X2JEK5_DROME Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession X2JEK5, Species DROME (Drosophila melanogaster, Fruit fly), Gene Dmel\CG44532, Length 183 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	34	Very low	69.4	Low	240 Å²	240	73.5 Å²	73.5	100%	1.182	50%	0.498	S	S	*	.				0	88.4	0	-65.1	-80.8	-152.1	0	0	107.9	G3	M1-G3 VanDerWaalsContact C-N 3.26Å; M1-G3 PolarHBondContact O-N 3Å
2	A	46.3	Very low	71.3	Confident	108 Å²	108	72.3 Å²	72.3	89%	0.893	50%	0.497	S	S	*	.			trans	-70.4	94.1	169.6	0	0	0	0	0	105.8	S4	A2-S4 PolarHBondContact O-N 3.38Å
3	G	43.5	Very low	73.2	Confident	66 Å²	66	74.7 Å²	74.7	68%	0.68	50%	0.496	S	S	*	.			trans	-49.6	119.6	179.6	0	0	0	0	0	107.3	M1 S5	M1-G3 VanDerWaalsContact C-N 3.26Å; M1-G3 PolarHBondContact O-N 3Å; G3-S5 PolarHBondContact O-N 3.1Å
4	S	48.7	Very low	74.8	Confident	110 Å²	110	69.5 Å²	69.5	77%	0.769	46%	0.461	S	S	*	.			trans	-56.1	97.1	174.8	54.1	0	0	0	0	106.2	A2 S6	A2-S4 PolarHBondContact O-N 3.38Å; S4-S6 PolarHBondContact O-N 2.76Å
5	S	63.1	Low	76.2	Confident	57 Å²	57	68.2 Å²	68.2	40%	0.399	45%	0.447	S	S	.	.			trans	-57.8	115.5	-178.9	-177.5	0	0	0	0	105.6	G3 R66	G3-S5 PolarHBondContact O-N 3.1Å; S5-R66 PolarHBondContact O-NH1 3.3Å
6	S	82.9	Confident	77.5	Confident	65 Å²	65	69.2 Å²	69.2	46%	0.455	45%	0.447	S	S	.	.			trans	-57.7	146.2	-178.9	66.8	0	0	0	0	107.4	S4 S8 A9 L10	S4-S6 PolarHBondContact O-N 2.76Å; S6-S8 PolarHBondContact O-N 2.77Å; S6-S8 VanDerWaalsContact O-N 3.12Å; S6-A9 WeakPolarHBondContact O-CB 3.39Å; S6-A9 PolarHBondContact O-N 3.03Å; S6-A9 WeakPolarHBondContact OG-CB 3.47Å; S6-A9 PolarHBondContact OG-N 3.13Å; S6-A9 VanDerWaalsContact OG-N 3.17Å; S6-L10 PolarHBondContact O-N 3.19Å; S6-L10 VanDerWaalsContact O-N 3.08Å
7	I	85.5	Confident	78.7	Confident	34 Å²	34	66 Å²	66	17%	0.174	43%	0.425	C	S	.	.	H	α-helix	trans	-54.5	-32.3	176	-177.4	55.3	0	0	0	111.3	L10 L11 I63 R66 M72	I7-L10 HydrophobicContact CD1-CD2 4Å; I7-L10 PolarHBondContact O-N 3.29Å; I7-L11 HydrophobicContact CD1-CG 4.39Å; I7-L11 HydrophobicContact CG1-CD1 4.12Å; I7-L11 HydrophobicContact CG1-CG 4.45Å; I7-L11 WeakPolarHBondContact O-CB 3.45Å; I7-L11 VanDerWaalsContact O-CG 3.26Å; I7-L11 WeakPolarHBondContact O-CG 3.31Å; I7-L11 PolarHBondContact O-N 2.95Å; I7-I63 HydrophobicContact CD1-CG1 4.1Å; I7-R66 HydrophobicContact CD1-CB 4.11Å; I7-M72 HydrophobicContact CB-CE 4.46Å; I7-M72 HydrophobicContact CB-SD 4.18Å; I7-M72 HydrophobicContact CG1-CE 4.14Å; I7-M72 HydrophobicContact CG1-SD 3.43Å; I7-M72 WeakPolarHBondContact CG1-SD 3.36Å; I7-M72 HydrophobicContact CG2-CE 3.49Å; I7-M72 VanDerWaalsContact CG2-CE 3.49Å; I7-M72 HydrophobicContact CG2-SD 3.68Å
8	S	86.6	Confident	79.8	Confident	70 Å²	70	62.3 Å²	62.3	49%	0.49	40%	0.402	S	S	.	.	H	α-helix	trans	-62.1	-41.3	172.8	-48.4	0	0	0	0	113.2	S6 L11 A12	S6-S8 PolarHBondContact O-N 2.77Å; S6-S8 VanDerWaalsContact O-N 3.12Å; S8-L11 PolarHBondContact O-N 3.49Å; S8-A12 WeakPolarHBondContact O-CB 3.2Å; S8-A12 PolarHBondContact O-N 3.08Å
9	A	89.4	Confident	80.7	Confident	43 Å²	43	63.7 Å²	63.7	36%	0.355	40%	0.403	S	S	.	.	H	α-helix	trans	-65.4	-41.8	175.6	0	0	0	0	0	111.6	S6 A12 E13	S6-A9 WeakPolarHBondContact O-CB 3.39Å; S6-A9 PolarHBondContact O-N 3.03Å; S6-A9 WeakPolarHBondContact OG-CB 3.47Å; S6-A9 PolarHBondContact OG-N 3.13Å; S6-A9 VanDerWaalsContact OG-N 3.17Å; A9-A12 PolarHBondContact O-N 2.99Å; A9-E13 PolarHBondContact O-N 3.41Å
10	L	91.2	Very high	81.6	Confident	15 Å²	15	65.4 Å²	65.4	8%	0.079	40%	0.403	C	S	.	.	H	α-helix	trans	-61.7	-43.6	174.1	177.7	62.4	0	0	0	111.8	S6 I7 A12 E13 Q14 T62 I63	S6-L10 PolarHBondContact O-N 3.19Å; S6-L10 VanDerWaalsContact O-N 3.08Å; I7-L10 HydrophobicContact CD1-CD2 4Å; I7-L10 PolarHBondContact O-N 3.29Å; L10-A12 PolarHBondContact O-N 3.38Å; L10-E13 PolarHBondContact O-N 3.33Å; L10-Q14 HydrophobicContact CD1-CG 4.46Å; L10-Q14 VanDerWaalsContact O-CG 3.29Å; L10-Q14 WeakPolarHBondContact O-CG 3.44Å; L10-Q14 PolarHBondContact O-N 3.4Å; L10-T62 HydrophobicContact CD2-CG2 3.58Å; L10-I63 HydrophobicContact CD2-CG1 3.58Å; L10-I63 HydrophobicContact CG-CD1 4.28Å; L10-I63 HydrophobicContact CG-CG1 3.85Å
11	L	92.6	Very high	82.4	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-62.8	-41.9	176.6	-73	164.7	0	0	0	111.6	I7 S8 Q14 M15 I63 M72 H74 Y76 F77	I7-L11 HydrophobicContact CD1-CG 4.39Å; I7-L11 HydrophobicContact CG1-CD1 4.12Å; I7-L11 HydrophobicContact CG1-CG 4.45Å; I7-L11 WeakPolarHBondContact O-CB 3.45Å; I7-L11 VanDerWaalsContact O-CG 3.26Å; I7-L11 WeakPolarHBondContact O-CG 3.31Å; I7-L11 PolarHBondContact O-N 2.95Å; S8-L11 PolarHBondContact O-N 3.49Å; L11-Q14 PolarHBondContact O-N 3.04Å; L11-M15 VanDerWaalsContact O-CG 3.29Å; L11-M15 WeakPolarHBondContact O-CG 3.42Å; L11-M15 PolarHBondContact O-N 3.12Å; L11-I63 HydrophobicContact CD2-CD1 3.67Å; L11-I63 HydrophobicContact CD2-CG1 4.32Å; L11-I63 HydrophobicContact CD2-CG2 4.4Å; L11-I63 HydrophobicContact CG-CD1 4.41Å; L11-M72 HydrophobicContact CD1-CE 4.35Å; L11-H74 HydrophobicContact CD1-CB 4.1Å; L11-Y76 HydrophobicContact CD2-CD1 3.94Å; L11-Y76 HydrophobicContact CD2-CD2 4.35Å; L11-Y76 HydrophobicContact CD2-CG 3.79Å; L11-F77 HydrophobicContact CD1-CE2 4.46Å; L11-F77 HydrophobicContact CD2-CE2 4.14Å; L11-F77 HydrophobicContact CD2-CZ 4.02Å
12	A	92.5	Very high	85.5	Confident	59 Å²	59	53.7 Å²	53.7	49%	0.488	34%	0.341	S	S	.	.	H	α-helix	trans	-63.6	-41.3	175.6	0	0	0	0	0	112.2	S8 A9 L10 M15 N16	S8-A12 WeakPolarHBondContact O-CB 3.2Å; S8-A12 PolarHBondContact O-N 3.08Å; A9-A12 PolarHBondContact O-N 2.99Å; L10-A12 PolarHBondContact O-N 3.38Å; A12-M15 PolarHBondContact O-N 2.85Å; A12-N16 PolarHBondContact O-N 3.36Å
13	E	95.4	Very high	88	Confident	104 Å²	104	50.2 Å²	50.2	49%	0.486	31%	0.31	S	S	.	.	H	α-helix	trans	-61.2	-44.5	174.2	-178.7	177	-169.1	0	0	111.6	A9 L10 M15 N16 L17	A9-E13 PolarHBondContact O-N 3.41Å; L10-E13 PolarHBondContact O-N 3.33Å; E13-M15 PolarHBondContact O-N 3.29Å; E13-N16 WeakPolarHBondContact O-CB 3.2Å; E13-N16 PolarHBondContact O-N 3.03Å; E13-L17 HydrophobicContact CG-CD1 4.18Å; E13-L17 WeakPolarHBondContact O-CG 3.4Å; E13-L17 PolarHBondContact O-N 3.42Å
14	Q	95.5	Very high	90.5	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.009	28%	0.279	C	S	.	.	H	α-helix	trans	-62.5	-42.9	177.2	-72.3	-64.9	-59.4	0	0	112.2	L10 L11 N16 L17 G18 F56 I63 Y76	L10-Q14 HydrophobicContact CD1-CG 4.46Å; L10-Q14 VanDerWaalsContact O-CG 3.29Å; L10-Q14 WeakPolarHBondContact O-CG 3.44Å; L10-Q14 PolarHBondContact O-N 3.4Å; L11-Q14 PolarHBondContact O-N 3.04Å; Q14-N16 VanDerWaalsContact C-N 3.3Å; Q14-N16 PolarHBondContact O-N 3.13Å; Q14-L17 PolarHBondContact O-N 3.32Å; Q14-G18 PolarHBondContact O-N 3.02Å; Q14-F56 HydrophobicContact CB-CE2 4.26Å; Q14-F56 PolarHBondContact NE2-O 3.48Å; Q14-F56 VanDerWaalsContact O-CE2 3.31Å; Q14-F56 WeakPolarHBondContact O-CE2 3.39Å; Q14-F56 PolarHBondContact OE1-O 3.37Å; Q14-I63 HydrophobicContact CB-CD1 4.27Å; Q14-I63 HydrophobicContact CG-CD1 3.62Å; Q14-Y76 HydrophobicContact CB-CD2 4.3Å; Q14-Y76 HydrophobicContact CB-CE2 3.71Å
15	M	95.8	Very high	92.9	Very high	50 Å²	50	42.4 Å²	42.4	25%	0.246	24%	0.244	C	C	.	.	H	α-helix	trans	-58	-44.6	173.5	-68.4	-65.1	-61.6	0	0	111.2	L11 A12 E13 G18 E19 Y76 F81	L11-M15 VanDerWaalsContact O-CG 3.29Å; L11-M15 WeakPolarHBondContact O-CG 3.42Å; L11-M15 PolarHBondContact O-N 3.12Å; A12-M15 PolarHBondContact O-N 2.85Å; E13-M15 PolarHBondContact O-N 3.29Å; M15-G18 PolarHBondContact O-N 3.38Å; M15-E19 WeakPolarHBondContact O-CG 3.36Å; M15-E19 PolarHBondContact O-N 3.11Å; M15-Y76 HydrophobicContact CG-CD2 4.48Å; M15-Y76 HydrophobicContact SD-CD2 3.95Å; M15-F81 HydrophobicContact CE-CD2 4.19Å; M15-F81 HydrophobicContact CE-CE2 3.97Å; M15-F81 HydrophobicContact CE-CZ 4.18Å; M15-F81 HydrophobicContact SD-CD1 3.79Å; M15-F81 HydrophobicContact SD-CD2 4.05Å; M15-F81 HydrophobicContact SD-CE1 3.84Å; M15-F81 HydrophobicContact SD-CE2 4.12Å; M15-F81 HydrophobicContact SD-CG 3.87Å; M15-F81 HydrophobicContact SD-CZ 4Å
16	N	97.4	Very high	94.5	Very high	84 Å²	84	45.4 Å²	45.4	45%	0.449	25%	0.247	S	C	.	.	H	α-helix	trans	-63.5	-43.8	177.2	-175.5	6.5	0	0	0	112.6	A12 E13 Q14 G18 E19 K20	A12-N16 PolarHBondContact O-N 3.36Å; E13-N16 WeakPolarHBondContact O-CB 3.2Å; E13-N16 PolarHBondContact O-N 3.03Å; Q14-N16 VanDerWaalsContact C-N 3.3Å; Q14-N16 PolarHBondContact O-N 3.13Å; N16-G18 VanDerWaalsContact C-N 3.34Å; N16-G18 PolarHBondContact O-N 3.23Å; N16-E19 PolarHBondContact O-N 2.99Å; N16-K20 WeakPolarHBondContact O-CG 3.47Å; N16-K20 PolarHBondContact O-N 3.38Å; N16-K20 WeakPolarHBondContact OD1-CE 3.5Å
17	L	98.3	Very high	95.2	Very high	15 Å²	15	45.5 Å²	45.5	8%	0.079	24%	0.242	C	C	.	.	H	α-helix	trans	-61.2	-42.9	175.5	-74.8	170	0	0	0	111.6	E13 Q14 K20 I21 L52 A55 F56	E13-L17 HydrophobicContact CG-CD1 4.18Å; E13-L17 WeakPolarHBondContact O-CG 3.4Å; E13-L17 PolarHBondContact O-N 3.42Å; Q14-L17 PolarHBondContact O-N 3.32Å; L17-K20 WeakPolarHBondContact O-CB 3.43Å; L17-K20 PolarHBondContact O-N 2.96Å; L17-I21 WeakPolarHBondContact O-CG1 3.2Å; L17-I21 PolarHBondContact O-N 3.32Å; L17-L52 HydrophobicContact CD2-CD2 3.97Å; L17-A55 HydrophobicContact CD1-CB 4.07Å; L17-A55 HydrophobicContact CD2-CB 4.13Å; L17-F56 HydrophobicContact CB-CB 4.41Å; L17-F56 HydrophobicContact CB-CD2 3.88Å
18	G	98	Very high	95.7	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-61	-42.9	174.4	0	0	0	0	0	112.8	Q14 M15 N16 K20 I21 Q22	Q14-G18 PolarHBondContact O-N 3.02Å; M15-G18 PolarHBondContact O-N 3.38Å; N16-G18 VanDerWaalsContact C-N 3.34Å; N16-G18 PolarHBondContact O-N 3.23Å; G18-K20 VanDerWaalsContact C-N 3.34Å; G18-K20 PolarHBondContact O-N 2.88Å; G18-I21 WeakPolarHBondContact O-CB 3.06Å; G18-I21 PolarHBondContact O-N 2.78Å; G18-Q22 WeakPolarHBondContact O-CG 3.27Å; G18-Q22 PolarHBondContact O-N 2.91Å
19	E	97.5	Very high	96.1	Very high	89 Å²	89	46.9 Å²	46.9	42%	0.416	24%	0.238	S	C	.	.	H	α-helix	trans	-62.6	-38.3	174	-75.6	-61.9	147	0	0	112.4	M15 N16 Q22 S23	M15-E19 WeakPolarHBondContact O-CG 3.36Å; M15-E19 PolarHBondContact O-N 3.11Å; N16-E19 PolarHBondContact O-N 2.99Å; E19-Q22 PolarHBondContact O-N 2.87Å; E19-S23 VanDerWaalsContact O-CB 3.26Å; E19-S23 WeakPolarHBondContact O-CB 3.44Å; E19-S23 PolarHBondContact O-N 2.99Å
20	K	98.6	Very high	96.4	Very high	97 Å²	97	52.6 Å²	52.6	42%	0.422	26%	0.255	S	S	.	.	H	α-helix	trans	-64	-41.9	174.3	-71.6	173.4	-177.9	174.4	0	111.6	N16 L17 G18 S23 I24 L52	N16-K20 WeakPolarHBondContact O-CG 3.47Å; N16-K20 PolarHBondContact O-N 3.38Å; N16-K20 WeakPolarHBondContact OD1-CE 3.5Å; L17-K20 WeakPolarHBondContact O-CB 3.43Å; L17-K20 PolarHBondContact O-N 2.96Å; G18-K20 VanDerWaalsContact C-N 3.34Å; G18-K20 PolarHBondContact O-N 2.88Å; K20-S23 WeakPolarHBondContact O-CB 3.2Å; K20-S23 PolarHBondContact O-N 3.12Å; K20-I24 WeakPolarHBondContact O-CG1 3.26Å; K20-I24 PolarHBondContact O-N 2.87Å; K20-L52 HydrophobicContact CB-CD1 3.71Å; K20-L52 HydrophobicContact CB-CD2 4.2Å; K20-L52 HydrophobicContact CD-CD2 4.16Å
21	I	98.6	Very high	96.6	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-59.7	-51.6	174.2	-71.9	167	0	0	0	110.1	L17 G18 S23 I24 I25 L49 L52 F56 I85 V89	L17-I21 WeakPolarHBondContact O-CG1 3.2Å; L17-I21 PolarHBondContact O-N 3.32Å; G18-I21 WeakPolarHBondContact O-CB 3.06Å; G18-I21 PolarHBondContact O-N 2.78Å; I21-S23 PolarHBondContact O-N 3.17Å; I21-I24 WeakPolarHBondContact O-CB 3.44Å; I21-I24 PolarHBondContact O-N 2.93Å; I21-I24 VanDerWaalsContact O-N 3.11Å; I21-I25 HydrophobicContact CG2-CD1 4.07Å; I21-I25 PolarHBondContact O-N 3.08Å; I21-L49 HydrophobicContact CG1-CD1 4.41Å; I21-L49 HydrophobicContact CG2-CD1 3.78Å; I21-L52 HydrophobicContact CD1-CB 4.22Å; I21-L52 HydrophobicContact CG1-CB 3.7Å; I21-L52 HydrophobicContact CG1-CD1 4.04Å; I21-F56 HydrophobicContact CD1-CB 4.25Å; I21-F56 HydrophobicContact CD1-CG 4.41Å; I21-I85 HydrophobicContact CD1-CG2 3.6Å; I21-I85 HydrophobicContact CG2-CG2 4.25Å; I21-V89 HydrophobicContact CD1-CG2 4.21Å; I21-V89 HydrophobicContact CG2-CG2 3.88Å
22	Q	98.2	Very high	96.7	Very high	59 Å²	59	55.9 Å²	55.9	28%	0.276	28%	0.278	S	S	.	.	H	α-helix	trans	-59.9	-36.2	177.3	-71.2	-179.2	-7	0	0	112.3	G18 E19 I25 R26 I85 L88	G18-Q22 WeakPolarHBondContact O-CG 3.27Å; G18-Q22 PolarHBondContact O-N 2.91Å; E19-Q22 PolarHBondContact O-N 2.87Å; Q22-I25 PolarHBondContact O-N 3.15Å; Q22-R26 VanDerWaalsContact O-CB 3.29Å; Q22-R26 WeakPolarHBondContact O-CB 3.42Å; Q22-R26 PolarHBondContact O-N 3.33Å; Q22-I85 HydrophobicContact CG-CD1 3.88Å; Q22-L88 HydrophobicContact CG-CD1 3.93Å
23	S	98.3	Very high	96.6	Very high	35 Å²	35	56.9 Å²	56.9	25%	0.245	29%	0.286	C	S	.	.	H	α-helix	trans	-64.5	-40.4	175.8	-172.2	0	0	0	0	112.1	E19 K20 I21 I25 R26 N27	E19-S23 VanDerWaalsContact O-CB 3.26Å; E19-S23 WeakPolarHBondContact O-CB 3.44Å; E19-S23 PolarHBondContact O-N 2.99Å; K20-S23 WeakPolarHBondContact O-CB 3.2Å; K20-S23 PolarHBondContact O-N 3.12Å; I21-S23 PolarHBondContact O-N 3.17Å; S23-I25 VanDerWaalsContact C-N 3.32Å; S23-I25 PolarHBondContact O-N 3.1Å; S23-R26 PolarHBondContact O-N 3.49Å; S23-N27 WeakPolarHBondContact O-CB 3.47Å; S23-N27 PolarHBondContact O-N 3.01Å; S23-N27 PolarHBondContact O-ND2 2.81Å; S23-N27 PolarHBondContact OG-ND2 3.39Å
24	I	97.3	Very high	96.5	Very high	5 Å²	5	59.4 Å²	59.4	3%	0.026	30%	0.298	C	S	.	.	H	α-helix	trans	-57.6	-48.4	172.9	-69.1	176.3	0	0	0	110.2	K20 I21 N27 Y28 K48 L52	K20-I24 WeakPolarHBondContact O-CG1 3.26Å; K20-I24 PolarHBondContact O-N 2.87Å; I21-I24 WeakPolarHBondContact O-CB 3.44Å; I21-I24 PolarHBondContact O-N 2.93Å; I21-I24 VanDerWaalsContact O-N 3.11Å; I24-N27 PolarHBondContact O-N 3.27Å; I24-Y28 WeakPolarHBondContact O-CB 3.27Å; I24-Y28 PolarHBondContact O-N 2.98Å; I24-K48 HydrophobicContact CD1-CB 4.01Å; I24-K48 HydrophobicContact CD1-CD 3.78Å; I24-K48 HydrophobicContact CD1-CG 3.6Å; I24-K48 HydrophobicContact CG1-CD 4.28Å; I24-L52 HydrophobicContact CD1-CD1 3.44Å; I24-L52 VanDerWaalsContact CD1-CD1 3.44Å; I24-L52 HydrophobicContact CD1-CG 4.49Å; I24-L52 HydrophobicContact CG1-CD1 4.36Å
25	I	97.4	Very high	96.2	Very high	7 Å²	7	65.7 Å²	65.7	4%	0.036	32%	0.322	C	S	.	.	H	α-helix	trans	-65.1	-46.5	-178.4	-65.5	166.2	0	0	0	111	I21 Q22 S23 N27 Y28 K29 L88 Y92	I21-I25 HydrophobicContact CG2-CD1 4.07Å; I21-I25 PolarHBondContact O-N 3.08Å; Q22-I25 PolarHBondContact O-N 3.15Å; S23-I25 VanDerWaalsContact C-N 3.32Å; S23-I25 PolarHBondContact O-N 3.1Å; I25-N27 VanDerWaalsContact C-N 3.33Å; I25-N27 PolarHBondContact O-N 2.76Å; I25-Y28 WeakPolarHBondContact O-CB 3.22Å; I25-Y28 PolarHBondContact O-N 3.3Å; I25-K29 HydrophobicContact CG2-CD 4.43Å; I25-K29 WeakPolarHBondContact O-CG 3.34Å; I25-K29 PolarHBondContact O-N 3.11Å; I25-L88 HydrophobicContact CD1-CB 3.74Å; I25-L88 HydrophobicContact CD1-CD1 4.38Å; I25-L88 HydrophobicContact CD1-CD2 4.33Å; I25-L88 HydrophobicContact CD1-CG 4.38Å; I25-Y92 HydrophobicContact CB-CD2 4.32Å; I25-Y92 HydrophobicContact CB-CG 4.46Å; I25-Y92 HydrophobicContact CD1-CD2 3.54Å; I25-Y92 HydrophobicContact CD1-CE2 4.21Å; I25-Y92 HydrophobicContact CD1-CG 4.06Å; I25-Y92 HydrophobicContact CG1-CD1 4.34Å; I25-Y92 HydrophobicContact CG1-CD2 3.7Å; I25-Y92 HydrophobicContact CG1-CE2 4.36Å; I25-Y92 HydrophobicContact CG1-CG 3.75Å; I25-Y92 HydrophobicContact CG2-CD1 4.03Å; I25-Y92 HydrophobicContact CG2-CD2 3.66Å; I25-Y92 HydrophobicContact CG2-CE1 3.77Å; I25-Y92 HydrophobicContact CG2-CE2 3.43Å; I25-Y92 VanDerWaalsContact CG2-CE2 3.43Å; I25-Y92 HydrophobicContact CG2-CG 4.02Å
26	R	97.7	Very high	96	Very high	120 Å²	120	66 Å²	66	45%	0.453	32%	0.322	S	S	.	.	H	α-helix	trans	-60.3	-43.5	176.7	-178.5	174.2	62.3	-149	-4.9	111.5	Q22 S23 Y28 K29 K30	Q22-R26 VanDerWaalsContact O-CB 3.29Å; Q22-R26 WeakPolarHBondContact O-CB 3.42Å; Q22-R26 PolarHBondContact O-N 3.33Å; S23-R26 PolarHBondContact O-N 3.49Å; R26-Y28 VanDerWaalsContact C-N 3.32Å; R26-K29 PolarHBondContact O-N 3.45Å; R26-K30 HydrophobicContact CG-CD 4.38Å; R26-K30 WeakPolarHBondContact O-CG 3.41Å; R26-K30 PolarHBondContact O-N 3.18Å; R26-K30 VanDerWaalsContact O-N 3.09Å
27	N	96.7	Very high	95.5	Very high	68 Å²	68	65.8 Å²	65.8	36%	0.364	33%	0.326	S	S	.	.	H	α-helix	trans	-69.1	-32.5	177.6	-69.9	-25.8	0	0	0	112.1	S23 I24 I25 A31	S23-N27 WeakPolarHBondContact O-CB 3.47Å; S23-N27 PolarHBondContact O-N 3.01Å; S23-N27 PolarHBondContact O-ND2 2.81Å; S23-N27 PolarHBondContact OG-ND2 3.39Å; I24-N27 PolarHBondContact O-N 3.27Å; I25-N27 VanDerWaalsContact C-N 3.33Å; I25-N27 PolarHBondContact O-N 2.76Å; N27-A31 WeakPolarHBondContact O-CB 3.31Å; N27-A31 PolarHBondContact O-N 2.78Å; N27-A31 VanDerWaalsContact O-N 3.11Å
28	Y	96	Very high	95	Very high	12 Å²	12	71.1 Å²	71.1	5%	0.047	35%	0.349	C	S	.	.	H	α-helix	trans	-62.5	-53.3	170	162.7	-111.8	0	0	0	111.4	I24 I25 R26 K30 A31 K36 Y41 F42 Y92 E95 F96	I24-Y28 WeakPolarHBondContact O-CB 3.27Å; I24-Y28 PolarHBondContact O-N 2.98Å; I25-Y28 WeakPolarHBondContact O-CB 3.22Å; I25-Y28 PolarHBondContact O-N 3.3Å; R26-Y28 VanDerWaalsContact C-N 3.32Å; Y28-K30 PolarHBondContact O-N 3.42Å; Y28-A31 WeakPolarHBondContact O-CB 3.4Å; Y28-A31 PolarHBondContact O-N 3.23Å; Y28-K36 HydrophobicContact CE2-CD 4Å; Y28-K36 HydrophobicContact CE2-CG 4.35Å; Y28-K36 WeakPolarHBondContact O-CE 3.38Å; Y28-K36 PolarHBondContact O-NZ 3.45Å; Y28-K36 VanDerWaalsContact O-NZ 3.09Å; Y28-Y41 WeakPolarHBondContact CA-OH 3.47Å; Y28-Y41 AromaticContact CD2-CE1 3.91Å; Y28-Y41 HydrophobicContact CD2-CE1 3.91Å; Y28-Y41 HydrophobicContact CE2-CE1 4.41Å; Y28-F42 HydrophobicContact CE2-CD1 4.48Å; Y28-F42 AromaticContact CE2-CE1 3.76Å; Y28-F42 HydrophobicContact CE2-CE1 3.76Å; Y28-Y92 AromaticContact CD1-CD1 3.81Å; Y28-Y92 HydrophobicContact CD1-CD1 3.81Å; Y28-Y92 AromaticContact CD1-CE1 3.77Å; Y28-Y92 HydrophobicContact CD1-CE1 3.77Å; Y28-Y92 AromaticContact CE1-CD1 3.99Å; Y28-Y92 HydrophobicContact CE1-CD1 3.99Å; Y28-Y92 AromaticContact CE1-CE1 3.82Å; Y28-Y92 HydrophobicContact CE1-CE1 3.82Å; Y28-E95 VanDerWaalsContact CE1-OE1 3.24Å; Y28-E95 WeakPolarHBondContact CE1-OE1 3.37Å; Y28-E95 VanDerWaalsContact CZ-OE1 3.25Å; Y28-E95 PolarHBondContact OH-OE1 2.9Å; Y28-F96 AromaticContact CD1-CE1 3.71Å; Y28-F96 HydrophobicContact CD1-CE1 3.71Å; Y28-F96 HydrophobicContact CD1-CZ 4.18Å; Y28-F96 AromaticContact CD2-CE1 3.72Å; Y28-F96 HydrophobicContact CD2-CE1 3.72Å; Y28-F96 HydrophobicContact CD2-CZ 4.4Å; Y28-F96 AromaticContact CE1-CE1 3.93Å; Y28-F96 HydrophobicContact CE1-CE1 3.93Å; Y28-F96 AromaticContact CE2-CE1 3.98Å; Y28-F96 HydrophobicContact CE2-CE1 3.98Å; Y28-F96 AromaticContact CG-CE1 3.59Å; Y28-F96 HydrophobicContact CG-CE1 3.59Å; Y28-F96 AromaticContact CG-CZ 3.96Å; Y28-F96 HydrophobicContact CG-CZ 3.96Å
29	K	95.3	Very high	94.5	Very high	121 Å²	121	73.7 Å²	73.7	53%	0.526	37%	0.366	S	S	.	.	H	α-helix	trans	-54.2	-43.4	179.3	-72.1	-178.3	179.6	-171.3	0	111.9	I25 R26 A31 K36 Y92	I25-K29 HydrophobicContact CG2-CD 4.43Å; I25-K29 WeakPolarHBondContact O-CG 3.34Å; I25-K29 PolarHBondContact O-N 3.11Å; R26-K29 PolarHBondContact O-N 3.45Å; K29-A31 PolarHBondContact O-N 3.23Å; K29-K36 PolarHBondContact O-NZ 3.27Å; K29-Y92 WeakPolarHBondContact CE-OH 3.41Å; K29-Y92 PolarHBondContact NZ-OH 3.05Å
30	K	96.5	Very high	94.1	Very high	163 Å²	163	71.6 Å²	71.6	71%	0.709	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-8.2	179.7	-66.5	-177.1	177.9	-168.7	0	115.3	R26 Y28	R26-K30 HydrophobicContact CG-CD 4.38Å; R26-K30 WeakPolarHBondContact O-CG 3.41Å; R26-K30 PolarHBondContact O-N 3.18Å; R26-K30 VanDerWaalsContact O-N 3.09Å; Y28-K30 PolarHBondContact O-N 3.42Å
31	A	94.6	Very high	93.9	Very high	11 Å²	11	68.3 Å²	68.3	9%	0.091	35%	0.353	C	S	.	.	S	Bend	trans	-69.1	139.8	-176.9	0	0	0	0	0	111.4	N27 Y28 K29 K36 Y41	N27-A31 WeakPolarHBondContact O-CB 3.31Å; N27-A31 PolarHBondContact O-N 2.78Å; N27-A31 VanDerWaalsContact O-N 3.11Å; Y28-A31 WeakPolarHBondContact O-CB 3.4Å; Y28-A31 PolarHBondContact O-N 3.23Å; K29-A31 PolarHBondContact O-N 3.23Å; A31-K36 HydrophobicContact CB-CG 4.29Å; A31-K36 WeakPolarHBondContact O-CE 3.44Å; A31-Y41 HydrophobicContact CB-CE1 4.43Å; A31-Y41 WeakPolarHBondContact CB-OH 3.38Å
32	P	95.1	Very high	93.7	Very high	72 Å²	72	68.5 Å²	68.5	47%	0.468	35%	0.354	S	S	.	.			trans	-66.3	153.8	178.3	28.5	-35.2	0	0	0	111.2	Q34 R35 K36	P32-Q34 VanDerWaalsContact C-N 3.27Å; P32-Q34 PolarHBondContact O-N 3.3Å; P32-R35 HydrophobicContact CG-CB 4.07Å; P32-R35 WeakPolarHBondContact O-CB 3.46Å; P32-R35 PolarHBondContact O-N 3.01Å; P32-K36 PolarHBondContact O-N 3.01Å
33	A	91.4	Very high	93.4	Very high	80 Å²	80	70.9 Å²	70.9	66%	0.661	37%	0.365	S	S	*	.	H	α-helix	trans	-54.6	-41.4	-179	0	0	0	0	0	112.7	R35 K36 S37	A33-R35 PolarHBondContact O-N 2.89Å; A33-R35 VanDerWaalsContact O-N 3.15Å; A33-K36 CarbonylContact O-C 3.41Å; A33-K36 WeakPolarHBondContact O-CA 3.26Å; A33-K36 PolarHBondContact O-N 2.71Å; A33-S37 PolarHBondContact O-N 3.03Å
34	Q	91.5	Very high	93.1	Very high	158 Å²	158	71.3 Å²	71.3	74%	0.738	38%	0.375	S	S	*	.	H	α-helix	trans	-58.8	-27.7	177	-167.7	-169.8	9.9	0	0	113.7	P32 S37	P32-Q34 VanDerWaalsContact C-N 3.27Å; P32-Q34 PolarHBondContact O-N 3.3Å; Q34-S37 PolarHBondContact O-OG 3.09Å
35	R	90.7	Very high	93	Very high	134 Å²	134	73 Å²	73	51%	0.506	38%	0.381	S	S	.	.	H	α-helix	trans	-81.5	-36.9	174.6	-169.8	178.9	-64.1	-178.3	-0.4	110.9	P32 A33 S37 K38 Y41	P32-R35 HydrophobicContact CG-CB 4.07Å; P32-R35 WeakPolarHBondContact O-CB 3.46Å; P32-R35 PolarHBondContact O-N 3.01Å; A33-R35 PolarHBondContact O-N 2.89Å; A33-R35 VanDerWaalsContact O-N 3.15Å; R35-S37 PolarHBondContact O-N 2.92Å; R35-K38 PolarHBondContact O-N 3.28Å; R35-Y41 HydrophobicContact CG-CD2 3.5Å; R35-Y41 VanDerWaalsContact CG-CD2 3.5Å; R35-Y41 HydrophobicContact CG-CE2 3.69Å; R35-Y41 HydrophobicContact CG-CG 3.97Å; R35-Y41 VanDerWaalsContact O-CB 3.27Å; R35-Y41 WeakPolarHBondContact O-CB 3.37Å
36	K	90.6	Very high	92.9	Very high	56 Å²	56	73.4 Å²	73.4	24%	0.243	38%	0.383	C	S	.	.	H	α-helix	trans	-74.8	-6.8	177.1	-64.9	-177.4	-179.7	176.3	0	113.5	Y28 K29 A31 P32 A33 K38 Y41 F42	Y28-K36 HydrophobicContact CE2-CD 4Å; Y28-K36 HydrophobicContact CE2-CG 4.35Å; Y28-K36 WeakPolarHBondContact O-CE 3.38Å; Y28-K36 PolarHBondContact O-NZ 3.45Å; Y28-K36 VanDerWaalsContact O-NZ 3.09Å; K29-K36 PolarHBondContact O-NZ 3.27Å; A31-K36 HydrophobicContact CB-CG 4.29Å; A31-K36 WeakPolarHBondContact O-CE 3.44Å; P32-K36 PolarHBondContact O-N 3.01Å; A33-K36 CarbonylContact O-C 3.41Å; A33-K36 WeakPolarHBondContact O-CA 3.26Å; A33-K36 PolarHBondContact O-N 2.71Å; K36-K38 VanDerWaalsContact C-N 3.31Å; K36-Y41 HydrophobicContact CG-CD1 4.4Å; K36-Y41 HydrophobicContact CG-CE1 3.97Å; K36-F42 HydrophobicContact CB-CZ 4.07Å; K36-F42 WeakPolarHBondContact O-CE2 3.37Å; K36-F42 WeakPolarHBondContact O-CZ 3.29Å
37	S	86.8	Confident	92.7	Very high	79 Å²	79	71.4 Å²	71.4	55%	0.552	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-2.7	173.7	67.5	0	0	0	0	113.1	A33 Q34 R35	A33-S37 PolarHBondContact O-N 3.03Å; Q34-S37 PolarHBondContact O-OG 3.09Å; R35-S37 PolarHBondContact O-N 2.92Å
38	K	88.6	Confident	92.7	Very high	127 Å²	127	73.9 Å²	73.9	55%	0.552	40%	0.395	S	S	*	.			trans	-100.2	122.8	-178.5	-61.2	-172.6	179.2	-169.3	0	109.8	R35 K36 G40 Y41	R35-K38 PolarHBondContact O-N 3.28Å; K36-K38 VanDerWaalsContact C-N 3.31Å; K38-G40 VanDerWaalsContact C-N 3.34Å; K38-G40 PolarHBondContact O-N 2.93Å; K38-Y41 VanDerWaalsContact O-CB 3.23Å; K38-Y41 WeakPolarHBondContact O-CB 3.41Å; K38-Y41 PolarHBondContact O-N 3.39Å
39	P	86.5	Confident	92.8	Very high	55 Å²	55	73.3 Å²	73.3	36%	0.357	39%	0.393	S	S	.	.	H	α-helix	trans	-53.3	-48.3	177.7	-26.5	32.6	0	0	0	113	Y41 F42 E43 L100	P39-Y41 PolarHBondContact O-N 3.44Å; P39-F42 PolarHBondContact O-N 3.08Å; P39-E43 PolarHBondContact O-N 3.29Å; P39-L100 WeakPolarHBondContact O-CD2 3.5Å
40	G	90.6	Very high	92.8	Very high	44 Å²	44	71.7 Å²	71.7	45%	0.454	39%	0.387	S	S	.	.	H	α-helix	trans	-60.3	-16.4	179.1	0	0	0	0	0	115.1	K38 G44	K38-G40 VanDerWaalsContact C-N 3.34Å; K38-G40 PolarHBondContact O-N 2.93Å; G40-G44 PolarHBondContact O-N 2.98Å; G40-G44 VanDerWaalsContact O-N 3.15Å
41	Y	93.8	Very high	92.8	Very high	28 Å²	28	67.8 Å²	67.8	11%	0.11	38%	0.38	C	S	.	.	H	α-helix	trans	-68.2	-43	170.3	175.4	-106	0	0	0	111.7	Y28 A31 R35 K36 K38 P39 R45	Y28-Y41 WeakPolarHBondContact CA-OH 3.47Å; Y28-Y41 AromaticContact CD2-CE1 3.91Å; Y28-Y41 HydrophobicContact CD2-CE1 3.91Å; Y28-Y41 HydrophobicContact CE2-CE1 4.41Å; A31-Y41 HydrophobicContact CB-CE1 4.43Å; A31-Y41 WeakPolarHBondContact CB-OH 3.38Å; R35-Y41 HydrophobicContact CG-CD2 3.5Å; R35-Y41 VanDerWaalsContact CG-CD2 3.5Å; R35-Y41 HydrophobicContact CG-CE2 3.69Å; R35-Y41 HydrophobicContact CG-CG 3.97Å; R35-Y41 VanDerWaalsContact O-CB 3.27Å; R35-Y41 WeakPolarHBondContact O-CB 3.37Å; K36-Y41 HydrophobicContact CG-CD1 4.4Å; K36-Y41 HydrophobicContact CG-CE1 3.97Å; K38-Y41 VanDerWaalsContact O-CB 3.23Å; K38-Y41 WeakPolarHBondContact O-CB 3.41Å; K38-Y41 PolarHBondContact O-N 3.39Å; P39-Y41 PolarHBondContact O-N 3.44Å; Y41-R45 HydrophobicContact CD2-CG 4.49Å; Y41-R45 HydrophobicContact CE1-CG 4.29Å; Y41-R45 HydrophobicContact CE2-CG 4.17Å; Y41-R45 WeakPolarHBondContact O-CB 3.29Å; Y41-R45 WeakPolarHBondContact O-CG 3.47Å; Y41-R45 PolarHBondContact O-N 3.37Å; Y41-R45 PolarHBondContact OH-NE 2.97Å
42	F	93.5	Very high	92.9	Very high	4 Å²	4	68.3 Å²	68.3	2%	0.018	38%	0.381	C	S	.	.	H	α-helix	trans	-73.7	-38.9	178.6	-61.8	-73.5	0	0	0	111.4	Y28 K36 P39 G44 R45 L46 F96 K99 L100	Y28-F42 HydrophobicContact CE2-CD1 4.48Å; Y28-F42 AromaticContact CE2-CE1 3.76Å; Y28-F42 HydrophobicContact CE2-CE1 3.76Å; K36-F42 HydrophobicContact CB-CZ 4.07Å; K36-F42 WeakPolarHBondContact O-CE2 3.37Å; K36-F42 WeakPolarHBondContact O-CZ 3.29Å; P39-F42 PolarHBondContact O-N 3.08Å; F42-G44 PolarHBondContact O-N 3.2Å; F42-R45 PolarHBondContact O-N 2.85Å; F42-R45 VanDerWaalsContact O-N 3.16Å; F42-L46 WeakPolarHBondContact O-CB 3.45Å; F42-L46 PolarHBondContact O-N 3.31Å; F42-F96 AromaticContact CD1-CD1 3.98Å; F42-F96 HydrophobicContact CD1-CD1 3.98Å; F42-K99 HydrophobicContact CD1-CB 3.83Å; F42-K99 HydrophobicContact CD1-CG 4.44Å; F42-K99 HydrophobicContact CD2-CB 4.04Å; F42-K99 HydrophobicContact CE1-CB 3.6Å; F42-K99 HydrophobicContact CE1-CG 3.83Å; F42-K99 HydrophobicContact CE2-CB 3.82Å; F42-K99 HydrophobicContact CG-CB 4.04Å; F42-K99 HydrophobicContact CZ-CB 3.61Å; F42-K99 HydrophobicContact CZ-CD 4.24Å; F42-K99 HydrophobicContact CZ-CG 3.92Å; F42-L100 HydrophobicContact CB-CD1 4.24Å; F42-L100 HydrophobicContact CB-CD2 3.61Å; F42-L100 HydrophobicContact CB-CG 3.62Å
43	E	91.8	Very high	93	Very high	109 Å²	109	67.4 Å²	67.4	51%	0.509	37%	0.369	S	S	.	.	H	α-helix	trans	-57.4	-50.6	175.3	-61.5	178.3	160.4	0	0	111	P39 R45 L46 S47 L100	P39-E43 PolarHBondContact O-N 3.29Å; E43-R45 VanDerWaalsContact C-N 3.27Å; E43-R45 PolarHBondContact O-N 3.33Å; E43-L46 PolarHBondContact O-N 2.94Å; E43-S47 WeakPolarHBondContact O-CB 3.47Å; E43-S47 PolarHBondContact O-N 3.32Å; E43-L100 HydrophobicContact CB-CD2 4.48Å; E43-L100 HydrophobicContact CG-CD1 4.35Å; E43-L100 HydrophobicContact CG-CD2 3.48Å; E43-L100 VanDerWaalsContact CG-CD2 3.48Å
44	G	93.5	Very high	93.2	Very high	44 Å²	44	67.5 Å²	67.5	45%	0.454	36%	0.358	S	S	.	.	H	α-helix	trans	-64.7	-31.5	179	0	0	0	0	0	113	G40 F42 K48	G40-G44 PolarHBondContact O-N 2.98Å; G40-G44 VanDerWaalsContact O-N 3.15Å; F42-G44 PolarHBondContact O-N 3.2Å; G44-K48 VanDerWaalsContact O-CB 3.31Å; G44-K48 WeakPolarHBondContact O-CB 3.3Å; G44-K48 PolarHBondContact O-N 2.95Å
45	R	94.6	Very high	93.3	Very high	40 Å²	40	62 Å²	62	15%	0.151	34%	0.34	C	S	.	.	H	α-helix	trans	-72.2	-43.6	175	-72.4	-72.6	-179.5	-159.9	-0.1	111.8	Y41 F42 E43 L49 F96	Y41-R45 HydrophobicContact CD2-CG 4.49Å; Y41-R45 HydrophobicContact CE1-CG 4.29Å; Y41-R45 HydrophobicContact CE2-CG 4.17Å; Y41-R45 WeakPolarHBondContact O-CB 3.29Å; Y41-R45 WeakPolarHBondContact O-CG 3.47Å; Y41-R45 PolarHBondContact O-N 3.37Å; Y41-R45 PolarHBondContact OH-NE 2.97Å; F42-R45 PolarHBondContact O-N 2.85Å; F42-R45 VanDerWaalsContact O-N 3.16Å; E43-R45 VanDerWaalsContact C-N 3.27Å; E43-R45 PolarHBondContact O-N 3.33Å; R45-L49 VanDerWaalsContact O-CB 3.27Å; R45-L49 WeakPolarHBondContact O-CB 3.4Å; R45-L49 PolarHBondContact O-N 2.93Å; R45-F96 HydrophobicContact CB-CD2 4.14Å; R45-F96 HydrophobicContact CB-CE2 3.77Å; R45-F96 HydrophobicContact CB-CZ 4.03Å
46	L	94.3	Very high	93.5	Very high	17 Å²	17	55.6 Å²	55.6	9%	0.089	32%	0.315	C	S	.	.	H	α-helix	trans	-63.8	-51.3	178.3	179.6	64	0	0	0	111.1	F42 E43 K48 L49 Q50 T93 F96 N97 L100	F42-L46 WeakPolarHBondContact O-CB 3.45Å; F42-L46 PolarHBondContact O-N 3.31Å; E43-L46 PolarHBondContact O-N 2.94Å; L46-K48 VanDerWaalsContact C-N 3.3Å; L46-K48 PolarHBondContact O-N 3.49Å; L46-L49 WeakPolarHBondContact O-CB 3.39Å; L46-L49 PolarHBondContact O-N 3.38Å; L46-L49 VanDerWaalsContact O-N 3.08Å; L46-Q50 HydrophobicContact CD1-CG 4.27Å; L46-Q50 WeakPolarHBondContact O-CB 3.49Å; L46-Q50 WeakPolarHBondContact O-CG 3.21Å; L46-Q50 PolarHBondContact O-N 3.39Å; L46-T93 HydrophobicContact CD1-CG2 3.94Å; L46-F96 HydrophobicContact CB-CB 4.33Å; L46-F96 HydrophobicContact CB-CD2 4.29Å; L46-F96 HydrophobicContact CD1-CB 4.43Å; L46-N97 WeakPolarHBondContact CD2-OD1 3.21Å; L46-L100 HydrophobicContact CD2-CD1 4.05Å
47	S	95.2	Very high	93.7	Very high	77 Å²	77	54.4 Å²	54.4	54%	0.538	31%	0.314	S	S	.	.	H	α-helix	trans	-55.8	-44.9	177.4	175.1	0	0	0	0	111.7	E43 Q50 S51	E43-S47 WeakPolarHBondContact O-CB 3.47Å; E43-S47 PolarHBondContact O-N 3.32Å; S47-Q50 PolarHBondContact O-N 3.35Å; S47-S51 WeakPolarHBondContact O-CB 3.42Å; S47-S51 PolarHBondContact O-N 3.14Å
48	K	96.9	Very high	93.9	Very high	120 Å²	120	57.6 Å²	57.6	52%	0.522	32%	0.318	S	S	.	.	H	α-helix	trans	-68.1	-37.8	177.5	-164.7	178.5	-179.7	160.6	0	112.7	I24 G44 L46 L52	I24-K48 HydrophobicContact CD1-CB 4.01Å; I24-K48 HydrophobicContact CD1-CD 3.78Å; I24-K48 HydrophobicContact CD1-CG 3.6Å; I24-K48 HydrophobicContact CG1-CD 4.28Å; G44-K48 VanDerWaalsContact O-CB 3.31Å; G44-K48 WeakPolarHBondContact O-CB 3.3Å; G44-K48 PolarHBondContact O-N 2.95Å; L46-K48 VanDerWaalsContact C-N 3.3Å; L46-K48 PolarHBondContact O-N 3.49Å; K48-L52 WeakPolarHBondContact O-CG 3.2Å; K48-L52 PolarHBondContact O-N 3.38Å; K48-L52 VanDerWaalsContact O-N 3.14Å
49	L	96.8	Very high	94	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-64.3	-46	176.8	-177.9	62.8	0	0	0	110.8	I21 R45 L46 L52 W53 V89 F96	I21-L49 HydrophobicContact CG1-CD1 4.41Å; I21-L49 HydrophobicContact CG2-CD1 3.78Å; R45-L49 VanDerWaalsContact O-CB 3.27Å; R45-L49 WeakPolarHBondContact O-CB 3.4Å; R45-L49 PolarHBondContact O-N 2.93Å; L46-L49 WeakPolarHBondContact O-CB 3.39Å; L46-L49 PolarHBondContact O-N 3.38Å; L46-L49 VanDerWaalsContact O-N 3.08Å; L49-L52 PolarHBondContact O-N 3.01Å; L49-W53 WeakPolarHBondContact O-CB 3.31Å; L49-W53 PolarHBondContact O-N 3.31Å; L49-V89 HydrophobicContact CD1-CG2 4.1Å; L49-F96 HydrophobicContact CD2-CD2 4.23Å; L49-F96 HydrophobicContact CD2-CE2 3.95Å
50	Q	95.9	Very high	94.2	Very high	88 Å²	88	50 Å²	50	41%	0.411	28%	0.281	S	S	.	.	H	α-helix	trans	-60.6	-49.3	176.4	-73	169.7	-32.9	0	0	111.3	L46 S47 L52 W53 D54	L46-Q50 HydrophobicContact CD1-CG 4.27Å; L46-Q50 WeakPolarHBondContact O-CB 3.49Å; L46-Q50 WeakPolarHBondContact O-CG 3.21Å; L46-Q50 PolarHBondContact O-N 3.39Å; S47-Q50 PolarHBondContact O-N 3.35Å; Q50-L52 VanDerWaalsContact C-N 3.32Å; Q50-L52 PolarHBondContact O-N 2.92Å; Q50-W53 CarbonylContact O-C 3.6Å; Q50-W53 PolarHBondContact O-N 2.9Å; Q50-W53 VanDerWaalsContact O-N 3.07Å; Q50-D54 VanDerWaalsContact O-CG 3.27Å; Q50-D54 PolarHBondContact O-N 3.09Å
51	S	95.5	Very high	94.1	Very high	80 Å²	80	52.8 Å²	52.8	56%	0.559	29%	0.286	S	S	*	.	H	α-helix	trans	-57.7	-41.8	178.2	177.8	0	0	0	0	113	S47 A55	S47-S51 WeakPolarHBondContact O-CB 3.42Å; S47-S51 PolarHBondContact O-N 3.14Å; S51-A55 PolarHBondContact O-N 3.07Å
52	L	97.2	Very high	93.8	Very high	22 Å²	22	54.2 Å²	54.2	12%	0.115	30%	0.298	C	S	.	.	H	α-helix	trans	-69.9	-38.6	175.3	-71.5	178.7	0	0	0	112.5	L17 K20 I21 I24 K48 L49 Q50 A55 F56	L17-L52 HydrophobicContact CD2-CD2 3.97Å; K20-L52 HydrophobicContact CB-CD1 3.71Å; K20-L52 HydrophobicContact CB-CD2 4.2Å; K20-L52 HydrophobicContact CD-CD2 4.16Å; I21-L52 HydrophobicContact CD1-CB 4.22Å; I21-L52 HydrophobicContact CG1-CB 3.7Å; I21-L52 HydrophobicContact CG1-CD1 4.04Å; I24-L52 HydrophobicContact CD1-CD1 3.44Å; I24-L52 VanDerWaalsContact CD1-CD1 3.44Å; I24-L52 HydrophobicContact CD1-CG 4.49Å; I24-L52 HydrophobicContact CG1-CD1 4.36Å; K48-L52 WeakPolarHBondContact O-CG 3.2Å; K48-L52 PolarHBondContact O-N 3.38Å; K48-L52 VanDerWaalsContact O-N 3.14Å; L49-L52 PolarHBondContact O-N 3.01Å; Q50-L52 VanDerWaalsContact C-N 3.32Å; Q50-L52 PolarHBondContact O-N 2.92Å; L52-A55 PolarHBondContact O-N 2.86Å; L52-F56 WeakPolarHBondContact O-CB 3.41Å; L52-F56 PolarHBondContact O-N 3.12Å
53	W	97.9	Very high	93.6	Very high	54 Å²	54	54 Å²	54	21%	0.205	30%	0.297	C	S	.	.	H	α-helix	trans	-65	-39.1	177.1	174.3	-112.2	0	0	0	112	L49 Q50 A55 F56 S57 F82 I85 K86 V89	L49-W53 WeakPolarHBondContact O-CB 3.31Å; L49-W53 PolarHBondContact O-N 3.31Å; Q50-W53 CarbonylContact O-C 3.6Å; Q50-W53 PolarHBondContact O-N 2.9Å; Q50-W53 VanDerWaalsContact O-N 3.07Å; W53-A55 VanDerWaalsContact C-N 3.34Å; W53-A55 PolarHBondContact O-N 2.9Å; W53-F56 HydrophobicContact CE3-CB 4.42Å; W53-F56 AromaticContact CE3-CD1 3.83Å; W53-F56 HydrophobicContact CE3-CD1 3.83Å; W53-F56 HydrophobicContact CH2-CD1 4.42Å; W53-F56 AromaticContact CZ3-CD1 3.48Å; W53-F56 HydrophobicContact CZ3-CD1 3.48Å; W53-F56 VanDerWaalsContact CZ3-CD1 3.48Å; W53-F56 AromaticContact CZ3-CE1 3.93Å; W53-F56 HydrophobicContact CZ3-CE1 3.93Å; W53-F56 PolarHBondContact O-N 3.48Å; W53-S57 VanDerWaalsContact O-CB 3.31Å; W53-S57 WeakPolarHBondContact O-CB 3.31Å; W53-S57 PolarHBondContact O-N 3.18Å; W53-S57 PolarHBondContact O-OG 2.78Å; W53-F82 AromaticContact CH2-CE2 3.82Å; W53-F82 HydrophobicContact CH2-CE2 3.82Å; W53-F82 AromaticContact CH2-CZ 3.83Å; W53-F82 HydrophobicContact CH2-CZ 3.83Å; W53-F82 HydrophobicContact CZ3-CE2 4.26Å; W53-I85 HydrophobicContact CE3-CG2 4.49Å; W53-I85 HydrophobicContact CZ3-CG2 4.31Å; W53-K86 HydrophobicContact CH2-CB 3.71Å; W53-K86 HydrophobicContact CH2-CD 4.37Å; W53-K86 HydrophobicContact CH2-CG 3.75Å; W53-K86 HydrophobicContact CZ2-CG 4.18Å; W53-K86 HydrophobicContact CZ3-CB 4.15Å; W53-V89 HydrophobicContact CB-CG1 4.05Å; W53-V89 HydrophobicContact CB-CG2 4.3Å; W53-V89 HydrophobicContact CD2-CB 4.3Å; W53-V89 HydrophobicContact CD2-CG1 3.92Å; W53-V89 HydrophobicContact CD2-CG2 4.12Å; W53-V89 HydrophobicContact CE3-CB 4.22Å; W53-V89 HydrophobicContact CE3-CG1 4.34Å; W53-V89 HydrophobicContact CE3-CG2 3.72Å; W53-V89 HydrophobicContact CG-CG1 3.77Å; W53-V89 HydrophobicContact CG-CG2 4.38Å; W53-V89 HydrophobicContact CZ3-CG2 4.41Å
54	D	94.8	Very high	93.4	Very high	82 Å²	82	53.4 Å²	53.4	44%	0.439	29%	0.292	S	S	.	.	H	α-helix	trans	-62.7	-42.4	175.8	-69	-15.7	0	0	0	111.2	Q50 S57 K58	Q50-D54 VanDerWaalsContact O-CG 3.27Å; Q50-D54 PolarHBondContact O-N 3.09Å; D54-S57 WeakPolarHBondContact CA-OG 3.32Å; D54-S57 PolarHBondContact O-OG 3.07Å; D54-S57 VanDerWaalsContact O-OG 3.12Å; D54-K58 WeakPolarHBondContact O-CB 3.42Å; D54-K58 WeakPolarHBondContact O-CD 3.41Å; D54-K58 WeakPolarHBondContact O-CG 3.46Å; D54-K58 PolarHBondContact O-N 3.26Å
55	A	94.9	Very high	92.9	Very high	42 Å²	42	55.4 Å²	55.4	35%	0.347	30%	0.296	S	S	.	.	H	α-helix	trans	-65.3	-42.3	174.3	0	0	0	0	0	112	L17 S51 L52 W53 G59	L17-A55 HydrophobicContact CD1-CB 4.07Å; L17-A55 HydrophobicContact CD2-CB 4.13Å; S51-A55 PolarHBondContact O-N 3.07Å; L52-A55 PolarHBondContact O-N 2.86Å; W53-A55 VanDerWaalsContact C-N 3.34Å; W53-A55 PolarHBondContact O-N 2.9Å; A55-G59 PolarHBondContact O-N 2.89Å
56	F	94.8	Very high	92.2	Very high	0 Å²	0	58 Å²	58	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-65.1	-51.2	179.4	-173.2	-96.5	0	0	0	111.7	Q14 L17 I21 L52 W53 K58 G59 E60 Y76 F81 F82 I85	Q14-F56 HydrophobicContact CB-CE2 4.26Å; Q14-F56 PolarHBondContact NE2-O 3.48Å; Q14-F56 VanDerWaalsContact O-CE2 3.31Å; Q14-F56 WeakPolarHBondContact O-CE2 3.39Å; Q14-F56 PolarHBondContact OE1-O 3.37Å; L17-F56 HydrophobicContact CB-CB 4.41Å; L17-F56 HydrophobicContact CB-CD2 3.88Å; I21-F56 HydrophobicContact CD1-CB 4.25Å; I21-F56 HydrophobicContact CD1-CG 4.41Å; L52-F56 WeakPolarHBondContact O-CB 3.41Å; L52-F56 PolarHBondContact O-N 3.12Å; W53-F56 HydrophobicContact CE3-CB 4.42Å; W53-F56 AromaticContact CE3-CD1 3.83Å; W53-F56 HydrophobicContact CE3-CD1 3.83Å; W53-F56 HydrophobicContact CH2-CD1 4.42Å; W53-F56 AromaticContact CZ3-CD1 3.48Å; W53-F56 HydrophobicContact CZ3-CD1 3.48Å; W53-F56 VanDerWaalsContact CZ3-CD1 3.48Å; W53-F56 AromaticContact CZ3-CE1 3.93Å; W53-F56 HydrophobicContact CZ3-CE1 3.93Å; W53-F56 PolarHBondContact O-N 3.48Å; F56-K58 VanDerWaalsContact C-N 3.34Å; F56-K58 PolarHBondContact O-N 3.44Å; F56-G59 PolarHBondContact O-N 3.18Å; F56-E60 PolarHBondContact O-N 3.43Å; F56-Y76 HydrophobicContact CE2-CE2 4.41Å; F56-Y76 HydrophobicContact CZ-CE2 4.28Å; F56-F81 HydrophobicContact CE2-CD1 4.19Å; F56-F81 AromaticContact CE2-CE1 3.89Å; F56-F81 HydrophobicContact CE2-CE1 3.89Å; F56-F81 HydrophobicContact CZ-CD1 4.07Å; F56-F81 HydrophobicContact CZ-CE1 4.17Å; F56-F82 HydrophobicContact CD1-CD2 4.13Å; F56-F82 HydrophobicContact CD1-CE2 4.19Å; F56-F82 AromaticContact CE1-CD2 3.39Å; F56-F82 HydrophobicContact CE1-CD2 3.39Å; F56-F82 AromaticContact CE1-CE2 3.86Å; F56-F82 HydrophobicContact CE1-CE2 3.86Å; F56-F82 HydrophobicContact CE1-CG 4.33Å; F56-F82 HydrophobicContact CZ-CD2 4.15Å; F56-I85 HydrophobicContact CD1-CG2 4.03Å; F56-I85 HydrophobicContact CE1-CB 3.89Å; F56-I85 HydrophobicContact CE1-CG2 3.73Å; F56-I85 HydrophobicContact CE2-CG1 4.42Å; F56-I85 HydrophobicContact CE2-CG2 4.36Å; F56-I85 HydrophobicContact CG-CG2 4.43Å; F56-I85 HydrophobicContact CZ-CB 3.86Å; F56-I85 HydrophobicContact CZ-CG1 3.98Å; F56-I85 HydrophobicContact CZ-CG2 3.94Å
57	S	93.2	Very high	91.5	Very high	30 Å²	30	59 Å²	59	21%	0.21	31%	0.312	C	S	.	.	H	α-helix	trans	-61	-38.5	-179.7	58.8	0	0	0	0	113.2	W53 D54 G59 E60 N61	W53-S57 VanDerWaalsContact O-CB 3.31Å; W53-S57 WeakPolarHBondContact O-CB 3.31Å; W53-S57 PolarHBondContact O-N 3.18Å; W53-S57 PolarHBondContact O-OG 2.78Å; D54-S57 WeakPolarHBondContact CA-OG 3.32Å; D54-S57 PolarHBondContact O-OG 3.07Å; D54-S57 VanDerWaalsContact O-OG 3.12Å; S57-G59 VanDerWaalsContact C-N 3.34Å; S57-G59 PolarHBondContact O-N 3.36Å; S57-E60 PolarHBondContact O-N 2.93Å; S57-N61 PolarHBondContact O-N 2.99Å
58	K	90.9	Very high	90.5	Very high	147 Å²	147	63.2 Å²	63.2	64%	0.639	32%	0.322	S	S	*	.	H	α-helix	trans	-60.7	-42.1	172.5	-76	173.7	-176.5	178	0	112.4	D54 F56 T62	D54-K58 WeakPolarHBondContact O-CB 3.42Å; D54-K58 WeakPolarHBondContact O-CD 3.41Å; D54-K58 WeakPolarHBondContact O-CG 3.46Å; D54-K58 PolarHBondContact O-N 3.26Å; F56-K58 VanDerWaalsContact C-N 3.34Å; F56-K58 PolarHBondContact O-N 3.44Å; K58-T62 PolarHBondContact O-N 3.47Å; K58-T62 PolarHBondContact O-OG1 2.99Å
59	G	91.4	Very high	89.1	Confident	7 Å²	7	65.8 Å²	65.8	7%	0.072	33%	0.334	C	S	.	.	H	α-helix	trans	-68.7	-37.3	178	0	0	0	0	0	113.1	A55 F56 S57 N61 T62 I63	A55-G59 PolarHBondContact O-N 2.89Å; F56-G59 PolarHBondContact O-N 3.18Å; S57-G59 VanDerWaalsContact C-N 3.34Å; S57-G59 PolarHBondContact O-N 3.36Å; G59-N61 PolarHBondContact O-N 3.38Å; G59-T62 WeakPolarHBondContact O-CB 3.46Å; G59-T62 PolarHBondContact O-N 3.45Å; G59-T62 VanDerWaalsContact O-N 3.11Å; G59-I63 WeakPolarHBondContact O-CG1 3.4Å; G59-I63 PolarHBondContact O-N 2.91Å
60	E	91.6	Very high	87.9	Confident	15 Å²	15	70 Å²	70	7%	0.07	36%	0.359	C	S	.	.	H	α-helix	trans	-60.3	-43.1	174.7	173.7	66.1	172.3	0	0	112.4	F56 S57 T62 I63 K64 Y76 F82	F56-E60 PolarHBondContact O-N 3.43Å; S57-E60 PolarHBondContact O-N 2.93Å; E60-T62 PolarHBondContact O-N 3.21Å; E60-I63 PolarHBondContact O-N 2.92Å; E60-K64 HydrophobicContact CG-CD 4.37Å; E60-K64 HydrophobicContact CG-CG 4.38Å; E60-K64 PolarHBondContact O-N 3.3Å; E60-K64 WeakPolarHBondContact OE1-CE 3.29Å; E60-Y76 WeakPolarHBondContact OE2-CE1 3.4Å; E60-Y76 PolarHBondContact OE2-OH 3.26Å; E60-F82 HydrophobicContact CB-CD2 3.64Å; E60-F82 HydrophobicContact CB-CE2 3.61Å; E60-F82 HydrophobicContact CG-CD1 4.45Å; E60-F82 HydrophobicContact CG-CD2 3.42Å; E60-F82 VanDerWaalsContact CG-CD2 3.42Å; E60-F82 HydrophobicContact CG-CE1 4.46Å; E60-F82 HydrophobicContact CG-CE2 3.48Å; E60-F82 VanDerWaalsContact CG-CE2 3.48Å; E60-F82 HydrophobicContact CG-CG 3.96Å; E60-F82 HydrophobicContact CG-CZ 4.02Å
61	N	87	Confident	86.8	Confident	102 Å²	102	74.3 Å²	74.3	55%	0.545	38%	0.38	S	S	.	.	H	α-helix	trans	-58.3	-36.2	176.2	-70.4	-20	0	0	0	111.7	S57 G59 T65	S57-N61 PolarHBondContact O-N 2.99Å; G59-N61 PolarHBondContact O-N 3.38Å; N61-T65 PolarHBondContact O-N 2.86Å; N61-T65 PolarHBondContact O-OG1 3.49Å
62	T	88.4	Confident	85.9	Confident	59 Å²	59	72.9 Å²	72.9	36%	0.362	37%	0.365	S	S	.	.	H	α-helix	trans	-70.8	-38	175.2	-54.4	0	0	0	0	111.8	L10 K58 G59 E60 R66	L10-T62 HydrophobicContact CD2-CG2 3.58Å; K58-T62 PolarHBondContact O-N 3.47Å; K58-T62 PolarHBondContact O-OG1 2.99Å; G59-T62 WeakPolarHBondContact O-CB 3.46Å; G59-T62 PolarHBondContact O-N 3.45Å; G59-T62 VanDerWaalsContact O-N 3.11Å; E60-T62 PolarHBondContact O-N 3.21Å; T62-R66 WeakPolarHBondContact O-CG 3.45Å; T62-R66 PolarHBondContact O-N 2.92Å
63	I	89.6	Confident	85.1	Confident	0 Å²	0	79.5 Å²	79.5	0%	0	40%	0.395	C	S	.	.	H	α-helix	trans	-64.4	-49.2	176.4	-71.7	172.4	0	0	0	110.8	I7 L10 L11 Q14 G59 E60 T65 R66 N67 Y76 F77	I7-I63 HydrophobicContact CD1-CG1 4.1Å; L10-I63 HydrophobicContact CD2-CG1 3.58Å; L10-I63 HydrophobicContact CG-CD1 4.28Å; L10-I63 HydrophobicContact CG-CG1 3.85Å; L11-I63 HydrophobicContact CD2-CD1 3.67Å; L11-I63 HydrophobicContact CD2-CG1 4.32Å; L11-I63 HydrophobicContact CD2-CG2 4.4Å; L11-I63 HydrophobicContact CG-CD1 4.41Å; Q14-I63 HydrophobicContact CB-CD1 4.27Å; Q14-I63 HydrophobicContact CG-CD1 3.62Å; G59-I63 WeakPolarHBondContact O-CG1 3.4Å; G59-I63 PolarHBondContact O-N 2.91Å; E60-I63 PolarHBondContact O-N 2.92Å; I63-T65 VanDerWaalsContact C-N 3.34Å; I63-T65 PolarHBondContact O-N 3.19Å; I63-R66 CarbonylContact O-C 3.59Å; I63-R66 PolarHBondContact O-N 3.23Å; I63-N67 HydrophobicContact CG2-CB 4.5Å; I63-N67 WeakPolarHBondContact O-CB 3.41Å; I63-N67 PolarHBondContact O-N 3.34Å; I63-Y76 HydrophobicContact CD1-CE1 4.13Å; I63-Y76 HydrophobicContact CD1-CE2 4.48Å; I63-F77 HydrophobicContact CG2-CE1 3.57Å; I63-F77 HydrophobicContact CG2-CZ 3.45Å; I63-F77 VanDerWaalsContact CG2-CZ 3.45Å
64	K	86.7	Confident	84.6	Confident	95 Å²	95	79.6 Å²	79.6	41%	0.413	40%	0.398	S	S	.	.	H	α-helix	trans	-54.7	-50.2	-179.7	-72.8	-177.6	178.8	-179.3	0	111.8	E60 R66 N67 E68	E60-K64 HydrophobicContact CG-CD 4.37Å; E60-K64 HydrophobicContact CG-CG 4.38Å; E60-K64 PolarHBondContact O-N 3.3Å; E60-K64 WeakPolarHBondContact OE1-CE 3.29Å; K64-R66 PolarHBondContact O-N 3.45Å; K64-R66 VanDerWaalsContact O-N 3.13Å; K64-N67 PolarHBondContact O-N 3.41Å; K64-E68 WeakPolarHBondContact O-CG 3.4Å; K64-E68 PolarHBondContact O-N 3.02Å; K64-E68 VanDerWaalsContact O-N 3.13Å
65	T	82.7	Confident	84.3	Confident	86 Å²	86	79.4 Å²	79.4	53%	0.528	40%	0.4	S	S	.	.	H	α-helix	trans	-56.4	-31.4	177.4	-52.5	0	0	0	0	113.1	N61 I63	N61-T65 PolarHBondContact O-N 2.86Å; N61-T65 PolarHBondContact O-OG1 3.49Å; I63-T65 VanDerWaalsContact C-N 3.34Å; I63-T65 PolarHBondContact O-N 3.19Å
66	R	81.8	Confident	84.1	Confident	94 Å²	94	77.6 Å²	77.6	36%	0.355	38%	0.384	S	S	.	.	H	α-helix	trans	-88.8	-39.7	179.2	-70.9	178.7	177.4	-166	2.9	112.7	S5 I7 T62 I63 K64 K69 T70	S5-R66 PolarHBondContact O-NH1 3.3Å; I7-R66 HydrophobicContact CD1-CB 4.11Å; T62-R66 WeakPolarHBondContact O-CG 3.45Å; T62-R66 PolarHBondContact O-N 2.92Å; I63-R66 CarbonylContact O-C 3.59Å; I63-R66 PolarHBondContact O-N 3.23Å; K64-R66 PolarHBondContact O-N 3.45Å; K64-R66 VanDerWaalsContact O-N 3.13Å; R66-K69 WeakPolarHBondContact O-CB 3.37Å; R66-K69 PolarHBondContact O-N 3.13Å; R66-T70 PolarHBondContact O-OG1 2.96Å
67	N	78.9	Confident	83.9	Confident	40 Å²	40	80 Å²	80	21%	0.214	40%	0.395	C	S	.	.	H	α-helix	trans	-71	-31.4	-175.1	-171.3	50.9	0	0	0	112.8	I63 K64 K69 T70 Q71 M72 F77	I63-N67 HydrophobicContact CG2-CB 4.5Å; I63-N67 WeakPolarHBondContact O-CB 3.41Å; I63-N67 PolarHBondContact O-N 3.34Å; K64-N67 PolarHBondContact O-N 3.41Å; N67-K69 PolarHBondContact O-N 3.35Å; N67-T70 PolarHBondContact O-N 3.46Å; N67-T70 VanDerWaalsContact O-N 3.1Å; N67-Q71 PolarHBondContact O-N 3.2Å; N67-M72 PolarHBondContact OD1-N 3.48Å; N67-F77 HydrophobicContact CB-CE1 4.44Å; N67-F77 HydrophobicContact CB-CZ 4.06Å
68	E	73.4	Confident	83.6	Confident	164 Å²	164	85.1 Å²	85.1	77%	0.766	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-23.3	171.5	-75.9	170.8	-173.3	0	0	112.7	K64	K64-E68 WeakPolarHBondContact O-CG 3.4Å; K64-E68 PolarHBondContact O-N 3.02Å; K64-E68 VanDerWaalsContact O-N 3.13Å
69	K	69	Low	83.6	Confident	175 Å²	175	81.8 Å²	81.8	76%	0.761	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-22.3	-179.7	-58	-177.1	-179.1	-177.3	0	114.2	R66 N67	R66-K69 WeakPolarHBondContact O-CB 3.37Å; R66-K69 PolarHBondContact O-N 3.13Å; N67-K69 PolarHBondContact O-N 3.35Å
70	T	70.8	Confident	83.5	Confident	87 Å²	87	86.5 Å²	86.5	53%	0.534	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.5	-10	-164.9	52.4	0	0	0	0	115.2	R66 N67 M72	R66-T70 PolarHBondContact O-OG1 2.96Å; N67-T70 PolarHBondContact O-N 3.46Å; N67-T70 VanDerWaalsContact O-N 3.1Å; T70-M72 PolarHBondContact O-N 3.36Å; T70-M72 WeakPolarHBondContact OG1-CG 3.48Å
71	Q	72.1	Confident	83.7	Confident	179 Å²	179	86.4 Å²	86.4	84%	0.836	43%	0.425	S	S	*	.			trans	40.3	64.5	-177.7	-70.5	-162.2	-7.1	0	0	113	N67	N67-Q71 PolarHBondContact O-N 3.2Å
72	M	76.3	Confident	84	Confident	50 Å²	50	83.3 Å²	83.3	25%	0.246	41%	0.407	C	S	.	.			trans	-78	137.1	-169.5	-60.6	-173.6	74.1	0	0	113.4	I7 L11 N67 T70 H74 F77	I7-M72 HydrophobicContact CB-CE 4.46Å; I7-M72 HydrophobicContact CB-SD 4.18Å; I7-M72 HydrophobicContact CG1-CE 4.14Å; I7-M72 HydrophobicContact CG1-SD 3.43Å; I7-M72 WeakPolarHBondContact CG1-SD 3.36Å; I7-M72 HydrophobicContact CG2-CE 3.49Å; I7-M72 VanDerWaalsContact CG2-CE 3.49Å; I7-M72 HydrophobicContact CG2-SD 3.68Å; L11-M72 HydrophobicContact CD1-CE 4.35Å; N67-M72 PolarHBondContact OD1-N 3.48Å; T70-M72 PolarHBondContact O-N 3.36Å; T70-M72 WeakPolarHBondContact OG1-CG 3.48Å; M72-H74 PolarHBondContact O-N 3.05Å; M72-F77 HydrophobicContact CB-CD2 4.47Å; M72-F77 HydrophobicContact CB-CE2 3.96Å; M72-F77 WeakPolarHBondContact O-CD2 3.45Å
73	E	81.8	Confident	84.2	Confident	161 Å²	161	84.5 Å²	84.5	75%	0.752	41%	0.414	S	S	*	.			trans	-85.3	101.8	163.9	-69	-160.2	-159.9	0	0	110.9	K78	E73-K78 IonicContact OE2-NZ 2.76Å; E73-K78 PolarHBondContact OE2-NZ 3.34Å
74	H	86.5	Confident	84.6	Confident	57 Å²	57	89.9 Å²	89.9	26%	0.264	44%	0.437	S	S	.	.			trans	-140.3	148.5	174.2	-169.2	-98.7	0	0	0	111.1	L11 M72 Y76 F77 K78	L11-H74 HydrophobicContact CD1-CB 4.1Å; M72-H74 PolarHBondContact O-N 3.05Å; H74-Y76 WeakPolarHBondContact ND1-CB 3.42Å; H74-Y76 PolarHBondContact ND1-N 3.47Å; H74-Y76 VanDerWaalsContact ND1-N 3.15Å; H74-Y76 PolarHBondContact O-N 3.45Å; H74-Y76 VanDerWaalsContact O-N 3.12Å; H74-F77 HydrophobicContact CB-CD2 3.82Å; H74-F77 HydrophobicContact CB-CE2 4.06Å; H74-F77 PolarHBondContact O-N 2.88Å; H74-K78 PolarHBondContact O-N 3.41Å
75	T	89.5	Confident	85.1	Confident	78 Å²	78	85.3 Å²	85.3	48%	0.479	42%	0.417	S	S	.	.	H	α-helix	trans	-54.6	-32.5	179.4	-54.4	0	0	0	0	112.6	F77 K78 N79	T75-F77 VanDerWaalsContact C-N 3.31Å; T75-F77 PolarHBondContact O-N 3.36Å; T75-K78 PolarHBondContact O-N 2.88Å; T75-N79 WeakPolarHBondContact CG2-ND2 3.44Å; T75-N79 VanDerWaalsContact O-CB 3.27Å; T75-N79 WeakPolarHBondContact O-CB 3.26Å; T75-N79 PolarHBondContact O-N 2.87Å
76	Y	90.5	Very high	85.7	Confident	4 Å²	4	86.2 Å²	86.2	2%	0.016	41%	0.414	C	S	.	.	H	α-helix	trans	-52.1	-47.8	173.2	-175.5	-90.2	0	0	0	112.4	L11 Q14 M15 F56 E60 I63 H74 F81 F82	L11-Y76 HydrophobicContact CD2-CD1 3.94Å; L11-Y76 HydrophobicContact CD2-CD2 4.35Å; L11-Y76 HydrophobicContact CD2-CG 3.79Å; Q14-Y76 HydrophobicContact CB-CD2 4.3Å; Q14-Y76 HydrophobicContact CB-CE2 3.71Å; M15-Y76 HydrophobicContact CG-CD2 4.48Å; M15-Y76 HydrophobicContact SD-CD2 3.95Å; F56-Y76 HydrophobicContact CE2-CE2 4.41Å; F56-Y76 HydrophobicContact CZ-CE2 4.28Å; E60-Y76 WeakPolarHBondContact OE2-CE1 3.4Å; E60-Y76 PolarHBondContact OE2-OH 3.26Å; I63-Y76 HydrophobicContact CD1-CE1 4.13Å; I63-Y76 HydrophobicContact CD1-CE2 4.48Å; H74-Y76 WeakPolarHBondContact ND1-CB 3.42Å; H74-Y76 PolarHBondContact ND1-N 3.47Å; H74-Y76 VanDerWaalsContact ND1-N 3.15Å; H74-Y76 PolarHBondContact O-N 3.45Å; H74-Y76 VanDerWaalsContact O-N 3.12Å; Y76-F81 HydrophobicContact CD2-CB 3.98Å; Y76-F81 AromaticContact CD2-CD1 3.64Å; Y76-F81 HydrophobicContact CD2-CD1 3.64Å; Y76-F81 HydrophobicContact CD2-CG 4.17Å; Y76-F81 HydrophobicContact CE2-CB 4.3Å; Y76-F81 AromaticContact CE2-CD1 3.55Å; Y76-F81 HydrophobicContact CE2-CD1 3.55Å; Y76-F81 HydrophobicContact CE2-CE1 4.38Å; Y76-F81 HydrophobicContact CE2-CG 4.38Å; Y76-F81 HydrophobicContact CG-CB 4.3Å; Y76-F81 VanDerWaalsContact O-CB 3.27Å; Y76-F81 WeakPolarHBondContact O-CB 3.34Å; Y76-F81 PolarHBondContact O-N 3.09Å; Y76-F82 HydrophobicContact CE1-CB 4.33Å
77	F	89.8	Confident	86.4	Confident	51 Å²	51	85.7 Å²	85.7	22%	0.224	42%	0.421	C	S	.	.	H	α-helix	trans	-78.7	-48.3	179.6	-54	-64.3	0	0	0	111.3	L11 I63 N67 M72 H74 T75 N79 N80	L11-F77 HydrophobicContact CD1-CE2 4.46Å; L11-F77 HydrophobicContact CD2-CE2 4.14Å; L11-F77 HydrophobicContact CD2-CZ 4.02Å; I63-F77 HydrophobicContact CG2-CE1 3.57Å; I63-F77 HydrophobicContact CG2-CZ 3.45Å; I63-F77 VanDerWaalsContact CG2-CZ 3.45Å; N67-F77 HydrophobicContact CB-CE1 4.44Å; N67-F77 HydrophobicContact CB-CZ 4.06Å; M72-F77 HydrophobicContact CB-CD2 4.47Å; M72-F77 HydrophobicContact CB-CE2 3.96Å; M72-F77 WeakPolarHBondContact O-CD2 3.45Å; H74-F77 HydrophobicContact CB-CD2 3.82Å; H74-F77 HydrophobicContact CB-CE2 4.06Å; H74-F77 PolarHBondContact O-N 2.88Å; T75-F77 VanDerWaalsContact C-N 3.31Å; T75-F77 PolarHBondContact O-N 3.36Å; F77-N79 PolarHBondContact O-N 2.95Å; F77-N79 VanDerWaalsContact O-N 3.11Å; F77-N80 PolarHBondContact O-N 3.39Å
78	K	87.3	Confident	87.2	Confident	136 Å²	136	85.7 Å²	85.7	59%	0.591	42%	0.421	S	S	*	.	H	α-helix	trans	-55.8	-33.9	-178.5	-67.9	-174.5	179.9	-178.6	0	112.4	E73 H74 T75	E73-K78 IonicContact OE2-NZ 2.76Å; E73-K78 PolarHBondContact OE2-NZ 3.34Å; H74-K78 PolarHBondContact O-N 3.41Å; T75-K78 PolarHBondContact O-N 2.88Å
79	N	90.5	Very high	88.4	Confident	77 Å²	77	78.3 Å²	78.3	41%	0.412	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	3.6	-178.8	-69.9	-11	0	0	0	114.7	T75 F77 F81 K84	T75-N79 WeakPolarHBondContact CG2-ND2 3.44Å; T75-N79 VanDerWaalsContact O-CB 3.27Å; T75-N79 WeakPolarHBondContact O-CB 3.26Å; T75-N79 PolarHBondContact O-N 2.87Å; F77-N79 PolarHBondContact O-N 2.95Å; F77-N79 VanDerWaalsContact O-N 3.11Å; N79-F81 PolarHBondContact O-N 3.49Å; N79-K84 WeakPolarHBondContact O-CD 3.45Å; N79-K84 WeakPolarHBondContact O-CE 2.81Å; N79-K84 PolarHBondContact O-NZ 3.19Å
80	N	90.2	Very high	89.6	Confident	106 Å²	106	73.7 Å²	73.7	57%	0.567	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	45.1	-170.7	-67	-48.8	0	0	0	112	F77 F82 V83 K84	F77-N80 PolarHBondContact O-N 3.39Å; N80-F82 PolarHBondContact O-N 3.4Å; N80-V83 HydrophobicContact CB-CB 4.39Å; N80-V83 PolarHBondContact O-N 3.25Å; N80-K84 PolarHBondContact O-N 3.39Å; N80-K84 VanDerWaalsContact O-N 3.09Å
81	F	94.5	Very high	90.8	Very high	14 Å²	14	73.8 Å²	73.8	6%	0.061	37%	0.368	C	S	.	.	H	α-helix	trans	-60.8	-44	-168.6	-171.4	-105.3	0	0	0	112.2	M15 F56 Y76 N79 V83 K84 I85	M15-F81 HydrophobicContact CE-CD2 4.19Å; M15-F81 HydrophobicContact CE-CE2 3.97Å; M15-F81 HydrophobicContact CE-CZ 4.18Å; M15-F81 HydrophobicContact SD-CD1 3.79Å; M15-F81 HydrophobicContact SD-CD2 4.05Å; M15-F81 HydrophobicContact SD-CE1 3.84Å; M15-F81 HydrophobicContact SD-CE2 4.12Å; M15-F81 HydrophobicContact SD-CG 3.87Å; M15-F81 HydrophobicContact SD-CZ 4Å; F56-F81 HydrophobicContact CE2-CD1 4.19Å; F56-F81 AromaticContact CE2-CE1 3.89Å; F56-F81 HydrophobicContact CE2-CE1 3.89Å; F56-F81 HydrophobicContact CZ-CD1 4.07Å; F56-F81 HydrophobicContact CZ-CE1 4.17Å; Y76-F81 HydrophobicContact CD2-CB 3.98Å; Y76-F81 AromaticContact CD2-CD1 3.64Å; Y76-F81 HydrophobicContact CD2-CD1 3.64Å; Y76-F81 HydrophobicContact CD2-CG 4.17Å; Y76-F81 HydrophobicContact CE2-CB 4.3Å; Y76-F81 AromaticContact CE2-CD1 3.55Å; Y76-F81 HydrophobicContact CE2-CD1 3.55Å; Y76-F81 HydrophobicContact CE2-CE1 4.38Å; Y76-F81 HydrophobicContact CE2-CG 4.38Å; Y76-F81 HydrophobicContact CG-CB 4.3Å; Y76-F81 VanDerWaalsContact O-CB 3.27Å; Y76-F81 WeakPolarHBondContact O-CB 3.34Å; Y76-F81 PolarHBondContact O-N 3.09Å; N79-F81 PolarHBondContact O-N 3.49Å; F81-V83 PolarHBondContact O-N 3.47Å; F81-K84 PolarHBondContact O-N 3.43Å; F81-I85 HydrophobicContact CD1-CG1 4.06Å; F81-I85 HydrophobicContact CE1-CD1 4.36Å; F81-I85 HydrophobicContact CE1-CG1 3.79Å; F81-I85 HydrophobicContact CE2-CD1 4.22Å; F81-I85 HydrophobicContact CE2-CG1 4.26Å; F81-I85 HydrophobicContact CG-CG1 4.45Å; F81-I85 HydrophobicContact CZ-CD1 3.98Å; F81-I85 HydrophobicContact CZ-CG1 3.91Å; F81-I85 WeakPolarHBondContact O-CG1 3.49Å; F81-I85 PolarHBondContact O-N 2.97Å
82	F	94	Very high	91.9	Very high	37 Å²	37	65.7 Å²	65.7	16%	0.162	33%	0.329	C	S	.	.	H	α-helix	trans	-53.6	-50.3	175.4	179.5	-99.9	0	0	0	112.4	W53 F56 E60 Y76 N80 K84 I85 K86	W53-F82 AromaticContact CH2-CE2 3.82Å; W53-F82 HydrophobicContact CH2-CE2 3.82Å; W53-F82 AromaticContact CH2-CZ 3.83Å; W53-F82 HydrophobicContact CH2-CZ 3.83Å; W53-F82 HydrophobicContact CZ3-CE2 4.26Å; F56-F82 HydrophobicContact CD1-CD2 4.13Å; F56-F82 HydrophobicContact CD1-CE2 4.19Å; F56-F82 AromaticContact CE1-CD2 3.39Å; F56-F82 HydrophobicContact CE1-CD2 3.39Å; F56-F82 AromaticContact CE1-CE2 3.86Å; F56-F82 HydrophobicContact CE1-CE2 3.86Å; F56-F82 HydrophobicContact CE1-CG 4.33Å; F56-F82 HydrophobicContact CZ-CD2 4.15Å; E60-F82 HydrophobicContact CB-CD2 3.64Å; E60-F82 HydrophobicContact CB-CE2 3.61Å; E60-F82 HydrophobicContact CG-CD1 4.45Å; E60-F82 HydrophobicContact CG-CD2 3.42Å; E60-F82 VanDerWaalsContact CG-CD2 3.42Å; E60-F82 HydrophobicContact CG-CE1 4.46Å; E60-F82 HydrophobicContact CG-CE2 3.48Å; E60-F82 VanDerWaalsContact CG-CE2 3.48Å; E60-F82 HydrophobicContact CG-CG 3.96Å; E60-F82 HydrophobicContact CG-CZ 4.02Å; Y76-F82 HydrophobicContact CE1-CB 4.33Å; N80-F82 PolarHBondContact O-N 3.4Å; F82-K84 PolarHBondContact O-N 2.99Å; F82-I85 PolarHBondContact O-N 3.3Å; F82-K86 HydrophobicContact CE1-CB 4.48Å; F82-K86 HydrophobicContact CE1-CD 4.05Å; F82-K86 HydrophobicContact CZ-CD 4.36Å; F82-K86 WeakPolarHBondContact O-CB 3.44Å; F82-K86 PolarHBondContact O-N 2.82Å
83	V	93.5	Very high	92.9	Very high	84 Å²	84	64.7 Å²	64.7	51%	0.509	33%	0.327	S	S	.	.	H	α-helix	trans	-61.4	-45.8	-178.2	179.4	0	0	0	0	110.3	N80 F81 I85 K86 T87	N80-V83 HydrophobicContact CB-CB 4.39Å; N80-V83 PolarHBondContact O-N 3.25Å; F81-V83 PolarHBondContact O-N 3.47Å; V83-I85 PolarHBondContact O-N 3.07Å; V83-K86 PolarHBondContact O-N 2.89Å; V83-T87 PolarHBondContact O-N 2.91Å; V83-T87 PolarHBondContact O-OG1 3.27Å; V83-T87 VanDerWaalsContact O-OG1 3.08Å
84	K	96.5	Very high	93.4	Very high	112 Å²	112	60.4 Å²	60.4	49%	0.487	31%	0.314	S	S	.	.	H	α-helix	trans	-59.3	-45.8	177.7	-72.6	175.2	175.4	164.1	0	112.3	N79 N80 F81 F82 L88	N79-K84 WeakPolarHBondContact O-CD 3.45Å; N79-K84 WeakPolarHBondContact O-CE 2.81Å; N79-K84 PolarHBondContact O-NZ 3.19Å; N80-K84 PolarHBondContact O-N 3.39Å; N80-K84 VanDerWaalsContact O-N 3.09Å; F81-K84 PolarHBondContact O-N 3.43Å; F82-K84 PolarHBondContact O-N 2.99Å; K84-L88 WeakPolarHBondContact O-CG 3.29Å; K84-L88 PolarHBondContact O-N 3.28Å
85	I	97.1	Very high	93.7	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-66.7	-42.8	178.2	-63.3	-57.2	0	0	0	110.8	I21 Q22 W53 F56 F81 F82 V83 T87 L88 V89	I21-I85 HydrophobicContact CD1-CG2 3.6Å; I21-I85 HydrophobicContact CG2-CG2 4.25Å; Q22-I85 HydrophobicContact CG-CD1 3.88Å; W53-I85 HydrophobicContact CE3-CG2 4.49Å; W53-I85 HydrophobicContact CZ3-CG2 4.31Å; F56-I85 HydrophobicContact CD1-CG2 4.03Å; F56-I85 HydrophobicContact CE1-CB 3.89Å; F56-I85 HydrophobicContact CE1-CG2 3.73Å; F56-I85 HydrophobicContact CE2-CG1 4.42Å; F56-I85 HydrophobicContact CE2-CG2 4.36Å; F56-I85 HydrophobicContact CG-CG2 4.43Å; F56-I85 HydrophobicContact CZ-CB 3.86Å; F56-I85 HydrophobicContact CZ-CG1 3.98Å; F56-I85 HydrophobicContact CZ-CG2 3.94Å; F81-I85 HydrophobicContact CD1-CG1 4.06Å; F81-I85 HydrophobicContact CE1-CD1 4.36Å; F81-I85 HydrophobicContact CE1-CG1 3.79Å; F81-I85 HydrophobicContact CE2-CD1 4.22Å; F81-I85 HydrophobicContact CE2-CG1 4.26Å; F81-I85 HydrophobicContact CG-CG1 4.45Å; F81-I85 HydrophobicContact CZ-CD1 3.98Å; F81-I85 HydrophobicContact CZ-CG1 3.91Å; F81-I85 WeakPolarHBondContact O-CG1 3.49Å; F81-I85 PolarHBondContact O-N 2.97Å; F82-I85 PolarHBondContact O-N 3.3Å; V83-I85 PolarHBondContact O-N 3.07Å; I85-T87 PolarHBondContact O-N 2.86Å; I85-L88 PolarHBondContact O-N 3.18Å; I85-V89 HydrophobicContact CG2-CG2 4.38Å; I85-V89 WeakPolarHBondContact O-CG2 3.38Å; I85-V89 PolarHBondContact O-N 3.44Å
86	K	96.5	Very high	93.9	Very high	104 Å²	104	55.8 Å²	55.8	45%	0.452	29%	0.287	S	S	.	.	H	α-helix	trans	-57.9	-47.6	176.5	-176	179.2	177.8	-176.8	0	111.7	W53 F82 V83 L88 V89 V90	W53-K86 HydrophobicContact CH2-CB 3.71Å; W53-K86 HydrophobicContact CH2-CD 4.37Å; W53-K86 HydrophobicContact CH2-CG 3.75Å; W53-K86 HydrophobicContact CZ2-CG 4.18Å; W53-K86 HydrophobicContact CZ3-CB 4.15Å; F82-K86 HydrophobicContact CE1-CB 4.48Å; F82-K86 HydrophobicContact CE1-CD 4.05Å; F82-K86 HydrophobicContact CZ-CD 4.36Å; F82-K86 WeakPolarHBondContact O-CB 3.44Å; F82-K86 PolarHBondContact O-N 2.82Å; V83-K86 PolarHBondContact O-N 2.89Å; K86-L88 VanDerWaalsContact C-N 3.33Å; K86-L88 PolarHBondContact O-N 2.98Å; K86-V89 PolarHBondContact O-N 3.45Å; K86-V90 WeakPolarHBondContact O-CG2 3.42Å; K86-V90 PolarHBondContact O-N 3.16Å
87	T	96.6	Very high	93.9	Very high	84 Å²	84	58.4 Å²	58.4	52%	0.515	30%	0.302	S	S	.	.	H	α-helix	trans	-57.7	-46.8	177.8	-60.6	0	0	0	0	111.2	V83 I85 V89 V90 E91	V83-T87 PolarHBondContact O-N 2.91Å; V83-T87 PolarHBondContact O-OG1 3.27Å; V83-T87 VanDerWaalsContact O-OG1 3.08Å; I85-T87 PolarHBondContact O-N 2.86Å; T87-V89 PolarHBondContact O-N 2.88Å; T87-V90 PolarHBondContact O-N 3.41Å; T87-E91 WeakPolarHBondContact O-CB 3.48Å; T87-E91 PolarHBondContact O-N 3.11Å
88	L	95.9	Very high	94	Very high	40 Å²	40	63.7 Å²	63.7	21%	0.209	32%	0.32	C	S	.	.	H	α-helix	trans	-60.8	-43.8	176.5	-74.5	174.5	0	0	0	112.2	Q22 I25 K84 I85 K86 E91 Y92	Q22-L88 HydrophobicContact CG-CD1 3.93Å; I25-L88 HydrophobicContact CD1-CB 3.74Å; I25-L88 HydrophobicContact CD1-CD1 4.38Å; I25-L88 HydrophobicContact CD1-CD2 4.33Å; I25-L88 HydrophobicContact CD1-CG 4.38Å; K84-L88 WeakPolarHBondContact O-CG 3.29Å; K84-L88 PolarHBondContact O-N 3.28Å; I85-L88 PolarHBondContact O-N 3.18Å; K86-L88 VanDerWaalsContact C-N 3.33Å; K86-L88 PolarHBondContact O-N 2.98Å; L88-E91 PolarHBondContact O-N 3.22Å; L88-Y92 HydrophobicContact CD2-CD2 4.45Å; L88-Y92 HydrophobicContact CD2-CE2 4.06Å; L88-Y92 VanDerWaalsContact O-CD2 3.26Å; L88-Y92 WeakPolarHBondContact O-CD2 3.32Å; L88-Y92 PolarHBondContact O-N 2.81Å
89	V	96.7	Very high	94.1	Very high	8 Å²	8	61.2 Å²	61.2	5%	0.048	31%	0.309	C	S	.	.	H	α-helix	trans	-61.6	-48.1	178.7	170.7	0	0	0	0	110.9	I21 L49 W53 I85 K86 T87 E91 Y92 T93	I21-V89 HydrophobicContact CD1-CG2 4.21Å; I21-V89 HydrophobicContact CG2-CG2 3.88Å; L49-V89 HydrophobicContact CD1-CG2 4.1Å; W53-V89 HydrophobicContact CB-CG1 4.05Å; W53-V89 HydrophobicContact CB-CG2 4.3Å; W53-V89 HydrophobicContact CD2-CB 4.3Å; W53-V89 HydrophobicContact CD2-CG1 3.92Å; W53-V89 HydrophobicContact CD2-CG2 4.12Å; W53-V89 HydrophobicContact CE3-CB 4.22Å; W53-V89 HydrophobicContact CE3-CG1 4.34Å; W53-V89 HydrophobicContact CE3-CG2 3.72Å; W53-V89 HydrophobicContact CG-CG1 3.77Å; W53-V89 HydrophobicContact CG-CG2 4.38Å; W53-V89 HydrophobicContact CZ3-CG2 4.41Å; I85-V89 HydrophobicContact CG2-CG2 4.38Å; I85-V89 WeakPolarHBondContact O-CG2 3.38Å; I85-V89 PolarHBondContact O-N 3.44Å; K86-V89 PolarHBondContact O-N 3.45Å; T87-V89 PolarHBondContact O-N 2.88Å; V89-E91 PolarHBondContact O-N 2.94Å; V89-Y92 PolarHBondContact O-N 2.8Å; V89-T93 WeakPolarHBondContact O-CB 3.21Å; V89-T93 PolarHBondContact O-N 3.04Å; V89-T93 PolarHBondContact O-OG1 3.04Å; V89-T93 VanDerWaalsContact O-OG1 3.07Å
90	V	94.8	Very high	94	Very high	78 Å²	78	58.3 Å²	58.3	47%	0.473	29%	0.294	S	S	.	.	H	α-helix	trans	-60.5	-45.3	179.7	172.7	0	0	0	0	111.5	K86 T87 S94	K86-V90 WeakPolarHBondContact O-CG2 3.42Å; K86-V90 PolarHBondContact O-N 3.16Å; T87-V90 PolarHBondContact O-N 3.41Å; V90-S94 WeakPolarHBondContact O-CB 3.26Å; V90-S94 PolarHBondContact O-N 3.29Å; V90-S94 VanDerWaalsContact O-N 3.16Å; V90-S94 PolarHBondContact O-OG 3.03Å
91	E	95.6	Very high	93.6	Very high	89 Å²	89	58.3 Å²	58.3	42%	0.416	29%	0.29	S	S	.	.	H	α-helix	trans	-58.8	-54.4	177.9	-176.2	-170.1	146.7	0	0	111.3	T87 L88 V89 S94 E95	T87-E91 WeakPolarHBondContact O-CB 3.48Å; T87-E91 PolarHBondContact O-N 3.11Å; L88-E91 PolarHBondContact O-N 3.22Å; V89-E91 PolarHBondContact O-N 2.94Å; E91-S94 PolarHBondContact O-N 3.44Å; E91-E95 PolarHBondContact O-N 3.28Å
92	Y	96.8	Very high	93	Very high	9 Å²	9	59.9 Å²	59.9	4%	0.035	31%	0.305	C	S	.	.	H	α-helix	trans	-78.5	-26.3	-173.3	-75.6	-81.4	0	0	0	113.6	I25 Y28 K29 L88 V89 E95 F96	I25-Y92 HydrophobicContact CB-CD2 4.32Å; I25-Y92 HydrophobicContact CB-CG 4.46Å; I25-Y92 HydrophobicContact CD1-CD2 3.54Å; I25-Y92 HydrophobicContact CD1-CE2 4.21Å; I25-Y92 HydrophobicContact CD1-CG 4.06Å; I25-Y92 HydrophobicContact CG1-CD1 4.34Å; I25-Y92 HydrophobicContact CG1-CD2 3.7Å; I25-Y92 HydrophobicContact CG1-CE2 4.36Å; I25-Y92 HydrophobicContact CG1-CG 3.75Å; I25-Y92 HydrophobicContact CG2-CD1 4.03Å; I25-Y92 HydrophobicContact CG2-CD2 3.66Å; I25-Y92 HydrophobicContact CG2-CE1 3.77Å; I25-Y92 HydrophobicContact CG2-CE2 3.43Å; I25-Y92 VanDerWaalsContact CG2-CE2 3.43Å; I25-Y92 HydrophobicContact CG2-CG 4.02Å; Y28-Y92 AromaticContact CD1-CD1 3.81Å; Y28-Y92 HydrophobicContact CD1-CD1 3.81Å; Y28-Y92 AromaticContact CD1-CE1 3.77Å; Y28-Y92 HydrophobicContact CD1-CE1 3.77Å; Y28-Y92 AromaticContact CE1-CD1 3.99Å; Y28-Y92 HydrophobicContact CE1-CD1 3.99Å; Y28-Y92 AromaticContact CE1-CE1 3.82Å; Y28-Y92 HydrophobicContact CE1-CE1 3.82Å; K29-Y92 WeakPolarHBondContact CE-OH 3.41Å; K29-Y92 PolarHBondContact NZ-OH 3.05Å; L88-Y92 HydrophobicContact CD2-CD2 4.45Å; L88-Y92 HydrophobicContact CD2-CE2 4.06Å; L88-Y92 VanDerWaalsContact O-CD2 3.26Å; L88-Y92 WeakPolarHBondContact O-CD2 3.32Å; L88-Y92 PolarHBondContact O-N 2.81Å; V89-Y92 PolarHBondContact O-N 2.8Å; Y92-E95 WeakPolarHBondContact CD1-OE2 3.26Å; Y92-E95 WeakPolarHBondContact CE1-OE2 3.3Å; Y92-E95 PolarHBondContact O-N 3.19Å; Y92-F96 HydrophobicContact CD1-CE1 4.29Å; Y92-F96 HydrophobicContact CD1-CZ 4.31Å; Y92-F96 WeakPolarHBondContact O-CB 3.31Å; Y92-F96 VanDerWaalsContact O-CD2 3.22Å; Y92-F96 WeakPolarHBondContact O-CD2 3.47Å; Y92-F96 WeakPolarHBondContact O-CG 3.49Å; Y92-F96 PolarHBondContact O-N 2.83Å
93	T	95.9	Very high	91.8	Very high	30 Å²	30	59.2 Å²	59.2	18%	0.184	31%	0.305	C	S	.	.	H	α-helix	trans	-62.4	-47.3	168.2	-72.4	0	0	0	0	110.4	L46 V89 E95 F96 N97	L46-T93 HydrophobicContact CD1-CG2 3.94Å; V89-T93 WeakPolarHBondContact O-CB 3.21Å; V89-T93 PolarHBondContact O-N 3.04Å; V89-T93 PolarHBondContact O-OG1 3.04Å; V89-T93 VanDerWaalsContact O-OG1 3.07Å; T93-E95 VanDerWaalsContact C-N 3.34Å; T93-E95 PolarHBondContact O-N 2.97Å; T93-F96 PolarHBondContact O-N 3.18Å; T93-N97 PolarHBondContact O-N 2.82Å; T93-N97 PolarHBondContact O-ND2 2.97Å
94	S	92.6	Very high	90.2	Very high	71 Å²	71	60 Å²	60	50%	0.497	30%	0.304	S	S	.	.	H	α-helix	trans	-63.1	-41.7	177	-53.7	0	0	0	0	111.4	V90 E91 R98	V90-S94 WeakPolarHBondContact O-CB 3.26Å; V90-S94 PolarHBondContact O-N 3.29Å; V90-S94 VanDerWaalsContact O-N 3.16Å; V90-S94 PolarHBondContact O-OG 3.03Å; E91-S94 PolarHBondContact O-N 3.44Å; S94-R98 WeakPolarHBondContact O-CB 3.48Å; S94-R98 PolarHBondContact O-N 2.93Å
95	E	92.2	Very high	88.3	Confident	37 Å²	37	60 Å²	60	17%	0.173	31%	0.309	C	S	.	.	H	α-helix	trans	-63.2	-45	176.9	-171.8	178.8	168.5	0	0	112.3	Y28 E91 Y92 T93 R98 K99	Y28-E95 VanDerWaalsContact CE1-OE1 3.24Å; Y28-E95 WeakPolarHBondContact CE1-OE1 3.37Å; Y28-E95 VanDerWaalsContact CZ-OE1 3.25Å; Y28-E95 PolarHBondContact OH-OE1 2.9Å; E91-E95 PolarHBondContact O-N 3.28Å; Y92-E95 WeakPolarHBondContact CD1-OE2 3.26Å; Y92-E95 WeakPolarHBondContact CE1-OE2 3.3Å; Y92-E95 PolarHBondContact O-N 3.19Å; T93-E95 VanDerWaalsContact C-N 3.34Å; T93-E95 PolarHBondContact O-N 2.97Å; E95-R98 PolarHBondContact O-N 2.98Å; E95-K99 VanDerWaalsContact O-CG 3.31Å; E95-K99 WeakPolarHBondContact O-CG 3.43Å; E95-K99 PolarHBondContact O-N 3.39Å
96	F	93.6	Very high	86.2	Confident	0 Å²	0	66 Å²	66	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-65.6	-43.9	179.3	-64.9	-20.8	0	0	0	111.9	Y28 F42 R45 L46 L49 Y92 T93 R98 K99 L100	Y28-F96 AromaticContact CD1-CE1 3.71Å; Y28-F96 HydrophobicContact CD1-CE1 3.71Å; Y28-F96 HydrophobicContact CD1-CZ 4.18Å; Y28-F96 AromaticContact CD2-CE1 3.72Å; Y28-F96 HydrophobicContact CD2-CE1 3.72Å; Y28-F96 HydrophobicContact CD2-CZ 4.4Å; Y28-F96 AromaticContact CE1-CE1 3.93Å; Y28-F96 HydrophobicContact CE1-CE1 3.93Å; Y28-F96 AromaticContact CE2-CE1 3.98Å; Y28-F96 HydrophobicContact CE2-CE1 3.98Å; Y28-F96 AromaticContact CG-CE1 3.59Å; Y28-F96 HydrophobicContact CG-CE1 3.59Å; Y28-F96 AromaticContact CG-CZ 3.96Å; Y28-F96 HydrophobicContact CG-CZ 3.96Å; F42-F96 AromaticContact CD1-CD1 3.98Å; F42-F96 HydrophobicContact CD1-CD1 3.98Å; R45-F96 HydrophobicContact CB-CD2 4.14Å; R45-F96 HydrophobicContact CB-CE2 3.77Å; R45-F96 HydrophobicContact CB-CZ 4.03Å; L46-F96 HydrophobicContact CB-CB 4.33Å; L46-F96 HydrophobicContact CB-CD2 4.29Å; L46-F96 HydrophobicContact CD1-CB 4.43Å; L49-F96 HydrophobicContact CD2-CD2 4.23Å; L49-F96 HydrophobicContact CD2-CE2 3.95Å; Y92-F96 HydrophobicContact CD1-CE1 4.29Å; Y92-F96 HydrophobicContact CD1-CZ 4.31Å; Y92-F96 WeakPolarHBondContact O-CB 3.31Å; Y92-F96 VanDerWaalsContact O-CD2 3.22Å; Y92-F96 WeakPolarHBondContact O-CD2 3.47Å; Y92-F96 WeakPolarHBondContact O-CG 3.49Å; Y92-F96 PolarHBondContact O-N 2.83Å; T93-F96 PolarHBondContact O-N 3.18Å; F96-R98 PolarHBondContact O-N 3.45Å; F96-K99 PolarHBondContact O-N 2.91Å; F96-L100 WeakPolarHBondContact O-CG 3.47Å; F96-L100 PolarHBondContact O-N 3.37Å
97	N	92.1	Very high	83.9	Confident	60 Å²	60	65.8 Å²	65.8	32%	0.321	35%	0.348	S	S	.	.	H	α-helix	trans	-59	-46.8	175	-74.3	-19.4	0	0	0	111.5	L46 T93 K99 L100 H101	L46-N97 WeakPolarHBondContact CD2-OD1 3.21Å; T93-N97 PolarHBondContact O-N 2.82Å; T93-N97 PolarHBondContact O-ND2 2.97Å; N97-K99 VanDerWaalsContact C-N 3.27Å; N97-K99 PolarHBondContact O-N 3.09Å; N97-L100 PolarHBondContact O-N 3.41Å; N97-H101 PolarHBondContact O-CD2 3.22Å; N97-H101 PolarHBondContact O-N 2.9Å
98	R	90.5	Very high	81.6	Confident	162 Å²	162	70 Å²	70	61%	0.611	36%	0.363	S	S	*	.	H	α-helix	trans	-59.1	-38.8	176.6	-176.3	-178.2	62.2	-173.1	-3.3	112.3	S94 E95 F96 A102	S94-R98 WeakPolarHBondContact O-CB 3.48Å; S94-R98 PolarHBondContact O-N 2.93Å; E95-R98 PolarHBondContact O-N 2.98Å; F96-R98 PolarHBondContact O-N 3.45Å; R98-A102 WeakPolarHBondContact O-CB 3.44Å; R98-A102 PolarHBondContact O-N 2.93Å; R98-A102 VanDerWaalsContact O-N 3.08Å
99	K	90.1	Very high	78.9	Confident	84 Å²	84	74.9 Å²	74.9	37%	0.365	39%	0.389	S	S	.	.	H	α-helix	trans	-73.8	-31.8	179.3	-71.8	-66.9	-177	-173.1	0	113.1	F42 E95 F96 N97 S103	F42-K99 HydrophobicContact CD1-CB 3.83Å; F42-K99 HydrophobicContact CD1-CG 4.44Å; F42-K99 HydrophobicContact CD2-CB 4.04Å; F42-K99 HydrophobicContact CE1-CB 3.6Å; F42-K99 HydrophobicContact CE1-CG 3.83Å; F42-K99 HydrophobicContact CE2-CB 3.82Å; F42-K99 HydrophobicContact CG-CB 4.04Å; F42-K99 HydrophobicContact CZ-CB 3.61Å; F42-K99 HydrophobicContact CZ-CD 4.24Å; F42-K99 HydrophobicContact CZ-CG 3.92Å; E95-K99 VanDerWaalsContact O-CG 3.31Å; E95-K99 WeakPolarHBondContact O-CG 3.43Å; E95-K99 PolarHBondContact O-N 3.39Å; F96-K99 PolarHBondContact O-N 2.91Å; N97-K99 VanDerWaalsContact C-N 3.27Å; N97-K99 PolarHBondContact O-N 3.09Å; K99-S103 PolarHBondContact O-N 2.8Å; K99-S103 PolarHBondContact O-OG 3.07Å
100	L	87.4	Confident	76.2	Confident	16 Å²	16	80.2 Å²	80.2	8%	0.084	42%	0.421	C	S	.	.	H	α-helix	trans	-63.4	-54.8	172	-76.4	166.7	0	0	0	110.7	P39 F42 E43 L46 F96 N97 A102 S103 E104	P39-L100 WeakPolarHBondContact O-CD2 3.5Å; F42-L100 HydrophobicContact CB-CD1 4.24Å; F42-L100 HydrophobicContact CB-CD2 3.61Å; F42-L100 HydrophobicContact CB-CG 3.62Å; E43-L100 HydrophobicContact CB-CD2 4.48Å; E43-L100 HydrophobicContact CG-CD1 4.35Å; E43-L100 HydrophobicContact CG-CD2 3.48Å; E43-L100 VanDerWaalsContact CG-CD2 3.48Å; L46-L100 HydrophobicContact CD2-CD1 4.05Å; F96-L100 WeakPolarHBondContact O-CG 3.47Å; F96-L100 PolarHBondContact O-N 3.37Å; N97-L100 PolarHBondContact O-N 3.41Å; L100-A102 VanDerWaalsContact C-N 3.32Å; L100-A102 PolarHBondContact O-N 3.02Å; L100-S103 WeakPolarHBondContact O-CB 3.38Å; L100-S103 PolarHBondContact O-N 2.97Å; L100-E104 PolarHBondContact O-N 3.29Å; L100-E104 VanDerWaalsContact O-N 3.13Å
101	H	82.8	Confident	73.5	Confident	106 Å²	106	85.6 Å²	85.6	49%	0.491	44%	0.441	S	S	.	.	H	α-helix	trans	-61.4	-37.1	179.2	-68.5	-53.8	0	0	0	113.6	N97 S103 E104 N105	N97-H101 PolarHBondContact O-CD2 3.22Å; N97-H101 PolarHBondContact O-N 2.9Å; H101-S103 PolarHBondContact O-N 3.48Å; H101-E104 IonicContact CE1-OE2 3.29Å; H101-E104 IonicContact ND1-OE2 2.66Å; H101-E104 PolarHBondContact ND1-OE2 3.47Å; H101-E104 VanDerWaalsContact ND1-OE2 3.09Å; H101-E104 PolarHBondContact O-N 2.86Å; H101-N105 PolarHBondContact O-N 3.47Å; H101-N105 PolarHBondContact O-ND2 3.39Å
102	A	81.4	Confident	70.6	Confident	46 Å²	46	85.8 Å²	85.8	38%	0.38	46%	0.457	S	S	.	.	H	α-helix	trans	-62.4	-32.6	174.4	0	0	0	0	0	112.5	R98 L100	R98-A102 WeakPolarHBondContact O-CB 3.44Å; R98-A102 PolarHBondContact O-N 2.93Å; R98-A102 VanDerWaalsContact O-N 3.08Å; L100-A102 VanDerWaalsContact C-N 3.32Å; L100-A102 PolarHBondContact O-N 3.02Å
103	S	68.9	Low	67.6	Low	23 Å²	23	90.4 Å²	90.4	16%	0.161	49%	0.491	C	S	.	.	H	α-helix	trans	-79	-27.3	180	-50.1	0	0	0	0	112.3	K99 L100 H101 T107	K99-S103 PolarHBondContact O-N 2.8Å; K99-S103 PolarHBondContact O-OG 3.07Å; L100-S103 WeakPolarHBondContact O-CB 3.38Å; L100-S103 PolarHBondContact O-N 2.97Å; H101-S103 PolarHBondContact O-N 3.48Å; S103-T107 PolarHBondContact O-OG1 3.35Å
104	E	60.8	Low	64.8	Low	101 Å²	101	97.6 Å²	97.6	47%	0.472	52%	0.522	S	S	.	.	H	α-helix	trans	-68.5	-46.4	174.5	-69.9	167.5	168.1	0	0	110.8	L100 H101 D106 T107	L100-E104 PolarHBondContact O-N 3.29Å; L100-E104 VanDerWaalsContact O-N 3.13Å; H101-E104 IonicContact CE1-OE2 3.29Å; H101-E104 IonicContact ND1-OE2 2.66Å; H101-E104 PolarHBondContact ND1-OE2 3.47Å; H101-E104 VanDerWaalsContact ND1-OE2 3.09Å; H101-E104 PolarHBondContact O-N 2.86Å; E104-D106 VanDerWaalsContact C-N 3.31Å; E104-D106 PolarHBondContact O-N 3Å; E104-T107 PolarHBondContact O-N 3.36Å
105	N	55.8	Low	62.2	Low	113 Å²	113	102.7 Å²	102.7	60%	0.604	54%	0.543	S	S	*	.	H	α-helix	trans	-63.9	-31.4	-179.3	-66.9	-27.7	0	0	0	113.8	H101 T107	H101-N105 PolarHBondContact O-N 3.47Å; H101-N105 PolarHBondContact O-ND2 3.39Å; N105-T107 VanDerWaalsContact C-N 3.27Å; N105-T107 PolarHBondContact O-N 2.89Å
106	D	52.9	Low	59.4	Low	125 Å²	125	107.4 Å²	107.4	67%	0.668	57%	0.569	S	S	*	*	H	α-helix	trans	-72.3	-22.6	175.4	-77.4	-17.7	0	0	0	112.2	E104	E104-D106 VanDerWaalsContact C-N 3.31Å; E104-D106 PolarHBondContact O-N 3Å
107	T	48.4	Very low	56.6	Low	99 Å²	99	112.8 Å²	112.8	61%	0.607	60%	0.602	S	S	*	*	H	α-helix	trans	-81.3	-27.2	-175.7	-44.3	0	0	0	0	112.2	S103 E104 N105 N109	S103-T107 PolarHBondContact O-OG1 3.35Å; E104-T107 PolarHBondContact O-N 3.36Å; N105-T107 VanDerWaalsContact C-N 3.27Å; N105-T107 PolarHBondContact O-N 2.89Å; T107-N109 PolarHBondContact O-N 2.9Å
108	E	47.9	Very low	54.1	Low	174 Å²	174	119.3 Å²	119.3	81%	0.813	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	-12.3	176.7	-69.8	-170.8	167.9	0	0	113.7
109	N	38.8	Very low	51.5	Low	142 Å²	142	119.9 Å²	119.9	76%	0.759	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	8.3	-176.7	-151.8	5.4	0	0	0	115.1	T107	T107-N109 PolarHBondContact O-N 2.9Å
110	V	40.3	Very low	49.1	Very low	119 Å²	119	121.5 Å²	121.5	72%	0.721	65%	0.654	S	S	*	*	S	Bend	trans	-111.6	4.1	-175.2	-165.4	0	0	0	0	113.7
111	H	39.2	Very low	46.7	Very low	192 Å²	192	125.8 Å²	125.8	89%	0.889	68%	0.683	S	S	*	*			trans	-115.4	55.9	174.5	-133.2	47.1	0	0	0	112.8
112	A	34.6	Very low	44.7	Very low	93 Å²	93	123.5 Å²	123.5	77%	0.769	68%	0.682	S	S	*	*			trans	-135.9	66.4	168.6	0	0	0	0	0	110.1
113	S	34	Very low	43.2	Very low	106 Å²	106	126.5 Å²	126.5	74%	0.741	70%	0.701	S	S	*	*			trans	-154.2	129.1	160.6	-161	0	0	0	0	109
114	E	36.3	Very low	42.2	Very low	180 Å²	180	133.1 Å²	133.1	84%	0.841	73%	0.729	S	S	*	*			trans	81.4	82.3	176.3	-54.9	179.2	172.1	0	0	116.5
115	L	38.5	Very low	41.8	Very low	178 Å²	178	134.8 Å²	134.8	93%	0.932	74%	0.737	S	S	*	*				-173.8	125	112.7	-98.3	150	0	0	0	111.3
116	D	33.8	Very low	41.7	Very low	136 Å²	136	135.3 Å²	135.3	73%	0.727	74%	0.739	S	S	*	*			trans	-56.7	150	176.3	-161.3	1.5	0	0	0	113
117	T	33.3	Very low	42.2	Very low	113 Å²	113	132.6 Å²	132.6	69%	0.693	73%	0.73	S	S	*	*			trans	54.4	93.2	164	37.7	0	0	0	0	118.9
118	K	40.3	Very low	43.3	Very low	198 Å²	198	133.4 Å²	133.4	86%	0.861	73%	0.727	S	S	*	*				-179.1	107.9	120.9	-95.2	159.9	-166.9	-178.5	0	109.7	V120	K118-V120 PolarHBondContact O-N 3.08Å
119	H	35.4	Very low	44.6	Very low	173 Å²	173	130 Å²	130	80%	0.801	72%	0.715	S	S	*	*			trans	-51.9	102.5	169.3	179.3	-79.6	0	0	0	111.1	P121	H119-P121 WeakPolarHBondContact ND1-CD 3.41Å
120	V	40.2	Very low	46.3	Very low	118 Å²	118	129.2 Å²	129.2	72%	0.715	71%	0.707	S	S	*	*			trans	-129.5	94.3	160.9	-176.2	0	0	0	0	107.4	K118 A122	K118-V120 PolarHBondContact O-N 3.08Å; V120-A122 VanDerWaalsContact C-N 3.35Å; V120-A122 HydrophobicContact CG1-CB 4.06Å; V120-A122 PolarHBondContact O-N 3.14Å
121	P	36.5	Very low	48	Very low	107 Å²	107	129.1 Å²	129.1	70%	0.695	70%	0.697	S	S	*	*			trans	-76.3	91.4	171.1	30.3	-29.7	0	0	0	107.7	H119	H119-P121 WeakPolarHBondContact ND1-CD 3.41Å
122	A	41.3	Very low	49.8	Very low	58 Å²	58	123.6 Å²	123.6	48%	0.479	67%	0.674	S	S	.	*			trans	-135.8	5.7	171.1	0	0	0	0	0	113.6	V120 Q124	V120-A122 VanDerWaalsContact C-N 3.35Å; V120-A122 HydrophobicContact CG1-CB 4.06Å; V120-A122 PolarHBondContact O-N 3.14Å; A122-Q124 PolarHBondContact O-N 2.52Å
123	S	49.7	Very low	51.9	Low	109 Å²	109	121.9 Å²	121.9	76%	0.762	66%	0.656	S	S	*	*	H	α-helix	trans	-80.6	-12.2	-170.8	-168.7	0	0	0	0	115.2
124	Q	49.3	Very low	53.9	Low	162 Å²	162	121.8 Å²	121.8	76%	0.757	65%	0.645	S	S	*	*	H	α-helix	trans	-88.1	-25.2	-173.4	-149	169.5	-15.8	0	0	113.1	A122 S127 E128	A122-Q124 PolarHBondContact O-N 2.52Å; Q124-S127 PolarHBondContact O-OG 3.39Å; Q124-S127 VanDerWaalsContact O-OG 3.08Å; Q124-E128 PolarHBondContact O-N 2.88Å
125	Q	51.8	Low	55.9	Low	136 Å²	136	114.7 Å²	114.7	64%	0.636	61%	0.613	S	S	*	*	H	α-helix	trans	-69.4	-34.3	178	-68.6	-172.8	-74.4	0	0	112.4	S127 E128 D129	Q125-S127 VanDerWaalsContact C-N 3.35Å; Q125-S127 PolarHBondContact O-N 3.46Å; Q125-E128 PolarHBondContact O-N 3.29Å; Q125-D129 WeakPolarHBondContact O-CB 3.36Å; Q125-D129 PolarHBondContact O-N 3.37Å
126	N	54	Low	57.9	Low	123 Å²	123	114.7 Å²	114.7	66%	0.658	60%	0.6	S	S	*	*	H	α-helix	trans	-68.8	-34	-175.3	-150.5	-0.3	0	0	0	112.3	Q130	N126-Q130 WeakPolarHBondContact O-CB 3.06Å; N126-Q130 PolarHBondContact O-N 2.88Å
127	S	63.5	Low	60.1	Low	69 Å²	69	113.8 Å²	113.8	48%	0.483	59%	0.592	S	S	.	*	H	α-helix	trans	-74.5	-35.4	175.2	57.7	0	0	0	0	112.2	Q124 Q125 F131	Q124-S127 PolarHBondContact O-OG 3.39Å; Q124-S127 VanDerWaalsContact O-OG 3.08Å; Q125-S127 VanDerWaalsContact C-N 3.35Å; Q125-S127 PolarHBondContact O-N 3.46Å; S127-F131 VanDerWaalsContact O-CB 3.25Å; S127-F131 WeakPolarHBondContact O-CB 3.48Å; S127-F131 PolarHBondContact O-N 3.09Å
128	E	71.7	Confident	62.4	Low	115 Å²	115	111 Å²	111	54%	0.537	57%	0.571	S	S	.	*	H	α-helix	trans	-68.4	-43.4	176.9	-168.8	169	-166.5	0	0	111.5	Q124 Q125 Q130 F131 N132	Q124-E128 PolarHBondContact O-N 2.88Å; Q125-E128 PolarHBondContact O-N 3.29Å; E128-Q130 VanDerWaalsContact C-N 3.35Å; E128-Q130 PolarHBondContact O-N 3.42Å; E128-F131 PolarHBondContact O-N 3.47Å; E128-N132 WeakPolarHBondContact O-CB 3.27Å; E128-N132 PolarHBondContact O-N 3.41Å; E128-N132 PolarHBondContact O-ND2 3.15Å
129	D	74.8	Confident	64.3	Low	103 Å²	103	105.3 Å²	105.3	55%	0.551	54%	0.544	S	S	*	.	H	α-helix	trans	-62.1	-41.7	174.7	-73	-26.7	0	0	0	111.8	Q125 N132 S133	Q125-D129 WeakPolarHBondContact O-CB 3.36Å; Q125-D129 PolarHBondContact O-N 3.37Å; D129-N132 PolarHBondContact O-N 3.02Å; D129-S133 WeakPolarHBondContact O-CB 3.41Å; D129-S133 PolarHBondContact O-N 3.18Å
130	Q	74.9	Confident	66.5	Low	126 Å²	126	100.6 Å²	100.6	59%	0.589	52%	0.524	S	S	*	.	H	α-helix	trans	-65.3	-42.9	175.4	-172.3	179.4	10.3	0	0	111.7	N126 E128 S133 M134	N126-Q130 WeakPolarHBondContact O-CB 3.06Å; N126-Q130 PolarHBondContact O-N 2.88Å; E128-Q130 VanDerWaalsContact C-N 3.35Å; E128-Q130 PolarHBondContact O-N 3.42Å; Q130-S133 WeakPolarHBondContact O-CB 3.24Å; Q130-S133 PolarHBondContact O-N 3.25Å; Q130-M134 HydrophobicContact CG-CE 4.49Å; Q130-M134 WeakPolarHBondContact O-CG 3.22Å; Q130-M134 PolarHBondContact O-N 3.15Å
131	F	74.3	Confident	68.7	Low	117 Å²	117	99.9 Å²	99.9	51%	0.513	52%	0.515	S	S	.	.	H	α-helix	trans	-62.4	-45.8	176.4	-179.6	-105	0	0	0	111.6	S127 E128 S133 M134 L135	S127-F131 VanDerWaalsContact O-CB 3.25Å; S127-F131 WeakPolarHBondContact O-CB 3.48Å; S127-F131 PolarHBondContact O-N 3.09Å; E128-F131 PolarHBondContact O-N 3.47Å; F131-S133 VanDerWaalsContact C-N 3.3Å; F131-S133 PolarHBondContact O-N 3.18Å; F131-M134 HydrophobicContact CD2-CE 4.41Å; F131-M134 PolarHBondContact O-N 2.84Å; F131-M134 VanDerWaalsContact O-N 3.17Å; F131-L135 HydrophobicContact CD1-CD1 3.81Å; F131-L135 HydrophobicContact CD1-CG 4.31Å; F131-L135 HydrophobicContact CE1-CD1 3.34Å; F131-L135 HydrophobicContact CE1-CG 3.97Å; F131-L135 HydrophobicContact CZ-CD1 3.86Å; F131-L135 HydrophobicContact CZ-CD2 4.23Å; F131-L135 HydrophobicContact CZ-CG 4.08Å; F131-L135 WeakPolarHBondContact O-CG 3.11Å; F131-L135 PolarHBondContact O-N 3.1Å
132	N	78.1	Confident	70.9	Confident	76 Å²	76	95.1 Å²	95.1	41%	0.406	48%	0.484	S	S	.	.	H	α-helix	trans	-62.1	-37.1	175.3	-71.4	-26.7	0	0	0	112	E128 D129 L135 R136	E128-N132 WeakPolarHBondContact O-CB 3.27Å; E128-N132 PolarHBondContact O-N 3.41Å; E128-N132 PolarHBondContact O-ND2 3.15Å; D129-N132 PolarHBondContact O-N 3.02Å; N132-L135 PolarHBondContact O-N 3.36Å; N132-R136 WeakPolarHBondContact O-CB 3.41Å; N132-R136 PolarHBondContact O-N 3.48Å
133	S	77.3	Confident	72.8	Confident	57 Å²	57	96.5 Å²	96.5	40%	0.399	48%	0.483	S	S	.	.	H	α-helix	trans	-62.7	-46	173	-170.6	0	0	0	0	111.7	D129 Q130 F131 R136 E137	D129-S133 WeakPolarHBondContact O-CB 3.41Å; D129-S133 PolarHBondContact O-N 3.18Å; Q130-S133 WeakPolarHBondContact O-CB 3.24Å; Q130-S133 PolarHBondContact O-N 3.25Å; F131-S133 VanDerWaalsContact C-N 3.3Å; F131-S133 PolarHBondContact O-N 3.18Å; S133-R136 WeakPolarHBondContact O-CB 3.42Å; S133-R136 PolarHBondContact O-N 3.26Å; S133-E137 PolarHBondContact O-N 3.41Å
134	M	76.7	Confident	74.6	Confident	103 Å²	103	99 Å²	99	51%	0.507	48%	0.476	S	S	.	.	H	α-helix	trans	-64.3	-40.6	176.8	-71.6	-172.7	-65.5	0	0	112.2	Q130 F131 R136 E137 H138	Q130-M134 HydrophobicContact CG-CE 4.49Å; Q130-M134 WeakPolarHBondContact O-CG 3.22Å; Q130-M134 PolarHBondContact O-N 3.15Å; F131-M134 HydrophobicContact CD2-CE 4.41Å; F131-M134 PolarHBondContact O-N 2.84Å; F131-M134 VanDerWaalsContact O-N 3.17Å; M134-R136 VanDerWaalsContact C-N 3.31Å; M134-R136 PolarHBondContact O-N 3.34Å; M134-E137 PolarHBondContact O-N 2.97Å; M134-H138 WeakPolarHBondContact O-CB 3.37Å; M134-H138 PolarHBondContact O-N 3.48Å
135	L	78.5	Confident	76.3	Confident	31 Å²	31	93.2 Å²	93.2	16%	0.162	45%	0.45	C	S	.	.	H	α-helix	trans	-60.7	-41.9	174.3	-76.5	179.4	0	0	0	111.6	F131 N132 H138 R139 M178	F131-L135 HydrophobicContact CD1-CD1 3.81Å; F131-L135 HydrophobicContact CD1-CG 4.31Å; F131-L135 HydrophobicContact CE1-CD1 3.34Å; F131-L135 HydrophobicContact CE1-CG 3.97Å; F131-L135 HydrophobicContact CZ-CD1 3.86Å; F131-L135 HydrophobicContact CZ-CD2 4.23Å; F131-L135 HydrophobicContact CZ-CG 4.08Å; F131-L135 WeakPolarHBondContact O-CG 3.11Å; F131-L135 PolarHBondContact O-N 3.1Å; N132-L135 PolarHBondContact O-N 3.36Å; L135-H138 WeakPolarHBondContact O-CB 3.36Å; L135-H138 PolarHBondContact O-N 2.92Å; L135-R139 WeakPolarHBondContact O-CG 3.38Å; L135-R139 PolarHBondContact O-N 3.21Å; L135-M178 HydrophobicContact CD2-CG 4.29Å; L135-M178 HydrophobicContact CD2-SD 3.79Å
136	R	80.2	Confident	77.7	Confident	179 Å²	179	89 Å²	89	68%	0.675	43%	0.432	S	S	*	.	H	α-helix	trans	-63.3	-42.6	175.8	-176.2	175.2	175.4	-111.4	-1	111.9	N132 S133 M134 H138 R139 I140	N132-R136 WeakPolarHBondContact O-CB 3.41Å; N132-R136 PolarHBondContact O-N 3.48Å; S133-R136 WeakPolarHBondContact O-CB 3.42Å; S133-R136 PolarHBondContact O-N 3.26Å; M134-R136 VanDerWaalsContact C-N 3.31Å; M134-R136 PolarHBondContact O-N 3.34Å; R136-H138 VanDerWaalsContact C-N 3.34Å; R136-R139 PolarHBondContact O-N 2.98Å; R136-I140 HydrophobicContact CG-CD1 4.32Å; R136-I140 WeakPolarHBondContact O-CG1 3.2Å; R136-I140 PolarHBondContact O-N 3.15Å; R136-I140 VanDerWaalsContact O-N 3.1Å
137	E	80.8	Confident	79.1	Confident	116 Å²	116	87.9 Å²	87.9	54%	0.542	43%	0.426	S	S	.	.	H	α-helix	trans	-63.3	-41	174.5	-73.5	-176.8	-174	0	0	112	S133 M134 R139 I140 L141	S133-E137 PolarHBondContact O-N 3.41Å; M134-E137 PolarHBondContact O-N 2.97Å; E137-R139 PolarHBondContact O-N 3.29Å; E137-I140 PolarHBondContact O-N 3.06Å; E137-L141 WeakPolarHBondContact O-CG 3.34Å; E137-L141 PolarHBondContact O-N 3.21Å
138	H	80.9	Confident	80.1	Confident	56 Å²	56	88.9 Å²	88.9	26%	0.259	43%	0.425	S	S	.	.	H	α-helix	trans	-60.2	-44.7	176.1	-172.3	72.6	0	0	0	111.7	M134 L135 R136 I140 L141 M142	M134-H138 WeakPolarHBondContact O-CB 3.37Å; M134-H138 PolarHBondContact O-N 3.48Å; L135-H138 WeakPolarHBondContact O-CB 3.36Å; L135-H138 PolarHBondContact O-N 2.92Å; R136-H138 VanDerWaalsContact C-N 3.34Å; H138-I140 PolarHBondContact O-N 3.3Å; H138-L141 PolarHBondContact O-N 3.47Å; H138-M142 WeakPolarHBondContact O-CG 3.45Å; H138-M142 PolarHBondContact O-N 3.02Å
139	R	79.8	Confident	80.5	Confident	77 Å²	77	84.3 Å²	84.3	29%	0.291	40%	0.404	S	S	.	.	H	α-helix	trans	-57.5	-48	173.8	-71.8	-179.2	-177.2	167.7	7.5	111.9	L135 R136 E137 L141 M142 D143 M178 D182	L135-R139 WeakPolarHBondContact O-CG 3.38Å; L135-R139 PolarHBondContact O-N 3.21Å; R136-R139 PolarHBondContact O-N 2.98Å; E137-R139 PolarHBondContact O-N 3.29Å; R139-L141 VanDerWaalsContact C-N 3.29Å; R139-L141 PolarHBondContact O-N 2.87Å; R139-M142 PolarHBondContact O-N 3.17Å; R139-D143 PolarHBondContact O-N 2.91Å; R139-M178 PolarHBondContact NH2-O 3.42Å; R139-M178 VanDerWaalsContact NH2-O 3.15Å; R139-D182 IonicContact CZ-OD2 2.97Å; R139-D182 VanDerWaalsContact CZ-OD2 3.29Å; R139-D182 IonicContact NH1-OD2 3.96Å; R139-D182 PolarHBondContact NH1-OD2 3.42Å; R139-D182 IonicContact NH2-OD1 3.09Å; R139-D182 IonicContact NH2-OD2 3.97Å; R139-D182 PolarHBondContact NH2-OD2 3.04Å
140	I	82.7	Confident	80.7	Confident	75 Å²	75	84 Å²	84	39%	0.385	40%	0.402	S	S	.	.	H	α-helix	trans	-60	-40.7	177.8	-67.6	165.3	0	0	0	111.3	R136 E137 H138 R144	R136-I140 HydrophobicContact CG-CD1 4.32Å; R136-I140 WeakPolarHBondContact O-CG1 3.2Å; R136-I140 PolarHBondContact O-N 3.15Å; R136-I140 VanDerWaalsContact O-N 3.1Å; E137-I140 PolarHBondContact O-N 3.06Å; H138-I140 PolarHBondContact O-N 3.3Å; I140-R144 WeakPolarHBondContact O-CB 3.34Å; I140-R144 WeakPolarHBondContact O-CG 3.38Å; I140-R144 PolarHBondContact O-N 3.31Å; I140-R144 VanDerWaalsContact O-N 3.09Å
141	L	86.1	Confident	81	Confident	103 Å²	103	84.6 Å²	84.6	54%	0.539	41%	0.405	S	S	.	.	H	α-helix	trans	-67.3	-39.4	178.6	-72	171.7	0	0	0	112	E137 H138 R139 R144 L145	E137-L141 WeakPolarHBondContact O-CG 3.34Å; E137-L141 PolarHBondContact O-N 3.21Å; H138-L141 PolarHBondContact O-N 3.47Å; R139-L141 VanDerWaalsContact C-N 3.29Å; R139-L141 PolarHBondContact O-N 2.87Å; L141-R144 PolarHBondContact O-N 2.82Å; L141-L145 WeakPolarHBondContact O-CB 3.45Å; L141-L145 PolarHBondContact O-N 3.26Å
142	M	82.7	Confident	80.9	Confident	6 Å²	6	81.9 Å²	81.9	3%	0.03	40%	0.396	C	S	.	.	H	α-helix	trans	-67	-44.8	176.7	-73.4	-58.8	-60.4	0	0	111.9	H138 R139 R144 L145 D146 M171 Q172 H175	H138-M142 WeakPolarHBondContact O-CG 3.45Å; H138-M142 PolarHBondContact O-N 3.02Å; R139-M142 PolarHBondContact O-N 3.17Å; M142-R144 PolarHBondContact O-N 3.43Å; M142-L145 HydrophobicContact CE-CD2 4.42Å; M142-L145 WeakPolarHBondContact O-CB 3.5Å; M142-L145 PolarHBondContact O-N 3.46Å; M142-L145 HydrophobicContact SD-CD2 4.17Å; M142-D146 PolarHBondContact O-N 3.46Å; M142-M171 HydrophobicContact CE-CB 4.01Å; M142-M171 HydrophobicContact SD-CB 4.03Å; M142-Q172 HydrophobicContact CE-CG 4.11Å; M142-H175 HydrophobicContact CE-CB 4.09Å; M142-H175 HydrophobicContact CG-CB 4.01Å; M142-H175 VanDerWaalsContact CG-CD2 3.49Å; M142-H175 WeakPolarHBondContact CG-CD2 3.25Å
143	D	82	Confident	80.6	Confident	87 Å²	87	83.2 Å²	83.2	47%	0.465	40%	0.399	S	S	.	.	H	α-helix	trans	-58.3	-39.3	174	-71.7	-21.9	0	0	0	111.6	R139 N147	R139-D143 PolarHBondContact O-N 2.91Å; D143-N147 PolarHBondContact O-N 3.16Å; D143-N147 VanDerWaalsContact O-N 3.09Å; D143-N147 PolarHBondContact O-ND2 3.37Å
144	R	86.7	Confident	79.9	Confident	162 Å²	162	84.6 Å²	84.6	61%	0.611	41%	0.408	S	S	*	.	H	α-helix	trans	-68.5	-38.2	175.7	-71.4	176.4	89.1	-175.5	8.1	111.8	I140 L141 M142 N147 I148	I140-R144 WeakPolarHBondContact O-CB 3.34Å; I140-R144 WeakPolarHBondContact O-CG 3.38Å; I140-R144 PolarHBondContact O-N 3.31Å; I140-R144 VanDerWaalsContact O-N 3.09Å; L141-R144 PolarHBondContact O-N 2.82Å; M142-R144 PolarHBondContact O-N 3.43Å; R144-N147 PolarHBondContact O-N 3.24Å; R144-I148 VanDerWaalsContact O-CG1 3.29Å; R144-I148 WeakPolarHBondContact O-CG1 3.1Å; R144-I148 PolarHBondContact O-N 3.26Å
145	L	84.4	Confident	79.1	Confident	41 Å²	41	83 Å²	83	22%	0.215	40%	0.404	C	S	.	.	H	α-helix	trans	-64.4	-45.7	177.3	-173.1	66.4	0	0	0	110.9	L141 M142 N147 I148 I149 L165 L168 M171	L141-L145 WeakPolarHBondContact O-CB 3.45Å; L141-L145 PolarHBondContact O-N 3.26Å; M142-L145 HydrophobicContact CE-CD2 4.42Å; M142-L145 WeakPolarHBondContact O-CB 3.5Å; M142-L145 PolarHBondContact O-N 3.46Å; M142-L145 HydrophobicContact SD-CD2 4.17Å; L145-N147 VanDerWaalsContact C-N 3.33Å; L145-N147 PolarHBondContact O-N 2.88Å; L145-I148 PolarHBondContact O-N 3.09Å; L145-I149 HydrophobicContact CD1-CD1 4.39Å; L145-I149 HydrophobicContact CD2-CD1 4.5Å; L145-I149 HydrophobicContact CG-CD1 3.84Å; L145-I149 WeakPolarHBondContact O-CD1 3.39Å; L145-I149 VanDerWaalsContact O-CG1 3.3Å; L145-I149 WeakPolarHBondContact O-CG1 3.31Å; L145-I149 PolarHBondContact O-N 3Å; L145-L165 HydrophobicContact CD1-CD1 4.48Å; L145-L168 HydrophobicContact CD2-CD1 3.76Å; L145-L168 HydrophobicContact CG-CD1 4.35Å; L145-M171 HydrophobicContact CD2-CE 3.77Å; L145-M171 HydrophobicContact CD2-SD 4.43Å
146	D	82.2	Confident	78.2	Confident	48 Å²	48	82.6 Å²	82.6	26%	0.257	40%	0.403	S	S	.	.	H	α-helix	trans	-62.2	-40.6	177.4	-76.1	-24.7	0	0	0	111.6	M142 I149 N150 Q172	M142-D146 PolarHBondContact O-N 3.46Å; D146-I149 PolarHBondContact O-N 3.22Å; D146-N150 WeakPolarHBondContact O-CB 3.33Å; D146-N150 VanDerWaalsContact O-CG 3.24Å; D146-N150 PolarHBondContact O-N 3.49Å; D146-N150 PolarHBondContact O-ND2 3.47Å; D146-N150 VanDerWaalsContact O-ND2 3.13Å; D146-Q172 PolarHBondContact OD1-NE2 3.17Å
147	N	83.4	Confident	77.1	Confident	98 Å²	98	84.3 Å²	84.3	52%	0.524	41%	0.409	S	S	.	.	H	α-helix	trans	-60.7	-45.7	173.5	-76.8	-47.9	0	0	0	112.4	D143 R144 L145 I149 N150 E151	D143-N147 PolarHBondContact O-N 3.16Å; D143-N147 VanDerWaalsContact O-N 3.09Å; D143-N147 PolarHBondContact O-ND2 3.37Å; R144-N147 PolarHBondContact O-N 3.24Å; L145-N147 VanDerWaalsContact C-N 3.33Å; L145-N147 PolarHBondContact O-N 2.88Å; N147-I149 VanDerWaalsContact C-N 3.32Å; N147-I149 PolarHBondContact O-N 3.33Å; N147-N150 PolarHBondContact O-N 3.18Å; N147-E151 WeakPolarHBondContact O-CG 3.31Å; N147-E151 PolarHBondContact O-N 2.66Å
148	I	82.9	Confident	76.2	Confident	90 Å²	90	85.3 Å²	85.3	46%	0.462	42%	0.418	S	S	.	.	H	α-helix	trans	-62	-42.4	177.2	-70.2	165.1	0	0	0	110.5	R144 L145 E151 L152	R144-I148 VanDerWaalsContact O-CG1 3.29Å; R144-I148 WeakPolarHBondContact O-CG1 3.1Å; R144-I148 PolarHBondContact O-N 3.26Å; L145-I148 PolarHBondContact O-N 3.09Å; I148-E151 PolarHBondContact O-N 2.97Å; I148-L152 HydrophobicContact CG2-CD1 3.68Å; I148-L152 HydrophobicContact CG2-CG 4.22Å; I148-L152 WeakPolarHBondContact O-CB 3.09Å; I148-L152 WeakPolarHBondContact O-CG 3.46Å; I148-L152 PolarHBondContact O-N 2.98Å
149	I	80.9	Confident	75.3	Confident	19 Å²	19	86 Å²	86	10%	0.097	44%	0.441	C	S	.	.	H	α-helix	trans	-63.4	-45.5	178.7	-69.7	157.4	0	0	0	110.5	L145 D146 N147 E151 L152 E153 L165 L168	L145-I149 HydrophobicContact CD1-CD1 4.39Å; L145-I149 HydrophobicContact CD2-CD1 4.5Å; L145-I149 HydrophobicContact CG-CD1 3.84Å; L145-I149 WeakPolarHBondContact O-CD1 3.39Å; L145-I149 VanDerWaalsContact O-CG1 3.3Å; L145-I149 WeakPolarHBondContact O-CG1 3.31Å; L145-I149 PolarHBondContact O-N 3Å; D146-I149 PolarHBondContact O-N 3.22Å; N147-I149 VanDerWaalsContact C-N 3.32Å; N147-I149 PolarHBondContact O-N 3.33Å; I149-E151 VanDerWaalsContact C-N 3.32Å; I149-E151 PolarHBondContact O-N 3.27Å; I149-L152 CarbonylContact O-C 3.59Å; I149-L152 PolarHBondContact O-N 3.11Å; I149-L152 VanDerWaalsContact O-N 3.14Å; I149-E153 HydrophobicContact CG2-CG 4.24Å; I149-E153 WeakPolarHBondContact O-CB 3.21Å; I149-E153 WeakPolarHBondContact O-CG 2.89Å; I149-E153 PolarHBondContact O-N 3.46Å; I149-L165 HydrophobicContact CD1-CD1 4.07Å; I149-L165 HydrophobicContact CG1-CD1 4.04Å; I149-L168 HydrophobicContact CD1-CD1 3.37Å; I149-L168 HydrophobicContact CD1-CD2 3.44Å; I149-L168 VanDerWaalsContact CD1-CD2 3.44Å; I149-L168 HydrophobicContact CD1-CG 4.03Å; I149-L168 HydrophobicContact CG1-CD2 4.35Å
150	N	79.8	Confident	74.5	Confident	98 Å²	98	87.1 Å²	87.1	52%	0.524	45%	0.452	S	S	.	.	H	α-helix	trans	-60.3	-40.5	177.2	-72.3	-33.1	0	0	0	112.2	D146 N147 C154	D146-N150 WeakPolarHBondContact O-CB 3.33Å; D146-N150 VanDerWaalsContact O-CG 3.24Å; D146-N150 PolarHBondContact O-N 3.49Å; D146-N150 PolarHBondContact O-ND2 3.47Å; D146-N150 VanDerWaalsContact O-ND2 3.13Å; N147-N150 PolarHBondContact O-N 3.18Å; N150-C154 WeakPolarHBondContact O-CB 3.14Å; N150-C154 PolarHBondContact O-N 2.96Å; N150-C154 VanDerWaalsContact O-N 3.1Å
151	E	79.8	Confident	73.6	Confident	138 Å²	138	90.2 Å²	90.2	65%	0.645	47%	0.469	S	S	*	.	H	α-helix	trans	-64.5	-43.9	173.6	-73.7	-174.7	173.5	0	0	111.8	N147 I148 I149 C154 V155	N147-E151 WeakPolarHBondContact O-CG 3.31Å; N147-E151 PolarHBondContact O-N 2.66Å; I148-E151 PolarHBondContact O-N 2.97Å; I149-E151 VanDerWaalsContact C-N 3.32Å; I149-E151 PolarHBondContact O-N 3.27Å; E151-C154 WeakPolarHBondContact O-CB 3.39Å; E151-C154 PolarHBondContact O-N 2.88Å; E151-V155 WeakPolarHBondContact O-CG2 3.4Å; E151-V155 PolarHBondContact O-N 3.31Å
152	L	72.8	Confident	72.7	Confident	60 Å²	60	89.9 Å²	89.9	31%	0.314	47%	0.473	S	S	.	.	H	α-helix	trans	-67.4	-38.8	179.1	-70.8	172.1	0	0	0	112.4	I148 I149 C154 V155 T156 I163	I148-L152 HydrophobicContact CG2-CD1 3.68Å; I148-L152 HydrophobicContact CG2-CG 4.22Å; I148-L152 WeakPolarHBondContact O-CB 3.09Å; I148-L152 WeakPolarHBondContact O-CG 3.46Å; I148-L152 PolarHBondContact O-N 2.98Å; I149-L152 CarbonylContact O-C 3.59Å; I149-L152 PolarHBondContact O-N 3.11Å; I149-L152 VanDerWaalsContact O-N 3.14Å; L152-C154 VanDerWaalsContact C-N 3.31Å; L152-C154 PolarHBondContact O-N 3.09Å; L152-V155 PolarHBondContact O-N 3.08Å; L152-T156 WeakPolarHBondContact O-CB 3.46Å; L152-T156 VanDerWaalsContact O-CG2 3.26Å; L152-T156 WeakPolarHBondContact O-CG2 3.49Å; L152-T156 PolarHBondContact O-N 3.21Å; L152-T156 PolarHBondContact O-OG1 3.3Å; L152-I163 HydrophobicContact CB-CD1 4.39Å; L152-I163 HydrophobicContact CD1-CD1 3.65Å; L152-I163 HydrophobicContact CD2-CD1 3.66Å; L152-I163 HydrophobicContact CG-CD1 4.08Å
153	E	72.5	Confident	72.1	Confident	104 Å²	104	94.3 Å²	94.3	49%	0.486	50%	0.496	S	S	.	.	H	α-helix	trans	-63	-38.4	173.6	-75.7	-170.3	175.9	0	0	111.5	I149 T156 R157	I149-E153 HydrophobicContact CG2-CG 4.24Å; I149-E153 WeakPolarHBondContact O-CB 3.21Å; I149-E153 WeakPolarHBondContact O-CG 2.89Å; I149-E153 PolarHBondContact O-N 3.46Å; E153-T156 VanDerWaalsContact CA-OG1 3.31Å; E153-T156 WeakPolarHBondContact CA-OG1 3.5Å; E153-T156 PolarHBondContact O-OG1 3.27Å; E153-R157 WeakPolarHBondContact O-CG 3.37Å; E153-R157 PolarHBondContact O-N 3.34Å
154	C	62.5	Low	71.5	Confident	85 Å²	85	97 Å²	97	57%	0.574	51%	0.508	S	S	*	.	H	α-helix	trans	-63.2	-44.1	173.3	-172.5	0	0	0	0	111.7	N150 E151 L152	N150-C154 WeakPolarHBondContact O-CB 3.14Å; N150-C154 PolarHBondContact O-N 2.96Å; N150-C154 VanDerWaalsContact O-N 3.1Å; E151-C154 WeakPolarHBondContact O-CB 3.39Å; E151-C154 PolarHBondContact O-N 2.88Å; L152-C154 VanDerWaalsContact C-N 3.31Å; L152-C154 PolarHBondContact O-N 3.09Å
155	V	60.3	Low	70.9	Confident	69 Å²	69	92.6 Å²	92.6	42%	0.418	50%	0.497	S	S	.	.	H	α-helix	trans	-72.7	-37	-179.4	174.8	0	0	0	0	112.4	E151 L152 R157 N158 I160	E151-V155 WeakPolarHBondContact O-CG2 3.4Å; E151-V155 PolarHBondContact O-N 3.31Å; L152-V155 PolarHBondContact O-N 3.08Å; V155-R157 VanDerWaalsContact C-N 3.3Å; V155-R157 PolarHBondContact O-N 3.13Å; V155-N158 VanDerWaalsContact O-CB 3.31Å; V155-N158 WeakPolarHBondContact O-CB 3.45Å; V155-N158 PolarHBondContact O-N 2.78Å; V155-I160 HydrophobicContact CG1-CD1 3.83Å
156	T	58.1	Low	70.6	Confident	24 Å²	24	95.3 Å²	95.3	15%	0.147	52%	0.517	C	S	.	.	H	α-helix	trans	-68.8	-27.1	-179.5	47.3	0	0	0	0	112.8	L152 E153 N158 G159 I160 N161	L152-T156 WeakPolarHBondContact O-CB 3.46Å; L152-T156 VanDerWaalsContact O-CG2 3.26Å; L152-T156 WeakPolarHBondContact O-CG2 3.49Å; L152-T156 PolarHBondContact O-N 3.21Å; L152-T156 PolarHBondContact O-OG1 3.3Å; E153-T156 VanDerWaalsContact CA-OG1 3.31Å; E153-T156 WeakPolarHBondContact CA-OG1 3.5Å; E153-T156 PolarHBondContact O-OG1 3.27Å; T156-N158 PolarHBondContact O-N 3.27Å; T156-N158 VanDerWaalsContact O-N 3.08Å; T156-G159 PolarHBondContact O-N 3.15Å; T156-I160 WeakPolarHBondContact CA-O 3.37Å; T156-I160 WeakPolarHBondContact CB-O 3.21Å; T156-I160 HydrophobicContact CG2-CB 4.14Å; T156-I160 HydrophobicContact CG2-CG2 4.25Å; T156-I160 WeakPolarHBondContact CG2-O 2.98Å; T156-I160 PolarHBondContact O-N 3.21Å; T156-I160 VanDerWaalsContact O-O 3.09Å; T156-N161 WeakPolarHBondContact CG2-O 3.4Å
157	R	57.8	Low	70.5	Confident	215 Å²	215	100.6 Å²	100.6	81%	0.811	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-19	167.1	-72.5	179.5	-171.2	-149.6	4.1	113.7	E153 V155 G159	E153-R157 WeakPolarHBondContact O-CG 3.37Å; E153-R157 PolarHBondContact O-N 3.34Å; V155-R157 VanDerWaalsContact C-N 3.3Å; V155-R157 PolarHBondContact O-N 3.13Å; R157-G159 VanDerWaalsContact C-N 3.26Å; R157-G159 PolarHBondContact O-N 2.95Å
158	N	61.3	Low	70.4	Confident	136 Å²	136	97.2 Å²	97.2	73%	0.727	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	18.9	174.4	-61.3	-30.2	0	0	0	113.9	V155 T156	V155-N158 VanDerWaalsContact O-CB 3.31Å; V155-N158 WeakPolarHBondContact O-CB 3.45Å; V155-N158 PolarHBondContact O-N 2.78Å; T156-N158 PolarHBondContact O-N 3.27Å; T156-N158 VanDerWaalsContact O-N 3.08Å
159	G	62.6	Low	70.1	Confident	72 Å²	72	97 Å²	97	74%	0.742	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.7	14.1	173.4	0	0	0	0	0	115.2	T156 R157	T156-G159 PolarHBondContact O-N 3.15Å; R157-G159 VanDerWaalsContact C-N 3.26Å; R157-G159 PolarHBondContact O-N 2.95Å
160	I	64.2	Low	70.1	Confident	100 Å²	100	100.3 Å²	100.3	51%	0.513	54%	0.537	S	S	.	.	P	Polyproline II helix	trans	-92.4	137.3	170.3	-54.5	-173.1	0	0	0	108.5	V155 T156	V155-I160 HydrophobicContact CG1-CD1 3.83Å; T156-I160 WeakPolarHBondContact CA-O 3.37Å; T156-I160 WeakPolarHBondContact CB-O 3.21Å; T156-I160 HydrophobicContact CG2-CB 4.14Å; T156-I160 HydrophobicContact CG2-CG2 4.25Å; T156-I160 WeakPolarHBondContact CG2-O 2.98Å; T156-I160 PolarHBondContact O-N 3.21Å; T156-I160 VanDerWaalsContact O-O 3.09Å
161	N	62.6	Low	70.1	Confident	139 Å²	139	98.5 Å²	98.5	74%	0.743	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-55.1	137.5	177.3	-70.8	-39.1	0	0	0	111.1	T156 I163	T156-N161 WeakPolarHBondContact CG2-O 3.4Å; N161-I163 PolarHBondContact O-N 2.87Å
162	P	66.3	Low	70.2	Confident	97 Å²	97	95.6 Å²	95.6	63%	0.63	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-58.8	135.3	178.2	22.6	-31.3	0	0	0	110.8	I164	P162-I164 PolarHBondContact O-N 2.96Å
163	I	70.7	Confident	70.5	Confident	98 Å²	98	96.8 Å²	96.8	50%	0.503	52%	0.519	S	S	.	.			trans	-79.5	114.6	175.3	-68.6	165.9	0	0	0	107.8	L152 N161 L165	L152-I163 HydrophobicContact CB-CD1 4.39Å; L152-I163 HydrophobicContact CD1-CD1 3.65Å; L152-I163 HydrophobicContact CD2-CD1 3.66Å; L152-I163 HydrophobicContact CG-CD1 4.08Å; N161-I163 PolarHBondContact O-N 2.87Å; I163-L165 HydrophobicContact CG2-CD2 4.24Å; I163-L165 HydrophobicContact CG2-CG 4.31Å
164	I	70.5	Confident	70.7	Confident	143 Å²	143	96.1 Å²	96.1	73%	0.733	52%	0.517	S	S	*	.			trans	-90.2	119.7	177.1	-56.1	174.6	0	0	0	108.5	P162 P166	P162-I164 PolarHBondContact O-N 2.96Å; I164-P166 WeakPolarHBondContact O-CD 3.23Å
165	L	73.8	Confident	71.5	Confident	71 Å²	71	93.5 Å²	93.5	37%	0.372	50%	0.496	S	S	.	.			trans	-105.8	98.7	172.3	-66.4	177.7	0	0	0	108.7	L145 I149 I163 Y167 L168	L145-L165 HydrophobicContact CD1-CD1 4.48Å; I149-L165 HydrophobicContact CD1-CD1 4.07Å; I149-L165 HydrophobicContact CG1-CD1 4.04Å; I163-L165 HydrophobicContact CG2-CD2 4.24Å; I163-L165 HydrophobicContact CG2-CG 4.31Å; L165-Y167 PolarHBondContact O-N 3.02Å; L165-Y167 VanDerWaalsContact O-N 3.07Å; L165-L168 HydrophobicContact CB-CB 3.74Å; L165-L168 HydrophobicContact CB-CD2 4.5Å; L165-L168 HydrophobicContact CD1-CD2 4.42Å; L165-L168 WeakPolarHBondContact O-CB 3.27Å; L165-L168 PolarHBondContact O-N 2.96Å; L165-L168 VanDerWaalsContact O-N 3.09Å
166	P	77	Confident	72.4	Confident	97 Å²	97	92.2 Å²	92.2	63%	0.63	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-28.2	-169.2	-26.5	34.9	0	0	0	115.2	I164	I164-P166 WeakPolarHBondContact O-CD 3.23Å
167	Y	80.5	Confident	73.2	Confident	159 Å²	159	97.3 Å²	97.3	62%	0.624	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.5	7.4	-176.3	-51.9	-66.1	0	0	0	113	L165 T169 D170 M171	L165-Y167 PolarHBondContact O-N 3.02Å; L165-Y167 VanDerWaalsContact O-N 3.07Å; Y167-T169 PolarHBondContact O-N 3.15Å; Y167-D170 PolarHBondContact O-N 2.96Å; Y167-M171 WeakPolarHBondContact O-CG 3.48Å; Y167-M171 PolarHBondContact O-N 3.42Å
168	L	80.9	Confident	73.8	Confident	28 Å²	28	90.3 Å²	90.3	15%	0.147	49%	0.493	C	S	.	.	H	α-helix	trans	-61.1	-45.9	-178.2	175.5	62.5	0	0	0	111.5	L145 I149 L165 D170 M171 Q172	L145-L168 HydrophobicContact CD2-CD1 3.76Å; L145-L168 HydrophobicContact CG-CD1 4.35Å; I149-L168 HydrophobicContact CD1-CD1 3.37Å; I149-L168 HydrophobicContact CD1-CD2 3.44Å; I149-L168 VanDerWaalsContact CD1-CD2 3.44Å; I149-L168 HydrophobicContact CD1-CG 4.03Å; I149-L168 HydrophobicContact CG1-CD2 4.35Å; L165-L168 HydrophobicContact CB-CB 3.74Å; L165-L168 HydrophobicContact CB-CD2 4.5Å; L165-L168 HydrophobicContact CD1-CD2 4.42Å; L165-L168 WeakPolarHBondContact O-CB 3.27Å; L165-L168 PolarHBondContact O-N 2.96Å; L165-L168 VanDerWaalsContact O-N 3.09Å; L168-D170 VanDerWaalsContact C-N 3.3Å; L168-D170 PolarHBondContact O-N 3.23Å; L168-M171 HydrophobicContact CD1-CE 4.47Å; L168-M171 PolarHBondContact O-N 2.93Å; L168-Q172 HydrophobicContact CD1-CG 4.17Å; L168-Q172 HydrophobicContact CG-CG 4.46Å; L168-Q172 WeakPolarHBondContact O-CG 3.32Å; L168-Q172 PolarHBondContact O-N 3.17Å
169	T	78.2	Confident	74.2	Confident	86 Å²	86	86.1 Å²	86.1	53%	0.528	47%	0.474	S	S	.	.	H	α-helix	trans	-59	-43.1	177.6	-48.2	0	0	0	0	111.5	Y167 M171 Q172 N173	Y167-T169 PolarHBondContact O-N 3.15Å; T169-M171 PolarHBondContact O-N 3.25Å; T169-Q172 PolarHBondContact O-N 3.46Å; T169-N173 VanDerWaalsContact O-CG 3.23Å; T169-N173 PolarHBondContact O-N 3.39Å; T169-N173 PolarHBondContact O-ND2 3.46Å
170	D	79.8	Confident	74.1	Confident	87 Å²	87	89.4 Å²	89.4	47%	0.465	47%	0.47	S	S	.	.	H	α-helix	trans	-64.1	-42	177.9	-62.5	-22.1	0	0	0	111.1	Y167 L168 N173 M174	Y167-D170 PolarHBondContact O-N 2.96Å; L168-D170 VanDerWaalsContact C-N 3.3Å; L168-D170 PolarHBondContact O-N 3.23Å; D170-N173 PolarHBondContact O-N 3.27Å; D170-M174 WeakPolarHBondContact O-CG 3.42Å; D170-M174 PolarHBondContact O-N 2.97Å
171	M	79.8	Confident	73.6	Confident	60 Å²	60	90 Å²	90	30%	0.296	48%	0.479	S	S	.	.	H	α-helix	trans	-64.6	-41.4	176.3	-71.3	-174.3	-66.1	0	0	112.2	M142 L145 Y167 L168 T169 M174 H175	M142-M171 HydrophobicContact CE-CB 4.01Å; M142-M171 HydrophobicContact SD-CB 4.03Å; L145-M171 HydrophobicContact CD2-CE 3.77Å; L145-M171 HydrophobicContact CD2-SD 4.43Å; Y167-M171 WeakPolarHBondContact O-CG 3.48Å; Y167-M171 PolarHBondContact O-N 3.42Å; L168-M171 HydrophobicContact CD1-CE 4.47Å; L168-M171 PolarHBondContact O-N 2.93Å; T169-M171 PolarHBondContact O-N 3.25Å; M171-M174 HydrophobicContact CG-CE 4.22Å; M171-M174 PolarHBondContact O-N 3.28Å; M171-H175 VanDerWaalsContact O-CB 3.3Å; M171-H175 WeakPolarHBondContact O-CB 3.4Å; M171-H175 PolarHBondContact O-N 3.33Å
172	Q	81.8	Confident	72.9	Confident	77 Å²	77	88.5 Å²	88.5	36%	0.36	47%	0.471	S	S	.	.	H	α-helix	trans	-64.5	-40.6	176.3	-74.4	176.7	-26.6	0	0	111.7	M142 D146 L168 T169 H175 A176	M142-Q172 HydrophobicContact CE-CG 4.11Å; D146-Q172 PolarHBondContact OD1-NE2 3.17Å; L168-Q172 HydrophobicContact CD1-CG 4.17Å; L168-Q172 HydrophobicContact CG-CG 4.46Å; L168-Q172 WeakPolarHBondContact O-CG 3.32Å; L168-Q172 PolarHBondContact O-N 3.17Å; T169-Q172 PolarHBondContact O-N 3.46Å; Q172-H175 PolarHBondContact O-N 2.82Å; Q172-A176 VanDerWaalsContact O-CB 3.31Å; Q172-A176 WeakPolarHBondContact O-CB 3.49Å; Q172-A176 PolarHBondContact O-N 3.49Å
173	N	80	Confident	71.7	Confident	86 Å²	86	94.1 Å²	94.1	46%	0.46	49%	0.493	S	S	.	.	H	α-helix	trans	-63.9	-48.1	175.8	-70	-19.9	0	0	0	111.5	T169 D170 H175 A176 E177	T169-N173 VanDerWaalsContact O-CG 3.23Å; T169-N173 PolarHBondContact O-N 3.39Å; T169-N173 PolarHBondContact O-ND2 3.46Å; D170-N173 PolarHBondContact O-N 3.27Å; N173-H175 VanDerWaalsContact C-N 3.31Å; N173-H175 PolarHBondContact O-N 2.89Å; N173-A176 PolarHBondContact O-N 3.34Å; N173-E177 WeakPolarHBondContact O-CG 3.4Å; N173-E177 PolarHBondContact O-N 2.92Å
174	M	76.7	Confident	71.8	Confident	89 Å²	89	93.9 Å²	93.9	44%	0.438	49%	0.493	S	S	.	.	H	α-helix	trans	-59.9	-41.8	176	-72.2	-174.7	-66.1	0	0	111.8	D170 M171 E177 M178	D170-M174 WeakPolarHBondContact O-CG 3.42Å; D170-M174 PolarHBondContact O-N 2.97Å; M171-M174 HydrophobicContact CG-CE 4.22Å; M171-M174 PolarHBondContact O-N 3.28Å; M174-E177 PolarHBondContact O-N 3.28Å; M174-M178 VanDerWaalsContact O-CG 3.26Å; M174-M178 WeakPolarHBondContact O-CG 3.43Å; M174-M178 PolarHBondContact O-N 2.9Å
175	H	78.5	Confident	71.8	Confident	30 Å²	30	91.3 Å²	91.3	14%	0.139	48%	0.48	C	S	.	.	H	α-helix	trans	-65.4	-39.6	177.1	-176.8	-100.5	0	0	0	112.6	M142 M171 Q172 N173 M178 S179	M142-H175 HydrophobicContact CE-CB 4.09Å; M142-H175 HydrophobicContact CG-CB 4.01Å; M142-H175 VanDerWaalsContact CG-CD2 3.49Å; M142-H175 WeakPolarHBondContact CG-CD2 3.25Å; M171-H175 VanDerWaalsContact O-CB 3.3Å; M171-H175 WeakPolarHBondContact O-CB 3.4Å; M171-H175 PolarHBondContact O-N 3.33Å; Q172-H175 PolarHBondContact O-N 2.82Å; N173-H175 VanDerWaalsContact C-N 3.31Å; N173-H175 PolarHBondContact O-N 2.89Å; H175-M178 PolarHBondContact O-N 3.01Å; H175-S179 WeakPolarHBondContact O-CB 3.48Å; H175-S179 PolarHBondContact O-N 3.31Å; H175-S179 PolarHBondContact O-OG 2.84Å
176	A	78.5	Confident	71.7	Confident	43 Å²	43	92.4 Å²	92.4	36%	0.355	49%	0.486	S	S	.	.	H	α-helix	trans	-65.6	-43.1	175.8	0	0	0	0	0	111.5	Q172 N173 S179 Q180	Q172-A176 VanDerWaalsContact O-CB 3.31Å; Q172-A176 WeakPolarHBondContact O-CB 3.49Å; Q172-A176 PolarHBondContact O-N 3.49Å; N173-A176 PolarHBondContact O-N 3.34Å; A176-S179 PolarHBondContact O-N 3.44Å; A176-Q180 WeakPolarHBondContact O-CG 3.45Å; A176-Q180 PolarHBondContact O-N 2.96Å
177	E	75.5	Confident	71.4	Confident	130 Å²	130	92.2 Å²	92.2	61%	0.607	48%	0.477	S	S	*	.	H	α-helix	trans	-59.1	-46.9	173.9	-73.1	173.3	-171.3	0	0	111	N173 M174 S179 Q180 T181	N173-E177 WeakPolarHBondContact O-CG 3.4Å; N173-E177 PolarHBondContact O-N 2.92Å; M174-E177 PolarHBondContact O-N 3.28Å; E177-S179 PolarHBondContact O-N 3.18Å; E177-Q180 PolarHBondContact O-N 3.44Å; E177-T181 PolarHBondContact O-N 3.3Å; E177-T181 PolarHBondContact O-OG1 3.47Å
178	M	70	Confident	70.9	Confident	69 Å²	69	88 Å²	88	34%	0.34	47%	0.468	S	S	.	.	H	α-helix	trans	-65.2	-21.8	176.8	-70.3	177.5	-170.8	0	0	114.3	L135 R139 M174 H175	L135-M178 HydrophobicContact CD2-CG 4.29Å; L135-M178 HydrophobicContact CD2-SD 3.79Å; R139-M178 PolarHBondContact NH2-O 3.42Å; R139-M178 VanDerWaalsContact NH2-O 3.15Å; M174-M178 VanDerWaalsContact O-CG 3.26Å; M174-M178 WeakPolarHBondContact O-CG 3.43Å; M174-M178 PolarHBondContact O-N 2.9Å; H175-M178 PolarHBondContact O-N 3.01Å
179	S	69.7	Low	70.2	Confident	48 Å²	48	92 Å²	92	34%	0.336	49%	0.49	S	S	.	.	H	α-helix	trans	-88.2	-23.4	177.3	-57.4	0	0	0	0	112.2	H175 A176 E177	H175-S179 WeakPolarHBondContact O-CB 3.48Å; H175-S179 PolarHBondContact O-N 3.31Å; H175-S179 PolarHBondContact O-OG 2.84Å; A176-S179 PolarHBondContact O-N 3.44Å; E177-S179 PolarHBondContact O-N 3.18Å
180	Q	62.4	Low	69.6	Low	140 Å²	140	92.4 Å²	92.4	65%	0.654	49%	0.487	S	S	*	.	H	α-helix	trans	-78.3	-25.5	175.7	-73.7	178.4	25.7	0	0	112.8	A176 E177 D182 I183	A176-Q180 WeakPolarHBondContact O-CG 3.45Å; A176-Q180 PolarHBondContact O-N 2.96Å; E177-Q180 PolarHBondContact O-N 3.44Å; Q180-D182 PolarHBondContact O-N 3.08Å; Q180-D182 VanDerWaalsContact O-N 3.15Å; Q180-I183 PolarHBondContact O-N 3.01Å
181	T	53	Low	68.8	Low	113 Å²	113	92.8 Å²	92.8	69%	0.693	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-5.3	179.6	-24.1	0	0	0	0	114.2	E177	E177-T181 PolarHBondContact O-N 3.3Å; E177-T181 PolarHBondContact O-OG1 3.47Å
182	D	48.2	Very low	67.9	Low	108 Å²	108	95.6 Å²	95.6	58%	0.578	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	9.8	179.8	-77.8	-2.3	0	0	0	114.1	R139 Q180	R139-D182 IonicContact CZ-OD2 2.97Å; R139-D182 VanDerWaalsContact CZ-OD2 3.29Å; R139-D182 IonicContact NH1-OD2 3.96Å; R139-D182 PolarHBondContact NH1-OD2 3.42Å; R139-D182 IonicContact NH2-OD1 3.09Å; R139-D182 IonicContact NH2-OD2 3.97Å; R139-D182 PolarHBondContact NH2-OD2 3.04Å; Q180-D182 PolarHBondContact O-N 3.08Å; Q180-D182 VanDerWaalsContact O-N 3.15Å
183	I	40.9	Very low	66.7	Low	214 Å²	214	97.3 Å²	97.3	100%	1.097	52%	0.518	S	S	*	.			trans	-109.8	0	173.9	-53.4	178.8	0	0	0	110.5	Q180	Q180-I183 PolarHBondContact O-N 3.01Å

Retrieved 183 of 183 residues in 188.4 ms (Link to these results)

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