalsContact O-N 3.14Å; E293-T295 VanDerWaalsContact C-N 3.31Å; E293-T295 PolarHBondContact O-N 2.81Å; T295-H298 PolarHBondContact O-N 3.05Å; T295-L299 WeakPolarHBondContact O-CB 3.46Å; T295-L299 PolarHBondContact O-N 3.2Å
296	V	53.2	Low	54.7	Low	26 Å²	26	62.5 Å²	62.5	16%	0.158	34%	0.337	C	S	.	.	H	α-helix	trans	-66.7	-39.2	177.9	175.5	0	0	0	0	111.7	F292 E293 L299 L300 I323	F292-V296 HydrophobicContact CD1-CG2 3.95Å; F292-V296 HydrophobicContact CE1-CG2 3.57Å; F292-V296 HydrophobicContact CE2-CG2 4.46Å; F292-V296 HydrophobicContact CZ-CG2 3.84Å; F292-V296 WeakPolarHBondContact O-CG2 3.36Å; F292-V296 PolarHBondContact O-N 2.81Å; E293-V296 PolarHBondContact O-N 2.86Å; V296-L299 WeakPolarHBondContact O-CB 3.38Å; V296-L299 PolarHBondContact O-N 3.44Å; V296-L300 HydrophobicContact CG1-CD1 4.26Å; V296-L300 WeakPolarHBondContact O-CG 3.38Å; V296-L300 PolarHBondContact O-N 2.71Å; V296-I323 HydrophobicContact CB-CD1 4.06Å; V296-I323 HydrophobicContact CG1-CD1 3.65Å; V296-I323 HydrophobicContact CG1-CG1 3.93Å; V296-I323 HydrophobicContact CG1-CG2 3.8Å
297	I	57.3	Low	54.8	Low	20 Å²	20	62.3 Å²	62.3	10%	0.103	34%	0.343	C	S	.	.	H	α-helix	trans	-66.2	-42.7	175.1	-69.6	168.9	0	0	0	110.8	E293 L299 L300 L301 L313 R319 I323	E293-I297 VanDerWaalsContact O-CG1 3.31Å; E293-I297 WeakPolarHBondContact O-CG1 3.4Å; E293-I297 PolarHBondContact O-N 2.87Å; I297-L299 VanDerWaalsContact C-N 3.33Å; I297-L300 PolarHBondContact O-N 2.86Å; I297-L301 HydrophobicContact CG2-CD1 3.95Å; I297-L301 HydrophobicContact CG2-CG 4.45Å; I297-L301 WeakPolarHBondContact O-CB 3.42Å; I297-L301 WeakPolarHBondContact O-CG 3.36Å; I297-L301 PolarHBondContact O-N 3.4Å; I297-L313 HydrophobicContact CG1-CD2 4.24Å; I297-L313 HydrophobicContact CG2-CD2 4.28Å; I297-R319 HydrophobicContact CD1-CB 3.97Å; I297-R319 HydrophobicContact CD1-CG 3.62Å; I297-I323 HydrophobicContact CG1-CD1 4.27Å
298	H	54.1	Low	55	Low	109 Å²	109	64.8 Å²	64.8	51%	0.505	35%	0.351	S	S	.	.	H	α-helix	trans	-63.2	-40.3	175.2	-167.1	-70.1	0	0	0	111.6	D294 T295 L301 T302	D294-H298 VanDerWaalsContact O-CB 3.3Å; D294-H298 WeakPolarHBondContact O-CB 3.4Å; D294-H298 PolarHBondContact O-N 2.93Å; T295-H298 PolarHBondContact O-N 3.05Å; H298-L301 PolarHBondContact O-N 3.1Å; H298-T302 WeakPolarHBondContact O-CB 3.49Å; H298-T302 PolarHBondContact O-N 3.14Å; H298-T302 PolarHBondContact O-OG1 3.28Å
299	L	49.4	Very low	55.3	Low	26 Å²	26	62 Å²	62	14%	0.136	33%	0.334	C	S	.	.	H	α-helix	trans	-61.7	-43.2	176.3	-173.8	154.8	0	0	0	111.6	L257 Y260 T295 V296 I297 T302 S303	L257-L299 HydrophobicContact CD1-CD1 4.02Å; L257-L299 HydrophobicContact CD1-CD2 3.94Å; Y260-L299 HydrophobicContact CD2-CB 4.07Å; Y260-L299 HydrophobicContact CD2-CD1 3.33Å; Y260-L299 HydrophobicContact CD2-CG 3.54Å; Y260-L299 HydrophobicContact CE2-CB 4.17Å; Y260-L299 HydrophobicContact CE2-CD1 4.23Å; Y260-L299 HydrophobicContact CE2-CG 3.96Å; Y260-L299 HydrophobicContact CG-CD1 3.68Å; Y260-L299 HydrophobicContact CG-CG 4.31Å; T295-L299 WeakPolarHBondContact O-CB 3.46Å; T295-L299 PolarHBondContact O-N 3.2Å; V296-L299 WeakPolarHBondContact O-CB 3.38Å; V296-L299 PolarHBondContact O-N 3.44Å; I297-L299 VanDerWaalsContact C-N 3.33Å; L299-T302 PolarHBondContact O-OG1 2.99Å; L299-S303 PolarHBondContact O-N 3.34Å
300	L	51.5	Low	55.4	Low	12 Å²	12	60.6 Å²	60.6	6%	0.063	32%	0.324	C	S	.	.	H	α-helix	trans	-66.1	-55.4	173.6	-68.2	170.4	0	0	0	109.6	V296 I297 T302 S303 L305 L313 I323 I326	V296-L300 HydrophobicContact CG1-CD1 4.26Å; V296-L300 WeakPolarHBondContact O-CG 3.38Å; V296-L300 PolarHBondContact O-N 2.71Å; I297-L300 PolarHBondContact O-N 2.86Å; L300-T302 PolarHBondContact O-N 3.02Å; L300-S303 PolarHBondContact O-N 3.4Å; L300-S303 PolarHBondContact O-OG 3.37Å; L300-L305 HydrophobicContact CB-CD1 3.8Å; L300-L305 HydrophobicContact CD2-CD1 4.14Å; L300-L305 WeakPolarHBondContact O-CD1 3.41Å; L300-L313 HydrophobicContact CB-CD1 3.4Å; L300-L313 HydrophobicContact CB-CD2 4.01Å; L300-L313 HydrophobicContact CB-CG 4.35Å; L300-L313 HydrophobicContact CD1-CD1 4.31Å; L300-L313 HydrophobicContact CD1-CD2 3.69Å; L300-L313 HydrophobicContact CG-CD1 4.44Å; L300-I323 HydrophobicContact CD1-CG1 4.23Å; L300-I326 HydrophobicContact CD1-CD1 3.99Å; L300-I326 HydrophobicContact CD1-CG2 4.24Å; L300-I326 HydrophobicContact CD2-CG2 3.94Å
301	L	54.6	Low	55.5	Low	72 Å²	72	61.2 Å²	61.2	38%	0.377	33%	0.329	S	S	.	.	H	α-helix	trans	-57.7	-23.9	-177.4	-73.2	172.6	0	0	0	115.8	I297 H298 S310 L313 K314	I297-L301 HydrophobicContact CG2-CD1 3.95Å; I297-L301 HydrophobicContact CG2-CG 4.45Å; I297-L301 WeakPolarHBondContact O-CB 3.42Å; I297-L301 WeakPolarHBondContact O-CG 3.36Å; I297-L301 PolarHBondContact O-N 3.4Å; H298-L301 PolarHBondContact O-N 3.1Å; L301-S310 WeakPolarHBondContact CD2-O 3.47Å; L301-L313 HydrophobicContact CD2-CB 3.72Å; L301-L313 HydrophobicContact CD2-CD1 4.1Å; L301-L313 HydrophobicContact CG-CB 4.02Å; L301-L313 HydrophobicContact CG-CD1 4.23Å; L301-K314 HydrophobicContact CD2-CG 4.41Å
302	T	47.8	Very low	55.8	Low	76 Å²	76	62.1 Å²	62.1	47%	0.466	33%	0.332	S	S	.	.	H	α-helix	trans	-90.7	-17.1	177.5	45.6	0	0	0	0	114.2	H298 L299 L300	H298-T302 WeakPolarHBondContact O-CB 3.49Å; H298-T302 PolarHBondContact O-N 3.14Å; H298-T302 PolarHBondContact O-OG1 3.28Å; L299-T302 PolarHBondContact O-OG1 2.99Å; L300-T302 PolarHBondContact O-N 3.02Å
303	S	49.9	Very low	56	Low	29 Å²	29	58.5 Å²	58.5	20%	0.203	32%	0.316	C	S	.	.	S	Bend	trans	-77.6	154.4	171.6	68.5	0	0	0	0	111.1	L299 L300 L305	L299-S303 PolarHBondContact O-N 3.34Å; L300-S303 PolarHBondContact O-N 3.4Å; L300-S303 PolarHBondContact O-OG 3.37Å; S303-L305 PolarHBondContact O-N 2.93Å; S303-L305 WeakPolarHBondContact OG-CD1 3.28Å
304	P	49.1	Very low	56.2	Low	101 Å²	101	63 Å²	63	66%	0.656	34%	0.335	S	S	*	.			trans	-72.2	69.2	177.1	31.2	-34.4	0	0	0	110.4
305	L	52.8	Low	56.4	Low	24 Å²	24	64 Å²	64	13%	0.126	34%	0.343	C	S	.	.			trans	-77	145.9	169.5	-77.1	131.8	0	0	0	109.9	L300 S303 S307 L309 L313 I326	L300-L305 HydrophobicContact CB-CD1 3.8Å; L300-L305 HydrophobicContact CD2-CD1 4.14Å; L300-L305 WeakPolarHBondContact O-CD1 3.41Å; S303-L305 PolarHBondContact O-N 2.93Å; S303-L305 WeakPolarHBondContact OG-CD1 3.28Å; L305-S307 PolarHBondContact O-N 3.02Å; L305-L309 HydrophobicContact CB-CB 4.28Å; L305-L309 HydrophobicContact CD2-CB 3.79Å; L305-L309 HydrophobicContact CD2-CD1 3.72Å; L305-L309 HydrophobicContact CD2-CG 4.41Å; L305-L313 HydrophobicContact CD1-CD1 4.18Å; L305-I326 HydrophobicContact CD2-CG2 3.74Å
306	P	56.5	Low	56.5	Low	46 Å²	46	69 Å²	69	30%	0.299	37%	0.374	S	S	.	.			trans	-48.5	140	163.9	-23.7	31.7	0	0	0	110.8	E308 L309 S310	P306-E308 PolarHBondContact O-N 3.15Å; P306-L309 HydrophobicContact CG-CD1 4.39Å; P306-L309 PolarHBondContact O-N 2.81Å; P306-S310 PolarHBondContact O-N 3.5Å; P306-S310 VanDerWaalsContact O-N 3.15Å
307	S	61.1	Low	57	Low	94 Å²	94	69.8 Å²	69.8	66%	0.657	39%	0.387	S	S	*	.	H	α-helix	trans	-47.3	-40.2	-176.9	-31.1	0	0	0	0	112.2	L305 L309 S310 E311	L305-S307 PolarHBondContact O-N 3.02Å; S307-L309 PolarHBondContact O-N 2.81Å; S307-S310 PolarHBondContact O-N 2.82Å; S307-S310 PolarHBondContact O-OG 2.81Å; S307-E311 PolarHBondContact O-N 3.48Å
308	E	61.9	Low	57.4	Low	155 Å²	155	73.8 Å²	73.8	72%	0.724	41%	0.409	S	S	*	.	H	α-helix	trans	-58.6	-40.5	178.4	-62.4	167.9	-175.1	0	0	113.9	P306 K312	P306-E308 PolarHBondContact O-N 3.15Å; E308-K312 PolarHBondContact O-N 2.68Å
309	L	58.6	Low	57.7	Low	14 Å²	14	72.1 Å²	72.1	7%	0.073	40%	0.398	C	S	.	.	H	α-helix	trans	-79.3	-33.6	178.1	-63.3	176.9	0	0	0	111.1	L305 P306 S307 E311 K312 L313 I326	L305-L309 HydrophobicContact CB-CB 4.28Å; L305-L309 HydrophobicContact CD2-CB 3.79Å; L305-L309 HydrophobicContact CD2-CD1 3.72Å; L305-L309 HydrophobicContact CD2-CG 4.41Å; P306-L309 HydrophobicContact CG-CD1 4.39Å; P306-L309 PolarHBondContact O-N 2.81Å; S307-L309 PolarHBondContact O-N 2.81Å; L309-E311 VanDerWaalsContact C-N 3.3Å; L309-E311 PolarHBondContact O-N 3.37Å; L309-K312 PolarHBondContact O-N 2.72Å; L309-L313 WeakPolarHBondContact O-CD1 3.38Å; L309-L313 PolarHBondContact O-N 3.41Å; L309-I326 HydrophobicContact CD1-CG2 4.48Å; L309-I326 HydrophobicContact CD2-CG1 4.13Å
310	S	60.7	Low	58.1	Low	28 Å²	28	73.7 Å²	73.7	20%	0.196	41%	0.411	C	S	.	.	H	α-helix	trans	-63	-35.4	173.6	83.2	0	0	0	0	112.4	L301 P306 S307	L301-S310 WeakPolarHBondContact CD2-O 3.47Å; P306-S310 PolarHBondContact O-N 3.5Å; P306-S310 VanDerWaalsContact O-N 3.15Å; S307-S310 PolarHBondContact O-N 2.82Å; S307-S310 PolarHBondContact O-OG 2.81Å
311	E	64.4	Low	58.7	Low	135 Å²	135	78.1 Å²	78.1	63%	0.631	43%	0.431	S	S	*	.	H	α-helix	trans	-72.9	-39.5	177.2	-73.8	-156.6	149.4	0	0	112.6	S307 L309 L313 K314	S307-E311 PolarHBondContact O-N 3.48Å; L309-E311 VanDerWaalsContact C-N 3.3Å; L309-E311 PolarHBondContact O-N 3.37Å; E311-L313 PolarHBondContact O-N 3.44Å; E311-K314 PolarHBondContact O-N 3.29Å; E311-K314 VanDerWaalsContact O-N 3.08Å
312	K	62.8	Low	59.1	Low	114 Å²	114	76 Å²	76	50%	0.496	42%	0.42	S	S	.	.	H	α-helix	trans	-57.1	-38	174.7	-76.9	-174.9	176	-173.7	0	112.1	E308 L309 K314 T315 I322	E308-K312 PolarHBondContact O-N 2.68Å; L309-K312 PolarHBondContact O-N 2.72Å; K312-K314 VanDerWaalsContact C-N 3.29Å; K312-K314 PolarHBondContact O-N 3.29Å; K312-T315 PolarHBondContact O-N 2.99Å; K312-T315 PolarHBondContact O-OG1 3.41Å; K312-I322 HydrophobicContact CB-CG2 4.47Å
313	L	59.2	Low	59.7	Low	8 Å²	8	73.4 Å²	73.4	4%	0.042	40%	0.403	C	S	.	.	H	α-helix	trans	-66	-25.2	177.6	-76.1	157.9	0	0	0	114.5	I297 L300 L301 L305 L309 E311 T315 I322 I326	I297-L313 HydrophobicContact CG1-CD2 4.24Å; I297-L313 HydrophobicContact CG2-CD2 4.28Å; L300-L313 HydrophobicContact CB-CD1 3.4Å; L300-L313 HydrophobicContact CB-CD2 4.01Å; L300-L313 HydrophobicContact CB-CG 4.35Å; L300-L313 HydrophobicContact CD1-CD1 4.31Å; L300-L313 HydrophobicContact CD1-CD2 3.69Å; L300-L313 HydrophobicContact CG-CD1 4.44Å; L301-L313 HydrophobicContact CD2-CB 3.72Å; L301-L313 HydrophobicContact CD2-CD1 4.1Å; L301-L313 HydrophobicContact CG-CB 4.02Å; L301-L313 HydrophobicContact CG-CD1 4.23Å; L305-L313 HydrophobicContact CD1-CD1 4.18Å; L309-L313 WeakPolarHBondContact O-CD1 3.38Å; L309-L313 PolarHBondContact O-N 3.41Å; E311-L313 PolarHBondContact O-N 3.44Å; L313-T315 PolarHBondContact O-N 2.85Å; L313-I322 HydrophobicContact CD2-CG2 4.22Å; L313-I326 HydrophobicContact CD1-CD1 3.79Å; L313-I326 HydrophobicContact CD2-CD1 3.5Å; L313-I326 HydrophobicContact CG-CD1 3.43Å; L313-I326 VanDerWaalsContact CG-CD1 3.43Å
314	K	63.8	Low	60.2	Low	148 Å²	148	76.3 Å²	76.3	64%	0.643	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-12.3	178.4	-68	177.4	-176.7	172.8	0	112.9	L301 E311 K312	L301-K314 HydrophobicContact CD2-CG 4.41Å; E311-K314 PolarHBondContact O-N 3.29Å; E311-K314 VanDerWaalsContact O-N 3.08Å; K312-K314 VanDerWaalsContact C-N 3.29Å; K312-K314 PolarHBondContact O-N 3.29Å
315	T	62.6	Low	61	Low	79 Å²	79	74.7 Å²	74.7	49%	0.485	40%	0.402	S	S	.	.	S	Bend	trans	-79.1	133.4	-179.7	67.3	0	0	0	0	111	K312 L313 G317 I322	K312-T315 PolarHBondContact O-N 2.99Å; K312-T315 PolarHBondContact O-OG1 3.41Å; L313-T315 PolarHBondContact O-N 2.85Å; T315-G317 PolarHBondContact O-N 2.83Å; T315-I322 WeakPolarHBondContact OG1-CD1 3.42Å
316	T	55.4	Low	61.3	Low	134 Å²	134	73.6 Å²	73.6	82%	0.822	40%	0.396	S	S	*	.			trans	-77.9	20.5	-178.4	42.6	0	0	0	0	114
317	G	63.4	Low	61.5	Low	42 Å²	42	75.9 Å²	75.9	43%	0.433	41%	0.406	S	S	.	.	S	Bend	trans	-75.6	-159.2	-179.5	0	0	0	0	0	113.8	T315 R319	T315-G317 PolarHBondContact O-N 2.83Å; G317-R319 VanDerWaalsContact C-N 3.34Å; G317-R319 WeakPolarHBondContact O-CG 3.46Å; G317-R319 PolarHBondContact O-N 3.22Å
318	N	65.2	Low	61.9	Low	104 Å²	104	78.3 Å²	78.3	56%	0.556	40%	0.4	S	S	*	.			trans	-62.9	87.8	-178.7	-147.1	17.9	0	0	0	110.8	S320 E321 I322	N318-S320 VanDerWaalsContact C-N 3.32Å; N318-S320 PolarHBondContact O-N 3.46Å; N318-E321 HydrophobicContact CB-CB 4.18Å; N318-E321 PolarHBondContact ND2-OE2 3.09Å; N318-E321 WeakPolarHBondContact O-CB 3.46Å; N318-E321 PolarHBondContact O-N 3.48Å; N318-E321 VanDerWaalsContact O-N 3.11Å; N318-I322 PolarHBondContact O-N 3.46Å
319	R	60.4	Low	61.9	Low	74 Å²	74	72.8 Å²	72.8	28%	0.279	38%	0.379	S	S	.	.	H	α-helix	trans	-57.7	-40.6	-167.3	-75.1	176	167.4	-167.1	-11.4	113.5	D294 I297 G317 E321 I322 I323	D294-R319 IonicContact OD1-CZ 3.33Å; D294-R319 IonicContact OD1-NH1 2.64Å; D294-R319 PolarHBondContact OD1-NH1 2.9Å; D294-R319 IonicContact OD1-NH2 3.34Å; D294-R319 PolarHBondContact OD1-NH2 3.44Å; D294-R319 IonicContact OD2-NH1 3.99Å; I297-R319 HydrophobicContact CD1-CB 3.97Å; I297-R319 HydrophobicContact CD1-CG 3.62Å; G317-R319 VanDerWaalsContact C-N 3.34Å; G317-R319 WeakPolarHBondContact O-CG 3.46Å; G317-R319 PolarHBondContact O-N 3.22Å; R319-E321 PolarHBondContact O-N 3.15Å; R319-I322 PolarHBondContact O-N 2.86Å; R319-I323 WeakPolarHBondContact O-CD1 3.32Å; R319-I323 VanDerWaalsContact O-CG1 3.28Å; R319-I323 WeakPolarHBondContact O-CG1 3.43Å; R319-I323 PolarHBondContact O-N 3.26Å
320	S	58.9	Low	62	Low	58 Å²	58	75.2 Å²	75.2	41%	0.406	39%	0.391	S	S	.	.	H	α-helix	trans	-61.8	-40.2	177.6	54.6	0	0	0	0	112.8	N318 I323 L324	N318-S320 VanDerWaalsContact C-N 3.32Å; N318-S320 PolarHBondContact O-N 3.46Å; S320-I323 PolarHBondContact O-N 2.88Å; S320-L324 WeakPolarHBondContact O-CG 3.44Å; S320-L324 PolarHBondContact O-N 2.87Å; S320-L324 VanDerWaalsContact O-N 3.07Å
321	E	63.7	Low	62.2	Low	105 Å²	105	76.7 Å²	76.7	49%	0.491	39%	0.394	S	S	.	.	H	α-helix	trans	-69.7	-39.4	178.5	-165.2	171	-173.1	0	0	111.6	N318 R319 L324 D325	N318-E321 HydrophobicContact CB-CB 4.18Å; N318-E321 PolarHBondContact ND2-OE2 3.09Å; N318-E321 WeakPolarHBondContact O-CB 3.46Å; N318-E321 PolarHBondContact O-N 3.48Å; N318-E321 VanDerWaalsContact O-N 3.11Å; R319-E321 PolarHBondContact O-N 3.15Å; E321-L324 PolarHBondContact O-N 3.31Å; E321-D325 WeakPolarHBondContact O-CB 3.41Å; E321-D325 PolarHBondContact O-N 3.46Å
322	I	62.6	Low	62.4	Low	27 Å²	27	73.6 Å²	73.6	14%	0.138	39%	0.387	C	S	.	.	H	α-helix	trans	-61.9	-44.3	174.7	-64.1	168.1	0	0	0	110.9	K312 L313 T315 N318 R319 D325 I326	K312-I322 HydrophobicContact CB-CG2 4.47Å; L313-I322 HydrophobicContact CD2-CG2 4.22Å; T315-I322 WeakPolarHBondContact OG1-CD1 3.42Å; N318-I322 PolarHBondContact O-N 3.46Å; R319-I322 PolarHBondContact O-N 2.86Å; I322-D325 PolarHBondContact O-N 2.82Å; I322-I326 HydrophobicContact CG2-CD1 3.83Å; I322-I326 WeakPolarHBondContact O-CD1 3.1Å; I322-I326 VanDerWaalsContact O-CG1 3.27Å; I322-I326 WeakPolarHBondContact O-CG1 3.38Å; I322-I326 PolarHBondContact O-N 2.89Å
323	I	60.1	Low	62.3	Low	22 Å²	22	74.5 Å²	74.5	11%	0.113	39%	0.388	C	S	.	.	H	α-helix	trans	-61.2	-46.6	177	-68.5	163.2	0	0	0	110.5	V296 I297 L300 R319 S320 D325 I326 L327	V296-I323 HydrophobicContact CB-CD1 4.06Å; V296-I323 HydrophobicContact CG1-CD1 3.65Å; V296-I323 HydrophobicContact CG1-CG1 3.93Å; V296-I323 HydrophobicContact CG1-CG2 3.8Å; I297-I323 HydrophobicContact CG1-CD1 4.27Å; L300-I323 HydrophobicContact CD1-CG1 4.23Å; R319-I323 WeakPolarHBondContact O-CD1 3.32Å; R319-I323 VanDerWaalsContact O-CG1 3.28Å; R319-I323 WeakPolarHBondContact O-CG1 3.43Å; R319-I323 PolarHBondContact O-N 3.26Å; S320-I323 PolarHBondContact O-N 2.88Å; I323-D325 PolarHBondContact O-N 3.07Å; I323-I326 PolarHBondContact O-N 2.71Å; I323-L327 HydrophobicContact CG2-CD1 4.13Å; I323-L327 WeakPolarHBondContact O-CG 3.07Å; I323-L327 PolarHBondContact O-N 2.84Å
324	L	60.8	Low	62.4	Low	91 Å²	91	77 Å²	77	48%	0.476	40%	0.401	S	S	.	.	H	α-helix	trans	-62.2	-40.9	177.9	-74.3	171.7	0	0	0	112.5	S320 E321 I326 L327 R328	S320-L324 WeakPolarHBondContact O-CG 3.44Å; S320-L324 PolarHBondContact O-N 2.87Å; S320-L324 VanDerWaalsContact O-N 3.07Å; E321-L324 PolarHBondContact O-N 3.31Å; L324-I326 VanDerWaalsContact C-N 3.33Å; L324-I326 PolarHBondContact O-N 2.98Å; L324-L327 PolarHBondContact O-N 3.29Å; L324-R328 WeakPolarHBondContact O-CG 3.03Å; L324-R328 PolarHBondContact O-N 3.35Å
325	D	65.1	Low	62.6	Low	67 Å²	67	72.7 Å²	72.7	36%	0.358	39%	0.387	S	S	.	.	H	α-helix	trans	-61.9	-40.2	176	-87.9	5.4	0	0	0	112.2	E321 I322 I323 R328 S329	E321-D325 WeakPolarHBondContact O-CB 3.41Å; E321-D325 PolarHBondContact O-N 3.46Å; I322-D325 PolarHBondContact O-N 2.82Å; I323-D325 PolarHBondContact O-N 3.07Å; D325-R328 PolarHBondContact O-N 3.43Å; D325-R328 IonicContact OD1-CZ 2.86Å; D325-R328 IonicContact OD1-NH1 3.63Å; D325-R328 PolarHBondContact OD1-NH1 2.94Å; D325-S329 WeakPolarHBondContact O-CB 3.49Å; D325-S329 PolarHBondContact O-N 3.36Å
326	I	61.1	Low	62.7	Low	1 Å²	1	72.3 Å²	72.3	1%	0.005	39%	0.387	C	S	.	.	H	α-helix	trans	-66.7	-44.5	177	-68.3	161.5	0	0	0	110.7	L300 L305 L309 L313 I322 I323 L324 R328 S329 L330	L300-I326 HydrophobicContact CD1-CD1 3.99Å; L300-I326 HydrophobicContact CD1-CG2 4.24Å; L300-I326 HydrophobicContact CD2-CG2 3.94Å; L305-I326 HydrophobicContact CD2-CG2 3.74Å; L309-I326 HydrophobicContact CD1-CG2 4.48Å; L309-I326 HydrophobicContact CD2-CG1 4.13Å; L313-I326 HydrophobicContact CD1-CD1 3.79Å; L313-I326 HydrophobicContact CD2-CD1 3.5Å; L313-I326 HydrophobicContact CG-CD1 3.43Å; L313-I326 VanDerWaalsContact CG-CD1 3.43Å; I322-I326 HydrophobicContact CG2-CD1 3.83Å; I322-I326 WeakPolarHBondContact O-CD1 3.1Å; I322-I326 VanDerWaalsContact O-CG1 3.27Å; I322-I326 WeakPolarHBondContact O-CG1 3.38Å; I322-I326 PolarHBondContact O-N 2.89Å; I323-I326 PolarHBondContact O-N 2.71Å; L324-I326 VanDerWaalsContact C-N 3.33Å; L324-I326 PolarHBondContact O-N 2.98Å; I326-R328 VanDerWaalsContact C-N 3.33Å; I326-R328 PolarHBondContact O-N 3.36Å; I326-S329 WeakPolarHBondContact O-CB 2.89Å; I326-S329 PolarHBondContact O-N 3.15Å; I326-S329 VanDerWaalsContact O-N 3.15Å; I326-L330 HydrophobicContact CG2-CD1 4.14Å; I326-L330 HydrophobicContact CG2-CG 4.46Å; I326-L330 WeakPolarHBondContact O-CG 3.37Å; I326-L330 PolarHBondContact O-N 3.43Å
327	L	59.7	Low	62.9	Low	94 Å²	94	68.2 Å²	68.2	49%	0.492	36%	0.364	S	S	.	.	H	α-helix	trans	-61	-40.4	176	-70.4	173.2	0	0	0	111.9	I323 L324 L330 K331	I323-L327 HydrophobicContact CG2-CD1 4.13Å; I323-L327 WeakPolarHBondContact O-CG 3.07Å; I323-L327 PolarHBondContact O-N 2.84Å; L324-L327 PolarHBondContact O-N 3.29Å; L327-L330 PolarHBondContact O-N 3.43Å; L327-K331 WeakPolarHBondContact O-CB 3.46Å; L327-K331 PolarHBondContact O-N 3.29Å
328	R	68.6	Low	62.5	Low	145 Å²	145	68.9 Å²	68.9	55%	0.547	36%	0.356	S	S	.	.	H	α-helix	trans	-64.1	-38.8	173.8	-72.3	-170.8	-139.5	113.8	5.2	112.3	L324 D325 I326 K331 S332	L324-R328 WeakPolarHBondContact O-CG 3.03Å; L324-R328 PolarHBondContact O-N 3.35Å; D325-R328 PolarHBondContact O-N 3.43Å; D325-R328 IonicContact OD1-CZ 2.86Å; D325-R328 IonicContact OD1-NH1 3.63Å; D325-R328 PolarHBondContact OD1-NH1 2.94Å; I326-R328 VanDerWaalsContact C-N 3.33Å; I326-R328 PolarHBondContact O-N 3.36Å; R328-K331 PolarHBondContact O-N 2.92Å; R328-S332 PolarHBondContact O-N 3.24Å
329	S	63.8	Low	62.6	Low	39 Å²	39	68.1 Å²	68.1	27%	0.273	35%	0.352	S	S	.	.	H	α-helix	trans	-66.5	-40.4	175.9	-172.6	0	0	0	0	112.4	D325 I326 S332 R333	D325-S329 WeakPolarHBondContact O-CB 3.49Å; D325-S329 PolarHBondContact O-N 3.36Å; I326-S329 WeakPolarHBondContact O-CB 2.89Å; I326-S329 PolarHBondContact O-N 3.15Å; I326-S329 VanDerWaalsContact O-N 3.15Å; S329-S332 PolarHBondContact O-N 3.48Å; S329-S332 PolarHBondContact O-OG 3.13Å; S329-R333 WeakPolarHBondContact O-CG 3.34Å; S329-R333 PolarHBondContact O-N 3.31Å; S329-R333 VanDerWaalsContact O-N 3.09Å
330	L	59.9	Low	62.6	Low	64 Å²	64	67.5 Å²	67.5	34%	0.335	36%	0.359	S	S	.	.	H	α-helix	trans	-65.8	-40.8	174	-68.8	173.4	0	0	0	111.4	I326 L327 S332 R333 L334	I326-L330 HydrophobicContact CG2-CD1 4.14Å; I326-L330 HydrophobicContact CG2-CG 4.46Å; I326-L330 WeakPolarHBondContact O-CG 3.37Å; I326-L330 PolarHBondContact O-N 3.43Å; L327-L330 PolarHBondContact O-N 3.43Å; L330-S332 PolarHBondContact O-N 3.46Å; L330-R333 PolarHBondContact O-N 3.48Å; L330-L334 PolarHBondContact O-N 2.92Å
331	K	64.2	Low	62.3	Low	59 Å²	59	68.9 Å²	68.9	26%	0.257	36%	0.361	S	S	.	.	H	α-helix	trans	-57.5	-47.3	173.5	-175.9	178.4	178.6	176.2	0	111.4	E34 L327 R328 R333 L334 V335	E34-K331 IonicContact OE1-NZ 2.86Å; E34-K331 PolarHBondContact OE1-NZ 3.06Å; L327-K331 WeakPolarHBondContact O-CB 3.46Å; L327-K331 PolarHBondContact O-N 3.29Å; R328-K331 PolarHBondContact O-N 2.92Å; K331-R333 PolarHBondContact O-N 3.37Å; K331-L334 PolarHBondContact O-N 2.95Å; K331-V335 WeakPolarHBondContact O-CG2 3.38Å; K331-V335 PolarHBondContact O-N 2.83Å; K331-V335 VanDerWaalsContact O-N 3.13Å
332	S	68.3	Low	62.3	Low	70 Å²	70	69.6 Å²	69.6	49%	0.49	36%	0.363	S	S	.	.	H	α-helix	trans	-65.9	-36.9	-179.3	67.9	0	0	0	0	112.7	R328 S329 L330 V335 S336	R328-S332 PolarHBondContact O-N 3.24Å; S329-S332 PolarHBondContact O-N 3.48Å; S329-S332 PolarHBondContact O-OG 3.13Å; L330-S332 PolarHBondContact O-N 3.46Å; S332-V335 PolarHBondContact O-N 2.74Å; S332-S336 PolarHBondContact O-N 3.4Å
333	R	62.4	Low	62.5	Low	134 Å²	134	72.5 Å²	72.5	51%	0.506	38%	0.377	S	S	.	.	H	α-helix	trans	-64.7	-43.2	174	-75.1	-178.3	65	-164.2	-1.2	112.7	S329 L330 K331 V335 S336 S337	S329-R333 WeakPolarHBondContact O-CG 3.34Å; S329-R333 PolarHBondContact O-N 3.31Å; S329-R333 VanDerWaalsContact O-N 3.09Å; L330-R333 PolarHBondContact O-N 3.48Å; K331-R333 PolarHBondContact O-N 3.37Å; R333-V335 VanDerWaalsContact C-N 3.32Å; R333-V335 PolarHBondContact O-N 3.45Å; R333-S336 PolarHBondContact O-N 3.42Å; R333-S337 PolarHBondContact O-N 2.98Å
334	L	60.1	Low	62.4	Low	61 Å²	61	76.5 Å²	76.5	32%	0.319	40%	0.396	S	S	.	.	H	α-helix	trans	-60.3	-43.5	177.9	-171.9	71.1	0	0	0	111.2	L26 L330 K331 S337 Q338	L26-L334 HydrophobicContact CD2-CD1 4Å; L26-L334 HydrophobicContact CD2-CD2 3.85Å; L26-L334 HydrophobicContact CD2-CG 4.01Å; L330-L334 PolarHBondContact O-N 2.92Å; K331-L334 PolarHBondContact O-N 2.95Å; L334-S337 PolarHBondContact O-N 2.76Å; L334-Q338 PolarHBondContact O-N 3.48Å
335	V	68.8	Low	61.8	Low	57 Å²	57	73.9 Å²	73.9	35%	0.345	39%	0.385	S	S	.	.	H	α-helix	trans	-62.3	-43.4	175.8	173.6	0	0	0	0	111.4	K331 S332 R333 S337 Q338 D339	K331-V335 WeakPolarHBondContact O-CG2 3.38Å; K331-V335 PolarHBondContact O-N 2.83Å; K331-V335 VanDerWaalsContact O-N 3.13Å; S332-V335 PolarHBondContact O-N 2.74Å; R333-V335 VanDerWaalsContact C-N 3.32Å; R333-V335 PolarHBondContact O-N 3.45Å; V335-S337 PolarHBondContact O-N 2.75Å; V335-Q338 WeakPolarHBondContact O-CB 3.5Å; V335-Q338 PolarHBondContact O-N 3.06Å; V335-D339 PolarHBondContact O-N 2.64Å
336	S	64.8	Low	61.8	Low	70 Å²	70	75.8 Å²	75.8	49%	0.49	39%	0.391	S	S	.	.	H	α-helix	trans	-63.4	-39.8	177	-178.5	0	0	0	0	113.4	S332 R333 D339 S340	S332-S336 PolarHBondContact O-N 3.4Å; R333-S336 PolarHBondContact O-N 3.42Å; S336-D339 PolarHBondContact O-N 3.36Å; S336-S340 PolarHBondContact O-N 2.95Å; S336-S340 PolarHBondContact O-OG 3.12Å
337	S	58.6	Low	61.7	Low	48 Å²	48	80.2 Å²	80.2	34%	0.336	41%	0.411	S	S	.	.	H	α-helix	trans	-64.3	-42.9	174.3	175	0	0	0	0	111.2	R333 L334 V335 D339 S340 I341	R333-S337 PolarHBondContact O-N 2.98Å; L334-S337 PolarHBondContact O-N 2.76Å; V335-S337 PolarHBondContact O-N 2.75Å; S337-D339 VanDerWaalsContact C-N 3.34Å; S337-D339 PolarHBondContact O-N 2.9Å; S337-S340 WeakPolarHBondContact O-CB 3.38Å; S337-S340 PolarHBondContact O-N 3.43Å; S337-S340 VanDerWaalsContact O-N 3.15Å; S337-I341 WeakPolarHBondContact O-CG1 3.39Å; S337-I341 PolarHBondContact O-N 3.48Å
338	Q	56.1	Low	61.1	Low	57 Å²	57	80.1 Å²	80.1	27%	0.266	41%	0.41	S	S	.	.	H	α-helix	trans	-57.8	-44.4	174.8	-177.7	179.3	0.8	0	0	112.4	L26 L334 V335 S340 K342	L26-Q338 HydrophobicContact CD1-CB 4.18Å; L26-Q338 HydrophobicContact CD1-CG 3.95Å; L334-Q338 PolarHBondContact O-N 3.48Å; V335-Q338 WeakPolarHBondContact O-CB 3.5Å; V335-Q338 PolarHBondContact O-N 3.06Å; Q338-S340 VanDerWaalsContact C-N 3.34Å; Q338-K342 PolarHBondContact O-N 2.8Å; Q338-K342 VanDerWaalsContact O-N 3.1Å
339	D	66.6	Low	60.5	Low	87 Å²	87	75.2 Å²	75.2	47%	0.465	40%	0.395	S	S	.	.	H	α-helix	trans	-65.2	-38.1	176.9	-73.6	-27.7	0	0	0	111.9	V335 S336 S337 K342 I343	V335-D339 PolarHBondContact O-N 2.64Å; S336-D339 PolarHBondContact O-N 3.36Å; S337-D339 VanDerWaalsContact C-N 3.34Å; S337-D339 PolarHBondContact O-N 2.9Å; D339-K342 WeakPolarHBondContact O-CB 3.39Å; D339-K342 PolarHBondContact O-N 3.01Å; D339-I343 WeakPolarHBondContact O-CG1 3.42Å; D339-I343 PolarHBondContact O-N 3.21Å
340	S	60.4	Low	60.5	Low	62 Å²	62	80.1 Å²	80.1	43%	0.434	41%	0.411	S	S	.	.	H	α-helix	trans	-65.5	-45.4	177.3	-59.3	0	0	0	0	112.1	S336 S337 Q338 K342 I343 E344	S336-S340 PolarHBondContact O-N 2.95Å; S336-S340 PolarHBondContact O-OG 3.12Å; S337-S340 WeakPolarHBondContact O-CB 3.38Å; S337-S340 PolarHBondContact O-N 3.43Å; S337-S340 VanDerWaalsContact O-N 3.15Å; Q338-S340 VanDerWaalsContact C-N 3.34Å; S340-K342 VanDerWaalsContact C-N 3.26Å; S340-K342 PolarHBondContact O-N 3.29Å; S340-I343 PolarHBondContact O-N 3.05Å; S340-E344 PolarHBondContact O-N 3.03Å
341	I	53.5	Low	60.1	Low	87 Å²	87	84 Å²	84	45%	0.446	42%	0.423	S	S	.	.	H	α-helix	trans	-59	-41	175.1	-69	166.9	0	0	0	110.5	S337 E344 S345	S337-I341 WeakPolarHBondContact O-CG1 3.39Å; S337-I341 PolarHBondContact O-N 3.48Å; I341-E344 PolarHBondContact O-N 3.06Å; I341-S345 WeakPolarHBondContact O-CB 2.98Å; I341-S345 PolarHBondContact O-N 3.41Å
342	K	63.3	Low	59.4	Low	120 Å²	120	82 Å²	82	52%	0.522	42%	0.415	S	S	.	.	H	α-helix	trans	-62.4	-44.5	177.1	-172.2	-176.6	175.1	-171.4	0	111.9	Q338 D339 S340 S345 E346	Q338-K342 PolarHBondContact O-N 2.8Å; Q338-K342 VanDerWaalsContact O-N 3.1Å; D339-K342 WeakPolarHBondContact O-CB 3.39Å; D339-K342 PolarHBondContact O-N 3.01Å; S340-K342 VanDerWaalsContact C-N 3.26Å; S340-K342 PolarHBondContact O-N 3.29Å; K342-S345 WeakPolarHBondContact O-CB 3.48Å; K342-S345 PolarHBondContact O-N 3.22Å; K342-E346 WeakPolarHBondContact O-CG 3.34Å; K342-E346 PolarHBondContact O-N 2.99Å
343	I	66.3	Low	58.9	Low	88 Å²	88	83.8 Å²	83.8	45%	0.451	42%	0.415	S	S	.	.	H	α-helix	trans	-62.5	-44.4	177.6	-68.8	165.7	0	0	0	111.4	D339 S340 E346 K347	D339-I343 WeakPolarHBondContact O-CG1 3.42Å; D339-I343 PolarHBondContact O-N 3.21Å; S340-I343 PolarHBondContact O-N 3.05Å; I343-E346 PolarHBondContact O-N 2.75Å; I343-K347 PolarHBondContact O-N 3.24Å
344	E	57.8	Low	58.5	Low	106 Å²	106	83.2 Å²	83.2	50%	0.495	42%	0.418	S	S	.	.	H	α-helix	trans	-66.2	-38.4	177.2	-70.8	-54.8	138.7	0	0	112	S340 I341 E346 K347 L348	S340-E344 PolarHBondContact O-N 3.03Å; I341-E344 PolarHBondContact O-N 3.06Å; E344-E346 VanDerWaalsContact C-N 3.31Å; E344-E346 PolarHBondContact O-N 3.48Å; E344-K347 WeakPolarHBondContact O-CB 3.31Å; E344-K347 PolarHBondContact O-N 2.8Å; E344-K347 IonicContact OE1-NZ 2.66Å; E344-K347 PolarHBondContact OE1-NZ 3.14Å; E344-K347 IonicContact OE2-NZ 3.72Å; E344-L348 PolarHBondContact O-N 3.45Å
345	S	49.5	Very low	58.1	Low	36 Å²	36	83 Å²	83	25%	0.252	42%	0.417	S	S	.	.	H	α-helix	trans	-60.1	-39.3	172	-179.5	0	0	0	0	112.3	I341 K342 L348 D349	I341-S345 WeakPolarHBondContact O-CB 2.98Å; I341-S345 PolarHBondContact O-N 3.41Å; K342-S345 WeakPolarHBondContact O-CB 3.48Å; K342-S345 PolarHBondContact O-N 3.22Å; S345-L348 PolarHBondContact O-N 3.43Å; S345-D349 PolarHBondContact O-N 3.29Å
346	E	63.5	Low	57.4	Low	106 Å²	106	84.7 Å²	84.7	50%	0.495	42%	0.417	S	S	.	.	H	α-helix	trans	-68	-34.3	176.4	-73.5	175.3	-169.6	0	0	112.2	K342 I343 E344 K350	K342-E346 WeakPolarHBondContact O-CG 3.34Å; K342-E346 PolarHBondContact O-N 2.99Å; I343-E346 PolarHBondContact O-N 2.75Å; E344-E346 VanDerWaalsContact C-N 3.31Å; E344-E346 PolarHBondContact O-N 3.48Å; E346-K350 PolarHBondContact O-N 3.43Å
347	K	58.6	Low	57.2	Low	94 Å²	94	89.5 Å²	89.5	41%	0.409	43%	0.429	S	S	.	.	H	α-helix	trans	-67.1	-44.4	172.7	-71.2	176.3	-173.2	168	0	111.5	I343 E344 D349 K350 Y351	I343-K347 PolarHBondContact O-N 3.24Å; E344-K347 WeakPolarHBondContact O-CB 3.31Å; E344-K347 PolarHBondContact O-N 2.8Å; E344-K347 IonicContact OE1-NZ 2.66Å; E344-K347 PolarHBondContact OE1-NZ 3.14Å; E344-K347 IonicContact OE2-NZ 3.72Å; K347-D349 VanDerWaalsContact C-N 3.29Å; K347-D349 PolarHBondContact O-N 3.29Å; K347-K350 WeakPolarHBondContact O-CB 3.48Å; K347-K350 PolarHBondContact O-N 3.48Å; K347-K350 VanDerWaalsContact O-N 3.13Å; K347-Y351 WeakPolarHBondContact O-CD2 3.42Å; K347-Y351 PolarHBondContact O-N 2.94Å; K347-Y351 VanDerWaalsContact O-N 3.08Å
348	L	48.3	Very low	56.8	Low	92 Å²	92	93.7 Å²	93.7	48%	0.482	44%	0.443	S	S	.	.	H	α-helix	trans	-58	-43.3	176.6	-170.3	73.2	0	0	0	110.9	E344 S345 K350 Y351 I352	E344-L348 PolarHBondContact O-N 3.45Å; S345-L348 PolarHBondContact O-N 3.43Å; L348-K350 VanDerWaalsContact C-N 3.32Å; L348-K350 PolarHBondContact O-N 3.1Å; L348-Y351 PolarHBondContact O-N 3.13Å; L348-Y351 VanDerWaalsContact O-N 3.17Å; L348-I352 HydrophobicContact CD2-CD1 4.4Å; L348-I352 HydrophobicContact CG-CD1 4Å; L348-I352 WeakPolarHBondContact O-CG1 3.23Å; L348-I352 PolarHBondContact O-N 3.25Å
349	D	55.3	Low	56.5	Low	43 Å²	43	91.6 Å²	91.6	23%	0.23	43%	0.434	C	S	.	.	H	α-helix	trans	-61.1	-39.5	176.4	-165.7	63.8	0	0	0	112.1	S345 K347 Y351 I352 Q353	S345-D349 PolarHBondContact O-N 3.29Å; K347-D349 VanDerWaalsContact C-N 3.29Å; K347-D349 PolarHBondContact O-N 3.29Å; D349-Y351 PolarHBondContact O-N 2.99Å; D349-I352 WeakPolarHBondContact O-CB 3.27Å; D349-I352 PolarHBondContact O-N 3.23Å; D349-Q353 VanDerWaalsContact O-CG 3.31Å; D349-Q353 WeakPolarHBondContact O-CG 3.49Å; D349-Q353 PolarHBondContact O-N 2.88Å; D349-Q353 PolarHBondContact OD2-NE2 3.24Å
350	K	63.9	Low	55.9	Low	142 Å²	142	91.8 Å²	91.8	62%	0.617	44%	0.435	S	S	*	.	H	α-helix	trans	-61.6	-42.6	173.5	-73.3	179.4	-176.8	173.7	0	112.7	E346 K347 L348 Q353 Q354	E346-K350 PolarHBondContact O-N 3.43Å; K347-K350 WeakPolarHBondContact O-CB 3.48Å; K347-K350 PolarHBondContact O-N 3.48Å; K347-K350 VanDerWaalsContact O-N 3.13Å; L348-K350 VanDerWaalsContact C-N 3.32Å; L348-K350 PolarHBondContact O-N 3.1Å; K350-Q353 PolarHBondContact O-N 2.84Å; K350-Q354 PolarHBondContact O-N 3.33Å
351	Y	51.4	Low	55.4	Low	146 Å²	146	90.5 Å²	90.5	57%	0.573	43%	0.431	S	S	*	.	H	α-helix	trans	-64	-42.9	175.7	-76.5	-67.4	0	0	0	111.6	K347 L348 D349 Q353 Q354 I355	K347-Y351 WeakPolarHBondContact O-CD2 3.42Å; K347-Y351 PolarHBondContact O-N 2.94Å; K347-Y351 VanDerWaalsContact O-N 3.08Å; L348-Y351 PolarHBondContact O-N 3.13Å; L348-Y351 VanDerWaalsContact O-N 3.17Å; D349-Y351 PolarHBondContact O-N 2.99Å; Y351-Q353 VanDerWaalsContact C-N 3.3Å; Y351-Q353 PolarHBondContact O-N 3.47Å; Y351-Q354 PolarHBondContact O-N 3Å; Y351-Q354 VanDerWaalsContact O-N 3.16Å; Y351-I355 WeakPolarHBondContact O-CG1 3.35Å; Y351-I355 PolarHBondContact O-N 2.86Å
352	I	50.8	Low	54.9	Low	17 Å²	17	88.8 Å²	88.8	9%	0.087	42%	0.423	C	S	.	.	H	α-helix	trans	-58.1	-43.9	174.7	-71.7	162.6	0	0	0	110.7	T12 L348 D349 I355 R356	T12-I352 HydrophobicContact CG2-CD1 4.15Å; L348-I352 HydrophobicContact CD2-CD1 4.4Å; L348-I352 HydrophobicContact CG-CD1 4Å; L348-I352 WeakPolarHBondContact O-CG1 3.23Å; L348-I352 PolarHBondContact O-N 3.25Å; D349-I352 WeakPolarHBondContact O-CB 3.27Å; D349-I352 PolarHBondContact O-N 3.23Å; I352-I355 PolarHBondContact O-N 3.47Å; I352-R356 WeakPolarHBondContact O-CG 3.2Å; I352-R356 PolarHBondContact O-N 3.33Å
353	Q	56.4	Low	54.1	Low	107 Å²	107	86.1 Å²	86.1	50%	0.5	41%	0.411	S	S	.	.	H	α-helix	trans	-64.1	-39.1	176.4	-71.2	-179.3	20.5	0	0	112.7	D349 K350 Y351 R356 K357	D349-Q353 VanDerWaalsContact O-CG 3.31Å; D349-Q353 WeakPolarHBondContact O-CG 3.49Å; D349-Q353 PolarHBondContact O-N 2.88Å; D349-Q353 PolarHBondContact OD2-NE2 3.24Å; K350-Q353 PolarHBondContact O-N 2.84Å; Y351-Q353 VanDerWaalsContact C-N 3.3Å; Y351-Q353 PolarHBondContact O-N 3.47Å; Q353-R356 PolarHBondContact O-N 2.89Å; Q353-K357 PolarHBondContact O-N 3.02Å
354	Q	54.9	Low	53.4	Low	122 Å²	122	90.1 Å²	90.1	57%	0.57	43%	0.425	S	S	*	.	H	α-helix	trans	-63.5	-45.2	174.6	-75.5	-177	-4.7	0	0	112.1	K350 Y351 R356 K357 Q358	K350-Q354 PolarHBondContact O-N 3.33Å; Y351-Q354 PolarHBondContact O-N 3Å; Y351-Q354 VanDerWaalsContact O-N 3.16Å; Q354-R356 VanDerWaalsContact C-N 3.35Å; Q354-R356 PolarHBondContact O-N 3Å; Q354-K357 WeakPolarHBondContact O-CB 3.37Å; Q354-K357 PolarHBondContact O-N 3.47Å; Q354-K357 VanDerWaalsContact O-N 3.15Å; Q354-Q358 PolarHBondContact O-N 3.47Å
355	I	51.5	Low	52.9	Low	57 Å²	57	90.2 Å²	90.2	29%	0.292	43%	0.433	S	S	.	.	H	α-helix	trans	-60.4	-45.8	175.9	-67.7	168.8	0	0	0	110.1	I232 Y351 I352 K357 Q358 L359	I232-I355 HydrophobicContact CD1-CD1 4.34Å; Y351-I355 WeakPolarHBondContact O-CG1 3.35Å; Y351-I355 PolarHBondContact O-N 2.86Å; I352-I355 PolarHBondContact O-N 3.47Å; I355-K357 VanDerWaalsContact C-N 3.28Å; I355-K357 PolarHBondContact O-N 3.4Å; I355-Q358 PolarHBondContact O-N 3.34Å; I355-L359 VanDerWaalsContact O-CB 3.23Å; I355-L359 WeakPolarHBondContact O-CB 3.35Å; I355-L359 PolarHBondContact O-N 2.88Å
356	R	53.4	Low	52.4	Low	92 Å²	92	93.6 Å²	93.6	35%	0.347	44%	0.443	S	S	.	.	H	α-helix	trans	-56.1	-42.9	175	-75	177.7	-174.2	178.6	6.2	111.6	I352 Q353 Q354 L359 L360	I352-R356 WeakPolarHBondContact O-CG 3.2Å; I352-R356 PolarHBondContact O-N 3.33Å; Q353-R356 PolarHBondContact O-N 2.89Å; Q354-R356 VanDerWaalsContact C-N 3.35Å; Q354-R356 PolarHBondContact O-N 3Å; R356-L359 PolarHBondContact O-N 3.41Å; R356-L360 WeakPolarHBondContact O-CB 3.15Å; R356-L360 WeakPolarHBondContact O-CD1 3.45Å; R356-L360 PolarHBondContact O-N 2.81Å
357	K	61.8	Low	51.5	Low	171 Å²	171	95.6 Å²	95.6	74%	0.743	46%	0.457	S	S	*	.	H	α-helix	trans	-65.3	-42.1	178.9	-168.4	179.1	179.3	-177.9	0	112.3	Q353 Q354 I355 L359 G361	Q353-K357 PolarHBondContact O-N 3.02Å; Q354-K357 WeakPolarHBondContact O-CB 3.37Å; Q354-K357 PolarHBondContact O-N 3.47Å; Q354-K357 VanDerWaalsContact O-N 3.15Å; I355-K357 VanDerWaalsContact C-N 3.28Å; I355-K357 PolarHBondContact O-N 3.4Å; K357-L359 VanDerWaalsContact C-N 3.33Å; K357-G361 PolarHBondContact O-N 3.19Å
358	Q	48.9	Very low	50.7	Low	136 Å²	136	95.3 Å²	95.3	64%	0.636	46%	0.46	S	S	*	.	H	α-helix	trans	-64.2	-40.4	174.5	-72.2	-179.7	-22.8	0	0	111.6	Q354 I355 G361 L362	Q354-Q358 PolarHBondContact O-N 3.47Å; I355-Q358 PolarHBondContact O-N 3.34Å; Q358-G361 WeakPolarHBondContact O-CA 3.42Å; Q358-G361 PolarHBondContact O-N 3.47Å; Q358-G361 VanDerWaalsContact O-N 3.14Å; Q358-L362 PolarHBondContact O-N 3.43Å
359	L	49.8	Very low	50	Low	12 Å²	12	96.4 Å²	96.4	6%	0.063	47%	0.473	C	S	.	.	H	α-helix	trans	-70.3	-39.3	-178.9	-159.2	134.1	0	0	0	112.3	M1 E5 I355 R356 K357 G361 L362 K363	M1-L359 HydrophobicContact CB-CD2 4.46Å; M1-L359 HydrophobicContact CE-CD1 4.34Å; M1-L359 HydrophobicContact CE-CD2 4.03Å; M1-L359 HydrophobicContact CE-CG 3.58Å; M1-L359 HydrophobicContact CG-CD1 4.49Å; M1-L359 HydrophobicContact CG-CD2 3.86Å; M1-L359 HydrophobicContact CG-CG 4.16Å; M1-L359 HydrophobicContact SD-CD2 3.72Å; M1-L359 HydrophobicContact SD-CG 3.98Å; E5-L359 VanDerWaalsContact CD-CD2 3.49Å; E5-L359 HydrophobicContact CG-CD2 3.38Å; E5-L359 WeakPolarHBondContact OE1-CD2 3.01Å; I355-L359 VanDerWaalsContact O-CB 3.23Å; I355-L359 WeakPolarHBondContact O-CB 3.35Å; I355-L359 PolarHBondContact O-N 2.88Å; R356-L359 PolarHBondContact O-N 3.41Å; K357-L359 VanDerWaalsContact C-N 3.33Å; L359-G361 VanDerWaalsContact C-N 3.29Å; L359-G361 PolarHBondContact O-N 2.8Å; L359-L362 PolarHBondContact O-N 2.92Å; L359-K363 PolarHBondContact O-N 3.39Å
360	L	55.1	Low	49.4	Very low	92 Å²	92	98.8 Å²	98.8	48%	0.482	49%	0.485	S	S	.	.	H	α-helix	trans	-61.9	-36.1	167.3	-91.6	146.2	0	0	0	112.2	R356 K363 K364	R356-L360 WeakPolarHBondContact O-CB 3.15Å; R356-L360 WeakPolarHBondContact O-CD1 3.45Å; R356-L360 PolarHBondContact O-N 2.81Å; L360-K363 PolarHBondContact O-N 3.33Å; L360-K364 PolarHBondContact O-N 2.84Å; L360-K364 VanDerWaalsContact O-N 3.08Å
361	G	49.3	Very low	47.8	Very low	35 Å²	35	97 Å²	97	36%	0.361	49%	0.491	S	S	.	.	H	α-helix	trans	-58	-51.3	171.2	0	0	0	0	0	111.6	K357 Q358 L359 K363 K364 T365	K357-G361 PolarHBondContact O-N 3.19Å; Q358-G361 WeakPolarHBondContact O-CA 3.42Å; Q358-G361 PolarHBondContact O-N 3.47Å; Q358-G361 VanDerWaalsContact O-N 3.14Å; L359-G361 VanDerWaalsContact C-N 3.29Å; L359-G361 PolarHBondContact O-N 2.8Å; G361-K363 PolarHBondContact O-N 2.88Å; G361-K364 PolarHBondContact O-N 3.45Å; G361-T365 PolarHBondContact O-N 2.74Å; G361-T365 VanDerWaalsContact O-N 3.11Å; G361-T365 PolarHBondContact O-OG1 2.75Å
362	L	43.6	Very low	46.7	Very low	51 Å²	51	98.3 Å²	98.3	27%	0.267	51%	0.507	S	S	.	.	H	α-helix	trans	-62	-42.4	174.9	-116.5	92.7	0	0	0	112.4	M1 W225 Q358 L359 K364 T365 F366	M1-L362 HydrophobicContact CE-CB 3.33Å; M1-L362 HydrophobicContact CE-CD2 3.58Å; M1-L362 HydrophobicContact CE-CG 4.09Å; W225-L362 HydrophobicContact CZ2-CD1 4.22Å; W225-L362 HydrophobicContact CZ2-CD2 4.08Å; Q358-L362 PolarHBondContact O-N 3.43Å; L359-L362 PolarHBondContact O-N 2.92Å; L362-K364 PolarHBondContact O-N 2.73Å; L362-T365 CarbonylContact O-C 3.58Å; L362-T365 WeakPolarHBondContact O-CA 3.36Å; L362-T365 WeakPolarHBondContact O-CB 3.36Å; L362-T365 PolarHBondContact O-N 2.72Å; L362-F366 HydrophobicContact CB-CD2 4.44Å; L362-F366 HydrophobicContact CD2-CD2 4.08Å; L362-F366 HydrophobicContact CD2-CE2 3.74Å; L362-F366 HydrophobicContact CG-CD2 4.12Å; L362-F366 HydrophobicContact CG-CE2 3.89Å; L362-F366 VanDerWaalsContact O-CD2 3.27Å; L362-F366 WeakPolarHBondContact O-CD2 3.35Å; L362-F366 PolarHBondContact O-N 3.18Å
363	K	46.1	Very low	45.5	Very low	64 Å²	64	103.1 Å²	103.1	28%	0.278	53%	0.532	S	S	.	.	H	α-helix	trans	-58	-39.8	179.1	-172.6	-179.2	179.4	-179.4	0	111.1	M1 L359 L360 G361 F366 D367 D370	M1-K363 HydrophobicContact SD-CB 4.11Å; L359-K363 PolarHBondContact O-N 3.39Å; L360-K363 PolarHBondContact O-N 3.33Å; G361-K363 PolarHBondContact O-N 2.88Å; K363-F366 PolarHBondContact O-N 3.09Å; K363-D367 PolarHBondContact O-N 3.08Å; K363-D367 VanDerWaalsContact O-N 3.07Å; K363-D370 IonicContact NZ-OD1 2.75Å
364	K	51.2	Low	44.1	Very low	171 Å²	171	103.3 Å²	103.3	74%	0.743	54%	0.544	S	S	*	.	H	α-helix	trans	-67.4	-33.4	172.3	-73.8	-173.7	-178.8	-173.4	0	112.9	L360 G361 L362 F366	L360-K364 PolarHBondContact O-N 2.84Å; L360-K364 VanDerWaalsContact O-N 3.08Å; G361-K364 PolarHBondContact O-N 3.45Å; L362-K364 PolarHBondContact O-N 2.73Å; K364-F366 VanDerWaalsContact C-N 3.29Å
365	T	47.1	Very low	42.8	Very low	109 Å²	109	102 Å²	102	67%	0.669	55%	0.547	S	S	*	.	H	α-helix	trans	-67.3	-30.5	174.9	-50.4	0	0	0	0	112.4	G361 L362	G361-T365 PolarHBondContact O-N 2.74Å; G361-T365 VanDerWaalsContact O-N 3.11Å; G361-T365 PolarHBondContact O-OG1 2.75Å; L362-T365 CarbonylContact O-C 3.58Å; L362-T365 WeakPolarHBondContact O-CA 3.36Å; L362-T365 WeakPolarHBondContact O-CB 3.36Å; L362-T365 PolarHBondContact O-N 2.72Å
366	F	39.8	Very low	41.9	Very low	107 Å²	107	106.3 Å²	106.3	47%	0.469	57%	0.571	S	S	.	*	H	α-helix	trans	-110.6	-0.2	-171.3	-71.7	-71.2	0	0	0	116.1	L362 K363 K364 L368	L362-F366 HydrophobicContact CB-CD2 4.44Å; L362-F366 HydrophobicContact CD2-CD2 4.08Å; L362-F366 HydrophobicContact CD2-CE2 3.74Å; L362-F366 HydrophobicContact CG-CD2 4.12Å; L362-F366 HydrophobicContact CG-CE2 3.89Å; L362-F366 VanDerWaalsContact O-CD2 3.27Å; L362-F366 WeakPolarHBondContact O-CD2 3.35Å; L362-F366 PolarHBondContact O-N 3.18Å; K363-F366 PolarHBondContact O-N 3.09Å; K364-F366 VanDerWaalsContact C-N 3.29Å; F366-L368 HydrophobicContact CB-CD1 4.03Å; F366-L368 HydrophobicContact CB-CG 3.91Å; F366-L368 PolarHBondContact O-N 3.14Å
367	D	44.8	Very low	41	Very low	147 Å²	147	106.3 Å²	106.3	79%	0.786	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	39.9	44.5	177.6	-99.2	-10.1	0	0	0	114.6	K363 P369	K363-D367 PolarHBondContact O-N 3.08Å; K363-D367 VanDerWaalsContact O-N 3.07Å; D367-P369 WeakPolarHBondContact O-CD 3.38Å
368	L	40.3	Very low	39.8	Very low	89 Å²	89	100.7 Å²	100.7	47%	0.466	57%	0.572	S	S	.	*			trans	-74.1	125	-171.8	-72.2	162.7	0	0	0	112.6	F366	F366-L368 HydrophobicContact CB-CD1 4.03Å; F366-L368 HydrophobicContact CB-CG 3.91Å; F366-L368 PolarHBondContact O-N 3.14Å
369	P	34.4	Very low	39.6	Very low	115 Å²	115	97.8 Å²	97.8	75%	0.747	57%	0.567	S	S	*	*			trans	-80.5	160.8	-178.2	29.5	-32.5	0	0	0	114.6	D367	D367-P369 WeakPolarHBondContact O-CD 3.38Å
370	D	42.1	Very low	39.4	Very low	93 Å²	93	101.2 Å²	101.2	50%	0.497	58%	0.582	S	S	.	*			trans	-98.7	3.6	-152.4	-100.8	14.2	0	0	0	116.8	K2 K363	K2-D370 VanDerWaalsContact CE-CG 3.43Å; K2-D370 WeakPolarHBondContact CE-OD1 3.4Å; K2-D370 VanDerWaalsContact NZ-CB 3.34Å; K2-D370 PolarHBondContact NZ-O 2.84Å; K2-D370 IonicContact NZ-OD1 3.94Å; K2-D370 PolarHBondContact NZ-OD1 3.25Å; K2-D370 IonicContact NZ-OD2 3.57Å; K2-D370 PolarHBondContact NZ-OD2 2.84Å; K363-D370 IonicContact NZ-OD1 2.75Å
371	S	31.1	Very low	39	Very low	105 Å²	105	104 Å²	104	73%	0.734	60%	0.597	S	S	*	*			trans	-106.9	72.2	-164.3	60.7	0	0	0	0	115.9
372	L	27.5	Very low	39	Very low	173 Å²	173	109 Å²	109	91%	0.906	61%	0.611	S	S	*	*			trans	-148.5	86.3	164.1	-83.7	167.6	0	0	0	108.9
373	I	26.4	Very low	39.4	Very low	118 Å²	118	110.8 Å²	110.8	61%	0.605	62%	0.618	S	S	*	*			trans	-140.1	104	177.8	-56.4	174.2	0	0	0	108.1
374	S	26.1	Very low	39.5	Very low	110 Å²	110	110 Å²	110	77%	0.769	62%	0.616	S	S	*	*			trans	-176.6	149.4	148.6	60.1	0	0	0	0	114
375	C	29.4	Very low	40.1	Very low	94 Å²	94	105.3 Å²	105.3	64%	0.635	60%	0.6	S	S	*	*			trans	101.3	103.7	151.2	-65.3	0	0	0	0	122	Q87	Q87-C375 PolarHBondContact OE1-O 3.39Å
376	D	31.1	Very low	40.8	Very low	148 Å²	148	100.9 Å²	100.9	79%	0.791	57%	0.573	S	S	*	*				39.7	131.2	127.6	-53.5	-25.7	0	0	0	123.6	Q87	Q87-D376 PolarHBondContact NE2-O 3.04Å
377	A	34.9	Very low	42.1	Very low	92 Å²	92	101.5 Å²	101.5	76%	0.76	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-100.3	150.3	-162.8	0	0	0	0	0	116.6
378	P	37.6	Very low	42.7	Very low	53 Å²	53	99.9 Å²	99.9	34%	0.344	57%	0.565	S	S	.	*	P	Polyproline II helix	trans	-100.7	169.7	177.6	19.2	1	0	0	0	114.9	Q87 Q383	Q87-P378 HydrophobicContact CG-CG 3.97Å; P378-Q383 PolarHBondContact O-NE2 3.28Å; P378-Q383 VanDerWaalsContact O-NE2 3.14Å
379	S	43.5	Very low	43.3	Very low	76 Å²	76	97.2 Å²	97.2	53%	0.531	55%	0.55	S	S	.	*	P	Polyproline II helix	trans	-81.3	159.3	-164.1	62.1	0	0	0	0	117.6	L381 E382	S379-L381 PolarHBondContact O-N 2.71Å; S379-E382 PolarHBondContact O-N 3.32Å
380	H	45.4	Very low	44.4	Very low	84 Å²	84	96.9 Å²	96.9	39%	0.389	53%	0.534	S	S	.	.	G	3₁₀ helix	trans	-56	-39.7	-173.6	-175.7	-87.9	0	0	0	116.4	E382 Q383	H380-E382 VanDerWaalsContact C-N 3.25Å; H380-E382 PolarHBondContact O-N 3.22Å; H380-Q383 WeakPolarHBondContact O-CB 3.17Å; H380-Q383 PolarHBondContact O-N 3.06Å
381	L	46.7	Very low	45.3	Very low	149 Å²	149	99.9 Å²	99.9	78%	0.78	54%	0.543	S	S	*	.	G	3₁₀ helix	trans	-65.3	-25	-178	-85.4	159.1	0	0	0	113.7	S379 Q383	S379-L381 PolarHBondContact O-N 2.71Å; L381-Q383 VanDerWaalsContact C-N 3.33Å
382	E	50.6	Low	46.4	Very low	140 Å²	140	97.6 Å²	97.6	65%	0.654	53%	0.527	S	S	*	.	G	3₁₀ helix	trans	-79.8	-18.2	174.6	-68.1	-177.7	155.4	0	0	112.4	S379 H380	S379-E382 PolarHBondContact O-N 3.32Å; H380-E382 VanDerWaalsContact C-N 3.25Å; H380-E382 PolarHBondContact O-N 3.22Å
383	Q	50.4	Low	47.4	Very low	90 Å²	90	93 Å²	93	42%	0.421	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-31.6	-171.7	-61.8	177.6	5.2	0	0	113.2	P378 H380 L381	P378-Q383 PolarHBondContact O-NE2 3.28Å; P378-Q383 VanDerWaalsContact O-NE2 3.14Å; H380-Q383 WeakPolarHBondContact O-CB 3.17Å; H380-Q383 PolarHBondContact O-N 3.06Å; L381-Q383 VanDerWaalsContact C-N 3.33Å
384	L	49.9	Very low	48.3	Very low	46 Å²	46	97.2 Å²	97.2	24%	0.241	51%	0.506	C	S	.	.			trans	-117.7	60.2	-176	-80.5	162.2	0	0	0	111.8	P386 I412 N413	L384-P386 WeakPolarHBondContact O-CD 3.46Å; L384-I412 HydrophobicContact CD1-CG2 4.07Å; L384-N413 PolarHBondContact O-ND2 3.34Å
385	N	62.7	Low	49.2	Very low	74 Å²	74	95.6 Å²	95.6	40%	0.396	51%	0.506	S	S	.	.			trans	-90.9	114.2	172.1	-172.5	-20.1	0	0	0	110.7	E387 H388 I389	N385-E387 PolarHBondContact O-N 3.05Å; N385-E387 WeakPolarHBondContact OD1-CB 3.08Å; N385-E387 PolarHBondContact OD1-N 3.4Å; N385-H388 HydrophobicContact CB-CB 3.88Å; N385-H388 WeakPolarHBondContact O-CB 3.49Å; N385-H388 PolarHBondContact O-N 3.42Å; N385-I389 PolarHBondContact O-N 3.36Å
386	P	62.1	Low	49.7	Very low	16 Å²	16	97.8 Å²	97.8	10%	0.104	51%	0.511	C	S	.	.	H	α-helix	trans	-56.4	-36.6	179.4	-17.4	26.2	0	0	0	113	L384 I389 R390 V406 C409 N410	L384-P386 WeakPolarHBondContact O-CD 3.46Å; P386-I389 PolarHBondContact O-N 2.99Å; P386-R390 WeakPolarHBondContact O-CB 3.28Å; P386-R390 PolarHBondContact O-N 3.05Å; P386-V406 HydrophobicContact CB-CG1 4.01Å; P386-C409 HydrophobicContact CB-CB 4.46Å; P386-C409 HydrophobicContact CG-CB 4.3Å; P386-N410 WeakPolarHBondContact CG-OD1 3.42Å
387	E	66.4	Low	50.3	Low	120 Å²	120	93.3 Å²	93.3	56%	0.561	49%	0.491	S	S	*	.	H	α-helix	trans	-69.7	-33.4	177.9	-69.1	-62.3	153.9	0	0	112.2	N385 R390 F391	N385-E387 PolarHBondContact O-N 3.05Å; N385-E387 WeakPolarHBondContact OD1-CB 3.08Å; N385-E387 PolarHBondContact OD1-N 3.4Å; E387-R390 PolarHBondContact O-N 2.95Å; E387-F391 VanDerWaalsContact O-CB 3.32Å; E387-F391 WeakPolarHBondContact O-CB 3.33Å; E387-F391 PolarHBondContact O-N 3.43Å
388	H	58.7	Low	51.4	Low	113 Å²	113	92.2 Å²	92.2	52%	0.523	48%	0.477	S	S	.	.	H	α-helix	trans	-70.1	-36.7	177.4	-170.2	-162.8	0	0	0	111.5	N385 F391 S392	N385-H388 HydrophobicContact CB-CB 3.88Å; N385-H388 WeakPolarHBondContact O-CB 3.49Å; N385-H388 PolarHBondContact O-N 3.42Å; H388-F391 PolarHBondContact O-N 3.06Å; H388-S392 PolarHBondContact CD2-OG 2.8Å; H388-S392 VanDerWaalsContact O-CB 3.26Å; H388-S392 WeakPolarHBondContact O-CB 3.4Å; H388-S392 PolarHBondContact O-N 3.15Å; H388-S392 PolarHBondContact O-OG 3.29Å
389	I	52.9	Low	52.7	Low	33 Å²	33	94.8 Å²	94.8	17%	0.169	49%	0.492	C	S	.	.	H	α-helix	trans	-66.6	-47	173.8	-66.3	169.4	0	0	0	109.9	N385 P386 F391 S392 W393 C409	N385-I389 PolarHBondContact O-N 3.36Å; P386-I389 PolarHBondContact O-N 2.99Å; I389-F391 VanDerWaalsContact C-N 3.27Å; I389-F391 PolarHBondContact O-N 3.26Å; I389-S392 PolarHBondContact O-N 2.99Å; I389-W393 HydrophobicContact CG2-CD2 3.95Å; I389-W393 HydrophobicContact CG2-CE3 4.13Å; I389-W393 HydrophobicContact CG2-CG 4.39Å; I389-W393 HydrophobicContact CG2-CZ2 4.43Å; I389-W393 HydrophobicContact CG2-CZ3 4.46Å; I389-W393 WeakPolarHBondContact O-CB 3.44Å; I389-W393 PolarHBondContact O-N 2.93Å; I389-C409 HydrophobicContact CD1-CB 4.36Å; I389-C409 WeakPolarHBondContact CD1-SG 2.86Å
390	R	57.6	Low	53.6	Low	108 Å²	108	98.6 Å²	98.6	41%	0.408	50%	0.502	S	S	.	.	H	α-helix	trans	-58.8	-39	176.7	-157.8	177.9	-150.9	165.6	8.9	112.4	P386 E387 R394 T402 D403 V406	P386-R390 WeakPolarHBondContact O-CB 3.28Å; P386-R390 PolarHBondContact O-N 3.05Å; E387-R390 PolarHBondContact O-N 2.95Å; R390-R394 PolarHBondContact O-N 3.47Å; R390-T402 HydrophobicContact CG-CG2 4.13Å; R390-D403 IonicContact CZ-OD1 2.68Å; R390-D403 IonicContact NE-OD1 3.31Å; R390-D403 IonicContact NH2-OD1 3Å; R390-D403 PolarHBondContact NH2-OD1 2.98Å; R390-V406 HydrophobicContact CB-CG2 3.96Å; R390-V406 HydrophobicContact CG-CG2 4.26Å
391	F	59.8	Low	54	Low	156 Å²	156	98.2 Å²	98.2	68%	0.684	50%	0.502	S	S	*	.	H	α-helix	trans	-71	-45.8	176.4	-173.7	-95.9	0	0	0	112.3	E387 H388 I389 W393 R394	E387-F391 VanDerWaalsContact O-CB 3.32Å; E387-F391 WeakPolarHBondContact O-CB 3.33Å; E387-F391 PolarHBondContact O-N 3.43Å; H388-F391 PolarHBondContact O-N 3.06Å; I389-F391 VanDerWaalsContact C-N 3.27Å; I389-F391 PolarHBondContact O-N 3.26Å; F391-W393 VanDerWaalsContact C-N 3.32Å; F391-W393 PolarHBondContact O-N 3.32Å; F391-R394 WeakPolarHBondContact O-CB 3.42Å; F391-R394 PolarHBondContact O-N 3.07Å
392	S	54	Low	54.6	Low	56 Å²	56	91.5 Å²	91.5	39%	0.392	47%	0.468	S	S	.	.	H	α-helix	trans	-68	-30.4	-177.2	-59.6	0	0	0	0	113.1	H388 I389	H388-S392 PolarHBondContact CD2-OG 2.8Å; H388-S392 VanDerWaalsContact O-CB 3.26Å; H388-S392 WeakPolarHBondContact O-CB 3.4Å; H388-S392 PolarHBondContact O-N 3.15Å; H388-S392 PolarHBondContact O-OG 3.29Å; I389-S392 PolarHBondContact O-N 2.99Å
393	W	49.7	Very low	55.6	Low	77 Å²	77	87.7 Å²	87.7	29%	0.292	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-1.6	-176.8	-67.7	8.9	0	0	0	113.6	I389 F391 G395 L396 C397 L401 T402 F405	I389-W393 HydrophobicContact CG2-CD2 3.95Å; I389-W393 HydrophobicContact CG2-CE3 4.13Å; I389-W393 HydrophobicContact CG2-CG 4.39Å; I389-W393 HydrophobicContact CG2-CZ2 4.43Å; I389-W393 HydrophobicContact CG2-CZ3 4.46Å; I389-W393 WeakPolarHBondContact O-CB 3.44Å; I389-W393 PolarHBondContact O-N 2.93Å; F391-W393 VanDerWaalsContact C-N 3.32Å; F391-W393 PolarHBondContact O-N 3.32Å; W393-G395 PolarHBondContact O-N 3.14Å; W393-L396 PolarHBondContact O-N 3.35Å; W393-C397 PolarHBondContact O-N 3.44Å; W393-L401 HydrophobicContact CZ3-CD2 4.35Å; W393-T402 HydrophobicContact CB-CG2 4.29Å; W393-F405 HydrophobicContact CE3-CB 4.46Å; W393-F405 HydrophobicContact CH2-CB 4.2Å; W393-F405 AromaticContact CH2-CD1 3.61Å; W393-F405 HydrophobicContact CH2-CD1 3.61Å; W393-F405 AromaticContact CH2-CD2 3.87Å; W393-F405 HydrophobicContact CH2-CD2 3.87Å; W393-F405 AromaticContact CH2-CE1 3.81Å; W393-F405 HydrophobicContact CH2-CE1 3.81Å; W393-F405 HydrophobicContact CH2-CE2 4.04Å; W393-F405 AromaticContact CH2-CG 3.63Å; W393-F405 HydrophobicContact CH2-CG 3.63Å; W393-F405 HydrophobicContact CH2-CZ 4.01Å; W393-F405 HydrophobicContact CZ3-CB 3.68Å; W393-F405 AromaticContact CZ3-CD1 3.91Å; W393-F405 HydrophobicContact CZ3-CD1 3.91Å; W393-F405 AromaticContact CZ3-CD2 3.44Å; W393-F405 HydrophobicContact CZ3-CD2 3.44Å; W393-F405 VanDerWaalsContact CZ3-CD2 3.44Å; W393-F405 HydrophobicContact CZ3-CE1 4.37Å; W393-F405 AromaticContact CZ3-CE2 3.94Å; W393-F405 HydrophobicContact CZ3-CE2 3.94Å; W393-F405 AromaticContact CZ3-CG 3.39Å; W393-F405 HydrophobicContact CZ3-CG 3.39Å; W393-F405 HydrophobicContact CZ3-CZ 4.38Å
394	R	44	Very low	56.4	Low	207 Å²	207	89.4 Å²	89.4	78%	0.781	46%	0.463	S	S	*	.	B	Isolated β-bridge	trans	-59.8	111.3	178	-160.9	177	-170.8	178.4	3.5	109.9	R390 F391	R390-R394 PolarHBondContact O-N 3.47Å; F391-R394 WeakPolarHBondContact O-CB 3.42Å; F391-R394 PolarHBondContact O-N 3.07Å
395	G	46.5	Very low	56.8	Low	75 Å²	75	92 Å²	92	77%	0.773	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.5	-6.9	-179	0	0	0	0	0	115.6	W393	W393-G395 PolarHBondContact O-N 3.14Å
396	L	39.5	Very low	57.2	Low	140 Å²	140	88.9 Å²	88.9	73%	0.733	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-27.8	174.5	-69.4	173	0	0	0	112.8	W393	W393-L396 PolarHBondContact O-N 3.35Å
397	C	43.7	Very low	57.6	Low	54 Å²	54	92.7 Å²	92.7	37%	0.365	48%	0.475	S	S	.	.	B	Isolated β-bridge	trans	-129.9	159.3	-178.5	-66.9	0	0	0	0	110.5	W393 L401	W393-C397 PolarHBondContact O-N 3.44Å; C397-L401 HydrophobicContact CB-CD2 4.25Å
398	S	58.5	Low	57.5	Low	69 Å²	69	89 Å²	89	48%	0.483	47%	0.465	S	S	.	.			trans	-59.3	148.9	169.6	64.3	0	0	0	0	110	E400 L401 T402	S398-E400 PolarHBondContact O-N 3.5Å; S398-L401 PolarHBondContact O-N 2.83Å; S398-L401 WeakPolarHBondContact OG-CB 3.49Å; S398-L401 PolarHBondContact OG-N 2.9Å; S398-T402 PolarHBondContact O-N 2.91Å; S398-T402 PolarHBondContact O-OG1 3.37Å
399	T	63.4	Low	57.7	Low	108 Å²	108	84 Å²	84	66%	0.663	44%	0.443	S	S	*	.	H	α-helix	trans	-56.6	-39.7	176.2	42.6	0	0	0	0	111.4	L401 T402 D403	T399-L401 PolarHBondContact O-N 3.33Å; T399-T402 PolarHBondContact O-N 3.38Å; T399-D403 WeakPolarHBondContact O-CB 3.42Å; T399-D403 VanDerWaalsContact O-CG 3.24Å; T399-D403 PolarHBondContact O-N 2.99Å
400	E	63.3	Low	58.7	Low	155 Å²	155	86.1 Å²	86.1	72%	0.724	46%	0.455	S	S	*	.	H	α-helix	trans	-59.3	-42.8	177.4	-66.2	174.4	177.3	0	0	112.9	S398 L404	S398-E400 PolarHBondContact O-N 3.5Å; E400-L404 WeakPolarHBondContact O-CB 3.38Å; E400-L404 PolarHBondContact O-N 3.15Å; E400-L404 VanDerWaalsContact O-N 3.11Å
401	L	54	Low	59.2	Low	76 Å²	76	86.4 Å²	86.4	40%	0.398	46%	0.464	S	S	.	.	H	α-helix	trans	-75.2	-35.8	-179.8	-163.1	137.4	0	0	0	111.4	W393 C397 S398 T399 L404 F405	W393-L401 HydrophobicContact CZ3-CD2 4.35Å; C397-L401 HydrophobicContact CB-CD2 4.25Å; S398-L401 PolarHBondContact O-N 2.83Å; S398-L401 WeakPolarHBondContact OG-CB 3.49Å; S398-L401 PolarHBondContact OG-N 2.9Å; T399-L401 PolarHBondContact O-N 3.33Å; L401-L404 PolarHBondContact O-N 3.32Å; L401-F405 HydrophobicContact CD2-CD2 3.85Å; L401-F405 HydrophobicContact CD2-CE2 3.81Å; L401-F405 HydrophobicContact CG-CD2 4.41Å; L401-F405 HydrophobicContact CG-CE2 4.44Å; L401-F405 WeakPolarHBondContact O-CD2 3.27Å; L401-F405 PolarHBondContact O-N 3.23Å; L401-F405 VanDerWaalsContact O-N 3.15Å
402	T	58.6	Low	59.2	Low	9 Å²	9	82.5 Å²	82.5	6%	0.055	45%	0.45	C	S	.	.	H	α-helix	trans	-62.7	-45.4	174.2	-51.5	0	0	0	0	110.8	R390 W393 S398 T399 F405 V406	R390-T402 HydrophobicContact CG-CG2 4.13Å; W393-T402 HydrophobicContact CB-CG2 4.29Å; S398-T402 PolarHBondContact O-N 2.91Å; S398-T402 PolarHBondContact O-OG1 3.37Å; T399-T402 PolarHBondContact O-N 3.38Å; T402-F405 PolarHBondContact O-N 3.46Å; T402-V406 VanDerWaalsContact O-CG2 3.27Å; T402-V406 WeakPolarHBondContact O-CG2 3.39Å; T402-V406 PolarHBondContact O-N 2.64Å
403	D	72.5	Confident	60	Low	60 Å²	60	81.4 Å²	81.4	32%	0.321	44%	0.44	S	S	.	.	H	α-helix	trans	-64.9	-40.8	178.5	-69.2	-25.9	0	0	0	111.3	R390 T399 F405 V406 D407	R390-D403 IonicContact CZ-OD1 2.68Å; R390-D403 IonicContact NE-OD1 3.31Å; R390-D403 IonicContact NH2-OD1 3Å; R390-D403 PolarHBondContact NH2-OD1 2.98Å; T399-D403 WeakPolarHBondContact O-CB 3.42Å; T399-D403 VanDerWaalsContact O-CG 3.24Å; T399-D403 PolarHBondContact O-N 2.99Å; D403-F405 VanDerWaalsContact C-N 3.31Å; D403-F405 PolarHBondContact O-N 3.01Å; D403-V406 PolarHBondContact O-N 2.89Å; D403-D407 PolarHBondContact O-N 3.36Å
404	L	65.8	Low	60.8	Low	125 Å²	125	79.1 Å²	79.1	65%	0.654	44%	0.44	S	S	*	.	H	α-helix	trans	-58.5	-39.5	175	-126	151.2	0	0	0	112.9	E400 L401 A408	E400-L404 WeakPolarHBondContact O-CB 3.38Å; E400-L404 PolarHBondContact O-N 3.15Å; E400-L404 VanDerWaalsContact O-N 3.11Å; L401-L404 PolarHBondContact O-N 3.32Å; L404-A408 PolarHBondContact O-N 2.94Å; L404-A408 VanDerWaalsContact O-N 3.11Å
405	F	58.3	Low	61.5	Low	101 Å²	101	74 Å²	74	44%	0.443	43%	0.428	S	S	.	.	H	α-helix	trans	-74.9	-36.6	176.3	-93	-88.3	0	0	0	112.9	W393 L401 T402 D403 D407 A408 C409	W393-F405 HydrophobicContact CE3-CB 4.46Å; W393-F405 HydrophobicContact CH2-CB 4.2Å; W393-F405 AromaticContact CH2-CD1 3.61Å; W393-F405 HydrophobicContact CH2-CD1 3.61Å; W393-F405 AromaticContact CH2-CD2 3.87Å; W393-F405 HydrophobicContact CH2-CD2 3.87Å; W393-F405 AromaticContact CH2-CE1 3.81Å; W393-F405 HydrophobicContact CH2-CE1 3.81Å; W393-F405 HydrophobicContact CH2-CE2 4.04Å; W393-F405 AromaticContact CH2-CG 3.63Å; W393-F405 HydrophobicContact CH2-CG 3.63Å; W393-F405 HydrophobicContact CH2-CZ 4.01Å; W393-F405 HydrophobicContact CZ3-CB 3.68Å; W393-F405 AromaticContact CZ3-CD1 3.91Å; W393-F405 HydrophobicContact CZ3-CD1 3.91Å; W393-F405 AromaticContact CZ3-CD2 3.44Å; W393-F405 HydrophobicContact CZ3-CD2 3.44Å; W393-F405 VanDerWaalsContact CZ3-CD2 3.44Å; W393-F405 HydrophobicContact CZ3-CE1 4.37Å; W393-F405 AromaticContact CZ3-CE2 3.94Å; W393-F405 HydrophobicContact CZ3-CE2 3.94Å; W393-F405 AromaticContact CZ3-CG 3.39Å; W393-F405 HydrophobicContact CZ3-CG 3.39Å; W393-F405 HydrophobicContact CZ3-CZ 4.38Å; L401-F405 HydrophobicContact CD2-CD2 3.85Å; L401-F405 HydrophobicContact CD2-CE2 3.81Å; L401-F405 HydrophobicContact CG-CD2 4.41Å; L401-F405 HydrophobicContact CG-CE2 4.44Å; L401-F405 WeakPolarHBondContact O-CD2 3.27Å; L401-F405 PolarHBondContact O-N 3.23Å; L401-F405 VanDerWaalsContact O-N 3.15Å; T402-F405 PolarHBondContact O-N 3.46Å; D403-F405 VanDerWaalsContact C-N 3.31Å; D403-F405 PolarHBondContact O-N 3.01Å; F405-D407 VanDerWaalsContact C-N 3.32Å; F405-A408 PolarHBondContact O-N 3.39Å; F405-C409 PolarHBondContact O-N 2.89Å; F405-C409 PolarHBondContact O-SG 2.92Å
406	V	71.8	Confident	62.1	Low	9 Å²	9	72.3 Å²	72.3	6%	0.055	40%	0.402	C	S	.	.	H	α-helix	trans	-61	-44.3	173.5	166	0	0	0	0	110.2	P386 R390 T402 D403 C409 N410	P386-V406 HydrophobicContact CB-CG1 4.01Å; R390-V406 HydrophobicContact CB-CG2 3.96Å; R390-V406 HydrophobicContact CG-CG2 4.26Å; T402-V406 VanDerWaalsContact O-CG2 3.27Å; T402-V406 WeakPolarHBondContact O-CG2 3.39Å; T402-V406 PolarHBondContact O-N 2.64Å; D403-V406 PolarHBondContact O-N 2.89Å; V406-C409 PolarHBondContact O-N 3.03Å; V406-N410 PolarHBondContact O-N 3.37Å; V406-N410 PolarHBondContact O-ND2 2.83Å
407	D	71.6	Confident	63.5	Low	95 Å²	95	70.7 Å²	70.7	51%	0.508	39%	0.391	S	S	.	.	H	α-helix	trans	-62.4	-46	176	-71.1	-17.4	0	0	0	111.3	D403 F405 C409 N410 D411	D403-D407 PolarHBondContact O-N 3.36Å; F405-D407 VanDerWaalsContact C-N 3.32Å; D407-C409 VanDerWaalsContact C-N 3.29Å; D407-C409 PolarHBondContact O-N 2.97Å; D407-N410 WeakPolarHBondContact O-CB 3.49Å; D407-N410 PolarHBondContact O-N 3.47Å; D407-N410 VanDerWaalsContact O-N 3.13Å; D407-D411 PolarHBondContact O-N 3.47Å
408	A	63.8	Low	64.6	Low	42 Å²	42	73.9 Å²	73.9	35%	0.347	40%	0.401	S	S	.	.	H	α-helix	trans	-60.5	-36	175.4	0	0	0	0	0	113	L404 F405 D411 I412	L404-A408 PolarHBondContact O-N 2.94Å; L404-A408 VanDerWaalsContact O-N 3.11Å; F405-A408 PolarHBondContact O-N 3.39Å; A408-D411 PolarHBondContact O-N 3.11Å; A408-I412 WeakPolarHBondContact O-CD1 3.35Å; A408-I412 VanDerWaalsContact O-CG1 3.25Å; A408-I412 WeakPolarHBondContact O-CG1 3.48Å; A408-I412 PolarHBondContact O-N 3.46Å
409	C	63.2	Low	64.4	Low	9 Å²	9	75.8 Å²	75.8	6%	0.061	41%	0.405	C	S	.	.	H	α-helix	trans	-70.1	-38	175.6	-66.6	0	0	0	0	112.1	P386 I389 F405 V406 D407 D411 I412 N413	P386-C409 HydrophobicContact CB-CB 4.46Å; P386-C409 HydrophobicContact CG-CB 4.3Å; I389-C409 HydrophobicContact CD1-CB 4.36Å; I389-C409 WeakPolarHBondContact CD1-SG 2.86Å; F405-C409 PolarHBondContact O-N 2.89Å; F405-C409 PolarHBondContact O-SG 2.92Å; V406-C409 PolarHBondContact O-N 3.03Å; D407-C409 VanDerWaalsContact C-N 3.29Å; D407-C409 PolarHBondContact O-N 2.97Å; C409-D411 VanDerWaalsContact C-N 3.34Å; C409-I412 PolarHBondContact O-N 2.66Å; C409-N413 WeakPolarHBondContact O-CB 3.47Å; C409-N413 VanDerWaalsContact O-CG 3.29Å; C409-N413 PolarHBondContact O-N 3.36Å; C409-N413 PolarHBondContact O-ND2 3.41Å
410	N	73.1	Confident	64.6	Low	78 Å²	78	75 Å²	75	42%	0.417	40%	0.397	S	S	.	.	H	α-helix	trans	-62.8	-42.2	172.9	-72.9	-36.4	0	0	0	111.3	P386 V406 D407 N413 G414	P386-N410 WeakPolarHBondContact CG-OD1 3.42Å; V406-N410 PolarHBondContact O-N 3.37Å; V406-N410 PolarHBondContact O-ND2 2.83Å; D407-N410 WeakPolarHBondContact O-CB 3.49Å; D407-N410 PolarHBondContact O-N 3.47Å; D407-N410 VanDerWaalsContact O-N 3.13Å; N410-N413 PolarHBondContact O-N 3.18Å; N410-G414 PolarHBondContact O-N 2.89Å
411	D	68.3	Low	64.8	Low	113 Å²	113	75.4 Å²	75.4	60%	0.604	39%	0.392	S	S	*	.	H	α-helix	trans	-63.2	-43.5	176.7	-71.3	-17.8	0	0	0	111.7	D407 A408 C409 G414 L415	D407-D411 PolarHBondContact O-N 3.47Å; A408-D411 PolarHBondContact O-N 3.11Å; C409-D411 VanDerWaalsContact C-N 3.34Å; D411-G414 PolarHBondContact O-N 3.4Å; D411-L415 WeakPolarHBondContact O-CG 3.36Å; D411-L415 PolarHBondContact O-N 3.4Å
412	I	60.2	Low	65	Low	75 Å²	75	76.8 Å²	76.8	39%	0.385	40%	0.399	S	S	.	.	H	α-helix	trans	-63.7	-45.4	176.2	-69.2	165.4	0	0	0	111	L384 A408 C409 G414 L415 V416	L384-I412 HydrophobicContact CD1-CG2 4.07Å; A408-I412 WeakPolarHBondContact O-CD1 3.35Å; A408-I412 VanDerWaalsContact O-CG1 3.25Å; A408-I412 WeakPolarHBondContact O-CG1 3.48Å; A408-I412 PolarHBondContact O-N 3.46Å; C409-I412 PolarHBondContact O-N 2.66Å; I412-G414 VanDerWaalsContact C-N 3.29Å; I412-G414 PolarHBondContact O-N 3.28Å; I412-L415 PolarHBondContact O-N 3.04Å; I412-V416 HydrophobicContact CG2-CG2 4.47Å; I412-V416 WeakPolarHBondContact O-CG2 3.49Å; I412-V416 PolarHBondContact O-N 2.84Å
413	N	69.6	Low	64.7	Low	32 Å²	32	82.2 Å²	82.2	17%	0.171	42%	0.424	C	S	.	.	H	α-helix	trans	-62.7	-38.7	177.2	-74.7	-21.8	0	0	0	111.3	L384 C409 N410 V416 E417	L384-N413 PolarHBondContact O-ND2 3.34Å; C409-N413 WeakPolarHBondContact O-CB 3.47Å; C409-N413 VanDerWaalsContact O-CG 3.29Å; C409-N413 PolarHBondContact O-N 3.36Å; C409-N413 PolarHBondContact O-ND2 3.41Å; N410-N413 PolarHBondContact O-N 3.18Å; N413-V416 PolarHBondContact O-N 2.91Å; N413-E417 PolarHBondContact O-N 3.35Å
414	G	66.6	Low	64.3	Low	30 Å²	30	84.8 Å²	84.8	31%	0.309	44%	0.437	S	S	.	.	H	α-helix	trans	-63	-39.9	173	0	0	0	0	0	113.1	N410 D411 I412 Q418	N410-G414 PolarHBondContact O-N 2.89Å; D411-G414 PolarHBondContact O-N 3.4Å; I412-G414 VanDerWaalsContact C-N 3.29Å; I412-G414 PolarHBondContact O-N 3.28Å; G414-Q418 WeakPolarHBondContact O-CG 2.85Å; G414-Q418 PolarHBondContact O-N 3.32Å
415	L	59	Low	64.1	Low	100 Å²	100	84.7 Å²	84.7	52%	0.524	43%	0.433	S	S	.	.	H	α-helix	trans	-67.2	-40.5	175.5	-76.4	169.6	0	0	0	112.4	D411 I412 Q418 L419	D411-L415 WeakPolarHBondContact O-CG 3.36Å; D411-L415 PolarHBondContact O-N 3.4Å; I412-L415 PolarHBondContact O-N 3.04Å; L415-Q418 PolarHBondContact O-N 2.91Å; L415-L419 WeakPolarHBondContact O-CB 3.19Å; L415-L419 WeakPolarHBondContact O-CG 3.26Å; L415-L419 PolarHBondContact O-N 3.33Å
416	V	60	Low	63.7	Low	38 Å²	38	82.2 Å²	82.2	23%	0.23	43%	0.431	C	S	.	.	H	α-helix	trans	-65.4	-43.8	176.7	172.8	0	0	0	0	110.6	I412 N413 Q418 L419 D420	I412-V416 HydrophobicContact CG2-CG2 4.47Å; I412-V416 WeakPolarHBondContact O-CG2 3.49Å; I412-V416 PolarHBondContact O-N 2.84Å; N413-V416 PolarHBondContact O-N 2.91Å; V416-Q418 VanDerWaalsContact C-N 3.27Å; V416-Q418 PolarHBondContact O-N 2.91Å; V416-L419 PolarHBondContact O-N 3.32Å; V416-D420 WeakPolarHBondContact O-CB 3.28Å; V416-D420 PolarHBondContact O-N 2.91Å
417	E	68.8	Low	62.9	Low	107 Å²	107	86.6 Å²	86.6	50%	0.5	45%	0.454	S	S	.	.	H	α-helix	trans	-60.6	-36	173.3	-80.6	-168.3	-164.1	0	0	113	N413 R421	N413-E417 PolarHBondContact O-N 3.35Å; E417-R421 WeakPolarHBondContact O-CB 3.3Å; E417-R421 WeakPolarHBondContact O-CG 3.41Å; E417-R421 PolarHBondContact O-N 3.45Å; E417-R421 IonicContact OE2-NH2 3.81Å; E417-R421 PolarHBondContact OE2-NH2 2.89Å
418	Q	66.3	Low	62.4	Low	120 Å²	120	87.7 Å²	87.7	56%	0.561	46%	0.459	S	S	*	.	H	α-helix	trans	-70.7	-39.4	175.9	-75.2	-179.9	11.3	0	0	112.1	G414 L415 V416 R421 L422	G414-Q418 WeakPolarHBondContact O-CG 2.85Å; G414-Q418 PolarHBondContact O-N 3.32Å; L415-Q418 PolarHBondContact O-N 2.91Å; V416-Q418 VanDerWaalsContact C-N 3.27Å; V416-Q418 PolarHBondContact O-N 2.91Å; Q418-R421 PolarHBondContact O-N 3.36Å; Q418-L422 WeakPolarHBondContact O-CB 3.48Å; Q418-L422 WeakPolarHBondContact O-CG 3.4Å; Q418-L422 PolarHBondContact O-N 3.41Å
419	L	55.1	Low	62	Low	110 Å²	110	89.9 Å²	89.9	58%	0.576	47%	0.468	S	S	*	.	H	α-helix	trans	-64.6	-45.2	174.7	-82.3	164.2	0	0	0	111.4	L415 V416 R421 L422 E423	L415-L419 WeakPolarHBondContact O-CB 3.19Å; L415-L419 WeakPolarHBondContact O-CG 3.26Å; L415-L419 PolarHBondContact O-N 3.33Å; V416-L419 PolarHBondContact O-N 3.32Å; L419-R421 VanDerWaalsContact C-N 3.29Å; L419-R421 PolarHBondContact O-N 3.47Å; L419-L422 CarbonylContact O-C 3.58Å; L419-L422 PolarHBondContact O-N 3.38Å; L419-L422 VanDerWaalsContact O-N 3.15Å; L419-E423 WeakPolarHBondContact O-CB 3.49Å; L419-E423 PolarHBondContact O-N 3.08Å
420	D	66.1	Low	61.1	Low	92 Å²	92	97.1 Å²	97.1	49%	0.492	50%	0.499	S	S	.	.	H	α-helix	trans	-62.3	-38.4	176.7	-71.2	-13.7	0	0	0	110.9	V416 L424	V416-D420 WeakPolarHBondContact O-CB 3.28Å; V416-D420 PolarHBondContact O-N 2.91Å; D420-L424 VanDerWaalsContact O-CB 3.26Å; D420-L424 WeakPolarHBondContact O-CB 3.49Å; D420-L424 PolarHBondContact O-N 3.41Å
421	R	67.7	Low	59.6	Low	162 Å²	162	97.4 Å²	97.4	61%	0.611	51%	0.505	S	S	*	.	H	α-helix	trans	-66.5	-41.8	173.4	-74	176.5	-150.3	-163.5	9.2	112.2	E417 Q418 L419 L424 E425	E417-R421 WeakPolarHBondContact O-CB 3.3Å; E417-R421 WeakPolarHBondContact O-CG 3.41Å; E417-R421 PolarHBondContact O-N 3.45Å; E417-R421 IonicContact OE2-NH2 3.81Å; E417-R421 PolarHBondContact OE2-NH2 2.89Å; Q418-R421 PolarHBondContact O-N 3.36Å; L419-R421 VanDerWaalsContact C-N 3.29Å; L419-R421 PolarHBondContact O-N 3.47Å; R421-L424 PolarHBondContact O-N 3.45Å; R421-E425 WeakPolarHBondContact O-CB 3.28Å; R421-E425 PolarHBondContact O-N 2.97Å
422	L	57.7	Low	58.2	Low	106 Å²	106	100.6 Å²	100.6	56%	0.555	52%	0.516	S	S	*	.	H	α-helix	trans	-67.2	-39.2	177.1	-83.6	165.2	0	0	0	112.1	Q418 L419 E425 A426	Q418-L422 WeakPolarHBondContact O-CB 3.48Å; Q418-L422 WeakPolarHBondContact O-CG 3.4Å; Q418-L422 PolarHBondContact O-N 3.41Å; L419-L422 CarbonylContact O-C 3.58Å; L419-L422 PolarHBondContact O-N 3.38Å; L419-L422 VanDerWaalsContact O-N 3.15Å; L422-E425 PolarHBondContact O-N 2.69Å; L422-A426 WeakPolarHBondContact O-CB 3.49Å; L422-A426 PolarHBondContact O-N 2.95Å
423	E	52.7	Low	57.1	Low	122 Å²	122	108.6 Å²	108.6	57%	0.57	56%	0.557	S	S	*	*	H	α-helix	trans	-66	-44.9	175.4	-173.2	172.2	-165.6	0	0	110	L419 E425 A426 D427	L419-E423 WeakPolarHBondContact O-CB 3.49Å; L419-E423 PolarHBondContact O-N 3.08Å; E423-E425 PolarHBondContact O-N 3.3Å; E423-A426 PolarHBondContact O-N 3.28Å; E423-D427 WeakPolarHBondContact O-CB 3.32Å; E423-D427 PolarHBondContact O-N 2.85Å
424	L	63.7	Low	56.4	Low	114 Å²	114	112.4 Å²	112.4	60%	0.597	58%	0.576	S	S	*	*	H	α-helix	trans	-64.4	-40	175.6	-154.4	109.8	0	0	0	111.8	D420 R421 D427 I428	D420-L424 VanDerWaalsContact O-CB 3.26Å; D420-L424 WeakPolarHBondContact O-CB 3.49Å; D420-L424 PolarHBondContact O-N 3.41Å; R421-L424 PolarHBondContact O-N 3.45Å; L424-D427 PolarHBondContact O-N 3.34Å; L424-I428 HydrophobicContact CD2-CD1 3.79Å; L424-I428 HydrophobicContact CG-CD1 4.25Å; L424-I428 WeakPolarHBondContact O-CB 3.43Å; L424-I428 VanDerWaalsContact O-CD1 3.32Å; L424-I428 WeakPolarHBondContact O-CD1 3.42Å; L424-I428 WeakPolarHBondContact O-CG1 3.31Å; L424-I428 PolarHBondContact O-N 2.64Å
425	E	63	Low	55.9	Low	124 Å²	124	116.7 Å²	116.7	58%	0.579	59%	0.59	S	S	*	*	H	α-helix	trans	-69.8	-34.6	176.3	-163.6	167.2	-155	0	0	111.3	R421 L422 E423 I428 T429	R421-E425 WeakPolarHBondContact O-CB 3.28Å; R421-E425 PolarHBondContact O-N 2.97Å; L422-E425 PolarHBondContact O-N 2.69Å; E423-E425 PolarHBondContact O-N 3.3Å; E425-I428 PolarHBondContact O-N 2.99Å; E425-T429 VanDerWaalsContact O-CB 3.26Å; E425-T429 WeakPolarHBondContact O-CB 3.46Å; E425-T429 PolarHBondContact O-N 2.8Å; E425-T429 PolarHBondContact O-OG1 3.07Å
426	A	49.8	Very low	55.7	Low	49 Å²	49	117.7 Å²	117.7	41%	0.405	59%	0.594	S	S	.	*	H	α-helix	trans	-67	-44.8	172.3	0	0	0	0	0	111.8	L422 E423 I428 T429 F430	L422-A426 WeakPolarHBondContact O-CB 3.49Å; L422-A426 PolarHBondContact O-N 2.95Å; E423-A426 PolarHBondContact O-N 3.28Å; A426-I428 VanDerWaalsContact C-N 3.29Å; A426-I428 PolarHBondContact O-N 2.93Å; A426-T429 PolarHBondContact O-N 2.85Å; A426-F430 WeakPolarHBondContact O-CA 3.39Å; A426-F430 WeakPolarHBondContact O-CB 3.5Å; A426-F430 PolarHBondContact O-N 2.77Å
427	D	55	Low	55.5	Low	101 Å²	101	122.4 Å²	122.4	54%	0.54	62%	0.615	S	S	.	*	H	α-helix	trans	-65.5	-30.6	174.8	-87	-8.5	0	0	0	112.2	E423 L424 F430 P431	E423-D427 WeakPolarHBondContact O-CB 3.32Å; E423-D427 PolarHBondContact O-N 2.85Å; L424-D427 PolarHBondContact O-N 3.34Å; D427-F430 CarbonylContact O-C 3.58Å; D427-P431 WeakPolarHBondContact O-CA 3.46Å; D427-P431 WeakPolarHBondContact O-CB 3.5Å
428	I	61.4	Low	54.6	Low	118 Å²	118	123.3 Å²	123.3	61%	0.605	62%	0.622	S	S	*	*	H	α-helix	trans	-77.9	-37.7	174.8	-70	163.8	0	0	0	111.5	L424 E425 A426 P431	L424-I428 HydrophobicContact CD2-CD1 3.79Å; L424-I428 HydrophobicContact CG-CD1 4.25Å; L424-I428 WeakPolarHBondContact O-CB 3.43Å; L424-I428 VanDerWaalsContact O-CD1 3.32Å; L424-I428 WeakPolarHBondContact O-CD1 3.42Å; L424-I428 WeakPolarHBondContact O-CG1 3.31Å; L424-I428 PolarHBondContact O-N 2.64Å; E425-I428 PolarHBondContact O-N 2.99Å; A426-I428 VanDerWaalsContact C-N 3.29Å; A426-I428 PolarHBondContact O-N 2.93Å; I428-P431 WeakPolarHBondContact O-CD 3.46Å
429	T	55.2	Low	53.9	Low	87 Å²	87	123.5 Å²	123.5	53%	0.534	63%	0.626	S	S	.	*	H	α-helix	trans	-76.6	-31.3	-179.9	-50.8	0	0	0	0	111.1	E425 A426 P431	E425-T429 VanDerWaalsContact O-CB 3.26Å; E425-T429 WeakPolarHBondContact O-CB 3.46Å; E425-T429 PolarHBondContact O-N 2.8Å; E425-T429 PolarHBondContact O-OG1 3.07Å; A426-T429 PolarHBondContact O-N 2.85Å; T429-P431 VanDerWaalsContact C-CD 3.47Å
430	F	44.4	Very low	53.8	Low	162 Å²	162	124.5 Å²	124.5	71%	0.711	63%	0.63	S	S	*	*	S	Bend	trans	-129.3	67.4	175.5	-55.8	-76.8	0	0	0	110.5	A426 D427 H432	A426-F430 WeakPolarHBondContact O-CA 3.39Å; A426-F430 WeakPolarHBondContact O-CB 3.5Å; A426-F430 PolarHBondContact O-N 2.77Å; D427-F430 CarbonylContact O-C 3.58Å; F430-H432 PolarHBondContact O-N 3.28Å
431	P	40.5	Very low	52.8	Low	84 Å²	84	127 Å²	127	55%	0.545	64%	0.641	S	S	.	*			trans	-67.6	133.1	177.1	27.7	-30.3	0	0	0	109.4	D427 I428 T429	D427-P431 WeakPolarHBondContact O-CA 3.46Å; D427-P431 WeakPolarHBondContact O-CB 3.5Å; I428-P431 WeakPolarHBondContact O-CD 3.46Å; T429-P431 VanDerWaalsContact C-CD 3.47Å
432	H	39.7	Very low	51.6	Low	179 Å²	179	124.1 Å²	124.1	83%	0.829	64%	0.643	S	S	*	*			trans	32.7	92.2	165.2	-73.3	-49.3	0	0	0	114.9	F430	F430-H432 PolarHBondContact O-N 3.28Å
433	I	36	Very low	51	Low	243 Å²	243	125.7 Å²	125.7	100%	1.246	65%	0.651	S	S	*	*				152	0	126.5	-75.2	154.6	0	0	0	109.1

Retrieved 433 of 433 residues in 412.9 ms (Link to these results)

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