H9FP55_MACMU Loading...

Stress-induced-phosphoprotein 1

Acts as a co-chaperone for HSP90AA1. Mediates the association of the molecular chaperones HSPA8/HSC70 and HSP90.

AlphaFold DB , UniProt , Accession H9FP55, Species MACMU (Macaca mulatta, Rhesus macaque), Gene STIP1, Length 543 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	66.3	Low	91.5	Very high	193 Å²	193	84.7 Å²	84.7	95%	0.951	40%	0.403	S	S	*	.				0	-45.8	0	-81.3	-168.6	-101.1	0	0	112.6	V4 N5	M1-V4 PolarHBondContact O-N 3.12Å; M1-N5 PolarHBondContact O-N 3.19Å; M1-N5 VanDerWaalsContact O-N 3.12Å
2	E	84.8	Confident	91.7	Very high	169 Å²	169	81.1 Å²	81.1	79%	0.79	39%	0.388	S	S	*	.	H	α-helix	trans	-59.3	-49.7	-179.6	-166	167.9	-166.3	0	0	113.1	V4 N5 E6	E2-V4 VanDerWaalsContact C-N 3.34Å; E2-V4 PolarHBondContact O-N 3.07Å; E2-N5 PolarHBondContact O-N 3.15Å; E2-E6 PolarHBondContact O-N 3.03Å
3	Q	91.8	Very high	92.1	Very high	122 Å²	122	87.6 Å²	87.6	57%	0.57	41%	0.413	S	S	*	.	H	α-helix	trans	-61.7	-35.4	176.9	-169.4	178.4	8.2	0	0	114	E6 L7 L33	Q3-E6 PolarHBondContact O-N 3.2Å; Q3-L7 HydrophobicContact CG-CD1 4.46Å; Q3-L7 WeakPolarHBondContact O-CG 3.11Å; Q3-L7 PolarHBondContact O-N 3.45Å; Q3-L33 HydrophobicContact CB-CD1 4.5Å; Q3-L33 HydrophobicContact CG-CD1 3.95Å
4	V	94.1	Very high	92.3	Very high	10 Å²	10	82.4 Å²	82.4	6%	0.061	39%	0.393	C	S	.	.	H	α-helix	trans	-66.3	-43.8	177.2	175.4	0	0	0	0	110.4	M1 E2 L7 K8 A30 L33 D34 L40	M1-V4 PolarHBondContact O-N 3.12Å; E2-V4 VanDerWaalsContact C-N 3.34Å; E2-V4 PolarHBondContact O-N 3.07Å; V4-L7 PolarHBondContact O-N 2.96Å; V4-K8 WeakPolarHBondContact O-CB 3.35Å; V4-K8 PolarHBondContact O-N 3.45Å; V4-A30 HydrophobicContact CG1-CB 4.43Å; V4-L33 HydrophobicContact CG2-CB 3.67Å; V4-L33 HydrophobicContact CG2-CD1 4.35Å; V4-D34 HydrophobicContact CG1-CB 3.93Å; V4-D34 HydrophobicContact CG2-CB 3.91Å; V4-L40 HydrophobicContact CG1-CD1 3.94Å
5	N	92.3	Very high	92.3	Very high	74 Å²	74	78.7 Å²	78.7	40%	0.396	38%	0.376	S	S	.	.	H	α-helix	trans	-65.9	-40.6	176.4	-81	-33.5	0	0	0	111.5	M1 E2 K8 E9	M1-N5 PolarHBondContact O-N 3.19Å; M1-N5 VanDerWaalsContact O-N 3.12Å; E2-N5 PolarHBondContact O-N 3.15Å; N5-K8 WeakPolarHBondContact O-CB 3.37Å; N5-K8 PolarHBondContact O-N 2.93Å; N5-K8 PolarHBondContact OD1-NZ 3.14Å; N5-E9 WeakPolarHBondContact O-CG 3.42Å; N5-E9 PolarHBondContact O-N 3.28Å
6	E	95.1	Very high	92.3	Very high	101 Å²	101	80.3 Å²	80.3	47%	0.472	40%	0.397	S	S	.	.	H	α-helix	trans	-60.4	-47	176.2	-165.8	-168.9	161.2	0	0	111.9	E2 Q3 K8 E9 K10	E2-E6 PolarHBondContact O-N 3.03Å; Q3-E6 PolarHBondContact O-N 3.2Å; E6-K8 PolarHBondContact O-N 2.68Å; E6-E9 PolarHBondContact O-N 2.71Å; E6-K10 WeakPolarHBondContact O-CB 3.42Å; E6-K10 WeakPolarHBondContact O-CG 3.39Å; E6-K10 PolarHBondContact O-N 3.45Å; E6-K10 WeakPolarHBondContact OE1-CE 3.27Å; E6-K10 IonicContact OE1-NZ 3.97Å; E6-K10 PolarHBondContact OE1-NZ 3.3Å
7	L	96.6	Very high	92.3	Very high	18 Å²	18	79.8 Å²	79.8	9%	0.094	41%	0.409	C	S	.	.	H	α-helix	trans	-63.6	-40.1	176.3	-74.3	168	0	0	0	112.1	Q3 V4 K10 G11 E29 A30 L33	Q3-L7 HydrophobicContact CG-CD1 4.46Å; Q3-L7 WeakPolarHBondContact O-CG 3.11Å; Q3-L7 PolarHBondContact O-N 3.45Å; V4-L7 PolarHBondContact O-N 2.96Å; L7-K10 PolarHBondContact O-N 2.85Å; L7-G11 PolarHBondContact O-N 3.46Å; L7-E29 HydrophobicContact CD1-CB 4.04Å; L7-E29 HydrophobicContact CD2-CB 4.45Å; L7-A30 HydrophobicContact CB-CB 3.85Å; L7-A30 HydrophobicContact CD1-CB 4.36Å; L7-L33 HydrophobicContact CD1-CD1 3.77Å
8	K	96.6	Very high	92.2	Very high	37 Å²	37	77.5 Å²	77.5	16%	0.161	41%	0.409	C	S	.	.	H	α-helix	trans	-60.7	-46.9	174.9	-177.3	-164.4	75.1	-163.1	0	111.4	V4 N5 E6 G11 N12 L40	V4-K8 WeakPolarHBondContact O-CB 3.35Å; V4-K8 PolarHBondContact O-N 3.45Å; N5-K8 WeakPolarHBondContact O-CB 3.37Å; N5-K8 PolarHBondContact O-N 2.93Å; N5-K8 PolarHBondContact OD1-NZ 3.14Å; E6-K8 PolarHBondContact O-N 2.68Å; K8-G11 PolarHBondContact O-N 3.29Å; K8-N12 PolarHBondContact O-N 2.91Å; K8-N12 PolarHBondContact O-ND2 3.45Å; K8-N12 PolarHBondContact O-OD1 2.7Å; K8-L40 HydrophobicContact CB-CD2 3.79Å; K8-L40 HydrophobicContact CD-CD2 4.17Å; K8-L40 HydrophobicContact CG-CD2 3.79Å
9	E	96.1	Very high	92.4	Very high	103 Å²	103	77.9 Å²	77.9	48%	0.481	41%	0.411	S	S	.	.	H	α-helix	trans	-67.5	-39.4	178.8	-66.8	-46.8	137.7	0	0	112.2	N5 E6 G11 N12 K13	N5-E9 WeakPolarHBondContact O-CG 3.42Å; N5-E9 PolarHBondContact O-N 3.28Å; E6-E9 PolarHBondContact O-N 2.71Å; E9-G11 VanDerWaalsContact C-N 3.34Å; E9-G11 PolarHBondContact O-N 2.95Å; E9-N12 PolarHBondContact O-N 3.4Å; E9-N12 PolarHBondContact OE2-ND2 3.45Å; E9-K13 WeakPolarHBondContact O-CB 3.08Å; E9-K13 PolarHBondContact O-N 3.07Å
10	K	95.7	Very high	92.5	Very high	105 Å²	105	75.8 Å²	75.8	46%	0.457	40%	0.399	S	S	.	.	H	α-helix	trans	-58.5	-45.9	171.1	-75.6	177.7	-176.3	169.4	0	111.4	E6 L7 N12 K13 A14	E6-K10 WeakPolarHBondContact O-CB 3.42Å; E6-K10 WeakPolarHBondContact O-CG 3.39Å; E6-K10 PolarHBondContact O-N 3.45Å; E6-K10 WeakPolarHBondContact OE1-CE 3.27Å; E6-K10 IonicContact OE1-NZ 3.97Å; E6-K10 PolarHBondContact OE1-NZ 3.3Å; L7-K10 PolarHBondContact O-N 2.85Å; K10-N12 PolarHBondContact O-N 3.05Å; K10-K13 PolarHBondContact O-N 3.45Å; K10-A14 WeakPolarHBondContact O-CB 3.46Å; K10-A14 PolarHBondContact O-N 2.95Å
11	G	96.8	Very high	92.7	Very high	0 Å²	0	76.8 Å²	76.8	0%	0	41%	0.405	C	S	.	.	H	α-helix	trans	-60.9	-43.8	175.8	0	0	0	0	0	112.7	L7 K8 E9 K13 A14 L15 A23 Y27	L7-G11 PolarHBondContact O-N 3.46Å; K8-G11 PolarHBondContact O-N 3.29Å; E9-G11 VanDerWaalsContact C-N 3.34Å; E9-G11 PolarHBondContact O-N 2.95Å; G11-K13 VanDerWaalsContact C-N 3.35Å; G11-K13 PolarHBondContact O-N 2.96Å; G11-A14 PolarHBondContact O-N 3.06Å; G11-L15 WeakPolarHBondContact O-CB 3.44Å; G11-L15 PolarHBondContact O-N 2.71Å; G11-A23 WeakPolarHBondContact O-CB 3.48Å; G11-Y27 VanDerWaalsContact C-OH 3.25Å; G11-Y27 PolarHBondContact O-OH 3.31Å
12	N	94.6	Very high	94	Very high	41 Å²	41	71.4 Å²	71.4	22%	0.219	38%	0.381	C	S	.	.	H	α-helix	trans	-61.5	-42.7	176.6	-66.1	-15.7	0	0	0	111.9	K8 E9 K10 L15 S16 Y27 N43	K8-N12 PolarHBondContact O-N 2.91Å; K8-N12 PolarHBondContact O-ND2 3.45Å; K8-N12 PolarHBondContact O-OD1 2.7Å; E9-N12 PolarHBondContact O-N 3.4Å; E9-N12 PolarHBondContact OE2-ND2 3.45Å; K10-N12 PolarHBondContact O-N 3.05Å; N12-L15 PolarHBondContact O-N 2.74Å; N12-S16 WeakPolarHBondContact O-CB 3.23Å; N12-S16 PolarHBondContact O-N 3.36Å; N12-S16 PolarHBondContact O-OG 3.38Å; N12-Y27 VanDerWaalsContact CA-OH 3.29Å; N12-Y27 WeakPolarHBondContact CA-OH 3.47Å; N12-Y27 PolarHBondContact N-OH 3.12Å; N12-Y27 VanDerWaalsContact N-OH 3.17Å; N12-Y27 WeakPolarHBondContact OD1-CE1 3.47Å; N12-Y27 PolarHBondContact OD1-OH 2.86Å; N12-N43 PolarHBondContact OD1-ND2 3.34Å; N12-N43 VanDerWaalsContact OD1-ND2 3.08Å
13	K	96.6	Very high	94.6	Very high	166 Å²	166	63.4 Å²	63.4	72%	0.722	34%	0.343	S	S	*	.	H	α-helix	trans	-65.3	-45.5	177.6	-169.9	177.5	-178.8	-179.5	0	111.4	E9 K10 G11 S16 A17	E9-K13 WeakPolarHBondContact O-CB 3.08Å; E9-K13 PolarHBondContact O-N 3.07Å; K10-K13 PolarHBondContact O-N 3.45Å; G11-K13 VanDerWaalsContact C-N 3.35Å; G11-K13 PolarHBondContact O-N 2.96Å; K13-S16 PolarHBondContact O-N 3.44Å; K13-A17 WeakPolarHBondContact O-CB 3.39Å; K13-A17 PolarHBondContact O-N 3.17Å
14	A	95.2	Very high	94.9	Very high	15 Å²	15	58.1 Å²	58.1	12%	0.124	32%	0.319	C	S	.	.	H	α-helix	trans	-60.9	-44.6	176	0	0	0	0	0	111.8	K10 G11 S16 A17 G18 N19 D22 A23	K10-A14 WeakPolarHBondContact O-CB 3.46Å; K10-A14 PolarHBondContact O-N 2.95Å; G11-A14 PolarHBondContact O-N 3.06Å; A14-S16 VanDerWaalsContact C-N 3.31Å; A14-S16 PolarHBondContact O-N 3.32Å; A14-A17 CarbonylContact O-C 3.44Å; A14-A17 PolarHBondContact O-N 3.12Å; A14-G18 PolarHBondContact O-N 3.37Å; A14-G18 VanDerWaalsContact O-N 3.08Å; A14-N19 HydrophobicContact CB-CB 4.32Å; A14-N19 PolarHBondContact O-N 3.12Å; A14-D22 HydrophobicContact CB-CB 4Å; A14-A23 HydrophobicContact CB-CB 4Å
15	L	91.6	Very high	95.1	Very high	27 Å²	27	63 Å²	63	14%	0.141	34%	0.341	C	S	.	.	H	α-helix	trans	-63.9	-37.3	179.3	-172.3	61.4	0	0	0	112.4	G11 N12 G18 A23 Y27 A47 K50	G11-L15 WeakPolarHBondContact O-CB 3.44Å; G11-L15 PolarHBondContact O-N 2.71Å; N12-L15 PolarHBondContact O-N 2.74Å; L15-G18 PolarHBondContact O-N 2.91Å; L15-A23 HydrophobicContact CB-CB 3.82Å; L15-A23 HydrophobicContact CD1-CB 4.34Å; L15-Y27 HydrophobicContact CD2-CE2 4.41Å; L15-A47 HydrophobicContact CD1-CB 3.79Å; L15-A47 HydrophobicContact CD2-CB 4.3Å; L15-K50 HydrophobicContact CD1-CD 3.95Å; L15-K50 PolarHBondContact O-NZ 2.91Å
16	S	92.6	Very high	95.3	Very high	103 Å²	103	60.5 Å²	60.5	72%	0.72	33%	0.329	S	S	*	.	H	α-helix	trans	-69.7	-36.3	175.8	-56.9	0	0	0	0	111.9	N12 K13 A14 G18	N12-S16 WeakPolarHBondContact O-CB 3.23Å; N12-S16 PolarHBondContact O-N 3.36Å; N12-S16 PolarHBondContact O-OG 3.38Å; K13-S16 PolarHBondContact O-N 3.44Å; A14-S16 VanDerWaalsContact C-N 3.31Å; A14-S16 PolarHBondContact O-N 3.32Å; S16-G18 PolarHBondContact O-N 3.49Å
17	A	93.1	Very high	95.5	Very high	72 Å²	72	55.8 Å²	55.8	60%	0.595	31%	0.307	S	S	*	.	H	α-helix	trans	-74.5	-8.5	174	0	0	0	0	0	113.9	K13 A14	K13-A17 WeakPolarHBondContact O-CB 3.39Å; K13-A17 PolarHBondContact O-N 3.17Å; A14-A17 CarbonylContact O-C 3.44Å; A14-A17 PolarHBondContact O-N 3.12Å
18	G	90.9	Very high	95.5	Very high	39 Å²	39	56.2 Å²	56.2	40%	0.402	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.2	1.6	-178.3	0	0	0	0	0	114.7	A14 L15 S16 I20	A14-G18 PolarHBondContact O-N 3.37Å; A14-G18 VanDerWaalsContact O-N 3.08Å; L15-G18 PolarHBondContact O-N 2.91Å; S16-G18 PolarHBondContact O-N 3.49Å; G18-I20 VanDerWaalsContact C-N 3.35Å; G18-I20 PolarHBondContact O-N 2.76Å
19	N	95	Very high	95.6	Very high	86 Å²	86	58 Å²	58	46%	0.46	32%	0.321	S	S	.	.			trans	-82.3	81	176.1	-63.4	-4.8	0	0	0	109.5	A14 D22 A23	A14-N19 HydrophobicContact CB-CB 4.32Å; A14-N19 PolarHBondContact O-N 3.12Å; N19-D22 HydrophobicContact CB-CB 4.24Å; N19-A23 PolarHBondContact O-N 2.66Å
20	I	95	Very high	95.6	Very high	34 Å²	34	53.1 Å²	53.1	17%	0.174	30%	0.298	C	S	.	.	H	α-helix	trans	-68.3	-39.7	-171	-60.8	168.8	0	0	0	112	G18 A23 L24 A47 K50 K51	G18-I20 VanDerWaalsContact C-N 3.35Å; G18-I20 PolarHBondContact O-N 2.76Å; I20-A23 WeakPolarHBondContact O-CB 3.42Å; I20-A23 PolarHBondContact O-N 2.92Å; I20-L24 HydrophobicContact CG2-CD1 4.08Å; I20-L24 HydrophobicContact CG2-CG 4.36Å; I20-L24 WeakPolarHBondContact O-CG 3.28Å; I20-L24 PolarHBondContact O-N 3.48Å; I20-A47 WeakPolarHBondContact CG2-O 3.41Å; I20-K50 HydrophobicContact CD1-CB 4.18Å; I20-K50 HydrophobicContact CD1-CD 4.17Å; I20-K50 HydrophobicContact CD1-CG 3.8Å; I20-K50 HydrophobicContact CG1-CD 4.27Å; I20-K50 HydrophobicContact CG1-CG 4.38Å; I20-K51 HydrophobicContact CG2-CB 3.87Å; I20-K51 HydrophobicContact CG2-CD 4.36Å; I20-K51 HydrophobicContact CG2-CG 4.34Å
21	D	95.8	Very high	95.7	Very high	98 Å²	98	48.8 Å²	48.8	52%	0.524	28%	0.279	S	S	.	.	H	α-helix	trans	-66.3	-43.6	-178.1	-70.3	-43	0	0	0	112.2	A23 L24 Q25 K51	D21-A23 VanDerWaalsContact C-N 3.3Å; D21-A23 PolarHBondContact O-N 3.15Å; D21-L24 PolarHBondContact O-N 2.96Å; D21-Q25 PolarHBondContact O-N 3.02Å; D21-K51 WeakPolarHBondContact OD1-CE 3.36Å; D21-K51 IonicContact OD1-NZ 2.91Å; D21-K51 PolarHBondContact OD1-NZ 3.37Å
22	D	95	Very high	95.7	Very high	80 Å²	80	57 Å²	57	43%	0.428	32%	0.315	S	S	.	.	H	α-helix	trans	-60.5	-41.2	174.5	-64.6	-14.8	0	0	0	111.5	A14 N19 Q25 C26	A14-D22 HydrophobicContact CB-CB 4Å; N19-D22 HydrophobicContact CB-CB 4.24Å; D22-Q25 PolarHBondContact O-N 3.25Å; D22-C26 WeakPolarHBondContact O-CB 3.35Å; D22-C26 PolarHBondContact O-N 3.32Å; D22-C26 PolarHBondContact O-SG 3.23Å; D22-C26 VanDerWaalsContact O-SG 3.38Å
23	A	96.8	Very high	95.8	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-62.3	-46.5	176.6	0	0	0	0	0	111.6	G11 A14 L15 N19 I20 D21 Q25 C26 Y27	G11-A23 WeakPolarHBondContact O-CB 3.48Å; A14-A23 HydrophobicContact CB-CB 4Å; L15-A23 HydrophobicContact CB-CB 3.82Å; L15-A23 HydrophobicContact CD1-CB 4.34Å; N19-A23 PolarHBondContact O-N 2.66Å; I20-A23 WeakPolarHBondContact O-CB 3.42Å; I20-A23 PolarHBondContact O-N 2.92Å; D21-A23 VanDerWaalsContact C-N 3.3Å; D21-A23 PolarHBondContact O-N 3.15Å; A23-Q25 VanDerWaalsContact C-N 3.33Å; A23-Q25 PolarHBondContact O-N 3.33Å; A23-C26 PolarHBondContact O-N 3.33Å; A23-Y27 HydrophobicContact CB-CE2 4.07Å; A23-Y27 WeakPolarHBondContact O-CD2 3.45Å; A23-Y27 VanDerWaalsContact O-CG 3.29Å; A23-Y27 PolarHBondContact O-N 3.25Å
24	L	97.6	Very high	95.8	Very high	12 Å²	12	53.6 Å²	53.6	6%	0.063	30%	0.304	C	S	.	.	H	α-helix	trans	-61.8	-39.9	177.3	-73.3	173	0	0	0	112.3	I20 D21 S28 R44 A47 Y48 K51	I20-L24 HydrophobicContact CG2-CD1 4.08Å; I20-L24 HydrophobicContact CG2-CG 4.36Å; I20-L24 WeakPolarHBondContact O-CG 3.28Å; I20-L24 PolarHBondContact O-N 3.48Å; D21-L24 PolarHBondContact O-N 2.96Å; L24-S28 VanDerWaalsContact O-CB 3.24Å; L24-S28 WeakPolarHBondContact O-CB 3.42Å; L24-S28 PolarHBondContact O-N 3.4Å; L24-S28 PolarHBondContact O-OG 3.38Å; L24-R44 HydrophobicContact CD2-CG 3.69Å; L24-A47 HydrophobicContact CD2-CB 3.56Å; L24-A47 HydrophobicContact CG-CB 3.99Å; L24-Y48 HydrophobicContact CD1-CD1 3.92Å; L24-Y48 HydrophobicContact CD1-CE1 3.84Å; L24-Y48 HydrophobicContact CD2-CD1 3.63Å; L24-Y48 HydrophobicContact CD2-CD2 4.02Å; L24-Y48 HydrophobicContact CD2-CE1 3.62Å; L24-Y48 HydrophobicContact CD2-CE2 4.03Å; L24-Y48 HydrophobicContact CD2-CG 3.81Å; L24-Y48 HydrophobicContact CG-CD1 4.46Å; L24-Y48 HydrophobicContact CG-CE1 4.34Å; L24-K51 HydrophobicContact CD1-CD 3.66Å
25	Q	97.6	Very high	95.8	Very high	112 Å²	112	55.7 Å²	55.7	52%	0.523	32%	0.316	S	S	.	.	H	α-helix	trans	-62.6	-52.4	174.9	-177.4	176.8	-9.4	0	0	110.7	D21 D22 A23 Y27 S28 E29	D21-Q25 PolarHBondContact O-N 3.02Å; D22-Q25 PolarHBondContact O-N 3.25Å; A23-Q25 VanDerWaalsContact C-N 3.33Å; A23-Q25 PolarHBondContact O-N 3.33Å; Q25-Y27 PolarHBondContact O-N 3.4Å; Q25-S28 PolarHBondContact O-N 3.19Å; Q25-S28 VanDerWaalsContact O-N 3.1Å; Q25-E29 WeakPolarHBondContact CG-OE1 3.45Å; Q25-E29 PolarHBondContact NE2-OE1 2.9Å; Q25-E29 WeakPolarHBondContact O-CG 3.13Å; Q25-E29 PolarHBondContact O-N 2.85Å
26	C	97.8	Very high	96	Very high	22 Å²	22	61.1 Å²	61.1	15%	0.149	34%	0.341	C	S	.	.	H	α-helix	trans	-56.8	-46.5	179.5	-78.3	0	0	0	0	112.3	D22 A23 E29 A30	D22-C26 WeakPolarHBondContact O-CB 3.35Å; D22-C26 PolarHBondContact O-N 3.32Å; D22-C26 PolarHBondContact O-SG 3.23Å; D22-C26 VanDerWaalsContact O-SG 3.38Å; A23-C26 PolarHBondContact O-N 3.33Å; C26-E29 PolarHBondContact O-N 3.25Å; C26-A30 WeakPolarHBondContact O-CB 3.44Å; C26-A30 PolarHBondContact O-N 3.5Å
27	Y	97.9	Very high	96.1	Very high	1 Å²	1	57.7 Å²	57.7	0%	0.004	31%	0.314	C	S	.	.	H	α-helix	trans	-66.4	-37.4	176.7	-61.5	-43.9	0	0	0	112.4	G11 N12 L15 A23 Q25 A30 I31 N43 R44 A47	G11-Y27 VanDerWaalsContact C-OH 3.25Å; G11-Y27 PolarHBondContact O-OH 3.31Å; N12-Y27 VanDerWaalsContact CA-OH 3.29Å; N12-Y27 WeakPolarHBondContact CA-OH 3.47Å; N12-Y27 PolarHBondContact N-OH 3.12Å; N12-Y27 VanDerWaalsContact N-OH 3.17Å; N12-Y27 WeakPolarHBondContact OD1-CE1 3.47Å; N12-Y27 PolarHBondContact OD1-OH 2.86Å; L15-Y27 HydrophobicContact CD2-CE2 4.41Å; A23-Y27 HydrophobicContact CB-CE2 4.07Å; A23-Y27 WeakPolarHBondContact O-CD2 3.45Å; A23-Y27 VanDerWaalsContact O-CG 3.29Å; A23-Y27 PolarHBondContact O-N 3.25Å; Q25-Y27 PolarHBondContact O-N 3.4Å; Y27-A30 PolarHBondContact O-N 2.91Å; Y27-I31 WeakPolarHBondContact O-CB 3.42Å; Y27-I31 WeakPolarHBondContact O-CD1 3.32Å; Y27-I31 WeakPolarHBondContact O-CG1 3.29Å; Y27-I31 PolarHBondContact O-N 3.26Å; Y27-N43 HydrophobicContact CD1-CB 4.2Å; Y27-N43 HydrophobicContact CD2-CB 4.43Å; Y27-N43 HydrophobicContact CE1-CB 3.73Å; Y27-N43 HydrophobicContact CE2-CB 3.99Å; Y27-R44 HydrophobicContact CD2-CB 4.08Å; Y27-R44 HydrophobicContact CD2-CG 4.38Å; Y27-R44 HydrophobicContact CG-CB 4.25Å; Y27-A47 HydrophobicContact CD2-CB 4.41Å; Y27-A47 HydrophobicContact CE2-CB 4.23Å
28	S	97.9	Very high	96.3	Very high	28 Å²	28	56.1 Å²	56.1	20%	0.196	30%	0.295	C	S	.	.	H	α-helix	trans	-68.3	-37.6	178.5	-61.6	0	0	0	0	112.4	L24 Q25 I31 K32 R44	L24-S28 VanDerWaalsContact O-CB 3.24Å; L24-S28 WeakPolarHBondContact O-CB 3.42Å; L24-S28 PolarHBondContact O-N 3.4Å; L24-S28 PolarHBondContact O-OG 3.38Å; Q25-S28 PolarHBondContact O-N 3.19Å; Q25-S28 VanDerWaalsContact O-N 3.1Å; S28-I31 PolarHBondContact O-N 3.04Å; S28-K32 WeakPolarHBondContact O-CG 3.35Å; S28-K32 PolarHBondContact O-N 3.39Å; S28-K32 VanDerWaalsContact O-N 3.14Å; S28-R44 WeakPolarHBondContact OG-CD 3.46Å; S28-R44 PolarHBondContact OG-NH1 2.97Å; S28-R44 VanDerWaalsContact OG-NH1 3.13Å
29	E	97.6	Very high	96.5	Very high	75 Å²	75	56.2 Å²	56.2	35%	0.35	29%	0.287	S	S	.	.	H	α-helix	trans	-66.4	-43.3	171.7	-71.7	176.9	-167	0	0	111.4	L7 Q25 C26 I31 K32 L33	L7-E29 HydrophobicContact CD1-CB 4.04Å; L7-E29 HydrophobicContact CD2-CB 4.45Å; Q25-E29 WeakPolarHBondContact CG-OE1 3.45Å; Q25-E29 PolarHBondContact NE2-OE1 2.9Å; Q25-E29 WeakPolarHBondContact O-CG 3.13Å; Q25-E29 PolarHBondContact O-N 2.85Å; C26-E29 PolarHBondContact O-N 3.25Å; E29-I31 VanDerWaalsContact C-N 3.3Å; E29-I31 PolarHBondContact O-N 3.43Å; E29-K32 WeakPolarHBondContact O-CB 3.42Å; E29-K32 PolarHBondContact O-N 3.45Å; E29-L33 PolarHBondContact O-N 3.18Å
30	A	97	Very high	96.6	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-60.3	-40	175.4	0	0	0	0	0	112	V4 L7 C26 Y27 L33 D34 L40	V4-A30 HydrophobicContact CG1-CB 4.43Å; L7-A30 HydrophobicContact CB-CB 3.85Å; L7-A30 HydrophobicContact CD1-CB 4.36Å; C26-A30 WeakPolarHBondContact O-CB 3.44Å; C26-A30 PolarHBondContact O-N 3.5Å; Y27-A30 PolarHBondContact O-N 2.91Å; A30-L33 PolarHBondContact O-N 3.19Å; A30-D34 PolarHBondContact O-N 3.29Å; A30-L40 HydrophobicContact CB-CD1 3.71Å; A30-L40 HydrophobicContact CB-CD2 3.86Å; A30-L40 HydrophobicContact CB-CG 4.4Å
31	I	97.8	Very high	96.8	Very high	13 Å²	13	51.6 Å²	51.6	7%	0.067	26%	0.261	C	S	.	.	H	α-helix	trans	-67.3	-34.6	178.1	-73.9	164.4	0	0	0	111.9	Y27 S28 E29 L33 D34 P35 L40 Y41 R44	Y27-I31 WeakPolarHBondContact O-CB 3.42Å; Y27-I31 WeakPolarHBondContact O-CD1 3.32Å; Y27-I31 WeakPolarHBondContact O-CG1 3.29Å; Y27-I31 PolarHBondContact O-N 3.26Å; S28-I31 PolarHBondContact O-N 3.04Å; E29-I31 VanDerWaalsContact C-N 3.3Å; E29-I31 PolarHBondContact O-N 3.43Å; I31-L33 PolarHBondContact O-N 3.02Å; I31-D34 CarbonylContact O-C 3.57Å; I31-D34 VanDerWaalsContact O-C 3.28Å; I31-D34 PolarHBondContact O-N 3.2Å; I31-P35 VanDerWaalsContact O-CA 3.24Å; I31-P35 WeakPolarHBondContact O-CA 3.32Å; I31-P35 VanDerWaalsContact O-N 3.09Å; I31-L40 HydrophobicContact CD1-CB 4.03Å; I31-L40 HydrophobicContact CG1-CB 3.52Å; I31-L40 HydrophobicContact CG1-CD1 3.97Å; I31-L40 HydrophobicContact CG1-CG 4.4Å; I31-Y41 HydrophobicContact CD1-CD1 4Å; I31-Y41 HydrophobicContact CD1-CD2 4.4Å; I31-Y41 HydrophobicContact CD1-CE1 4.09Å; I31-Y41 HydrophobicContact CD1-CE2 4.47Å; I31-Y41 HydrophobicContact CD1-CG 4.18Å; I31-Y41 HydrophobicContact CG1-CD2 4.44Å; I31-Y41 HydrophobicContact CG1-CE2 4.22Å; I31-Y41 HydrophobicContact CG2-CE1 3.96Å; I31-Y41 HydrophobicContact CG2-CE2 4.1Å; I31-Y41 WeakPolarHBondContact CG2-OH 3.42Å; I31-R44 HydrophobicContact CD1-CB 4.44Å
32	K	97.3	Very high	96.9	Very high	174 Å²	174	46.9 Å²	46.9	76%	0.757	24%	0.236	S	C	*	.	H	α-helix	trans	-62.1	-34.6	173.4	-72.2	172.9	-176	177.4	0	111.8	S28 E29	S28-K32 WeakPolarHBondContact O-CG 3.35Å; S28-K32 PolarHBondContact O-N 3.39Å; S28-K32 VanDerWaalsContact O-N 3.14Å; E29-K32 WeakPolarHBondContact O-CB 3.42Å; E29-K32 PolarHBondContact O-N 3.45Å
33	L	96.4	Very high	97	Very high	89 Å²	89	44 Å²	44	47%	0.466	22%	0.221	S	C	.	.	H	α-helix	trans	-82	-31.7	179.2	-63.8	177.5	0	0	0	112.9	Q3 V4 L7 E29 A30 I31	Q3-L33 HydrophobicContact CB-CD1 4.5Å; Q3-L33 HydrophobicContact CG-CD1 3.95Å; V4-L33 HydrophobicContact CG2-CB 3.67Å; V4-L33 HydrophobicContact CG2-CD1 4.35Å; L7-L33 HydrophobicContact CD1-CD1 3.77Å; E29-L33 PolarHBondContact O-N 3.18Å; A30-L33 PolarHBondContact O-N 3.19Å; I31-L33 PolarHBondContact O-N 3.02Å
34	D	96	Very high	97.1	Very high	46 Å²	46	45.6 Å²	45.6	25%	0.246	23%	0.227	C	C	.	.			trans	-140.9	81.9	179	-174.4	3.4	0	0	0	111.6	V4 A30 I31 H36 N37	V4-D34 HydrophobicContact CG1-CB 3.93Å; V4-D34 HydrophobicContact CG2-CB 3.91Å; A30-D34 PolarHBondContact O-N 3.29Å; I31-D34 CarbonylContact O-C 3.57Å; I31-D34 VanDerWaalsContact O-C 3.28Å; I31-D34 PolarHBondContact O-N 3.2Å; D34-H36 PolarHBondContact O-N 3.4Å; D34-N37 HydrophobicContact CB-CB 4.33Å; D34-N37 PolarHBondContact O-N 2.93Å; D34-N37 WeakPolarHBondContact OD2-CB 3.48Å; D34-N37 PolarHBondContact OD2-ND2 3.07Å; D34-N37 VanDerWaalsContact OD2-ND2 3.17Å
35	P	95.9	Very high	97.1	Very high	58 Å²	58	45.1 Å²	45.1	38%	0.377	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-6.4	-173.5	27.7	-34.3	0	0	0	114.1	I31 Y41	I31-P35 VanDerWaalsContact O-CA 3.24Å; I31-P35 WeakPolarHBondContact O-CA 3.32Å; I31-P35 VanDerWaalsContact O-N 3.09Å; P35-Y41 VanDerWaalsContact O-CE2 3.25Å; P35-Y41 WeakPolarHBondContact O-CE2 3.35Å; P35-Y41 PolarHBondContact O-OH 3.39Å; P35-Y41 VanDerWaalsContact O-OH 3.07Å
36	H	94.9	Very high	97	Very high	142 Å²	142	40.6 Å²	40.6	66%	0.657	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.8	1	-179.8	-62.8	88.9	0	0	0	112.8	D34 H38 L67	D34-H36 PolarHBondContact O-N 3.4Å; H36-H38 PolarHBondContact O-N 3.38Å; H36-L67 HydrophobicContact CB-CD2 4.47Å
37	N	95.4	Very high	96.9	Very high	31 Å²	31	39.5 Å²	39.5	17%	0.166	20%	0.199	C	C	.	.			trans	-85.1	94.3	-177.8	-164.1	-35.8	0	0	0	112.5	D34 V39 L40 Y41	D34-N37 HydrophobicContact CB-CB 4.33Å; D34-N37 PolarHBondContact O-N 2.93Å; D34-N37 WeakPolarHBondContact OD2-CB 3.48Å; D34-N37 PolarHBondContact OD2-ND2 3.07Å; D34-N37 VanDerWaalsContact OD2-ND2 3.17Å; N37-V39 PolarHBondContact O-N 3.18Å; N37-V39 WeakPolarHBondContact OD1-CB 3.39Å; N37-V39 PolarHBondContact OD1-N 3.3Å; N37-V39 VanDerWaalsContact OD1-N 3.16Å; N37-L40 HydrophobicContact CB-CD1 3.81Å; N37-L40 HydrophobicContact CB-CG 3.89Å; N37-L40 PolarHBondContact O-N 2.93Å; N37-Y41 WeakPolarHBondContact O-CD2 3.36Å
38	H	96	Very high	96.9	Very high	39 Å²	39	41.1 Å²	41.1	18%	0.181	21%	0.205	C	C	.	.	H	α-helix	trans	-51.1	-29.6	177	60.6	-81.9	0	0	0	114.1	H36 L40 S42 T64 L67 K68 W71	H36-H38 PolarHBondContact O-N 3.38Å; H38-L40 PolarHBondContact O-N 2.93Å; H38-S42 WeakPolarHBondContact O-CB 3.37Å; H38-S42 PolarHBondContact O-N 3.12Å; H38-T64 HydrophobicContact CB-CG2 4.25Å; H38-L67 HydrophobicContact CB-CB 3.88Å; H38-K68 HydrophobicContact CB-CB 3.84Å; H38-K68 VanDerWaalsContact CE1-CD 3.43Å; H38-K68 WeakPolarHBondContact CE1-CD 3.39Å; H38-K68 VanDerWaalsContact NE2-CD 3.26Å; H38-K68 WeakPolarHBondContact NE2-CD 3.37Å; H38-W71 AromaticContact CD2-CE3 3.49Å; H38-W71 VanDerWaalsContact CD2-CE3 3.49Å; H38-W71 AromaticContact CD2-CZ3 3.54Å
39	V	96.8	Very high	96.8	Very high	41 Å²	41	40.9 Å²	40.9	25%	0.248	21%	0.205	C	C	.	.	H	α-helix	trans	-67.5	-36.2	179.4	-176.8	0	0	0	0	111.6	N37 S42 N43 W71	N37-V39 PolarHBondContact O-N 3.18Å; N37-V39 WeakPolarHBondContact OD1-CB 3.39Å; N37-V39 PolarHBondContact OD1-N 3.3Å; N37-V39 VanDerWaalsContact OD1-N 3.16Å; V39-S42 WeakPolarHBondContact O-CB 3.33Å; V39-S42 PolarHBondContact O-N 3.12Å; V39-N43 WeakPolarHBondContact O-CB 3.45Å; V39-N43 PolarHBondContact O-N 3.07Å; V39-W71 HydrophobicContact CG2-CH2 4.21Å
40	L	97.2	Very high	96.6	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-66.5	-44.1	179.5	-59.4	178.3	0	0	0	111.4	V4 K8 A30 I31 N37 H38 S42 N43 R44	V4-L40 HydrophobicContact CG1-CD1 3.94Å; K8-L40 HydrophobicContact CB-CD2 3.79Å; K8-L40 HydrophobicContact CD-CD2 4.17Å; K8-L40 HydrophobicContact CG-CD2 3.79Å; A30-L40 HydrophobicContact CB-CD1 3.71Å; A30-L40 HydrophobicContact CB-CD2 3.86Å; A30-L40 HydrophobicContact CB-CG 4.4Å; I31-L40 HydrophobicContact CD1-CB 4.03Å; I31-L40 HydrophobicContact CG1-CB 3.52Å; I31-L40 HydrophobicContact CG1-CD1 3.97Å; I31-L40 HydrophobicContact CG1-CG 4.4Å; N37-L40 HydrophobicContact CB-CD1 3.81Å; N37-L40 HydrophobicContact CB-CG 3.89Å; N37-L40 PolarHBondContact O-N 2.93Å; H38-L40 PolarHBondContact O-N 2.93Å; L40-S42 VanDerWaalsContact C-N 3.35Å; L40-N43 PolarHBondContact O-N 3.17Å; L40-R44 WeakPolarHBondContact O-CB 3.48Å; L40-R44 PolarHBondContact O-N 2.9Å
41	Y	98.1	Very high	96.5	Very high	22 Å²	22	48 Å²	48	9%	0.086	24%	0.235	C	C	.	.	H	α-helix	trans	-64	-40	173.8	-66.1	-88.7	0	0	0	111.3	I31 P35 N37 N43 R44 S45 D60 K63 T64 L67	I31-Y41 HydrophobicContact CD1-CD1 4Å; I31-Y41 HydrophobicContact CD1-CD2 4.4Å; I31-Y41 HydrophobicContact CD1-CE1 4.09Å; I31-Y41 HydrophobicContact CD1-CE2 4.47Å; I31-Y41 HydrophobicContact CD1-CG 4.18Å; I31-Y41 HydrophobicContact CG1-CD2 4.44Å; I31-Y41 HydrophobicContact CG1-CE2 4.22Å; I31-Y41 HydrophobicContact CG2-CE1 3.96Å; I31-Y41 HydrophobicContact CG2-CE2 4.1Å; I31-Y41 WeakPolarHBondContact CG2-OH 3.42Å; P35-Y41 VanDerWaalsContact O-CE2 3.25Å; P35-Y41 WeakPolarHBondContact O-CE2 3.35Å; P35-Y41 PolarHBondContact O-OH 3.39Å; P35-Y41 VanDerWaalsContact O-OH 3.07Å; N37-Y41 WeakPolarHBondContact O-CD2 3.36Å; Y41-N43 VanDerWaalsContact C-N 3.32Å; Y41-N43 PolarHBondContact O-N 3.49Å; Y41-R44 PolarHBondContact O-N 3.41Å; Y41-S45 WeakPolarHBondContact O-CB 3.44Å; Y41-S45 PolarHBondContact O-N 3.2Å; Y41-D60 WeakPolarHBondContact CD1-OD1 3.41Å; Y41-K63 HydrophobicContact CD1-CB 3.93Å; Y41-K63 HydrophobicContact CD1-CG 3.65Å; Y41-K63 HydrophobicContact CD2-CG 4.34Å; Y41-K63 HydrophobicContact CE1-CB 4.28Å; Y41-K63 HydrophobicContact CE1-CG 3.56Å; Y41-K63 HydrophobicContact CE2-CG 4.27Å; Y41-K63 HydrophobicContact CG-CB 4.33Å; Y41-K63 HydrophobicContact CG-CG 4.04Å; Y41-T64 WeakPolarHBondContact CB-OG1 3.47Å; Y41-L67 HydrophobicContact CD2-CD1 3.56Å; Y41-L67 HydrophobicContact CE2-CD1 3.5Å; Y41-L67 HydrophobicContact CG-CD1 4.49Å
42	S	97.8	Very high	96.3	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-61.2	-39.3	175.6	-172.4	0	0	0	0	112.9	H38 V39 L40 A46 T64 R77	H38-S42 WeakPolarHBondContact O-CB 3.37Å; H38-S42 PolarHBondContact O-N 3.12Å; V39-S42 WeakPolarHBondContact O-CB 3.33Å; V39-S42 PolarHBondContact O-N 3.12Å; L40-S42 VanDerWaalsContact C-N 3.35Å; S42-A46 PolarHBondContact O-N 3.36Å; S42-T64 PolarHBondContact N-OG1 3.07Å; S42-T64 VanDerWaalsContact N-OG1 3.16Å; S42-R77 PolarHBondContact O-NE 3.21Å; S42-R77 WeakPolarHBondContact OG-CG 3.49Å
43	N	97.4	Very high	96.2	Very high	18 Å²	18	42.8 Å²	42.8	10%	0.096	22%	0.223	C	C	.	.	H	α-helix	trans	-75.3	-39.8	178.7	-72.6	-4.7	0	0	0	111.9	N12 Y27 V39 L40 Y41 A46 A47	N12-N43 PolarHBondContact OD1-ND2 3.34Å; N12-N43 VanDerWaalsContact OD1-ND2 3.08Å; Y27-N43 HydrophobicContact CD1-CB 4.2Å; Y27-N43 HydrophobicContact CD2-CB 4.43Å; Y27-N43 HydrophobicContact CE1-CB 3.73Å; Y27-N43 HydrophobicContact CE2-CB 3.99Å; V39-N43 WeakPolarHBondContact O-CB 3.45Å; V39-N43 PolarHBondContact O-N 3.07Å; L40-N43 PolarHBondContact O-N 3.17Å; Y41-N43 VanDerWaalsContact C-N 3.32Å; Y41-N43 PolarHBondContact O-N 3.49Å; N43-A46 WeakPolarHBondContact O-CB 3.41Å; N43-A46 PolarHBondContact O-N 2.91Å; N43-A47 PolarHBondContact O-N 3.44Å
44	R	98.2	Very high	96.2	Very high	34 Å²	34	42.1 Å²	42.1	13%	0.128	22%	0.215	C	C	.	.	H	α-helix	trans	-68.2	-37.5	176.1	-162.4	175.5	64.7	-177	-3.6	112.4	L24 Y27 S28 I31 L40 Y41 A46 A47 Y48 D60	L24-R44 HydrophobicContact CD2-CG 3.69Å; Y27-R44 HydrophobicContact CD2-CB 4.08Å; Y27-R44 HydrophobicContact CD2-CG 4.38Å; Y27-R44 HydrophobicContact CG-CB 4.25Å; S28-R44 WeakPolarHBondContact OG-CD 3.46Å; S28-R44 PolarHBondContact OG-NH1 2.97Å; S28-R44 VanDerWaalsContact OG-NH1 3.13Å; I31-R44 HydrophobicContact CD1-CB 4.44Å; L40-R44 WeakPolarHBondContact O-CB 3.48Å; L40-R44 PolarHBondContact O-N 2.9Å; Y41-R44 PolarHBondContact O-N 3.41Å; R44-A46 VanDerWaalsContact C-N 3.29Å; R44-A46 PolarHBondContact O-N 3.39Å; R44-A47 PolarHBondContact O-N 2.97Å; R44-A47 VanDerWaalsContact O-N 3.13Å; R44-Y48 HydrophobicContact CG-CD2 3.99Å; R44-Y48 HydrophobicContact CG-CE2 3.66Å; R44-Y48 WeakPolarHBondContact O-CD2 3.48Å; R44-Y48 PolarHBondContact O-N 3.41Å; R44-D60 WeakPolarHBondContact CB-OD2 3.49Å; R44-D60 WeakPolarHBondContact CG-OD2 3.45Å; R44-D60 IonicContact CZ-OD1 2.72Å; R44-D60 IonicContact CZ-OD2 2.75Å; R44-D60 IonicContact NE-OD1 3.07Å; R44-D60 IonicContact NE-OD2 3.56Å; R44-D60 PolarHBondContact NE-OD2 2.87Å; R44-D60 IonicContact NH2-OD1 3.6Å; R44-D60 PolarHBondContact NH2-OD1 3.01Å; R44-D60 IonicContact NH2-OD2 3.18Å
45	S	97.8	Very high	96.2	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.014	22%	0.222	C	C	.	.	H	α-helix	trans	-54.6	-45.5	169.2	176.1	0	0	0	0	111.5	Y41 A47 Y48 A49 A57	Y41-S45 WeakPolarHBondContact O-CB 3.44Å; Y41-S45 PolarHBondContact O-N 3.2Å; S45-A47 PolarHBondContact O-N 3.16Å; S45-Y48 PolarHBondContact O-N 3.4Å; S45-A49 WeakPolarHBondContact O-CB 3.26Å; S45-A49 PolarHBondContact O-N 3.01Å; S45-A57 WeakPolarHBondContact O-CB 3.43Å; S45-A57 PolarHBondContact OG-O 3.41Å
46	A	95.6	Very high	96.3	Very high	17 Å²	17	45.3 Å²	45.3	14%	0.14	22%	0.222	C	C	.	.	H	α-helix	trans	-63.1	-40.8	176.8	0	0	0	0	0	112.7	S42 N43 R44 A49 K50	S42-A46 PolarHBondContact O-N 3.36Å; N43-A46 WeakPolarHBondContact O-CB 3.41Å; N43-A46 PolarHBondContact O-N 2.91Å; R44-A46 VanDerWaalsContact C-N 3.29Å; R44-A46 PolarHBondContact O-N 3.39Å; A46-A49 PolarHBondContact O-N 3.48Å; A46-K50 PolarHBondContact O-N 3.38Å
47	A	96.9	Very high	96.4	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-66.5	-42.3	177.2	0	0	0	0	0	112	L15 I20 L24 Y27 N43 R44 S45 K50 K51	L15-A47 HydrophobicContact CD1-CB 3.79Å; L15-A47 HydrophobicContact CD2-CB 4.3Å; I20-A47 WeakPolarHBondContact CG2-O 3.41Å; L24-A47 HydrophobicContact CD2-CB 3.56Å; L24-A47 HydrophobicContact CG-CB 3.99Å; Y27-A47 HydrophobicContact CD2-CB 4.41Å; Y27-A47 HydrophobicContact CE2-CB 4.23Å; N43-A47 PolarHBondContact O-N 3.44Å; R44-A47 PolarHBondContact O-N 2.97Å; R44-A47 VanDerWaalsContact O-N 3.13Å; S45-A47 PolarHBondContact O-N 3.16Å; A47-K50 PolarHBondContact O-N 3.31Å; A47-K51 PolarHBondContact O-N 3.45Å
48	Y	98	Very high	96.5	Very high	34 Å²	34	39.1 Å²	39.1	13%	0.133	19%	0.191	C	C	.	.	H	α-helix	trans	-62.5	-42.7	174	-79.2	-52.1	0	0	0	112.4	L24 R44 S45 K50 K51 G52 D53 K56 D60	L24-Y48 HydrophobicContact CD1-CD1 3.92Å; L24-Y48 HydrophobicContact CD1-CE1 3.84Å; L24-Y48 HydrophobicContact CD2-CD1 3.63Å; L24-Y48 HydrophobicContact CD2-CD2 4.02Å; L24-Y48 HydrophobicContact CD2-CE1 3.62Å; L24-Y48 HydrophobicContact CD2-CE2 4.03Å; L24-Y48 HydrophobicContact CD2-CG 3.81Å; L24-Y48 HydrophobicContact CG-CD1 4.46Å; L24-Y48 HydrophobicContact CG-CE1 4.34Å; R44-Y48 HydrophobicContact CG-CD2 3.99Å; R44-Y48 HydrophobicContact CG-CE2 3.66Å; R44-Y48 WeakPolarHBondContact O-CD2 3.48Å; R44-Y48 PolarHBondContact O-N 3.41Å; S45-Y48 PolarHBondContact O-N 3.4Å; Y48-K50 VanDerWaalsContact C-N 3.31Å; Y48-K50 PolarHBondContact O-N 3.02Å; Y48-K51 WeakPolarHBondContact O-CB 3.48Å; Y48-K51 PolarHBondContact O-N 3.24Å; Y48-K51 VanDerWaalsContact O-N 3.11Å; Y48-G52 PolarHBondContact O-N 3.43Å; Y48-G52 VanDerWaalsContact O-N 3.08Å; Y48-D53 HydrophobicContact CD1-CB 4.14Å; Y48-D53 PolarHBondContact O-N 3.49Å; Y48-K56 HydrophobicContact CD1-CB 3.91Å; Y48-K56 HydrophobicContact CD1-CD 4.09Å; Y48-K56 HydrophobicContact CD2-CB 3.71Å; Y48-K56 HydrophobicContact CE1-CB 4.09Å; Y48-K56 HydrophobicContact CE1-CD 3.55Å; Y48-K56 HydrophobicContact CE1-CG 4.49Å; Y48-K56 HydrophobicContact CE2-CB 3.87Å; Y48-K56 HydrophobicContact CE2-CD 4.26Å; Y48-K56 HydrophobicContact CG-CB 3.75Å; Y48-D60 WeakPolarHBondContact CD2-OD2 3.44Å; Y48-D60 WeakPolarHBondContact CE2-OD2 3.39Å
49	A	93.9	Very high	96.6	Very high	23 Å²	23	42.1 Å²	42.1	19%	0.19	21%	0.205	C	C	.	.	H	α-helix	trans	-60.9	-41	175.1	0	0	0	0	0	111.7	S45 A46 K51 G52 Y54 A57	S45-A49 WeakPolarHBondContact O-CB 3.26Å; S45-A49 PolarHBondContact O-N 3.01Å; A46-A49 PolarHBondContact O-N 3.48Å; A49-K51 VanDerWaalsContact C-N 3.29Å; A49-K51 PolarHBondContact O-N 3.03Å; A49-G52 PolarHBondContact O-N 3.07Å; A49-G52 VanDerWaalsContact O-N 3.16Å; A49-Y54 WeakPolarHBondContact O-CE1 3.23Å; A49-A57 HydrophobicContact CB-CB 4.05Å
50	K	94.5	Very high	96.7	Very high	117 Å²	117	40.7 Å²	40.7	51%	0.509	20%	0.196	S	C	.	.	H	α-helix	trans	-66.6	-29.4	175.4	-161.7	176	177.8	177.7	0	112.6	L15 I20 A46 A47 Y48 G52	L15-K50 HydrophobicContact CD1-CD 3.95Å; L15-K50 PolarHBondContact O-NZ 2.91Å; I20-K50 HydrophobicContact CD1-CB 4.18Å; I20-K50 HydrophobicContact CD1-CD 4.17Å; I20-K50 HydrophobicContact CD1-CG 3.8Å; I20-K50 HydrophobicContact CG1-CD 4.27Å; I20-K50 HydrophobicContact CG1-CG 4.38Å; A46-K50 PolarHBondContact O-N 3.38Å; A47-K50 PolarHBondContact O-N 3.31Å; Y48-K50 VanDerWaalsContact C-N 3.31Å; Y48-K50 PolarHBondContact O-N 3.02Å; K50-G52 VanDerWaalsContact C-N 3.33Å
51	K	95.1	Very high	96.7	Very high	107 Å²	107	40.7 Å²	40.7	47%	0.465	20%	0.196	S	C	.	.	H	α-helix	trans	-74.6	-20.1	173.4	-163.8	167.3	174.5	168	0	113.4	I20 D21 L24 A47 Y48 A49	I20-K51 HydrophobicContact CG2-CB 3.87Å; I20-K51 HydrophobicContact CG2-CD 4.36Å; I20-K51 HydrophobicContact CG2-CG 4.34Å; D21-K51 WeakPolarHBondContact OD1-CE 3.36Å; D21-K51 IonicContact OD1-NZ 2.91Å; D21-K51 PolarHBondContact OD1-NZ 3.37Å; L24-K51 HydrophobicContact CD1-CD 3.66Å; A47-K51 PolarHBondContact O-N 3.45Å; Y48-K51 WeakPolarHBondContact O-CB 3.48Å; Y48-K51 PolarHBondContact O-N 3.24Å; Y48-K51 VanDerWaalsContact O-N 3.11Å; A49-K51 VanDerWaalsContact C-N 3.29Å; A49-K51 PolarHBondContact O-N 3.03Å
52	G	92.9	Very high	96.7	Very high	33 Å²	33	40.8 Å²	40.8	34%	0.34	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.8	6.5	-171.3	0	0	0	0	0	114.5	Y48 A49 K50 Y54	Y48-G52 PolarHBondContact O-N 3.43Å; Y48-G52 VanDerWaalsContact O-N 3.08Å; A49-G52 PolarHBondContact O-N 3.07Å; A49-G52 VanDerWaalsContact O-N 3.16Å; K50-G52 VanDerWaalsContact C-N 3.33Å; G52-Y54 VanDerWaalsContact C-N 3.34Å; G52-Y54 WeakPolarHBondContact O-CD2 3.46Å; G52-Y54 PolarHBondContact O-N 3.21Å
53	D	95.8	Very high	96.7	Very high	46 Å²	46	44.9 Å²	44.9	25%	0.246	22%	0.218	C	C	.	.			trans	-89.8	71.6	176.6	-164.8	-18.9	0	0	0	109.9	Y48 Q55 K56 A57	Y48-D53 HydrophobicContact CD1-CB 4.14Å; Y48-D53 PolarHBondContact O-N 3.49Å; D53-Q55 VanDerWaalsContact C-N 3.27Å; D53-Q55 PolarHBondContact O-N 2.9Å; D53-K56 PolarHBondContact O-N 2.72Å; D53-K56 PolarHBondContact OD1-N 2.97Å; D53-K56 VanDerWaalsContact OD2-CD 3.23Å; D53-K56 WeakPolarHBondContact OD2-CD 3.33Å; D53-K56 WeakPolarHBondContact OD2-CE 3.43Å; D53-K56 IonicContact OD2-NZ 3.3Å; D53-K56 PolarHBondContact OD2-NZ 3.28Å; D53-A57 PolarHBondContact O-N 2.73Å; D53-A57 VanDerWaalsContact O-N 3.08Å
54	Y	95.2	Very high	96.7	Very high	74 Å²	74	44 Å²	44	29%	0.29	21%	0.213	S	C	.	.	H	α-helix	trans	-68.6	-25.6	-170.2	-52.1	-56.8	0	0	0	113.7	A49 G52 A57 Y58 F84	A49-Y54 WeakPolarHBondContact O-CE1 3.23Å; G52-Y54 VanDerWaalsContact C-N 3.34Å; G52-Y54 WeakPolarHBondContact O-CD2 3.46Å; G52-Y54 PolarHBondContact O-N 3.21Å; Y54-A57 PolarHBondContact O-N 3.01Å; Y54-Y58 WeakPolarHBondContact O-CB 3.2Å; Y54-Y58 PolarHBondContact O-N 3.44Å; Y54-F84 HydrophobicContact CD1-CB 3.29Å; Y54-F84 HydrophobicContact CD1-CD1 4.37Å; Y54-F84 AromaticContact CD1-CD2 3.91Å; Y54-F84 HydrophobicContact CD1-CD2 3.91Å; Y54-F84 AromaticContact CD1-CG 3.63Å; Y54-F84 HydrophobicContact CD1-CG 3.63Å; Y54-F84 HydrophobicContact CD2-CB 3.75Å; Y54-F84 HydrophobicContact CE1-CB 3.49Å; Y54-F84 VanDerWaalsContact CE1-CB 3.49Å; Y54-F84 AromaticContact CE1-CD1 3.68Å; Y54-F84 HydrophobicContact CE1-CD1 3.68Å; Y54-F84 AromaticContact CE1-CD2 3.77Å; Y54-F84 HydrophobicContact CE1-CD2 3.77Å; Y54-F84 HydrophobicContact CE1-CE1 4.33Å; Y54-F84 HydrophobicContact CE1-CE2 4.42Å; Y54-F84 AromaticContact CE1-CG 3.37Å; Y54-F84 HydrophobicContact CE1-CG 3.37Å; Y54-F84 HydrophobicContact CE2-CB 3.92Å; Y54-F84 HydrophobicContact CE2-CD1 4.41Å; Y54-F84 HydrophobicContact CE2-CG 4.41Å; Y54-F84 HydrophobicContact CG-CB 3.43Å; Y54-F84 VanDerWaalsContact CG-CB 3.43Å; Y54-F84 HydrophobicContact CG-CG 4.26Å; Y54-F84 AromaticContact CZ-CD1 3.7Å; Y54-F84 AromaticContact CZ-CG 3.8Å
55	Q	97.5	Very high	96.7	Very high	84 Å²	84	43.1 Å²	43.1	39%	0.393	21%	0.211	S	C	.	.	H	α-helix	trans	-67.9	-46.5	176.7	-177.3	55.8	39.3	0	0	111	D53 A57 Y58 E59	D53-Q55 VanDerWaalsContact C-N 3.27Å; D53-Q55 PolarHBondContact O-N 2.9Å; Q55-A57 VanDerWaalsContact C-N 3.33Å; Q55-A57 PolarHBondContact O-N 3.14Å; Q55-Y58 WeakPolarHBondContact O-CB 3.35Å; Q55-Y58 PolarHBondContact O-N 3.31Å; Q55-E59 PolarHBondContact NE2-OE1 3.5Å; Q55-E59 VanDerWaalsContact NE2-OE1 3.09Å; Q55-E59 WeakPolarHBondContact O-CG 3.35Å; Q55-E59 PolarHBondContact O-N 2.87Å
56	K	96.9	Very high	96.6	Very high	87 Å²	87	48.3 Å²	48.3	38%	0.378	24%	0.239	S	C	.	.	H	α-helix	trans	-67.1	-35	173.5	-68.1	-170.8	-168.8	130.3	0	112.6	Y48 D53 Y58 E59 D60	Y48-K56 HydrophobicContact CD1-CB 3.91Å; Y48-K56 HydrophobicContact CD1-CD 4.09Å; Y48-K56 HydrophobicContact CD2-CB 3.71Å; Y48-K56 HydrophobicContact CE1-CB 4.09Å; Y48-K56 HydrophobicContact CE1-CD 3.55Å; Y48-K56 HydrophobicContact CE1-CG 4.49Å; Y48-K56 HydrophobicContact CE2-CB 3.87Å; Y48-K56 HydrophobicContact CE2-CD 4.26Å; Y48-K56 HydrophobicContact CG-CB 3.75Å; D53-K56 PolarHBondContact O-N 2.72Å; D53-K56 PolarHBondContact OD1-N 2.97Å; D53-K56 VanDerWaalsContact OD2-CD 3.23Å; D53-K56 WeakPolarHBondContact OD2-CD 3.33Å; D53-K56 WeakPolarHBondContact OD2-CE 3.43Å; D53-K56 IonicContact OD2-NZ 3.3Å; D53-K56 PolarHBondContact OD2-NZ 3.28Å; K56-Y58 VanDerWaalsContact C-N 3.27Å; K56-Y58 PolarHBondContact O-N 3.44Å; K56-E59 PolarHBondContact O-N 3.39Å; K56-D60 PolarHBondContact O-N 2.99Å
57	A	97.8	Very high	96.7	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-60.5	-39.9	173.4	0	0	0	0	0	111.9	S45 A49 D53 Y54 Q55 G61 A81	S45-A57 WeakPolarHBondContact O-CB 3.43Å; S45-A57 PolarHBondContact OG-O 3.41Å; A49-A57 HydrophobicContact CB-CB 4.05Å; D53-A57 PolarHBondContact O-N 2.73Å; D53-A57 VanDerWaalsContact O-N 3.08Å; Y54-A57 PolarHBondContact O-N 3.01Å; Q55-A57 VanDerWaalsContact C-N 3.33Å; Q55-A57 PolarHBondContact O-N 3.14Å; A57-G61 PolarHBondContact O-N 3.03Å; A57-A81 HydrophobicContact CB-CB 3.97Å
58	Y	98.3	Very high	96.6	Very high	44 Å²	44	52.8 Å²	52.8	17%	0.173	26%	0.257	C	S	.	.	H	α-helix	trans	-65.9	-45.9	175.5	170.7	-104.4	0	0	0	111.8	Y54 Q55 K56 D60 G61 C62 K78 L82 L85	Y54-Y58 WeakPolarHBondContact O-CB 3.2Å; Y54-Y58 PolarHBondContact O-N 3.44Å; Q55-Y58 WeakPolarHBondContact O-CB 3.35Å; Q55-Y58 PolarHBondContact O-N 3.31Å; K56-Y58 VanDerWaalsContact C-N 3.27Å; K56-Y58 PolarHBondContact O-N 3.44Å; Y58-D60 PolarHBondContact O-N 3.07Å; Y58-G61 CarbonylContact O-C 3.33Å; Y58-G61 WeakPolarHBondContact O-CA 3.37Å; Y58-G61 PolarHBondContact O-N 3.44Å; Y58-G61 VanDerWaalsContact O-N 3.12Å; Y58-C62 VanDerWaalsContact CE2-SG 3.6Å; Y58-C62 PolarHBondContact O-N 3.22Å; Y58-C62 PolarHBondContact O-SG 3.03Å; Y58-K78 HydrophobicContact CD2-CG 4.19Å; Y58-K78 HydrophobicContact CE2-CG 4.02Å; Y58-L82 HydrophobicContact CD2-CD1 4.4Å; Y58-L82 HydrophobicContact CD2-CD2 3.71Å; Y58-L82 HydrophobicContact CD2-CG 3.71Å; Y58-L82 HydrophobicContact CE2-CD1 4.01Å; Y58-L82 HydrophobicContact CE2-CD2 3.48Å; Y58-L82 VanDerWaalsContact CE2-CD2 3.48Å; Y58-L82 HydrophobicContact CE2-CG 3.71Å; Y58-L85 HydrophobicContact CG-CD1 4.44Å
59	E	98.1	Very high	96.5	Very high	101 Å²	101	54.4 Å²	54.4	47%	0.472	27%	0.271	S	S	.	.	H	α-helix	trans	-58.4	-47.4	177	-72.2	163.2	-163.9	0	0	112.2	Q55 K56 G61 C62 K63	Q55-E59 PolarHBondContact NE2-OE1 3.5Å; Q55-E59 VanDerWaalsContact NE2-OE1 3.09Å; Q55-E59 WeakPolarHBondContact O-CG 3.35Å; Q55-E59 PolarHBondContact O-N 2.87Å; K56-E59 PolarHBondContact O-N 3.39Å; E59-G61 VanDerWaalsContact C-N 3.31Å; E59-G61 PolarHBondContact O-N 3.47Å; E59-C62 PolarHBondContact O-N 3.05Å; E59-K63 PolarHBondContact O-N 2.98Å
60	D	97.9	Very high	96.5	Very high	11 Å²	11	57.8 Å²	57.8	6%	0.059	29%	0.286	C	S	.	.	H	α-helix	trans	-67.1	-32.1	175.2	-84	-9.9	0	0	0	112.2	Y41 R44 Y48 K56 Y58 K63 T64	Y41-D60 WeakPolarHBondContact CD1-OD1 3.41Å; R44-D60 WeakPolarHBondContact CB-OD2 3.49Å; R44-D60 WeakPolarHBondContact CG-OD2 3.45Å; R44-D60 IonicContact CZ-OD1 2.72Å; R44-D60 IonicContact CZ-OD2 2.75Å; R44-D60 IonicContact NE-OD1 3.07Å; R44-D60 IonicContact NE-OD2 3.56Å; R44-D60 PolarHBondContact NE-OD2 2.87Å; R44-D60 IonicContact NH2-OD1 3.6Å; R44-D60 PolarHBondContact NH2-OD1 3.01Å; R44-D60 IonicContact NH2-OD2 3.18Å; Y48-D60 WeakPolarHBondContact CD2-OD2 3.44Å; Y48-D60 WeakPolarHBondContact CE2-OD2 3.39Å; K56-D60 PolarHBondContact O-N 2.99Å; Y58-D60 PolarHBondContact O-N 3.07Å; D60-K63 PolarHBondContact O-N 2.99Å; D60-T64 WeakPolarHBondContact O-CB 3.16Å; D60-T64 PolarHBondContact O-N 3.43Å; D60-T64 PolarHBondContact O-OG1 3.21Å
61	G	97.4	Very high	96.4	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-63.1	-48.2	172.8	0	0	0	0	0	111.7	A57 Y58 E59 T64 V65	A57-G61 PolarHBondContact O-N 3.03Å; Y58-G61 CarbonylContact O-C 3.33Å; Y58-G61 WeakPolarHBondContact O-CA 3.37Å; Y58-G61 PolarHBondContact O-N 3.44Å; Y58-G61 VanDerWaalsContact O-N 3.12Å; E59-G61 VanDerWaalsContact C-N 3.31Å; E59-G61 PolarHBondContact O-N 3.47Å; G61-T64 WeakPolarHBondContact O-CB 2.8Å; G61-T64 PolarHBondContact O-N 3.35Å; G61-V65 PolarHBondContact O-N 3.23Å; G61-V65 VanDerWaalsContact O-N 3.16Å
62	C	97.8	Very high	96.3	Very high	25 Å²	25	49.5 Å²	49.5	17%	0.169	25%	0.249	C	C	.	.	H	α-helix	trans	-58.4	-48.2	173.2	-70.9	0	0	0	0	111	Y58 E59 T64 V65 D66	Y58-C62 VanDerWaalsContact CE2-SG 3.6Å; Y58-C62 PolarHBondContact O-N 3.22Å; Y58-C62 PolarHBondContact O-SG 3.03Å; E59-C62 PolarHBondContact O-N 3.05Å; C62-T64 PolarHBondContact O-N 3.05Å; C62-V65 PolarHBondContact O-N 3.48Å; C62-D66 PolarHBondContact O-N 3.13Å
63	K	97.9	Very high	96.3	Very high	86 Å²	86	52.1 Å²	52.1	37%	0.374	25%	0.251	S	S	.	.	H	α-helix	trans	-61.8	-34.3	179.9	-167.8	57.4	173.6	178.7	0	112.7	Y41 E59 D60 D66 L67	Y41-K63 HydrophobicContact CD1-CB 3.93Å; Y41-K63 HydrophobicContact CD1-CG 3.65Å; Y41-K63 HydrophobicContact CD2-CG 4.34Å; Y41-K63 HydrophobicContact CE1-CB 4.28Å; Y41-K63 HydrophobicContact CE1-CG 3.56Å; Y41-K63 HydrophobicContact CE2-CG 4.27Å; Y41-K63 HydrophobicContact CG-CB 4.33Å; Y41-K63 HydrophobicContact CG-CG 4.04Å; E59-K63 PolarHBondContact O-N 2.98Å; D60-K63 PolarHBondContact O-N 2.99Å; K63-D66 PolarHBondContact O-N 3.38Å; K63-L67 HydrophobicContact CD-CG 4.44Å; K63-L67 HydrophobicContact CG-CD1 4.16Å; K63-L67 WeakPolarHBondContact O-CB 3.16Å; K63-L67 VanDerWaalsContact O-CG 3.26Å; K63-L67 WeakPolarHBondContact O-CG 3.36Å; K63-L67 PolarHBondContact O-N 3.03Å
64	T	97.4	Very high	96.2	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62.2	-46.6	174.1	-57.4	0	0	0	0	111.2	H38 Y41 S42 D60 G61 C62 L67 K68 W71	H38-T64 HydrophobicContact CB-CG2 4.25Å; Y41-T64 WeakPolarHBondContact CB-OG1 3.47Å; S42-T64 PolarHBondContact N-OG1 3.07Å; S42-T64 VanDerWaalsContact N-OG1 3.16Å; D60-T64 WeakPolarHBondContact O-CB 3.16Å; D60-T64 PolarHBondContact O-N 3.43Å; D60-T64 PolarHBondContact O-OG1 3.21Å; G61-T64 WeakPolarHBondContact O-CB 2.8Å; G61-T64 PolarHBondContact O-N 3.35Å; C62-T64 PolarHBondContact O-N 3.05Å; T64-L67 PolarHBondContact O-N 2.82Å; T64-K68 PolarHBondContact O-N 3.26Å; T64-W71 HydrophobicContact CG2-CE3 3.79Å; T64-W71 HydrophobicContact CG2-CZ3 3.65Å
65	V	97.4	Very high	96.4	Very high	14 Å²	14	47 Å²	47	9%	0.085	23%	0.228	C	C	.	.	H	α-helix	trans	-66.3	-41.5	177.9	174.4	0	0	0	0	110.8	G61 C62 L67 K68 P69 Y75 K78	G61-V65 PolarHBondContact O-N 3.23Å; G61-V65 VanDerWaalsContact O-N 3.16Å; C62-V65 PolarHBondContact O-N 3.48Å; V65-L67 VanDerWaalsContact C-N 3.33Å; V65-L67 PolarHBondContact O-N 3.46Å; V65-K68 CarbonylContact O-C 3.6Å; V65-K68 PolarHBondContact O-N 3.23Å; V65-P69 WeakPolarHBondContact O-CA 3.49Å; V65-P69 WeakPolarHBondContact O-CD 3.45Å; V65-P69 WeakPolarHBondContact O-CG 3.06Å; V65-Y75 HydrophobicContact CG1-CD1 4.42Å; V65-Y75 HydrophobicContact CG1-CE1 3.73Å; V65-Y75 HydrophobicContact CG1-CE2 4.19Å; V65-Y75 HydrophobicContact CG2-CD1 4.18Å; V65-Y75 HydrophobicContact CG2-CD2 4.31Å; V65-Y75 HydrophobicContact CG2-CE1 4.29Å; V65-Y75 HydrophobicContact CG2-CE2 4.43Å; V65-Y75 HydrophobicContact CG2-CG 4.18Å; V65-K78 HydrophobicContact CG2-CD 4.44Å
66	D	97.3	Very high	96.3	Very high	111 Å²	111	43.8 Å²	43.8	59%	0.594	22%	0.215	S	C	*	.	H	α-helix	trans	-61.5	-41	177.5	-63.7	-19.9	0	0	0	112.1	C62 K63	C62-D66 PolarHBondContact O-N 3.13Å; K63-D66 PolarHBondContact O-N 3.38Å
67	L	95.9	Very high	96.3	Very high	45 Å²	45	43.1 Å²	43.1	24%	0.236	21%	0.21	C	C	.	.	H	α-helix	trans	-76.2	-30	179.2	-72.3	173.4	0	0	0	112.8	H36 H38 Y41 K63 T64 V65	H36-L67 HydrophobicContact CB-CD2 4.47Å; H38-L67 HydrophobicContact CB-CB 3.88Å; Y41-L67 HydrophobicContact CD2-CD1 3.56Å; Y41-L67 HydrophobicContact CE2-CD1 3.5Å; Y41-L67 HydrophobicContact CG-CD1 4.49Å; K63-L67 HydrophobicContact CD-CG 4.44Å; K63-L67 HydrophobicContact CG-CD1 4.16Å; K63-L67 WeakPolarHBondContact O-CB 3.16Å; K63-L67 VanDerWaalsContact O-CG 3.26Å; K63-L67 WeakPolarHBondContact O-CG 3.36Å; K63-L67 PolarHBondContact O-N 3.03Å; T64-L67 PolarHBondContact O-N 2.82Å; V65-L67 VanDerWaalsContact C-N 3.33Å; V65-L67 PolarHBondContact O-N 3.46Å
68	K	96.4	Very high	96.3	Very high	67 Å²	67	44.9 Å²	44.9	29%	0.291	22%	0.217	S	C	.	.			trans	-144.9	84.3	178.7	-166.7	167.7	-179.1	158.3	0	112	H38 T64 V65 D70 W71	H38-K68 HydrophobicContact CB-CB 3.84Å; H38-K68 VanDerWaalsContact CE1-CD 3.43Å; H38-K68 WeakPolarHBondContact CE1-CD 3.39Å; H38-K68 VanDerWaalsContact NE2-CD 3.26Å; H38-K68 WeakPolarHBondContact NE2-CD 3.37Å; T64-K68 PolarHBondContact O-N 3.26Å; V65-K68 CarbonylContact O-C 3.6Å; V65-K68 PolarHBondContact O-N 3.23Å; K68-D70 VanDerWaalsContact C-N 3.25Å; K68-D70 WeakPolarHBondContact CE-OD1 3.13Å; K68-D70 WeakPolarHBondContact CG-OD1 3.47Å; K68-D70 PolarHBondContact O-N 3.07Å; K68-W71 HydrophobicContact CB-CB 4.28Å; K68-W71 HydrophobicContact CD-CB 3.75Å; K68-W71 HydrophobicContact CD-CG 4.23Å; K68-W71 HydrophobicContact CG-CB 3.69Å; K68-W71 PolarHBondContact O-N 3.22Å
69	P	95.3	Very high	96.2	Very high	67 Å²	67	42.8 Å²	42.8	44%	0.435	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-15.3	-173.6	-20.6	32.4	0	0	0	115.1	V65 Y75 H101	V65-P69 WeakPolarHBondContact O-CA 3.49Å; V65-P69 WeakPolarHBondContact O-CD 3.45Å; V65-P69 WeakPolarHBondContact O-CG 3.06Å; P69-Y75 WeakPolarHBondContact O-CE2 3.39Å; P69-Y75 PolarHBondContact O-OH 3.18Å; P69-H101 PolarHBondContact O-CD2 3.03Å; P69-H101 VanDerWaalsContact O-CD2 3.31Å
70	D	92.9	Very high	96.1	Very high	94 Å²	94	39.5 Å²	39.5	50%	0.503	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	1	-178.8	66.1	-27.7	0	0	0	113.3	K68	K68-D70 VanDerWaalsContact C-N 3.25Å; K68-D70 WeakPolarHBondContact CE-OD1 3.13Å; K68-D70 WeakPolarHBondContact CG-OD1 3.47Å; K68-D70 PolarHBondContact O-N 3.07Å
71	W	94	Very high	96	Very high	51 Å²	51	39 Å²	39	19%	0.193	20%	0.197	C	C	.	.			trans	-103.1	111.6	-174	-172	47.4	0	0	0	113.1	H38 V39 T64 K68 K73 G74	H38-W71 AromaticContact CD2-CE3 3.49Å; H38-W71 VanDerWaalsContact CD2-CE3 3.49Å; H38-W71 AromaticContact CD2-CZ3 3.54Å; V39-W71 HydrophobicContact CG2-CH2 4.21Å; T64-W71 HydrophobicContact CG2-CE3 3.79Å; T64-W71 HydrophobicContact CG2-CZ3 3.65Å; K68-W71 HydrophobicContact CB-CB 4.28Å; K68-W71 HydrophobicContact CD-CB 3.75Å; K68-W71 HydrophobicContact CD-CG 4.23Å; K68-W71 HydrophobicContact CG-CB 3.69Å; K68-W71 PolarHBondContact O-N 3.22Å; W71-K73 HydrophobicContact CD2-CB 3.81Å; W71-K73 VanDerWaalsContact CE2-CB 3.49Å; W71-K73 HydrophobicContact CE3-CB 4.1Å; W71-K73 HydrophobicContact CG-CB 4.46Å; W71-K73 HydrophobicContact CH2-CB 3.96Å; W71-K73 HydrophobicContact CH2-CD 3.68Å; W71-K73 HydrophobicContact CH2-CG 4.18Å; W71-K73 HydrophobicContact CZ2-CB 3.61Å; W71-K73 HydrophobicContact CZ2-CD 3.47Å; W71-K73 VanDerWaalsContact CZ2-CD 3.47Å; W71-K73 HydrophobicContact CZ2-CG 4.08Å; W71-K73 HydrophobicContact CZ3-CB 4.17Å; W71-K73 PolarHBondContact O-N 3.16Å; W71-K73 VanDerWaalsContact O-N 3.11Å; W71-G74 PolarHBondContact O-N 3.45Å
72	G	92.5	Very high	96	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-60.8	-27	-174.5	0	0	0	0	0	114.4	G74 Y75 S76 E102	G72-G74 VanDerWaalsContact C-N 3.28Å; G72-G74 PolarHBondContact O-N 3.25Å; G72-Y75 PolarHBondContact O-N 2.94Å; G72-S76 PolarHBondContact O-N 3.37Å; G72-S76 PolarHBondContact O-OG 2.99Å; G72-E102 WeakPolarHBondContact CA-OE2 3.44Å; G72-E102 PolarHBondContact N-OE1 2.94Å; G72-E102 PolarHBondContact N-OE2 3.26Å
73	K	92.6	Very high	95.8	Very high	88 Å²	88	40 Å²	40	38%	0.383	20%	0.199	S	C	.	.	H	α-helix	trans	-65.4	-30.8	176.3	-161.8	178.1	-175.6	-178.9	0	112.4	W71 S76 R77	W71-K73 HydrophobicContact CD2-CB 3.81Å; W71-K73 VanDerWaalsContact CE2-CB 3.49Å; W71-K73 HydrophobicContact CE3-CB 4.1Å; W71-K73 HydrophobicContact CG-CB 4.46Å; W71-K73 HydrophobicContact CH2-CB 3.96Å; W71-K73 HydrophobicContact CH2-CD 3.68Å; W71-K73 HydrophobicContact CH2-CG 4.18Å; W71-K73 HydrophobicContact CZ2-CB 3.61Å; W71-K73 HydrophobicContact CZ2-CD 3.47Å; W71-K73 VanDerWaalsContact CZ2-CD 3.47Å; W71-K73 HydrophobicContact CZ2-CG 4.08Å; W71-K73 HydrophobicContact CZ3-CB 4.17Å; W71-K73 PolarHBondContact O-N 3.16Å; W71-K73 VanDerWaalsContact O-N 3.11Å; K73-S76 WeakPolarHBondContact O-CB 3.16Å; K73-S76 PolarHBondContact O-N 3.08Å; K73-R77 WeakPolarHBondContact O-CG 3.38Å; K73-R77 PolarHBondContact O-N 3.37Å
74	G	94.8	Very high	95.4	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-62.9	-49.3	175.3	0	0	0	0	0	111.9	W71 G72 S76 R77 K78	W71-G74 PolarHBondContact O-N 3.45Å; G72-G74 VanDerWaalsContact C-N 3.28Å; G72-G74 PolarHBondContact O-N 3.25Å; G74-S76 VanDerWaalsContact C-N 3.3Å; G74-S76 PolarHBondContact O-N 3.01Å; G74-R77 PolarHBondContact O-N 3.29Å; G74-R77 VanDerWaalsContact O-N 3.13Å; G74-K78 PolarHBondContact O-N 2.9Å
75	Y	97.7	Very high	95	Very high	11 Å²	11	43.6 Å²	43.6	4%	0.043	22%	0.217	C	C	.	.	H	α-helix	trans	-60.7	-39.9	174.8	-64.9	-87.7	0	0	0	111.9	V65 P69 G72 R77 K78 A79 T94 E97 G98 H101	V65-Y75 HydrophobicContact CG1-CD1 4.42Å; V65-Y75 HydrophobicContact CG1-CE1 3.73Å; V65-Y75 HydrophobicContact CG1-CE2 4.19Å; V65-Y75 HydrophobicContact CG2-CD1 4.18Å; V65-Y75 HydrophobicContact CG2-CD2 4.31Å; V65-Y75 HydrophobicContact CG2-CE1 4.29Å; V65-Y75 HydrophobicContact CG2-CE2 4.43Å; V65-Y75 HydrophobicContact CG2-CG 4.18Å; P69-Y75 WeakPolarHBondContact O-CE2 3.39Å; P69-Y75 PolarHBondContact O-OH 3.18Å; G72-Y75 PolarHBondContact O-N 2.94Å; Y75-R77 VanDerWaalsContact C-N 3.31Å; Y75-R77 PolarHBondContact O-N 3.44Å; Y75-K78 PolarHBondContact O-N 3.36Å; Y75-A79 VanDerWaalsContact O-CB 3.24Å; Y75-A79 WeakPolarHBondContact O-CB 3.44Å; Y75-A79 PolarHBondContact O-N 3.2Å; Y75-T94 HydrophobicContact CD1-CG2 4.08Å; Y75-T94 WeakPolarHBondContact CD1-O 3.48Å; Y75-E97 HydrophobicContact CD1-CB 4.23Å; Y75-E97 HydrophobicContact CE1-CB 3.93Å; Y75-G98 VanDerWaalsContact CG-CA 3.43Å; Y75-H101 AromaticContact CE2-CD2 3.96Å; Y75-H101 AromaticContact CZ-CD2 3.72Å; Y75-H101 PolarHBondContact OH-CD2 3.44Å; Y75-H101 VanDerWaalsContact OH-CD2 3.23Å; Y75-H101 PolarHBondContact OH-NE2 3.07Å
76	S	96	Very high	94.6	Very high	17 Å²	17	47.9 Å²	47.9	12%	0.119	24%	0.239	C	C	.	.	H	α-helix	trans	-59.9	-39.8	175.3	-58.6	0	0	0	0	112.3	G72 K73 G74 A80 L108	G72-S76 PolarHBondContact O-N 3.37Å; G72-S76 PolarHBondContact O-OG 2.99Å; K73-S76 WeakPolarHBondContact O-CB 3.16Å; K73-S76 PolarHBondContact O-N 3.08Å; G74-S76 VanDerWaalsContact C-N 3.3Å; G74-S76 PolarHBondContact O-N 3.01Å; S76-A80 VanDerWaalsContact O-CB 3.27Å; S76-A80 WeakPolarHBondContact O-CB 3.24Å; S76-A80 PolarHBondContact O-N 3.21Å; S76-L108 WeakPolarHBondContact OG-CD2 3.37Å
77	R	96.8	Very high	94.4	Very high	74 Å²	74	46 Å²	46	28%	0.279	22%	0.224	S	C	.	.	H	α-helix	trans	-68.4	-47.1	176.5	-69.5	-60.5	-172.7	-150.6	0.4	112.2	S42 K73 G74 Y75 A80 A81	S42-R77 PolarHBondContact O-NE 3.21Å; S42-R77 WeakPolarHBondContact OG-CG 3.49Å; K73-R77 WeakPolarHBondContact O-CG 3.38Å; K73-R77 PolarHBondContact O-N 3.37Å; G74-R77 PolarHBondContact O-N 3.29Å; G74-R77 VanDerWaalsContact O-N 3.13Å; Y75-R77 VanDerWaalsContact C-N 3.31Å; Y75-R77 PolarHBondContact O-N 3.44Å; R77-A80 PolarHBondContact O-N 2.89Å; R77-A81 PolarHBondContact O-N 2.94Å; R77-A81 VanDerWaalsContact O-N 3.1Å
78	K	97.9	Very high	94	Very high	37 Å²	37	44.9 Å²	44.9	16%	0.161	22%	0.217	C	C	.	.	H	α-helix	trans	-60.2	-46.4	177.8	-178.8	-178.9	170.7	-173.8	0	111.1	Y58 V65 G74 Y75 A81 L82 T94	Y58-K78 HydrophobicContact CD2-CG 4.19Å; Y58-K78 HydrophobicContact CE2-CG 4.02Å; V65-K78 HydrophobicContact CG2-CD 4.44Å; G74-K78 PolarHBondContact O-N 2.9Å; Y75-K78 PolarHBondContact O-N 3.36Å; K78-A81 PolarHBondContact O-N 2.78Å; K78-L82 HydrophobicContact CG-CD1 4.3Å; K78-L82 WeakPolarHBondContact O-CG 3.43Å; K78-L82 PolarHBondContact O-N 3.15Å; K78-L82 VanDerWaalsContact O-N 3.09Å; K78-T94 HydrophobicContact CB-CG2 3.97Å; K78-T94 HydrophobicContact CD-CG2 3.81Å; K78-T94 HydrophobicContact CG-CG2 3.9Å
79	A	97.2	Very high	93.8	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-65.3	-45.9	179.3	0	0	0	0	0	112.1	Y75 A81 L82 E83 T94 Y95	Y75-A79 VanDerWaalsContact O-CB 3.24Å; Y75-A79 WeakPolarHBondContact O-CB 3.44Å; Y75-A79 PolarHBondContact O-N 3.2Å; A79-A81 VanDerWaalsContact C-N 3.29Å; A79-A81 PolarHBondContact O-N 2.92Å; A79-L82 WeakPolarHBondContact O-CB 3.38Å; A79-L82 PolarHBondContact O-N 3.25Å; A79-E83 WeakPolarHBondContact O-CG 3.37Å; A79-E83 PolarHBondContact O-N 2.62Å; A79-T94 HydrophobicContact CB-CG2 3.93Å; A79-Y95 HydrophobicContact CB-CD1 4.08Å; A79-Y95 HydrophobicContact CB-CD2 3.84Å; A79-Y95 HydrophobicContact CB-CE1 3.71Å; A79-Y95 HydrophobicContact CB-CE2 3.45Å; A79-Y95 VanDerWaalsContact CB-CE2 3.45Å; A79-Y95 HydrophobicContact CB-CG 4.12Å
80	A	95.3	Very high	93.7	Very high	31 Å²	31	46.7 Å²	46.7	26%	0.256	22%	0.221	S	C	.	.	H	α-helix	trans	-58.6	-39.6	176.7	0	0	0	0	0	112.5	S76 R77 E83 F84	S76-A80 VanDerWaalsContact O-CB 3.27Å; S76-A80 WeakPolarHBondContact O-CB 3.24Å; S76-A80 PolarHBondContact O-N 3.21Å; R77-A80 PolarHBondContact O-N 2.89Å; A80-E83 WeakPolarHBondContact O-CB 3.43Å; A80-E83 PolarHBondContact O-N 2.9Å; A80-F84 WeakPolarHBondContact O-CD2 3.47Å; A80-F84 PolarHBondContact O-N 3.29Å
81	A	96.3	Very high	93.9	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.008	20%	0.197	C	C	.	.	H	α-helix	trans	-65.7	-41	174.8	0	0	0	0	0	112.4	A57 R77 K78 A79 E83 F84 L85	A57-A81 HydrophobicContact CB-CB 3.97Å; R77-A81 PolarHBondContact O-N 2.94Å; R77-A81 VanDerWaalsContact O-N 3.1Å; K78-A81 PolarHBondContact O-N 2.78Å; A79-A81 VanDerWaalsContact C-N 3.29Å; A79-A81 PolarHBondContact O-N 2.92Å; A81-E83 VanDerWaalsContact C-N 3.3Å; A81-E83 PolarHBondContact O-N 3.14Å; A81-F84 PolarHBondContact O-N 3.33Å; A81-L85 WeakPolarHBondContact O-CG 3.18Å; A81-L85 PolarHBondContact O-N 2.96Å; A81-L85 VanDerWaalsContact O-N 3.11Å
82	L	96.4	Very high	94	Very high	1 Å²	1	42 Å²	42	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-61.8	-36.8	174.3	-73.3	166.3	0	0	0	112.4	Y58 K78 A79 L85 N86 R87 E90 A91 T94	Y58-L82 HydrophobicContact CD2-CD1 4.4Å; Y58-L82 HydrophobicContact CD2-CD2 3.71Å; Y58-L82 HydrophobicContact CD2-CG 3.71Å; Y58-L82 HydrophobicContact CE2-CD1 4.01Å; Y58-L82 HydrophobicContact CE2-CD2 3.48Å; Y58-L82 VanDerWaalsContact CE2-CD2 3.48Å; Y58-L82 HydrophobicContact CE2-CG 3.71Å; K78-L82 HydrophobicContact CG-CD1 4.3Å; K78-L82 WeakPolarHBondContact O-CG 3.43Å; K78-L82 PolarHBondContact O-N 3.15Å; K78-L82 VanDerWaalsContact O-N 3.09Å; A79-L82 WeakPolarHBondContact O-CB 3.38Å; A79-L82 PolarHBondContact O-N 3.25Å; L82-L85 CarbonylContact O-C 3.28Å; L82-L85 PolarHBondContact O-N 2.85Å; L82-N86 PolarHBondContact O-N 2.68Å; L82-R87 HydrophobicContact CB-CB 4.32Å; L82-R87 HydrophobicContact CD2-CB 3.8Å; L82-R87 HydrophobicContact CD2-CG 4.47Å; L82-R87 VanDerWaalsContact CD2-CZ 3.45Å; L82-R87 PolarHBondContact O-N 3.48Å; L82-E90 HydrophobicContact CD1-CB 3.98Å; L82-E90 HydrophobicContact CD2-CB 4.13Å; L82-A91 HydrophobicContact CB-CB 3.86Å; L82-T94 WeakPolarHBondContact CD1-OG1 3.22Å
83	E	93.4	Very high	94.2	Very high	44 Å²	44	49.5 Å²	49.5	21%	0.206	23%	0.226	C	C	.	.	H	α-helix	trans	-61.1	-46.8	175.2	-72	-177.4	-137	0	0	112.4	A79 A80 A81 L85 N86 F88 A91 Y95 M115	A79-E83 WeakPolarHBondContact O-CG 3.37Å; A79-E83 PolarHBondContact O-N 2.62Å; A80-E83 WeakPolarHBondContact O-CB 3.43Å; A80-E83 PolarHBondContact O-N 2.9Å; A81-E83 VanDerWaalsContact C-N 3.3Å; A81-E83 PolarHBondContact O-N 3.14Å; E83-L85 PolarHBondContact O-N 3.46Å; E83-N86 PolarHBondContact O-N 2.63Å; E83-F88 WeakPolarHBondContact O-CE1 3.47Å; E83-A91 HydrophobicContact CG-CB 3.91Å; E83-Y95 WeakPolarHBondContact OE1-CE2 3.43Å; E83-Y95 PolarHBondContact OE1-OH 2.97Å; E83-M115 HydrophobicContact CG-CE 3.77Å; E83-M115 HydrophobicContact CG-SD 3.58Å; E83-M115 VanDerWaalsContact CG-SD 3.58Å; E83-M115 WeakPolarHBondContact OE2-CE 3.45Å
84	F	90.4	Very high	94.4	Very high	112 Å²	112	45.6 Å²	45.6	49%	0.491	21%	0.209	S	C	.	.	H	α-helix	trans	-67.5	-25	176.8	-73.9	-67.9	0	0	0	113	Y54 A80 A81 N86	Y54-F84 HydrophobicContact CD1-CB 3.29Å; Y54-F84 HydrophobicContact CD1-CD1 4.37Å; Y54-F84 AromaticContact CD1-CD2 3.91Å; Y54-F84 HydrophobicContact CD1-CD2 3.91Å; Y54-F84 AromaticContact CD1-CG 3.63Å; Y54-F84 HydrophobicContact CD1-CG 3.63Å; Y54-F84 HydrophobicContact CD2-CB 3.75Å; Y54-F84 HydrophobicContact CE1-CB 3.49Å; Y54-F84 VanDerWaalsContact CE1-CB 3.49Å; Y54-F84 AromaticContact CE1-CD1 3.68Å; Y54-F84 HydrophobicContact CE1-CD1 3.68Å; Y54-F84 AromaticContact CE1-CD2 3.77Å; Y54-F84 HydrophobicContact CE1-CD2 3.77Å; Y54-F84 HydrophobicContact CE1-CE1 4.33Å; Y54-F84 HydrophobicContact CE1-CE2 4.42Å; Y54-F84 AromaticContact CE1-CG 3.37Å; Y54-F84 HydrophobicContact CE1-CG 3.37Å; Y54-F84 HydrophobicContact CE2-CB 3.92Å; Y54-F84 HydrophobicContact CE2-CD1 4.41Å; Y54-F84 HydrophobicContact CE2-CG 4.41Å; Y54-F84 HydrophobicContact CG-CB 3.43Å; Y54-F84 VanDerWaalsContact CG-CB 3.43Å; Y54-F84 HydrophobicContact CG-CG 4.26Å; Y54-F84 AromaticContact CZ-CD1 3.7Å; Y54-F84 AromaticContact CZ-CG 3.8Å; A80-F84 WeakPolarHBondContact O-CD2 3.47Å; A80-F84 PolarHBondContact O-N 3.29Å; A81-F84 PolarHBondContact O-N 3.33Å; F84-N86 PolarHBondContact O-N 3.32Å
85	L	89.5	Confident	94.5	Very high	50 Å²	50	46.1 Å²	46.1	26%	0.262	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	3	170.8	-67.5	170.2	0	0	0	113.4	Y58 A81 L82 E83 R87	Y58-L85 HydrophobicContact CG-CD1 4.44Å; A81-L85 WeakPolarHBondContact O-CG 3.18Å; A81-L85 PolarHBondContact O-N 2.96Å; A81-L85 VanDerWaalsContact O-N 3.11Å; L82-L85 CarbonylContact O-C 3.28Å; L82-L85 PolarHBondContact O-N 2.85Å; E83-L85 PolarHBondContact O-N 3.46Å; L85-R87 HydrophobicContact CB-CG 4.23Å; L85-R87 PolarHBondContact O-N 3.02Å
86	N	88.4	Confident	94.5	Very high	105 Å²	105	49.1 Å²	49.1	56%	0.561	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.1	22.5	-174.8	-59	-64.6	0	0	0	114.9	L82 E83 F84 F88	L82-N86 PolarHBondContact O-N 2.68Å; E83-N86 PolarHBondContact O-N 2.63Å; F84-N86 PolarHBondContact O-N 3.32Å; N86-F88 VanDerWaalsContact C-N 3.3Å; N86-F88 HydrophobicContact CB-CE2 3.88Å; N86-F88 HydrophobicContact CB-CZ 3.86Å; N86-F88 WeakPolarHBondContact O-CD2 3.4Å; N86-F88 PolarHBondContact O-N 3.08Å; N86-F88 VanDerWaalsContact OD1-CZ 3.23Å; N86-F88 WeakPolarHBondContact OD1-CZ 3.38Å
87	R	92.1	Very high	94.5	Very high	72 Å²	72	52.3 Å²	52.3	27%	0.272	24%	0.239	S	C	.	.			trans	-91.8	58.9	178.5	-68.4	167.4	66	-170	-3	110.6	L82 L85 E89 E90 A91	L82-R87 HydrophobicContact CB-CB 4.32Å; L82-R87 HydrophobicContact CD2-CB 3.8Å; L82-R87 HydrophobicContact CD2-CG 4.47Å; L82-R87 VanDerWaalsContact CD2-CZ 3.45Å; L82-R87 PolarHBondContact O-N 3.48Å; L85-R87 HydrophobicContact CB-CG 4.23Å; L85-R87 PolarHBondContact O-N 3.02Å; R87-E89 PolarHBondContact O-N 3.04Å; R87-E90 HydrophobicContact CB-CB 4.4Å; R87-E90 IonicContact CZ-OE1 3.41Å; R87-E90 IonicContact CZ-OE2 2.75Å; R87-E90 IonicContact NE-OE1 3.72Å; R87-E90 PolarHBondContact NE-OE1 3.35Å; R87-E90 IonicContact NE-OE2 2.72Å; R87-E90 VanDerWaalsContact NH2-CD 3.27Å; R87-E90 IonicContact NH2-OE1 2.91Å; R87-E90 PolarHBondContact NH2-OE1 3.01Å; R87-E90 IonicContact NH2-OE2 2.74Å; R87-E90 PolarHBondContact NH2-OE2 3.44Å; R87-E90 PolarHBondContact O-N 2.93Å; R87-A91 PolarHBondContact O-N 3.38Å
88	F	88.9	Confident	94.4	Very high	21 Å²	21	48.8 Å²	48.8	9%	0.092	23%	0.225	C	C	.	.	H	α-helix	trans	-63.5	-38.2	-166.9	-56.6	-58.7	0	0	0	115.3	E83 N86 E90 A91 K92 M115 L119	E83-F88 WeakPolarHBondContact O-CE1 3.47Å; N86-F88 VanDerWaalsContact C-N 3.3Å; N86-F88 HydrophobicContact CB-CE2 3.88Å; N86-F88 HydrophobicContact CB-CZ 3.86Å; N86-F88 WeakPolarHBondContact O-CD2 3.4Å; N86-F88 PolarHBondContact O-N 3.08Å; N86-F88 VanDerWaalsContact OD1-CZ 3.23Å; N86-F88 WeakPolarHBondContact OD1-CZ 3.38Å; F88-E90 VanDerWaalsContact C-N 3.29Å; F88-E90 PolarHBondContact O-N 3.35Å; F88-A91 PolarHBondContact O-N 3.44Å; F88-K92 PolarHBondContact O-N 3.16Å; F88-M115 HydrophobicContact CD1-SD 4.14Å; F88-L119 HydrophobicContact CB-CD2 3.85Å; F88-L119 HydrophobicContact CB-CG 4.39Å
89	E	91.2	Very high	94.3	Very high	94 Å²	94	48.5 Å²	48.5	44%	0.439	23%	0.225	S	C	.	.	H	α-helix	trans	-65.8	-36.1	177.1	-71.1	-68	174.6	0	0	111.5	R87 R93 L119	R87-E89 PolarHBondContact O-N 3.04Å; E89-R93 WeakPolarHBondContact O-CG 3.4Å; E89-R93 PolarHBondContact O-N 3.19Å; E89-R93 VanDerWaalsContact O-N 3.08Å; E89-L119 HydrophobicContact CG-CD2 4.24Å
90	E	94.5	Very high	94.2	Very high	77 Å²	77	56.2 Å²	56.2	36%	0.36	26%	0.259	S	S	.	.	H	α-helix	trans	-72.8	-36.4	175.5	-61.4	-178.6	-98.2	0	0	111.5	L82 R87 F88 R93 T94	L82-E90 HydrophobicContact CD1-CB 3.98Å; L82-E90 HydrophobicContact CD2-CB 4.13Å; R87-E90 HydrophobicContact CB-CB 4.4Å; R87-E90 IonicContact CZ-OE1 3.41Å; R87-E90 IonicContact CZ-OE2 2.75Å; R87-E90 IonicContact NE-OE1 3.72Å; R87-E90 PolarHBondContact NE-OE1 3.35Å; R87-E90 IonicContact NE-OE2 2.72Å; R87-E90 VanDerWaalsContact NH2-CD 3.27Å; R87-E90 IonicContact NH2-OE1 2.91Å; R87-E90 PolarHBondContact NH2-OE1 3.01Å; R87-E90 IonicContact NH2-OE2 2.74Å; R87-E90 PolarHBondContact NH2-OE2 3.44Å; R87-E90 PolarHBondContact O-N 2.93Å; F88-E90 VanDerWaalsContact C-N 3.29Å; F88-E90 PolarHBondContact O-N 3.35Å; E90-R93 PolarHBondContact O-N 3.27Å; E90-T94 WeakPolarHBondContact O-CB 3.4Å; E90-T94 PolarHBondContact O-N 2.81Å; E90-T94 PolarHBondContact O-OG1 2.84Å
91	A	95.6	Very high	94.1	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-61.3	-46.3	172.3	0	0	0	0	0	111	L82 E83 R87 F88 R93 T94 Y95 M115	L82-A91 HydrophobicContact CB-CB 3.86Å; E83-A91 HydrophobicContact CG-CB 3.91Å; R87-A91 PolarHBondContact O-N 3.38Å; F88-A91 PolarHBondContact O-N 3.44Å; A91-R93 PolarHBondContact O-N 3.48Å; A91-T94 WeakPolarHBondContact O-CB 3.43Å; A91-T94 PolarHBondContact O-N 2.86Å; A91-Y95 VanDerWaalsContact O-CD2 3.23Å; A91-Y95 WeakPolarHBondContact O-CD2 3.46Å; A91-Y95 PolarHBondContact O-N 3.36Å; A91-M115 HydrophobicContact CB-CG 4.36Å; A91-M115 HydrophobicContact CB-SD 4.16Å
92	K	96.1	Very high	94	Very high	46 Å²	46	62.2 Å²	62.2	20%	0.2	28%	0.281	C	S	.	.	H	α-helix	trans	-54.7	-53.9	174.6	176.8	174	174.7	159.8	0	111.4	F88 T94 Y95 E96 L112 M115 E116 L119	F88-K92 PolarHBondContact O-N 3.16Å; K92-T94 VanDerWaalsContact C-N 3.26Å; K92-T94 PolarHBondContact O-N 2.93Å; K92-Y95 PolarHBondContact O-N 3.45Å; K92-Y95 VanDerWaalsContact O-N 3.12Å; K92-E96 WeakPolarHBondContact CE-OE1 3.44Å; K92-E96 IonicContact NZ-OE1 3.37Å; K92-E96 WeakPolarHBondContact O-CG 3.28Å; K92-E96 PolarHBondContact O-N 3.34Å; K92-L112 HydrophobicContact CD-CD1 4.46Å; K92-L112 HydrophobicContact CG-CD1 3.72Å; K92-M115 HydrophobicContact CB-CB 4.25Å; K92-E116 HydrophobicContact CD-CG 4.23Å; K92-E116 WeakPolarHBondContact CE-OE1 3.16Å; K92-E116 IonicContact NZ-OE1 3.71Å; K92-E116 PolarHBondContact NZ-OE1 3.36Å; K92-L119 HydrophobicContact CB-CD1 4.1Å; K92-L119 HydrophobicContact CD-CD1 3.86Å
93	R	97	Very high	93.8	Very high	159 Å²	159	65 Å²	65	60%	0.6	31%	0.305	S	S	*	.	H	α-helix	trans	-58.6	-38.8	178.5	-70.8	176.4	-170.4	-178.5	2.7	112.1	E89 E90 A91 Y95 E96 E97	E89-R93 WeakPolarHBondContact O-CG 3.4Å; E89-R93 PolarHBondContact O-N 3.19Å; E89-R93 VanDerWaalsContact O-N 3.08Å; E90-R93 PolarHBondContact O-N 3.27Å; A91-R93 PolarHBondContact O-N 3.48Å; R93-Y95 VanDerWaalsContact C-N 3.34Å; R93-Y95 PolarHBondContact O-N 3.38Å; R93-E96 PolarHBondContact O-N 3.34Å; R93-E97 WeakPolarHBondContact O-CB 3.49Å; R93-E97 WeakPolarHBondContact O-CG 3.34Å; R93-E97 PolarHBondContact O-N 3.28Å
94	T	97.1	Very high	93.6	Very high	5 Å²	5	69.6 Å²	69.6	3%	0.031	33%	0.33	C	S	.	.	H	α-helix	trans	-63.7	-39.4	177.7	-58.2	0	0	0	0	111.7	Y75 K78 A79 L82 E90 A91 K92 G98	Y75-T94 HydrophobicContact CD1-CG2 4.08Å; Y75-T94 WeakPolarHBondContact CD1-O 3.48Å; K78-T94 HydrophobicContact CB-CG2 3.97Å; K78-T94 HydrophobicContact CD-CG2 3.81Å; K78-T94 HydrophobicContact CG-CG2 3.9Å; A79-T94 HydrophobicContact CB-CG2 3.93Å; L82-T94 WeakPolarHBondContact CD1-OG1 3.22Å; E90-T94 WeakPolarHBondContact O-CB 3.4Å; E90-T94 PolarHBondContact O-N 2.81Å; E90-T94 PolarHBondContact O-OG1 2.84Å; A91-T94 WeakPolarHBondContact O-CB 3.43Å; A91-T94 PolarHBondContact O-N 2.86Å; K92-T94 VanDerWaalsContact C-N 3.26Å; K92-T94 PolarHBondContact O-N 2.93Å; T94-G98 PolarHBondContact O-N 2.76Å
95	Y	97.3	Very high	93.7	Very high	11 Å²	11	65.6 Å²	65.6	4%	0.043	31%	0.314	C	S	.	.	H	α-helix	trans	-66.1	-43.3	173.6	-75.8	-60.3	0	0	0	112.3	A79 E83 A91 K92 R93 E97 G98 L99 L108 M115	A79-Y95 HydrophobicContact CB-CD1 4.08Å; A79-Y95 HydrophobicContact CB-CD2 3.84Å; A79-Y95 HydrophobicContact CB-CE1 3.71Å; A79-Y95 HydrophobicContact CB-CE2 3.45Å; A79-Y95 VanDerWaalsContact CB-CE2 3.45Å; A79-Y95 HydrophobicContact CB-CG 4.12Å; E83-Y95 WeakPolarHBondContact OE1-CE2 3.43Å; E83-Y95 PolarHBondContact OE1-OH 2.97Å; A91-Y95 VanDerWaalsContact O-CD2 3.23Å; A91-Y95 WeakPolarHBondContact O-CD2 3.46Å; A91-Y95 PolarHBondContact O-N 3.36Å; K92-Y95 PolarHBondContact O-N 3.45Å; K92-Y95 VanDerWaalsContact O-N 3.12Å; R93-Y95 VanDerWaalsContact C-N 3.34Å; R93-Y95 PolarHBondContact O-N 3.38Å; Y95-E97 PolarHBondContact O-N 2.88Å; Y95-G98 PolarHBondContact O-N 3.37Å; Y95-L99 WeakPolarHBondContact O-CG 3.17Å; Y95-L99 PolarHBondContact O-N 3.16Å; Y95-L108 HydrophobicContact CD1-CB 4.39Å; Y95-L108 HydrophobicContact CD1-CD2 3.63Å; Y95-L108 HydrophobicContact CE1-CD2 4.03Å; Y95-M115 HydrophobicContact CD2-CG 3.96Å; Y95-M115 HydrophobicContact CE2-CG 3.88Å
96	E	97	Very high	93.8	Very high	74 Å²	74	67.9 Å²	67.9	35%	0.346	33%	0.332	S	S	.	.	H	α-helix	trans	-60.6	-43.2	175.8	-68.5	172.6	163.1	0	0	111.8	K92 R93 L99 K100 L112	K92-E96 WeakPolarHBondContact CE-OE1 3.44Å; K92-E96 IonicContact NZ-OE1 3.37Å; K92-E96 WeakPolarHBondContact O-CG 3.28Å; K92-E96 PolarHBondContact O-N 3.34Å; R93-E96 PolarHBondContact O-N 3.34Å; E96-L99 PolarHBondContact O-N 3.04Å; E96-K100 PolarHBondContact O-N 3.13Å; E96-L112 HydrophobicContact CG-CD1 3.84Å; E96-L112 HydrophobicContact CG-CD2 4.11Å
97	E	95.7	Very high	93.8	Very high	85 Å²	85	68 Å²	68	40%	0.397	33%	0.329	S	S	.	.	H	α-helix	trans	-60.9	-47.4	174.5	-75.4	178.6	167.4	0	0	111.8	Y75 R93 Y95 L99 K100 H101	Y75-E97 HydrophobicContact CD1-CB 4.23Å; Y75-E97 HydrophobicContact CE1-CB 3.93Å; R93-E97 WeakPolarHBondContact O-CB 3.49Å; R93-E97 WeakPolarHBondContact O-CG 3.34Å; R93-E97 PolarHBondContact O-N 3.28Å; Y95-E97 PolarHBondContact O-N 2.88Å; E97-L99 VanDerWaalsContact C-N 3.27Å; E97-L99 PolarHBondContact O-N 3.5Å; E97-K100 WeakPolarHBondContact O-CB 3.31Å; E97-K100 PolarHBondContact O-N 3.33Å; E97-H101 PolarHBondContact O-CD2 3.27Å
98	G	95.6	Very high	93.9	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-59.5	-37.5	176.6	0	0	0	0	0	113	Y75 T94 Y95 K100 H101 E102 L108	Y75-G98 VanDerWaalsContact CG-CA 3.43Å; T94-G98 PolarHBondContact O-N 2.76Å; Y95-G98 PolarHBondContact O-N 3.37Å; G98-K100 VanDerWaalsContact C-N 3.28Å; G98-K100 PolarHBondContact O-N 2.88Å; G98-H101 PolarHBondContact O-N 3.46Å; G98-H101 VanDerWaalsContact O-N 3.12Å; G98-E102 PolarHBondContact O-N 3.37Å; G98-L108 VanDerWaalsContact C-CD1 3.46Å
99	L	96	Very high	94.2	Very high	30 Å²	30	68.2 Å²	68.2	16%	0.157	33%	0.332	C	S	.	.	H	α-helix	trans	-70.4	-20.1	177.1	-73.2	168.8	0	0	0	113.4	Y95 E96 E97 H101 E102 A103 L108 K109 L112	Y95-L99 WeakPolarHBondContact O-CG 3.17Å; Y95-L99 PolarHBondContact O-N 3.16Å; E96-L99 PolarHBondContact O-N 3.04Å; E97-L99 VanDerWaalsContact C-N 3.27Å; E97-L99 PolarHBondContact O-N 3.5Å; L99-H101 PolarHBondContact O-N 3.27Å; L99-E102 CarbonylContact O-C 3.6Å; L99-A103 WeakPolarHBondContact O-CA 3.06Å; L99-A103 PolarHBondContact O-N 2.92Å; L99-A103 VanDerWaalsContact O-N 3.13Å; L99-L108 HydrophobicContact CD2-CB 3.65Å; L99-L108 HydrophobicContact CD2-CD1 4.39Å; L99-L108 HydrophobicContact CG-CB 3.83Å; L99-L108 HydrophobicContact CG-CD1 4.44Å; L99-K109 HydrophobicContact CD1-CG 4.48Å; L99-K109 HydrophobicContact CD2-CG 3.79Å; L99-L112 HydrophobicContact CD1-CB 4.36Å; L99-L112 HydrophobicContact CD1-CD2 3.62Å
100	K	95.4	Very high	94.3	Very high	162 Å²	162	68.6 Å²	68.6	70%	0.704	33%	0.334	S	S	*	.	H	α-helix	trans	-66.6	-30.8	169.6	-65.8	172.4	-174.4	171.6	0	111.6	E96 E97 G98	E96-K100 PolarHBondContact O-N 3.13Å; E97-K100 WeakPolarHBondContact O-CB 3.31Å; E97-K100 PolarHBondContact O-N 3.33Å; G98-K100 VanDerWaalsContact C-N 3.28Å; G98-K100 PolarHBondContact O-N 2.88Å
101	H	92.7	Very high	94.1	Very high	101 Å²	101	65.1 Å²	65.1	47%	0.468	32%	0.319	S	S	.	.	H	α-helix	trans	-89	-43.1	178.2	-63.4	-72.1	0	0	0	112.3	P69 Y75 E97 G98 L99	P69-H101 PolarHBondContact O-CD2 3.03Å; P69-H101 VanDerWaalsContact O-CD2 3.31Å; Y75-H101 AromaticContact CE2-CD2 3.96Å; Y75-H101 AromaticContact CZ-CD2 3.72Å; Y75-H101 PolarHBondContact OH-CD2 3.44Å; Y75-H101 VanDerWaalsContact OH-CD2 3.23Å; Y75-H101 PolarHBondContact OH-NE2 3.07Å; E97-H101 PolarHBondContact O-CD2 3.27Å; G98-H101 PolarHBondContact O-N 3.46Å; G98-H101 VanDerWaalsContact O-N 3.12Å; L99-H101 PolarHBondContact O-N 3.27Å
102	E	93.9	Very high	94.1	Very high	57 Å²	57	66.3 Å²	66.3	27%	0.266	33%	0.325	S	S	.	.			trans	-125.3	74.7	178.8	-65.7	-176.5	-175.4	0	0	111.5	G72 G98 L99 N104 N105	G72-E102 WeakPolarHBondContact CA-OE2 3.44Å; G72-E102 PolarHBondContact N-OE1 2.94Å; G72-E102 PolarHBondContact N-OE2 3.26Å; G98-E102 PolarHBondContact O-N 3.37Å; L99-E102 CarbonylContact O-C 3.6Å; E102-N104 PolarHBondContact O-N 3.21Å; E102-N105 HydrophobicContact CB-CB 3.87Å; E102-N105 WeakPolarHBondContact O-CB 3.44Å; E102-N105 PolarHBondContact O-N 3.04Å; E102-N105 PolarHBondContact OE2-ND2 3.43Å
103	A	91.1	Very high	93.9	Very high	61 Å²	61	70.5 Å²	70.5	50%	0.504	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-21.3	-174.2	0	0	0	0	0	115.1	L99 K109	L99-A103 WeakPolarHBondContact O-CA 3.06Å; L99-A103 PolarHBondContact O-N 2.92Å; L99-A103 VanDerWaalsContact O-N 3.13Å; A103-K109 WeakPolarHBondContact O-CE 3.44Å; A103-K109 PolarHBondContact O-NZ 2.81Å; A103-K109 VanDerWaalsContact O-NZ 3.12Å
104	N	90.8	Very high	93.4	Very high	139 Å²	139	67 Å²	67	74%	0.743	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.8	10.6	179.8	-72.2	-33	0	0	0	114.3	E102 P106 K109	E102-N104 PolarHBondContact O-N 3.21Å; N104-P106 WeakPolarHBondContact O-CD 3.35Å; N104-K109 PolarHBondContact OD1-NZ 3.15Å
105	N	92	Very high	93	Very high	28 Å²	28	67 Å²	67	15%	0.15	34%	0.338	C	S	.	.			trans	-68.8	117	178	-173.2	-52.4	0	0	0	111	E102 Q107 L108 K109	E102-N105 HydrophobicContact CB-CB 3.87Å; E102-N105 WeakPolarHBondContact O-CB 3.44Å; E102-N105 PolarHBondContact O-N 3.04Å; E102-N105 PolarHBondContact OE2-ND2 3.43Å; N105-Q107 PolarHBondContact O-N 3.06Å; N105-Q107 WeakPolarHBondContact OD1-CA 3.31Å; N105-Q107 VanDerWaalsContact OD1-CB 3.31Å; N105-Q107 WeakPolarHBondContact OD1-CB 3.43Å; N105-Q107 PolarHBondContact OD1-N 3.17Å; N105-L108 HydrophobicContact CB-CB 4.19Å; N105-L108 HydrophobicContact CB-CD1 3.93Å; N105-L108 HydrophobicContact CB-CG 4.07Å; N105-L108 PolarHBondContact O-N 3.06Å; N105-L108 PolarHBondContact OD1-N 3.39Å; N105-L108 VanDerWaalsContact OD1-N 3.15Å; N105-K109 WeakPolarHBondContact O-CG 3.35Å; N105-K109 PolarHBondContact O-N 3.03Å
106	P	91.4	Very high	92.4	Very high	99 Å²	99	70.4 Å²	70.4	64%	0.643	36%	0.355	S	S	*	.	H	α-helix	trans	-66.8	-36.2	-176.8	26.3	-33.6	0	0	0	112.6	N104 L108 K109 E110	N104-P106 WeakPolarHBondContact O-CD 3.35Å; P106-L108 VanDerWaalsContact C-N 3.35Å; P106-L108 PolarHBondContact O-N 2.91Å; P106-K109 PolarHBondContact O-N 3.43Å; P106-E110 WeakPolarHBondContact O-CB 3.3Å; P106-E110 PolarHBondContact O-N 3.03Å
107	Q	89	Confident	91.5	Very high	106 Å²	106	69.2 Å²	69.2	50%	0.495	36%	0.357	S	S	.	.	H	α-helix	trans	-65.4	-39.4	-178.9	-171.4	65.4	66.2	0	0	111.7	N105 G111	N105-Q107 PolarHBondContact O-N 3.06Å; N105-Q107 WeakPolarHBondContact OD1-CA 3.31Å; N105-Q107 VanDerWaalsContact OD1-CB 3.31Å; N105-Q107 WeakPolarHBondContact OD1-CB 3.43Å; N105-Q107 PolarHBondContact OD1-N 3.17Å; Q107-G111 PolarHBondContact O-N 3.36Å
108	L	94.1	Very high	90.6	Very high	0 Å²	0	70.2 Å²	70.2	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-71.4	-39.2	177	-65.3	179.6	0	0	0	111.8	S76 Y95 G98 L99 N105 P106 G111 L112	S76-L108 WeakPolarHBondContact OG-CD2 3.37Å; Y95-L108 HydrophobicContact CD1-CB 4.39Å; Y95-L108 HydrophobicContact CD1-CD2 3.63Å; Y95-L108 HydrophobicContact CE1-CD2 4.03Å; G98-L108 VanDerWaalsContact C-CD1 3.46Å; L99-L108 HydrophobicContact CD2-CB 3.65Å; L99-L108 HydrophobicContact CD2-CD1 4.39Å; L99-L108 HydrophobicContact CG-CB 3.83Å; L99-L108 HydrophobicContact CG-CD1 4.44Å; N105-L108 HydrophobicContact CB-CB 4.19Å; N105-L108 HydrophobicContact CB-CD1 3.93Å; N105-L108 HydrophobicContact CB-CG 4.07Å; N105-L108 PolarHBondContact O-N 3.06Å; N105-L108 PolarHBondContact OD1-N 3.39Å; N105-L108 VanDerWaalsContact OD1-N 3.15Å; P106-L108 VanDerWaalsContact C-N 3.35Å; P106-L108 PolarHBondContact O-N 2.91Å; L108-G111 PolarHBondContact O-N 3.07Å; L108-L112 WeakPolarHBondContact O-CB 3.48Å; L108-L112 PolarHBondContact O-N 3.34Å
109	K	95.6	Very high	89.8	Confident	98 Å²	98	70.9 Å²	70.9	43%	0.426	36%	0.361	S	S	.	.	H	α-helix	trans	-62.6	-45.9	175.5	-73.2	-177.3	-178.1	176.6	0	111.8	L99 A103 N104 N105 P106 L112 Q113	L99-K109 HydrophobicContact CD1-CG 4.48Å; L99-K109 HydrophobicContact CD2-CG 3.79Å; A103-K109 WeakPolarHBondContact O-CE 3.44Å; A103-K109 PolarHBondContact O-NZ 2.81Å; A103-K109 VanDerWaalsContact O-NZ 3.12Å; N104-K109 PolarHBondContact OD1-NZ 3.15Å; N105-K109 WeakPolarHBondContact O-CG 3.35Å; N105-K109 PolarHBondContact O-N 3.03Å; P106-K109 PolarHBondContact O-N 3.43Å; K109-L112 PolarHBondContact O-N 3.47Å; K109-Q113 WeakPolarHBondContact O-CB 3.49Å; K109-Q113 PolarHBondContact O-N 3.45Å
110	E	92.9	Very high	88.4	Confident	103 Å²	103	71.5 Å²	71.5	48%	0.481	37%	0.37	S	S	.	.	H	α-helix	trans	-63.9	-45.5	177.2	-174	-177	-178	0	0	111.4	P106 L112 Q113 N114	P106-E110 WeakPolarHBondContact O-CB 3.3Å; P106-E110 PolarHBondContact O-N 3.03Å; E110-L112 PolarHBondContact O-N 2.9Å; E110-Q113 PolarHBondContact O-N 2.88Å; E110-N114 WeakPolarHBondContact O-CB 3.31Å; E110-N114 VanDerWaalsContact O-CG 3.28Å; E110-N114 PolarHBondContact O-N 2.69Å; E110-N114 PolarHBondContact O-ND2 3.48Å
111	G	90.6	Very high	86.6	Confident	4 Å²	4	70.3 Å²	70.3	4%	0.041	37%	0.367	C	S	.	.	H	α-helix	trans	-58.4	-46.1	175.6	0	0	0	0	0	112.7	Q107 L108 N114 M115	Q107-G111 PolarHBondContact O-N 3.36Å; L108-G111 PolarHBondContact O-N 3.07Å; G111-N114 PolarHBondContact O-N 2.88Å; G111-M115 WeakPolarHBondContact O-CG 3.3Å; G111-M115 PolarHBondContact O-N 2.89Å
112	L	94.9	Very high	84.9	Confident	25 Å²	25	72.9 Å²	72.9	13%	0.131	37%	0.373	C	S	.	.	H	α-helix	trans	-60	-49.1	175.6	-178.5	56.7	0	0	0	111.6	K92 E96 L99 L108 K109 E110 N114 M115 E116	K92-L112 HydrophobicContact CD-CD1 4.46Å; K92-L112 HydrophobicContact CG-CD1 3.72Å; E96-L112 HydrophobicContact CG-CD1 3.84Å; E96-L112 HydrophobicContact CG-CD2 4.11Å; L99-L112 HydrophobicContact CD1-CB 4.36Å; L99-L112 HydrophobicContact CD1-CD2 3.62Å; L108-L112 WeakPolarHBondContact O-CB 3.48Å; L108-L112 PolarHBondContact O-N 3.34Å; K109-L112 PolarHBondContact O-N 3.47Å; E110-L112 PolarHBondContact O-N 2.9Å; L112-N114 VanDerWaalsContact C-N 3.31Å; L112-N114 PolarHBondContact O-N 3.25Å; L112-M115 PolarHBondContact O-N 3.24Å; L112-M115 VanDerWaalsContact O-N 3.13Å; L112-E116 HydrophobicContact CD1-CG 4.14Å; L112-E116 HydrophobicContact CG-CG 4.41Å; L112-E116 WeakPolarHBondContact O-CG 3.49Å; L112-E116 PolarHBondContact O-N 3.15Å
113	Q	91.1	Very high	82.7	Confident	134 Å²	134	78 Å²	78	63%	0.626	39%	0.394	S	S	*	.	H	α-helix	trans	-59.3	-42.2	179.7	-174.8	179.4	-2	0	0	111.8	K109 E110 E116 A117	K109-Q113 WeakPolarHBondContact O-CB 3.49Å; K109-Q113 PolarHBondContact O-N 3.45Å; E110-Q113 PolarHBondContact O-N 2.88Å; Q113-E116 PolarHBondContact O-N 3.45Å; Q113-A117 WeakPolarHBondContact O-CB 3.15Å; Q113-A117 PolarHBondContact O-N 2.88Å
114	N	86.6	Confident	80.5	Confident	85 Å²	85	82.6 Å²	82.6	46%	0.455	40%	0.403	S	S	.	.	H	α-helix	trans	-63.8	-40.5	176.3	-72	-22.2	0	0	0	111.9	E110 G111 L112 R118	E110-N114 WeakPolarHBondContact O-CB 3.31Å; E110-N114 VanDerWaalsContact O-CG 3.28Å; E110-N114 PolarHBondContact O-N 2.69Å; E110-N114 PolarHBondContact O-ND2 3.48Å; G111-N114 PolarHBondContact O-N 2.88Å; L112-N114 VanDerWaalsContact C-N 3.31Å; L112-N114 PolarHBondContact O-N 3.25Å; N114-R118 VanDerWaalsContact O-CB 3.32Å; N114-R118 WeakPolarHBondContact O-CB 3.33Å; N114-R118 PolarHBondContact O-N 3.37Å
115	M	88.4	Confident	78.8	Confident	4 Å²	4	82.5 Å²	82.5	2%	0.02	40%	0.4	C	S	.	.	H	α-helix	trans	-67.4	-40.2	175.8	-70.7	-53.6	97.9	0	0	112.3	E83 F88 A91 K92 Y95 G111 L112 R118 L119	E83-M115 HydrophobicContact CG-CE 3.77Å; E83-M115 HydrophobicContact CG-SD 3.58Å; E83-M115 VanDerWaalsContact CG-SD 3.58Å; E83-M115 WeakPolarHBondContact OE2-CE 3.45Å; F88-M115 HydrophobicContact CD1-SD 4.14Å; A91-M115 HydrophobicContact CB-CG 4.36Å; A91-M115 HydrophobicContact CB-SD 4.16Å; K92-M115 HydrophobicContact CB-CB 4.25Å; Y95-M115 HydrophobicContact CD2-CG 3.96Å; Y95-M115 HydrophobicContact CE2-CG 3.88Å; G111-M115 WeakPolarHBondContact O-CG 3.3Å; G111-M115 PolarHBondContact O-N 2.89Å; L112-M115 PolarHBondContact O-N 3.24Å; L112-M115 VanDerWaalsContact O-N 3.13Å; M115-R118 PolarHBondContact O-N 2.99Å; M115-L119 WeakPolarHBondContact O-CB 3.44Å; M115-L119 VanDerWaalsContact O-CG 3.25Å; M115-L119 WeakPolarHBondContact O-CG 3.4Å; M115-L119 PolarHBondContact O-N 3.49Å
116	E	85.9	Confident	77.6	Confident	84 Å²	84	82.3 Å²	82.3	39%	0.393	40%	0.399	S	S	.	.	H	α-helix	trans	-64.1	-43.5	175.6	-71.4	-170.6	142.5	0	0	112.1	K92 L112 Q113 L119 A120	K92-E116 HydrophobicContact CD-CG 4.23Å; K92-E116 WeakPolarHBondContact CE-OE1 3.16Å; K92-E116 IonicContact NZ-OE1 3.71Å; K92-E116 PolarHBondContact NZ-OE1 3.36Å; L112-E116 HydrophobicContact CD1-CG 4.14Å; L112-E116 HydrophobicContact CG-CG 4.41Å; L112-E116 WeakPolarHBondContact O-CG 3.49Å; L112-E116 PolarHBondContact O-N 3.15Å; Q113-E116 PolarHBondContact O-N 3.45Å; E116-L119 PolarHBondContact O-N 3.09Å; E116-A120 WeakPolarHBondContact O-CB 3.35Å; E116-A120 PolarHBondContact O-N 2.88Å
117	A	77.6	Confident	76.7	Confident	49 Å²	49	78.6 Å²	78.6	41%	0.405	38%	0.375	S	S	.	.	H	α-helix	trans	-60.5	-47	174	0	0	0	0	0	111.3	Q113 L119 A120 E121	Q113-A117 WeakPolarHBondContact O-CB 3.15Å; Q113-A117 PolarHBondContact O-N 2.88Å; A117-L119 PolarHBondContact O-N 3.39Å; A117-A120 WeakPolarHBondContact O-CB 3.45Å; A117-A120 PolarHBondContact O-N 3.49Å; A117-E121 WeakPolarHBondContact O-CG 3.42Å; A117-E121 PolarHBondContact O-N 2.91Å
118	R	77.9	Confident	76.4	Confident	105 Å²	105	73.6 Å²	73.6	40%	0.396	35%	0.352	S	S	.	.	H	α-helix	trans	-64.8	-38.5	179.6	-168.8	173.3	-171.9	171.5	-0.1	113	N114 M115 R122	N114-R118 VanDerWaalsContact O-CB 3.32Å; N114-R118 WeakPolarHBondContact O-CB 3.33Å; N114-R118 PolarHBondContact O-N 3.37Å; M115-R118 PolarHBondContact O-N 2.99Å; R118-R122 PolarHBondContact O-N 3.12Å; R118-R122 VanDerWaalsContact O-N 3.1Å
119	L	77.4	Confident	75.7	Confident	14 Å²	14	78.7 Å²	78.7	7%	0.073	38%	0.379	C	S	.	.	H	α-helix	trans	-73.4	-33	175.1	-70.7	169.8	0	0	0	111.7	F88 E89 K92 M115 E116 A117 R122 K123	F88-L119 HydrophobicContact CB-CD2 3.85Å; F88-L119 HydrophobicContact CB-CG 4.39Å; E89-L119 HydrophobicContact CG-CD2 4.24Å; K92-L119 HydrophobicContact CB-CD1 4.1Å; K92-L119 HydrophobicContact CD-CD1 3.86Å; M115-L119 WeakPolarHBondContact O-CB 3.44Å; M115-L119 VanDerWaalsContact O-CG 3.25Å; M115-L119 WeakPolarHBondContact O-CG 3.4Å; M115-L119 PolarHBondContact O-N 3.49Å; E116-L119 PolarHBondContact O-N 3.09Å; A117-L119 PolarHBondContact O-N 3.39Å; L119-R122 PolarHBondContact O-N 3.26Å; L119-K123 WeakPolarHBondContact O-CG 3.48Å; L119-K123 PolarHBondContact O-N 3.37Å
120	A	66.8	Low	74.8	Confident	43 Å²	43	76.6 Å²	76.6	36%	0.355	37%	0.371	S	S	.	.	H	α-helix	trans	-66	-46.1	172.2	0	0	0	0	0	111.2	E116 A117 R122 K123 F124	E116-A120 WeakPolarHBondContact O-CB 3.35Å; E116-A120 PolarHBondContact O-N 2.88Å; A117-A120 WeakPolarHBondContact O-CB 3.45Å; A117-A120 PolarHBondContact O-N 3.49Å; A120-R122 PolarHBondContact O-N 2.85Å; A120-K123 CarbonylContact O-C 3.57Å; A120-K123 WeakPolarHBondContact O-CA 3.33Å; A120-K123 WeakPolarHBondContact O-CB 3.25Å; A120-K123 PolarHBondContact O-N 3.27Å; A120-F124 WeakPolarHBondContact O-CD2 3.34Å; A120-F124 PolarHBondContact O-N 3.09Å
121	E	58.1	Low	73.9	Confident	138 Å²	138	77.8 Å²	77.8	65%	0.645	39%	0.388	S	S	*	.	H	α-helix	trans	-55.6	-39.9	171.8	-76.2	178.4	179.1	0	0	111.7	A117 F124	A117-E121 WeakPolarHBondContact O-CG 3.42Å; A117-E121 PolarHBondContact O-N 2.91Å; E121-F124 WeakPolarHBondContact O-CB 3.39Å; E121-F124 PolarHBondContact O-N 3.36Å
122	R	56.3	Low	73.5	Confident	155 Å²	155	82 Å²	82	59%	0.585	41%	0.409	S	S	*	.	H	α-helix	trans	-68.3	-35.1	175.4	-161.3	177.7	-176.3	-179.8	1.7	112.7	R118 L119 A120 M125	R118-R122 PolarHBondContact O-N 3.12Å; R118-R122 VanDerWaalsContact O-N 3.1Å; L119-R122 PolarHBondContact O-N 3.26Å; A120-R122 PolarHBondContact O-N 2.85Å; R122-M125 HydrophobicContact CG-CE 3.89Å; R122-M125 PolarHBondContact O-N 3.21Å
123	K	48.8	Very low	73.1	Confident	164 Å²	164	80.8 Å²	80.8	71%	0.713	40%	0.403	S	S	*	.	H	α-helix	trans	-71	-30	172.4	-77.6	-179.8	179.2	178.9	0	112.5	L119 A120 M125 N126	L119-K123 WeakPolarHBondContact O-CG 3.48Å; L119-K123 PolarHBondContact O-N 3.37Å; A120-K123 CarbonylContact O-C 3.57Å; A120-K123 WeakPolarHBondContact O-CA 3.33Å; A120-K123 WeakPolarHBondContact O-CB 3.25Å; A120-K123 PolarHBondContact O-N 3.27Å; K123-M125 PolarHBondContact O-N 3.13Å; K123-N126 PolarHBondContact O-N 3.31Å
124	F	44.3	Very low	73	Confident	157 Å²	157	77.5 Å²	77.5	69%	0.689	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-12.3	173.1	-99.7	-86.6	0	0	0	113.6	A120 E121 N126	A120-F124 WeakPolarHBondContact O-CD2 3.34Å; A120-F124 PolarHBondContact O-N 3.09Å; E121-F124 WeakPolarHBondContact O-CB 3.39Å; E121-F124 PolarHBondContact O-N 3.36Å; F124-N126 VanDerWaalsContact C-N 3.26Å; F124-N126 PolarHBondContact O-N 3.13Å
125	M	55.2	Low	73.1	Confident	138 Å²	138	79.6 Å²	79.6	68%	0.68	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-1.9	175.6	-69.3	-159.4	-72.1	0	0	114.8	R122 K123	R122-M125 HydrophobicContact CG-CE 3.89Å; R122-M125 PolarHBondContact O-N 3.21Å; K123-M125 PolarHBondContact O-N 3.13Å
126	N	66.6	Low	72.9	Confident	23 Å²	23	82.9 Å²	82.9	12%	0.123	41%	0.407	C	S	.	.			trans	-139.4	89.3	168	-169.2	-2.2	0	0	0	112.9	K123 F124 F128 N129 L159 R160 P163	K123-N126 PolarHBondContact O-N 3.31Å; F124-N126 VanDerWaalsContact C-N 3.26Å; F124-N126 PolarHBondContact O-N 3.13Å; N126-F128 PolarHBondContact O-N 3.38Å; N126-F128 VanDerWaalsContact O-N 3.1Å; N126-F128 WeakPolarHBondContact OD1-CB 3.48Å; N126-F128 PolarHBondContact OD1-N 2.88Å; N126-N129 HydrophobicContact CB-CB 4.29Å; N126-N129 PolarHBondContact O-N 2.94Å; N126-L159 PolarHBondContact ND2-O 2.92Å; N126-R160 PolarHBondContact ND2-O 3.36Å; N126-P163 HydrophobicContact CB-CB 3.87Å; N126-P163 HydrophobicContact CB-CG 4.16Å; N126-P163 WeakPolarHBondContact ND2-CB 3.49Å; N126-P163 VanDerWaalsContact ND2-CG 3.33Å; N126-P163 WeakPolarHBondContact ND2-CG 3.24Å
127	P	73	Confident	73.2	Confident	22 Å²	22	78.9 Å²	78.9	14%	0.143	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-62.8	-16.8	177.8	24.4	-31.5	0	0	0	113.5	L179 L182 L183	P127-L179 HydrophobicContact CB-CD2 4.41Å; P127-L179 HydrophobicContact CG-CD2 3.54Å; P127-L182 HydrophobicContact CB-CB 4.22Å; P127-L182 HydrophobicContact CB-CD1 4.4Å; P127-L183 HydrophobicContact CB-CD2 3.91Å; P127-L183 HydrophobicContact CB-CG 4.41Å; P127-L183 HydrophobicContact CG-CD2 4.45Å
128	F	83.1	Confident	73.9	Confident	1 Å²	1	81.5 Å²	81.5	0%	0.004	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-86	-7	-179.5	-55.5	-88.9	0	0	0	113.7	N126 L133 I156 L159 R160 L166 I175 T178 L179 L182	N126-F128 PolarHBondContact O-N 3.38Å; N126-F128 VanDerWaalsContact O-N 3.1Å; N126-F128 WeakPolarHBondContact OD1-CB 3.48Å; N126-F128 PolarHBondContact OD1-N 2.88Å; F128-L133 WeakPolarHBondContact O-CD2 3.39Å; F128-I156 HydrophobicContact CD1-CD1 3.97Å; F128-I156 HydrophobicContact CE1-CD1 3.83Å; F128-L159 HydrophobicContact CB-CB 4.28Å; F128-L159 HydrophobicContact CD1-CB 4.11Å; F128-L159 HydrophobicContact CD1-CD1 4.34Å; F128-L159 HydrophobicContact CD2-CB 3.89Å; F128-L159 HydrophobicContact CD2-CD1 4.47Å; F128-L159 HydrophobicContact CE1-CB 4.43Å; F128-L159 HydrophobicContact CE1-CD1 3.84Å; F128-L159 HydrophobicContact CE2-CB 4.25Å; F128-L159 HydrophobicContact CE2-CD1 4.01Å; F128-L159 HydrophobicContact CG-CB 3.83Å; F128-L159 HydrophobicContact CZ-CD1 3.67Å; F128-R160 HydrophobicContact CB-CB 4.37Å; F128-R160 PolarHBondContact O-NE 3.15Å; F128-R160 VanDerWaalsContact O-NE 3.11Å; F128-L166 HydrophobicContact CE2-CD1 3.59Å; F128-L166 HydrophobicContact CE2-CD2 4.23Å; F128-L166 HydrophobicContact CZ-CD1 3.96Å; F128-I175 HydrophobicContact CZ-CG2 4.46Å; F128-T178 HydrophobicContact CE1-CG2 3.87Å; F128-L179 HydrophobicContact CE2-CD2 3.58Å; F128-L179 HydrophobicContact CE2-CG 4.4Å; F128-L179 HydrophobicContact CZ-CD2 3.53Å; F128-L179 HydrophobicContact CZ-CG 3.92Å; F128-L182 HydrophobicContact CD1-CD1 3.71Å; F128-L182 HydrophobicContact CE1-CD1 3.84Å; F128-L182 HydrophobicContact CG-CD1 4.28Å; F128-L182 HydrophobicContact CZ-CD1 4.47Å
129	N	77.7	Confident	74.3	Confident	106 Å²	106	81 Å²	81	57%	0.567	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-106.1	26.7	-179.8	-160.1	18.6	0	0	0	113.5	N126 R160	N126-N129 HydrophobicContact CB-CB 4.29Å; N126-N129 PolarHBondContact O-N 2.94Å; N129-R160 HydrophobicContact CB-CG 4.47Å
130	M	77.1	Confident	74.9	Confident	55 Å²	55	81.9 Å²	81.9	27%	0.271	41%	0.409	S	S	.	.			trans	-80.3	143.8	175.9	66.2	-177.6	-64.1	0	0	111.9	N132 L133 K136 L182	M130-N132 VanDerWaalsContact C-N 3.27Å; M130-N132 PolarHBondContact O-N 3.29Å; M130-L133 HydrophobicContact CG-CB 3.9Å; M130-L133 HydrophobicContact CG-CD1 3.85Å; M130-L133 WeakPolarHBondContact O-CB 3.3Å; M130-L133 PolarHBondContact O-N 3.44Å; M130-L133 HydrophobicContact SD-CD1 4.37Å; M130-K136 HydrophobicContact CE-CD 3.8Å; M130-K136 HydrophobicContact SD-CD 4.13Å; M130-L182 HydrophobicContact SD-CD2 3.94Å
131	P	74	Confident	75.8	Confident	127 Å²	127	83.9 Å²	83.9	83%	0.825	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-35.6	-177.7	-27.2	34.5	0	0	0	114.5
132	N	83.3	Confident	77.2	Confident	93 Å²	93	82.3 Å²	82.3	50%	0.497	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	28.7	-176.1	-61.4	-8.1	0	0	0	112.7	M130 Y134 Q135 K136	M130-N132 VanDerWaalsContact C-N 3.27Å; M130-N132 PolarHBondContact O-N 3.29Å; N132-Y134 PolarHBondContact O-N 3.18Å; N132-Q135 PolarHBondContact O-N 2.92Å; N132-K136 PolarHBondContact O-N 2.92Å; N132-K136 VanDerWaalsContact O-N 3.07Å
133	L	85.8	Confident	78.7	Confident	0 Å²	0	74.9 Å²	74.9	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-51.2	-57.2	-173.4	-176.9	76.4	0	0	0	112.5	F128 M130 Q135 K136 L137 I156 R160 L182	F128-L133 WeakPolarHBondContact O-CD2 3.39Å; M130-L133 HydrophobicContact CG-CB 3.9Å; M130-L133 HydrophobicContact CG-CD1 3.85Å; M130-L133 WeakPolarHBondContact O-CB 3.3Å; M130-L133 PolarHBondContact O-N 3.44Å; M130-L133 HydrophobicContact SD-CD1 4.37Å; L133-Q135 PolarHBondContact O-N 2.87Å; L133-K136 PolarHBondContact O-N 3.49Å; L133-L137 HydrophobicContact CD1-CD1 4.48Å; L133-L137 HydrophobicContact CG-CD1 4.16Å; L133-L137 WeakPolarHBondContact O-CG 3.43Å; L133-L137 PolarHBondContact O-N 3.47Å; L133-I156 HydrophobicContact CD2-CG2 3.5Å; L133-I156 VanDerWaalsContact CD2-CG2 3.5Å; L133-R160 VanDerWaalsContact CB-NH2 3.29Å; L133-L182 HydrophobicContact CD1-CD1 3.63Å; L133-L182 HydrophobicContact CD1-CD2 3.41Å; L133-L182 VanDerWaalsContact CD1-CD2 3.41Å; L133-L182 HydrophobicContact CD1-CG 4.16Å; L133-L182 HydrophobicContact CG-CD2 4.47Å
134	Y	90	Very high	80.7	Confident	65 Å²	65	74.4 Å²	74.4	26%	0.255	37%	0.372	S	S	.	.	H	α-helix	trans	-68.6	-38	-174	-72	-68.4	0	0	0	112.3	N132 K136 L137 E138 L147 I156 E157	N132-Y134 PolarHBondContact O-N 3.18Å; Y134-K136 VanDerWaalsContact C-N 3.26Å; Y134-K136 PolarHBondContact O-N 2.88Å; Y134-L137 PolarHBondContact O-N 2.87Å; Y134-E138 WeakPolarHBondContact O-CB 3.26Å; Y134-E138 VanDerWaalsContact O-CG 3.27Å; Y134-E138 WeakPolarHBondContact O-CG 3.37Å; Y134-E138 PolarHBondContact O-N 3.18Å; Y134-L147 HydrophobicContact CD1-CD2 3.91Å; Y134-L147 HydrophobicContact CE1-CD2 4.1Å; Y134-I156 HydrophobicContact CE1-CG2 4.34Å; Y134-E157 WeakPolarHBondContact CE2-OE1 3.39Å; Y134-E157 PolarHBondContact OH-OE1 3.01Å
135	Q	87.5	Confident	82.7	Confident	128 Å²	128	71.1 Å²	71.1	60%	0.598	37%	0.365	S	S	*	.	H	α-helix	trans	-58	-40.5	173.8	-72.5	179.1	-18.4	0	0	111.9	N132 L133 E138 S139	N132-Q135 PolarHBondContact O-N 2.92Å; L133-Q135 PolarHBondContact O-N 2.87Å; Q135-E138 PolarHBondContact O-N 3.34Å; Q135-S139 WeakPolarHBondContact O-CB 3.46Å; Q135-S139 PolarHBondContact O-N 2.86Å; Q135-S139 VanDerWaalsContact O-N 3.09Å; Q135-S139 PolarHBondContact O-OG 3.39Å
136	K	85.4	Confident	84.4	Confident	74 Å²	74	66.4 Å²	66.4	32%	0.322	34%	0.343	S	S	.	.	H	α-helix	trans	-71.8	-35.7	179	-163	171.7	-175.7	-173.8	0	112.6	M130 N132 L133 Y134 S139 V181 L182	M130-K136 HydrophobicContact CE-CD 3.8Å; M130-K136 HydrophobicContact SD-CD 4.13Å; N132-K136 PolarHBondContact O-N 2.92Å; N132-K136 VanDerWaalsContact O-N 3.07Å; L133-K136 PolarHBondContact O-N 3.49Å; Y134-K136 VanDerWaalsContact C-N 3.26Å; Y134-K136 PolarHBondContact O-N 2.88Å; K136-S139 PolarHBondContact O-OG 3.41Å; K136-S139 VanDerWaalsContact O-OG 3.07Å; K136-V181 VanDerWaalsContact CE-O 3.24Å; K136-V181 WeakPolarHBondContact CE-O 3.48Å; K136-V181 HydrophobicContact CG-CG1 4.5Å; K136-L182 PolarHBondContact NZ-O 3.12Å
137	L	91.7	Very high	85.4	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-73.5	-30.7	175.2	-65.4	-179.8	0	0	0	112.7	L133 Y134 T143 R144 L147 T178 V181 L182	L133-L137 HydrophobicContact CD1-CD1 4.48Å; L133-L137 HydrophobicContact CG-CD1 4.16Å; L133-L137 WeakPolarHBondContact O-CG 3.43Å; L133-L137 PolarHBondContact O-N 3.47Å; Y134-L137 PolarHBondContact O-N 2.87Å; L137-T143 WeakPolarHBondContact CA-OG1 3.39Å; L137-T143 HydrophobicContact CD2-CG2 3.94Å; L137-T143 CarbonylContact O-C 3.45Å; L137-T143 WeakPolarHBondContact O-CB 3.4Å; L137-T143 PolarHBondContact O-OG1 2.9Å; L137-R144 PolarHBondContact O-N 2.87Å; L137-L147 HydrophobicContact CB-CD1 3.78Å; L137-L147 HydrophobicContact CB-CD2 4.4Å; L137-L147 HydrophobicContact CB-CG 4.33Å; L137-L147 HydrophobicContact CD1-CD2 4.41Å; L137-T178 HydrophobicContact CD1-CG2 4.14Å; L137-T178 HydrophobicContact CD2-CG2 3.59Å; L137-V181 HydrophobicContact CD2-CB 4.36Å; L137-V181 HydrophobicContact CD2-CG1 4.12Å; L137-L182 HydrophobicContact CD2-CD2 3.68Å; L137-L182 HydrophobicContact CD2-CG 4.01Å; L137-L182 HydrophobicContact CG-CD2 4.01Å
138	E	91.1	Very high	85.9	Confident	103 Å²	103	69.3 Å²	69.3	48%	0.481	37%	0.365	S	S	.	.	H	α-helix	trans	-74.6	-29.3	174.8	-74.5	176.6	178	0	0	112.5	Y134 Q135 R144 L147	Y134-E138 WeakPolarHBondContact O-CB 3.26Å; Y134-E138 VanDerWaalsContact O-CG 3.27Å; Y134-E138 WeakPolarHBondContact O-CG 3.37Å; Y134-E138 PolarHBondContact O-N 3.18Å; Q135-E138 PolarHBondContact O-N 3.34Å; E138-R144 WeakPolarHBondContact O-CD 3.47Å; E138-L147 HydrophobicContact CB-CD1 4.23Å; E138-L147 HydrophobicContact CG-CD1 3.36Å
139	S	87.9	Confident	86.2	Confident	95 Å²	95	71.8 Å²	71.8	66%	0.664	38%	0.378	S	S	*	.	H	α-helix	trans	-79.2	-19.5	-178.7	68.3	0	0	0	0	114.1	Q135 K136	Q135-S139 WeakPolarHBondContact O-CB 3.46Å; Q135-S139 PolarHBondContact O-N 2.86Å; Q135-S139 VanDerWaalsContact O-N 3.09Å; Q135-S139 PolarHBondContact O-OG 3.39Å; K136-S139 PolarHBondContact O-OG 3.41Å; K136-S139 VanDerWaalsContact O-OG 3.07Å
140	D	88.7	Confident	86.7	Confident	32 Å²	32	71.4 Å²	71.4	17%	0.171	38%	0.381	C	S	.	.	S	Bend	trans	-94	125.8	175.2	-172.7	-60.9	0	0	0	111.3	R142 T143 R144 V181	D140-R142 PolarHBondContact O-N 3.41Å; D140-R142 VanDerWaalsContact O-N 3.15Å; D140-R142 VanDerWaalsContact OD1-CB 3.23Å; D140-R142 WeakPolarHBondContact OD1-CB 3.42Å; D140-R142 WeakPolarHBondContact OD1-CG 3.43Å; D140-R142 PolarHBondContact OD1-N 3.24Å; D140-R142 IonicContact OD1-NE 3.93Å; D140-R142 PolarHBondContact OD1-NE 3.31Å; D140-R142 IonicContact OD2-CZ 3.45Å; D140-R142 IonicContact OD2-NE 2.81Å; D140-R142 PolarHBondContact OD2-NE 3.47Å; D140-R142 IonicContact OD2-NH2 3.49Å; D140-R142 PolarHBondContact OD2-NH2 2.68Å; D140-T143 PolarHBondContact O-N 3.38Å; D140-T143 PolarHBondContact O-OG1 3.18Å; D140-R144 VanDerWaalsContact O-CB 3.28Å; D140-R144 WeakPolarHBondContact O-CB 3.44Å; D140-R144 PolarHBondContact O-N 2.93Å; D140-V181 HydrophobicContact CB-CB 4.37Å; D140-V181 HydrophobicContact CB-CG1 3.59Å; D140-V181 HydrophobicContact CB-CG2 3.78Å; D140-V181 WeakPolarHBondContact OD2-CG2 3.45Å
141	P	86.3	Confident	87.4	Confident	85 Å²	85	72.4 Å²	72.4	55%	0.552	39%	0.391	S	S	*	.	H	α-helix	trans	-55.9	-30.6	-178.7	-26.4	34.3	0	0	0	115.1
142	R	87.1	Confident	88.2	Confident	105 Å²	105	66.4 Å²	66.4	40%	0.396	35%	0.351	S	S	.	.	H	α-helix	trans	-74.1	-36.4	-176.7	-58.2	173.9	-70.1	179.7	-3.2	112.1	D140 T145 T177 D186	D140-R142 PolarHBondContact O-N 3.41Å; D140-R142 VanDerWaalsContact O-N 3.15Å; D140-R142 VanDerWaalsContact OD1-CB 3.23Å; D140-R142 WeakPolarHBondContact OD1-CB 3.42Å; D140-R142 WeakPolarHBondContact OD1-CG 3.43Å; D140-R142 PolarHBondContact OD1-N 3.24Å; D140-R142 IonicContact OD1-NE 3.93Å; D140-R142 PolarHBondContact OD1-NE 3.31Å; D140-R142 IonicContact OD2-CZ 3.45Å; D140-R142 IonicContact OD2-NE 2.81Å; D140-R142 PolarHBondContact OD2-NE 3.47Å; D140-R142 IonicContact OD2-NH2 3.49Å; D140-R142 PolarHBondContact OD2-NH2 2.68Å; R142-T145 PolarHBondContact O-OG1 2.86Å; R142-T177 HydrophobicContact CB-CG2 3.7Å; R142-D186 IonicContact NH1-OD1 3.34Å; R142-D186 PolarHBondContact NH1-OD1 3.08Å; R142-D186 VanDerWaalsContact NH1-OD1 3.08Å
143	T	89.3	Confident	88.5	Confident	0 Å²	0	68 Å²	68	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-94.5	-22.7	-179.8	48.4	0	0	0	0	113	L137 D140 T145 L146 L147 T177 V181	L137-T143 WeakPolarHBondContact CA-OG1 3.39Å; L137-T143 HydrophobicContact CD2-CG2 3.94Å; L137-T143 CarbonylContact O-C 3.45Å; L137-T143 WeakPolarHBondContact O-CB 3.4Å; L137-T143 PolarHBondContact O-OG1 2.9Å; D140-T143 PolarHBondContact O-N 3.38Å; D140-T143 PolarHBondContact O-OG1 3.18Å; T143-T145 VanDerWaalsContact C-N 3.32Å; T143-T145 PolarHBondContact O-N 3.46Å; T143-L146 WeakPolarHBondContact O-CB 3.18Å; T143-L146 PolarHBondContact O-N 2.88Å; T143-L147 WeakPolarHBondContact O-CG 3.5Å; T143-L147 PolarHBondContact O-N 3Å; T143-L147 VanDerWaalsContact O-N 3.08Å; T143-T177 HydrophobicContact CG2-CG2 4.23Å; T143-V181 HydrophobicContact CG2-CB 4.1Å; T143-V181 HydrophobicContact CG2-CG2 3.61Å
144	R	90.3	Very high	88.7	Confident	153 Å²	153	73.8 Å²	73.8	58%	0.577	38%	0.377	S	S	*	.	H	α-helix	trans	-59.8	-39.9	178.3	-175.9	177.7	65.4	-177.2	-0.7	112.8	L137 E138 D140 L147	L137-R144 PolarHBondContact O-N 2.87Å; E138-R144 WeakPolarHBondContact O-CD 3.47Å; D140-R144 VanDerWaalsContact O-CB 3.28Å; D140-R144 WeakPolarHBondContact O-CB 3.44Å; D140-R144 PolarHBondContact O-N 2.93Å; R144-L147 PolarHBondContact O-N 3.21Å
145	T	86.4	Confident	88.6	Confident	89 Å²	89	71.1 Å²	71.1	55%	0.546	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-39.3	177	51	0	0	0	0	111.5	R142 T143 L147 S148	R142-T145 PolarHBondContact O-OG1 2.86Å; T143-T145 VanDerWaalsContact C-N 3.32Å; T143-T145 PolarHBondContact O-N 3.46Å; T145-L147 VanDerWaalsContact C-N 3.29Å; T145-L147 PolarHBondContact O-N 3.01Å; T145-S148 PolarHBondContact O-N 3.41Å; T145-S148 PolarHBondContact O-OG 3.1Å
146	L	89.7	Confident	88.8	Confident	39 Å²	39	65 Å²	65	20%	0.204	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-64.7	-32	177.9	-57.6	178.3	0	0	0	112.5	T143 S148 D149 Y152 R174	T143-L146 WeakPolarHBondContact O-CB 3.18Å; T143-L146 PolarHBondContact O-N 2.88Å; L146-S148 PolarHBondContact O-N 2.94Å; L146-S148 VanDerWaalsContact O-N 3.09Å; L146-D149 WeakPolarHBondContact O-CB 3.26Å; L146-D149 PolarHBondContact O-N 3.42Å; L146-Y152 HydrophobicContact CB-CD1 3.65Å; L146-Y152 HydrophobicContact CB-CD2 4.2Å; L146-Y152 HydrophobicContact CB-CE1 3.58Å; L146-Y152 HydrophobicContact CB-CE2 4.15Å; L146-Y152 HydrophobicContact CB-CG 3.95Å; L146-Y152 HydrophobicContact CD1-CE2 4.02Å; L146-Y152 WeakPolarHBondContact O-CD1 3.34Å; L146-R174 HydrophobicContact CD1-CB 4.05Å; L146-R174 HydrophobicContact CD1-CG 4.18Å; L146-R174 HydrophobicContact CD2-CG 4.09Å
147	L	88.1	Confident	88.9	Confident	7 Å²	7	64.5 Å²	64.5	4%	0.037	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-64.7	-10.8	177.5	-75.1	173.9	0	0	0	114.4	Y134 L137 E138 T143 R144 T145 D149 Y152 R153	Y134-L147 HydrophobicContact CD1-CD2 3.91Å; Y134-L147 HydrophobicContact CE1-CD2 4.1Å; L137-L147 HydrophobicContact CB-CD1 3.78Å; L137-L147 HydrophobicContact CB-CD2 4.4Å; L137-L147 HydrophobicContact CB-CG 4.33Å; L137-L147 HydrophobicContact CD1-CD2 4.41Å; E138-L147 HydrophobicContact CB-CD1 4.23Å; E138-L147 HydrophobicContact CG-CD1 3.36Å; T143-L147 WeakPolarHBondContact O-CG 3.5Å; T143-L147 PolarHBondContact O-N 3Å; T143-L147 VanDerWaalsContact O-N 3.08Å; R144-L147 PolarHBondContact O-N 3.21Å; T145-L147 VanDerWaalsContact C-N 3.29Å; T145-L147 PolarHBondContact O-N 3.01Å; L147-D149 VanDerWaalsContact C-N 3.35Å; L147-Y152 HydrophobicContact CD2-CD1 4.31Å; L147-Y152 HydrophobicContact CD2-CE1 3.89Å; L147-Y152 HydrophobicContact CG-CE1 4.17Å; L147-R153 VanDerWaalsContact O-CZ 3.24Å; L147-R153 PolarHBondContact O-NE 3.46Å; L147-R153 PolarHBondContact O-NH2 3.31Å
148	S	84.2	Confident	88.6	Confident	99 Å²	99	68 Å²	68	69%	0.692	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-81.2	-15.4	171.7	67.1	0	0	0	0	113.4	T145 L146	T145-S148 PolarHBondContact O-N 3.41Å; T145-S148 PolarHBondContact O-OG 3.1Å; L146-S148 PolarHBondContact O-N 2.94Å; L146-S148 VanDerWaalsContact O-N 3.09Å
149	D	89.5	Confident	88.2	Confident	53 Å²	53	63.2 Å²	63.2	28%	0.283	33%	0.332	S	S	.	.			trans	-86.1	119	178.7	178.6	-6	0	0	0	111	L146 L147 T151 Y152 R153 R174	L146-D149 WeakPolarHBondContact O-CB 3.26Å; L146-D149 PolarHBondContact O-N 3.42Å; L147-D149 VanDerWaalsContact C-N 3.35Å; D149-T151 VanDerWaalsContact C-N 3.25Å; D149-T151 PolarHBondContact O-N 2.91Å; D149-T151 WeakPolarHBondContact OD1-CB 3.41Å; D149-T151 PolarHBondContact OD1-N 3.05Å; D149-T151 PolarHBondContact OD1-OG1 3.07Å; D149-T151 PolarHBondContact OD2-OG1 3.08Å; D149-Y152 PolarHBondContact O-N 3.15Å; D149-R153 PolarHBondContact O-N 3.37Å; D149-R174 IonicContact OD2-NH1 2.76Å; D149-R174 PolarHBondContact OD2-NH1 3.23Å
150	P	87.8	Confident	87.9	Confident	98 Å²	98	61.1 Å²	61.1	64%	0.636	31%	0.31	S	S	*	.	H	α-helix	trans	-58.4	-34.2	178.2	-23.4	33.6	0	0	0	113.7	R153 E154	P150-R153 PolarHBondContact O-N 3.1Å; P150-E154 PolarHBondContact O-N 3.43Å; P150-E154 VanDerWaalsContact O-N 3.09Å
151	T	90.9	Very high	87.3	Confident	76 Å²	76	65.4 Å²	65.4	47%	0.466	33%	0.332	S	S	.	.	H	α-helix	trans	-71.8	-32.9	-178.1	69.9	0	0	0	0	112	D149 L155 R174	D149-T151 VanDerWaalsContact C-N 3.25Å; D149-T151 PolarHBondContact O-N 2.91Å; D149-T151 WeakPolarHBondContact OD1-CB 3.41Å; D149-T151 PolarHBondContact OD1-N 3.05Å; D149-T151 PolarHBondContact OD1-OG1 3.07Å; D149-T151 PolarHBondContact OD2-OG1 3.08Å; T151-L155 WeakPolarHBondContact O-CB 3.43Å; T151-L155 PolarHBondContact O-N 2.73Å; T151-R174 PolarHBondContact OG1-NH1 2.98Å
152	Y	91.5	Very high	86.9	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-69.7	-41.6	174	175.3	-106.6	0	0	0	111	L146 L147 D149 E154 L155 I156 R174 T178	L146-Y152 HydrophobicContact CB-CD1 3.65Å; L146-Y152 HydrophobicContact CB-CD2 4.2Å; L146-Y152 HydrophobicContact CB-CE1 3.58Å; L146-Y152 HydrophobicContact CB-CE2 4.15Å; L146-Y152 HydrophobicContact CB-CG 3.95Å; L146-Y152 HydrophobicContact CD1-CE2 4.02Å; L146-Y152 WeakPolarHBondContact O-CD1 3.34Å; L147-Y152 HydrophobicContact CD2-CD1 4.31Å; L147-Y152 HydrophobicContact CD2-CE1 3.89Å; L147-Y152 HydrophobicContact CG-CE1 4.17Å; D149-Y152 PolarHBondContact O-N 3.15Å; Y152-E154 VanDerWaalsContact C-N 3.33Å; Y152-E154 PolarHBondContact O-N 3.24Å; Y152-L155 WeakPolarHBondContact O-CB 3.14Å; Y152-L155 PolarHBondContact O-N 2.91Å; Y152-I156 HydrophobicContact CD1-CG1 4.42Å; Y152-I156 HydrophobicContact CE1-CG1 4.1Å; Y152-I156 HydrophobicContact CE2-CD1 4.04Å; Y152-I156 HydrophobicContact CE2-CG1 4.19Å; Y152-I156 WeakPolarHBondContact O-CG1 3.4Å; Y152-I156 PolarHBondContact O-N 3.42Å; Y152-R174 HydrophobicContact CD2-CB 3.86Å; Y152-R174 HydrophobicContact CD2-CG 4.45Å; Y152-R174 HydrophobicContact CE2-CB 3.86Å; Y152-T178 VanDerWaalsContact CE2-OG1 3.28Å; Y152-T178 WeakPolarHBondContact CE2-OG1 3.35Å; Y152-T178 WeakPolarHBondContact OH-CG2 3.38Å; Y152-T178 PolarHBondContact OH-OG1 3.42Å
153	R	89	Confident	86.1	Confident	127 Å²	127	65 Å²	65	48%	0.479	33%	0.33	S	S	.	.	H	α-helix	trans	-60.2	-43.9	174.9	-69.3	-173.3	179.1	-155.8	-4	112.2	L147 D149 P150 L155 I156 E157	L147-R153 VanDerWaalsContact O-CZ 3.24Å; L147-R153 PolarHBondContact O-NE 3.46Å; L147-R153 PolarHBondContact O-NH2 3.31Å; D149-R153 PolarHBondContact O-N 3.37Å; P150-R153 PolarHBondContact O-N 3.1Å; R153-L155 VanDerWaalsContact C-N 3.32Å; R153-L155 PolarHBondContact O-N 3.02Å; R153-I156 PolarHBondContact O-N 3.35Å; R153-E157 PolarHBondContact O-N 3.11Å
154	E	89.6	Confident	85.2	Confident	121 Å²	121	69.8 Å²	69.8	57%	0.565	36%	0.363	S	S	*	.	H	α-helix	trans	-61.7	-41.9	176.5	-167.1	-179.4	170.4	0	0	111.5	P150 Y152 I156 E157 Q158	P150-E154 PolarHBondContact O-N 3.43Å; P150-E154 VanDerWaalsContact O-N 3.09Å; Y152-E154 VanDerWaalsContact C-N 3.33Å; Y152-E154 PolarHBondContact O-N 3.24Å; E154-I156 PolarHBondContact O-N 2.96Å; E154-E157 PolarHBondContact O-N 3.36Å; E154-Q158 WeakPolarHBondContact O-CB 3.28Å; E154-Q158 VanDerWaalsContact O-CG 3.3Å; E154-Q158 WeakPolarHBondContact O-CG 3.25Å; E154-Q158 PolarHBondContact O-N 2.97Å; E154-Q158 PolarHBondContact OE1-NE2 3.29Å
155	L	89.6	Confident	84.6	Confident	10 Å²	10	64.9 Å²	64.9	5%	0.052	35%	0.349	C	S	.	.	H	α-helix	trans	-60.3	-41.6	175.5	178.2	64.9	0	0	0	112.6	T151 Y152 R153 Q158 L159 K169 D172 I175	T151-L155 WeakPolarHBondContact O-CB 3.43Å; T151-L155 PolarHBondContact O-N 2.73Å; Y152-L155 WeakPolarHBondContact O-CB 3.14Å; Y152-L155 PolarHBondContact O-N 2.91Å; R153-L155 VanDerWaalsContact C-N 3.32Å; R153-L155 PolarHBondContact O-N 3.02Å; L155-Q158 PolarHBondContact O-N 3.33Å; L155-L159 WeakPolarHBondContact O-CG 3.41Å; L155-L159 PolarHBondContact O-N 3.41Å; L155-K169 HydrophobicContact CD1-CB 4.31Å; L155-K169 HydrophobicContact CD1-CD 3.85Å; L155-K169 HydrophobicContact CD1-CG 4.06Å; L155-D172 HydrophobicContact CD2-CB 4.42Å; L155-D172 WeakPolarHBondContact CD2-OD2 3.48Å; L155-I175 HydrophobicContact CD1-CD1 4.37Å; L155-I175 HydrophobicContact CD2-CD1 3.46Å; L155-I175 VanDerWaalsContact CD2-CD1 3.46Å; L155-I175 HydrophobicContact CD2-CG1 3.76Å; L155-I175 HydrophobicContact CG-CD1 3.74Å; L155-I175 HydrophobicContact CG-CG1 4.38Å
156	I	90.9	Very high	84.3	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-65.5	-41.9	175.8	-64	-56.8	0	0	0	111.6	F128 L133 Y134 Y152 R153 E154 L159 R160 I175 T178	F128-I156 HydrophobicContact CD1-CD1 3.97Å; F128-I156 HydrophobicContact CE1-CD1 3.83Å; L133-I156 HydrophobicContact CD2-CG2 3.5Å; L133-I156 VanDerWaalsContact CD2-CG2 3.5Å; Y134-I156 HydrophobicContact CE1-CG2 4.34Å; Y152-I156 HydrophobicContact CD1-CG1 4.42Å; Y152-I156 HydrophobicContact CE1-CG1 4.1Å; Y152-I156 HydrophobicContact CE2-CD1 4.04Å; Y152-I156 HydrophobicContact CE2-CG1 4.19Å; Y152-I156 WeakPolarHBondContact O-CG1 3.4Å; Y152-I156 PolarHBondContact O-N 3.42Å; R153-I156 PolarHBondContact O-N 3.35Å; E154-I156 PolarHBondContact O-N 2.96Å; I156-L159 PolarHBondContact O-N 3.23Å; I156-R160 WeakPolarHBondContact O-CB 3.42Å; I156-R160 PolarHBondContact O-N 3.43Å; I156-I175 HydrophobicContact CD1-CD1 4.48Å; I156-T178 HydrophobicContact CD1-CG2 3.6Å
157	E	87.5	Confident	83.6	Confident	63 Å²	63	63.4 Å²	63.4	29%	0.294	35%	0.351	S	S	.	.	H	α-helix	trans	-67.2	-35.7	175.3	-74.7	-59.8	142	0	0	112.4	Y134 R153 E154 R160 N161	Y134-E157 WeakPolarHBondContact CE2-OE1 3.39Å; Y134-E157 PolarHBondContact OH-OE1 3.01Å; R153-E157 PolarHBondContact O-N 3.11Å; E154-E157 PolarHBondContact O-N 3.36Å; E157-R160 PolarHBondContact O-N 2.81Å; E157-R160 IonicContact OE1-CZ 2.67Å; E157-R160 IonicContact OE1-NH1 3.58Å; E157-R160 PolarHBondContact OE1-NH1 2.77Å; E157-R160 IonicContact OE2-NH1 2.71Å; E157-N161 WeakPolarHBondContact O-CB 3.49Å; E157-N161 PolarHBondContact O-N 3.23Å; E157-N161 PolarHBondContact O-ND2 3.45Å
158	Q	84.6	Confident	83.2	Confident	74 Å²	74	67.8 Å²	67.8	35%	0.346	38%	0.378	S	S	.	.	H	α-helix	trans	-61.4	-46.9	172.8	-74.9	176.1	11.6	0	0	111.2	E154 L155 R160 N161 K162	E154-Q158 WeakPolarHBondContact O-CB 3.28Å; E154-Q158 VanDerWaalsContact O-CG 3.3Å; E154-Q158 WeakPolarHBondContact O-CG 3.25Å; E154-Q158 PolarHBondContact O-N 2.97Å; E154-Q158 PolarHBondContact OE1-NE2 3.29Å; L155-Q158 PolarHBondContact O-N 3.33Å; Q158-R160 PolarHBondContact O-N 2.94Å; Q158-N161 PolarHBondContact O-N 3.06Å; Q158-K162 PolarHBondContact O-N 3.38Å
159	L	82.6	Confident	83	Confident	1 Å²	1	66.4 Å²	66.4	1%	0.005	36%	0.36	C	S	.	.	H	α-helix	trans	-70.2	-30.4	178.8	-69.9	175	0	0	0	113.2	N126 F128 L155 I156 K162 P163 D165 L166 K169 I175	N126-L159 PolarHBondContact ND2-O 2.92Å; F128-L159 HydrophobicContact CB-CB 4.28Å; F128-L159 HydrophobicContact CD1-CB 4.11Å; F128-L159 HydrophobicContact CD1-CD1 4.34Å; F128-L159 HydrophobicContact CD2-CB 3.89Å; F128-L159 HydrophobicContact CD2-CD1 4.47Å; F128-L159 HydrophobicContact CE1-CB 4.43Å; F128-L159 HydrophobicContact CE1-CD1 3.84Å; F128-L159 HydrophobicContact CE2-CB 4.25Å; F128-L159 HydrophobicContact CE2-CD1 4.01Å; F128-L159 HydrophobicContact CG-CB 3.83Å; F128-L159 HydrophobicContact CZ-CD1 3.67Å; L155-L159 WeakPolarHBondContact O-CG 3.41Å; L155-L159 PolarHBondContact O-N 3.41Å; I156-L159 PolarHBondContact O-N 3.23Å; L159-K162 CarbonylContact O-C 3.56Å; L159-P163 WeakPolarHBondContact O-CA 3.46Å; L159-D165 HydrophobicContact CD2-CB 4.47Å; L159-L166 HydrophobicContact CD1-CD1 4.15Å; L159-L166 HydrophobicContact CD2-CB 4.13Å; L159-L166 HydrophobicContact CD2-CD1 4.15Å; L159-K169 HydrophobicContact CD2-CB 4.16Å; L159-K169 HydrophobicContact CD2-CG 4.05Å; L159-I175 HydrophobicContact CD1-CD1 3.36Å; L159-I175 HydrophobicContact CD1-CG1 4.22Å
160	R	82.1	Confident	82.5	Confident	52 Å²	52	67.5 Å²	67.5	20%	0.196	37%	0.366	C	S	.	.	H	α-helix	trans	-63.3	-44.9	170.8	179.2	179.8	-81.4	-175.9	-19.1	111.5	N126 F128 N129 L133 I156 E157 Q158	N126-R160 PolarHBondContact ND2-O 3.36Å; F128-R160 HydrophobicContact CB-CB 4.37Å; F128-R160 PolarHBondContact O-NE 3.15Å; F128-R160 VanDerWaalsContact O-NE 3.11Å; N129-R160 HydrophobicContact CB-CG 4.47Å; L133-R160 VanDerWaalsContact CB-NH2 3.29Å; I156-R160 WeakPolarHBondContact O-CB 3.42Å; I156-R160 PolarHBondContact O-N 3.43Å; E157-R160 PolarHBondContact O-N 2.81Å; E157-R160 IonicContact OE1-CZ 2.67Å; E157-R160 IonicContact OE1-NH1 3.58Å; E157-R160 PolarHBondContact OE1-NH1 2.77Å; E157-R160 IonicContact OE2-NH1 2.71Å; Q158-R160 PolarHBondContact O-N 2.94Å
161	N	77.3	Confident	82	Confident	121 Å²	121	71.6 Å²	71.6	65%	0.647	38%	0.376	S	S	*	.	H	α-helix	trans	-82.4	-29.5	-176.9	-68.7	-45.2	0	0	0	113.7	E157 Q158	E157-N161 WeakPolarHBondContact O-CB 3.49Å; E157-N161 PolarHBondContact O-N 3.23Å; E157-N161 PolarHBondContact O-ND2 3.45Å; Q158-N161 PolarHBondContact O-N 3.06Å
162	K	76.3	Confident	81.6	Confident	129 Å²	129	69.7 Å²	69.7	56%	0.561	36%	0.363	S	S	*	.			trans	-134.2	76.2	179.9	-68.6	-175.4	-178.7	176.7	0	111.6	Q158 L159 S164 D165	Q158-K162 PolarHBondContact O-N 3.38Å; L159-K162 CarbonylContact O-C 3.56Å; K162-S164 PolarHBondContact O-N 3.46Å; K162-S164 VanDerWaalsContact O-N 3.1Å; K162-D165 WeakPolarHBondContact O-CB 3.27Å; K162-D165 PolarHBondContact O-N 3.15Å
163	P	70.1	Confident	81	Confident	54 Å²	54	74.5 Å²	74.5	35%	0.351	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-59.8	-21.7	178.9	13.5	-25.1	0	0	0	115.1	N126 L159 D165 L166	N126-P163 HydrophobicContact CB-CB 3.87Å; N126-P163 HydrophobicContact CB-CG 4.16Å; N126-P163 WeakPolarHBondContact ND2-CB 3.49Å; N126-P163 VanDerWaalsContact ND2-CG 3.33Å; N126-P163 WeakPolarHBondContact ND2-CG 3.24Å; L159-P163 WeakPolarHBondContact O-CA 3.46Å; P163-D165 PolarHBondContact O-N 3.25Å; P163-L166 VanDerWaalsContact O-CB 3.29Å; P163-L166 WeakPolarHBondContact O-CB 3.46Å; P163-L166 PolarHBondContact O-N 3.3Å
164	S	71.6	Confident	81	Confident	99 Å²	99	71.1 Å²	71.1	69%	0.692	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-60.2	-26.8	173.7	51.2	0	0	0	0	113.2	K162 L166	K162-S164 PolarHBondContact O-N 3.46Å; K162-S164 VanDerWaalsContact O-N 3.1Å; S164-L166 PolarHBondContact O-N 3.42Å
165	D	78.2	Confident	81	Confident	51 Å²	51	65.3 Å²	65.3	27%	0.273	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-78.3	-10.4	-175.6	-64.9	-0.4	0	0	0	111.7	L159 K162 P163 G167 T168 K169	L159-D165 HydrophobicContact CD2-CB 4.47Å; K162-D165 WeakPolarHBondContact O-CB 3.27Å; K162-D165 PolarHBondContact O-N 3.15Å; P163-D165 PolarHBondContact O-N 3.25Å; D165-G167 VanDerWaalsContact C-N 3.25Å; D165-G167 PolarHBondContact O-N 2.97Å; D165-T168 PolarHBondContact O-N 3.39Å; D165-T168 PolarHBondContact O-OG1 3.39Å; D165-K169 WeakPolarHBondContact O-CG 3.48Å; D165-K169 PolarHBondContact O-N 3.02Å; D165-K169 VanDerWaalsContact O-N 3.1Å
166	L	79.1	Confident	80.6	Confident	38 Å²	38	67.5 Å²	67.5	20%	0.199	37%	0.365	C	S	.	.	H	α-helix	trans	-50	-46.3	-180	-176.2	58.4	0	0	0	111.8	F128 L159 P163 S164 T168 K169 L170 I175 L179	F128-L166 HydrophobicContact CE2-CD1 3.59Å; F128-L166 HydrophobicContact CE2-CD2 4.23Å; F128-L166 HydrophobicContact CZ-CD1 3.96Å; L159-L166 HydrophobicContact CD1-CD1 4.15Å; L159-L166 HydrophobicContact CD2-CB 4.13Å; L159-L166 HydrophobicContact CD2-CD1 4.15Å; P163-L166 VanDerWaalsContact O-CB 3.29Å; P163-L166 WeakPolarHBondContact O-CB 3.46Å; P163-L166 PolarHBondContact O-N 3.3Å; S164-L166 PolarHBondContact O-N 3.42Å; L166-T168 PolarHBondContact O-N 3.49Å; L166-K169 CarbonylContact O-C 3.49Å; L166-K169 PolarHBondContact O-N 3.38Å; L166-L170 WeakPolarHBondContact O-CG 3.34Å; L166-L170 PolarHBondContact O-N 3.36Å; L166-I175 HydrophobicContact CD1-CG2 3.92Å; L166-L179 HydrophobicContact CD1-CD1 4.21Å; L166-L179 HydrophobicContact CD2-CD2 4.48Å
167	G	74.9	Confident	80.3	Confident	58 Å²	58	69.7 Å²	69.7	60%	0.598	38%	0.378	S	S	*	.	H	α-helix	trans	-57	-35.1	179.7	0	0	0	0	0	113.8	D165	D165-G167 VanDerWaalsContact C-N 3.25Å; D165-G167 PolarHBondContact O-N 2.97Å
168	T	79.5	Confident	80.4	Confident	99 Å²	99	66.7 Å²	66.7	61%	0.607	36%	0.364	S	S	*	.	H	α-helix	trans	-82.5	-24.2	177.8	66.3	0	0	0	0	113.1	D165 L166	D165-T168 PolarHBondContact O-N 3.39Å; D165-T168 PolarHBondContact O-OG1 3.39Å; L166-T168 PolarHBondContact O-N 3.49Å
169	K	80.4	Confident	80.4	Confident	71 Å²	71	63.7 Å²	63.7	31%	0.309	35%	0.351	S	S	.	.	H	α-helix	trans	-92.9	-7.1	-178.3	-59.8	-61.2	-175.4	172.7	0	113.5	L155 L159 D165 L166 Q171 D172 I175	L155-K169 HydrophobicContact CD1-CB 4.31Å; L155-K169 HydrophobicContact CD1-CD 3.85Å; L155-K169 HydrophobicContact CD1-CG 4.06Å; L159-K169 HydrophobicContact CD2-CB 4.16Å; L159-K169 HydrophobicContact CD2-CG 4.05Å; D165-K169 WeakPolarHBondContact O-CG 3.48Å; D165-K169 PolarHBondContact O-N 3.02Å; D165-K169 VanDerWaalsContact O-N 3.1Å; L166-K169 CarbonylContact O-C 3.49Å; L166-K169 PolarHBondContact O-N 3.38Å; K169-Q171 PolarHBondContact O-N 3.13Å; K169-Q171 VanDerWaalsContact O-N 3.12Å; K169-D172 WeakPolarHBondContact O-CB 3.48Å; K169-D172 PolarHBondContact O-N 2.88Å; K169-I175 HydrophobicContact CB-CG1 4.49Å; K169-I175 WeakPolarHBondContact O-CG1 3.4Å
170	L	79.2	Confident	80.5	Confident	76 Å²	76	63.8 Å²	63.8	40%	0.398	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-18.6	174.3	-79.2	171	0	0	0	113.9	L166 D172 I175 M176 L179	L166-L170 WeakPolarHBondContact O-CG 3.34Å; L166-L170 PolarHBondContact O-N 3.36Å; L170-D172 VanDerWaalsContact C-N 3.26Å; L170-D172 PolarHBondContact O-N 3.43Å; L170-I175 HydrophobicContact CD2-CG2 4.33Å; L170-M176 HydrophobicContact CD2-SD 3.71Å; L170-L179 HydrophobicContact CD2-CD1 3.79Å
171	Q	76.8	Confident	80.7	Confident	183 Å²	183	61.8 Å²	61.8	86%	0.855	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-18.2	174.8	-63.9	-177	-5.2	0	0	113.2	K169 P173	K169-Q171 PolarHBondContact O-N 3.13Å; K169-Q171 VanDerWaalsContact O-N 3.12Å; Q171-P173 WeakPolarHBondContact O-CD 3.44Å
172	D	83.6	Confident	81	Confident	37 Å²	37	56.4 Å²	56.4	20%	0.198	32%	0.316	C	S	.	.	S	Bend	trans	-78.3	117.6	174.4	-171.8	-39.3	0	0	0	108.9	L155 K169 L170 R174 I175	L155-D172 HydrophobicContact CD2-CB 4.42Å; L155-D172 WeakPolarHBondContact CD2-OD2 3.48Å; K169-D172 WeakPolarHBondContact O-CB 3.48Å; K169-D172 PolarHBondContact O-N 2.88Å; L170-D172 VanDerWaalsContact C-N 3.26Å; L170-D172 PolarHBondContact O-N 3.43Å; D172-R174 PolarHBondContact O-N 3.06Å; D172-R174 WeakPolarHBondContact OD1-CB 3.42Å; D172-R174 VanDerWaalsContact OD1-CG 3.3Å; D172-R174 WeakPolarHBondContact OD1-CG 3.46Å; D172-R174 IonicContact OD1-CZ 3.62Å; D172-R174 PolarHBondContact OD1-N 3.33Å; D172-R174 IonicContact OD1-NE 3.73Å; D172-R174 PolarHBondContact OD1-NE 2.87Å; D172-R174 IonicContact OD1-NH2 3.39Å; D172-R174 IonicContact OD2-CZ 2.74Å; D172-R174 IonicContact OD2-NE 3.78Å; D172-R174 PolarHBondContact OD2-NE 2.43Å; D172-R174 IonicContact OD2-NH2 2.8Å; D172-R174 PolarHBondContact OD2-NH2 3.07Å; D172-I175 HydrophobicContact CB-CG1 4.01Å; D172-I175 WeakPolarHBondContact O-CB 3.11Å; D172-I175 PolarHBondContact O-N 3.47Å
173	P	78.1	Confident	81.1	Confident	101 Å²	101	53.8 Å²	53.8	66%	0.656	31%	0.308	S	S	*	.	H	α-helix	trans	-60.7	-24.6	-174.9	24.7	-34.3	0	0	0	112.5	Q171 I175 T177	Q171-P173 WeakPolarHBondContact O-CD 3.44Å; P173-I175 VanDerWaalsContact C-N 3.29Å; P173-I175 PolarHBondContact O-N 3.32Å; P173-T177 PolarHBondContact O-OG1 2.98Å
174	R	89.6	Confident	81.2	Confident	55 Å²	55	54.3 Å²	54.3	21%	0.208	32%	0.323	C	S	.	.	H	α-helix	trans	-64.3	-35.7	176.6	-58.8	176.1	-67.5	-179.6	3.7	111.1	L146 D149 T151 Y152 D172 T177 T178	L146-R174 HydrophobicContact CD1-CB 4.05Å; L146-R174 HydrophobicContact CD1-CG 4.18Å; L146-R174 HydrophobicContact CD2-CG 4.09Å; D149-R174 IonicContact OD2-NH1 2.76Å; D149-R174 PolarHBondContact OD2-NH1 3.23Å; T151-R174 PolarHBondContact OG1-NH1 2.98Å; Y152-R174 HydrophobicContact CD2-CB 3.86Å; Y152-R174 HydrophobicContact CD2-CG 4.45Å; Y152-R174 HydrophobicContact CE2-CB 3.86Å; D172-R174 PolarHBondContact O-N 3.06Å; D172-R174 WeakPolarHBondContact OD1-CB 3.42Å; D172-R174 VanDerWaalsContact OD1-CG 3.3Å; D172-R174 WeakPolarHBondContact OD1-CG 3.46Å; D172-R174 IonicContact OD1-CZ 3.62Å; D172-R174 PolarHBondContact OD1-N 3.33Å; D172-R174 IonicContact OD1-NE 3.73Å; D172-R174 PolarHBondContact OD1-NE 2.87Å; D172-R174 IonicContact OD1-NH2 3.39Å; D172-R174 IonicContact OD2-CZ 2.74Å; D172-R174 IonicContact OD2-NE 3.78Å; D172-R174 PolarHBondContact OD2-NE 2.43Å; D172-R174 IonicContact OD2-NH2 2.8Å; D172-R174 PolarHBondContact OD2-NH2 3.07Å; R174-T177 PolarHBondContact O-N 2.95Å; R174-T178 PolarHBondContact O-N 2.95Å; R174-T178 PolarHBondContact O-OG1 2.72Å
175	I	87.9	Confident	81.2	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-66.9	-38.7	-176.2	-67.5	-56.7	0	0	0	112.4	F128 L155 I156 L159 L166 K169 L170 D172 P173 T178 L179	F128-I175 HydrophobicContact CZ-CG2 4.46Å; L155-I175 HydrophobicContact CD1-CD1 4.37Å; L155-I175 HydrophobicContact CD2-CD1 3.46Å; L155-I175 VanDerWaalsContact CD2-CD1 3.46Å; L155-I175 HydrophobicContact CD2-CG1 3.76Å; L155-I175 HydrophobicContact CG-CD1 3.74Å; L155-I175 HydrophobicContact CG-CG1 4.38Å; I156-I175 HydrophobicContact CD1-CD1 4.48Å; L159-I175 HydrophobicContact CD1-CD1 3.36Å; L159-I175 HydrophobicContact CD1-CG1 4.22Å; L166-I175 HydrophobicContact CD1-CG2 3.92Å; K169-I175 HydrophobicContact CB-CG1 4.49Å; K169-I175 WeakPolarHBondContact O-CG1 3.4Å; L170-I175 HydrophobicContact CD2-CG2 4.33Å; D172-I175 HydrophobicContact CB-CG1 4.01Å; D172-I175 WeakPolarHBondContact O-CB 3.11Å; D172-I175 PolarHBondContact O-N 3.47Å; P173-I175 VanDerWaalsContact C-N 3.29Å; P173-I175 PolarHBondContact O-N 3.32Å; I175-T178 PolarHBondContact O-N 3.45Å; I175-L179 HydrophobicContact CG2-CD1 3.94Å; I175-L179 HydrophobicContact CG2-CG 4.23Å; I175-L179 WeakPolarHBondContact O-CB 3.23Å; I175-L179 VanDerWaalsContact O-CG 3.29Å; I175-L179 WeakPolarHBondContact O-CG 3.43Å; I175-L179 PolarHBondContact O-N 3.2Å
176	M	82.1	Confident	80.5	Confident	55 Å²	55	55.9 Å²	55.9	27%	0.271	33%	0.326	S	S	.	.	H	α-helix	trans	-65.2	-41.9	176.5	-72.3	-61.3	-72	0	0	111.4	L170 L179 S180 L187	L170-M176 HydrophobicContact CD2-SD 3.71Å; M176-L179 PolarHBondContact O-N 3.49Å; M176-L179 HydrophobicContact SD-CD1 4.42Å; M176-S180 WeakPolarHBondContact O-CB 3.42Å; M176-S180 PolarHBondContact O-N 3.43Å; M176-S180 PolarHBondContact O-OG 3.32Å; M176-L187 HydrophobicContact CE-CB 3.8Å
177	T	85.8	Confident	79.7	Confident	46 Å²	46	56.1 Å²	56.1	28%	0.282	33%	0.328	S	S	.	.	H	α-helix	trans	-62.6	-45	172.2	-51.8	0	0	0	0	111.2	R142 T143 P173 R174 S180 V181	R142-T177 HydrophobicContact CB-CG2 3.7Å; T143-T177 HydrophobicContact CG2-CG2 4.23Å; P173-T177 PolarHBondContact O-OG1 2.98Å; R174-T177 PolarHBondContact O-N 2.95Å; T177-S180 WeakPolarHBondContact O-CB 3.39Å; T177-S180 PolarHBondContact O-N 3.48Å; T177-V181 WeakPolarHBondContact O-CG2 3.37Å; T177-V181 PolarHBondContact O-N 2.71Å; T177-V181 VanDerWaalsContact O-N 3.13Å
178	T	88.7	Confident	78.5	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-59.9	-49.3	176.3	-46.5	0	0	0	0	111.9	F128 L137 Y152 I156 R174 I175 S180 V181 L182	F128-T178 HydrophobicContact CE1-CG2 3.87Å; L137-T178 HydrophobicContact CD1-CG2 4.14Å; L137-T178 HydrophobicContact CD2-CG2 3.59Å; Y152-T178 VanDerWaalsContact CE2-OG1 3.28Å; Y152-T178 WeakPolarHBondContact CE2-OG1 3.35Å; Y152-T178 WeakPolarHBondContact OH-CG2 3.38Å; Y152-T178 PolarHBondContact OH-OG1 3.42Å; I156-T178 HydrophobicContact CD1-CG2 3.6Å; R174-T178 PolarHBondContact O-N 2.95Å; R174-T178 PolarHBondContact O-OG1 2.72Å; I175-T178 PolarHBondContact O-N 3.45Å; T178-S180 PolarHBondContact O-N 3.11Å; T178-V181 PolarHBondContact O-N 3.23Å; T178-V181 VanDerWaalsContact O-N 3.17Å; T178-L182 HydrophobicContact CG2-CD1 3.81Å; T178-L182 HydrophobicContact CG2-CG 4.14Å; T178-L182 VanDerWaalsContact O-CG 3.26Å; T178-L182 WeakPolarHBondContact O-CG 3.13Å; T178-L182 PolarHBondContact O-N 2.96Å
179	L	85.4	Confident	76.6	Confident	12 Å²	12	55.6 Å²	55.6	6%	0.063	33%	0.33	C	S	.	.	H	α-helix	trans	-59.4	-38.5	178.1	-76.7	172.8	0	0	0	111.3	P127 F128 L166 L170 I175 M176 V181 L182 L183 L187	P127-L179 HydrophobicContact CB-CD2 4.41Å; P127-L179 HydrophobicContact CG-CD2 3.54Å; F128-L179 HydrophobicContact CE2-CD2 3.58Å; F128-L179 HydrophobicContact CE2-CG 4.4Å; F128-L179 HydrophobicContact CZ-CD2 3.53Å; F128-L179 HydrophobicContact CZ-CG 3.92Å; L166-L179 HydrophobicContact CD1-CD1 4.21Å; L166-L179 HydrophobicContact CD2-CD2 4.48Å; L170-L179 HydrophobicContact CD2-CD1 3.79Å; I175-L179 HydrophobicContact CG2-CD1 3.94Å; I175-L179 HydrophobicContact CG2-CG 4.23Å; I175-L179 WeakPolarHBondContact O-CB 3.23Å; I175-L179 VanDerWaalsContact O-CG 3.29Å; I175-L179 WeakPolarHBondContact O-CG 3.43Å; I175-L179 PolarHBondContact O-N 3.2Å; M176-L179 PolarHBondContact O-N 3.49Å; M176-L179 HydrophobicContact SD-CD1 4.42Å; L179-V181 VanDerWaalsContact C-N 3.33Å; L179-V181 PolarHBondContact O-N 3.1Å; L179-L182 PolarHBondContact O-N 2.91Å; L179-L183 HydrophobicContact CD2-CD1 4.46Å; L179-L183 VanDerWaalsContact O-CB 3.25Å; L179-L183 WeakPolarHBondContact O-CB 3.25Å; L179-L183 WeakPolarHBondContact O-CG 2.99Å; L179-L183 PolarHBondContact O-N 2.74Å; L179-L187 HydrophobicContact CB-CD1 3.69Å
180	S	82.9	Confident	74.5	Confident	3 Å²	3	59.5 Å²	59.5	2%	0.021	35%	0.351	C	S	.	.	H	α-helix	trans	-59.4	-46	177.2	-58.3	0	0	0	0	111.4	M176 T177 T178 G184 V185 L187	M176-S180 WeakPolarHBondContact O-CB 3.42Å; M176-S180 PolarHBondContact O-N 3.43Å; M176-S180 PolarHBondContact O-OG 3.32Å; T177-S180 WeakPolarHBondContact O-CB 3.39Å; T177-S180 PolarHBondContact O-N 3.48Å; T178-S180 PolarHBondContact O-N 3.11Å; S180-G184 WeakPolarHBondContact O-CA 3.27Å; S180-G184 PolarHBondContact O-N 3.12Å; S180-V185 CarbonylContact C-O 3.58Å; S180-V185 WeakPolarHBondContact CA-O 3.41Å; S180-V185 WeakPolarHBondContact CB-O 3.42Å; S180-V185 PolarHBondContact O-N 3.36Å; S180-V185 VanDerWaalsContact O-N 3.11Å; S180-V185 VanDerWaalsContact O-O 3.08Å; S180-L187 VanDerWaalsContact OG-CB 3.25Å; S180-L187 WeakPolarHBondContact OG-CB 3.37Å; S180-L187 PolarHBondContact OG-N 3.19Å
181	V	87.1	Confident	72.4	Confident	9 Å²	9	62.9 Å²	62.9	6%	0.055	37%	0.369	C	S	.	.	H	α-helix	trans	-67.6	-43.1	177.2	177	0	0	0	0	112	K136 L137 D140 T143 T177 T178 L179 G184	K136-V181 VanDerWaalsContact CE-O 3.24Å; K136-V181 WeakPolarHBondContact CE-O 3.48Å; K136-V181 HydrophobicContact CG-CG1 4.5Å; L137-V181 HydrophobicContact CD2-CB 4.36Å; L137-V181 HydrophobicContact CD2-CG1 4.12Å; D140-V181 HydrophobicContact CB-CB 4.37Å; D140-V181 HydrophobicContact CB-CG1 3.59Å; D140-V181 HydrophobicContact CB-CG2 3.78Å; D140-V181 WeakPolarHBondContact OD2-CG2 3.45Å; T143-V181 HydrophobicContact CG2-CB 4.1Å; T143-V181 HydrophobicContact CG2-CG2 3.61Å; T177-V181 WeakPolarHBondContact O-CG2 3.37Å; T177-V181 PolarHBondContact O-N 2.71Å; T177-V181 VanDerWaalsContact O-N 3.13Å; T178-V181 PolarHBondContact O-N 3.23Å; T178-V181 VanDerWaalsContact O-N 3.17Å; L179-V181 VanDerWaalsContact C-N 3.33Å; L179-V181 PolarHBondContact O-N 3.1Å; V181-G184 PolarHBondContact O-N 3.34Å
182	L	83.6	Confident	70.1	Confident	9 Å²	9	63.2 Å²	63.2	5%	0.047	37%	0.371	C	S	.	.	H	α-helix	trans	-68.8	-41.8	-177.1	-66.8	-179.3	0	0	0	112.4	P127 F128 M130 L133 K136 L137 T178 L179	P127-L182 HydrophobicContact CB-CB 4.22Å; P127-L182 HydrophobicContact CB-CD1 4.4Å; F128-L182 HydrophobicContact CD1-CD1 3.71Å; F128-L182 HydrophobicContact CE1-CD1 3.84Å; F128-L182 HydrophobicContact CG-CD1 4.28Å; F128-L182 HydrophobicContact CZ-CD1 4.47Å; M130-L182 HydrophobicContact SD-CD2 3.94Å; L133-L182 HydrophobicContact CD1-CD1 3.63Å; L133-L182 HydrophobicContact CD1-CD2 3.41Å; L133-L182 VanDerWaalsContact CD1-CD2 3.41Å; L133-L182 HydrophobicContact CD1-CG 4.16Å; L133-L182 HydrophobicContact CG-CD2 4.47Å; K136-L182 PolarHBondContact NZ-O 3.12Å; L137-L182 HydrophobicContact CD2-CD2 3.68Å; L137-L182 HydrophobicContact CD2-CG 4.01Å; L137-L182 HydrophobicContact CG-CD2 4.01Å; T178-L182 HydrophobicContact CG2-CD1 3.81Å; T178-L182 HydrophobicContact CG2-CG 4.14Å; T178-L182 VanDerWaalsContact O-CG 3.26Å; T178-L182 WeakPolarHBondContact O-CG 3.13Å; T178-L182 PolarHBondContact O-N 2.96Å; L179-L182 PolarHBondContact O-N 2.91Å
183	L	78.8	Confident	67.9	Low	73 Å²	73	70.7 Å²	70.7	38%	0.382	41%	0.405	S	S	.	.	H	α-helix	trans	-84.4	-15.1	179.8	-61.1	174.3	0	0	0	112.7	P127 L179 V185 L187	P127-L183 HydrophobicContact CB-CD2 3.91Å; P127-L183 HydrophobicContact CB-CG 4.41Å; P127-L183 HydrophobicContact CG-CD2 4.45Å; L179-L183 HydrophobicContact CD2-CD1 4.46Å; L179-L183 VanDerWaalsContact O-CB 3.25Å; L179-L183 WeakPolarHBondContact O-CB 3.25Å; L179-L183 WeakPolarHBondContact O-CG 2.99Å; L179-L183 PolarHBondContact O-N 2.74Å; L183-V185 VanDerWaalsContact C-N 3.3Å; L183-V185 HydrophobicContact CB-CG2 3.81Å; L183-V185 WeakPolarHBondContact O-CG2 3.4Å; L183-L187 HydrophobicContact CD1-CD1 4.32Å
184	G	72.6	Confident	65.4	Low	65 Å²	65	74.7 Å²	74.7	67%	0.67	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.9	30.4	-178.1	0	0	0	0	0	112.8	S180 V181	S180-G184 WeakPolarHBondContact O-CA 3.27Å; S180-G184 PolarHBondContact O-N 3.12Å; V181-G184 PolarHBondContact O-N 3.34Å
185	V	70.1	Confident	62.8	Low	83 Å²	83	81.7 Å²	81.7	50%	0.503	45%	0.45	S	S	.	.	S	Bend	trans	-130.3	135.9	-179.1	-146.6	0	0	0	0	107.1	S180 L183 L187	S180-V185 CarbonylContact C-O 3.58Å; S180-V185 WeakPolarHBondContact CA-O 3.41Å; S180-V185 WeakPolarHBondContact CB-O 3.42Å; S180-V185 PolarHBondContact O-N 3.36Å; S180-V185 VanDerWaalsContact O-N 3.11Å; S180-V185 VanDerWaalsContact O-O 3.08Å; L183-V185 VanDerWaalsContact C-N 3.3Å; L183-V185 HydrophobicContact CB-CG2 3.81Å; L183-V185 WeakPolarHBondContact O-CG2 3.4Å; V185-L187 PolarHBondContact O-N 3.47Å
186	D	64.8	Low	60	Low	100 Å²	100	88.1 Å²	88.1	54%	0.535	49%	0.489	S	S	.	.			trans	-80.1	106.6	177.9	-155.9	15.5	0	0	0	109.9	R142	R142-D186 IonicContact NH1-OD1 3.34Å; R142-D186 PolarHBondContact NH1-OD1 3.08Å; R142-D186 VanDerWaalsContact NH1-OD1 3.08Å
187	L	62.1	Low	57.6	Low	43 Å²	43	90.2 Å²	90.2	23%	0.225	52%	0.515	C	S	.	.			trans	-96.4	2.2	-179.4	-54.4	166.9	0	0	0	112	M176 L179 S180 L183 V185	M176-L187 HydrophobicContact CE-CB 3.8Å; L179-L187 HydrophobicContact CB-CD1 3.69Å; S180-L187 VanDerWaalsContact OG-CB 3.25Å; S180-L187 WeakPolarHBondContact OG-CB 3.37Å; S180-L187 PolarHBondContact OG-N 3.19Å; L183-L187 HydrophobicContact CD1-CD1 4.32Å; V185-L187 PolarHBondContact O-N 3.47Å
188	G	48.4	Very low	55	Low	68 Å²	68	94.2 Å²	94.2	70%	0.701	54%	0.539	S	S	*	.	S	Bend	trans	-82.6	-3.5	-177	0	0	0	0	0	115.5
189	S	40.2	Very low	52.3	Low	78 Å²	78	99.7 Å²	99.7	55%	0.545	58%	0.575	S	S	.	*			trans	-123.7	55.6	-178	61.4	0	0	0	0	110.9	D191	S189-D191 VanDerWaalsContact C-N 3.32Å
190	M	36.2	Very low	49.7	Very low	153 Å²	153	104.8 Å²	104.8	75%	0.754	61%	0.609	S	S	*	*			trans	-96.5	20	170.2	-77	-175.2	71.4	0	0	112.8
191	D	35.3	Very low	47.4	Very low	147 Å²	147	109.9 Å²	109.9	79%	0.786	64%	0.642	S	S	*	*	S	Bend	trans	-124.2	129.1	157.8	-77.5	-43.1	0	0	0	107.4	S189	S189-D191 VanDerWaalsContact C-N 3.32Å
192	E	28.6	Very low	44.9	Very low	190 Å²	190	115.1 Å²	115.1	89%	0.888	68%	0.676	S	S	*	*	S	Bend	trans	89.8	117.4	179.8	-55.1	-172.1	172.5	0	0	117.4
193	E	36.4	Very low	42.5	Very low	195 Å²	195	120.3 Å²	120.3	91%	0.911	71%	0.71	S	S	*	*			trans	-60	124.7	170	-63.4	175.2	145	0	0	110.7
194	E	27.3	Very low	40.5	Very low	185 Å²	185	122 Å²	122	86%	0.864	73%	0.726	S	S	*	*			trans	-171.2	131.1	139.6	-108.5	178.3	-171.2	0	0	110.9	V196	E194-V196 PolarHBondContact O-N 2.93Å
195	E	35.2	Very low	38.7	Very low	202 Å²	202	125 Å²	125	94%	0.944	73%	0.733	S	S	*	*			trans	-64.8	119.3	172.9	-73.6	-175.5	147.1	0	0	110.7
196	V	28	Very low	36.8	Very low	134 Å²	134	130.8 Å²	130.8	81%	0.812	75%	0.752	S	S	*	*			trans	-129.5	122.3	159.1	-169.2	0	0	0	0	109.9	E194	E194-V196 PolarHBondContact O-N 2.93Å
197	A	31.4	Very low	35.4	Very low	100 Å²	100	135 Å²	135	83%	0.826	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-67.7	133.9	-174.1	0	0	0	0	0	113.6
198	T	31	Very low	34.1	Very low	129 Å²	129	142.6 Å²	142.6	79%	0.791	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-89.2	146.9	161.5	49.9	0	0	0	0	111.2
199	P	32.8	Very low	33.4	Very low	116 Å²	116	144.8 Å²	144.8	75%	0.753	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-68.2	152	-179.7	-5.5	21	0	0	0	111.6
200	P	31.2	Very low	33.1	Very low	118 Å²	118	150.4 Å²	150.4	77%	0.766	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-70.6	150.7	-178.6	28.9	-32.9	0	0	0	112
201	P	34.5	Very low	32.9	Very low	111 Å²	111	149 Å²	149	72%	0.721	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-65.8	158.8	171.8	-5.7	19.7	0	0	0	111.5
202	P	35.1	Very low	33.2	Very low	118 Å²	118	150 Å²	150	77%	0.766	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-62.3	146	177.3	27	-33.5	0	0	0	111.1
203	P	32.9	Very low	33.6	Very low	119 Å²	119	145.2 Å²	145.2	77%	0.773	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-67	140.9	-171.9	-11.6	25.2	0	0	0	111.2
204	P	36.4	Very low	34	Very low	109 Å²	109	142.1 Å²	142.1	71%	0.708	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-63.6	151.8	167.9	27.1	-32.2	0	0	0	110.5	K206	P204-K206 PolarHBondContact O-N 3.4Å
205	P	34.2	Very low	35.1	Very low	126 Å²	126	140.8 Å²	140.8	82%	0.818	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-58.4	126.2	178.4	22.8	-31.7	0	0	0	110.3	K207	P205-K207 PolarHBondContact O-N 3.43Å
206	K	31.4	Very low	35.6	Very low	206 Å²	206	138.2 Å²	138.2	90%	0.896	77%	0.771	S	S	*	*			trans	-52.2	112	-178.9	-74.3	179.4	176	-178.8	0	110	P204	P204-K206 PolarHBondContact O-N 3.4Å
207	K	35.9	Very low	37	Very low	188 Å²	188	137.9 Å²	137.9	82%	0.817	77%	0.765	S	S	*	*			trans	-65.4	131	153.5	-83.7	177.5	174.3	176.1	0	106.5	P205 T209	P205-K207 PolarHBondContact O-N 3.43Å; K207-T209 PolarHBondContact O-N 2.89Å
208	E	33.8	Very low	38.8	Very low	202 Å²	202	135.4 Å²	135.4	94%	0.944	74%	0.737	S	S	*	*			trans	-62.1	82.4	172.9	-69.2	178.5	164.7	0	0	109.9
209	T	32.8	Very low	41.3	Very low	115 Å²	115	132.6 Å²	132.6	71%	0.706	72%	0.721	S	S	*	*			trans	-65.6	135.8	150.2	41	0	0	0	0	106.8	K207	K207-T209 PolarHBondContact O-N 2.89Å
210	K	34.1	Very low	43.9	Very low	195 Å²	195	132.1 Å²	132.1	85%	0.848	71%	0.709	S	S	*	*			trans	-40.6	130.9	162.9	-82.9	178.3	173.2	178.7	0	107.8	E212	K210-E212 PolarHBondContact O-N 3.41Å
211	P	33.2	Very low	46.5	Very low	125 Å²	125	129.8 Å²	129.8	81%	0.812	69%	0.69	S	S	*	*			trans	-57.2	113.8	-176.5	20.5	-29.1	0	0	0	108.3
212	E	41	Very low	49.1	Very low	166 Å²	166	127.8 Å²	127.8	78%	0.776	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-54.9	138.4	155	-70.5	177.8	173.4	0	0	106.2	K210 M214	K210-E212 PolarHBondContact O-N 3.41Å; E212-M214 PolarHBondContact O-N 3.17Å; E212-M214 VanDerWaalsContact O-N 3.13Å
213	P	36.6	Very low	51.7	Low	90 Å²	90	125.1 Å²	125.1	58%	0.584	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-51.8	127	177.4	-19.8	29.4	0	0	0	108.5	D217	P213-D217 HydrophobicContact CB-CB 4.02Å
214	M	45.4	Very low	54.5	Low	130 Å²	130	123.3 Å²	123.3	64%	0.64	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-51.9	148.1	172.3	-80	172.8	56.2	0	0	108.5	E212 E216 D217	E212-M214 PolarHBondContact O-N 3.17Å; E212-M214 VanDerWaalsContact O-N 3.13Å; M214-E216 PolarHBondContact O-N 3.47Å; M214-D217 PolarHBondContact O-N 2.83Å
215	E	49.4	Very low	57.2	Low	158 Å²	158	118.1 Å²	118.1	74%	0.738	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-49.6	-24.9	178.1	-84.8	-177.2	147.8	0	0	112.9	D217 K223	E215-D217 PolarHBondContact O-N 3.43Å; E215-K223 WeakPolarHBondContact O-CE 3.4Å
216	E	47	Very low	59.9	Low	148 Å²	148	114.4 Å²	114.4	69%	0.692	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-64.3	-29.6	174.1	-71.2	-176.5	148.5	0	0	114.5	M214 K223	M214-E216 PolarHBondContact O-N 3.47Å; E216-K223 PolarHBondContact O-NZ 2.97Å
217	D	57.2	Low	62.8	Low	127 Å²	127	111.2 Å²	111.2	68%	0.679	55%	0.553	S	S	*	*	G	3₁₀ helix	trans	-92.2	-3	-177	-80.4	-30.6	0	0	0	114.5	P213 M214 E215	P213-D217 HydrophobicContact CB-CB 4.02Å; M214-D217 PolarHBondContact O-N 2.83Å; E215-D217 PolarHBondContact O-N 3.43Å
218	L	68.9	Low	65.7	Low	47 Å²	47	103.5 Å²	103.5	25%	0.246	52%	0.52	C	S	.	.	S	Bend	trans	-71.9	137	178.3	-77.5	163.9	0	0	0	111.3	K222 K223 L226	L218-K222 HydrophobicContact CD2-CB 4.4Å; L218-K222 HydrophobicContact CD2-CD 4.17Å; L218-K223 HydrophobicContact CB-CG 4.02Å; L218-K223 WeakPolarHBondContact O-CE 3.39Å; L218-K223 PolarHBondContact O-NZ 3.47Å; L218-L226 HydrophobicContact CD1-CD1 4.24Å
219	P	83.2	Confident	68.6	Low	71 Å²	71	95.6 Å²	95.6	46%	0.461	48%	0.482	S	S	.	.			trans	-52.6	143.4	171.3	-29	38	0	0	0	111.9	N221 K222 K223	P219-N221 WeakPolarHBondContact CB-OD1 3.24Å; P219-N221 PolarHBondContact O-N 3.3Å; P219-N221 VanDerWaalsContact O-N 3.14Å; P219-K222 WeakPolarHBondContact O-CB 3.26Å; P219-K222 PolarHBondContact O-N 2.88Å; P219-K223 PolarHBondContact O-N 3.25Å; P219-K223 VanDerWaalsContact O-N 3.15Å
220	E	86.9	Confident	71.6	Confident	105 Å²	105	94.2 Å²	94.2	49%	0.491	47%	0.468	S	S	.	.	H	α-helix	trans	-56.5	-35.6	-172.3	-175.2	57	-151.9	0	0	112.9	K222 K223 Q224	E220-K222 VanDerWaalsContact C-N 3.35Å; E220-K222 PolarHBondContact O-N 3.42Å; E220-K223 PolarHBondContact O-N 2.88Å; E220-Q224 WeakPolarHBondContact O-CG 3.3Å; E220-Q224 PolarHBondContact O-N 2.9Å; E220-Q224 PolarHBondContact OE1-NE2 3.25Å; E220-Q224 VanDerWaalsContact OE1-NE2 3.07Å
221	N	87.1	Confident	74.5	Confident	70 Å²	70	89 Å²	89	37%	0.374	45%	0.448	S	S	.	.	H	α-helix	trans	-62.4	-38.9	175	66.1	-44	0	0	0	112.6	P219 Q224 A225 L254	P219-N221 WeakPolarHBondContact CB-OD1 3.24Å; P219-N221 PolarHBondContact O-N 3.3Å; P219-N221 VanDerWaalsContact O-N 3.14Å; N221-Q224 PolarHBondContact O-N 3.28Å; N221-A225 WeakPolarHBondContact O-CB 3.18Å; N221-A225 PolarHBondContact O-N 2.99Å; N221-L254 PolarHBondContact ND2-O 2.89Å
222	K	88.8	Confident	77.5	Confident	69 Å²	69	83 Å²	83	30%	0.3	41%	0.41	S	S	.	.	H	α-helix	trans	-70	-37.8	176.5	-66.5	-162.4	171.3	-164.1	0	112	L218 P219 E220 A225 L226 D255	L218-K222 HydrophobicContact CD2-CB 4.4Å; L218-K222 HydrophobicContact CD2-CD 4.17Å; P219-K222 WeakPolarHBondContact O-CB 3.26Å; P219-K222 PolarHBondContact O-N 2.88Å; E220-K222 VanDerWaalsContact C-N 3.35Å; E220-K222 PolarHBondContact O-N 3.42Å; K222-A225 PolarHBondContact O-N 3.45Å; K222-L226 WeakPolarHBondContact O-CG 3.46Å; K222-L226 PolarHBondContact O-N 3.14Å; K222-D255 HydrophobicContact CG-CB 4.35Å
223	K	89.8	Confident	80	Confident	61 Å²	61	76.6 Å²	76.6	27%	0.265	38%	0.381	S	S	.	.	H	α-helix	trans	-61.3	-44.5	173.2	-72	173.4	173.8	159.9	0	111.5	E215 E216 L218 P219 E220 L226 K227	E215-K223 WeakPolarHBondContact O-CE 3.4Å; E216-K223 PolarHBondContact O-NZ 2.97Å; L218-K223 HydrophobicContact CB-CG 4.02Å; L218-K223 WeakPolarHBondContact O-CE 3.39Å; L218-K223 PolarHBondContact O-NZ 3.47Å; P219-K223 PolarHBondContact O-N 3.25Å; P219-K223 VanDerWaalsContact O-N 3.15Å; E220-K223 PolarHBondContact O-N 2.88Å; K223-L226 PolarHBondContact O-N 2.99Å; K223-K227 PolarHBondContact O-N 3.41Å; K223-K227 VanDerWaalsContact O-N 3.16Å
224	Q	91.8	Very high	82.8	Confident	81 Å²	81	75.8 Å²	75.8	38%	0.379	37%	0.372	S	S	.	.	H	α-helix	trans	-66.3	-40.9	176.9	-68.9	176.4	8.3	0	0	111.8	E220 N221 L226 K227 E228 L254	E220-Q224 WeakPolarHBondContact O-CG 3.3Å; E220-Q224 PolarHBondContact O-N 2.9Å; E220-Q224 PolarHBondContact OE1-NE2 3.25Å; E220-Q224 VanDerWaalsContact OE1-NE2 3.07Å; N221-Q224 PolarHBondContact O-N 3.28Å; Q224-L226 VanDerWaalsContact C-N 3.32Å; Q224-L226 PolarHBondContact O-N 2.93Å; Q224-K227 PolarHBondContact O-N 3.26Å; Q224-E228 WeakPolarHBondContact O-CG 3.5Å; Q224-E228 PolarHBondContact O-N 3.29Å; Q224-L254 HydrophobicContact CB-CD1 3.82Å
225	A	92.1	Very high	85.2	Confident	0 Å²	0	70 Å²	70	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-59.3	-41.4	175.5	0	0	0	0	0	112.3	N221 K222 E228 K229 A251 L254 D255 Y261	N221-A225 WeakPolarHBondContact O-CB 3.18Å; N221-A225 PolarHBondContact O-N 2.99Å; K222-A225 PolarHBondContact O-N 3.45Å; A225-E228 PolarHBondContact O-N 3.07Å; A225-K229 WeakPolarHBondContact O-CB 3.45Å; A225-K229 PolarHBondContact O-N 3.4Å; A225-A251 WeakPolarHBondContact CB-O 3.38Å; A225-A251 WeakPolarHBondContact O-CB 3.42Å; A225-L254 HydrophobicContact CB-CB 3.81Å; A225-D255 HydrophobicContact CB-CB 3.74Å; A225-Y261 HydrophobicContact CB-CE2 4.18Å; A225-Y261 WeakPolarHBondContact CB-OH 3.47Å
226	L	91.5	Very high	87.4	Confident	49 Å²	49	65.3 Å²	65.3	26%	0.257	32%	0.32	S	S	.	.	H	α-helix	trans	-65.6	-39.6	176.2	-70.6	173.6	0	0	0	112.6	L218 K222 K223 Q224 K229 E230	L218-L226 HydrophobicContact CD1-CD1 4.24Å; K222-L226 WeakPolarHBondContact O-CG 3.46Å; K222-L226 PolarHBondContact O-N 3.14Å; K223-L226 PolarHBondContact O-N 2.99Å; Q224-L226 VanDerWaalsContact C-N 3.32Å; Q224-L226 PolarHBondContact O-N 2.93Å; L226-K229 WeakPolarHBondContact O-CB 3.29Å; L226-K229 PolarHBondContact O-N 2.71Å; L226-E230 PolarHBondContact O-N 3.02Å
227	K	93.1	Very high	89.7	Confident	139 Å²	139	65.5 Å²	65.5	60%	0.604	32%	0.319	S	S	*	.	H	α-helix	trans	-62.2	-46.9	174.2	-72.6	176.1	-179	174.3	0	111.6	K223 Q224 K229 E230 L231	K223-K227 PolarHBondContact O-N 3.41Å; K223-K227 VanDerWaalsContact O-N 3.16Å; Q224-K227 PolarHBondContact O-N 3.26Å; K227-K229 VanDerWaalsContact C-N 3.31Å; K227-K229 PolarHBondContact O-N 2.87Å; K227-E230 PolarHBondContact O-N 2.96Å; K227-L231 WeakPolarHBondContact O-CG 3.26Å; K227-L231 PolarHBondContact O-N 3.41Å
228	E	95.8	Very high	91.5	Very high	26 Å²	26	67.5 Å²	67.5	12%	0.121	32%	0.322	C	S	.	.	H	α-helix	trans	-61.3	-40.6	176.3	-68.5	-67.6	171	0	0	111.1	Q224 A225 E230 L231 G232 H247 K250 A251 L254	Q224-E228 WeakPolarHBondContact O-CG 3.5Å; Q224-E228 PolarHBondContact O-N 3.29Å; A225-E228 PolarHBondContact O-N 3.07Å; E228-E230 PolarHBondContact O-N 3.06Å; E228-L231 PolarHBondContact O-N 2.67Å; E228-G232 PolarHBondContact O-N 3.26Å; E228-H247 WeakPolarHBondContact O-CB 3.18Å; E228-H247 IonicContact OE2-CE1 3.57Å; E228-H247 IonicContact OE2-CG 3.76Å; E228-H247 IonicContact OE2-ND1 2.71Å; E228-H247 PolarHBondContact OE2-ND1 2.83Å; E228-K250 HydrophobicContact CG-CB 4.45Å; E228-K250 HydrophobicContact CG-CD 4.18Å; E228-K250 HydrophobicContact CG-CG 4.14Å; E228-K250 WeakPolarHBondContact OE1-CD 3.33Å; E228-K250 VanDerWaalsContact OE1-CE 3.23Å; E228-K250 WeakPolarHBondContact OE1-CE 3.27Å; E228-K250 IonicContact OE1-NZ 2.7Å; E228-K250 PolarHBondContact OE1-NZ 3.13Å; E228-A251 HydrophobicContact CB-CB 3.95Å; E228-L254 HydrophobicContact CG-CD1 4.08Å
229	K	94.4	Very high	92.7	Very high	36 Å²	36	73 Å²	73	16%	0.157	34%	0.344	C	S	.	.	H	α-helix	trans	-58.6	-44.4	173.5	-180	-148.4	67.2	173.6	0	112.2	A225 L226 K227 G232 N233 Y248 A251 Y261	A225-K229 WeakPolarHBondContact O-CB 3.45Å; A225-K229 PolarHBondContact O-N 3.4Å; L226-K229 WeakPolarHBondContact O-CB 3.29Å; L226-K229 PolarHBondContact O-N 2.71Å; K227-K229 VanDerWaalsContact C-N 3.31Å; K227-K229 PolarHBondContact O-N 2.87Å; K229-G232 PolarHBondContact O-N 2.83Å; K229-N233 PolarHBondContact O-N 2.95Å; K229-N233 PolarHBondContact O-OD1 3.23Å; K229-Y248 HydrophobicContact CG-CE1 4.49Å; K229-A251 HydrophobicContact CB-CB 4.42Å; K229-Y261 HydrophobicContact CB-CD1 3.84Å; K229-Y261 HydrophobicContact CB-CE1 3.62Å; K229-Y261 HydrophobicContact CD-CD1 4.21Å; K229-Y261 HydrophobicContact CD-CE1 3.88Å; K229-Y261 HydrophobicContact CG-CD1 3.82Å; K229-Y261 HydrophobicContact CG-CE1 3.83Å
230	E	95.6	Very high	93.3	Very high	86 Å²	86	73 Å²	73	40%	0.402	34%	0.34	S	S	.	.	H	α-helix	trans	-66.3	-39.6	177.9	-65.5	-52.3	149.8	0	0	112.5	L226 K227 E228 G232 N233 D234	L226-E230 PolarHBondContact O-N 3.02Å; K227-E230 PolarHBondContact O-N 2.96Å; E228-E230 PolarHBondContact O-N 3.06Å; E230-G232 VanDerWaalsContact C-N 3.27Å; E230-G232 PolarHBondContact O-N 3.15Å; E230-N233 WeakPolarHBondContact O-CB 3.36Å; E230-N233 PolarHBondContact O-N 3.02Å; E230-N233 VanDerWaalsContact O-N 3.12Å; E230-N233 PolarHBondContact OE2-ND2 3.12Å; E230-D234 PolarHBondContact O-N 2.79Å
231	L	95.1	Very high	93.8	Very high	84 Å²	84	69.9 Å²	69.9	44%	0.44	33%	0.325	S	S	.	.	H	α-helix	trans	-59.5	-40.5	171.7	-67.5	173.4	0	0	0	111.7	K227 E228 D234 A235 H247	K227-L231 WeakPolarHBondContact O-CG 3.26Å; K227-L231 PolarHBondContact O-N 3.41Å; E228-L231 PolarHBondContact O-N 2.67Å; L231-D234 PolarHBondContact O-N 2.86Å; L231-A235 PolarHBondContact O-N 3.33Å; L231-H247 HydrophobicContact CB-CB 4.47Å
232	G	95.9	Very high	94.2	Very high	0 Å²	0	71.1 Å²	71.1	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-63.2	-41.5	173.3	0	0	0	0	0	112.8	E228 K229 E230 D234 A235 Y236 A244 Y248	E228-G232 PolarHBondContact O-N 3.26Å; K229-G232 PolarHBondContact O-N 2.83Å; E230-G232 VanDerWaalsContact C-N 3.27Å; E230-G232 PolarHBondContact O-N 3.15Å; G232-D234 VanDerWaalsContact C-N 3.34Å; G232-D234 PolarHBondContact O-N 2.7Å; G232-A235 PolarHBondContact O-N 2.88Å; G232-Y236 WeakPolarHBondContact O-CB 3.32Å; G232-Y236 PolarHBondContact O-N 3.17Å; G232-A244 WeakPolarHBondContact O-CB 3.42Å; G232-Y248 VanDerWaalsContact C-CZ 3.43Å; G232-Y248 VanDerWaalsContact C-OH 3.23Å; G232-Y248 PolarHBondContact O-OH 2.94Å
233	N	94.6	Very high	94.5	Very high	32 Å²	32	70 Å²	70	17%	0.171	33%	0.33	C	S	.	.	H	α-helix	trans	-62.9	-41.1	176.2	-67.9	-20	0	0	0	111.4	K229 E230 Y236 K237 Y248 N264	K229-N233 PolarHBondContact O-N 2.95Å; K229-N233 PolarHBondContact O-OD1 3.23Å; E230-N233 WeakPolarHBondContact O-CB 3.36Å; E230-N233 PolarHBondContact O-N 3.02Å; E230-N233 VanDerWaalsContact O-N 3.12Å; E230-N233 PolarHBondContact OE2-ND2 3.12Å; N233-Y236 WeakPolarHBondContact O-CB 3.33Å; N233-Y236 PolarHBondContact O-N 3.25Å; N233-K237 WeakPolarHBondContact O-CG 3.25Å; N233-K237 PolarHBondContact O-N 3.13Å; N233-Y248 WeakPolarHBondContact CA-OH 3.43Å; N233-Y248 PolarHBondContact N-OH 3.48Å; N233-Y248 PolarHBondContact OD1-OH 2.8Å; N233-N264 PolarHBondContact OD1-ND2 3.29Å; N233-N264 VanDerWaalsContact OD1-ND2 3.13Å
234	D	95.7	Very high	94.8	Very high	73 Å²	73	67.1 Å²	67.1	39%	0.39	32%	0.318	S	S	.	.	H	α-helix	trans	-67.8	-40.3	178.3	-74.4	-15.7	0	0	0	112	E230 L231 G232 K237 K238	E230-D234 PolarHBondContact O-N 2.79Å; L231-D234 PolarHBondContact O-N 2.86Å; G232-D234 VanDerWaalsContact C-N 3.34Å; G232-D234 PolarHBondContact O-N 2.7Å; D234-K237 IonicContact OD1-NZ 2.87Å; D234-K238 WeakPolarHBondContact O-CG 3.24Å; D234-K238 PolarHBondContact O-N 2.95Å
235	A	95.6	Very high	95.1	Very high	9 Å²	9	64 Å²	64	7%	0.074	30%	0.303	C	S	.	.	H	α-helix	trans	-64.5	-41.1	171.9	0	0	0	0	0	111.6	L231 G232 K237 K238 K239 D240 T243 A244	L231-A235 PolarHBondContact O-N 3.33Å; G232-A235 PolarHBondContact O-N 2.88Å; A235-K237 PolarHBondContact O-N 3.45Å; A235-K238 CarbonylContact O-C 3.53Å; A235-K238 PolarHBondContact O-N 3.2Å; A235-K238 VanDerWaalsContact O-N 3.15Å; A235-K239 PolarHBondContact O-N 3.01Å; A235-D240 HydrophobicContact CB-CB 4.42Å; A235-D240 PolarHBondContact O-N 3.49Å; A235-T243 HydrophobicContact CB-CG2 4.01Å; A235-A244 HydrophobicContact CB-CB 3.91Å
236	Y	94.8	Very high	95.3	Very high	58 Å²	58	71 Å²	71	23%	0.227	33%	0.334	C	S	.	.	H	α-helix	trans	-60	-46	176.7	179.1	-88.5	0	0	0	112.1	G232 N233 K238 K239 F241 A267 V268 E271	G232-Y236 WeakPolarHBondContact O-CB 3.32Å; G232-Y236 PolarHBondContact O-N 3.17Å; N233-Y236 WeakPolarHBondContact O-CB 3.33Å; N233-Y236 PolarHBondContact O-N 3.25Å; Y236-K238 PolarHBondContact O-N 3Å; Y236-K239 WeakPolarHBondContact O-CA 3.38Å; Y236-K239 PolarHBondContact O-N 3.1Å; Y236-F241 HydrophobicContact CD2-CD1 4.27Å; Y236-F241 HydrophobicContact CD2-CE1 4.16Å; Y236-F241 HydrophobicContact CE2-CE1 4.15Å; Y236-A267 HydrophobicContact CE2-CB 4.06Å; Y236-V268 HydrophobicContact CD2-CG2 3.63Å; Y236-V268 HydrophobicContact CE2-CG2 4.01Å; Y236-E271 HydrophobicContact CE2-CG 4.17Å; Y236-E271 WeakPolarHBondContact OH-CG 3.28Å
237	K	95.1	Very high	95.6	Very high	152 Å²	152	71 Å²	71	66%	0.661	33%	0.333	S	S	*	.	H	α-helix	trans	-60	-35.2	176.1	-72.4	171	-173.8	167.9	0	112.1	N233 D234 A235 K239	N233-K237 WeakPolarHBondContact O-CG 3.25Å; N233-K237 PolarHBondContact O-N 3.13Å; D234-K237 IonicContact OD1-NZ 2.87Å; A235-K237 PolarHBondContact O-N 3.45Å; K237-K239 PolarHBondContact O-N 2.86Å
238	K	96.1	Very high	95.8	Very high	170 Å²	170	64.6 Å²	64.6	74%	0.739	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	2.2	174.7	-66.3	171.6	-175.3	173.8	0	113.6	D234 A235 Y236 D240	D234-K238 WeakPolarHBondContact O-CG 3.24Å; D234-K238 PolarHBondContact O-N 2.95Å; A235-K238 CarbonylContact O-C 3.53Å; A235-K238 PolarHBondContact O-N 3.2Å; A235-K238 VanDerWaalsContact O-N 3.15Å; Y236-K238 PolarHBondContact O-N 3Å; K238-D240 PolarHBondContact O-N 2.92Å; K238-D240 VanDerWaalsContact O-N 3.15Å
239	K	93.9	Very high	95.8	Very high	163 Å²	163	66.1 Å²	66.1	71%	0.709	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	19.3	-171.8	-58.5	-177.9	177.6	178	0	113.8	A235 Y236 K237 F241	A235-K239 PolarHBondContact O-N 3.01Å; Y236-K239 WeakPolarHBondContact O-CA 3.38Å; Y236-K239 PolarHBondContact O-N 3.1Å; K237-K239 PolarHBondContact O-N 2.86Å; K239-F241 HydrophobicContact CB-CE1 4.49Å; K239-F241 HydrophobicContact CB-CE2 4.39Å; K239-F241 HydrophobicContact CB-CZ 4.12Å; K239-F241 HydrophobicContact CG-CZ 4.27Å; K239-F241 PolarHBondContact O-N 3.32Å
240	D	96.5	Very high	95.9	Very high	71 Å²	71	69.2 Å²	69.2	38%	0.38	33%	0.327	S	S	.	.			trans	-82.5	77.1	169.8	-176	-3	0	0	0	108.9	A235 K238 D242 T243 A244	A235-D240 HydrophobicContact CB-CB 4.42Å; A235-D240 PolarHBondContact O-N 3.49Å; K238-D240 PolarHBondContact O-N 2.92Å; K238-D240 VanDerWaalsContact O-N 3.15Å; D240-D242 VanDerWaalsContact C-N 3.35Å; D240-D242 PolarHBondContact O-N 3.06Å; D240-T243 WeakPolarHBondContact OD1-CB 3.22Å; D240-T243 PolarHBondContact OD1-N 3.12Å; D240-T243 PolarHBondContact OD1-OG1 3.21Å; D240-T243 VanDerWaalsContact OD1-OG1 3.07Å; D240-T243 WeakPolarHBondContact OD2-CB 3.34Å; D240-T243 PolarHBondContact OD2-OG1 3.08Å; D240-A244 WeakPolarHBondContact O-CB 3.25Å; D240-A244 PolarHBondContact O-N 2.81Å
241	F	96.1	Very high	95.8	Very high	38 Å²	38	65.1 Å²	65.1	17%	0.167	31%	0.308	C	S	.	.	H	α-helix	trans	-66.9	-33.5	-172.1	-66.4	-43.1	0	0	0	113.6	Y236 K239 A244 L245 V268 E271 K272	Y236-F241 HydrophobicContact CD2-CD1 4.27Å; Y236-F241 HydrophobicContact CD2-CE1 4.16Å; Y236-F241 HydrophobicContact CE2-CE1 4.15Å; K239-F241 HydrophobicContact CB-CE1 4.49Å; K239-F241 HydrophobicContact CB-CE2 4.39Å; K239-F241 HydrophobicContact CB-CZ 4.12Å; K239-F241 HydrophobicContact CG-CZ 4.27Å; K239-F241 PolarHBondContact O-N 3.32Å; F241-A244 PolarHBondContact O-N 3.3Å; F241-L245 WeakPolarHBondContact O-CB 3.34Å; F241-L245 VanDerWaalsContact O-CG 3.27Å; F241-L245 WeakPolarHBondContact O-CG 3.34Å; F241-L245 PolarHBondContact O-N 2.9Å; F241-V268 HydrophobicContact CB-CG1 3.59Å; F241-V268 HydrophobicContact CD1-CB 4.49Å; F241-V268 HydrophobicContact CD1-CG1 3.82Å; F241-V268 HydrophobicContact CD1-CG2 4.4Å; F241-V268 HydrophobicContact CG-CG1 3.86Å; F241-E271 HydrophobicContact CE1-CB 3.97Å; F241-E271 HydrophobicContact CE1-CG 4.44Å; F241-E271 HydrophobicContact CE2-CB 4.33Å; F241-E271 HydrophobicContact CZ-CB 3.6Å; F241-E271 HydrophobicContact CZ-CG 4.36Å; F241-K272 HydrophobicContact CB-CD 4.07Å; F241-K272 HydrophobicContact CB-CG 4.42Å; F241-K272 HydrophobicContact CD2-CD 4.26Å; F241-K272 HydrophobicContact CD2-CG 3.71Å; F241-K272 HydrophobicContact CE2-CG 4.21Å; F241-K272 HydrophobicContact CG-CD 4.36Å; F241-K272 HydrophobicContact CG-CG 4.16Å
242	D	95.6	Very high	95.8	Very high	96 Å²	96	64.2 Å²	64.2	51%	0.513	30%	0.3	S	S	.	.	H	α-helix	trans	-74.5	-38.6	-177.7	-62.6	-27.2	0	0	0	110.7	D240 K246 K272	D240-D242 VanDerWaalsContact C-N 3.35Å; D240-D242 PolarHBondContact O-N 3.06Å; D242-K246 WeakPolarHBondContact O-CG 3.48Å; D242-K246 PolarHBondContact O-N 2.96Å; D242-K272 IonicContact OD1-NZ 3.12Å; D242-K272 PolarHBondContact OD1-NZ 2.83Å; D242-K272 VanDerWaalsContact OD1-NZ 3.12Å
243	T	95.8	Very high	95.7	Very high	46 Å²	46	71.5 Å²	71.5	28%	0.282	34%	0.335	S	S	.	.	H	α-helix	trans	-67.4	-40.1	171	-58.6	0	0	0	0	111.5	A235 D240 L245 K246 H247	A235-T243 HydrophobicContact CB-CG2 4.01Å; D240-T243 WeakPolarHBondContact OD1-CB 3.22Å; D240-T243 PolarHBondContact OD1-N 3.12Å; D240-T243 PolarHBondContact OD1-OG1 3.21Å; D240-T243 VanDerWaalsContact OD1-OG1 3.07Å; D240-T243 WeakPolarHBondContact OD2-CB 3.34Å; D240-T243 PolarHBondContact OD2-OG1 3.08Å; T243-L245 PolarHBondContact O-N 3.27Å; T243-K246 PolarHBondContact O-N 2.85Å; T243-H247 PolarHBondContact O-CD2 3.47Å; T243-H247 VanDerWaalsContact O-CD2 3.28Å; T243-H247 PolarHBondContact O-N 2.94Å; T243-H247 VanDerWaalsContact O-N 3.14Å
244	A	96.4	Very high	95.6	Very high	0 Å²	0	72 Å²	72	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-58.7	-46.6	175.5	0	0	0	0	0	112	G232 A235 D240 F241 K246 H247 Y248 V268	G232-A244 WeakPolarHBondContact O-CB 3.42Å; A235-A244 HydrophobicContact CB-CB 3.91Å; D240-A244 WeakPolarHBondContact O-CB 3.25Å; D240-A244 PolarHBondContact O-N 2.81Å; F241-A244 PolarHBondContact O-N 3.3Å; A244-K246 PolarHBondContact O-N 3.32Å; A244-H247 PolarHBondContact O-N 3.05Å; A244-Y248 HydrophobicContact CB-CD2 4.45Å; A244-Y248 HydrophobicContact CB-CE2 3.96Å; A244-Y248 WeakPolarHBondContact O-CD2 3.29Å; A244-Y248 VanDerWaalsContact O-CG 3.28Å; A244-Y248 PolarHBondContact O-N 3.5Å; A244-V268 HydrophobicContact CB-CG2 4.25Å
245	L	96.7	Very high	95.4	Very high	15 Å²	15	69 Å²	69	8%	0.079	32%	0.321	C	S	.	.	H	α-helix	trans	-60.9	-42.2	177.7	-74.4	170	0	0	0	112.3	F241 T243 H247 Y248 D249 Q265 V268 Y269	F241-L245 WeakPolarHBondContact O-CB 3.34Å; F241-L245 VanDerWaalsContact O-CG 3.27Å; F241-L245 WeakPolarHBondContact O-CG 3.34Å; F241-L245 PolarHBondContact O-N 2.9Å; T243-L245 PolarHBondContact O-N 3.27Å; L245-H247 PolarHBondContact O-N 3.45Å; L245-Y248 PolarHBondContact O-N 3.07Å; L245-D249 WeakPolarHBondContact O-CB 3.46Å; L245-D249 PolarHBondContact O-N 2.89Å; L245-Q265 HydrophobicContact CD2-CB 3.93Å; L245-Q265 HydrophobicContact CD2-CG 4Å; L245-V268 HydrophobicContact CD1-CG1 3.89Å; L245-V268 HydrophobicContact CD2-CB 3.99Å; L245-V268 HydrophobicContact CD2-CG1 4.06Å; L245-V268 HydrophobicContact CD2-CG2 4.15Å; L245-V268 HydrophobicContact CG-CB 4.25Å; L245-V268 HydrophobicContact CG-CG1 3.82Å; L245-V268 HydrophobicContact CG-CG2 4.29Å; L245-Y269 HydrophobicContact CD1-CE2 4.16Å; L245-Y269 HydrophobicContact CD2-CD2 4.34Å; L245-Y269 HydrophobicContact CD2-CE2 3.75Å
246	K	97.3	Very high	95.2	Very high	149 Å²	149	72.5 Å²	72.5	65%	0.648	34%	0.343	S	S	*	.	H	α-helix	trans	-58.3	-46.6	176.2	-73.2	172.6	-175.4	172.2	0	112.1	D242 T243 A244 D249 K250	D242-K246 WeakPolarHBondContact O-CG 3.48Å; D242-K246 PolarHBondContact O-N 2.96Å; T243-K246 PolarHBondContact O-N 2.85Å; A244-K246 PolarHBondContact O-N 3.32Å; K246-D249 PolarHBondContact O-N 2.96Å; K246-K250 PolarHBondContact O-N 3.39Å
247	H	97.6	Very high	94.9	Very high	48 Å²	48	72.1 Å²	72.1	22%	0.222	35%	0.347	C	S	.	.	H	α-helix	trans	-67	-40.2	178.5	-78.1	-60.5	0	0	0	112.3	E228 L231 T243 A244 L245 K250 A251	E228-H247 WeakPolarHBondContact O-CB 3.18Å; E228-H247 IonicContact OE2-CE1 3.57Å; E228-H247 IonicContact OE2-CG 3.76Å; E228-H247 IonicContact OE2-ND1 2.71Å; E228-H247 PolarHBondContact OE2-ND1 2.83Å; L231-H247 HydrophobicContact CB-CB 4.47Å; T243-H247 PolarHBondContact O-CD2 3.47Å; T243-H247 VanDerWaalsContact O-CD2 3.28Å; T243-H247 PolarHBondContact O-N 2.94Å; T243-H247 VanDerWaalsContact O-N 3.14Å; A244-H247 PolarHBondContact O-N 3.05Å; L245-H247 PolarHBondContact O-N 3.45Å; H247-K250 PolarHBondContact O-N 3.4Å; H247-A251 WeakPolarHBondContact O-CB 3.48Å; H247-A251 PolarHBondContact O-N 3.1Å
248	Y	96.9	Very high	94.5	Very high	4 Å²	4	66.5 Å²	66.5	2%	0.016	32%	0.324	C	S	.	.	H	α-helix	trans	-67.6	-36.3	175.1	-61.9	-40.4	0	0	0	113.3	K229 G232 N233 A244 L245 A251 K252 N264 Q265 V268	K229-Y248 HydrophobicContact CG-CE1 4.49Å; G232-Y248 VanDerWaalsContact C-CZ 3.43Å; G232-Y248 VanDerWaalsContact C-OH 3.23Å; G232-Y248 PolarHBondContact O-OH 2.94Å; N233-Y248 WeakPolarHBondContact CA-OH 3.43Å; N233-Y248 PolarHBondContact N-OH 3.48Å; N233-Y248 PolarHBondContact OD1-OH 2.8Å; A244-Y248 HydrophobicContact CB-CD2 4.45Å; A244-Y248 HydrophobicContact CB-CE2 3.96Å; A244-Y248 WeakPolarHBondContact O-CD2 3.29Å; A244-Y248 VanDerWaalsContact O-CG 3.28Å; A244-Y248 PolarHBondContact O-N 3.5Å; L245-Y248 PolarHBondContact O-N 3.07Å; Y248-A251 PolarHBondContact O-N 3.3Å; Y248-K252 WeakPolarHBondContact O-CB 3.11Å; Y248-K252 PolarHBondContact O-N 2.75Å; Y248-N264 HydrophobicContact CD1-CB 3.99Å; Y248-N264 HydrophobicContact CD2-CB 4.04Å; Y248-N264 HydrophobicContact CE1-CB 3.7Å; Y248-N264 HydrophobicContact CE2-CB 3.76Å; Y248-N264 HydrophobicContact CG-CB 4.15Å; Y248-Q265 HydrophobicContact CD2-CG 4.17Å; Y248-Q265 HydrophobicContact CG-CG 4.27Å; Y248-V268 HydrophobicContact CD2-CG2 4.37Å; Y248-V268 HydrophobicContact CE2-CG2 3.97Å
249	D	96.6	Very high	94.3	Very high	58 Å²	58	58.4 Å²	58.4	31%	0.31	29%	0.289	S	S	.	.	H	α-helix	trans	-63.7	-44.6	173.7	-84.9	-41.1	0	0	0	111.1	L245 K246 A251 K252 E253 Q265	L245-D249 WeakPolarHBondContact O-CB 3.46Å; L245-D249 PolarHBondContact O-N 2.89Å; K246-D249 PolarHBondContact O-N 2.96Å; D249-A251 VanDerWaalsContact C-N 3.34Å; D249-A251 PolarHBondContact O-N 3.21Å; D249-K252 WeakPolarHBondContact O-CB 3.46Å; D249-K252 PolarHBondContact O-N 3.31Å; D249-K252 IonicContact OD1-NZ 2.71Å; D249-K252 PolarHBondContact OD1-NZ 2.72Å; D249-E253 WeakPolarHBondContact O-CG 3.3Å; D249-E253 PolarHBondContact O-N 2.95Å; D249-Q265 PolarHBondContact OD1-NE2 2.78Å; D249-Q265 PolarHBondContact OD2-NE2 3.01Å
250	K	95.5	Very high	94.2	Very high	101 Å²	101	51.9 Å²	51.9	44%	0.439	26%	0.263	S	S	.	.	H	α-helix	trans	-63	-39.2	175.2	-167.4	171	174.2	-157.1	0	112.4	E228 K246 H247 K252 E253 L254	E228-K250 HydrophobicContact CG-CB 4.45Å; E228-K250 HydrophobicContact CG-CD 4.18Å; E228-K250 HydrophobicContact CG-CG 4.14Å; E228-K250 WeakPolarHBondContact OE1-CD 3.33Å; E228-K250 VanDerWaalsContact OE1-CE 3.23Å; E228-K250 WeakPolarHBondContact OE1-CE 3.27Å; E228-K250 IonicContact OE1-NZ 2.7Å; E228-K250 PolarHBondContact OE1-NZ 3.13Å; K246-K250 PolarHBondContact O-N 3.39Å; H247-K250 PolarHBondContact O-N 3.4Å; K250-K252 VanDerWaalsContact C-N 3.34Å; K250-K252 PolarHBondContact O-N 2.74Å; K250-E253 PolarHBondContact O-N 3.48Å; K250-L254 HydrophobicContact CG-CD1 4.37Å; K250-L254 VanDerWaalsContact O-CG 3.29Å; K250-L254 WeakPolarHBondContact O-CG 3.26Å; K250-L254 PolarHBondContact O-N 3.34Å; K250-L254 VanDerWaalsContact O-N 3.12Å
251	A	94.3	Very high	94.1	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.4	-41.9	173.6	0	0	0	0	0	112.1	A225 E228 K229 H247 Y248 D249 L254 D255 Y261	A225-A251 WeakPolarHBondContact CB-O 3.38Å; A225-A251 WeakPolarHBondContact O-CB 3.42Å; E228-A251 HydrophobicContact CB-CB 3.95Å; K229-A251 HydrophobicContact CB-CB 4.42Å; H247-A251 WeakPolarHBondContact O-CB 3.48Å; H247-A251 PolarHBondContact O-N 3.1Å; Y248-A251 PolarHBondContact O-N 3.3Å; D249-A251 VanDerWaalsContact C-N 3.34Å; D249-A251 PolarHBondContact O-N 3.21Å; A251-L254 PolarHBondContact O-N 3.33Å; A251-D255 PolarHBondContact O-N 3.3Å; A251-Y261 HydrophobicContact CB-CD1 3.78Å; A251-Y261 HydrophobicContact CB-CD2 4.22Å; A251-Y261 HydrophobicContact CB-CE1 4.02Å; A251-Y261 HydrophobicContact CB-CE2 4.41Å; A251-Y261 HydrophobicContact CB-CG 3.9Å
252	K	94.6	Very high	94	Very high	65 Å²	65	47.4 Å²	47.4	28%	0.283	24%	0.24	S	C	.	.	H	α-helix	trans	-67.1	-36.1	176.9	-173.6	-173.1	76.2	-151.3	0	112.8	Y248 D249 K250 D255 P256 I262	Y248-K252 WeakPolarHBondContact O-CB 3.11Å; Y248-K252 PolarHBondContact O-N 2.75Å; D249-K252 WeakPolarHBondContact O-CB 3.46Å; D249-K252 PolarHBondContact O-N 3.31Å; D249-K252 IonicContact OD1-NZ 2.71Å; D249-K252 PolarHBondContact OD1-NZ 2.72Å; K250-K252 VanDerWaalsContact C-N 3.34Å; K250-K252 PolarHBondContact O-N 2.74Å; K252-D255 CarbonylContact O-C 3.58Å; K252-P256 VanDerWaalsContact O-CA 3.23Å; K252-P256 WeakPolarHBondContact O-CA 3.32Å; K252-P256 VanDerWaalsContact O-N 3.14Å; K252-I262 HydrophobicContact CD-CD1 4.45Å; K252-I262 HydrophobicContact CD-CG1 3.95Å; K252-I262 HydrophobicContact CG-CG1 4.4Å
253	E	94.4	Very high	94	Very high	153 Å²	153	43.1 Å²	43.1	72%	0.715	22%	0.218	S	C	*	.	H	α-helix	trans	-65.5	-39.3	174.3	-73.7	174.6	-178.6	0	0	112	D249 K250	D249-E253 WeakPolarHBondContact O-CG 3.3Å; D249-E253 PolarHBondContact O-N 2.95Å; K250-E253 PolarHBondContact O-N 3.48Å
254	L	93.1	Very high	94	Very high	43 Å²	43	42.2 Å²	42.2	23%	0.225	21%	0.211	C	C	.	.	H	α-helix	trans	-73.9	-35	179.8	-70.4	168.7	0	0	0	113.2	N221 Q224 A225 E228 K250 A251	N221-L254 PolarHBondContact ND2-O 2.89Å; Q224-L254 HydrophobicContact CB-CD1 3.82Å; A225-L254 HydrophobicContact CB-CB 3.81Å; E228-L254 HydrophobicContact CG-CD1 4.08Å; K250-L254 HydrophobicContact CG-CD1 4.37Å; K250-L254 VanDerWaalsContact O-CG 3.29Å; K250-L254 WeakPolarHBondContact O-CG 3.26Å; K250-L254 PolarHBondContact O-N 3.34Å; K250-L254 VanDerWaalsContact O-N 3.12Å; A251-L254 PolarHBondContact O-N 3.33Å
255	D	91.2	Very high	94	Very high	9 Å²	9	42.5 Å²	42.5	5%	0.048	21%	0.212	C	C	.	.			trans	-142.4	88	177.2	178.3	19.3	0	0	0	111.1	K222 A225 A251 K252 T257 Y261	K222-D255 HydrophobicContact CG-CB 4.35Å; A225-D255 HydrophobicContact CB-CB 3.74Å; A251-D255 PolarHBondContact O-N 3.3Å; K252-D255 CarbonylContact O-C 3.58Å; D255-T257 PolarHBondContact O-N 3.45Å; D255-T257 PolarHBondContact OD1-N 3.41Å; D255-T257 PolarHBondContact OD1-OG1 3.32Å; D255-Y261 HydrophobicContact CB-CE2 3.98Å; D255-Y261 WeakPolarHBondContact O-CE2 3.34Å
256	P	90.1	Very high	94	Very high	84 Å²	84	41.8 Å²	41.8	55%	0.545	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-7.1	-177.3	29	-35.5	0	0	0	113.5	K252	K252-P256 VanDerWaalsContact O-CA 3.23Å; K252-P256 WeakPolarHBondContact O-CA 3.32Å; K252-P256 VanDerWaalsContact O-N 3.14Å
257	T	88.6	Confident	94	Very high	49 Å²	49	35.1 Å²	35.1	30%	0.301	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-12.6	-175.5	66.2	0	0	0	0	113.3	D255	D255-T257 PolarHBondContact O-N 3.45Å; D255-T257 PolarHBondContact OD1-N 3.41Å; D255-T257 PolarHBondContact OD1-OG1 3.32Å
258	N	88.1	Confident	94	Very high	34 Å²	34	32.9 Å²	32.9	18%	0.182	17%	0.171	C	C	.	.			trans	-101.3	111.3	-176.3	-171.9	-27.2	0	0	0	111.9	T260 Y261 E294	N258-T260 PolarHBondContact O-N 3.42Å; N258-T260 WeakPolarHBondContact OD1-CB 3.44Å; N258-T260 PolarHBondContact OD1-N 3Å; N258-T260 PolarHBondContact OD1-OG1 2.92Å; N258-Y261 HydrophobicContact CB-CD2 3.98Å; N258-Y261 HydrophobicContact CB-CE2 3.52Å; N258-Y261 WeakPolarHBondContact O-CD2 3.36Å; N258-E294 VanDerWaalsContact CA-OE1 3.22Å; N258-E294 WeakPolarHBondContact CA-OE1 3.34Å
259	M	92	Very high	94	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64	-23	-179.6	74.1	173.7	-67.3	0	0	112.7	Y261 I262 T263 A285 V288 E294 Q298 I299 A302	M259-Y261 VanDerWaalsContact C-N 3.26Å; M259-Y261 PolarHBondContact O-N 3.08Å; M259-I262 PolarHBondContact O-N 3.06Å; M259-I262 VanDerWaalsContact O-N 3.07Å; M259-T263 HydrophobicContact CE-CG2 3.72Å; M259-T263 WeakPolarHBondContact O-CG2 3.11Å; M259-T263 PolarHBondContact O-N 3.48Å; M259-A285 HydrophobicContact CB-CB 4.18Å; M259-A285 WeakPolarHBondContact CB-O 3.18Å; M259-A285 HydrophobicContact CE-CB 3.94Å; M259-A285 WeakPolarHBondContact CE-O 3.37Å; M259-V288 HydrophobicContact CB-CG1 4.4Å; M259-E294 WeakPolarHBondContact CG-OE1 3.36Å; M259-E294 WeakPolarHBondContact CG-OE2 3.37Å; M259-E294 PolarHBondContact N-OE1 3.41Å; M259-Q298 HydrophobicContact CE-CB 4.41Å; M259-Q298 HydrophobicContact CG-CB 4.25Å; M259-Q298 HydrophobicContact SD-CB 3.64Å; M259-I299 HydrophobicContact CE-CG1 4.39Å; M259-I299 HydrophobicContact SD-CG1 3.89Å; M259-A302 HydrophobicContact CE-CB 3.92Å
260	T	91.6	Very high	94.1	Very high	26 Å²	26	34.2 Å²	34.2	16%	0.16	17%	0.173	C	C	.	.	H	α-helix	trans	-59	-39.3	-173.6	-56.8	0	0	0	0	111.2	N258 I262 T263 N264 Q298	N258-T260 PolarHBondContact O-N 3.42Å; N258-T260 WeakPolarHBondContact OD1-CB 3.44Å; N258-T260 PolarHBondContact OD1-N 3Å; N258-T260 PolarHBondContact OD1-OG1 2.92Å; T260-I262 VanDerWaalsContact C-N 3.34Å; T260-I262 PolarHBondContact O-N 2.92Å; T260-T263 WeakPolarHBondContact CA-OG1 3.38Å; T260-T263 PolarHBondContact O-N 3.09Å; T260-T263 PolarHBondContact O-OG1 3.05Å; T260-N264 PolarHBondContact O-N 2.93Å; T260-N264 PolarHBondContact O-OD1 3.08Å; T260-Q298 PolarHBondContact OG1-NE2 3.24Å
261	Y	93.5	Very high	94.1	Very high	1 Å²	1	34.5 Å²	34.5	0%	0.004	18%	0.176	C	C	.	.	H	α-helix	trans	-61.1	-44.7	177.9	-47.5	-45.5	0	0	0	111.3	A225 K229 A251 D255 N258 M259 T263 N264 Q265	A225-Y261 HydrophobicContact CB-CE2 4.18Å; A225-Y261 WeakPolarHBondContact CB-OH 3.47Å; K229-Y261 HydrophobicContact CB-CD1 3.84Å; K229-Y261 HydrophobicContact CB-CE1 3.62Å; K229-Y261 HydrophobicContact CD-CD1 4.21Å; K229-Y261 HydrophobicContact CD-CE1 3.88Å; K229-Y261 HydrophobicContact CG-CD1 3.82Å; K229-Y261 HydrophobicContact CG-CE1 3.83Å; A251-Y261 HydrophobicContact CB-CD1 3.78Å; A251-Y261 HydrophobicContact CB-CD2 4.22Å; A251-Y261 HydrophobicContact CB-CE1 4.02Å; A251-Y261 HydrophobicContact CB-CE2 4.41Å; A251-Y261 HydrophobicContact CB-CG 3.9Å; D255-Y261 HydrophobicContact CB-CE2 3.98Å; D255-Y261 WeakPolarHBondContact O-CE2 3.34Å; N258-Y261 HydrophobicContact CB-CD2 3.98Å; N258-Y261 HydrophobicContact CB-CE2 3.52Å; N258-Y261 WeakPolarHBondContact O-CD2 3.36Å; M259-Y261 VanDerWaalsContact C-N 3.26Å; M259-Y261 PolarHBondContact O-N 3.08Å; Y261-T263 PolarHBondContact O-N 3.27Å; Y261-N264 WeakPolarHBondContact O-CB 3.46Å; Y261-N264 PolarHBondContact O-N 3.21Å; Y261-Q265 WeakPolarHBondContact O-CG 3.42Å; Y261-Q265 PolarHBondContact O-N 3.18Å
262	I	94.8	Very high	94.1	Very high	14 Å²	14	39.2 Å²	39.2	7%	0.072	20%	0.196	C	C	.	.	H	α-helix	trans	-65.7	-40.8	177.3	-51.8	174.6	0	0	0	110.3	K252 M259 T260 N264 Q265 A266 L281 K284 A285 V288	K252-I262 HydrophobicContact CD-CD1 4.45Å; K252-I262 HydrophobicContact CD-CG1 3.95Å; K252-I262 HydrophobicContact CG-CG1 4.4Å; M259-I262 PolarHBondContact O-N 3.06Å; M259-I262 VanDerWaalsContact O-N 3.07Å; T260-I262 VanDerWaalsContact C-N 3.34Å; T260-I262 PolarHBondContact O-N 2.92Å; I262-N264 VanDerWaalsContact C-N 3.27Å; I262-N264 PolarHBondContact O-N 3.18Å; I262-Q265 WeakPolarHBondContact O-CB 3.41Å; I262-Q265 PolarHBondContact O-N 2.95Å; I262-A266 PolarHBondContact O-N 3.03Å; I262-L281 HydrophobicContact CG2-CB 4.22Å; I262-L281 HydrophobicContact CG2-CD2 4.09Å; I262-L281 WeakPolarHBondContact CG2-O 3.29Å; I262-K284 HydrophobicContact CG2-CB 4.5Å; I262-A285 HydrophobicContact CB-CB 3.85Å; I262-A285 HydrophobicContact CG2-CB 3.83Å; I262-V288 HydrophobicContact CD1-CB 4.34Å; I262-V288 HydrophobicContact CD1-CG2 3.86Å
263	T	95.1	Very high	94.2	Very high	7 Å²	7	37.9 Å²	37.9	4%	0.043	20%	0.201	C	C	.	.	H	α-helix	trans	-66.2	-28.6	176.2	68.2	0	0	0	0	113.4	M259 T260 Y261 A266 A267 A285 A302 R305	M259-T263 HydrophobicContact CE-CG2 3.72Å; M259-T263 WeakPolarHBondContact O-CG2 3.11Å; M259-T263 PolarHBondContact O-N 3.48Å; T260-T263 WeakPolarHBondContact CA-OG1 3.38Å; T260-T263 PolarHBondContact O-N 3.09Å; T260-T263 PolarHBondContact O-OG1 3.05Å; Y261-T263 PolarHBondContact O-N 3.27Å; T263-A266 WeakPolarHBondContact O-CB 3.38Å; T263-A266 PolarHBondContact O-N 2.71Å; T263-A267 PolarHBondContact O-N 2.86Å; T263-A285 HydrophobicContact CG2-CB 3.52Å; T263-A302 HydrophobicContact CG2-CB 4.03Å; T263-R305 PolarHBondContact O-NH1 3.37Å
264	N	95.8	Very high	94.3	Very high	26 Å²	26	33.9 Å²	33.9	14%	0.139	18%	0.184	C	C	.	.	H	α-helix	trans	-73.5	-38.1	173.8	-73.8	2	0	0	0	111.3	N233 Y248 T260 Y261 I262 A266 A267 V268	N233-N264 PolarHBondContact OD1-ND2 3.29Å; N233-N264 VanDerWaalsContact OD1-ND2 3.13Å; Y248-N264 HydrophobicContact CD1-CB 3.99Å; Y248-N264 HydrophobicContact CD2-CB 4.04Å; Y248-N264 HydrophobicContact CE1-CB 3.7Å; Y248-N264 HydrophobicContact CE2-CB 3.76Å; Y248-N264 HydrophobicContact CG-CB 4.15Å; T260-N264 PolarHBondContact O-N 2.93Å; T260-N264 PolarHBondContact O-OD1 3.08Å; Y261-N264 WeakPolarHBondContact O-CB 3.46Å; Y261-N264 PolarHBondContact O-N 3.21Å; I262-N264 VanDerWaalsContact C-N 3.27Å; I262-N264 PolarHBondContact O-N 3.18Å; N264-A266 VanDerWaalsContact C-N 3.32Å; N264-A266 PolarHBondContact O-N 3.04Å; N264-A267 WeakPolarHBondContact O-CB 3.43Å; N264-A267 PolarHBondContact O-N 3.39Å; N264-V268 PolarHBondContact O-N 2.69Å; N264-V268 VanDerWaalsContact O-N 3.12Å
265	Q	97	Very high	94.5	Very high	7 Å²	7	34.4 Å²	34.4	3%	0.033	18%	0.184	C	C	.	.	H	α-helix	trans	-60.2	-44	168.7	-61.8	-175.7	-66.5	0	0	111	L245 Y248 D249 Y261 I262 A267 V268 Y269 L281	L245-Q265 HydrophobicContact CD2-CB 3.93Å; L245-Q265 HydrophobicContact CD2-CG 4Å; Y248-Q265 HydrophobicContact CD2-CG 4.17Å; Y248-Q265 HydrophobicContact CG-CG 4.27Å; D249-Q265 PolarHBondContact OD1-NE2 2.78Å; D249-Q265 PolarHBondContact OD2-NE2 3.01Å; Y261-Q265 WeakPolarHBondContact O-CG 3.42Å; Y261-Q265 PolarHBondContact O-N 3.18Å; I262-Q265 WeakPolarHBondContact O-CB 3.41Å; I262-Q265 PolarHBondContact O-N 2.95Å; Q265-A267 PolarHBondContact O-N 2.99Å; Q265-V268 WeakPolarHBondContact O-CB 3.28Å; Q265-V268 PolarHBondContact O-N 3.09Å; Q265-Y269 VanDerWaalsContact O-CD2 3.28Å; Q265-Y269 WeakPolarHBondContact O-CD2 3.37Å; Q265-Y269 PolarHBondContact O-N 3.24Å; Q265-Y269 VanDerWaalsContact O-N 3.12Å; Q265-L281 HydrophobicContact CB-CD1 3.98Å
266	A	97.2	Very high	94.8	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-59	-37.1	175.4	0	0	0	0	0	112.1	I262 T263 N264 Y269 F270 C278 L281 C282	I262-A266 PolarHBondContact O-N 3.03Å; T263-A266 WeakPolarHBondContact O-CB 3.38Å; T263-A266 PolarHBondContact O-N 2.71Å; N264-A266 VanDerWaalsContact C-N 3.32Å; N264-A266 PolarHBondContact O-N 3.04Å; A266-Y269 PolarHBondContact O-N 3.39Å; A266-F270 WeakPolarHBondContact O-CB 3.4Å; A266-F270 PolarHBondContact O-N 3.48Å; A266-C278 PolarHBondContact O-SG 2.9Å; A266-C278 VanDerWaalsContact O-SG 3.38Å; A266-L281 HydrophobicContact CB-CB 3.76Å; A266-C282 VanDerWaalsContact CB-SG 3.52Å
267	A	96.6	Very high	95.1	Very high	9 Å²	9	38.1 Å²	38.1	7%	0.074	20%	0.196	C	C	.	.	H	α-helix	trans	-62.5	-40.8	174	0	0	0	0	0	112.1	Y236 T263 N264 Q265 F270 E271	Y236-A267 HydrophobicContact CE2-CB 4.06Å; T263-A267 PolarHBondContact O-N 2.86Å; N264-A267 WeakPolarHBondContact O-CB 3.43Å; N264-A267 PolarHBondContact O-N 3.39Å; Q265-A267 PolarHBondContact O-N 2.99Å; A267-F270 WeakPolarHBondContact O-CB 3.16Å; A267-F270 PolarHBondContact O-N 3.19Å; A267-E271 PolarHBondContact O-N 3.07Å
268	V	97.3	Very high	95.6	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-58.4	-50.7	174.2	174.6	0	0	0	0	111.2	Y236 F241 A244 L245 Y248 N264 Q265 F270 E271 K272	Y236-V268 HydrophobicContact CD2-CG2 3.63Å; Y236-V268 HydrophobicContact CE2-CG2 4.01Å; F241-V268 HydrophobicContact CB-CG1 3.59Å; F241-V268 HydrophobicContact CD1-CB 4.49Å; F241-V268 HydrophobicContact CD1-CG1 3.82Å; F241-V268 HydrophobicContact CD1-CG2 4.4Å; F241-V268 HydrophobicContact CG-CG1 3.86Å; A244-V268 HydrophobicContact CB-CG2 4.25Å; L245-V268 HydrophobicContact CD1-CG1 3.89Å; L245-V268 HydrophobicContact CD2-CB 3.99Å; L245-V268 HydrophobicContact CD2-CG1 4.06Å; L245-V268 HydrophobicContact CD2-CG2 4.15Å; L245-V268 HydrophobicContact CG-CB 4.25Å; L245-V268 HydrophobicContact CG-CG1 3.82Å; L245-V268 HydrophobicContact CG-CG2 4.29Å; Y248-V268 HydrophobicContact CD2-CG2 4.37Å; Y248-V268 HydrophobicContact CE2-CG2 3.97Å; N264-V268 PolarHBondContact O-N 2.69Å; N264-V268 VanDerWaalsContact O-N 3.12Å; Q265-V268 WeakPolarHBondContact O-CB 3.28Å; Q265-V268 PolarHBondContact O-N 3.09Å; V268-F270 VanDerWaalsContact C-N 3.27Å; V268-F270 PolarHBondContact O-N 3.38Å; V268-E271 PolarHBondContact O-N 3.44Å; V268-K272 HydrophobicContact CG1-CD 3.88Å; V268-K272 HydrophobicContact CG1-CG 4.34Å; V268-K272 WeakPolarHBondContact O-CG 3.34Å; V268-K272 PolarHBondContact O-N 3.22Å
269	Y	97.4	Very high	96	Very high	58 Å²	58	34.9 Å²	34.9	23%	0.227	18%	0.176	C	C	.	.	H	α-helix	trans	-66.4	-31.5	-179.3	-74.8	-77.4	0	0	0	112.5	L245 Q265 A266 K272 G273 D274 K277 L281	L245-Y269 HydrophobicContact CD1-CE2 4.16Å; L245-Y269 HydrophobicContact CD2-CD2 4.34Å; L245-Y269 HydrophobicContact CD2-CE2 3.75Å; Q265-Y269 VanDerWaalsContact O-CD2 3.28Å; Q265-Y269 WeakPolarHBondContact O-CD2 3.37Å; Q265-Y269 PolarHBondContact O-N 3.24Å; Q265-Y269 VanDerWaalsContact O-N 3.12Å; A266-Y269 PolarHBondContact O-N 3.39Å; Y269-K272 PolarHBondContact O-N 3.23Å; Y269-G273 PolarHBondContact O-N 3.5Å; Y269-D274 HydrophobicContact CD1-CB 4.06Å; Y269-D274 CarbonylContact O-C 3.5Å; Y269-D274 PolarHBondContact O-N 3.08Å; Y269-K277 HydrophobicContact CD1-CB 3.85Å; Y269-K277 HydrophobicContact CD1-CG 3.74Å; Y269-K277 HydrophobicContact CD2-CG 3.95Å; Y269-K277 HydrophobicContact CE1-CB 4.35Å; Y269-K277 HydrophobicContact CE1-CG 3.83Å; Y269-K277 HydrophobicContact CE2-CG 4.04Å; Y269-K277 HydrophobicContact CG-CB 3.96Å; Y269-K277 HydrophobicContact CG-CG 3.8Å; Y269-L281 HydrophobicContact CD2-CD1 3.33Å; Y269-L281 HydrophobicContact CE2-CD1 3.64Å; Y269-L281 HydrophobicContact CG-CD1 4.33Å
270	F	97.2	Very high	96.3	Very high	33 Å²	33	38 Å²	38	15%	0.145	19%	0.191	C	C	.	.	H	α-helix	trans	-59.7	-46.8	171	-177.5	-92	0	0	0	111.9	A266 A267 V268 G273 Y275 C278 N308 K312	A266-F270 WeakPolarHBondContact O-CB 3.4Å; A266-F270 PolarHBondContact O-N 3.48Å; A267-F270 WeakPolarHBondContact O-CB 3.16Å; A267-F270 PolarHBondContact O-N 3.19Å; V268-F270 VanDerWaalsContact C-N 3.27Å; V268-F270 PolarHBondContact O-N 3.38Å; F270-G273 PolarHBondContact O-N 3.09Å; F270-Y275 HydrophobicContact CD2-CD1 4.04Å; F270-Y275 HydrophobicContact CD2-CE1 4.02Å; F270-Y275 HydrophobicContact CE2-CD1 4.3Å; F270-Y275 HydrophobicContact CE2-CE1 4.03Å; F270-C278 HydrophobicContact CB-CB 4.31Å; F270-N308 HydrophobicContact CE2-CB 3.77Å; F270-N308 HydrophobicContact CZ-CB 3.95Å; F270-K312 HydrophobicContact CE2-CG 4.24Å; F270-K312 HydrophobicContact CZ-CG 3.94Å
271	E	96	Very high	96.6	Very high	106 Å²	106	37.6 Å²	37.6	50%	0.495	19%	0.187	S	C	.	.	H	α-helix	trans	-70	-33	177.8	-65.6	-58.5	150.4	0	0	112.8	Y236 F241 A267 V268 G273	Y236-E271 HydrophobicContact CE2-CG 4.17Å; Y236-E271 WeakPolarHBondContact OH-CG 3.28Å; F241-E271 HydrophobicContact CE1-CB 3.97Å; F241-E271 HydrophobicContact CE1-CG 4.44Å; F241-E271 HydrophobicContact CE2-CB 4.33Å; F241-E271 HydrophobicContact CZ-CB 3.6Å; F241-E271 HydrophobicContact CZ-CG 4.36Å; A267-E271 PolarHBondContact O-N 3.07Å; V268-E271 PolarHBondContact O-N 3.44Å; E271-G273 PolarHBondContact O-N 2.99Å
272	K	95.7	Very high	96.8	Very high	100 Å²	100	37.6 Å²	37.6	44%	0.435	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-8.7	172.4	-67.6	178.7	81.8	161.2	0	113	F241 D242 V268 Y269 D274	F241-K272 HydrophobicContact CB-CD 4.07Å; F241-K272 HydrophobicContact CB-CG 4.42Å; F241-K272 HydrophobicContact CD2-CD 4.26Å; F241-K272 HydrophobicContact CD2-CG 3.71Å; F241-K272 HydrophobicContact CE2-CG 4.21Å; F241-K272 HydrophobicContact CG-CD 4.36Å; F241-K272 HydrophobicContact CG-CG 4.16Å; D242-K272 IonicContact OD1-NZ 3.12Å; D242-K272 PolarHBondContact OD1-NZ 2.83Å; D242-K272 VanDerWaalsContact OD1-NZ 3.12Å; V268-K272 HydrophobicContact CG1-CD 3.88Å; V268-K272 HydrophobicContact CG1-CG 4.34Å; V268-K272 WeakPolarHBondContact O-CG 3.34Å; V268-K272 PolarHBondContact O-N 3.22Å; Y269-K272 PolarHBondContact O-N 3.23Å; K272-D274 VanDerWaalsContact C-N 3.3Å
273	G	95.4	Very high	96.9	Very high	37 Å²	37	41.1 Å²	41.1	38%	0.381	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	80	5	-177.1	0	0	0	0	0	114.6	Y269 F270 E271 Y275	Y269-G273 PolarHBondContact O-N 3.5Å; F270-G273 PolarHBondContact O-N 3.09Å; E271-G273 PolarHBondContact O-N 2.99Å; G273-Y275 VanDerWaalsContact C-N 3.31Å; G273-Y275 PolarHBondContact O-N 3.2Å
274	D	97.1	Very high	97	Very high	68 Å²	68	45.6 Å²	45.6	36%	0.364	22%	0.222	S	C	.	.			trans	-84.4	78.5	173.5	-171.2	-13.9	0	0	0	109.9	Y269 K272 N276 K277 C278	Y269-D274 HydrophobicContact CD1-CB 4.06Å; Y269-D274 CarbonylContact O-C 3.5Å; Y269-D274 PolarHBondContact O-N 3.08Å; K272-D274 VanDerWaalsContact C-N 3.3Å; D274-N276 VanDerWaalsContact C-N 3.29Å; D274-N276 PolarHBondContact O-N 3.04Å; D274-N276 PolarHBondContact OD1-N 3.31Å; D274-K277 HydrophobicContact CB-CB 4.31Å; D274-K277 VanDerWaalsContact CG-CB 3.42Å; D274-K277 PolarHBondContact O-N 3.07Å; D274-K277 WeakPolarHBondContact OD1-CB 3.49Å; D274-K277 PolarHBondContact OD1-N 3.22Å; D274-K277 WeakPolarHBondContact OD2-CB 3.48Å; D274-C278 WeakPolarHBondContact O-CB 3.4Å; D274-C278 PolarHBondContact O-N 3.39Å
275	Y	97.5	Very high	97	Very high	54 Å²	54	44.3 Å²	44.3	21%	0.212	22%	0.216	C	C	.	.	H	α-helix	trans	-66.5	-30.1	-178	-59.1	-49.4	0	0	0	112.8	F270 G273 R279 K312 E313	F270-Y275 HydrophobicContact CD2-CD1 4.04Å; F270-Y275 HydrophobicContact CD2-CE1 4.02Å; F270-Y275 HydrophobicContact CE2-CD1 4.3Å; F270-Y275 HydrophobicContact CE2-CE1 4.03Å; G273-Y275 VanDerWaalsContact C-N 3.31Å; G273-Y275 PolarHBondContact O-N 3.2Å; Y275-R279 VanDerWaalsContact O-CG 3.26Å; Y275-R279 WeakPolarHBondContact O-CG 3.46Å; Y275-R279 PolarHBondContact O-N 3.07Å; Y275-R279 PolarHBondContact O-NE 3.35Å; Y275-K312 HydrophobicContact CE1-CB 3.96Å; Y275-K312 HydrophobicContact CE1-CG 4.28Å; Y275-K312 HydrophobicContact CE2-CB 3.99Å; Y275-E313 HydrophobicContact CD2-CG 3.55Å; Y275-E313 HydrophobicContact CE2-CG 4.23Å; Y275-E313 HydrophobicContact CG-CG 4.2Å
276	N	96.8	Very high	96.9	Very high	107 Å²	107	44.2 Å²	44.2	57%	0.572	22%	0.215	S	C	*	.	H	α-helix	trans	-64.2	-49.9	175.6	-73.4	-34	0	0	0	110.9	D274 C278 R279 E280	D274-N276 VanDerWaalsContact C-N 3.29Å; D274-N276 PolarHBondContact O-N 3.04Å; D274-N276 PolarHBondContact OD1-N 3.31Å; N276-C278 VanDerWaalsContact C-N 3.34Å; N276-C278 PolarHBondContact O-N 3.1Å; N276-R279 PolarHBondContact O-N 3.27Å; N276-R279 PolarHBondContact OD1-NH2 3.38Å; N276-E280 PolarHBondContact O-N 3.2Å
277	K	97	Very high	96.8	Very high	64 Å²	64	48.6 Å²	48.6	28%	0.278	24%	0.238	S	C	.	.	H	α-helix	trans	-67	-37.1	179.1	-163.7	71.5	-169.8	169.1	0	112.4	Y269 D274 R279 E280 L281	Y269-K277 HydrophobicContact CD1-CB 3.85Å; Y269-K277 HydrophobicContact CD1-CG 3.74Å; Y269-K277 HydrophobicContact CD2-CG 3.95Å; Y269-K277 HydrophobicContact CE1-CB 4.35Å; Y269-K277 HydrophobicContact CE1-CG 3.83Å; Y269-K277 HydrophobicContact CE2-CG 4.04Å; Y269-K277 HydrophobicContact CG-CB 3.96Å; Y269-K277 HydrophobicContact CG-CG 3.8Å; D274-K277 HydrophobicContact CB-CB 4.31Å; D274-K277 VanDerWaalsContact CG-CB 3.42Å; D274-K277 PolarHBondContact O-N 3.07Å; D274-K277 WeakPolarHBondContact OD1-CB 3.49Å; D274-K277 PolarHBondContact OD1-N 3.22Å; D274-K277 WeakPolarHBondContact OD2-CB 3.48Å; K277-R279 VanDerWaalsContact C-N 3.33Å; K277-R279 PolarHBondContact O-N 3.03Å; K277-E280 WeakPolarHBondContact CD-OE2 3.37Å; K277-E280 VanDerWaalsContact NZ-CD 3.3Å; K277-E280 IonicContact NZ-OE1 2.74Å; K277-E280 PolarHBondContact NZ-OE1 3.19Å; K277-E280 VanDerWaalsContact NZ-OE1 3.12Å; K277-E280 IonicContact NZ-OE2 3.23Å; K277-E280 PolarHBondContact NZ-OE2 3.12Å; K277-E280 PolarHBondContact O-N 3.4Å; K277-L281 HydrophobicContact CG-CD1 4.19Å; K277-L281 WeakPolarHBondContact O-CB 3.39Å; K277-L281 WeakPolarHBondContact O-CG 3.39Å; K277-L281 PolarHBondContact O-N 2.75Å
278	C	97.8	Very high	96.6	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-55.2	-47.5	171.6	174.2	0	0	0	0	111.8	A266 F270 D274 N276 L281 C282	A266-C278 PolarHBondContact O-SG 2.9Å; A266-C278 VanDerWaalsContact O-SG 3.38Å; F270-C278 HydrophobicContact CB-CB 4.31Å; D274-C278 WeakPolarHBondContact O-CB 3.4Å; D274-C278 PolarHBondContact O-N 3.39Å; N276-C278 VanDerWaalsContact C-N 3.34Å; N276-C278 PolarHBondContact O-N 3.1Å; C278-L281 PolarHBondContact O-N 3.03Å; C278-C282 WeakPolarHBondContact O-CB 3.43Å; C278-C282 PolarHBondContact O-N 3.35Å; C278-C282 PolarHBondContact O-SG 3.26Å; C278-C282 VanDerWaalsContact O-SG 3.39Å
279	R	97.9	Very high	96.3	Very high	15 Å²	15	49.4 Å²	49.4	6%	0.057	24%	0.243	C	C	.	.	H	α-helix	trans	-64.9	-47.6	-179.5	-72	-176.7	-74.3	-132.1	-5.5	111.9	Y275 N276 K277 L281 C282 E283 I306 S309 Y310 E313	Y275-R279 VanDerWaalsContact O-CG 3.26Å; Y275-R279 WeakPolarHBondContact O-CG 3.46Å; Y275-R279 PolarHBondContact O-N 3.07Å; Y275-R279 PolarHBondContact O-NE 3.35Å; N276-R279 PolarHBondContact O-N 3.27Å; N276-R279 PolarHBondContact OD1-NH2 3.38Å; K277-R279 VanDerWaalsContact C-N 3.33Å; K277-R279 PolarHBondContact O-N 3.03Å; R279-L281 VanDerWaalsContact C-N 3.3Å; R279-L281 PolarHBondContact O-N 2.88Å; R279-C282 PolarHBondContact O-N 3.1Å; R279-C282 VanDerWaalsContact O-N 3.14Å; R279-E283 WeakPolarHBondContact O-CG 3.48Å; R279-E283 PolarHBondContact O-N 3.19Å; R279-I306 HydrophobicContact CG-CG2 4.08Å; R279-S309 WeakPolarHBondContact CD-OG 3.26Å; R279-S309 WeakPolarHBondContact CG-OG 3.34Å; R279-Y310 VanDerWaalsContact CD-CE2 3.49Å; R279-E313 IonicContact CZ-OE2 3.96Å; R279-E313 IonicContact NH1-OE2 3.94Å; R279-E313 PolarHBondContact NH1-OE2 3.43Å; R279-E313 IonicContact NH2-OE1 3.44Å; R279-E313 PolarHBondContact NH2-OE1 3.04Å; R279-E313 IonicContact NH2-OE2 3.02Å; R279-E313 PolarHBondContact NH2-OE2 3.06Å
280	E	97.8	Very high	95.9	Very high	67 Å²	67	52.7 Å²	52.7	31%	0.313	26%	0.255	S	S	.	.	H	α-helix	trans	-56.2	-44.4	177.7	-171.2	-158.2	143.2	0	0	111.5	N276 K277 E283 K284	N276-E280 PolarHBondContact O-N 3.2Å; K277-E280 WeakPolarHBondContact CD-OE2 3.37Å; K277-E280 VanDerWaalsContact NZ-CD 3.3Å; K277-E280 IonicContact NZ-OE1 2.74Å; K277-E280 PolarHBondContact NZ-OE1 3.19Å; K277-E280 VanDerWaalsContact NZ-OE1 3.12Å; K277-E280 IonicContact NZ-OE2 3.23Å; K277-E280 PolarHBondContact NZ-OE2 3.12Å; K277-E280 PolarHBondContact O-N 3.4Å; E280-E283 PolarHBondContact O-N 3.28Å; E280-K284 WeakPolarHBondContact O-CG 3.44Å; E280-K284 PolarHBondContact O-N 2.82Å; E280-K284 WeakPolarHBondContact OE1-CE 3.49Å; E280-K284 IonicContact OE1-NZ 2.76Å; E280-K284 PolarHBondContact OE1-NZ 3.45Å
281	L	97.6	Very high	95.7	Very high	17 Å²	17	58.5 Å²	58.5	9%	0.089	28%	0.282	C	S	.	.	H	α-helix	trans	-68.6	-39.3	177.7	-72.1	170.1	0	0	0	112.3	I262 Q265 A266 Y269 K277 C278 R279 K284 A285	I262-L281 HydrophobicContact CG2-CB 4.22Å; I262-L281 HydrophobicContact CG2-CD2 4.09Å; I262-L281 WeakPolarHBondContact CG2-O 3.29Å; Q265-L281 HydrophobicContact CB-CD1 3.98Å; A266-L281 HydrophobicContact CB-CB 3.76Å; Y269-L281 HydrophobicContact CD2-CD1 3.33Å; Y269-L281 HydrophobicContact CE2-CD1 3.64Å; Y269-L281 HydrophobicContact CG-CD1 4.33Å; K277-L281 HydrophobicContact CG-CD1 4.19Å; K277-L281 WeakPolarHBondContact O-CB 3.39Å; K277-L281 WeakPolarHBondContact O-CG 3.39Å; K277-L281 PolarHBondContact O-N 2.75Å; C278-L281 PolarHBondContact O-N 3.03Å; R279-L281 VanDerWaalsContact C-N 3.3Å; R279-L281 PolarHBondContact O-N 2.88Å; L281-K284 PolarHBondContact O-N 2.98Å; L281-A285 WeakPolarHBondContact O-CB 3.43Å; L281-A285 PolarHBondContact O-N 3.06Å
282	C	97.8	Very high	95.3	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-63.6	-41.4	174.5	-77.8	0	0	0	0	112.4	A266 C278 R279 A285 I286 A302 I306	A266-C282 VanDerWaalsContact CB-SG 3.52Å; C278-C282 WeakPolarHBondContact O-CB 3.43Å; C278-C282 PolarHBondContact O-N 3.35Å; C278-C282 PolarHBondContact O-SG 3.26Å; C278-C282 VanDerWaalsContact O-SG 3.39Å; R279-C282 PolarHBondContact O-N 3.1Å; R279-C282 VanDerWaalsContact O-N 3.14Å; C282-A285 WeakPolarHBondContact O-CB 3.37Å; C282-A285 PolarHBondContact O-N 3.38Å; C282-I286 WeakPolarHBondContact O-CD1 3.26Å; C282-I286 VanDerWaalsContact O-CG1 3.24Å; C282-I286 WeakPolarHBondContact O-CG1 3.4Å; C282-I286 PolarHBondContact O-N 3.4Å; C282-A302 HydrophobicContact CB-CB 4.4Å; C282-I306 HydrophobicContact CB-CD1 3.7Å; C282-I306 HydrophobicContact CB-CG1 3.43Å; C282-I306 VanDerWaalsContact CB-CG1 3.43Å
283	E	97	Very high	94.8	Very high	89 Å²	89	63 Å²	63	42%	0.416	30%	0.297	S	S	.	.	H	α-helix	trans	-61.8	-48.2	176	-72.3	175.3	166.7	0	0	110.8	R279 E280 A285 I286 D287 I306	R279-E283 WeakPolarHBondContact O-CG 3.48Å; R279-E283 PolarHBondContact O-N 3.19Å; E280-E283 PolarHBondContact O-N 3.28Å; E283-A285 VanDerWaalsContact C-N 3.3Å; E283-A285 PolarHBondContact O-N 3.32Å; E283-I286 WeakPolarHBondContact O-CB 3.22Å; E283-I286 PolarHBondContact O-N 3.13Å; E283-I286 VanDerWaalsContact O-N 3.08Å; E283-D287 PolarHBondContact O-N 3.01Å; E283-I306 HydrophobicContact CG-CD1 3.98Å
284	K	96.6	Very high	94.2	Very high	100 Å²	100	63.3 Å²	63.3	44%	0.435	29%	0.289	S	S	.	.	H	α-helix	trans	-57.2	-41.8	173.1	-74.2	173.6	173.9	176.4	0	112.7	I262 E280 L281 I286 D287 V288	I262-K284 HydrophobicContact CG2-CB 4.5Å; E280-K284 WeakPolarHBondContact O-CG 3.44Å; E280-K284 PolarHBondContact O-N 2.82Å; E280-K284 WeakPolarHBondContact OE1-CE 3.49Å; E280-K284 IonicContact OE1-NZ 2.76Å; E280-K284 PolarHBondContact OE1-NZ 3.45Å; L281-K284 PolarHBondContact O-N 2.98Å; K284-I286 VanDerWaalsContact C-N 3.32Å; K284-I286 PolarHBondContact O-N 3.08Å; K284-D287 PolarHBondContact O-N 3.1Å; K284-V288 WeakPolarHBondContact O-CG2 3.21Å; K284-V288 PolarHBondContact O-N 2.82Å
285	A	95.6	Very high	93.6	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-62.9	-40.4	177	0	0	0	0	0	111.5	M259 I262 T263 L281 C282 E283 V288 G289	M259-A285 HydrophobicContact CB-CB 4.18Å; M259-A285 WeakPolarHBondContact CB-O 3.18Å; M259-A285 HydrophobicContact CE-CB 3.94Å; M259-A285 WeakPolarHBondContact CE-O 3.37Å; I262-A285 HydrophobicContact CB-CB 3.85Å; I262-A285 HydrophobicContact CG2-CB 3.83Å; T263-A285 HydrophobicContact CG2-CB 3.52Å; L281-A285 WeakPolarHBondContact O-CB 3.43Å; L281-A285 PolarHBondContact O-N 3.06Å; C282-A285 WeakPolarHBondContact O-CB 3.37Å; C282-A285 PolarHBondContact O-N 3.38Å; E283-A285 VanDerWaalsContact C-N 3.3Å; E283-A285 PolarHBondContact O-N 3.32Å; A285-V288 PolarHBondContact O-N 2.81Å; A285-G289 PolarHBondContact O-N 3.26Å
286	I	95.6	Very high	93	Very high	5 Å²	5	66.5 Å²	66.5	3%	0.026	30%	0.301	C	S	.	.	H	α-helix	trans	-63.6	-42.5	177.4	-69.6	158.2	0	0	0	110.7	C282 E283 K284 G289 R290 I299 A302 Y303 I306	C282-I286 WeakPolarHBondContact O-CD1 3.26Å; C282-I286 VanDerWaalsContact O-CG1 3.24Å; C282-I286 WeakPolarHBondContact O-CG1 3.4Å; C282-I286 PolarHBondContact O-N 3.4Å; E283-I286 WeakPolarHBondContact O-CB 3.22Å; E283-I286 PolarHBondContact O-N 3.13Å; E283-I286 VanDerWaalsContact O-N 3.08Å; K284-I286 VanDerWaalsContact C-N 3.32Å; K284-I286 PolarHBondContact O-N 3.08Å; I286-G289 PolarHBondContact O-N 3.45Å; I286-R290 HydrophobicContact CG2-CG 4.42Å; I286-R290 WeakPolarHBondContact O-CB 3.44Å; I286-R290 VanDerWaalsContact O-CG 3.31Å; I286-R290 WeakPolarHBondContact O-CG 3.42Å; I286-R290 PolarHBondContact O-N 2.62Å; I286-I299 HydrophobicContact CG1-CG2 4.25Å; I286-I299 HydrophobicContact CG2-CG2 4.09Å; I286-A302 HydrophobicContact CD1-CB 3.93Å; I286-A302 HydrophobicContact CG1-CB 3.61Å; I286-Y303 HydrophobicContact CD1-CD1 3.61Å; I286-Y303 HydrophobicContact CD1-CD2 4.28Å; I286-Y303 HydrophobicContact CD1-CE1 3.58Å; I286-Y303 HydrophobicContact CD1-CE2 4.24Å; I286-Y303 HydrophobicContact CD1-CG 3.99Å; I286-Y303 HydrophobicContact CG2-CE2 4.47Å; I286-I306 HydrophobicContact CD1-CD1 4.01Å
287	D	94.4	Very high	92.7	Very high	91 Å²	91	67 Å²	67	49%	0.487	30%	0.295	S	S	.	.	H	α-helix	trans	-61.3	-50.2	177.1	-65.9	-25.1	0	0	0	110.9	E283 K284 G289 R290 E291	E283-D287 PolarHBondContact O-N 3.01Å; K284-D287 PolarHBondContact O-N 3.1Å; D287-G289 VanDerWaalsContact C-N 3.33Å; D287-G289 PolarHBondContact O-N 3.44Å; D287-R290 PolarHBondContact O-N 3.37Å; D287-E291 WeakPolarHBondContact O-CG 3.36Å; D287-E291 PolarHBondContact O-N 3.31Å
288	V	92	Very high	92.3	Very high	27 Å²	27	65.8 Å²	65.8	16%	0.164	29%	0.29	C	S	.	.	H	α-helix	trans	-57.7	-45.3	175.3	172.3	0	0	0	0	111.4	M259 I262 K284 A285 R290 E291 N292	M259-V288 HydrophobicContact CB-CG1 4.4Å; I262-V288 HydrophobicContact CD1-CB 4.34Å; I262-V288 HydrophobicContact CD1-CG2 3.86Å; K284-V288 WeakPolarHBondContact O-CG2 3.21Å; K284-V288 PolarHBondContact O-N 2.82Å; A285-V288 PolarHBondContact O-N 2.81Å; V288-R290 VanDerWaalsContact C-N 3.34Å; V288-R290 PolarHBondContact O-N 3.03Å; V288-E291 PolarHBondContact O-N 3.22Å; V288-N292 WeakPolarHBondContact O-CB 3.42Å; V288-N292 PolarHBondContact O-N 2.81Å; V288-N292 PolarHBondContact O-ND2 3.03Å
289	G	91.1	Very high	92	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-64.3	-36.6	179.5	0	0	0	0	0	112.9	A285 I286 D287 R293 E294	A285-G289 PolarHBondContact O-N 3.26Å; I286-G289 PolarHBondContact O-N 3.45Å; D287-G289 VanDerWaalsContact C-N 3.33Å; D287-G289 PolarHBondContact O-N 3.44Å; G289-R293 PolarHBondContact O-N 2.97Å; G289-R293 VanDerWaalsContact O-N 3.07Å; G289-E294 PolarHBondContact O-N 3.43Å
290	R	90.5	Very high	91.8	Very high	127 Å²	127	65.7 Å²	65.7	48%	0.479	29%	0.292	S	S	.	.	H	α-helix	trans	-72.4	-43.4	176.8	-75	178.7	171.1	-172.6	-4.1	112.2	I286 D287 V288 N292 R293 I299 Y303 E329	I286-R290 HydrophobicContact CG2-CG 4.42Å; I286-R290 WeakPolarHBondContact O-CB 3.44Å; I286-R290 VanDerWaalsContact O-CG 3.31Å; I286-R290 WeakPolarHBondContact O-CG 3.42Å; I286-R290 PolarHBondContact O-N 2.62Å; D287-R290 PolarHBondContact O-N 3.37Å; V288-R290 VanDerWaalsContact C-N 3.34Å; V288-R290 PolarHBondContact O-N 3.03Å; R290-N292 VanDerWaalsContact C-N 3.31Å; R290-N292 PolarHBondContact O-N 2.91Å; R290-R293 PolarHBondContact O-N 3.21Å; R290-I299 HydrophobicContact CG-CD1 3.96Å; R290-Y303 PolarHBondContact NH2-OH 3.47Å; R290-E329 IonicContact CZ-OE1 3.71Å; R290-E329 IonicContact NH2-OE1 2.74Å; R290-E329 PolarHBondContact NH2-OE1 3.38Å
291	E	91.6	Very high	91.7	Very high	154 Å²	154	68.2 Å²	68.2	72%	0.72	30%	0.302	S	S	*	.	H	α-helix	trans	-61.6	-40.9	177.2	-73.7	179.5	176.6	0	0	111.7	D287 V288	D287-E291 WeakPolarHBondContact O-CG 3.36Å; D287-E291 PolarHBondContact O-N 3.31Å; V288-E291 PolarHBondContact O-N 3.22Å
292	N	88.2	Confident	91.6	Very high	69 Å²	69	67.4 Å²	67.4	37%	0.369	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	4.2	-178.2	-64.3	-73.8	0	0	0	114	V288 R290 E294	V288-N292 WeakPolarHBondContact O-CB 3.42Å; V288-N292 PolarHBondContact O-N 2.81Å; V288-N292 PolarHBondContact O-ND2 3.03Å; R290-N292 VanDerWaalsContact C-N 3.31Å; R290-N292 PolarHBondContact O-N 2.91Å; N292-E294 VanDerWaalsContact C-N 3.29Å; N292-E294 PolarHBondContact O-N 3.28Å
293	R	85.6	Confident	91.6	Very high	231 Å²	231	68.4 Å²	68.4	87%	0.872	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	42.2	179.4	-55.1	-179.3	-179.7	-173.9	-0	113.4	G289 R290	G289-R293 PolarHBondContact O-N 2.97Å; G289-R293 VanDerWaalsContact O-N 3.07Å; R290-R293 PolarHBondContact O-N 3.21Å
294	E	82.7	Confident	91.6	Very high	45 Å²	45	64.6 Å²	64.6	21%	0.21	29%	0.285	C	S	.	.			trans	-67.3	167.3	175.5	-83.8	-165	-115.1	0	0	113.2	N258 M259 G289 N292 Y296	N258-E294 VanDerWaalsContact CA-OE1 3.22Å; N258-E294 WeakPolarHBondContact CA-OE1 3.34Å; M259-E294 WeakPolarHBondContact CG-OE1 3.36Å; M259-E294 WeakPolarHBondContact CG-OE2 3.37Å; M259-E294 PolarHBondContact N-OE1 3.41Å; G289-E294 PolarHBondContact O-N 3.43Å; N292-E294 VanDerWaalsContact C-N 3.29Å; N292-E294 PolarHBondContact O-N 3.28Å; E294-Y296 PolarHBondContact O-N 2.9Å
295	D	83.8	Confident	91.7	Very high	71 Å²	71	62.1 Å²	62.1	38%	0.38	27%	0.273	S	S	.	.			trans	-56.1	123	177.6	-172.9	-15.3	0	0	0	110.6	R297 Q298	D295-R297 PolarHBondContact O-N 2.97Å; D295-R297 WeakPolarHBondContact OD1-CB 3.32Å; D295-R297 VanDerWaalsContact OD1-CG 3.25Å; D295-R297 WeakPolarHBondContact OD1-CG 3.42Å; D295-R297 PolarHBondContact OD1-N 3.38Å; D295-R297 WeakPolarHBondContact OD2-CD 3.4Å; D295-Q298 HydrophobicContact CB-CG 4.48Å; D295-Q298 WeakPolarHBondContact O-CB 3.23Å; D295-Q298 PolarHBondContact O-N 2.92Å
296	Y	86.3	Confident	91.8	Very high	117 Å²	117	62.1 Å²	62.1	46%	0.459	27%	0.273	S	S	.	.	H	α-helix	trans	-53.2	-24.1	176.1	57.9	-90.8	0	0	0	112.7	E294 Q298 I299 A300 E329 H330	E294-Y296 PolarHBondContact O-N 2.9Å; Y296-Q298 VanDerWaalsContact C-N 3.33Å; Y296-Q298 PolarHBondContact O-N 3.37Å; Y296-I299 PolarHBondContact O-N 3.48Å; Y296-A300 WeakPolarHBondContact O-CB 3.4Å; Y296-A300 PolarHBondContact O-N 3.06Å; Y296-E329 VanDerWaalsContact CD2-O 3.27Å; Y296-E329 WeakPolarHBondContact CD2-O 3.47Å; Y296-H330 HydrophobicContact CD2-CB 4.09Å; Y296-H330 HydrophobicContact CE2-CB 4.33Å; Y296-H330 AromaticContact CE2-CD2 3.78Å
297	R	89.8	Confident	91.9	Very high	119 Å²	119	61.9 Å²	61.9	45%	0.449	27%	0.272	S	S	.	.	H	α-helix	trans	-62.1	-36.5	172.2	-64.9	176	-176.2	178.5	1.3	113	D295 K301 H330	D295-R297 PolarHBondContact O-N 2.97Å; D295-R297 WeakPolarHBondContact OD1-CB 3.32Å; D295-R297 VanDerWaalsContact OD1-CG 3.25Å; D295-R297 WeakPolarHBondContact OD1-CG 3.42Å; D295-R297 PolarHBondContact OD1-N 3.38Å; D295-R297 WeakPolarHBondContact OD2-CD 3.4Å; R297-K301 WeakPolarHBondContact O-CG 3.48Å; R297-K301 PolarHBondContact O-N 3.04Å; R297-K301 VanDerWaalsContact O-N 3.09Å; R297-H330 HydrophobicContact CG-CB 4.46Å
298	Q	88.8	Confident	92.1	Very high	37 Å²	37	59.1 Å²	59.1	17%	0.173	26%	0.257	C	S	.	.	H	α-helix	trans	-73.7	-38.7	178.9	-61.9	-65.4	91.4	0	0	110.8	M259 T260 D295 Y296 A300 K301 A302	M259-Q298 HydrophobicContact CE-CB 4.41Å; M259-Q298 HydrophobicContact CG-CB 4.25Å; M259-Q298 HydrophobicContact SD-CB 3.64Å; T260-Q298 PolarHBondContact OG1-NE2 3.24Å; D295-Q298 HydrophobicContact CB-CG 4.48Å; D295-Q298 WeakPolarHBondContact O-CB 3.23Å; D295-Q298 PolarHBondContact O-N 2.92Å; Y296-Q298 VanDerWaalsContact C-N 3.33Å; Y296-Q298 PolarHBondContact O-N 3.37Å; Q298-A300 VanDerWaalsContact C-N 3.35Å; Q298-K301 WeakPolarHBondContact O-CB 3.02Å; Q298-K301 PolarHBondContact O-N 3.41Å; Q298-A302 PolarHBondContact O-N 3.21Å
299	I	91.4	Very high	92.4	Very high	10 Å²	10	57.8 Å²	57.8	5%	0.051	25%	0.249	C	C	.	.	H	α-helix	trans	-60	-45.9	171.3	-57	178.8	0	0	0	110.5	M259 I286 R290 Y296 K301 A302 Y303 E329	M259-I299 HydrophobicContact CE-CG1 4.39Å; M259-I299 HydrophobicContact SD-CG1 3.89Å; I286-I299 HydrophobicContact CG1-CG2 4.25Å; I286-I299 HydrophobicContact CG2-CG2 4.09Å; R290-I299 HydrophobicContact CG-CD1 3.96Å; Y296-I299 PolarHBondContact O-N 3.48Å; I299-K301 VanDerWaalsContact C-N 3.31Å; I299-K301 PolarHBondContact O-N 3.09Å; I299-A302 PolarHBondContact O-N 2.91Å; I299-A302 VanDerWaalsContact O-N 3.17Å; I299-Y303 HydrophobicContact CG2-CD2 4.04Å; I299-Y303 HydrophobicContact CG2-CE2 3.79Å; I299-Y303 PolarHBondContact O-N 3.35Å; I299-E329 HydrophobicContact CG2-CG 4.17Å
300	A	93.6	Very high	92.7	Very high	4 Å²	4	59.7 Å²	59.7	3%	0.033	26%	0.256	C	S	.	.	H	α-helix	trans	-59	-40.6	175.8	0	0	0	0	0	112.3	Y296 Q298 Y303 A304 S326 E329 H330	Y296-A300 WeakPolarHBondContact O-CB 3.4Å; Y296-A300 PolarHBondContact O-N 3.06Å; Q298-A300 VanDerWaalsContact C-N 3.35Å; A300-Y303 PolarHBondContact O-N 3.06Å; A300-A304 WeakPolarHBondContact O-CB 3.43Å; A300-A304 PolarHBondContact O-N 3.16Å; A300-S326 WeakPolarHBondContact O-CB 3.47Å; A300-S326 PolarHBondContact O-OG 3.27Å; A300-E329 HydrophobicContact CB-CB 3.84Å; A300-H330 HydrophobicContact CB-CB 3.57Å
301	K	95.5	Very high	93	Very high	120 Å²	120	55.8 Å²	55.8	52%	0.522	24%	0.243	S	C	.	.	H	α-helix	trans	-64.5	-38.9	175.8	-74	174.6	-173.5	168.3	0	112.5	R297 Q298 I299 A304 R305	R297-K301 WeakPolarHBondContact O-CG 3.48Å; R297-K301 PolarHBondContact O-N 3.04Å; R297-K301 VanDerWaalsContact O-N 3.09Å; Q298-K301 WeakPolarHBondContact O-CB 3.02Å; Q298-K301 PolarHBondContact O-N 3.41Å; I299-K301 VanDerWaalsContact C-N 3.31Å; I299-K301 PolarHBondContact O-N 3.09Å; K301-A304 PolarHBondContact O-N 3.48Å; K301-R305 PolarHBondContact O-N 3.01Å
302	A	96.4	Very high	93.3	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.3	-46.9	175.8	0	0	0	0	0	111.3	M259 T263 C282 I286 Q298 I299 A304 R305 I306	M259-A302 HydrophobicContact CE-CB 3.92Å; T263-A302 HydrophobicContact CG2-CB 4.03Å; C282-A302 HydrophobicContact CB-CB 4.4Å; I286-A302 HydrophobicContact CD1-CB 3.93Å; I286-A302 HydrophobicContact CG1-CB 3.61Å; Q298-A302 PolarHBondContact O-N 3.21Å; I299-A302 PolarHBondContact O-N 2.91Å; I299-A302 VanDerWaalsContact O-N 3.17Å; A302-A304 VanDerWaalsContact C-N 3.34Å; A302-A304 PolarHBondContact O-N 3.37Å; A302-R305 PolarHBondContact O-N 3.37Å; A302-R305 VanDerWaalsContact O-N 3.16Å; A302-I306 PolarHBondContact O-N 3.31Å
303	Y	97.7	Very high	93.7	Very high	20 Å²	20	54 Å²	54	8%	0.078	23%	0.23	C	C	.	.	H	α-helix	trans	-60.1	-41.6	172.9	-78.1	-53.3	0	0	0	112.9	I286 R290 I299 A300 R305 I306 G307 F322 K325 E329	I286-Y303 HydrophobicContact CD1-CD1 3.61Å; I286-Y303 HydrophobicContact CD1-CD2 4.28Å; I286-Y303 HydrophobicContact CD1-CE1 3.58Å; I286-Y303 HydrophobicContact CD1-CE2 4.24Å; I286-Y303 HydrophobicContact CD1-CG 3.99Å; I286-Y303 HydrophobicContact CG2-CE2 4.47Å; R290-Y303 PolarHBondContact NH2-OH 3.47Å; I299-Y303 HydrophobicContact CG2-CD2 4.04Å; I299-Y303 HydrophobicContact CG2-CE2 3.79Å; I299-Y303 PolarHBondContact O-N 3.35Å; A300-Y303 PolarHBondContact O-N 3.06Å; Y303-R305 VanDerWaalsContact C-N 3.27Å; Y303-R305 PolarHBondContact O-N 2.95Å; Y303-I306 HydrophobicContact CD1-CD1 4.34Å; Y303-I306 WeakPolarHBondContact O-CB 3.44Å; Y303-I306 PolarHBondContact O-N 3.47Å; Y303-G307 PolarHBondContact O-N 3.34Å; Y303-F322 AromaticContact CD1-CD1 3.85Å; Y303-F322 HydrophobicContact CD1-CD1 3.85Å; Y303-F322 HydrophobicContact CD1-CE1 4.27Å; Y303-F322 HydrophobicContact CE1-CD1 4.34Å; Y303-F322 HydrophobicContact CE1-CE1 4.38Å; Y303-K325 HydrophobicContact CD1-CB 4.02Å; Y303-K325 HydrophobicContact CD1-CD 4.19Å; Y303-K325 HydrophobicContact CD2-CB 4.28Å; Y303-K325 HydrophobicContact CE1-CB 4.2Å; Y303-K325 HydrophobicContact CE1-CD 3.8Å; Y303-K325 HydrophobicContact CE2-CB 4.47Å; Y303-K325 HydrophobicContact CG-CB 4.05Å; Y303-E329 HydrophobicContact CD2-CG 3.85Å; Y303-E329 HydrophobicContact CE2-CG 3.82Å
304	A	97.5	Very high	94.2	Very high	9 Å²	9	49 Å²	49	7%	0.074	22%	0.217	C	C	.	.	H	α-helix	trans	-61.3	-37.3	176.6	0	0	0	0	0	111.9	A300 K301 A302 G307 N308 V335	A300-A304 WeakPolarHBondContact O-CB 3.43Å; A300-A304 PolarHBondContact O-N 3.16Å; K301-A304 PolarHBondContact O-N 3.48Å; A302-A304 VanDerWaalsContact C-N 3.34Å; A302-A304 PolarHBondContact O-N 3.37Å; A304-G307 PolarHBondContact O-N 3.13Å; A304-N308 PolarHBondContact O-N 3.34Å; A304-N308 PolarHBondContact O-ND2 2.9Å; A304-V335 HydrophobicContact CB-CG2 3.69Å
305	R	97.5	Very high	94.8	Very high	49 Å²	49	51.2 Å²	51.2	19%	0.185	23%	0.226	C	C	.	.	H	α-helix	trans	-68.5	-38.9	176.1	-170.9	176.1	-68.6	108.2	-7.2	112	T263 K301 A302 Y303 G307 N308 S309	T263-R305 PolarHBondContact O-NH1 3.37Å; K301-R305 PolarHBondContact O-N 3.01Å; A302-R305 PolarHBondContact O-N 3.37Å; A302-R305 VanDerWaalsContact O-N 3.16Å; Y303-R305 VanDerWaalsContact C-N 3.27Å; Y303-R305 PolarHBondContact O-N 2.95Å; R305-G307 VanDerWaalsContact C-N 3.35Å; R305-N308 PolarHBondContact O-N 3.37Å; R305-S309 PolarHBondContact O-N 3.17Å
306	I	98.1	Very high	95.5	Very high	0 Å²	0	49 Å²	49	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-59.1	-48.3	170.4	-63	169.9	0	0	0	109.9	R279 C282 E283 I286 A302 Y303 N308 S309 Y310 F322	R279-I306 HydrophobicContact CG-CG2 4.08Å; C282-I306 HydrophobicContact CB-CD1 3.7Å; C282-I306 HydrophobicContact CB-CG1 3.43Å; C282-I306 VanDerWaalsContact CB-CG1 3.43Å; E283-I306 HydrophobicContact CG-CD1 3.98Å; I286-I306 HydrophobicContact CD1-CD1 4.01Å; A302-I306 PolarHBondContact O-N 3.31Å; Y303-I306 HydrophobicContact CD1-CD1 4.34Å; Y303-I306 WeakPolarHBondContact O-CB 3.44Å; Y303-I306 PolarHBondContact O-N 3.47Å; I306-N308 VanDerWaalsContact C-N 3.33Å; I306-N308 PolarHBondContact O-N 3.33Å; I306-S309 WeakPolarHBondContact O-CB 3.48Å; I306-S309 PolarHBondContact O-N 3.41Å; I306-S309 VanDerWaalsContact O-N 3.08Å; I306-S309 PolarHBondContact O-OG 3.01Å; I306-Y310 HydrophobicContact CG2-CD2 3.86Å; I306-Y310 HydrophobicContact CG2-CE2 3.62Å; I306-Y310 WeakPolarHBondContact O-CD2 3.27Å; I306-Y310 PolarHBondContact O-N 3.47Å; I306-F322 HydrophobicContact CB-CB 4.35Å; I306-F322 HydrophobicContact CB-CD1 3.99Å; I306-F322 HydrophobicContact CB-CE1 4.43Å; I306-F322 HydrophobicContact CB-CG 4.11Å; I306-F322 HydrophobicContact CD1-CD1 4.2Å; I306-F322 HydrophobicContact CD1-CE1 4.03Å; I306-F322 HydrophobicContact CG2-CB 4.02Å; I306-F322 HydrophobicContact CG2-CD1 3.48Å; I306-F322 VanDerWaalsContact CG2-CD1 3.48Å; I306-F322 HydrophobicContact CG2-CD2 3.55Å; I306-F322 HydrophobicContact CG2-CE1 3.68Å; I306-F322 HydrophobicContact CG2-CE2 3.78Å; I306-F322 HydrophobicContact CG2-CG 3.39Å; I306-F322 HydrophobicContact CG2-CZ 3.81Å
307	G	97.7	Very high	95.9	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-57.1	-44.1	176	0	0	0	0	0	112.8	Y303 A304 R305 S309 Y310 F311 A319	Y303-G307 PolarHBondContact O-N 3.34Å; A304-G307 PolarHBondContact O-N 3.13Å; R305-G307 VanDerWaalsContact C-N 3.35Å; G307-S309 VanDerWaalsContact C-N 3.3Å; G307-S309 PolarHBondContact O-N 3.27Å; G307-Y310 PolarHBondContact O-N 2.94Å; G307-F311 WeakPolarHBondContact O-CB 3.43Å; G307-F311 PolarHBondContact O-N 3.46Å; G307-A319 WeakPolarHBondContact O-CB 3.42Å
308	N	97.8	Very high	96.3	Very high	32 Å²	32	47 Å²	47	17%	0.171	21%	0.212	C	C	.	.	H	α-helix	trans	-61.5	-36.3	175.7	-66.5	-28.1	0	0	0	112.6	F270 A304 R305 I306 F311 K312 Y323 K338	F270-N308 HydrophobicContact CE2-CB 3.77Å; F270-N308 HydrophobicContact CZ-CB 3.95Å; A304-N308 PolarHBondContact O-N 3.34Å; A304-N308 PolarHBondContact O-ND2 2.9Å; R305-N308 PolarHBondContact O-N 3.37Å; I306-N308 VanDerWaalsContact C-N 3.33Å; I306-N308 PolarHBondContact O-N 3.33Å; N308-F311 WeakPolarHBondContact O-CB 3.36Å; N308-F311 PolarHBondContact O-N 3.05Å; N308-K312 WeakPolarHBondContact O-CG 3.48Å; N308-K312 PolarHBondContact O-N 2.97Å; N308-Y323 WeakPolarHBondContact CA-OH 3.33Å; N308-Y323 PolarHBondContact N-OH 3.48Å; N308-Y323 WeakPolarHBondContact OD1-CE1 3.29Å; N308-Y323 PolarHBondContact OD1-OH 3.09Å; N308-K338 WeakPolarHBondContact OD1-CD 3.36Å; N308-K338 PolarHBondContact OD1-NZ 2.99Å; N308-K338 VanDerWaalsContact OD1-NZ 3.16Å
309	S	97.8	Very high	96.7	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-65.6	-46.1	178.6	75.7	0	0	0	0	111.6	R279 R305 I306 G307 F311 K312 E313	R279-S309 WeakPolarHBondContact CD-OG 3.26Å; R279-S309 WeakPolarHBondContact CG-OG 3.34Å; R305-S309 PolarHBondContact O-N 3.17Å; I306-S309 WeakPolarHBondContact O-CB 3.48Å; I306-S309 PolarHBondContact O-N 3.41Å; I306-S309 VanDerWaalsContact O-N 3.08Å; I306-S309 PolarHBondContact O-OG 3.01Å; G307-S309 VanDerWaalsContact C-N 3.3Å; G307-S309 PolarHBondContact O-N 3.27Å; S309-F311 VanDerWaalsContact C-N 3.31Å; S309-F311 PolarHBondContact O-N 3.09Å; S309-K312 PolarHBondContact O-N 2.94Å; S309-E313 PolarHBondContact O-N 3.41Å; S309-E313 VanDerWaalsContact O-N 3.16Å
310	Y	98.3	Very high	97	Very high	40 Å²	40	45.7 Å²	45.7	16%	0.157	21%	0.207	C	C	.	.	H	α-helix	trans	-64.3	-36.9	173.8	-76.8	-68.8	0	0	0	112.2	R279 I306 G307 K312 E313 E314 K315 D318 F322	R279-Y310 VanDerWaalsContact CD-CE2 3.49Å; I306-Y310 HydrophobicContact CG2-CD2 3.86Å; I306-Y310 HydrophobicContact CG2-CE2 3.62Å; I306-Y310 WeakPolarHBondContact O-CD2 3.27Å; I306-Y310 PolarHBondContact O-N 3.47Å; G307-Y310 PolarHBondContact O-N 2.94Å; Y310-K312 VanDerWaalsContact C-N 3.31Å; Y310-K312 PolarHBondContact O-N 3.12Å; Y310-E313 CarbonylContact O-C 3.13Å; Y310-E313 PolarHBondContact O-N 3.05Å; Y310-E314 PolarHBondContact O-N 3.16Å; Y310-K315 HydrophobicContact CD1-CB 3.88Å; Y310-K315 HydrophobicContact CD1-CD 3.92Å; Y310-K315 HydrophobicContact CE1-CD 4.26Å; Y310-K315 PolarHBondContact O-N 3.33Å; Y310-D318 HydrophobicContact CD1-CB 3.37Å; Y310-D318 HydrophobicContact CD2-CB 3.87Å; Y310-D318 HydrophobicContact CE1-CB 3.58Å; Y310-D318 HydrophobicContact CE2-CB 4.08Å; Y310-D318 HydrophobicContact CG-CB 3.53Å; Y310-F322 AromaticContact CD2-CD2 3.75Å; Y310-F322 HydrophobicContact CD2-CD2 3.75Å; Y310-F322 HydrophobicContact CD2-CE2 4.14Å; Y310-F322 AromaticContact CE2-CD2 3.49Å; Y310-F322 HydrophobicContact CE2-CD2 3.49Å; Y310-F322 VanDerWaalsContact CE2-CD2 3.49Å; Y310-F322 AromaticContact CE2-CE2 3.39Å; Y310-F322 HydrophobicContact CE2-CE2 3.39Å; Y310-F322 HydrophobicContact CE2-CZ 4.36Å
311	F	97.6	Very high	97.2	Very high	45 Å²	45	50.1 Å²	50.1	20%	0.197	23%	0.226	C	C	.	.	H	α-helix	trans	-61.5	-40.2	175.9	-170.6	-83.4	0	0	0	111.8	G307 N308 S309 E313 E314 Y316 A319 Y323 Q341 A342 I345	G307-F311 WeakPolarHBondContact O-CB 3.43Å; G307-F311 PolarHBondContact O-N 3.46Å; N308-F311 WeakPolarHBondContact O-CB 3.36Å; N308-F311 PolarHBondContact O-N 3.05Å; S309-F311 VanDerWaalsContact C-N 3.31Å; S309-F311 PolarHBondContact O-N 3.09Å; F311-E313 VanDerWaalsContact C-N 3.34Å; F311-E314 PolarHBondContact O-N 3.08Å; F311-Y316 HydrophobicContact CD2-CD1 4.03Å; F311-Y316 HydrophobicContact CD2-CE1 4.03Å; F311-Y316 HydrophobicContact CE2-CD1 4.15Å; F311-Y316 AromaticContact CE2-CE1 3.93Å; F311-Y316 HydrophobicContact CE2-CE1 3.93Å; F311-Y316 HydrophobicContact CG-CE1 4.46Å; F311-Y316 HydrophobicContact CZ-CE1 4.28Å; F311-A319 HydrophobicContact CB-CB 4.13Å; F311-Y323 HydrophobicContact CD2-CE2 4.22Å; F311-Q341 HydrophobicContact CE2-CG 4.34Å; F311-Q341 HydrophobicContact CZ-CG 4.16Å; F311-A342 HydrophobicContact CD2-CB 3.9Å; F311-A342 HydrophobicContact CE2-CB 3.93Å; F311-I345 HydrophobicContact CE2-CD1 4.25Å; F311-I345 HydrophobicContact CZ-CD1 4.05Å
312	K	96.6	Very high	97.3	Very high	128 Å²	128	45.3 Å²	45.3	56%	0.557	21%	0.205	S	C	*	.	H	α-helix	trans	-68.9	-30.1	175.7	-74.3	-70.2	-173	174.7	0	113.3	F270 Y275 N308 S309 Y310 E314	F270-K312 HydrophobicContact CE2-CG 4.24Å; F270-K312 HydrophobicContact CZ-CG 3.94Å; Y275-K312 HydrophobicContact CE1-CB 3.96Å; Y275-K312 HydrophobicContact CE1-CG 4.28Å; Y275-K312 HydrophobicContact CE2-CB 3.99Å; N308-K312 WeakPolarHBondContact O-CG 3.48Å; N308-K312 PolarHBondContact O-N 2.97Å; S309-K312 PolarHBondContact O-N 2.94Å; Y310-K312 VanDerWaalsContact C-N 3.31Å; Y310-K312 PolarHBondContact O-N 3.12Å; K312-E314 PolarHBondContact O-N 3.43Å
313	E	96.4	Very high	97.4	Very high	57 Å²	57	45.3 Å²	45.3	27%	0.266	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83	7.3	172.5	-65.9	-172	135.7	0	0	113.6	Y275 R279 S309 Y310 F311 K315	Y275-E313 HydrophobicContact CD2-CG 3.55Å; Y275-E313 HydrophobicContact CE2-CG 4.23Å; Y275-E313 HydrophobicContact CG-CG 4.2Å; R279-E313 IonicContact CZ-OE2 3.96Å; R279-E313 IonicContact NH1-OE2 3.94Å; R279-E313 PolarHBondContact NH1-OE2 3.43Å; R279-E313 IonicContact NH2-OE1 3.44Å; R279-E313 PolarHBondContact NH2-OE1 3.04Å; R279-E313 IonicContact NH2-OE2 3.02Å; R279-E313 PolarHBondContact NH2-OE2 3.06Å; S309-E313 PolarHBondContact O-N 3.41Å; S309-E313 VanDerWaalsContact O-N 3.16Å; Y310-E313 CarbonylContact O-C 3.13Å; Y310-E313 PolarHBondContact O-N 3.05Å; F311-E313 VanDerWaalsContact C-N 3.34Å; E313-K315 HydrophobicContact CB-CD 4.21Å; E313-K315 HydrophobicContact CB-CG 4.22Å; E313-K315 PolarHBondContact O-N 3.14Å; E313-K315 IonicContact OE1-NZ 2.66Å; E313-K315 IonicContact OE2-NZ 3.12Å; E313-K315 PolarHBondContact OE2-NZ 3.02Å
314	E	96.1	Very high	97.3	Very high	127 Å²	127	48 Å²	48	59%	0.593	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	58	18.1	-175.4	-53.5	-173.9	175.3	0	0	114.6	Y310 F311 K312 Y316	Y310-E314 PolarHBondContact O-N 3.16Å; F311-E314 PolarHBondContact O-N 3.08Å; K312-E314 PolarHBondContact O-N 3.43Å; E314-Y316 VanDerWaalsContact C-N 3.28Å; E314-Y316 HydrophobicContact CB-CE2 3.85Å; E314-Y316 WeakPolarHBondContact O-CD2 3.36Å; E314-Y316 WeakPolarHBondContact O-CE2 3.44Å; E314-Y316 PolarHBondContact O-N 3.11Å
315	K	96.9	Very high	97.2	Very high	91 Å²	91	51.2 Å²	51.2	40%	0.396	23%	0.233	S	C	.	.			trans	-86.9	68.2	175.6	-68.4	175.7	-171.5	158.2	0	109.9	Y310 E313 K317 D318 A319	Y310-K315 HydrophobicContact CD1-CB 3.88Å; Y310-K315 HydrophobicContact CD1-CD 3.92Å; Y310-K315 HydrophobicContact CE1-CD 4.26Å; Y310-K315 PolarHBondContact O-N 3.33Å; E313-K315 HydrophobicContact CB-CD 4.21Å; E313-K315 HydrophobicContact CB-CG 4.22Å; E313-K315 PolarHBondContact O-N 3.14Å; E313-K315 IonicContact OE1-NZ 2.66Å; E313-K315 IonicContact OE2-NZ 3.12Å; E313-K315 PolarHBondContact OE2-NZ 3.02Å; K315-K317 VanDerWaalsContact C-N 3.31Å; K315-K317 PolarHBondContact O-N 3.26Å; K315-D318 PolarHBondContact O-N 2.97Å; K315-A319 PolarHBondContact O-N 3.38Å
316	Y	97.1	Very high	97.2	Very high	24 Å²	24	49 Å²	49	9%	0.094	23%	0.225	C	C	.	.	H	α-helix	trans	-63.3	-31.8	-169.5	-58.2	-68	0	0	0	114.2	F311 E314 A319 I320 A342 I345	F311-Y316 HydrophobicContact CD2-CD1 4.03Å; F311-Y316 HydrophobicContact CD2-CE1 4.03Å; F311-Y316 HydrophobicContact CE2-CD1 4.15Å; F311-Y316 AromaticContact CE2-CE1 3.93Å; F311-Y316 HydrophobicContact CE2-CE1 3.93Å; F311-Y316 HydrophobicContact CG-CE1 4.46Å; F311-Y316 HydrophobicContact CZ-CE1 4.28Å; E314-Y316 VanDerWaalsContact C-N 3.28Å; E314-Y316 HydrophobicContact CB-CE2 3.85Å; E314-Y316 WeakPolarHBondContact O-CD2 3.36Å; E314-Y316 WeakPolarHBondContact O-CE2 3.44Å; E314-Y316 PolarHBondContact O-N 3.11Å; Y316-A319 PolarHBondContact O-N 3.37Å; Y316-I320 VanDerWaalsContact O-CD1 3.31Å; Y316-I320 WeakPolarHBondContact O-CD1 3.29Å; Y316-I320 WeakPolarHBondContact O-CG1 3.4Å; Y316-I320 PolarHBondContact O-N 3.42Å; Y316-A342 HydrophobicContact CD1-CB 4.2Å; Y316-I345 HydrophobicContact CD1-CB 4.47Å; Y316-I345 HydrophobicContact CD1-CG2 4.41Å; Y316-I345 HydrophobicContact CD2-CG2 3.8Å; Y316-I345 HydrophobicContact CE1-CB 4.35Å; Y316-I345 HydrophobicContact CE1-CD1 3.9Å; Y316-I345 HydrophobicContact CE1-CG2 4.05Å; Y316-I345 HydrophobicContact CE2-CB 4.37Å; Y316-I345 HydrophobicContact CE2-CG2 3.37Å; Y316-I345 HydrophobicContact CG-CG2 4.3Å
317	K	96.3	Very high	96.9	Very high	126 Å²	126	50.2 Å²	50.2	55%	0.548	23%	0.232	S	C	.	.	H	α-helix	trans	-59.2	-49.1	175.9	-72.5	-174.6	-177.8	-169.5	0	111.8	K315 I320 H321 L346 E350	K315-K317 VanDerWaalsContact C-N 3.31Å; K315-K317 PolarHBondContact O-N 3.26Å; K317-I320 PolarHBondContact O-N 3.45Å; K317-H321 PolarHBondContact O-N 3.37Å; K317-H321 VanDerWaalsContact O-N 3.15Å; K317-L346 HydrophobicContact CD-CD1 4.43Å; K317-L346 HydrophobicContact CG-CD1 3.81Å; K317-L346 HydrophobicContact CG-CD2 3.54Å; K317-L346 HydrophobicContact CG-CG 4.34Å; K317-E350 WeakPolarHBondContact CE-OE1 3.45Å; K317-E350 IonicContact NZ-OE1 3.66Å; K317-E350 PolarHBondContact NZ-OE1 3.33Å
318	D	97.3	Very high	96.7	Very high	68 Å²	68	54.3 Å²	54.3	36%	0.364	27%	0.266	S	S	.	.	H	α-helix	trans	-68.9	-38.6	178	-60.2	-53.7	0	0	0	111.3	Y310 K315 I320 H321 F322	Y310-D318 HydrophobicContact CD1-CB 3.37Å; Y310-D318 HydrophobicContact CD2-CB 3.87Å; Y310-D318 HydrophobicContact CE1-CB 3.58Å; Y310-D318 HydrophobicContact CE2-CB 4.08Å; Y310-D318 HydrophobicContact CG-CB 3.53Å; K315-D318 PolarHBondContact O-N 2.97Å; D318-I320 PolarHBondContact O-N 3.23Å; D318-H321 WeakPolarHBondContact O-CB 3.27Å; D318-H321 PolarHBondContact O-N 2.9Å; D318-F322 WeakPolarHBondContact O-CD2 3.37Å; D318-F322 PolarHBondContact O-N 3.48Å
319	A	97.9	Very high	96.3	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-57.3	-48.7	175.5	0	0	0	0	0	111.9	G307 F311 K315 Y316 H321 F322 Y323	G307-A319 WeakPolarHBondContact O-CB 3.42Å; F311-A319 HydrophobicContact CB-CB 4.13Å; K315-A319 PolarHBondContact O-N 3.38Å; Y316-A319 PolarHBondContact O-N 3.37Å; A319-H321 PolarHBondContact O-N 2.92Å; A319-F322 PolarHBondContact O-N 3.39Å; A319-Y323 HydrophobicContact CB-CD2 4.41Å; A319-Y323 HydrophobicContact CB-CE2 4.1Å; A319-Y323 WeakPolarHBondContact O-CB 3.44Å; A319-Y323 WeakPolarHBondContact O-CD2 3.42Å; A319-Y323 VanDerWaalsContact O-CG 3.25Å; A319-Y323 PolarHBondContact O-N 3.28Å
320	I	97.8	Very high	95.9	Very high	20 Å²	20	58.5 Å²	58.5	10%	0.103	28%	0.284	C	S	.	.	H	α-helix	trans	-60.3	-44.6	177.7	-67.2	159.4	0	0	0	110.9	Y316 K317 D318 F322 Y323 N324 A342 E343 L346	Y316-I320 VanDerWaalsContact O-CD1 3.31Å; Y316-I320 WeakPolarHBondContact O-CD1 3.29Å; Y316-I320 WeakPolarHBondContact O-CG1 3.4Å; Y316-I320 PolarHBondContact O-N 3.42Å; K317-I320 PolarHBondContact O-N 3.45Å; D318-I320 PolarHBondContact O-N 3.23Å; I320-F322 VanDerWaalsContact C-N 3.35Å; I320-F322 PolarHBondContact O-N 3.34Å; I320-Y323 PolarHBondContact O-N 3.23Å; I320-N324 WeakPolarHBondContact CG2-ND2 3.5Å; I320-N324 WeakPolarHBondContact O-CB 3.3Å; I320-N324 PolarHBondContact O-N 3.38Å; I320-N324 PolarHBondContact O-ND2 3.04Å; I320-A342 HydrophobicContact CD1-CB 4.26Å; I320-A342 HydrophobicContact CG1-CB 3.67Å; I320-E343 HydrophobicContact CD1-CB 4.32Å; I320-E343 HydrophobicContact CD1-CG 3.74Å; I320-E343 HydrophobicContact CG1-CG 3.94Å; I320-E343 HydrophobicContact CG2-CG 4.21Å; I320-L346 HydrophobicContact CD1-CB 4.29Å; I320-L346 HydrophobicContact CD1-CD2 3.68Å
321	H	97.6	Very high	95.5	Very high	97 Å²	97	65.2 Å²	65.2	45%	0.449	31%	0.309	S	S	.	.	H	α-helix	trans	-55.3	-48.9	177	176.6	65	0	0	0	112	K317 D318 A319 N324 K325	K317-H321 PolarHBondContact O-N 3.37Å; K317-H321 VanDerWaalsContact O-N 3.15Å; D318-H321 WeakPolarHBondContact O-CB 3.27Å; D318-H321 PolarHBondContact O-N 2.9Å; A319-H321 PolarHBondContact O-N 2.92Å; H321-N324 PolarHBondContact O-N 2.85Å; H321-K325 VanDerWaalsContact NE2-CE 3.35Å; H321-K325 WeakPolarHBondContact NE2-CE 3.33Å; H321-K325 PolarHBondContact NE2-NZ 2.94Å; H321-K325 PolarHBondContact O-N 3.39Å
322	F	97.7	Very high	95.1	Very high	18 Å²	18	64.9 Å²	64.9	8%	0.079	31%	0.311	C	S	.	.	H	α-helix	trans	-75.3	-30.9	-179.5	-79.2	-76.6	0	0	0	113.8	Y303 I306 Y310 D318 A319 I320 K325 S326	Y303-F322 AromaticContact CD1-CD1 3.85Å; Y303-F322 HydrophobicContact CD1-CD1 3.85Å; Y303-F322 HydrophobicContact CD1-CE1 4.27Å; Y303-F322 HydrophobicContact CE1-CD1 4.34Å; Y303-F322 HydrophobicContact CE1-CE1 4.38Å; I306-F322 HydrophobicContact CB-CB 4.35Å; I306-F322 HydrophobicContact CB-CD1 3.99Å; I306-F322 HydrophobicContact CB-CE1 4.43Å; I306-F322 HydrophobicContact CB-CG 4.11Å; I306-F322 HydrophobicContact CD1-CD1 4.2Å; I306-F322 HydrophobicContact CD1-CE1 4.03Å; I306-F322 HydrophobicContact CG2-CB 4.02Å; I306-F322 HydrophobicContact CG2-CD1 3.48Å; I306-F322 VanDerWaalsContact CG2-CD1 3.48Å; I306-F322 HydrophobicContact CG2-CD2 3.55Å; I306-F322 HydrophobicContact CG2-CE1 3.68Å; I306-F322 HydrophobicContact CG2-CE2 3.78Å; I306-F322 HydrophobicContact CG2-CG 3.39Å; I306-F322 HydrophobicContact CG2-CZ 3.81Å; Y310-F322 AromaticContact CD2-CD2 3.75Å; Y310-F322 HydrophobicContact CD2-CD2 3.75Å; Y310-F322 HydrophobicContact CD2-CE2 4.14Å; Y310-F322 AromaticContact CE2-CD2 3.49Å; Y310-F322 HydrophobicContact CE2-CD2 3.49Å; Y310-F322 VanDerWaalsContact CE2-CD2 3.49Å; Y310-F322 AromaticContact CE2-CE2 3.39Å; Y310-F322 HydrophobicContact CE2-CE2 3.39Å; Y310-F322 HydrophobicContact CE2-CZ 4.36Å; D318-F322 WeakPolarHBondContact O-CD2 3.37Å; D318-F322 PolarHBondContact O-N 3.48Å; A319-F322 PolarHBondContact O-N 3.39Å; I320-F322 VanDerWaalsContact C-N 3.35Å; I320-F322 PolarHBondContact O-N 3.34Å; F322-K325 HydrophobicContact CD1-CD 4.03Å; F322-K325 HydrophobicContact CE1-CD 4.24Å; F322-K325 PolarHBondContact O-N 3.3Å; F322-S326 PolarHBondContact O-N 3.47Å
323	Y	97.7	Very high	94.8	Very high	1 Å²	1	63 Å²	63	0%	0.004	31%	0.312	C	S	.	.	H	α-helix	trans	-63.9	-42.3	169.3	-69.6	-38	0	0	0	111.7	N308 F311 A319 I320 K325 S326 L327 V335 K338 C339 A342	N308-Y323 WeakPolarHBondContact CA-OH 3.33Å; N308-Y323 PolarHBondContact N-OH 3.48Å; N308-Y323 WeakPolarHBondContact OD1-CE1 3.29Å; N308-Y323 PolarHBondContact OD1-OH 3.09Å; F311-Y323 HydrophobicContact CD2-CE2 4.22Å; A319-Y323 HydrophobicContact CB-CD2 4.41Å; A319-Y323 HydrophobicContact CB-CE2 4.1Å; A319-Y323 WeakPolarHBondContact O-CB 3.44Å; A319-Y323 WeakPolarHBondContact O-CD2 3.42Å; A319-Y323 VanDerWaalsContact O-CG 3.25Å; A319-Y323 PolarHBondContact O-N 3.28Å; I320-Y323 PolarHBondContact O-N 3.23Å; Y323-K325 VanDerWaalsContact C-N 3.34Å; Y323-K325 PolarHBondContact O-N 3.26Å; Y323-S326 WeakPolarHBondContact O-CB 3.38Å; Y323-S326 PolarHBondContact O-N 2.92Å; Y323-L327 VanDerWaalsContact O-CG 3.26Å; Y323-L327 WeakPolarHBondContact O-CG 3.49Å; Y323-L327 PolarHBondContact O-N 2.73Å; Y323-V335 HydrophobicContact CD1-CG1 3.76Å; Y323-V335 HydrophobicContact CG-CG1 4.21Å; Y323-K338 HydrophobicContact CE1-CB 4.32Å; Y323-K338 HydrophobicContact CE2-CB 3.97Å; Y323-C339 HydrophobicContact CD2-CB 4.14Å; Y323-C339 HydrophobicContact CG-CB 4.28Å; Y323-A342 HydrophobicContact CE2-CB 4.43Å
324	N	95.7	Very high	94.6	Very high	76 Å²	76	65.5 Å²	65.5	41%	0.406	33%	0.327	S	S	.	.	H	α-helix	trans	-63.9	-39	175.3	-75.8	-34.3	0	0	0	112.1	I320 H321 L327 A328	I320-N324 WeakPolarHBondContact CG2-ND2 3.5Å; I320-N324 WeakPolarHBondContact O-CB 3.3Å; I320-N324 PolarHBondContact O-N 3.38Å; I320-N324 PolarHBondContact O-ND2 3.04Å; H321-N324 PolarHBondContact O-N 2.85Å; N324-L327 PolarHBondContact O-N 3.05Å; N324-A328 WeakPolarHBondContact O-CB 3.49Å; N324-A328 PolarHBondContact O-N 3.38Å
325	K	96.3	Very high	94.5	Very high	76 Å²	76	60.1 Å²	60.1	33%	0.33	30%	0.303	S	S	.	.	H	α-helix	trans	-59.2	-46.1	170.2	-73.6	-177.6	173.5	-178.3	0	112.1	Y303 H321 F322 Y323 L327 A328 E329	Y303-K325 HydrophobicContact CD1-CB 4.02Å; Y303-K325 HydrophobicContact CD1-CD 4.19Å; Y303-K325 HydrophobicContact CD2-CB 4.28Å; Y303-K325 HydrophobicContact CE1-CB 4.2Å; Y303-K325 HydrophobicContact CE1-CD 3.8Å; Y303-K325 HydrophobicContact CE2-CB 4.47Å; Y303-K325 HydrophobicContact CG-CB 4.05Å; H321-K325 VanDerWaalsContact NE2-CE 3.35Å; H321-K325 WeakPolarHBondContact NE2-CE 3.33Å; H321-K325 PolarHBondContact NE2-NZ 2.94Å; H321-K325 PolarHBondContact O-N 3.39Å; F322-K325 HydrophobicContact CD1-CD 4.03Å; F322-K325 HydrophobicContact CE1-CD 4.24Å; F322-K325 PolarHBondContact O-N 3.3Å; Y323-K325 VanDerWaalsContact C-N 3.34Å; Y323-K325 PolarHBondContact O-N 3.26Å; K325-L327 PolarHBondContact O-N 2.6Å; K325-A328 PolarHBondContact O-N 3.39Å; K325-E329 WeakPolarHBondContact O-CG 3.45Å; K325-E329 PolarHBondContact O-N 3.47Å
326	S	95.8	Very high	94.3	Very high	2 Å²	2	58 Å²	58	1%	0.014	30%	0.295	C	S	.	.	H	α-helix	trans	-59	-47.1	176.3	179.4	0	0	0	0	112.2	A300 F322 Y323 A328 E329 H330	A300-S326 WeakPolarHBondContact O-CB 3.47Å; A300-S326 PolarHBondContact O-OG 3.27Å; F322-S326 PolarHBondContact O-N 3.47Å; Y323-S326 WeakPolarHBondContact O-CB 3.38Å; Y323-S326 PolarHBondContact O-N 2.92Å; S326-A328 VanDerWaalsContact C-N 3.28Å; S326-A328 PolarHBondContact O-N 3.27Å; S326-E329 PolarHBondContact O-N 3.45Å; S326-H330 PolarHBondContact O-N 3.02Å
327	L	92	Very high	94.3	Very high	26 Å²	26	63.2 Å²	63.2	14%	0.136	32%	0.319	C	S	.	.	H	α-helix	trans	-67.3	-27.5	-179.8	-67	170.3	0	0	0	113	Y323 N324 K325 R331 V335 L336 C339	Y323-L327 VanDerWaalsContact O-CG 3.26Å; Y323-L327 WeakPolarHBondContact O-CG 3.49Å; Y323-L327 PolarHBondContact O-N 2.73Å; N324-L327 PolarHBondContact O-N 3.05Å; K325-L327 PolarHBondContact O-N 2.6Å; L327-R331 HydrophobicContact CD2-CG 4.12Å; L327-R331 PolarHBondContact O-N 3.5Å; L327-V335 HydrophobicContact CD1-CG1 4.39Å; L327-V335 HydrophobicContact CD2-CB 3.91Å; L327-V335 HydrophobicContact CD2-CG1 3.86Å; L327-V335 HydrophobicContact CG-CB 4.45Å; L327-V335 HydrophobicContact CG-CG1 3.84Å; L327-L336 HydrophobicContact CD1-CD1 4.17Å; L327-L336 HydrophobicContact CD2-CB 4.24Å; L327-C339 HydrophobicContact CD1-CB 4.31Å
328	A	93.4	Very high	94.2	Very high	87 Å²	87	61 Å²	61	72%	0.719	31%	0.309	S	S	*	.	H	α-helix	trans	-70.5	-35.2	173.3	0	0	0	0	0	112.3	N324 K325 S326	N324-A328 WeakPolarHBondContact O-CB 3.49Å; N324-A328 PolarHBondContact O-N 3.38Å; K325-A328 PolarHBondContact O-N 3.39Å; S326-A328 VanDerWaalsContact C-N 3.28Å; S326-A328 PolarHBondContact O-N 3.27Å
329	E	90.3	Very high	94.2	Very high	60 Å²	60	57.9 Å²	57.9	28%	0.28	29%	0.293	S	S	.	.	H	α-helix	trans	-76.4	-49	175	-59.9	-73	-174.4	0	0	111.1	R290 Y296 I299 A300 Y303 K325 S326	R290-E329 IonicContact CZ-OE1 3.71Å; R290-E329 IonicContact NH2-OE1 2.74Å; R290-E329 PolarHBondContact NH2-OE1 3.38Å; Y296-E329 VanDerWaalsContact CD2-O 3.27Å; Y296-E329 WeakPolarHBondContact CD2-O 3.47Å; I299-E329 HydrophobicContact CG2-CG 4.17Å; A300-E329 HydrophobicContact CB-CB 3.84Å; Y303-E329 HydrophobicContact CD2-CG 3.85Å; Y303-E329 HydrophobicContact CE2-CG 3.82Å; K325-E329 WeakPolarHBondContact O-CG 3.45Å; K325-E329 PolarHBondContact O-N 3.47Å; S326-E329 PolarHBondContact O-N 3.45Å
330	H	90.1	Very high	94.1	Very high	59 Å²	59	63 Å²	63	27%	0.273	32%	0.316	S	S	.	.			trans	-153.8	114.5	175	-177	-111	0	0	0	111.6	Y296 R297 A300 S326 T332	Y296-H330 HydrophobicContact CD2-CB 4.09Å; Y296-H330 HydrophobicContact CE2-CB 4.33Å; Y296-H330 AromaticContact CE2-CD2 3.78Å; R297-H330 HydrophobicContact CG-CB 4.46Å; A300-H330 HydrophobicContact CB-CB 3.57Å; S326-H330 PolarHBondContact O-N 3.02Å; H330-T332 VanDerWaalsContact ND1-CG2 3.28Å; H330-T332 WeakPolarHBondContact ND1-CG2 3.42Å; H330-T332 PolarHBondContact O-N 2.78Å
331	R	89.9	Confident	94	Very high	182 Å²	182	66.9 Å²	66.9	69%	0.687	33%	0.334	S	S	*	.			trans	-72.7	113.9	-179	-170.9	174.8	-175.1	165.8	1.5	111.3	L327	L327-R331 HydrophobicContact CD2-CG 4.12Å; L327-R331 PolarHBondContact O-N 3.5Å
332	T	88.3	Confident	94	Very high	37 Å²	37	62.3 Å²	62.3	23%	0.227	31%	0.313	C	S	.	.			trans	-117.8	139.7	175.1	55.7	0	0	0	0	111.1	H330 D334 V335 L336	H330-T332 VanDerWaalsContact ND1-CG2 3.28Å; H330-T332 WeakPolarHBondContact ND1-CG2 3.42Å; H330-T332 PolarHBondContact O-N 2.78Å; T332-D334 VanDerWaalsContact C-N 3.26Å; T332-D334 PolarHBondContact O-N 3.01Å; T332-V335 PolarHBondContact O-N 2.91Å; T332-V335 WeakPolarHBondContact OG1-CB 3.43Å; T332-V335 WeakPolarHBondContact OG1-CG2 3.45Å; T332-L336 PolarHBondContact O-N 3.46Å
333	P	91	Very high	93.9	Very high	89 Å²	89	65.8 Å²	65.8	58%	0.578	33%	0.329	S	S	*	.	H	α-helix	trans	-57.2	-37.4	179	-27.1	35.5	0	0	0	113.5	L336 K337	P333-L336 PolarHBondContact O-N 3.29Å; P333-K337 WeakPolarHBondContact O-CG 3.42Å; P333-K337 PolarHBondContact O-N 3.5Å
334	D	91.8	Very high	93.8	Very high	109 Å²	109	73.5 Å²	73.5	58%	0.583	36%	0.363	S	S	*	.	H	α-helix	trans	-68.1	-43	-177.4	-59.9	-30.7	0	0	0	112.3	T332 L336 K337 K338	T332-D334 VanDerWaalsContact C-N 3.26Å; T332-D334 PolarHBondContact O-N 3.01Å; D334-L336 VanDerWaalsContact C-N 3.34Å; D334-K337 PolarHBondContact O-N 3.41Å; D334-K338 WeakPolarHBondContact O-CG 3.42Å; D334-K338 PolarHBondContact O-N 3.22Å; D334-K338 VanDerWaalsContact O-N 3.1Å
335	V	93.8	Very high	93.8	Very high	14 Å²	14	72.2 Å²	72.2	9%	0.085	36%	0.356	C	S	.	.	H	α-helix	trans	-68.3	-37.2	176	178.1	0	0	0	0	110.6	A304 Y323 L327 T332 K338 C339	A304-V335 HydrophobicContact CB-CG2 3.69Å; Y323-V335 HydrophobicContact CD1-CG1 3.76Å; Y323-V335 HydrophobicContact CG-CG1 4.21Å; L327-V335 HydrophobicContact CD1-CG1 4.39Å; L327-V335 HydrophobicContact CD2-CB 3.91Å; L327-V335 HydrophobicContact CD2-CG1 3.86Å; L327-V335 HydrophobicContact CG-CB 4.45Å; L327-V335 HydrophobicContact CG-CG1 3.84Å; T332-V335 PolarHBondContact O-N 2.91Å; T332-V335 WeakPolarHBondContact OG1-CB 3.43Å; T332-V335 WeakPolarHBondContact OG1-CG2 3.45Å; V335-K338 PolarHBondContact O-N 3.2Å; V335-C339 WeakPolarHBondContact O-CB 3.49Å; V335-C339 PolarHBondContact O-N 2.97Å
336	L	93.3	Very high	93.7	Very high	47 Å²	47	69.9 Å²	69.9	25%	0.246	35%	0.347	C	S	.	.	H	α-helix	trans	-61.4	-45.8	175.7	179.9	63.3	0	0	0	111.4	L327 T332 P333 D334 K338 C339 Q340	L327-L336 HydrophobicContact CD1-CD1 4.17Å; L327-L336 HydrophobicContact CD2-CB 4.24Å; T332-L336 PolarHBondContact O-N 3.46Å; P333-L336 PolarHBondContact O-N 3.29Å; D334-L336 VanDerWaalsContact C-N 3.34Å; L336-K338 VanDerWaalsContact C-N 3.34Å; L336-K338 PolarHBondContact O-N 3.25Å; L336-C339 WeakPolarHBondContact O-CB 3.32Å; L336-C339 PolarHBondContact O-N 2.81Å; L336-Q340 HydrophobicContact CD1-CG 4.42Å; L336-Q340 WeakPolarHBondContact O-CG 3.29Å; L336-Q340 PolarHBondContact O-N 3.12Å
337	K	95.9	Very high	93.6	Very high	133 Å²	133	77.3 Å²	77.3	58%	0.578	38%	0.379	S	S	*	.	H	α-helix	trans	-58.9	-45.1	175.9	-74.3	173.1	-177.6	175.2	0	111.5	P333 D334 Q340 Q341	P333-K337 WeakPolarHBondContact O-CG 3.42Å; P333-K337 PolarHBondContact O-N 3.5Å; D334-K337 PolarHBondContact O-N 3.41Å; K337-Q340 PolarHBondContact O-N 2.89Å; K337-Q341 WeakPolarHBondContact O-CB 3.45Å; K337-Q341 PolarHBondContact O-N 3.11Å
338	K	95.4	Very high	93.6	Very high	80 Å²	80	79.7 Å²	79.7	35%	0.348	39%	0.389	S	S	.	.	H	α-helix	trans	-64.5	-39.2	176.8	-71.9	-178.8	176	-178.8	0	112.7	N308 Y323 D334 V335 L336 Q341 A342	N308-K338 WeakPolarHBondContact OD1-CD 3.36Å; N308-K338 PolarHBondContact OD1-NZ 2.99Å; N308-K338 VanDerWaalsContact OD1-NZ 3.16Å; Y323-K338 HydrophobicContact CE1-CB 4.32Å; Y323-K338 HydrophobicContact CE2-CB 3.97Å; D334-K338 WeakPolarHBondContact O-CG 3.42Å; D334-K338 PolarHBondContact O-N 3.22Å; D334-K338 VanDerWaalsContact O-N 3.1Å; V335-K338 PolarHBondContact O-N 3.2Å; L336-K338 VanDerWaalsContact C-N 3.34Å; L336-K338 PolarHBondContact O-N 3.25Å; K338-Q341 PolarHBondContact O-N 2.83Å; K338-A342 WeakPolarHBondContact O-CB 3.25Å; K338-A342 PolarHBondContact O-N 3.3Å
339	C	96.1	Very high	93.5	Very high	3 Å²	3	79.4 Å²	79.4	2%	0.02	37%	0.373	C	S	.	.	H	α-helix	trans	-61.5	-50.8	175.1	-164.9	0	0	0	0	111	Y323 L327 V335 L336 Q341 A342 E343	Y323-C339 HydrophobicContact CD2-CB 4.14Å; Y323-C339 HydrophobicContact CG-CB 4.28Å; L327-C339 HydrophobicContact CD1-CB 4.31Å; V335-C339 WeakPolarHBondContact O-CB 3.49Å; V335-C339 PolarHBondContact O-N 2.97Å; L336-C339 WeakPolarHBondContact O-CB 3.32Å; L336-C339 PolarHBondContact O-N 2.81Å; C339-Q341 VanDerWaalsContact C-N 3.28Å; C339-Q341 PolarHBondContact O-N 3.32Å; C339-A342 WeakPolarHBondContact O-CB 3.33Å; C339-A342 PolarHBondContact O-N 3.13Å; C339-A342 VanDerWaalsContact O-N 3.12Å; C339-E343 WeakPolarHBondContact O-CG 3.39Å; C339-E343 PolarHBondContact O-N 3Å
340	Q	95.6	Very high	93.6	Very high	107 Å²	107	80.9 Å²	80.9	50%	0.5	38%	0.38	S	S	.	.	H	α-helix	trans	-60.5	-37.7	176.9	-71	174.4	-12.9	0	0	112.4	L336 K337 K344	L336-Q340 HydrophobicContact CD1-CG 4.42Å; L336-Q340 WeakPolarHBondContact O-CG 3.29Å; L336-Q340 PolarHBondContact O-N 3.12Å; K337-Q340 PolarHBondContact O-N 2.89Å; Q340-K344 WeakPolarHBondContact O-CB 3.36Å; Q340-K344 PolarHBondContact O-N 3.34Å
341	Q	96.8	Very high	93.6	Very high	102 Å²	102	83.3 Å²	83.3	48%	0.477	39%	0.386	S	S	.	.	H	α-helix	trans	-63.8	-46.9	174.4	-176.5	179.3	5.3	0	0	111.2	F311 K337 K338 C339 E343 K344 I345	F311-Q341 HydrophobicContact CE2-CG 4.34Å; F311-Q341 HydrophobicContact CZ-CG 4.16Å; K337-Q341 WeakPolarHBondContact O-CB 3.45Å; K337-Q341 PolarHBondContact O-N 3.11Å; K338-Q341 PolarHBondContact O-N 2.83Å; C339-Q341 VanDerWaalsContact C-N 3.28Å; C339-Q341 PolarHBondContact O-N 3.32Å; Q341-E343 PolarHBondContact O-N 3.3Å; Q341-K344 PolarHBondContact O-N 3.3Å; Q341-I345 HydrophobicContact CG-CD1 4Å; Q341-I345 VanDerWaalsContact O-CG1 3.31Å; Q341-I345 WeakPolarHBondContact O-CG1 3.34Å; Q341-I345 PolarHBondContact O-N 3.19Å
342	A	96.6	Very high	93.7	Very high	0 Å²	0	79 Å²	79	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-61.8	-42.4	177.2	0	0	0	0	0	111.7	F311 Y316 I320 Y323 K338 C339 K344 I345 L346	F311-A342 HydrophobicContact CD2-CB 3.9Å; F311-A342 HydrophobicContact CE2-CB 3.93Å; Y316-A342 HydrophobicContact CD1-CB 4.2Å; I320-A342 HydrophobicContact CD1-CB 4.26Å; I320-A342 HydrophobicContact CG1-CB 3.67Å; Y323-A342 HydrophobicContact CE2-CB 4.43Å; K338-A342 WeakPolarHBondContact O-CB 3.25Å; K338-A342 PolarHBondContact O-N 3.3Å; C339-A342 WeakPolarHBondContact O-CB 3.33Å; C339-A342 PolarHBondContact O-N 3.13Å; C339-A342 VanDerWaalsContact O-N 3.12Å; A342-K344 PolarHBondContact O-N 2.95Å; A342-I345 PolarHBondContact O-N 2.86Å; A342-L346 VanDerWaalsContact O-CB 3.3Å; A342-L346 WeakPolarHBondContact O-CB 3.5Å; A342-L346 PolarHBondContact O-N 2.85Å
343	E	96.2	Very high	93.8	Very high	91 Å²	91	81.5 Å²	81.5	43%	0.425	40%	0.401	S	S	.	.	H	α-helix	trans	-60.4	-43.6	174.8	-73	176.1	166.3	0	0	111.9	I320 C339 Q341 K347	I320-E343 HydrophobicContact CD1-CB 4.32Å; I320-E343 HydrophobicContact CD1-CG 3.74Å; I320-E343 HydrophobicContact CG1-CG 3.94Å; I320-E343 HydrophobicContact CG2-CG 4.21Å; C339-E343 WeakPolarHBondContact O-CG 3.39Å; C339-E343 PolarHBondContact O-N 3Å; Q341-E343 PolarHBondContact O-N 3.3Å; E343-K347 VanDerWaalsContact O-CB 3.24Å; E343-K347 WeakPolarHBondContact O-CB 3.49Å; E343-K347 PolarHBondContact O-N 2.87Å
344	K	96.4	Very high	93.9	Very high	164 Å²	164	82 Å²	82	71%	0.713	39%	0.392	S	S	*	.	H	α-helix	trans	-63.1	-45.5	177.8	-175.2	-178	177.6	-175.4	0	111.5	Q340 Q341 A342 E348	Q340-K344 WeakPolarHBondContact O-CB 3.36Å; Q340-K344 PolarHBondContact O-N 3.34Å; Q341-K344 PolarHBondContact O-N 3.3Å; A342-K344 PolarHBondContact O-N 2.95Å; K344-E348 PolarHBondContact O-N 3.38Å; K344-E348 VanDerWaalsContact O-N 3.09Å
345	I	95.4	Very high	93.9	Very high	49 Å²	49	79.7 Å²	79.7	25%	0.251	38%	0.379	S	S	.	.	H	α-helix	trans	-64.7	-47.8	179.1	-64.1	164.2	0	0	0	110.1	F311 Y316 Q341 A342 K347 E348 Q349	F311-I345 HydrophobicContact CE2-CD1 4.25Å; F311-I345 HydrophobicContact CZ-CD1 4.05Å; Y316-I345 HydrophobicContact CD1-CB 4.47Å; Y316-I345 HydrophobicContact CD1-CG2 4.41Å; Y316-I345 HydrophobicContact CD2-CG2 3.8Å; Y316-I345 HydrophobicContact CE1-CB 4.35Å; Y316-I345 HydrophobicContact CE1-CD1 3.9Å; Y316-I345 HydrophobicContact CE1-CG2 4.05Å; Y316-I345 HydrophobicContact CE2-CB 4.37Å; Y316-I345 HydrophobicContact CE2-CG2 3.37Å; Y316-I345 HydrophobicContact CG-CG2 4.3Å; Q341-I345 HydrophobicContact CG-CD1 4Å; Q341-I345 VanDerWaalsContact O-CG1 3.31Å; Q341-I345 WeakPolarHBondContact O-CG1 3.34Å; Q341-I345 PolarHBondContact O-N 3.19Å; A342-I345 PolarHBondContact O-N 2.86Å; I345-K347 VanDerWaalsContact C-N 3.33Å; I345-K347 PolarHBondContact O-N 3.36Å; I345-E348 PolarHBondContact O-N 3.2Å; I345-E348 VanDerWaalsContact O-N 3.15Å; I345-Q349 HydrophobicContact CG2-CG 4.35Å; I345-Q349 WeakPolarHBondContact O-CG 3.32Å; I345-Q349 PolarHBondContact O-N 3.05Å
346	L	94.4	Very high	94	Very high	26 Å²	26	81.9 Å²	81.9	14%	0.136	39%	0.39	C	S	.	.	H	α-helix	trans	-58.3	-46.5	179	177.8	61.9	0	0	0	111.5	K317 I320 A342 E348 Q349 E350	K317-L346 HydrophobicContact CD-CD1 4.43Å; K317-L346 HydrophobicContact CG-CD1 3.81Å; K317-L346 HydrophobicContact CG-CD2 3.54Å; K317-L346 HydrophobicContact CG-CG 4.34Å; I320-L346 HydrophobicContact CD1-CB 4.29Å; I320-L346 HydrophobicContact CD1-CD2 3.68Å; A342-L346 VanDerWaalsContact O-CB 3.3Å; A342-L346 WeakPolarHBondContact O-CB 3.5Å; A342-L346 PolarHBondContact O-N 2.85Å; L346-E348 VanDerWaalsContact C-N 3.28Å; L346-E348 PolarHBondContact O-N 2.76Å; L346-Q349 PolarHBondContact O-N 2.93Å; L346-E350 HydrophobicContact CD1-CG 4.17Å; L346-E350 HydrophobicContact CG-CG 4.48Å; L346-E350 WeakPolarHBondContact O-CB 3.23Å; L346-E350 WeakPolarHBondContact O-CG 3.17Å; L346-E350 PolarHBondContact O-N 3.28Å
347	K	93.8	Very high	94	Very high	158 Å²	158	83 Å²	83	69%	0.687	40%	0.4	S	S	*	.	H	α-helix	trans	-60.6	-38.7	178.4	-176.1	177.1	-178.9	178.2	0	112	E343 I345 R351	E343-K347 VanDerWaalsContact O-CB 3.24Å; E343-K347 WeakPolarHBondContact O-CB 3.49Å; E343-K347 PolarHBondContact O-N 2.87Å; I345-K347 VanDerWaalsContact C-N 3.33Å; I345-K347 PolarHBondContact O-N 3.36Å; K347-R351 VanDerWaalsContact O-CB 3.3Å; K347-R351 WeakPolarHBondContact O-CB 3.28Å; K347-R351 PolarHBondContact O-N 3.02Å
348	E	91.9	Very high	93.9	Very high	77 Å²	77	82.6 Å²	82.6	36%	0.36	40%	0.404	S	S	.	.	H	α-helix	trans	-70.7	-41.5	176.8	-177.8	59.8	-171.6	0	0	112	K344 I345 L346 E350 R351 L352	K344-E348 PolarHBondContact O-N 3.38Å; K344-E348 VanDerWaalsContact O-N 3.09Å; I345-E348 PolarHBondContact O-N 3.2Å; I345-E348 VanDerWaalsContact O-N 3.15Å; L346-E348 VanDerWaalsContact C-N 3.28Å; L346-E348 PolarHBondContact O-N 2.76Å; E348-E350 PolarHBondContact O-N 2.86Å; E348-R351 WeakPolarHBondContact O-CB 3.43Å; E348-R351 PolarHBondContact O-N 2.8Å; E348-R351 IonicContact OE1-CZ 2.72Å; E348-R351 IonicContact OE1-NE 3.31Å; E348-R351 PolarHBondContact OE1-NE 2.86Å; E348-R351 IonicContact OE1-NH2 3.64Å; E348-R351 PolarHBondContact OE1-NH2 3.35Å; E348-R351 IonicContact OE2-CZ 3.33Å; E348-R351 IonicContact OE2-NE 3.28Å; E348-R351 PolarHBondContact OE2-NE 3.41Å; E348-R351 IonicContact OE2-NH2 2.99Å; E348-R351 PolarHBondContact OE2-NH2 3.06Å; E348-L352 HydrophobicContact CG-CD1 4.15Å; E348-L352 HydrophobicContact CG-CG 4.46Å; E348-L352 WeakPolarHBondContact O-CB 3.37Å; E348-L352 VanDerWaalsContact O-CG 3.3Å; E348-L352 WeakPolarHBondContact O-CG 2.83Å; E348-L352 PolarHBondContact O-N 2.85Å
349	Q	91.7	Very high	93.9	Very high	80 Å²	80	82.1 Å²	82.1	37%	0.374	41%	0.406	S	S	.	.	H	α-helix	trans	-59.4	-46.3	173.5	-74	-176.4	-23.2	0	0	111.6	I345 L346 R351 L352 A353	I345-Q349 HydrophobicContact CG2-CG 4.35Å; I345-Q349 WeakPolarHBondContact O-CG 3.32Å; I345-Q349 PolarHBondContact O-N 3.05Å; L346-Q349 PolarHBondContact O-N 2.93Å; Q349-R351 VanDerWaalsContact C-N 3.34Å; Q349-R351 PolarHBondContact O-N 3.47Å; Q349-L352 PolarHBondContact O-N 3.43Å; Q349-A353 VanDerWaalsContact O-CB 3.28Å; Q349-A353 WeakPolarHBondContact O-CB 3.46Å; Q349-A353 PolarHBondContact O-N 3.21Å
350	E	91.6	Very high	93.9	Very high	92 Å²	92	82.1 Å²	82.1	43%	0.43	41%	0.405	S	S	.	.	H	α-helix	trans	-63.8	-40.5	176.7	-71.8	-177.8	156.3	0	0	111.3	K317 L346 E348 A353 Y354	K317-E350 WeakPolarHBondContact CE-OE1 3.45Å; K317-E350 IonicContact NZ-OE1 3.66Å; K317-E350 PolarHBondContact NZ-OE1 3.33Å; L346-E350 HydrophobicContact CD1-CG 4.17Å; L346-E350 HydrophobicContact CG-CG 4.48Å; L346-E350 WeakPolarHBondContact O-CB 3.23Å; L346-E350 WeakPolarHBondContact O-CG 3.17Å; L346-E350 PolarHBondContact O-N 3.28Å; E348-E350 PolarHBondContact O-N 2.86Å; E350-A353 PolarHBondContact O-N 3.46Å; E350-Y354 WeakPolarHBondContact O-CB 3.48Å; E350-Y354 PolarHBondContact O-N 2.99Å
351	R	90.4	Very high	93.9	Very high	109 Å²	109	80.8 Å²	80.8	41%	0.411	40%	0.402	S	S	.	.	H	α-helix	trans	-60.2	-48.7	174.9	-173.3	-174.4	77.9	98.5	0.6	111.5	K347 E348 Q349 Y354 I355	K347-R351 VanDerWaalsContact O-CB 3.3Å; K347-R351 WeakPolarHBondContact O-CB 3.28Å; K347-R351 PolarHBondContact O-N 3.02Å; E348-R351 WeakPolarHBondContact O-CB 3.43Å; E348-R351 PolarHBondContact O-N 2.8Å; E348-R351 IonicContact OE1-CZ 2.72Å; E348-R351 IonicContact OE1-NE 3.31Å; E348-R351 PolarHBondContact OE1-NE 2.86Å; E348-R351 IonicContact OE1-NH2 3.64Å; E348-R351 PolarHBondContact OE1-NH2 3.35Å; E348-R351 IonicContact OE2-CZ 3.33Å; E348-R351 IonicContact OE2-NE 3.28Å; E348-R351 PolarHBondContact OE2-NE 3.41Å; E348-R351 IonicContact OE2-NH2 2.99Å; E348-R351 PolarHBondContact OE2-NH2 3.06Å; Q349-R351 VanDerWaalsContact C-N 3.34Å; Q349-R351 PolarHBondContact O-N 3.47Å; R351-Y354 WeakPolarHBondContact O-CB 3.4Å; R351-Y354 PolarHBondContact O-N 3.21Å; R351-I355 WeakPolarHBondContact O-CG1 3.42Å; R351-I355 PolarHBondContact O-N 2.98Å
352	L	90.7	Very high	93.9	Very high	92 Å²	92	80.3 Å²	80.3	48%	0.482	40%	0.399	S	S	.	.	H	α-helix	trans	-65.8	-41.2	-179.6	-69.5	173.4	0	0	0	111.6	E348 Q349 Y354 I355	E348-L352 HydrophobicContact CG-CD1 4.15Å; E348-L352 HydrophobicContact CG-CG 4.46Å; E348-L352 WeakPolarHBondContact O-CB 3.37Å; E348-L352 VanDerWaalsContact O-CG 3.3Å; E348-L352 WeakPolarHBondContact O-CG 2.83Å; E348-L352 PolarHBondContact O-N 2.85Å; Q349-L352 PolarHBondContact O-N 3.43Å; L352-Y354 PolarHBondContact O-N 3.41Å; L352-I355 HydrophobicContact CD2-CD1 3.95Å; L352-I355 WeakPolarHBondContact O-CB 3.23Å; L352-I355 PolarHBondContact O-N 2.92Å; L352-I355 VanDerWaalsContact O-N 3.13Å
353	A	91.5	Very high	93.9	Very high	89 Å²	89	81.4 Å²	81.4	74%	0.736	40%	0.404	S	S	*	.	H	α-helix	trans	-63.9	-24.6	174.6	0	0	0	0	0	112.7	Q349 E350 I355	Q349-A353 VanDerWaalsContact O-CB 3.28Å; Q349-A353 WeakPolarHBondContact O-CB 3.46Å; Q349-A353 PolarHBondContact O-N 3.21Å; E350-A353 PolarHBondContact O-N 3.46Å; A353-I355 VanDerWaalsContact C-N 3.34Å
354	Y	91.9	Very high	93.9	Very high	99 Å²	99	78.9 Å²	78.9	39%	0.388	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-11	176.9	-155.3	-103.8	0	0	0	114	E350 R351 L352 N356 E385 K388 R389	E350-Y354 WeakPolarHBondContact O-CB 3.48Å; E350-Y354 PolarHBondContact O-N 2.99Å; R351-Y354 WeakPolarHBondContact O-CB 3.4Å; R351-Y354 PolarHBondContact O-N 3.21Å; L352-Y354 PolarHBondContact O-N 3.41Å; Y354-N356 PolarHBondContact O-N 2.91Å; Y354-E385 WeakPolarHBondContact CE1-OE1 3.37Å; Y354-E385 PolarHBondContact OH-OE1 3.34Å; Y354-K388 HydrophobicContact CD1-CB 3.96Å; Y354-K388 HydrophobicContact CE1-CB 3.91Å; Y354-K388 HydrophobicContact CE1-CD 4.38Å; Y354-R389 HydrophobicContact CD1-CG 3.88Å; Y354-R389 HydrophobicContact CE1-CG 3.58Å; Y354-R389 PolarHBondContact OH-NH2 2.87Å; Y354-R389 VanDerWaalsContact OH-NH2 3.07Å
355	I	93.5	Very high	94	Very high	62 Å²	62	74.7 Å²	74.7	32%	0.318	38%	0.377	S	S	.	.			trans	-72.6	118.2	-179.7	-64.6	177.5	0	0	0	109.2	R351 L352 A353 R389 P391	R351-I355 WeakPolarHBondContact O-CG1 3.42Å; R351-I355 PolarHBondContact O-N 2.98Å; L352-I355 HydrophobicContact CD2-CD1 3.95Å; L352-I355 WeakPolarHBondContact O-CB 3.23Å; L352-I355 PolarHBondContact O-N 2.92Å; L352-I355 VanDerWaalsContact O-N 3.13Å; A353-I355 VanDerWaalsContact C-N 3.34Å; I355-R389 CarbonylContact C-O 3.53Å; I355-R389 VanDerWaalsContact CA-O 3.25Å; I355-R389 WeakPolarHBondContact CA-O 3.36Å; I355-R389 WeakPolarHBondContact CG2-O 3.46Å; I355-P391 HydrophobicContact CD1-CG 4.3Å
356	N	94.3	Very high	94.1	Very high	59 Å²	59	75.5 Å²	75.5	32%	0.316	38%	0.379	S	S	.	.			trans	-146.7	101.6	174.2	-174.6	-44.5	0	0	0	109.1	Y354 D358 L359 A360 R389	Y354-N356 PolarHBondContact O-N 2.91Å; N356-D358 VanDerWaalsContact C-N 3.29Å; N356-D358 PolarHBondContact O-N 3.2Å; N356-D358 PolarHBondContact OD1-N 3.25Å; N356-D358 VanDerWaalsContact OD1-N 3.13Å; N356-L359 HydrophobicContact CB-CB 4.14Å; N356-L359 HydrophobicContact CB-CD1 4.12Å; N356-L359 HydrophobicContact CB-CG 4.32Å; N356-L359 PolarHBondContact O-N 3.37Å; N356-L359 PolarHBondContact OD1-N 3.46Å; N356-A360 WeakPolarHBondContact O-CB 3.15Å; N356-A360 PolarHBondContact O-N 3.11Å; N356-R389 CarbonylContact C-O 3.32Å; N356-R389 PolarHBondContact N-O 3.46Å
357	P	93.9	Very high	94.2	Very high	70 Å²	70	74.3 Å²	74.3	46%	0.455	37%	0.373	S	S	.	.	H	α-helix	trans	-60	-32.8	-177.5	-27.3	36.5	0	0	0	114.8	A360 L361	P357-A360 WeakPolarHBondContact O-CB 3.46Å; P357-A360 PolarHBondContact O-N 3.12Å; P357-L361 PolarHBondContact O-N 3.24Å
358	D	94.3	Very high	94.4	Very high	125 Å²	125	69 Å²	69	67%	0.668	35%	0.352	S	S	*	.	H	α-helix	trans	-72.3	-45.3	-178.7	-62.6	-35.9	0	0	0	111.1	N356 A360 L361 E362	N356-D358 VanDerWaalsContact C-N 3.29Å; N356-D358 PolarHBondContact O-N 3.2Å; N356-D358 PolarHBondContact OD1-N 3.25Å; N356-D358 VanDerWaalsContact OD1-N 3.13Å; D358-A360 VanDerWaalsContact C-N 3.26Å; D358-A360 PolarHBondContact O-N 3.34Å; D358-L361 WeakPolarHBondContact O-CB 3.45Å; D358-L361 PolarHBondContact O-N 3.12Å; D358-L361 VanDerWaalsContact O-N 3.15Å; D358-E362 PolarHBondContact O-N 3.37Å
359	L	94.6	Very high	94.7	Very high	71 Å²	71	70.2 Å²	70.2	37%	0.372	36%	0.358	S	S	.	.	H	α-helix	trans	-66.6	-30	172.8	-68	178.7	0	0	0	111.9	N356 E363	N356-L359 HydrophobicContact CB-CB 4.14Å; N356-L359 HydrophobicContact CB-CD1 4.12Å; N356-L359 HydrophobicContact CB-CG 4.32Å; N356-L359 PolarHBondContact O-N 3.37Å; N356-L359 PolarHBondContact OD1-N 3.46Å; L359-E363 WeakPolarHBondContact O-CG 3.37Å; L359-E363 PolarHBondContact O-N 3.24Å; L359-E363 VanDerWaalsContact O-N 3.1Å
360	A	96.1	Very high	94.9	Very high	2 Å²	2	67.4 Å²	67.4	2%	0.017	35%	0.347	C	S	.	.	H	α-helix	trans	-65.6	-40.5	171.7	0	0	0	0	0	111.5	N356 P357 D358 E363 K364 A386 R389 N390	N356-A360 WeakPolarHBondContact O-CB 3.15Å; N356-A360 PolarHBondContact O-N 3.11Å; P357-A360 WeakPolarHBondContact O-CB 3.46Å; P357-A360 PolarHBondContact O-N 3.12Å; D358-A360 VanDerWaalsContact C-N 3.26Å; D358-A360 PolarHBondContact O-N 3.34Å; A360-E363 PolarHBondContact O-N 3.27Å; A360-K364 WeakPolarHBondContact O-CB 3.32Å; A360-K364 PolarHBondContact O-N 3.04Å; A360-A386 WeakPolarHBondContact CB-O 3.42Å; A360-A386 WeakPolarHBondContact O-CB 3.41Å; A360-R389 HydrophobicContact CB-CB 3.72Å; A360-N390 HydrophobicContact CB-CB 3.48Å; A360-N390 VanDerWaalsContact CB-CB 3.48Å
361	L	95.8	Very high	95.2	Very high	80 Å²	80	65.7 Å²	65.7	42%	0.419	34%	0.338	S	S	.	.	H	α-helix	trans	-64	-42	176.3	177.6	60.5	0	0	0	111.6	P357 D358 K364 N365	P357-L361 PolarHBondContact O-N 3.24Å; D358-L361 WeakPolarHBondContact O-CB 3.45Å; D358-L361 PolarHBondContact O-N 3.12Å; D358-L361 VanDerWaalsContact O-N 3.15Å; L361-K364 VanDerWaalsContact CD1-CE 3.49Å; L361-K364 WeakPolarHBondContact O-CB 3.4Å; L361-K364 PolarHBondContact O-N 3.44Å; L361-N365 VanDerWaalsContact O-CG 3.26Å; L361-N365 PolarHBondContact O-N 3.47Å; L361-N365 PolarHBondContact O-ND2 2.99Å
362	E	96.1	Very high	95.5	Very high	92 Å²	92	68.3 Å²	68.3	43%	0.43	36%	0.355	S	S	.	.	H	α-helix	trans	-60.7	-49.4	175.5	-166.7	-166.5	145	0	0	111.6	D358 K364 N365 K366	D358-E362 PolarHBondContact O-N 3.37Å; E362-K364 VanDerWaalsContact C-N 3.33Å; E362-K364 PolarHBondContact O-N 3.06Å; E362-N365 PolarHBondContact O-N 3.15Å; E362-N365 VanDerWaalsContact O-N 3.13Å; E362-K366 PolarHBondContact O-N 3.21Å; E362-K366 WeakPolarHBondContact OE1-CE 3.49Å; E362-K366 IonicContact OE1-NZ 2.9Å; E362-K366 PolarHBondContact OE1-NZ 2.91Å
363	E	97.1	Very high	95.8	Very high	23 Å²	23	71.6 Å²	71.6	11%	0.107	37%	0.365	C	S	.	.	H	α-helix	trans	-63.6	-37.7	176.7	-71.5	-56.6	130.9	0	0	112.4	L359 A360 N365 K366 G367 H382 E385 A386 R389	L359-E363 WeakPolarHBondContact O-CG 3.37Å; L359-E363 PolarHBondContact O-N 3.24Å; L359-E363 VanDerWaalsContact O-N 3.1Å; A360-E363 PolarHBondContact O-N 3.27Å; E363-N365 VanDerWaalsContact C-N 3.28Å; E363-N365 PolarHBondContact O-N 3.46Å; E363-K366 PolarHBondContact O-N 3.05Å; E363-K366 IonicContact OE1-NZ 2.66Å; E363-K366 PolarHBondContact OE1-NZ 3.01Å; E363-G367 PolarHBondContact O-N 3.15Å; E363-H382 IonicContact OE2-CE1 2.83Å; E363-H382 IonicContact OE2-CG 3.67Å; E363-H382 IonicContact OE2-ND1 3.86Å; E363-H382 PolarHBondContact OE2-ND1 3.48Å; E363-E385 HydrophobicContact CG-CB 4.46Å; E363-E385 HydrophobicContact CG-CG 4.21Å; E363-A386 HydrophobicContact CB-CB 3.93Å; E363-R389 IonicContact OE1-NH1 2.66Å
364	K	97.4	Very high	95.9	Very high	38 Å²	38	69 Å²	69	17%	0.165	35%	0.346	C	S	.	.	H	α-helix	trans	-58.1	-42.8	173	-176.4	-168.5	74.7	-169.9	0	111.1	A360 L361 E362 G367 N368 Y383 A386 L396	A360-K364 WeakPolarHBondContact O-CB 3.32Å; A360-K364 PolarHBondContact O-N 3.04Å; L361-K364 VanDerWaalsContact CD1-CE 3.49Å; L361-K364 WeakPolarHBondContact O-CB 3.4Å; L361-K364 PolarHBondContact O-N 3.44Å; E362-K364 VanDerWaalsContact C-N 3.33Å; E362-K364 PolarHBondContact O-N 3.06Å; K364-G367 PolarHBondContact O-N 3.3Å; K364-N368 PolarHBondContact O-N 3.18Å; K364-N368 PolarHBondContact O-ND2 3.18Å; K364-N368 PolarHBondContact O-OD1 3.1Å; K364-Y383 HydrophobicContact CG-CE1 4.29Å; K364-A386 HydrophobicContact CB-CB 4.45Å; K364-L396 HydrophobicContact CB-CD2 3.65Å; K364-L396 HydrophobicContact CD-CD2 3.56Å; K364-L396 HydrophobicContact CG-CD2 3.49Å; K364-L396 VanDerWaalsContact CG-CD2 3.49Å
365	N	97.6	Very high	96.1	Very high	75 Å²	75	67.5 Å²	67.5	40%	0.401	35%	0.345	S	S	.	.	H	α-helix	trans	-66.4	-43.1	179.7	-67.7	-20.4	0	0	0	111.6	L361 E362 E363 G367 N368 E369	L361-N365 VanDerWaalsContact O-CG 3.26Å; L361-N365 PolarHBondContact O-N 3.47Å; L361-N365 PolarHBondContact O-ND2 2.99Å; E362-N365 PolarHBondContact O-N 3.15Å; E362-N365 VanDerWaalsContact O-N 3.13Å; E363-N365 VanDerWaalsContact C-N 3.28Å; E363-N365 PolarHBondContact O-N 3.46Å; N365-G367 VanDerWaalsContact C-N 3.3Å; N365-G367 PolarHBondContact O-N 2.92Å; N365-N368 WeakPolarHBondContact O-CB 3.41Å; N365-N368 PolarHBondContact O-N 2.88Å; N365-N368 VanDerWaalsContact O-N 3.14Å; N365-E369 PolarHBondContact O-N 2.71Å
366	K	97.1	Very high	96.2	Very high	67 Å²	67	67.7 Å²	67.7	29%	0.291	34%	0.342	S	S	.	.	H	α-helix	trans	-58.2	-43.4	171.6	-65.7	174.2	-170.1	160.4	0	111.7	E362 E363 N368 E369 C370 H382	E362-K366 PolarHBondContact O-N 3.21Å; E362-K366 WeakPolarHBondContact OE1-CE 3.49Å; E362-K366 IonicContact OE1-NZ 2.9Å; E362-K366 PolarHBondContact OE1-NZ 2.91Å; E363-K366 PolarHBondContact O-N 3.05Å; E363-K366 IonicContact OE1-NZ 2.66Å; E363-K366 PolarHBondContact OE1-NZ 3.01Å; K366-N368 VanDerWaalsContact C-N 3.34Å; K366-N368 PolarHBondContact O-N 3.3Å; K366-E369 PolarHBondContact O-N 2.99Å; K366-C370 PolarHBondContact O-N 3.47Å; K366-H382 HydrophobicContact CB-CB 4.49Å
367	G	97.5	Very high	96.2	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-59.7	-42.5	174.6	0	0	0	0	0	112.7	E363 K364 N365 C370 F371 A379 Y383	E363-G367 PolarHBondContact O-N 3.15Å; K364-G367 PolarHBondContact O-N 3.3Å; N365-G367 VanDerWaalsContact C-N 3.3Å; N365-G367 PolarHBondContact O-N 2.92Å; G367-C370 PolarHBondContact O-N 3.41Å; G367-F371 WeakPolarHBondContact O-CB 3.27Å; G367-F371 PolarHBondContact O-N 3.38Å; G367-A379 WeakPolarHBondContact O-CB 3.46Å; G367-Y383 VanDerWaalsContact C-CZ 3.43Å; G367-Y383 VanDerWaalsContact C-OH 3.27Å; G367-Y383 PolarHBondContact O-OH 3.49Å
368	N	97.4	Very high	96.2	Very high	46 Å²	46	67.9 Å²	67.9	25%	0.246	34%	0.341	C	S	.	.	H	α-helix	trans	-62.2	-42.4	175.9	-67.7	-24.4	0	0	0	111.5	K364 N365 K366 F371 Q372 Y383 N399	K364-N368 PolarHBondContact O-N 3.18Å; K364-N368 PolarHBondContact O-ND2 3.18Å; K364-N368 PolarHBondContact O-OD1 3.1Å; N365-N368 WeakPolarHBondContact O-CB 3.41Å; N365-N368 PolarHBondContact O-N 2.88Å; N365-N368 VanDerWaalsContact O-N 3.14Å; K366-N368 VanDerWaalsContact C-N 3.34Å; K366-N368 PolarHBondContact O-N 3.3Å; N368-F371 PolarHBondContact O-N 2.87Å; N368-Q372 VanDerWaalsContact O-CG 3.32Å; N368-Q372 WeakPolarHBondContact O-CG 3.49Å; N368-Q372 PolarHBondContact O-N 3.47Å; N368-Y383 VanDerWaalsContact CA-OH 3.27Å; N368-Y383 WeakPolarHBondContact CA-OH 3.49Å; N368-Y383 PolarHBondContact N-OH 3.31Å; N368-Y383 PolarHBondContact OD1-OH 3.03Å; N368-N399 PolarHBondContact OD1-ND2 3.18Å
369	E	97.7	Very high	96.4	Very high	104 Å²	104	62 Å²	62	49%	0.486	31%	0.309	S	S	.	.	H	α-helix	trans	-63.2	-46.3	176.9	-70.5	177.6	-161.5	0	0	112.1	N365 K366 F371 Q372 K373	N365-E369 PolarHBondContact O-N 2.71Å; K366-E369 PolarHBondContact O-N 2.99Å; E369-F371 VanDerWaalsContact C-N 3.3Å; E369-F371 PolarHBondContact O-N 3.38Å; E369-Q372 PolarHBondContact O-N 3.05Å; E369-K373 WeakPolarHBondContact O-CG 3.31Å; E369-K373 PolarHBondContact O-N 3.07Å
370	C	97.1	Very high	96.4	Very high	21 Å²	21	60.9 Å²	60.9	14%	0.142	30%	0.303	C	S	.	.	H	α-helix	trans	-60.4	-41.9	174.7	-72.5	0	0	0	0	111.5	K366 G367 Q372 K373 G374 D375 Q378 A379	K366-C370 PolarHBondContact O-N 3.47Å; G367-C370 PolarHBondContact O-N 3.41Å; C370-Q372 PolarHBondContact O-N 2.66Å; C370-K373 CarbonylContact O-C 3.26Å; C370-K373 PolarHBondContact O-N 3.08Å; C370-G374 PolarHBondContact O-N 3.47Å; C370-D375 HydrophobicContact CB-CB 4.47Å; C370-D375 PolarHBondContact O-N 2.96Å; C370-Q378 HydrophobicContact CB-CB 4.33Å; C370-A379 HydrophobicContact CB-CB 3.75Å
371	F	97.2	Very high	96.5	Very high	55 Å²	55	66.6 Å²	66.6	24%	0.241	33%	0.327	C	S	.	.	H	α-helix	trans	-62	-43.7	178.1	-171.4	-85.5	0	0	0	111.8	G367 N368 E369 K373 G374 Y376 A379 A402	G367-F371 WeakPolarHBondContact O-CB 3.27Å; G367-F371 PolarHBondContact O-N 3.38Å; N368-F371 PolarHBondContact O-N 2.87Å; E369-F371 VanDerWaalsContact C-N 3.3Å; E369-F371 PolarHBondContact O-N 3.38Å; F371-K373 VanDerWaalsContact C-N 3.29Å; F371-K373 PolarHBondContact O-N 3.31Å; F371-G374 PolarHBondContact O-N 3.24Å; F371-Y376 AromaticContact CD2-CD1 3.8Å; F371-Y376 HydrophobicContact CD2-CD1 3.8Å; F371-Y376 HydrophobicContact CD2-CE1 4.06Å; F371-Y376 AromaticContact CE2-CD1 3.85Å; F371-Y376 HydrophobicContact CE2-CD1 3.85Å; F371-Y376 AromaticContact CE2-CE1 3.9Å; F371-Y376 HydrophobicContact CE2-CE1 3.9Å; F371-Y376 HydrophobicContact CG-CD1 4.49Å; F371-Y376 HydrophobicContact CG-CE1 4.48Å; F371-Y376 HydrophobicContact CZ-CE1 4.17Å; F371-A379 HydrophobicContact CB-CB 4.05Å; F371-A402 HydrophobicContact CE2-CB 3.86Å; F371-A402 HydrophobicContact CZ-CB 4Å
372	Q	96.7	Very high	96.6	Very high	164 Å²	164	64.9 Å²	64.9	77%	0.766	32%	0.317	S	S	*	.	H	α-helix	trans	-64	-34.2	176.5	-73	174.6	13	0	0	112.5	N368 E369 C370 G374	N368-Q372 VanDerWaalsContact O-CG 3.32Å; N368-Q372 WeakPolarHBondContact O-CG 3.49Å; N368-Q372 PolarHBondContact O-N 3.47Å; E369-Q372 PolarHBondContact O-N 3.05Å; C370-Q372 PolarHBondContact O-N 2.66Å; Q372-G374 PolarHBondContact O-N 3.13Å
373	K	96.6	Very high	96.6	Very high	162 Å²	162	60.7 Å²	60.7	70%	0.704	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-6.6	173.8	-68.5	168.9	-176.6	167.9	0	113.4	E369 C370 F371 D375	E369-K373 WeakPolarHBondContact O-CG 3.31Å; E369-K373 PolarHBondContact O-N 3.07Å; C370-K373 CarbonylContact O-C 3.26Å; C370-K373 PolarHBondContact O-N 3.08Å; F371-K373 VanDerWaalsContact C-N 3.29Å; F371-K373 PolarHBondContact O-N 3.31Å; K373-D375 VanDerWaalsContact C-N 3.29Å
374	G	94.6	Very high	96.6	Very high	33 Å²	33	61.5 Å²	61.5	34%	0.34	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.7	6.7	-175.6	0	0	0	0	0	114.5	C370 F371 Q372 Y376	C370-G374 PolarHBondContact O-N 3.47Å; F371-G374 PolarHBondContact O-N 3.24Å; Q372-G374 PolarHBondContact O-N 3.13Å; G374-Y376 VanDerWaalsContact C-N 3.29Å; G374-Y376 VanDerWaalsContact O-CD2 3.27Å; G374-Y376 WeakPolarHBondContact O-CD2 3.39Å; G374-Y376 WeakPolarHBondContact O-CE2 3.41Å; G374-Y376 PolarHBondContact O-N 3.38Å
375	D	96.4	Very high	96.6	Very high	69 Å²	69	61.2 Å²	61.2	37%	0.369	30%	0.303	S	S	.	.			trans	-84.3	74.5	174.6	-170.6	-14	0	0	0	110.1	C370 K373 P377 Q378 A379	C370-D375 HydrophobicContact CB-CB 4.47Å; C370-D375 PolarHBondContact O-N 2.96Å; K373-D375 VanDerWaalsContact C-N 3.29Å; D375-P377 WeakPolarHBondContact OD1-CD 3.49Å; D375-Q378 PolarHBondContact O-N 2.92Å; D375-Q378 WeakPolarHBondContact OD1-CB 3.41Å; D375-Q378 WeakPolarHBondContact OD1-CG 3.49Å; D375-Q378 PolarHBondContact OD1-N 3.46Å; D375-Q378 VanDerWaalsContact OD1-N 3.09Å; D375-Q378 WeakPolarHBondContact OD2-CG 3.35Å; D375-A379 WeakPolarHBondContact O-CB 3.49Å; D375-A379 PolarHBondContact O-N 2.97Å
376	Y	94.1	Very high	96.6	Very high	65 Å²	65	57.7 Å²	57.7	26%	0.255	28%	0.284	S	S	.	.	H	α-helix	trans	-63.5	-37.5	-178.6	-49.1	-63.4	0	0	0	114	F371 G374 A379 M380 K406	F371-Y376 AromaticContact CD2-CD1 3.8Å; F371-Y376 HydrophobicContact CD2-CD1 3.8Å; F371-Y376 HydrophobicContact CD2-CE1 4.06Å; F371-Y376 AromaticContact CE2-CD1 3.85Å; F371-Y376 HydrophobicContact CE2-CD1 3.85Å; F371-Y376 AromaticContact CE2-CE1 3.9Å; F371-Y376 HydrophobicContact CE2-CE1 3.9Å; F371-Y376 HydrophobicContact CG-CD1 4.49Å; F371-Y376 HydrophobicContact CG-CE1 4.48Å; F371-Y376 HydrophobicContact CZ-CE1 4.17Å; G374-Y376 VanDerWaalsContact C-N 3.29Å; G374-Y376 VanDerWaalsContact O-CD2 3.27Å; G374-Y376 WeakPolarHBondContact O-CD2 3.39Å; G374-Y376 WeakPolarHBondContact O-CE2 3.41Å; G374-Y376 PolarHBondContact O-N 3.38Å; Y376-A379 PolarHBondContact O-N 3.4Å; Y376-M380 WeakPolarHBondContact O-CB 3.49Å; Y376-M380 PolarHBondContact O-N 2.94Å; Y376-K406 HydrophobicContact CD1-CB 3.92Å; Y376-K406 HydrophobicContact CD1-CG 4.08Å; Y376-K406 HydrophobicContact CD2-CB 3.83Å; Y376-K406 HydrophobicContact CE1-CB 3.97Å; Y376-K406 HydrophobicContact CE1-CD 4.4Å; Y376-K406 HydrophobicContact CE1-CG 3.73Å; Y376-K406 HydrophobicContact CE2-CB 3.89Å; Y376-K406 HydrophobicContact CE2-CG 4.28Å; Y376-K406 HydrophobicContact CG-CB 3.84Å; Y376-K406 HydrophobicContact CG-CG 4.49Å
377	P	95.1	Very high	96.5	Very high	62 Å²	62	55.1 Å²	55.1	40%	0.403	27%	0.273	S	S	.	.	H	α-helix	trans	-61.7	-42.7	175.5	-25.8	36.2	0	0	0	113.7	D375 K381 L407	D375-P377 WeakPolarHBondContact OD1-CD 3.49Å; P377-K381 PolarHBondContact O-N 2.67Å; P377-L407 HydrophobicContact CG-CD2 4.14Å
378	Q	94.6	Very high	96.4	Very high	72 Å²	72	60.3 Å²	60.3	34%	0.336	30%	0.296	S	S	.	.	H	α-helix	trans	-72	-39.4	175.9	-65.9	-64.5	-19.2	0	0	111.7	C370 D375 M380 K381 H382	C370-Q378 HydrophobicContact CB-CB 4.33Å; D375-Q378 PolarHBondContact O-N 2.92Å; D375-Q378 WeakPolarHBondContact OD1-CB 3.41Å; D375-Q378 WeakPolarHBondContact OD1-CG 3.49Å; D375-Q378 PolarHBondContact OD1-N 3.46Å; D375-Q378 VanDerWaalsContact OD1-N 3.09Å; D375-Q378 WeakPolarHBondContact OD2-CG 3.35Å; Q378-M380 VanDerWaalsContact C-N 3.27Å; Q378-M380 PolarHBondContact O-N 3.34Å; Q378-K381 WeakPolarHBondContact O-CB 3.35Å; Q378-K381 PolarHBondContact O-N 3.23Å; Q378-K381 VanDerWaalsContact O-N 3.08Å; Q378-H382 PolarHBondContact O-CD2 2.89Å; Q378-H382 VanDerWaalsContact O-CD2 3.26Å; Q378-H382 PolarHBondContact O-N 3.17Å; Q378-H382 VanDerWaalsContact O-N 3.07Å
379	A	96.9	Very high	96.3	Very high	0 Å²	0	60 Å²	60	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-55.8	-44.1	174	0	0	0	0	0	111.6	G367 C370 F371 D375 Y376 K381 H382 Y383	G367-A379 WeakPolarHBondContact O-CB 3.46Å; C370-A379 HydrophobicContact CB-CB 3.75Å; F371-A379 HydrophobicContact CB-CB 4.05Å; D375-A379 WeakPolarHBondContact O-CB 3.49Å; D375-A379 PolarHBondContact O-N 2.97Å; Y376-A379 PolarHBondContact O-N 3.4Å; A379-K381 VanDerWaalsContact C-N 3.34Å; A379-K381 PolarHBondContact O-N 3.32Å; A379-H382 PolarHBondContact O-N 3.27Å; A379-Y383 HydrophobicContact CB-CD2 4.42Å; A379-Y383 HydrophobicContact CB-CE2 4.02Å; A379-Y383 WeakPolarHBondContact O-CD2 3.02Å; A379-Y383 PolarHBondContact O-N 3.28Å
380	M	96.4	Very high	96.2	Very high	49 Å²	49	56.7 Å²	56.7	24%	0.241	28%	0.277	C	S	.	.	H	α-helix	trans	-61.4	-38.1	176.6	-177.8	-173.8	67.4	0	0	112.8	Y376 Q378 T384 R400 C403 Y404 L407	Y376-M380 WeakPolarHBondContact O-CB 3.49Å; Y376-M380 PolarHBondContact O-N 2.94Å; Q378-M380 VanDerWaalsContact C-N 3.27Å; Q378-M380 PolarHBondContact O-N 3.34Å; M380-T384 VanDerWaalsContact O-CB 3.26Å; M380-T384 WeakPolarHBondContact O-CB 3.41Å; M380-T384 PolarHBondContact O-N 3.42Å; M380-T384 PolarHBondContact O-OG1 3.38Å; M380-R400 HydrophobicContact CG-CG 4.09Å; M380-C403 HydrophobicContact CB-CB 4.2Å; M380-Y404 HydrophobicContact CG-CE1 4.28Å; M380-Y404 HydrophobicContact SD-CD1 3.95Å; M380-Y404 HydrophobicContact SD-CE1 3.26Å; M380-Y404 WeakPolarHBondContact SD-CE1 3.37Å; M380-L407 HydrophobicContact SD-CD1 4.37Å
381	K	96.6	Very high	96.1	Very high	121 Å²	121	56.9 Å²	56.9	53%	0.526	28%	0.278	S	S	.	.	H	α-helix	trans	-62.9	-49.4	175.2	-72.7	177.3	-177.8	172	0	110.9	P377 Q378 A379 T384 E385	P377-K381 PolarHBondContact O-N 2.67Å; Q378-K381 WeakPolarHBondContact O-CB 3.35Å; Q378-K381 PolarHBondContact O-N 3.23Å; Q378-K381 VanDerWaalsContact O-N 3.08Å; A379-K381 VanDerWaalsContact C-N 3.34Å; A379-K381 PolarHBondContact O-N 3.32Å; K381-T384 PolarHBondContact O-N 3.43Å; K381-E385 WeakPolarHBondContact O-CB 3.48Å; K381-E385 PolarHBondContact O-N 2.86Å
382	H	97.8	Very high	95.9	Very high	45 Å²	45	62.5 Å²	62.5	21%	0.208	30%	0.302	C	S	.	.	H	α-helix	trans	-62.1	-44.3	178.2	-73.4	-59.6	0	0	0	112.3	E363 K366 Q378 A379 T384 E385 A386	E363-H382 IonicContact OE2-CE1 2.83Å; E363-H382 IonicContact OE2-CG 3.67Å; E363-H382 IonicContact OE2-ND1 3.86Å; E363-H382 PolarHBondContact OE2-ND1 3.48Å; K366-H382 HydrophobicContact CB-CB 4.49Å; Q378-H382 PolarHBondContact O-CD2 2.89Å; Q378-H382 VanDerWaalsContact O-CD2 3.26Å; Q378-H382 PolarHBondContact O-N 3.17Å; Q378-H382 VanDerWaalsContact O-N 3.07Å; A379-H382 PolarHBondContact O-N 3.27Å; H382-T384 PolarHBondContact O-N 2.93Å; H382-E385 PolarHBondContact O-N 3.44Å; H382-A386 WeakPolarHBondContact O-CB 3.5Å; H382-A386 PolarHBondContact O-N 3.49Å
383	Y	97.5	Very high	95.9	Very high	4 Å²	4	56.3 Å²	56.3	2%	0.016	28%	0.275	C	S	.	.	H	α-helix	trans	-66.1	-37.1	175.4	-63.6	-45	0	0	0	113	K364 G367 N368 A379 E385 A386 I387 N399 R400 C403	K364-Y383 HydrophobicContact CG-CE1 4.29Å; G367-Y383 VanDerWaalsContact C-CZ 3.43Å; G367-Y383 VanDerWaalsContact C-OH 3.27Å; G367-Y383 PolarHBondContact O-OH 3.49Å; N368-Y383 VanDerWaalsContact CA-OH 3.27Å; N368-Y383 WeakPolarHBondContact CA-OH 3.49Å; N368-Y383 PolarHBondContact N-OH 3.31Å; N368-Y383 PolarHBondContact OD1-OH 3.03Å; A379-Y383 HydrophobicContact CB-CD2 4.42Å; A379-Y383 HydrophobicContact CB-CE2 4.02Å; A379-Y383 WeakPolarHBondContact O-CD2 3.02Å; A379-Y383 PolarHBondContact O-N 3.28Å; Y383-E385 VanDerWaalsContact C-N 3.26Å; Y383-E385 PolarHBondContact O-N 2.91Å; Y383-A386 PolarHBondContact O-N 3.3Å; Y383-I387 VanDerWaalsContact O-CG1 3.24Å; Y383-I387 WeakPolarHBondContact O-CG1 3.16Å; Y383-I387 PolarHBondContact O-N 2.66Å; Y383-N399 HydrophobicContact CD1-CB 4.07Å; Y383-N399 HydrophobicContact CD2-CB 4.19Å; Y383-N399 HydrophobicContact CE1-CB 3.75Å; Y383-N399 HydrophobicContact CE2-CB 3.89Å; Y383-N399 HydrophobicContact CG-CB 4.28Å; Y383-R400 HydrophobicContact CD2-CB 4.37Å; Y383-R400 HydrophobicContact CG-CB 4.49Å; Y383-C403 VanDerWaalsContact CE2-SG 3.56Å
384	T	97.3	Very high	95.9	Very high	40 Å²	40	48.7 Å²	48.7	25%	0.245	24%	0.242	C	C	.	.	H	α-helix	trans	-62.5	-39	175	-63.9	0	0	0	0	111.2	M380 K381 H382 I387 K388 R400	M380-T384 VanDerWaalsContact O-CB 3.26Å; M380-T384 WeakPolarHBondContact O-CB 3.41Å; M380-T384 PolarHBondContact O-N 3.42Å; M380-T384 PolarHBondContact O-OG1 3.38Å; K381-T384 PolarHBondContact O-N 3.43Å; H382-T384 PolarHBondContact O-N 2.93Å; T384-I387 PolarHBondContact O-N 2.83Å; T384-K388 WeakPolarHBondContact O-CG 3.48Å; T384-K388 PolarHBondContact O-N 3.1Å; T384-K388 VanDerWaalsContact O-N 3.15Å; T384-R400 VanDerWaalsContact OG1-CD 3.26Å; T384-R400 WeakPolarHBondContact OG1-CD 3.44Å; T384-R400 PolarHBondContact OG1-NH1 3.19Å; T384-R400 VanDerWaalsContact OG1-NH1 3.13Å
385	E	96.6	Very high	96	Very high	32 Å²	32	51.9 Å²	51.9	15%	0.15	25%	0.247	C	C	.	.	H	α-helix	trans	-69.5	-41.6	176.6	-166.7	50.4	-141.3	0	0	112.2	Y354 E363 K381 H382 Y383 I387 K388 R389	Y354-E385 WeakPolarHBondContact CE1-OE1 3.37Å; Y354-E385 PolarHBondContact OH-OE1 3.34Å; E363-E385 HydrophobicContact CG-CB 4.46Å; E363-E385 HydrophobicContact CG-CG 4.21Å; K381-E385 WeakPolarHBondContact O-CB 3.48Å; K381-E385 PolarHBondContact O-N 2.86Å; H382-E385 PolarHBondContact O-N 3.44Å; Y383-E385 VanDerWaalsContact C-N 3.26Å; Y383-E385 PolarHBondContact O-N 2.91Å; E385-I387 VanDerWaalsContact C-N 3.32Å; E385-I387 PolarHBondContact O-N 2.74Å; E385-K388 PolarHBondContact O-N 3.44Å; E385-K388 IonicContact OE2-NZ 2.69Å; E385-K388 PolarHBondContact OE2-NZ 3.22Å; E385-R389 PolarHBondContact O-N 3.4Å; E385-R389 IonicContact OE1-CZ 2.76Å; E385-R389 VanDerWaalsContact OE1-CZ 3.3Å; E385-R389 IonicContact OE1-NE 2.72Å; E385-R389 PolarHBondContact OE1-NE 3.34Å; E385-R389 IonicContact OE1-NH2 2.8Å; E385-R389 PolarHBondContact OE1-NH2 2.91Å; E385-R389 VanDerWaalsContact OE1-NH2 3.07Å
386	A	96.8	Very high	96	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-58.2	-42.7	171.7	0	0	0	0	0	111.9	A360 E363 K364 H382 Y383 K388 R389 N390 L396	A360-A386 WeakPolarHBondContact CB-O 3.42Å; A360-A386 WeakPolarHBondContact O-CB 3.41Å; E363-A386 HydrophobicContact CB-CB 3.93Å; K364-A386 HydrophobicContact CB-CB 4.45Å; H382-A386 WeakPolarHBondContact O-CB 3.5Å; H382-A386 PolarHBondContact O-N 3.49Å; Y383-A386 PolarHBondContact O-N 3.3Å; A386-K388 PolarHBondContact O-N 3.23Å; A386-R389 CarbonylContact O-C 3.59Å; A386-R389 PolarHBondContact O-N 2.99Å; A386-R389 VanDerWaalsContact O-N 3.15Å; A386-N390 PolarHBondContact O-N 2.94Å; A386-L396 HydrophobicContact CB-CD1 3.89Å; A386-L396 HydrophobicContact CB-CD2 3.88Å; A386-L396 HydrophobicContact CB-CG 4.47Å
387	I	96.5	Very high	96.2	Very high	13 Å²	13	46.8 Å²	46.8	7%	0.067	22%	0.222	C	C	.	.	H	α-helix	trans	-63.7	-39.2	178.5	-72.1	164.9	0	0	0	111.4	Y383 T384 E385 R389 N390 P391 L396 Y397 R400	Y383-I387 VanDerWaalsContact O-CG1 3.24Å; Y383-I387 WeakPolarHBondContact O-CG1 3.16Å; Y383-I387 PolarHBondContact O-N 2.66Å; T384-I387 PolarHBondContact O-N 2.83Å; E385-I387 VanDerWaalsContact C-N 3.32Å; E385-I387 PolarHBondContact O-N 2.74Å; I387-R389 PolarHBondContact O-N 3.44Å; I387-N390 CarbonylContact O-C 3.53Å; I387-N390 VanDerWaalsContact O-C 3.26Å; I387-N390 PolarHBondContact O-N 3.33Å; I387-P391 WeakPolarHBondContact O-CA 3.48Å; I387-P391 WeakPolarHBondContact O-CB 3.31Å; I387-P391 WeakPolarHBondContact O-CD 3.16Å; I387-L396 HydrophobicContact CD1-CB 4.2Å; I387-L396 HydrophobicContact CG1-CB 3.51Å; I387-L396 HydrophobicContact CG1-CD1 4.2Å; I387-Y397 HydrophobicContact CD1-CD1 4.04Å; I387-Y397 HydrophobicContact CD1-CE1 4.19Å; I387-Y397 HydrophobicContact CD1-CG 4.24Å; I387-Y397 HydrophobicContact CG1-CD2 4.47Å; I387-Y397 HydrophobicContact CG1-CE2 4.32Å; I387-Y397 HydrophobicContact CG2-CE1 3.91Å; I387-Y397 HydrophobicContact CG2-CE2 4.12Å; I387-Y397 WeakPolarHBondContact CG2-OH 3.35Å; I387-R400 HydrophobicContact CD1-CB 4.34Å
388	K	95.1	Very high	96.4	Very high	109 Å²	109	43.9 Å²	43.9	47%	0.474	20%	0.203	S	C	.	.	H	α-helix	trans	-61.6	-36.7	175.2	-69.6	175.7	-166	160.9	0	111.9	Y354 T384 E385 A386	Y354-K388 HydrophobicContact CD1-CB 3.96Å; Y354-K388 HydrophobicContact CE1-CB 3.91Å; Y354-K388 HydrophobicContact CE1-CD 4.38Å; T384-K388 WeakPolarHBondContact O-CG 3.48Å; T384-K388 PolarHBondContact O-N 3.1Å; T384-K388 VanDerWaalsContact O-N 3.15Å; E385-K388 PolarHBondContact O-N 3.44Å; E385-K388 IonicContact OE2-NZ 2.69Å; E385-K388 PolarHBondContact OE2-NZ 3.22Å; A386-K388 PolarHBondContact O-N 3.23Å
389	R	95.4	Very high	96.5	Very high	39 Å²	39	41.9 Å²	41.9	15%	0.147	20%	0.195	C	C	.	.	H	α-helix	trans	-84.2	-24.7	-178.3	-65.9	-176.6	-177.3	141.6	7.2	113.5	Y354 I355 N356 A360 E363 E385 A386 I387	Y354-R389 HydrophobicContact CD1-CG 3.88Å; Y354-R389 HydrophobicContact CE1-CG 3.58Å; Y354-R389 PolarHBondContact OH-NH2 2.87Å; Y354-R389 VanDerWaalsContact OH-NH2 3.07Å; I355-R389 CarbonylContact C-O 3.53Å; I355-R389 VanDerWaalsContact CA-O 3.25Å; I355-R389 WeakPolarHBondContact CA-O 3.36Å; I355-R389 WeakPolarHBondContact CG2-O 3.46Å; N356-R389 CarbonylContact C-O 3.32Å; N356-R389 PolarHBondContact N-O 3.46Å; A360-R389 HydrophobicContact CB-CB 3.72Å; E363-R389 IonicContact OE1-NH1 2.66Å; E385-R389 PolarHBondContact O-N 3.4Å; E385-R389 IonicContact OE1-CZ 2.76Å; E385-R389 VanDerWaalsContact OE1-CZ 3.3Å; E385-R389 IonicContact OE1-NE 2.72Å; E385-R389 PolarHBondContact OE1-NE 3.34Å; E385-R389 IonicContact OE1-NH2 2.8Å; E385-R389 PolarHBondContact OE1-NH2 2.91Å; E385-R389 VanDerWaalsContact OE1-NH2 3.07Å; A386-R389 CarbonylContact O-C 3.59Å; A386-R389 PolarHBondContact O-N 2.99Å; A386-R389 VanDerWaalsContact O-N 3.15Å; I387-R389 PolarHBondContact O-N 3.44Å
390	N	95.4	Very high	96.5	Very high	35 Å²	35	43.3 Å²	43.3	19%	0.187	20%	0.2	C	C	.	.			trans	-144.2	79.1	173.5	-172	3.7	0	0	0	111	A360 A386 I387 K392 D393 L396	A360-N390 HydrophobicContact CB-CB 3.48Å; A360-N390 VanDerWaalsContact CB-CB 3.48Å; A386-N390 PolarHBondContact O-N 2.94Å; I387-N390 CarbonylContact O-C 3.53Å; I387-N390 VanDerWaalsContact O-C 3.26Å; I387-N390 PolarHBondContact O-N 3.33Å; N390-K392 PolarHBondContact O-N 2.8Å; N390-K392 VanDerWaalsContact O-N 3.11Å; N390-D393 PolarHBondContact O-N 3.08Å; N390-L396 HydrophobicContact CB-CD1 4.28Å; N390-L396 WeakPolarHBondContact O-CD1 3.37Å
391	P	94.8	Very high	96.6	Very high	25 Å²	25	41 Å²	41	16%	0.162	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-3.6	-175	27.7	-35.4	0	0	0	114	I355 I387 Y397	I355-P391 HydrophobicContact CD1-CG 4.3Å; I387-P391 WeakPolarHBondContact O-CA 3.48Å; I387-P391 WeakPolarHBondContact O-CB 3.31Å; I387-P391 WeakPolarHBondContact O-CD 3.16Å; P391-Y397 WeakPolarHBondContact O-CE2 3.47Å; P391-Y397 PolarHBondContact O-OH 3.15Å
392	K	94.1	Very high	96.6	Very high	173 Å²	173	35.6 Å²	35.6	75%	0.752	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.1	-3.6	-178.8	-66.3	-174.2	176.7	-177.6	0	113.6	N390 A394	N390-K392 PolarHBondContact O-N 2.8Å; N390-K392 VanDerWaalsContact O-N 3.11Å; K392-A394 PolarHBondContact O-N 3.4Å
393	D	95.4	Very high	96.6	Very high	35 Å²	35	33.4 Å²	33.4	19%	0.187	16%	0.157	C	C	.	.			trans	-86	101.9	178.2	-176.2	-1.3	0	0	0	110.8	N390 K395 L396 Y397	N390-D393 PolarHBondContact O-N 3.08Å; D393-K395 PolarHBondContact O-N 2.65Å; D393-K395 VanDerWaalsContact O-N 3.1Å; D393-K395 VanDerWaalsContact OD1-CB 3.26Å; D393-K395 WeakPolarHBondContact OD1-CB 3.43Å; D393-K395 WeakPolarHBondContact OD1-CG 3.32Å; D393-K395 PolarHBondContact OD1-N 2.92Å; D393-L396 HydrophobicContact CB-CD1 3.9Å; D393-L396 HydrophobicContact CB-CG 3.89Å; D393-L396 WeakPolarHBondContact O-CB 3.48Å; D393-L396 PolarHBondContact O-N 3.44Å; D393-L396 VanDerWaalsContact O-N 3.08Å; D393-Y397 WeakPolarHBondContact O-CD2 3.39Å
394	A	96.4	Very high	96.5	Very high	2 Å²	2	34.7 Å²	34.7	2%	0.017	16%	0.162	C	C	.	.	H	α-helix	trans	-54.3	-29.2	178.8	0	0	0	0	0	113.1	K392 L396 Y397 S398 C420 L423 E424 F427	K392-A394 PolarHBondContact O-N 3.4Å; A394-L396 VanDerWaalsContact C-N 3.28Å; A394-L396 PolarHBondContact O-N 3.39Å; A394-Y397 PolarHBondContact O-N 2.98Å; A394-S398 PolarHBondContact O-N 3.4Å; A394-S398 VanDerWaalsContact O-N 3.12Å; A394-C420 PolarHBondContact O-SG 3.2Å; A394-L423 HydrophobicContact CB-CB 3.94Å; A394-E424 HydrophobicContact CB-CB 3.58Å; A394-F427 HydrophobicContact CB-CD1 4.42Å
395	K	96.6	Very high	96.4	Very high	100 Å²	100	34.2 Å²	34.2	44%	0.435	16%	0.158	S	C	.	.	H	α-helix	trans	-65.4	-33	-179	-61.8	164.5	-174	161.3	0	111.8	D393 S398 N399 F427	D393-K395 PolarHBondContact O-N 2.65Å; D393-K395 VanDerWaalsContact O-N 3.1Å; D393-K395 VanDerWaalsContact OD1-CB 3.26Å; D393-K395 WeakPolarHBondContact OD1-CB 3.43Å; D393-K395 WeakPolarHBondContact OD1-CG 3.32Å; D393-K395 PolarHBondContact OD1-N 2.92Å; K395-S398 PolarHBondContact O-N 2.8Å; K395-N399 WeakPolarHBondContact O-CB 3.21Å; K395-N399 VanDerWaalsContact O-CG 3.26Å; K395-N399 PolarHBondContact O-N 3.21Å; K395-N399 PolarHBondContact O-OD1 2.97Å; K395-F427 HydrophobicContact CG-CE1 4.16Å; K395-F427 HydrophobicContact CG-CE2 4.4Å; K395-F427 HydrophobicContact CG-CZ 3.83Å
396	L	97.6	Very high	96.3	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.01	18%	0.177	C	C	.	.	H	α-helix	trans	-66.3	-41.6	180	-57.8	179.8	0	0	0	111.4	K364 A386 I387 N390 D393 A394 N399 R400	K364-L396 HydrophobicContact CB-CD2 3.65Å; K364-L396 HydrophobicContact CD-CD2 3.56Å; K364-L396 HydrophobicContact CG-CD2 3.49Å; K364-L396 VanDerWaalsContact CG-CD2 3.49Å; A386-L396 HydrophobicContact CB-CD1 3.89Å; A386-L396 HydrophobicContact CB-CD2 3.88Å; A386-L396 HydrophobicContact CB-CG 4.47Å; I387-L396 HydrophobicContact CD1-CB 4.2Å; I387-L396 HydrophobicContact CG1-CB 3.51Å; I387-L396 HydrophobicContact CG1-CD1 4.2Å; N390-L396 HydrophobicContact CB-CD1 4.28Å; N390-L396 WeakPolarHBondContact O-CD1 3.37Å; D393-L396 HydrophobicContact CB-CD1 3.9Å; D393-L396 HydrophobicContact CB-CG 3.89Å; D393-L396 WeakPolarHBondContact O-CB 3.48Å; D393-L396 PolarHBondContact O-N 3.44Å; D393-L396 VanDerWaalsContact O-N 3.08Å; A394-L396 VanDerWaalsContact C-N 3.28Å; A394-L396 PolarHBondContact O-N 3.39Å; L396-N399 PolarHBondContact O-N 3.44Å; L396-R400 PolarHBondContact O-N 3.47Å
397	Y	98.1	Very high	96.1	Very high	24 Å²	24	41.4 Å²	41.4	9%	0.094	19%	0.192	C	C	.	.	H	α-helix	trans	-65.7	-43.9	174.9	-66.4	-90	0	0	0	111.7	I387 P391 D393 A394 N399 R400 A401 D416 E419 L423	I387-Y397 HydrophobicContact CD1-CD1 4.04Å; I387-Y397 HydrophobicContact CD1-CE1 4.19Å; I387-Y397 HydrophobicContact CD1-CG 4.24Å; I387-Y397 HydrophobicContact CG1-CD2 4.47Å; I387-Y397 HydrophobicContact CG1-CE2 4.32Å; I387-Y397 HydrophobicContact CG2-CE1 3.91Å; I387-Y397 HydrophobicContact CG2-CE2 4.12Å; I387-Y397 WeakPolarHBondContact CG2-OH 3.35Å; P391-Y397 WeakPolarHBondContact O-CE2 3.47Å; P391-Y397 PolarHBondContact O-OH 3.15Å; D393-Y397 WeakPolarHBondContact O-CD2 3.39Å; A394-Y397 PolarHBondContact O-N 2.98Å; Y397-N399 VanDerWaalsContact C-N 3.32Å; Y397-N399 PolarHBondContact O-N 3.25Å; Y397-R400 PolarHBondContact O-N 2.98Å; Y397-A401 VanDerWaalsContact O-CB 3.3Å; Y397-A401 WeakPolarHBondContact O-CB 3.33Å; Y397-A401 PolarHBondContact O-N 3.09Å; Y397-D416 WeakPolarHBondContact CB-O 2.9Å; Y397-E419 HydrophobicContact CD1-CB 3.89Å; Y397-E419 HydrophobicContact CD1-CG 3.81Å; Y397-E419 HydrophobicContact CE1-CB 4.07Å; Y397-E419 HydrophobicContact CE1-CG 3.5Å; Y397-E419 HydrophobicContact CE2-CG 4.33Å; Y397-E419 HydrophobicContact CG-CB 4.4Å; Y397-E419 HydrophobicContact CG-CG 4.32Å; Y397-L423 HydrophobicContact CD2-CD1 3.64Å; Y397-L423 HydrophobicContact CE2-CD1 3.43Å; Y397-L423 VanDerWaalsContact CE2-CD1 3.43Å
398	S	97.8	Very high	95.9	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.007	22%	0.22	C	C	.	.	H	α-helix	trans	-59.4	-41.5	174.4	-175.1	0	0	0	0	112.7	A394 K395 A402	A394-S398 PolarHBondContact O-N 3.4Å; A394-S398 VanDerWaalsContact O-N 3.12Å; K395-S398 PolarHBondContact O-N 2.8Å; S398-A402 PolarHBondContact O-N 3.49Å; S398-A402 VanDerWaalsContact O-N 3.1Å
399	N	97.2	Very high	95.8	Very high	31 Å²	31	46.4 Å²	46.4	17%	0.166	22%	0.22	C	C	.	.	H	α-helix	trans	-68.1	-41.4	178.3	-77	1.6	0	0	0	112.2	N368 Y383 K395 L396 Y397 A402 C403	N368-N399 PolarHBondContact OD1-ND2 3.18Å; Y383-N399 HydrophobicContact CD1-CB 4.07Å; Y383-N399 HydrophobicContact CD2-CB 4.19Å; Y383-N399 HydrophobicContact CE1-CB 3.75Å; Y383-N399 HydrophobicContact CE2-CB 3.89Å; Y383-N399 HydrophobicContact CG-CB 4.28Å; K395-N399 WeakPolarHBondContact O-CB 3.21Å; K395-N399 VanDerWaalsContact O-CG 3.26Å; K395-N399 PolarHBondContact O-N 3.21Å; K395-N399 PolarHBondContact O-OD1 2.97Å; L396-N399 PolarHBondContact O-N 3.44Å; Y397-N399 VanDerWaalsContact C-N 3.32Å; Y397-N399 PolarHBondContact O-N 3.25Å; N399-A402 WeakPolarHBondContact O-CB 3.46Å; N399-A402 PolarHBondContact O-N 2.9Å; N399-C403 PolarHBondContact O-N 2.88Å
400	R	98.1	Very high	95.6	Very high	30 Å²	30	46.5 Å²	46.5	11%	0.113	22%	0.222	C	C	.	.	H	α-helix	trans	-70.7	-36.7	176	-166.3	174.1	64.8	-174.4	-3.3	112.3	M380 Y383 T384 I387 L396 Y397 A402 C403 Y404 D416	M380-R400 HydrophobicContact CG-CG 4.09Å; Y383-R400 HydrophobicContact CD2-CB 4.37Å; Y383-R400 HydrophobicContact CG-CB 4.49Å; T384-R400 VanDerWaalsContact OG1-CD 3.26Å; T384-R400 WeakPolarHBondContact OG1-CD 3.44Å; T384-R400 PolarHBondContact OG1-NH1 3.19Å; T384-R400 VanDerWaalsContact OG1-NH1 3.13Å; I387-R400 HydrophobicContact CD1-CB 4.34Å; L396-R400 PolarHBondContact O-N 3.47Å; Y397-R400 PolarHBondContact O-N 2.98Å; R400-A402 PolarHBondContact O-N 3.02Å; R400-C403 WeakPolarHBondContact O-CA 3.49Å; R400-C403 VanDerWaalsContact O-CB 3.29Å; R400-C403 WeakPolarHBondContact O-CB 3.37Å; R400-C403 PolarHBondContact O-N 2.74Å; R400-Y404 HydrophobicContact CG-CD2 4.15Å; R400-Y404 HydrophobicContact CG-CE2 3.74Å; R400-Y404 WeakPolarHBondContact O-CD2 3.35Å; R400-Y404 PolarHBondContact O-N 3.47Å; R400-D416 WeakPolarHBondContact CB-OD2 3.48Å; R400-D416 IonicContact CZ-OD1 3.57Å; R400-D416 IonicContact CZ-OD2 2.93Å; R400-D416 IonicContact NE-OD1 3.53Å; R400-D416 IonicContact NE-OD2 2.75Å; R400-D416 PolarHBondContact NE-OD2 3.48Å; R400-D416 IonicContact NH2-OD1 3.53Å; R400-D416 PolarHBondContact NH2-OD1 3.13Å; R400-D416 IonicContact NH2-OD2 2.75Å; R400-D416 PolarHBondContact NH2-OD2 3.48Å
401	A	97.8	Very high	95.4	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-57	-40.8	171	0	0	0	0	0	111.5	Y397 C403 Y404 T405 A413 D416 C417	Y397-A401 VanDerWaalsContact O-CB 3.3Å; Y397-A401 WeakPolarHBondContact O-CB 3.33Å; Y397-A401 PolarHBondContact O-N 3.09Å; A401-C403 VanDerWaalsContact C-N 3.32Å; A401-C403 PolarHBondContact O-N 2.93Å; A401-Y404 PolarHBondContact O-N 3.31Å; A401-T405 PolarHBondContact O-N 3.49Å; A401-T405 PolarHBondContact O-OG1 3.46Å; A401-T405 VanDerWaalsContact O-OG1 3.05Å; A401-A413 HydrophobicContact CB-CB 4.47Å; A401-D416 HydrophobicContact CB-CB 3.87Å; A401-C417 VanDerWaalsContact CB-SG 3.52Å
402	A	96.5	Very high	95.3	Very high	7 Å²	7	53 Å²	53	6%	0.058	25%	0.251	C	S	.	.	H	α-helix	trans	-60.7	-39.9	174.8	0	0	0	0	0	112.4	F371 S398 N399 R400 K406	F371-A402 HydrophobicContact CE2-CB 3.86Å; F371-A402 HydrophobicContact CZ-CB 4Å; S398-A402 PolarHBondContact O-N 3.49Å; S398-A402 VanDerWaalsContact O-N 3.1Å; N399-A402 WeakPolarHBondContact O-CB 3.46Å; N399-A402 PolarHBondContact O-N 2.9Å; R400-A402 PolarHBondContact O-N 3.02Å; A402-K406 WeakPolarHBondContact O-CG 3.39Å; A402-K406 PolarHBondContact O-N 3.3Å; A402-K406 VanDerWaalsContact O-N 3.14Å
403	C	97.1	Very high	95.4	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.9	-48.8	172	-65.7	0	0	0	0	111.3	M380 Y383 N399 R400 A401 T405 K406 L407	M380-C403 HydrophobicContact CB-CB 4.2Å; Y383-C403 VanDerWaalsContact CE2-SG 3.56Å; N399-C403 PolarHBondContact O-N 2.88Å; R400-C403 WeakPolarHBondContact O-CA 3.49Å; R400-C403 VanDerWaalsContact O-CB 3.29Å; R400-C403 WeakPolarHBondContact O-CB 3.37Å; R400-C403 PolarHBondContact O-N 2.74Å; A401-C403 VanDerWaalsContact C-N 3.32Å; A401-C403 PolarHBondContact O-N 2.93Å; C403-T405 VanDerWaalsContact C-N 3.34Å; C403-T405 PolarHBondContact O-N 3.03Å; C403-K406 PolarHBondContact O-N 3.28Å; C403-K406 VanDerWaalsContact O-N 3.12Å; C403-L407 WeakPolarHBondContact O-CG 3.4Å; C403-L407 PolarHBondContact O-N 3.12Å
404	Y	96.6	Very high	95.4	Very high	31 Å²	31	44 Å²	44	12%	0.122	21%	0.211	C	C	.	.	H	α-helix	trans	-59.5	-42.7	179.4	-75.6	-50.8	0	0	0	112.3	M380 R400 A401 K406 L407 L408 E409 L412 D416	M380-Y404 HydrophobicContact CG-CE1 4.28Å; M380-Y404 HydrophobicContact SD-CD1 3.95Å; M380-Y404 HydrophobicContact SD-CE1 3.26Å; M380-Y404 WeakPolarHBondContact SD-CE1 3.37Å; R400-Y404 HydrophobicContact CG-CD2 4.15Å; R400-Y404 HydrophobicContact CG-CE2 3.74Å; R400-Y404 WeakPolarHBondContact O-CD2 3.35Å; R400-Y404 PolarHBondContact O-N 3.47Å; A401-Y404 PolarHBondContact O-N 3.31Å; Y404-K406 VanDerWaalsContact C-N 3.32Å; Y404-K406 PolarHBondContact O-N 2.99Å; Y404-L407 CarbonylContact O-C 3.39Å; Y404-L407 PolarHBondContact O-N 3.49Å; Y404-L407 VanDerWaalsContact O-N 3.15Å; Y404-L408 PolarHBondContact O-N 2.97Å; Y404-E409 HydrophobicContact CD1-CB 3.8Å; Y404-E409 HydrophobicContact CD1-CG 4.44Å; Y404-E409 HydrophobicContact CG-CB 4.4Å; Y404-E409 PolarHBondContact O-N 3.31Å; Y404-L412 HydrophobicContact CD1-CB 3.84Å; Y404-L412 HydrophobicContact CD1-CD1 4.04Å; Y404-L412 HydrophobicContact CD2-CB 3.84Å; Y404-L412 HydrophobicContact CE1-CB 3.91Å; Y404-L412 HydrophobicContact CE1-CD1 3.57Å; Y404-L412 HydrophobicContact CE1-CG 4.39Å; Y404-L412 HydrophobicContact CE2-CB 3.91Å; Y404-L412 HydrophobicContact CG-CB 3.82Å; Y404-D416 WeakPolarHBondContact CE2-OD2 3.21Å
405	T	94.5	Very high	95.4	Very high	29 Å²	29	50.6 Å²	50.6	18%	0.178	24%	0.239	C	C	.	.	H	α-helix	trans	-60.8	-40.4	174.8	-52.4	0	0	0	0	112	A401 C403 L407 L408 F410	A401-T405 PolarHBondContact O-N 3.49Å; A401-T405 PolarHBondContact O-OG1 3.46Å; A401-T405 VanDerWaalsContact O-OG1 3.05Å; C403-T405 VanDerWaalsContact C-N 3.34Å; C403-T405 PolarHBondContact O-N 3.03Å; T405-L407 VanDerWaalsContact C-N 3.3Å; T405-L407 PolarHBondContact O-N 2.93Å; T405-L408 PolarHBondContact O-N 3.04Å; T405-F410 HydrophobicContact CG2-CD1 4.42Å; T405-F410 HydrophobicContact CG2-CE1 4.21Å
406	K	94.3	Very high	95.4	Very high	123 Å²	123	46.3 Å²	46.3	54%	0.535	22%	0.221	S	C	.	.	H	α-helix	trans	-68.6	-28.7	176.2	-68.8	-65.3	-175.8	-174.2	0	113.1	Y376 A402 C403 Y404 L408	Y376-K406 HydrophobicContact CD1-CB 3.92Å; Y376-K406 HydrophobicContact CD1-CG 4.08Å; Y376-K406 HydrophobicContact CD2-CB 3.83Å; Y376-K406 HydrophobicContact CE1-CB 3.97Å; Y376-K406 HydrophobicContact CE1-CD 4.4Å; Y376-K406 HydrophobicContact CE1-CG 3.73Å; Y376-K406 HydrophobicContact CE2-CB 3.89Å; Y376-K406 HydrophobicContact CE2-CG 4.28Å; Y376-K406 HydrophobicContact CG-CB 3.84Å; Y376-K406 HydrophobicContact CG-CG 4.49Å; A402-K406 WeakPolarHBondContact O-CG 3.39Å; A402-K406 PolarHBondContact O-N 3.3Å; A402-K406 VanDerWaalsContact O-N 3.14Å; C403-K406 PolarHBondContact O-N 3.28Å; C403-K406 VanDerWaalsContact O-N 3.12Å; Y404-K406 VanDerWaalsContact C-N 3.32Å; Y404-K406 PolarHBondContact O-N 2.99Å; K406-L408 VanDerWaalsContact C-N 3.3Å
407	L	93.4	Very high	95.4	Very high	60 Å²	60	46.2 Å²	46.2	31%	0.314	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	2.9	174.9	-66	172.7	0	0	0	113.3	P377 M380 C403 Y404 T405 E409	P377-L407 HydrophobicContact CG-CD2 4.14Å; M380-L407 HydrophobicContact SD-CD1 4.37Å; C403-L407 WeakPolarHBondContact O-CG 3.4Å; C403-L407 PolarHBondContact O-N 3.12Å; Y404-L407 CarbonylContact O-C 3.39Å; Y404-L407 PolarHBondContact O-N 3.49Å; Y404-L407 VanDerWaalsContact O-N 3.15Å; T405-L407 VanDerWaalsContact C-N 3.3Å; T405-L407 PolarHBondContact O-N 2.93Å; L407-E409 HydrophobicContact CB-CG 4.32Å; L407-E409 PolarHBondContact O-N 3.38Å
408	L	92.1	Very high	95.4	Very high	125 Å²	125	49.7 Å²	49.7	65%	0.654	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.3	17.6	-177.2	-46.9	174.6	0	0	0	114.4	Y404 T405 K406 F410	Y404-L408 PolarHBondContact O-N 2.97Å; T405-L408 PolarHBondContact O-N 3.04Å; K406-L408 VanDerWaalsContact C-N 3.3Å; L408-F410 VanDerWaalsContact C-N 3.28Å; L408-F410 HydrophobicContact CB-CE2 4.09Å; L408-F410 HydrophobicContact CB-CZ 3.96Å; L408-F410 HydrophobicContact CD2-CE1 4.23Å; L408-F410 HydrophobicContact CD2-CE2 4.37Å; L408-F410 HydrophobicContact CD2-CZ 3.57Å; L408-F410 HydrophobicContact CG-CZ 4.39Å; L408-F410 WeakPolarHBondContact O-CD2 3.42Å; L408-F410 PolarHBondContact O-N 3.4Å; L408-F410 VanDerWaalsContact O-N 3.12Å
409	E	93	Very high	95.4	Very high	102 Å²	102	52.9 Å²	52.9	48%	0.477	25%	0.252	S	S	.	.			trans	-88.6	60.7	177.3	-68.3	-63.9	168.6	0	0	110.9	Y404 L407 Q411 L412 A413	Y404-E409 HydrophobicContact CD1-CB 3.8Å; Y404-E409 HydrophobicContact CD1-CG 4.44Å; Y404-E409 HydrophobicContact CG-CB 4.4Å; Y404-E409 PolarHBondContact O-N 3.31Å; L407-E409 HydrophobicContact CB-CG 4.32Å; L407-E409 PolarHBondContact O-N 3.38Å; E409-Q411 VanDerWaalsContact C-N 3.32Å; E409-Q411 PolarHBondContact O-N 3.09Å; E409-L412 HydrophobicContact CB-CD1 4.37Å; E409-L412 PolarHBondContact O-N 2.84Å; E409-A413 PolarHBondContact O-N 3.41Å; E409-A413 VanDerWaalsContact O-N 3.09Å
410	F	90.2	Very high	95.4	Very high	42 Å²	42	51.4 Å²	51.4	18%	0.184	24%	0.244	C	C	.	.	H	α-helix	trans	-62.3	-34.2	-166.9	-53.8	-60.7	0	0	0	114.1	T405 L408 A413 L414 A440 M441	T405-F410 HydrophobicContact CG2-CD1 4.42Å; T405-F410 HydrophobicContact CG2-CE1 4.21Å; L408-F410 VanDerWaalsContact C-N 3.28Å; L408-F410 HydrophobicContact CB-CE2 4.09Å; L408-F410 HydrophobicContact CB-CZ 3.96Å; L408-F410 HydrophobicContact CD2-CE1 4.23Å; L408-F410 HydrophobicContact CD2-CE2 4.37Å; L408-F410 HydrophobicContact CD2-CZ 3.57Å; L408-F410 HydrophobicContact CG-CZ 4.39Å; L408-F410 WeakPolarHBondContact O-CD2 3.42Å; L408-F410 PolarHBondContact O-N 3.4Å; L408-F410 VanDerWaalsContact O-N 3.12Å; F410-A413 WeakPolarHBondContact O-CB 3.4Å; F410-A413 PolarHBondContact O-N 3.03Å; F410-L414 WeakPolarHBondContact O-CG 3.24Å; F410-L414 PolarHBondContact O-N 3.34Å; F410-A440 HydrophobicContact CD1-CB 3.92Å; F410-A440 HydrophobicContact CE1-CB 3.32Å; F410-A440 HydrophobicContact CZ-CB 3.65Å; F410-M441 HydrophobicContact CB-CG 3.53Å; F410-M441 HydrophobicContact CB-SD 3.56Å; F410-M441 VanDerWaalsContact CB-SD 3.56Å; F410-M441 HydrophobicContact CD2-CG 3.74Å; F410-M441 HydrophobicContact CG-CG 3.71Å; F410-M441 HydrophobicContact CG-SD 4.41Å
411	Q	91.4	Very high	95.4	Very high	121 Å²	121	51.3 Å²	51.3	57%	0.565	25%	0.246	S	C	*	.	H	α-helix	trans	-65.1	-40.6	178.5	-67.4	-60.1	-57.9	0	0	112.3	E409 L414 K415 M441	E409-Q411 VanDerWaalsContact C-N 3.32Å; E409-Q411 PolarHBondContact O-N 3.09Å; Q411-L414 PolarHBondContact O-N 3.38Å; Q411-K415 PolarHBondContact O-N 3.31Å; Q411-K415 VanDerWaalsContact O-N 3.16Å; Q411-M441 PolarHBondContact NE2-SD 2.96Å; Q411-M441 VanDerWaalsContact NE2-SD 3.44Å
412	L	92.9	Very high	95.3	Very high	75 Å²	75	58.1 Å²	58.1	39%	0.393	28%	0.277	S	S	.	.	H	α-helix	trans	-69	-37.4	175.4	-64.2	177.7	0	0	0	111.1	Y404 E409 K415 D416	Y404-L412 HydrophobicContact CD1-CB 3.84Å; Y404-L412 HydrophobicContact CD1-CD1 4.04Å; Y404-L412 HydrophobicContact CD2-CB 3.84Å; Y404-L412 HydrophobicContact CE1-CB 3.91Å; Y404-L412 HydrophobicContact CE1-CD1 3.57Å; Y404-L412 HydrophobicContact CE1-CG 4.39Å; Y404-L412 HydrophobicContact CE2-CB 3.91Å; Y404-L412 HydrophobicContact CG-CB 3.82Å; E409-L412 HydrophobicContact CB-CD1 4.37Å; E409-L412 PolarHBondContact O-N 2.84Å; L412-K415 PolarHBondContact O-N 3.12Å; L412-D416 PolarHBondContact O-N 2.91Å
413	A	96	Very high	95.3	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-59.8	-45.6	173.2	0	0	0	0	0	112	A401 E409 F410 K415 D416 C417 A437	A401-A413 HydrophobicContact CB-CB 4.47Å; E409-A413 PolarHBondContact O-N 3.41Å; E409-A413 VanDerWaalsContact O-N 3.09Å; F410-A413 WeakPolarHBondContact O-CB 3.4Å; F410-A413 PolarHBondContact O-N 3.03Å; A413-K415 VanDerWaalsContact C-N 3.35Å; A413-K415 PolarHBondContact O-N 3.4Å; A413-D416 PolarHBondContact O-N 2.97Å; A413-C417 PolarHBondContact O-N 3.02Å; A413-C417 PolarHBondContact O-SG 2.93Å; A413-A437 HydrophobicContact CB-CB 4.19Å
414	L	95.2	Very high	95.3	Very high	20 Å²	20	63.9 Å²	63.9	11%	0.105	31%	0.305	C	S	.	.	H	α-helix	trans	-60.5	-44	178.1	-69.6	175	0	0	0	111.8	F410 Q411 C417 E418 K434 A437 L438 M441	F410-L414 WeakPolarHBondContact O-CG 3.24Å; F410-L414 PolarHBondContact O-N 3.34Å; Q411-L414 PolarHBondContact O-N 3.38Å; L414-C417 PolarHBondContact O-N 3.23Å; L414-E418 WeakPolarHBondContact O-CG 3.11Å; L414-E418 PolarHBondContact O-N 2.95Å; L414-K434 HydrophobicContact CD2-CG 3.84Å; L414-A437 HydrophobicContact CD2-CB 3.88Å; L414-A437 HydrophobicContact CG-CB 4.31Å; L414-L438 HydrophobicContact CD1-CD2 4.08Å; L414-L438 HydrophobicContact CD2-CD2 3.95Å; L414-L438 HydrophobicContact CD2-CG 3.83Å; L414-M441 HydrophobicContact CD1-SD 3.95Å
415	K	96.8	Very high	95.3	Very high	139 Å²	139	66 Å²	66	60%	0.604	32%	0.322	S	S	*	.	H	α-helix	trans	-60.9	-45.8	177.5	-172.5	-179.7	-179.6	179.8	0	112.2	Q411 L412 A413 C417 E418 E419	Q411-K415 PolarHBondContact O-N 3.31Å; Q411-K415 VanDerWaalsContact O-N 3.16Å; L412-K415 PolarHBondContact O-N 3.12Å; A413-K415 VanDerWaalsContact C-N 3.35Å; A413-K415 PolarHBondContact O-N 3.4Å; K415-C417 VanDerWaalsContact C-N 3.32Å; K415-C417 PolarHBondContact O-N 3.34Å; K415-E418 PolarHBondContact O-N 2.76Å; K415-E419 PolarHBondContact O-N 3.13Å
416	D	97.4	Very high	95.3	Very high	10 Å²	10	69.2 Å²	69.2	5%	0.053	34%	0.342	C	S	.	.	H	α-helix	trans	-65.7	-35.8	176.3	-87.8	-0.8	0	0	0	111.9	Y397 R400 A401 Y404 L412 A413 E418 E419 C420	Y397-D416 WeakPolarHBondContact CB-O 2.9Å; R400-D416 WeakPolarHBondContact CB-OD2 3.48Å; R400-D416 IonicContact CZ-OD1 3.57Å; R400-D416 IonicContact CZ-OD2 2.93Å; R400-D416 IonicContact NE-OD1 3.53Å; R400-D416 IonicContact NE-OD2 2.75Å; R400-D416 PolarHBondContact NE-OD2 3.48Å; R400-D416 IonicContact NH2-OD1 3.53Å; R400-D416 PolarHBondContact NH2-OD1 3.13Å; R400-D416 IonicContact NH2-OD2 2.75Å; R400-D416 PolarHBondContact NH2-OD2 3.48Å; A401-D416 HydrophobicContact CB-CB 3.87Å; Y404-D416 WeakPolarHBondContact CE2-OD2 3.21Å; L412-D416 PolarHBondContact O-N 2.91Å; A413-D416 PolarHBondContact O-N 2.97Å; D416-E418 VanDerWaalsContact C-N 3.34Å; D416-E419 PolarHBondContact O-N 3.06Å; D416-C420 WeakPolarHBondContact O-CB 3.39Å; D416-C420 PolarHBondContact O-N 3.39Å
417	C	97.4	Very high	95.4	Very high	0 Å²	0	65 Å²	65	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-67.5	-35.7	175	-63.8	0	0	0	0	112.2	A401 A413 L414 K415 C420 I421 R433 K434	A401-C417 VanDerWaalsContact CB-SG 3.52Å; A413-C417 PolarHBondContact O-N 3.02Å; A413-C417 PolarHBondContact O-SG 2.93Å; L414-C417 PolarHBondContact O-N 3.23Å; K415-C417 VanDerWaalsContact C-N 3.32Å; K415-C417 PolarHBondContact O-N 3.34Å; C417-C420 WeakPolarHBondContact O-CB 3.45Å; C417-C420 PolarHBondContact O-N 3.45Å; C417-I421 WeakPolarHBondContact O-CB 3.44Å; C417-I421 WeakPolarHBondContact O-CD1 3.46Å; C417-I421 WeakPolarHBondContact O-CG1 3.41Å; C417-I421 PolarHBondContact O-N 3.38Å; C417-R433 VanDerWaalsContact SG-CB 3.52Å; C417-K434 HydrophobicContact CB-CB 3.68Å; C417-K434 HydrophobicContact CB-CG 4.29Å; C417-K434 PolarHBondContact SG-N 3.43Å; C417-K434 VanDerWaalsContact SG-N 3.41Å
418	E	97.3	Very high	95.5	Very high	98 Å²	98	64.2 Å²	64.2	46%	0.458	32%	0.32	S	S	.	.	H	α-helix	trans	-65	-46.3	174.7	-76.5	173.3	176.3	0	0	111.7	L414 K415 D416 C420 I421 Q422 K434	L414-E418 WeakPolarHBondContact O-CG 3.11Å; L414-E418 PolarHBondContact O-N 2.95Å; K415-E418 PolarHBondContact O-N 2.76Å; D416-E418 VanDerWaalsContact C-N 3.34Å; E418-C420 VanDerWaalsContact C-N 3.31Å; E418-C420 PolarHBondContact O-N 3.02Å; E418-I421 PolarHBondContact O-N 3.03Å; E418-Q422 WeakPolarHBondContact O-CB 3.42Å; E418-Q422 PolarHBondContact O-N 3.37Å; E418-K434 IonicContact OE1-NZ 3.37Å; E418-K434 PolarHBondContact OE1-NZ 2.73Å
419	E	97.6	Very high	95.6	Very high	68 Å²	68	63.1 Å²	63.1	32%	0.318	31%	0.31	S	S	.	.	H	α-helix	trans	-61.7	-41.9	174.4	-165.4	69.3	-148	0	0	111.2	Y397 K415 D416 I421 Q422 L423	Y397-E419 HydrophobicContact CD1-CB 3.89Å; Y397-E419 HydrophobicContact CD1-CG 3.81Å; Y397-E419 HydrophobicContact CE1-CB 4.07Å; Y397-E419 HydrophobicContact CE1-CG 3.5Å; Y397-E419 HydrophobicContact CE2-CG 4.33Å; Y397-E419 HydrophobicContact CG-CB 4.4Å; Y397-E419 HydrophobicContact CG-CG 4.32Å; K415-E419 PolarHBondContact O-N 3.13Å; D416-E419 PolarHBondContact O-N 3.06Å; E419-I421 PolarHBondContact O-N 3.37Å; E419-Q422 PolarHBondContact O-N 2.99Å; E419-L423 HydrophobicContact CG-CD1 4.23Å; E419-L423 WeakPolarHBondContact O-CB 3.38Å; E419-L423 VanDerWaalsContact O-CG 3.27Å; E419-L423 WeakPolarHBondContact O-CG 3.33Å; E419-L423 PolarHBondContact O-N 3.38Å
420	C	97.8	Very high	95.8	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-57.2	-48.4	175.3	-178.2	0	0	0	0	112.2	A394 D416 C417 E418 L423 E424 F427	A394-C420 PolarHBondContact O-SG 3.2Å; D416-C420 WeakPolarHBondContact O-CB 3.39Å; D416-C420 PolarHBondContact O-N 3.39Å; C417-C420 WeakPolarHBondContact O-CB 3.45Å; C417-C420 PolarHBondContact O-N 3.45Å; E418-C420 VanDerWaalsContact C-N 3.31Å; E418-C420 PolarHBondContact O-N 3.02Å; C420-L423 PolarHBondContact O-N 2.93Å; C420-E424 PolarHBondContact O-N 3.11Å; C420-F427 VanDerWaalsContact SG-CD1 3.56Å
421	I	97.3	Very high	96.1	Very high	27 Å²	27	58 Å²	58	14%	0.138	29%	0.285	C	S	.	.	H	α-helix	trans	-67.6	-37.5	178.2	-68.9	164.1	0	0	0	111	C417 E418 E419 E424 P425 Y431 K434	C417-I421 WeakPolarHBondContact O-CB 3.44Å; C417-I421 WeakPolarHBondContact O-CD1 3.46Å; C417-I421 WeakPolarHBondContact O-CG1 3.41Å; C417-I421 PolarHBondContact O-N 3.38Å; E418-I421 PolarHBondContact O-N 3.03Å; E419-I421 PolarHBondContact O-N 3.37Å; I421-E424 CarbonylContact O-C 3.49Å; I421-P425 VanDerWaalsContact O-CA 3.22Å; I421-P425 WeakPolarHBondContact O-CA 3.23Å; I421-P425 WeakPolarHBondContact O-CD 3.22Å; I421-P425 WeakPolarHBondContact O-CG 3.36Å; I421-P425 VanDerWaalsContact O-N 3.08Å; I421-Y431 HydrophobicContact CD1-CD1 3.93Å; I421-Y431 HydrophobicContact CD1-CD2 4.29Å; I421-Y431 HydrophobicContact CD1-CE1 4.03Å; I421-Y431 HydrophobicContact CD1-CE2 4.36Å; I421-Y431 HydrophobicContact CD1-CG 4.07Å; I421-Y431 HydrophobicContact CG1-CD2 4.05Å; I421-Y431 HydrophobicContact CG1-CE1 4.39Å; I421-Y431 HydrophobicContact CG1-CE2 3.9Å; I421-Y431 HydrophobicContact CG1-CG 4.35Å; I421-Y431 HydrophobicContact CG2-CE1 4.13Å; I421-Y431 HydrophobicContact CG2-CE2 4.02Å; I421-Y431 WeakPolarHBondContact CG2-OH 3.39Å; I421-K434 HydrophobicContact CD1-CD 4.08Å
422	Q	97.5	Very high	96.4	Very high	143 Å²	143	52.2 Å²	52.2	67%	0.668	26%	0.258	S	S	*	.	H	α-helix	trans	-65.2	-39.7	176.9	-177.5	176.7	-6.2	0	0	111.9	E418 E419	E418-Q422 WeakPolarHBondContact O-CB 3.42Å; E418-Q422 PolarHBondContact O-N 3.37Å; E419-Q422 PolarHBondContact O-N 2.99Å
423	L	95.9	Very high	96.6	Very high	60 Å²	60	51.5 Å²	51.5	31%	0.314	25%	0.25	S	C	.	.	H	α-helix	trans	-71.8	-42	177.6	-71.7	172	0	0	0	112.3	A394 Y397 E419 C420	A394-L423 HydrophobicContact CB-CB 3.94Å; Y397-L423 HydrophobicContact CD2-CD1 3.64Å; Y397-L423 HydrophobicContact CE2-CD1 3.43Å; Y397-L423 VanDerWaalsContact CE2-CD1 3.43Å; E419-L423 HydrophobicContact CG-CD1 4.23Å; E419-L423 WeakPolarHBondContact O-CB 3.38Å; E419-L423 VanDerWaalsContact O-CG 3.27Å; E419-L423 WeakPolarHBondContact O-CG 3.33Å; E419-L423 PolarHBondContact O-N 3.38Å; C420-L423 PolarHBondContact O-N 2.93Å
424	E	96.6	Very high	96.7	Very high	68 Å²	68	53.5 Å²	53.5	32%	0.318	26%	0.259	S	S	.	.			trans	-139	87	-179.7	-163.8	-179.5	157.1	0	0	111	A394 C420 I421 T426 F427	A394-E424 HydrophobicContact CB-CB 3.58Å; C420-E424 PolarHBondContact O-N 3.11Å; I421-E424 CarbonylContact O-C 3.49Å; E424-T426 PolarHBondContact O-N 3.47Å; E424-T426 VanDerWaalsContact O-N 3.12Å; E424-F427 HydrophobicContact CB-CB 3.86Å; E424-F427 HydrophobicContact CG-CB 3.76Å; E424-F427 VanDerWaalsContact O-CB 3.29Å; E424-F427 WeakPolarHBondContact O-CB 3.46Å; E424-F427 PolarHBondContact O-N 3.08Å
425	P	96.6	Very high	96.8	Very high	75 Å²	75	52.6 Å²	52.6	49%	0.487	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-18.2	-176.3	-25.2	33.9	0	0	0	115.2	I421 Y431	I421-P425 VanDerWaalsContact O-CA 3.22Å; I421-P425 WeakPolarHBondContact O-CA 3.23Å; I421-P425 WeakPolarHBondContact O-CD 3.22Å; I421-P425 WeakPolarHBondContact O-CG 3.36Å; I421-P425 VanDerWaalsContact O-N 3.08Å; P425-Y431 VanDerWaalsContact O-CE2 3.25Å; P425-Y431 WeakPolarHBondContact O-CE2 3.47Å; P425-Y431 PolarHBondContact O-OH 2.75Å
426	T	95.3	Very high	96.7	Very high	98 Å²	98	47.1 Å²	47.1	60%	0.601	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-3.9	176	52.6	0	0	0	0	112.6	E424 I428	E424-T426 PolarHBondContact O-N 3.47Å; E424-T426 VanDerWaalsContact O-N 3.12Å; T426-I428 PolarHBondContact O-N 2.81Å; T426-I428 VanDerWaalsContact O-N 3.08Å
427	F	95.6	Very high	96.6	Very high	34 Å²	34	46.7 Å²	46.7	15%	0.149	23%	0.232	C	C	.	.			trans	-81.3	94.7	-176.9	-171.3	-132.4	0	0	0	111.3	A394 K395 C420 E424 K429 G430	A394-F427 HydrophobicContact CB-CD1 4.42Å; K395-F427 HydrophobicContact CG-CE1 4.16Å; K395-F427 HydrophobicContact CG-CE2 4.4Å; K395-F427 HydrophobicContact CG-CZ 3.83Å; C420-F427 VanDerWaalsContact SG-CD1 3.56Å; E424-F427 HydrophobicContact CB-CB 3.86Å; E424-F427 HydrophobicContact CG-CB 3.76Å; E424-F427 VanDerWaalsContact O-CB 3.29Å; E424-F427 WeakPolarHBondContact O-CB 3.46Å; E424-F427 PolarHBondContact O-N 3.08Å; F427-K429 HydrophobicContact CD1-CB 4.26Å; F427-K429 HydrophobicContact CE1-CB 3.74Å; F427-K429 HydrophobicContact CE2-CB 4.04Å; F427-K429 HydrophobicContact CE2-CD 4.27Å; F427-K429 HydrophobicContact CE2-CG 4.23Å; F427-K429 HydrophobicContact CZ-CB 3.62Å; F427-K429 HydrophobicContact CZ-CD 3.88Å; F427-K429 HydrophobicContact CZ-CG 4.07Å; F427-K429 PolarHBondContact O-N 3.38Å; F427-G430 PolarHBondContact O-N 3.01Å
428	I	95.5	Very high	96.5	Very high	44 Å²	44	47.3 Å²	47.3	23%	0.226	24%	0.236	C	C	.	.	H	α-helix	trans	-50.7	-37.7	-175.8	-62.3	153	0	0	0	112.6	T426 G430 Y431 T432 A454 L457 D458 C461	T426-I428 PolarHBondContact O-N 2.81Å; T426-I428 VanDerWaalsContact O-N 3.08Å; I428-G430 PolarHBondContact O-N 2.75Å; I428-Y431 PolarHBondContact O-N 3.38Å; I428-T432 HydrophobicContact CG2-CG2 3.97Å; I428-T432 PolarHBondContact O-N 3.37Å; I428-A454 HydrophobicContact CG2-CB 4.29Å; I428-L457 HydrophobicContact CG1-CB 4.15Å; I428-D458 HydrophobicContact CD1-CB 3.38Å; I428-D458 HydrophobicContact CG1-CB 4.22Å; I428-C461 HydrophobicContact CG2-CB 4.44Å
429	K	95.4	Very high	96.3	Very high	102 Å²	102	44.5 Å²	44.5	44%	0.443	22%	0.222	S	C	.	.	H	α-helix	trans	-61.5	-26.9	179.1	-72	-168.8	176.2	-177.6	0	113.5	F427 T432 R433	F427-K429 HydrophobicContact CD1-CB 4.26Å; F427-K429 HydrophobicContact CE1-CB 3.74Å; F427-K429 HydrophobicContact CE2-CB 4.04Å; F427-K429 HydrophobicContact CE2-CD 4.27Å; F427-K429 HydrophobicContact CE2-CG 4.23Å; F427-K429 HydrophobicContact CZ-CB 3.62Å; F427-K429 HydrophobicContact CZ-CD 3.88Å; F427-K429 HydrophobicContact CZ-CG 4.07Å; F427-K429 PolarHBondContact O-N 3.38Å; K429-T432 WeakPolarHBondContact CA-OG1 3.48Å; K429-T432 PolarHBondContact O-OG1 2.99Å; K429-R433 VanDerWaalsContact O-CB 3.23Å; K429-R433 WeakPolarHBondContact O-CB 3.32Å; K429-R433 WeakPolarHBondContact O-CG 3.45Å; K429-R433 PolarHBondContact O-N 3.03Å
430	G	96.1	Very high	95.9	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-62.6	-44.7	172.7	0	0	0	0	0	111.4	F427 I428 K434	F427-G430 PolarHBondContact O-N 3.01Å; I428-G430 PolarHBondContact O-N 2.75Å; G430-K434 WeakPolarHBondContact O-CB 3.39Å; G430-K434 PolarHBondContact O-N 2.89Å
431	Y	97.5	Very high	95.4	Very high	36 Å²	36	47.1 Å²	47.1	14%	0.141	24%	0.244	C	C	.	.	H	α-helix	trans	-70.1	-46.4	178	-63.6	-93.9	0	0	0	112.2	I421 P425 I428 R433 K434 A435 V450 K453 L457	I421-Y431 HydrophobicContact CD1-CD1 3.93Å; I421-Y431 HydrophobicContact CD1-CD2 4.29Å; I421-Y431 HydrophobicContact CD1-CE1 4.03Å; I421-Y431 HydrophobicContact CD1-CE2 4.36Å; I421-Y431 HydrophobicContact CD1-CG 4.07Å; I421-Y431 HydrophobicContact CG1-CD2 4.05Å; I421-Y431 HydrophobicContact CG1-CE1 4.39Å; I421-Y431 HydrophobicContact CG1-CE2 3.9Å; I421-Y431 HydrophobicContact CG1-CG 4.35Å; I421-Y431 HydrophobicContact CG2-CE1 4.13Å; I421-Y431 HydrophobicContact CG2-CE2 4.02Å; I421-Y431 WeakPolarHBondContact CG2-OH 3.39Å; P425-Y431 VanDerWaalsContact O-CE2 3.25Å; P425-Y431 WeakPolarHBondContact O-CE2 3.47Å; P425-Y431 PolarHBondContact O-OH 2.75Å; I428-Y431 PolarHBondContact O-N 3.38Å; Y431-R433 VanDerWaalsContact C-N 3.31Å; Y431-R433 PolarHBondContact O-N 3.32Å; Y431-K434 PolarHBondContact O-N 2.96Å; Y431-A435 WeakPolarHBondContact O-CB 3.37Å; Y431-A435 PolarHBondContact O-N 3.32Å; Y431-V450 HydrophobicContact CD1-CG1 4.32Å; Y431-V450 VanDerWaalsContact O-CG1 3.32Å; Y431-V450 WeakPolarHBondContact O-CG1 3.34Å; Y431-K453 HydrophobicContact CD1-CB 3.92Å; Y431-K453 HydrophobicContact CE1-CB 4.09Å; Y431-K453 HydrophobicContact CE1-CD 4.41Å; Y431-L457 HydrophobicContact CD2-CD1 3.81Å; Y431-L457 HydrophobicContact CE2-CD1 3.52Å
432	T	96.9	Very high	94.9	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-64.5	-36.2	179.9	64.8	0	0	0	0	111.9	I428 K429 A436 A454 E463 A464	I428-T432 HydrophobicContact CG2-CG2 3.97Å; I428-T432 PolarHBondContact O-N 3.37Å; K429-T432 WeakPolarHBondContact CA-OG1 3.48Å; K429-T432 PolarHBondContact O-OG1 2.99Å; T432-A436 VanDerWaalsContact O-CB 3.28Å; T432-A436 WeakPolarHBondContact O-CB 3.38Å; T432-A436 PolarHBondContact O-N 2.89Å; T432-A454 HydrophobicContact CG2-CB 4.09Å; T432-E463 HydrophobicContact CG2-CG 4.49Å; T432-E463 PolarHBondContact OG1-OE2 2.87Å; T432-A464 HydrophobicContact CG2-CB 4.06Å
433	R	97.3	Very high	94.4	Very high	59 Å²	59	47.2 Å²	47.2	22%	0.223	24%	0.243	C	C	.	.	H	α-helix	trans	-67.3	-41.9	173.1	-68.1	-72.6	-177.5	-117.5	2.3	112.5	C417 K429 Y431 A436 A437 E463	C417-R433 VanDerWaalsContact SG-CB 3.52Å; K429-R433 VanDerWaalsContact O-CB 3.23Å; K429-R433 WeakPolarHBondContact O-CB 3.32Å; K429-R433 WeakPolarHBondContact O-CG 3.45Å; K429-R433 PolarHBondContact O-N 3.03Å; Y431-R433 VanDerWaalsContact C-N 3.31Å; Y431-R433 PolarHBondContact O-N 3.32Å; R433-A436 PolarHBondContact O-N 3.36Å; R433-A437 PolarHBondContact O-N 2.91Å; R433-E463 IonicContact NH1-OE1 2.94Å; R433-E463 PolarHBondContact NH1-OE1 3.2Å
434	K	97.6	Very high	93.9	Very high	43 Å²	43	46.2 Å²	46.2	19%	0.187	24%	0.235	C	C	.	.	H	α-helix	trans	-60.9	-48.1	175.4	-174.4	170.2	-173.2	162.8	0	111.1	L414 C417 E418 I421 G430 Y431 A437 L438 V450	L414-K434 HydrophobicContact CD2-CG 3.84Å; C417-K434 HydrophobicContact CB-CB 3.68Å; C417-K434 HydrophobicContact CB-CG 4.29Å; C417-K434 PolarHBondContact SG-N 3.43Å; C417-K434 VanDerWaalsContact SG-N 3.41Å; E418-K434 IonicContact OE1-NZ 3.37Å; E418-K434 PolarHBondContact OE1-NZ 2.73Å; I421-K434 HydrophobicContact CD1-CD 4.08Å; G430-K434 WeakPolarHBondContact O-CB 3.39Å; G430-K434 PolarHBondContact O-N 2.89Å; Y431-K434 PolarHBondContact O-N 2.96Å; K434-A437 PolarHBondContact O-N 2.88Å; K434-L438 HydrophobicContact CG-CD1 4.35Å; K434-L438 WeakPolarHBondContact O-CG 3.36Å; K434-L438 PolarHBondContact O-N 3.48Å; K434-V450 HydrophobicContact CB-CG1 3.96Å; K434-V450 HydrophobicContact CD-CG1 4.26Å; K434-V450 HydrophobicContact CD-CG2 4.4Å; K434-V450 HydrophobicContact CG-CG1 4.11Å
435	A	96.8	Very high	93.4	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-63.7	-42	179	0	0	0	0	0	112	Y431 A437 L438 E439 V450 Y451	Y431-A435 WeakPolarHBondContact O-CB 3.37Å; Y431-A435 PolarHBondContact O-N 3.32Å; A435-A437 VanDerWaalsContact C-N 3.33Å; A435-A437 PolarHBondContact O-N 3.47Å; A435-L438 PolarHBondContact O-N 2.96Å; A435-E439 WeakPolarHBondContact O-CB 3.39Å; A435-E439 PolarHBondContact O-N 3.1Å; A435-V450 HydrophobicContact CB-CB 3.95Å; A435-V450 HydrophobicContact CB-CG1 3.84Å; A435-Y451 HydrophobicContact CB-CD1 3.41Å; A435-Y451 VanDerWaalsContact CB-CD1 3.41Å; A435-Y451 HydrophobicContact CB-CD2 3.62Å; A435-Y451 HydrophobicContact CB-CE1 3.39Å; A435-Y451 HydrophobicContact CB-CE2 3.59Å; A435-Y451 HydrophobicContact CB-CG 3.53Å; A435-Y451 VanDerWaalsContact CB-CZ 3.48Å
436	A	95.9	Very high	93	Very high	25 Å²	25	45.7 Å²	45.7	21%	0.207	23%	0.228	C	C	.	.	H	α-helix	trans	-62.7	-36.8	175.3	0	0	0	0	0	112.9	T432 R433 A440 Y451	T432-A436 VanDerWaalsContact O-CB 3.28Å; T432-A436 WeakPolarHBondContact O-CB 3.38Å; T432-A436 PolarHBondContact O-N 2.89Å; R433-A436 PolarHBondContact O-N 3.36Å; A436-A440 WeakPolarHBondContact O-CB 3.24Å; A436-A440 PolarHBondContact O-N 3.01Å; A436-Y451 WeakPolarHBondContact CA-OH 3.36Å; A436-Y451 PolarHBondContact N-OH 3.38Å
437	A	95.8	Very high	92.9	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-66.5	-41	174.1	0	0	0	0	0	111.9	A413 L414 R433 K434 A435 A440 M441	A413-A437 HydrophobicContact CB-CB 4.19Å; L414-A437 HydrophobicContact CD2-CB 3.88Å; L414-A437 HydrophobicContact CG-CB 4.31Å; R433-A437 PolarHBondContact O-N 2.91Å; K434-A437 PolarHBondContact O-N 2.88Å; A435-A437 VanDerWaalsContact C-N 3.33Å; A435-A437 PolarHBondContact O-N 3.47Å; A437-A440 PolarHBondContact O-N 3.12Å; A437-M441 WeakPolarHBondContact O-CG 3.2Å; A437-M441 PolarHBondContact O-N 3.22Å
438	L	93.4	Very high	92.7	Very high	13 Å²	13	40.3 Å²	40.3	7%	0.068	20%	0.197	C	C	.	.	H	α-helix	trans	-66.2	-41	174.5	-68.1	168.4	0	0	0	112.2	L414 K434 A435 A440 M441 K442 D443 K446 A447 V450	L414-L438 HydrophobicContact CD1-CD2 4.08Å; L414-L438 HydrophobicContact CD2-CD2 3.95Å; L414-L438 HydrophobicContact CD2-CG 3.83Å; K434-L438 HydrophobicContact CG-CD1 4.35Å; K434-L438 WeakPolarHBondContact O-CG 3.36Å; K434-L438 PolarHBondContact O-N 3.48Å; A435-L438 PolarHBondContact O-N 2.96Å; L438-A440 VanDerWaalsContact C-N 3.34Å; L438-A440 PolarHBondContact O-N 2.93Å; L438-M441 CarbonylContact O-C 3.59Å; L438-M441 WeakPolarHBondContact O-CA 3.41Å; L438-M441 WeakPolarHBondContact O-CB 3.49Å; L438-M441 PolarHBondContact O-N 2.96Å; L438-M441 VanDerWaalsContact O-N 3.15Å; L438-K442 PolarHBondContact O-N 3.49Å; L438-K442 VanDerWaalsContact O-N 3.09Å; L438-D443 HydrophobicContact CD2-CB 4.45Å; L438-D443 PolarHBondContact O-N 3.03Å; L438-K446 HydrophobicContact CD1-CB 3.94Å; L438-K446 HydrophobicContact CD2-CB 4.47Å; L438-A447 HydrophobicContact CB-CB 3.78Å; L438-V450 HydrophobicContact CD1-CG2 3.92Å
439	E	93	Very high	92.6	Very high	39 Å²	39	42.7 Å²	42.7	18%	0.182	21%	0.21	C	C	.	.	H	α-helix	trans	-58.1	-46.2	173.6	179.1	-178.9	174.3	0	0	110.3	A435 M441 K442 A447 Y451 R470	A435-E439 WeakPolarHBondContact O-CB 3.39Å; A435-E439 PolarHBondContact O-N 3.1Å; E439-M441 VanDerWaalsContact C-N 3.29Å; E439-M441 PolarHBondContact O-N 3.43Å; E439-K442 WeakPolarHBondContact O-CA 3.37Å; E439-K442 PolarHBondContact O-N 3.34Å; E439-A447 HydrophobicContact CB-CB 4.2Å; E439-Y451 PolarHBondContact OE2-OH 2.94Å; E439-R470 IonicContact OE1-CZ 3.45Å; E439-R470 IonicContact OE1-NE 2.77Å; E439-R470 PolarHBondContact OE1-NE 3.16Å; E439-R470 IonicContact OE1-NH2 3.08Å; E439-R470 IonicContact OE2-NH2 3.51Å; E439-R470 PolarHBondContact OE2-NH2 2.83Å
440	A	90.8	Very high	92.6	Very high	47 Å²	47	38.6 Å²	38.6	39%	0.388	19%	0.194	S	C	.	.	H	α-helix	trans	-65	-31.4	176.4	0	0	0	0	0	113.1	F410 A436 A437 L438 K442	F410-A440 HydrophobicContact CD1-CB 3.92Å; F410-A440 HydrophobicContact CE1-CB 3.32Å; F410-A440 HydrophobicContact CZ-CB 3.65Å; A436-A440 WeakPolarHBondContact O-CB 3.24Å; A436-A440 PolarHBondContact O-N 3.01Å; A437-A440 PolarHBondContact O-N 3.12Å; L438-A440 VanDerWaalsContact C-N 3.34Å; L438-A440 PolarHBondContact O-N 2.93Å; A440-K442 PolarHBondContact O-N 2.89Å
441	M	87.4	Confident	92.7	Very high	76 Å²	76	38.7 Å²	38.7	37%	0.374	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-3.2	170.4	-70.2	-179.2	61.2	0	0	113.8	F410 Q411 L414 A437 L438 E439 D443	F410-M441 HydrophobicContact CB-CG 3.53Å; F410-M441 HydrophobicContact CB-SD 3.56Å; F410-M441 VanDerWaalsContact CB-SD 3.56Å; F410-M441 HydrophobicContact CD2-CG 3.74Å; F410-M441 HydrophobicContact CG-CG 3.71Å; F410-M441 HydrophobicContact CG-SD 4.41Å; Q411-M441 PolarHBondContact NE2-SD 2.96Å; Q411-M441 VanDerWaalsContact NE2-SD 3.44Å; L414-M441 HydrophobicContact CD1-SD 3.95Å; A437-M441 WeakPolarHBondContact O-CG 3.2Å; A437-M441 PolarHBondContact O-N 3.22Å; L438-M441 CarbonylContact O-C 3.59Å; L438-M441 WeakPolarHBondContact O-CA 3.41Å; L438-M441 WeakPolarHBondContact O-CB 3.49Å; L438-M441 PolarHBondContact O-N 2.96Å; L438-M441 VanDerWaalsContact O-N 3.15Å; E439-M441 VanDerWaalsContact C-N 3.29Å; E439-M441 PolarHBondContact O-N 3.43Å; M441-D443 PolarHBondContact O-N 3.38Å
442	K	86.9	Confident	92.6	Very high	129 Å²	129	40.4 Å²	40.4	56%	0.561	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.5	23	-175.7	-46.8	-178.8	177.9	-179.4	0	114.3	L438 E439 A440 Y444 R478	L438-K442 PolarHBondContact O-N 3.49Å; L438-K442 VanDerWaalsContact O-N 3.09Å; E439-K442 WeakPolarHBondContact O-CA 3.37Å; E439-K442 PolarHBondContact O-N 3.34Å; A440-K442 PolarHBondContact O-N 2.89Å; K442-Y444 HydrophobicContact CB-CE1 4.27Å; K442-Y444 HydrophobicContact CB-CE2 4.1Å; K442-Y444 PolarHBondContact O-N 3.16Å; K442-R478 PolarHBondContact O-NH1 3.21Å; K442-R478 PolarHBondContact O-NH2 3.13Å
443	D	85.2	Confident	92.5	Very high	43 Å²	43	46.1 Å²	46.1	23%	0.23	23%	0.228	C	C	.	.			trans	-88.3	65.7	169.5	-163	-18	0	0	0	108.8	L438 M441 T445 K446 A447	L438-D443 HydrophobicContact CD2-CB 4.45Å; L438-D443 PolarHBondContact O-N 3.03Å; M441-D443 PolarHBondContact O-N 3.38Å; D443-T445 VanDerWaalsContact C-N 3.31Å; D443-T445 PolarHBondContact O-N 3.48Å; D443-K446 PolarHBondContact O-N 3.43Å; D443-K446 WeakPolarHBondContact OD1-CG 3.35Å; D443-K446 WeakPolarHBondContact OD2-CD 3.47Å; D443-K446 VanDerWaalsContact OD2-CE 3.32Å; D443-K446 WeakPolarHBondContact OD2-CE 3.45Å; D443-K446 IonicContact OD2-NZ 2.73Å; D443-K446 PolarHBondContact OD2-NZ 3.22Å; D443-A447 WeakPolarHBondContact O-CB 3.46Å; D443-A447 PolarHBondContact O-N 3.48Å
444	Y	87.3	Confident	92.4	Very high	39 Å²	39	43.3 Å²	43.3	15%	0.153	22%	0.218	C	C	.	.	H	α-helix	trans	-62.7	-35.2	-170.4	-55.9	-54	0	0	0	112.9	K442 A447 M448 C471 A474	K442-Y444 HydrophobicContact CB-CE1 4.27Å; K442-Y444 HydrophobicContact CB-CE2 4.1Å; K442-Y444 PolarHBondContact O-N 3.16Å; Y444-A447 PolarHBondContact O-N 3.38Å; Y444-M448 WeakPolarHBondContact O-CB 3.35Å; Y444-M448 VanDerWaalsContact O-CG 3.26Å; Y444-M448 WeakPolarHBondContact O-CG 3.36Å; Y444-M448 PolarHBondContact O-N 2.93Å; Y444-C471 HydrophobicContact CD1-CB 4.4Å; Y444-A474 HydrophobicContact CD1-CB 4.19Å; Y444-A474 HydrophobicContact CD2-CB 4.1Å; Y444-A474 HydrophobicContact CE1-CB 3.94Å; Y444-A474 HydrophobicContact CE2-CB 3.81Å; Y444-A474 HydrophobicContact CG-CB 4.29Å
445	T	84.8	Confident	92.3	Very high	49 Å²	49	42.6 Å²	42.6	30%	0.301	22%	0.216	S	C	.	.	H	α-helix	trans	-60.7	-53	177.5	-48.1	0	0	0	0	110.6	D443 A447 M448 D449	D443-T445 VanDerWaalsContact C-N 3.31Å; D443-T445 PolarHBondContact O-N 3.48Å; T445-A447 VanDerWaalsContact C-N 3.31Å; T445-A447 PolarHBondContact O-N 3.01Å; T445-M448 WeakPolarHBondContact O-CB 3.42Å; T445-M448 PolarHBondContact O-N 3.05Å; T445-D449 PolarHBondContact O-N 2.76Å; T445-D449 VanDerWaalsContact O-N 3.1Å
446	K	87.9	Confident	92.3	Very high	83 Å²	83	48.1 Å²	48.1	36%	0.361	25%	0.245	S	C	.	.	H	α-helix	trans	-67.6	-33.4	178	-63.8	-172.8	-162.2	137.3	0	112.2	L438 D443 M448 D449 V450	L438-K446 HydrophobicContact CD1-CB 3.94Å; L438-K446 HydrophobicContact CD2-CB 4.47Å; D443-K446 PolarHBondContact O-N 3.43Å; D443-K446 WeakPolarHBondContact OD1-CG 3.35Å; D443-K446 WeakPolarHBondContact OD2-CD 3.47Å; D443-K446 VanDerWaalsContact OD2-CE 3.32Å; D443-K446 WeakPolarHBondContact OD2-CE 3.45Å; D443-K446 IonicContact OD2-NZ 2.73Å; D443-K446 PolarHBondContact OD2-NZ 3.22Å; K446-M448 VanDerWaalsContact C-N 3.34Å; K446-D449 PolarHBondContact O-N 2.94Å; K446-V450 VanDerWaalsContact O-CG2 3.29Å; K446-V450 WeakPolarHBondContact O-CG2 3.45Å; K446-V450 PolarHBondContact O-N 3.25Å; K446-V450 VanDerWaalsContact O-N 3.13Å
447	A	93.2	Very high	92.2	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-61.3	-43.8	174.4	0	0	0	0	0	111.2	L438 E439 D443 Y444 T445 V450 Y451	L438-A447 HydrophobicContact CB-CB 3.78Å; E439-A447 HydrophobicContact CB-CB 4.2Å; D443-A447 WeakPolarHBondContact O-CB 3.46Å; D443-A447 PolarHBondContact O-N 3.48Å; Y444-A447 PolarHBondContact O-N 3.38Å; T445-A447 VanDerWaalsContact C-N 3.31Å; T445-A447 PolarHBondContact O-N 3.01Å; A447-V450 PolarHBondContact O-N 3.3Å; A447-Y451 HydrophobicContact CB-CD2 4.47Å; A447-Y451 HydrophobicContact CB-CE2 4.4Å; A447-Y451 WeakPolarHBondContact O-CB 3.27Å; A447-Y451 WeakPolarHBondContact O-CD2 3.46Å; A447-Y451 PolarHBondContact O-N 3.39Å
448	M	92.9	Very high	92	Very high	20 Å²	20	53.1 Å²	53.1	10%	0.099	27%	0.268	C	S	.	.	H	α-helix	trans	-61.3	-46	175.9	-74.1	171.9	63.9	0	0	111.9	Y444 T445 K446 V450 Y451 Q452 Y468 C471 M472 Q475	Y444-M448 WeakPolarHBondContact O-CB 3.35Å; Y444-M448 VanDerWaalsContact O-CG 3.26Å; Y444-M448 WeakPolarHBondContact O-CG 3.36Å; Y444-M448 PolarHBondContact O-N 2.93Å; T445-M448 WeakPolarHBondContact O-CB 3.42Å; T445-M448 PolarHBondContact O-N 3.05Å; K446-M448 VanDerWaalsContact C-N 3.34Å; M448-V450 VanDerWaalsContact C-N 3.26Å; M448-V450 PolarHBondContact O-N 2.98Å; M448-Y451 PolarHBondContact O-N 2.85Å; M448-Q452 WeakPolarHBondContact O-CB 3.43Å; M448-Q452 PolarHBondContact O-N 3.11Å; M448-Y468 HydrophobicContact CB-CD2 3.97Å; M448-Y468 HydrophobicContact CB-CE2 3.77Å; M448-Y468 HydrophobicContact CE-CE1 3.95Å; M448-Y468 HydrophobicContact CE-CE2 3.92Å; M448-Y468 HydrophobicContact CG-CD2 4.16Å; M448-Y468 HydrophobicContact CG-CE2 4.18Å; M448-Y468 WeakPolarHBondContact O-CD2 3.17Å; M448-C471 HydrophobicContact CG-CB 3.41Å; M448-C471 VanDerWaalsContact CG-CB 3.41Å; M448-C471 HydrophobicContact SD-CB 4.03Å; M448-M472 HydrophobicContact CE-CB 3.94Å; M448-M472 HydrophobicContact CE-CG 4.22Å; M448-M472 HydrophobicContact SD-CB 4.15Å; M448-Q475 PolarHBondContact SD-OE1 3.34Å; M448-Q475 VanDerWaalsContact SD-OE1 3.36Å
449	D	92.7	Very high	92	Very high	94 Å²	94	57.8 Å²	57.8	50%	0.503	30%	0.302	S	S	.	.	H	α-helix	trans	-57.9	-40.5	177	-66.1	-23.6	0	0	0	112	T445 K446 K453	T445-D449 PolarHBondContact O-N 2.76Å; T445-D449 VanDerWaalsContact O-N 3.1Å; K446-D449 PolarHBondContact O-N 2.94Å; D449-K453 WeakPolarHBondContact O-CG 3.44Å; D449-K453 PolarHBondContact O-N 2.95Å; D449-K453 VanDerWaalsContact O-N 3.12Å
450	V	95.6	Very high	91.9	Very high	15 Å²	15	60 Å²	60	9%	0.091	32%	0.322	C	S	.	.	H	α-helix	trans	-75.6	-37.7	179.8	179.9	0	0	0	0	111.6	Y431 K434 A435 L438 K446 A447 M448 Q452 K453 A454	Y431-V450 HydrophobicContact CD1-CG1 4.32Å; Y431-V450 VanDerWaalsContact O-CG1 3.32Å; Y431-V450 WeakPolarHBondContact O-CG1 3.34Å; K434-V450 HydrophobicContact CB-CG1 3.96Å; K434-V450 HydrophobicContact CD-CG1 4.26Å; K434-V450 HydrophobicContact CD-CG2 4.4Å; K434-V450 HydrophobicContact CG-CG1 4.11Å; A435-V450 HydrophobicContact CB-CB 3.95Å; A435-V450 HydrophobicContact CB-CG1 3.84Å; L438-V450 HydrophobicContact CD1-CG2 3.92Å; K446-V450 VanDerWaalsContact O-CG2 3.29Å; K446-V450 WeakPolarHBondContact O-CG2 3.45Å; K446-V450 PolarHBondContact O-N 3.25Å; K446-V450 VanDerWaalsContact O-N 3.13Å; A447-V450 PolarHBondContact O-N 3.3Å; M448-V450 VanDerWaalsContact C-N 3.26Å; M448-V450 PolarHBondContact O-N 2.98Å; V450-Q452 VanDerWaalsContact C-N 3.31Å; V450-K453 PolarHBondContact O-N 3.23Å; V450-A454 PolarHBondContact O-N 2.95Å; V450-A454 VanDerWaalsContact O-N 3.08Å
451	Y	97.2	Very high	92.1	Very high	2 Å²	2	58.7 Å²	58.7	1%	0.008	31%	0.309	C	S	.	.	H	α-helix	trans	-63.6	-38	171.8	-78.9	-53.4	0	0	0	111.6	A435 A436 E439 A447 M448 A454 L455 A464 G467	A435-Y451 HydrophobicContact CB-CD1 3.41Å; A435-Y451 VanDerWaalsContact CB-CD1 3.41Å; A435-Y451 HydrophobicContact CB-CD2 3.62Å; A435-Y451 HydrophobicContact CB-CE1 3.39Å; A435-Y451 HydrophobicContact CB-CE2 3.59Å; A435-Y451 HydrophobicContact CB-CG 3.53Å; A435-Y451 VanDerWaalsContact CB-CZ 3.48Å; A436-Y451 WeakPolarHBondContact CA-OH 3.36Å; A436-Y451 PolarHBondContact N-OH 3.38Å; E439-Y451 PolarHBondContact OE2-OH 2.94Å; A447-Y451 HydrophobicContact CB-CD2 4.47Å; A447-Y451 HydrophobicContact CB-CE2 4.4Å; A447-Y451 WeakPolarHBondContact O-CB 3.27Å; A447-Y451 WeakPolarHBondContact O-CD2 3.46Å; A447-Y451 PolarHBondContact O-N 3.39Å; M448-Y451 PolarHBondContact O-N 2.85Å; Y451-A454 WeakPolarHBondContact O-CB 3.36Å; Y451-A454 PolarHBondContact O-N 3.45Å; Y451-A454 VanDerWaalsContact O-N 3.13Å; Y451-L455 WeakPolarHBondContact O-CG 3.35Å; Y451-L455 PolarHBondContact O-N 2.92Å; Y451-A464 HydrophobicContact CD1-CB 4.11Å; Y451-G467 VanDerWaalsContact CD2-C 3.45Å; Y451-G467 VanDerWaalsContact CE2-C 3.41Å
452	Q	95.7	Very high	92.4	Very high	73 Å²	73	63 Å²	63	34%	0.341	33%	0.326	S	S	.	.	H	α-helix	trans	-61.5	-45.1	174.5	-173.2	57.7	53.1	0	0	110.7	M448 V450 A454 L455 D456 Y468	M448-Q452 WeakPolarHBondContact O-CB 3.43Å; M448-Q452 PolarHBondContact O-N 3.11Å; V450-Q452 VanDerWaalsContact C-N 3.31Å; Q452-A454 VanDerWaalsContact C-N 3.25Å; Q452-A454 PolarHBondContact O-N 3.36Å; Q452-L455 CarbonylContact O-C 3.15Å; Q452-L455 WeakPolarHBondContact O-CA 3.29Å; Q452-L455 WeakPolarHBondContact O-CB 3.4Å; Q452-L455 PolarHBondContact O-N 3.49Å; Q452-D456 PolarHBondContact NE2-OD1 2.95Å; Q452-D456 PolarHBondContact O-N 2.85Å; Q452-Y468 HydrophobicContact CB-CE2 4.26Å
453	K	95.4	Very high	92.7	Very high	119 Å²	119	60.7 Å²	60.7	52%	0.517	32%	0.317	S	S	.	.	H	α-helix	trans	-58.2	-36.4	173.3	-71.5	175.6	-177.5	-180	0	113.1	Y431 D449 V450 L457	Y431-K453 HydrophobicContact CD1-CB 3.92Å; Y431-K453 HydrophobicContact CE1-CB 4.09Å; Y431-K453 HydrophobicContact CE1-CD 4.41Å; D449-K453 WeakPolarHBondContact O-CG 3.44Å; D449-K453 PolarHBondContact O-N 2.95Å; D449-K453 VanDerWaalsContact O-N 3.12Å; V450-K453 PolarHBondContact O-N 3.23Å; K453-L457 WeakPolarHBondContact O-CG 3.39Å; K453-L457 PolarHBondContact O-N 3.29Å
454	A	95.8	Very high	93.2	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-66.3	-38.7	174	0	0	0	0	0	112.1	I428 T432 V450 Y451 Q452 L457 D458 A464	I428-A454 HydrophobicContact CG2-CB 4.29Å; T432-A454 HydrophobicContact CG2-CB 4.09Å; V450-A454 PolarHBondContact O-N 2.95Å; V450-A454 VanDerWaalsContact O-N 3.08Å; Y451-A454 WeakPolarHBondContact O-CB 3.36Å; Y451-A454 PolarHBondContact O-N 3.45Å; Y451-A454 VanDerWaalsContact O-N 3.13Å; Q452-A454 VanDerWaalsContact C-N 3.25Å; Q452-A454 PolarHBondContact O-N 3.36Å; A454-L457 PolarHBondContact O-N 3.47Å; A454-D458 PolarHBondContact O-N 3.36Å; A454-A464 HydrophobicContact CB-CB 3.78Å
455	L	95.4	Very high	93.6	Very high	28 Å²	28	58.4 Å²	58.4	15%	0.147	31%	0.312	C	S	.	.	H	α-helix	trans	-71.8	-31.4	176.4	-68.9	169.4	0	0	0	113.1	Y451 Q452 L457 D458 S459 A464 A465	Y451-L455 WeakPolarHBondContact O-CG 3.35Å; Y451-L455 PolarHBondContact O-N 2.92Å; Q452-L455 CarbonylContact O-C 3.15Å; Q452-L455 WeakPolarHBondContact O-CA 3.29Å; Q452-L455 WeakPolarHBondContact O-CB 3.4Å; Q452-L455 PolarHBondContact O-N 3.49Å; L455-L457 PolarHBondContact O-N 3.29Å; L455-D458 CarbonylContact O-C 3.6Å; L455-D458 PolarHBondContact O-N 3.36Å; L455-S459 VanDerWaalsContact O-CA 3.26Å; L455-S459 WeakPolarHBondContact O-CA 3.42Å; L455-S459 PolarHBondContact O-N 3.22Å; L455-A464 HydrophobicContact CD2-CB 3.86Å; L455-A464 HydrophobicContact CG-CB 3.86Å; L455-A465 HydrophobicContact CD2-CB 4.06Å
456	D	95.4	Very high	94.1	Very high	116 Å²	116	60.4 Å²	60.4	62%	0.62	32%	0.321	S	S	*	.	H	α-helix	trans	-65.9	-31.4	173.9	-61.7	-21.5	0	0	0	111	Q452	Q452-D456 PolarHBondContact NE2-OD1 2.95Å; Q452-D456 PolarHBondContact O-N 2.85Å
457	L	93.8	Very high	94.4	Very high	80 Å²	80	56.4 Å²	56.4	42%	0.419	30%	0.304	S	S	.	.	H	α-helix	trans	-78.3	-40.9	173.4	-67.7	173.9	0	0	0	112.5	I428 Y431 K453 A454 L455	I428-L457 HydrophobicContact CG1-CB 4.15Å; Y431-L457 HydrophobicContact CD2-CD1 3.81Å; Y431-L457 HydrophobicContact CE2-CD1 3.52Å; K453-L457 WeakPolarHBondContact O-CG 3.39Å; K453-L457 PolarHBondContact O-N 3.29Å; A454-L457 PolarHBondContact O-N 3.47Å; L455-L457 PolarHBondContact O-N 3.29Å
458	D	93	Very high	94.5	Very high	51 Å²	51	59.2 Å²	59.2	27%	0.273	32%	0.315	S	S	.	.			trans	-146.4	101.6	175.5	174.9	12.9	0	0	0	111	I428 A454 L455 S460 C461	I428-D458 HydrophobicContact CD1-CB 3.38Å; I428-D458 HydrophobicContact CG1-CB 4.22Å; A454-D458 PolarHBondContact O-N 3.36Å; L455-D458 CarbonylContact O-C 3.6Å; L455-D458 PolarHBondContact O-N 3.36Å; D458-S460 PolarHBondContact O-N 3.5Å; D458-S460 VanDerWaalsContact O-N 3.12Å; D458-S460 WeakPolarHBondContact OD1-CA 3.29Å; D458-S460 WeakPolarHBondContact OD1-CB 3.39Å; D458-S460 PolarHBondContact OD1-N 2.9Å; D458-S460 PolarHBondContact OD1-OG 2.9Å; D458-C461 HydrophobicContact CB-CB 4.3Å; D458-C461 WeakPolarHBondContact O-CB 3.26Å; D458-C461 PolarHBondContact O-N 3.36Å
459	S	92.1	Very high	94.5	Very high	110 Å²	110	62.4 Å²	62.4	77%	0.769	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-14.6	-179.4	61.4	0	0	0	0	113.4	L455	L455-S459 VanDerWaalsContact O-CA 3.26Å; L455-S459 WeakPolarHBondContact O-CA 3.42Å; L455-S459 PolarHBondContact O-N 3.22Å
460	S	92.6	Very high	94.6	Very high	87 Å²	87	63.4 Å²	63.4	61%	0.608	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-1.1	177.3	77.3	0	0	0	0	113.4	D458 K462	D458-S460 PolarHBondContact O-N 3.5Å; D458-S460 VanDerWaalsContact O-N 3.12Å; D458-S460 WeakPolarHBondContact OD1-CA 3.29Å; D458-S460 WeakPolarHBondContact OD1-CB 3.39Å; D458-S460 PolarHBondContact OD1-N 2.9Å; D458-S460 PolarHBondContact OD1-OG 2.9Å; S460-K462 PolarHBondContact O-N 3.34Å
461	C	93.8	Very high	94.4	Very high	18 Å²	18	62.7 Å²	62.7	12%	0.122	32%	0.322	C	S	.	.			trans	-67.1	95.8	-179	-172.4	0	0	0	0	111.8	I428 D458 E463 A464 A465	I428-C461 HydrophobicContact CG2-CB 4.44Å; D458-C461 HydrophobicContact CB-CB 4.3Å; D458-C461 WeakPolarHBondContact O-CB 3.26Å; D458-C461 PolarHBondContact O-N 3.36Å; C461-E463 VanDerWaalsContact C-N 3.32Å; C461-E463 PolarHBondContact O-N 3.39Å; C461-A464 HydrophobicContact CB-CB 4.05Å; C461-A464 PolarHBondContact O-N 3.4Å; C461-A465 PolarHBondContact O-N 3.35Å
462	K	94.2	Very high	94	Very high	166 Å²	166	66.2 Å²	66.2	72%	0.722	34%	0.339	S	S	*	.	H	α-helix	trans	-57	-41.9	178.9	-65.3	-174.2	179.5	-178.2	0	113.1	S460 A464 A465 D466	S460-K462 PolarHBondContact O-N 3.34Å; K462-A464 VanDerWaalsContact C-N 3.29Å; K462-A464 PolarHBondContact O-N 2.91Å; K462-A465 PolarHBondContact O-N 3.31Å; K462-D466 WeakPolarHBondContact O-CB 3.36Å; K462-D466 PolarHBondContact O-N 2.71Å
463	E	93.9	Very high	93.6	Very high	81 Å²	81	68.1 Å²	68.1	38%	0.379	35%	0.35	S	S	.	.	H	α-helix	trans	-58.6	-42.2	179.5	-174.8	179.3	-159.4	0	0	111.3	T432 R433 C461 G467	T432-E463 HydrophobicContact CG2-CG 4.49Å; T432-E463 PolarHBondContact OG1-OE2 2.87Å; R433-E463 IonicContact NH1-OE1 2.94Å; R433-E463 PolarHBondContact NH1-OE1 3.2Å; C461-E463 VanDerWaalsContact C-N 3.32Å; C461-E463 PolarHBondContact O-N 3.39Å; E463-G467 PolarHBondContact O-N 2.67Å
464	A	94.6	Very high	93.2	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-72.1	-43.2	178.2	0	0	0	0	0	112.3	T432 Y451 A454 L455 C461 K462 G467 Y468	T432-A464 HydrophobicContact CG2-CB 4.06Å; Y451-A464 HydrophobicContact CD1-CB 4.11Å; A454-A464 HydrophobicContact CB-CB 3.78Å; L455-A464 HydrophobicContact CD2-CB 3.86Å; L455-A464 HydrophobicContact CG-CB 3.86Å; C461-A464 HydrophobicContact CB-CB 4.05Å; C461-A464 PolarHBondContact O-N 3.4Å; K462-A464 VanDerWaalsContact C-N 3.29Å; K462-A464 PolarHBondContact O-N 2.91Å; A464-G467 PolarHBondContact O-N 3.21Å; A464-Y468 WeakPolarHBondContact O-CB 3.49Å; A464-Y468 PolarHBondContact O-N 3.33Å
465	A	95.8	Very high	92.4	Very high	34 Å²	34	67.4 Å²	67.4	28%	0.281	35%	0.353	S	S	.	.	H	α-helix	trans	-61.4	-48.3	177.7	0	0	0	0	0	111.4	L455 C461 K462 G467 Y468 Q469	L455-A465 HydrophobicContact CD2-CB 4.06Å; C461-A465 PolarHBondContact O-N 3.35Å; K462-A465 PolarHBondContact O-N 3.31Å; A465-G467 VanDerWaalsContact C-N 3.34Å; A465-G467 PolarHBondContact O-N 3.23Å; A465-Y468 PolarHBondContact O-N 3.06Å; A465-Q469 VanDerWaalsContact O-CG 3.31Å; A465-Q469 WeakPolarHBondContact O-CG 3.44Å; A465-Q469 PolarHBondContact O-N 2.86Å
466	D	95.8	Very high	91.4	Very high	91 Å²	91	75.6 Å²	75.6	49%	0.487	38%	0.384	S	S	.	.	H	α-helix	trans	-64.3	-40.6	178.6	-66.3	-18.6	0	0	0	111.1	K462 Q469 R470	K462-D466 WeakPolarHBondContact O-CB 3.36Å; K462-D466 PolarHBondContact O-N 2.71Å; D466-Q469 PolarHBondContact O-N 3.06Å; D466-R470 WeakPolarHBondContact O-CB 3.34Å; D466-R470 WeakPolarHBondContact O-CG 3.39Å; D466-R470 PolarHBondContact O-N 3.09Å; D466-R470 PolarHBondContact O-NH1 3.45Å
467	G	94.3	Very high	90.4	Very high	0 Å²	0	75.4 Å²	75.4	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-62.6	-44	175.6	0	0	0	0	0	113.3	Y451 E463 A464 A465 R470 C471	Y451-G467 VanDerWaalsContact CD2-C 3.45Å; Y451-G467 VanDerWaalsContact CE2-C 3.41Å; E463-G467 PolarHBondContact O-N 2.67Å; A464-G467 PolarHBondContact O-N 3.21Å; A465-G467 VanDerWaalsContact C-N 3.34Å; A465-G467 PolarHBondContact O-N 3.23Å; G467-R470 VanDerWaalsContact CA-NH2 3.28Å; G467-R470 PolarHBondContact O-N 3.34Å; G467-C471 PolarHBondContact O-N 3.12Å; G467-C471 PolarHBondContact O-SG 3.48Å
468	Y	94.8	Very high	89	Confident	59 Å²	59	74.8 Å²	74.8	23%	0.231	38%	0.375	C	S	.	.	H	α-helix	trans	-59.7	-48.8	174.6	-172.8	-85.3	0	0	0	111.3	M448 Q452 A464 A465 R470 C471 M472	M448-Y468 HydrophobicContact CB-CD2 3.97Å; M448-Y468 HydrophobicContact CB-CE2 3.77Å; M448-Y468 HydrophobicContact CE-CE1 3.95Å; M448-Y468 HydrophobicContact CE-CE2 3.92Å; M448-Y468 HydrophobicContact CG-CD2 4.16Å; M448-Y468 HydrophobicContact CG-CE2 4.18Å; M448-Y468 WeakPolarHBondContact O-CD2 3.17Å; Q452-Y468 HydrophobicContact CB-CE2 4.26Å; A464-Y468 WeakPolarHBondContact O-CB 3.49Å; A464-Y468 PolarHBondContact O-N 3.33Å; A465-Y468 PolarHBondContact O-N 3.06Å; Y468-R470 PolarHBondContact O-N 2.85Å; Y468-C471 PolarHBondContact O-N 3.25Å; Y468-M472 HydrophobicContact CE1-SD 4.45Å; Y468-M472 WeakPolarHBondContact O-CB 3.26Å; Y468-M472 PolarHBondContact O-N 3.46Å
469	Q	93.3	Very high	87.6	Confident	86 Å²	86	81.3 Å²	81.3	40%	0.402	40%	0.403	S	S	.	.	H	α-helix	trans	-62.1	-42.7	178.8	-68.7	-62.3	-43.6	0	0	112.1	A465 D466 M472 M473	A465-Q469 VanDerWaalsContact O-CG 3.31Å; A465-Q469 WeakPolarHBondContact O-CG 3.44Å; A465-Q469 PolarHBondContact O-N 2.86Å; D466-Q469 PolarHBondContact O-N 3.06Å; Q469-M472 PolarHBondContact O-N 2.92Å; Q469-M473 WeakPolarHBondContact O-CG 3.36Å; Q469-M473 PolarHBondContact O-N 3.34Å
470	R	94.1	Very high	86.3	Confident	116 Å²	116	78.7 Å²	78.7	44%	0.438	38%	0.38	S	S	.	.	H	α-helix	trans	-60.1	-46.7	174.8	-76.5	-168.6	-52.4	-85.8	0.5	112.1	E439 D466 G467 Y468 M472 M473 A474	E439-R470 IonicContact OE1-CZ 3.45Å; E439-R470 IonicContact OE1-NE 2.77Å; E439-R470 PolarHBondContact OE1-NE 3.16Å; E439-R470 IonicContact OE1-NH2 3.08Å; E439-R470 IonicContact OE2-NH2 3.51Å; E439-R470 PolarHBondContact OE2-NH2 2.83Å; D466-R470 WeakPolarHBondContact O-CB 3.34Å; D466-R470 WeakPolarHBondContact O-CG 3.39Å; D466-R470 PolarHBondContact O-N 3.09Å; D466-R470 PolarHBondContact O-NH1 3.45Å; G467-R470 VanDerWaalsContact CA-NH2 3.28Å; G467-R470 PolarHBondContact O-N 3.34Å; Y468-R470 PolarHBondContact O-N 2.85Å; R470-M472 VanDerWaalsContact C-N 3.34Å; R470-M472 PolarHBondContact O-N 2.71Å; R470-M473 PolarHBondContact O-N 2.92Å; R470-A474 VanDerWaalsContact O-CB 3.29Å; R470-A474 WeakPolarHBondContact O-CB 3.2Å; R470-A474 PolarHBondContact O-N 3.28Å
471	C	92.4	Very high	85.1	Confident	0 Å²	0	76.6 Å²	76.6	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-62.8	-42.4	178.3	-66.6	0	0	0	0	111.5	Y444 M448 G467 Y468 A474 Q475	Y444-C471 HydrophobicContact CD1-CB 4.4Å; M448-C471 HydrophobicContact CG-CB 3.41Å; M448-C471 VanDerWaalsContact CG-CB 3.41Å; M448-C471 HydrophobicContact SD-CB 4.03Å; G467-C471 PolarHBondContact O-N 3.12Å; G467-C471 PolarHBondContact O-SG 3.48Å; Y468-C471 PolarHBondContact O-N 3.25Å; C471-A474 PolarHBondContact O-N 3.37Å; C471-Q475 WeakPolarHBondContact O-CB 3Å; C471-Q475 PolarHBondContact O-N 3.27Å
472	M	87.5	Confident	83.8	Confident	75 Å²	75	81.2 Å²	81.2	37%	0.369	40%	0.396	S	S	.	.	H	α-helix	trans	-61.2	-46.7	177.3	-174.3	-177.1	72.4	0	0	111.8	M448 Y468 Q469 R470 Q475 Y476	M448-M472 HydrophobicContact CE-CB 3.94Å; M448-M472 HydrophobicContact CE-CG 4.22Å; M448-M472 HydrophobicContact SD-CB 4.15Å; Y468-M472 HydrophobicContact CE1-SD 4.45Å; Y468-M472 WeakPolarHBondContact O-CB 3.26Å; Y468-M472 PolarHBondContact O-N 3.46Å; Q469-M472 PolarHBondContact O-N 2.92Å; R470-M472 VanDerWaalsContact C-N 3.34Å; R470-M472 PolarHBondContact O-N 2.71Å; M472-Q475 PolarHBondContact O-N 3.16Å; M472-Y476 WeakPolarHBondContact O-CB 3.42Å; M472-Y476 PolarHBondContact O-N 3.06Å
473	M	88.2	Confident	82.6	Confident	113 Å²	113	80.9 Å²	80.9	56%	0.557	40%	0.396	S	S	*	.	H	α-helix	trans	-64.5	-41.5	175.5	-70.5	-177.1	-177.3	0	0	112	Q469 R470 Q475 Y476 N477	Q469-M473 WeakPolarHBondContact O-CG 3.36Å; Q469-M473 PolarHBondContact O-N 3.34Å; R470-M473 PolarHBondContact O-N 2.92Å; M473-Q475 VanDerWaalsContact C-N 3.27Å; M473-Q475 PolarHBondContact O-N 2.75Å; M473-Y476 PolarHBondContact O-N 3.16Å; M473-N477 WeakPolarHBondContact O-CB 3.43Å; M473-N477 VanDerWaalsContact O-CG 3.3Å; M473-N477 PolarHBondContact O-N 3.45Å; M473-N477 PolarHBondContact O-ND2 2.96Å
474	A	85.6	Confident	81.5	Confident	29 Å²	29	79.3 Å²	79.3	24%	0.24	39%	0.391	C	S	.	.	H	α-helix	trans	-65.6	-31.9	177.8	0	0	0	0	0	112.4	Y444 R470 C471 R478	Y444-A474 HydrophobicContact CD1-CB 4.19Å; Y444-A474 HydrophobicContact CD2-CB 4.1Å; Y444-A474 HydrophobicContact CE1-CB 3.94Å; Y444-A474 HydrophobicContact CE2-CB 3.81Å; Y444-A474 HydrophobicContact CG-CB 4.29Å; R470-A474 VanDerWaalsContact O-CB 3.29Å; R470-A474 WeakPolarHBondContact O-CB 3.2Å; R470-A474 PolarHBondContact O-N 3.28Å; C471-A474 PolarHBondContact O-N 3.37Å; A474-R478 PolarHBondContact O-N 3.47Å
475	Q	79.2	Confident	80.3	Confident	75 Å²	75	80.5 Å²	80.5	35%	0.35	40%	0.398	S	S	.	.	H	α-helix	trans	-74	-41.4	173.1	-172.9	174.9	6	0	0	111.9	M448 C471 M472 M473 R478	M448-Q475 PolarHBondContact SD-OE1 3.34Å; M448-Q475 VanDerWaalsContact SD-OE1 3.36Å; C471-Q475 WeakPolarHBondContact O-CB 3Å; C471-Q475 PolarHBondContact O-N 3.27Å; M472-Q475 PolarHBondContact O-N 3.16Å; M473-Q475 VanDerWaalsContact C-N 3.27Å; M473-Q475 PolarHBondContact O-N 2.75Å; Q475-R478 WeakPolarHBondContact O-CB 3.46Å; Q475-R478 PolarHBondContact O-N 3.13Å
476	Y	75.1	Confident	79.2	Confident	201 Å²	201	85.2 Å²	85.2	79%	0.788	41%	0.412	S	S	*	.	H	α-helix	trans	-66.4	-38.7	177.5	-174.8	-95.9	0	0	0	112.6	M472 M473 R478	M472-Y476 WeakPolarHBondContact O-CB 3.42Å; M472-Y476 PolarHBondContact O-N 3.06Å; M473-Y476 PolarHBondContact O-N 3.16Å; Y476-R478 PolarHBondContact O-N 3.19Å
477	N	73.4	Confident	78.3	Confident	112 Å²	112	89.2 Å²	89.2	60%	0.599	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	2.9	178.9	-66.7	-30.8	0	0	0	113.6	M473 H479	M473-N477 WeakPolarHBondContact O-CB 3.43Å; M473-N477 VanDerWaalsContact O-CG 3.3Å; M473-N477 PolarHBondContact O-N 3.45Å; M473-N477 PolarHBondContact O-ND2 2.96Å; N477-H479 PolarHBondContact O-N 3.21Å
478	R	65.6	Low	77.2	Confident	67 Å²	67	93.5 Å²	93.5	25%	0.253	44%	0.437	S	S	.	.			trans	-76.9	105.5	172.2	-99.5	179.7	167.6	164.2	3.8	109.5	K442 A474 Q475 Y476 D480	K442-R478 PolarHBondContact O-NH1 3.21Å; K442-R478 PolarHBondContact O-NH2 3.13Å; A474-R478 PolarHBondContact O-N 3.47Å; Q475-R478 WeakPolarHBondContact O-CB 3.46Å; Q475-R478 PolarHBondContact O-N 3.13Å; Y476-R478 PolarHBondContact O-N 3.19Å; R478-D480 PolarHBondContact O-N 3.14Å
479	H	62.6	Low	76.2	Confident	188 Å²	188	90.9 Å²	90.9	87%	0.87	43%	0.427	S	S	*	.			trans	-78.4	68.2	161.8	-66.6	-66	0	0	0	109.7	N477 S481	N477-H479 PolarHBondContact O-N 3.21Å; H479-S481 PolarHBondContact O-N 3.38Å
480	D	64.4	Low	75.4	Confident	55 Å²	55	90.5 Å²	90.5	29%	0.294	43%	0.426	S	S	.	.			trans	-72.1	126.3	176.9	-71.8	-32.3	0	0	0	109.8	R478 D484 V485 R488	R478-D480 PolarHBondContact O-N 3.14Å; D480-D484 HydrophobicContact CB-CB 4.33Å; D480-V485 HydrophobicContact CB-CG2 3.63Å; D480-R488 IonicContact OD1-NH2 3.49Å; D480-R488 PolarHBondContact OD1-NH2 2.85Å; D480-R488 IonicContact OD2-CZ 3.64Å; D480-R488 IonicContact OD2-NH1 3.2Å; D480-R488 PolarHBondContact OD2-NH1 3.29Å; D480-R488 IonicContact OD2-NH2 2.67Å; D480-R488 PolarHBondContact OD2-NH2 3.48Å
481	S	67.6	Low	74.3	Confident	43 Å²	43	88.4 Å²	88.4	30%	0.301	43%	0.434	S	S	.	.			trans	-66.6	155.5	166.4	72.7	0	0	0	0	109.9	H479 E483 D484 V485	H479-S481 PolarHBondContact O-N 3.38Å; S481-E483 PolarHBondContact O-N 3.4Å; S481-D484 WeakPolarHBondContact CB-OD2 3.25Å; S481-D484 PolarHBondContact N-OD2 3.22Å; S481-D484 PolarHBondContact O-N 3.17Å; S481-D484 VanDerWaalsContact OG-CG 3.25Å; S481-D484 PolarHBondContact OG-N 3.3Å; S481-D484 VanDerWaalsContact OG-N 3.15Å; S481-D484 PolarHBondContact OG-OD2 2.91Å; S481-V485 WeakPolarHBondContact O-CG2 3.41Å; S481-V485 PolarHBondContact O-N 3.31Å
482	P	67.8	Low	73.5	Confident	115 Å²	115	89.4 Å²	89.4	75%	0.747	44%	0.439	S	S	*	.	H	α-helix	trans	-52.9	-28.9	173.3	-27.5	35.4	0	0	0	113.5	K486	P482-K486 WeakPolarHBondContact O-CB 3.36Å; P482-K486 PolarHBondContact O-N 3.22Å; P482-K486 VanDerWaalsContact O-N 3.09Å
483	E	69.1	Low	72.9	Confident	158 Å²	158	90.3 Å²	90.3	74%	0.738	45%	0.451	S	S	*	.	H	α-helix	trans	-73.8	-37.7	176	-62.4	-171.3	162.7	0	0	112.7	S481 K486 R487	S481-E483 PolarHBondContact O-N 3.4Å; E483-K486 PolarHBondContact O-N 3.47Å; E483-R487 WeakPolarHBondContact O-CB 3.38Å; E483-R487 PolarHBondContact O-N 2.99Å
484	D	70.4	Confident	72.5	Confident	48 Å²	48	89.8 Å²	89.8	26%	0.257	45%	0.447	S	S	.	.	H	α-helix	trans	-67.8	-39.9	175.9	-68.4	-56.5	0	0	0	111.9	D480 S481 R487 R488	D480-D484 HydrophobicContact CB-CB 4.33Å; S481-D484 WeakPolarHBondContact CB-OD2 3.25Å; S481-D484 PolarHBondContact N-OD2 3.22Å; S481-D484 PolarHBondContact O-N 3.17Å; S481-D484 VanDerWaalsContact OG-CG 3.25Å; S481-D484 PolarHBondContact OG-N 3.3Å; S481-D484 VanDerWaalsContact OG-N 3.15Å; S481-D484 PolarHBondContact OG-OD2 2.91Å; D484-R487 PolarHBondContact O-N 3.19Å; D484-R487 IonicContact OD1-CZ 3.7Å; D484-R487 IonicContact OD1-NH1 2.93Å; D484-R487 IonicContact OD1-NH2 2.98Å; D484-R487 PolarHBondContact OD1-NH2 3.35Å; D484-R488 WeakPolarHBondContact O-CB 3.48Å; D484-R488 PolarHBondContact O-N 3.23Å; D484-R488 VanDerWaalsContact O-N 3.07Å
485	V	70.1	Confident	72.4	Confident	26 Å²	26	88.4 Å²	88.4	16%	0.158	44%	0.435	C	S	.	.	H	α-helix	trans	-60.4	-49.2	173	179.3	0	0	0	0	109.9	D480 S481 R487 R488 A489 V537 G538	D480-V485 HydrophobicContact CB-CG2 3.63Å; S481-V485 WeakPolarHBondContact O-CG2 3.41Å; S481-V485 PolarHBondContact O-N 3.31Å; V485-R487 PolarHBondContact O-N 3.29Å; V485-R488 PolarHBondContact O-N 2.9Å; V485-A489 VanDerWaalsContact O-CB 3.3Å; V485-A489 WeakPolarHBondContact O-CB 3.37Å; V485-A489 PolarHBondContact O-N 3.13Å; V485-V537 WeakPolarHBondContact CG1-O 3.44Å; V485-G538 WeakPolarHBondContact CG1-O 3.35Å
486	K	72.6	Confident	72.5	Confident	133 Å²	133	89.7 Å²	89.7	58%	0.578	44%	0.441	S	S	*	.	H	α-helix	trans	-62.3	-44.9	178.7	-172.2	177.1	179.6	-179.9	0	112.4	P482 E483 R488 A489 M490 L539	P482-K486 WeakPolarHBondContact O-CB 3.36Å; P482-K486 PolarHBondContact O-N 3.22Å; P482-K486 VanDerWaalsContact O-N 3.09Å; E483-K486 PolarHBondContact O-N 3.47Å; K486-R488 PolarHBondContact O-N 3.18Å; K486-A489 PolarHBondContact O-N 3.43Å; K486-M490 HydrophobicContact CG-CG 4.36Å; K486-M490 VanDerWaalsContact O-CB 3.31Å; K486-M490 WeakPolarHBondContact O-CB 3.4Å; K486-M490 WeakPolarHBondContact O-CG 3.44Å; K486-M490 PolarHBondContact O-N 3.49Å; K486-L539 HydrophobicContact CB-CD2 4.34Å; K486-L539 HydrophobicContact CG-CD2 4.34Å
487	R	75.9	Confident	73.1	Confident	174 Å²	174	86.7 Å²	86.7	66%	0.657	43%	0.434	S	S	*	.	H	α-helix	trans	-60.8	-43.1	179	-174.7	-178.9	65.6	-144.6	-13.1	111.8	E483 D484 V485 A491	E483-R487 WeakPolarHBondContact O-CB 3.38Å; E483-R487 PolarHBondContact O-N 2.99Å; D484-R487 PolarHBondContact O-N 3.19Å; D484-R487 IonicContact OD1-CZ 3.7Å; D484-R487 IonicContact OD1-NH1 2.93Å; D484-R487 IonicContact OD1-NH2 2.98Å; D484-R487 PolarHBondContact OD1-NH2 3.35Å; V485-R487 PolarHBondContact O-N 3.29Å; R487-A491 PolarHBondContact O-N 3.36Å
488	R	71.2	Confident	73.7	Confident	91 Å²	91	81.8 Å²	81.8	34%	0.343	41%	0.408	S	S	.	.	H	α-helix	trans	-69.8	-47.1	179.4	-177.2	-167.6	-52.6	128.3	5.3	112	D480 D484 V485 K486 M490 A491 D492	D480-R488 IonicContact OD1-NH2 3.49Å; D480-R488 PolarHBondContact OD1-NH2 2.85Å; D480-R488 IonicContact OD2-CZ 3.64Å; D480-R488 IonicContact OD2-NH1 3.2Å; D480-R488 PolarHBondContact OD2-NH1 3.29Å; D480-R488 IonicContact OD2-NH2 2.67Å; D480-R488 PolarHBondContact OD2-NH2 3.48Å; D484-R488 WeakPolarHBondContact O-CB 3.48Å; D484-R488 PolarHBondContact O-N 3.23Å; D484-R488 VanDerWaalsContact O-N 3.07Å; V485-R488 PolarHBondContact O-N 2.9Å; K486-R488 PolarHBondContact O-N 3.18Å; R488-M490 PolarHBondContact O-N 3.18Å; R488-A491 WeakPolarHBondContact O-CA 3.35Å; R488-A491 VanDerWaalsContact O-CB 3.31Å; R488-A491 WeakPolarHBondContact O-CB 3.42Å; R488-A491 PolarHBondContact O-N 2.99Å; R488-D492 PolarHBondContact O-N 3.1Å
489	A	73.2	Confident	74.5	Confident	3 Å²	3	81.3 Å²	81.3	3%	0.025	41%	0.409	C	S	.	.	H	α-helix	trans	-60.9	-39.8	179.3	0	0	0	0	0	110.4	V485 K486 A491 D492 V495 V537 L539	V485-A489 VanDerWaalsContact O-CB 3.3Å; V485-A489 WeakPolarHBondContact O-CB 3.37Å; V485-A489 PolarHBondContact O-N 3.13Å; K486-A489 PolarHBondContact O-N 3.43Å; A489-A491 PolarHBondContact O-N 3Å; A489-D492 PolarHBondContact O-N 3.18Å; A489-D492 VanDerWaalsContact O-N 3.15Å; A489-V495 HydrophobicContact CB-CG1 4.17Å; A489-V495 WeakPolarHBondContact O-CB 3.31Å; A489-V495 WeakPolarHBondContact O-CG1 3.4Å; A489-V537 HydrophobicContact CB-CB 4.06Å; A489-V537 HydrophobicContact CB-CG2 3.76Å; A489-L539 HydrophobicContact CB-CD1 3.37Å; A489-L539 HydrophobicContact CB-CD2 3.92Å; A489-L539 HydrophobicContact CB-CG 3.4Å; A489-L539 VanDerWaalsContact CB-CG 3.4Å
490	M	77.3	Confident	75.6	Confident	79 Å²	79	75.3 Å²	75.3	39%	0.389	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-4.2	173.3	-63	-68.1	-94.3	0	0	114.1	K486 R488 Q496 M499	K486-M490 HydrophobicContact CG-CG 4.36Å; K486-M490 VanDerWaalsContact O-CB 3.31Å; K486-M490 WeakPolarHBondContact O-CB 3.4Å; K486-M490 WeakPolarHBondContact O-CG 3.44Å; K486-M490 PolarHBondContact O-N 3.49Å; R488-M490 PolarHBondContact O-N 3.18Å; M490-Q496 VanDerWaalsContact O-CG 3.29Å; M490-Q496 WeakPolarHBondContact O-CG 3.4Å; M490-Q496 PolarHBondContact O-NE2 2.96Å; M490-M499 HydrophobicContact SD-CB 4.5Å; M490-M499 HydrophobicContact SD-CG 4.37Å
491	A	71.7	Confident	76.9	Confident	72 Å²	72	74.7 Å²	74.7	60%	0.595	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-13	169.7	0	0	0	0	0	112.6	R487 R488 A489 P493	R487-A491 PolarHBondContact O-N 3.36Å; R488-A491 WeakPolarHBondContact O-CA 3.35Å; R488-A491 VanDerWaalsContact O-CB 3.31Å; R488-A491 WeakPolarHBondContact O-CB 3.42Å; R488-A491 PolarHBondContact O-N 2.99Å; A489-A491 PolarHBondContact O-N 3Å; A491-P493 WeakPolarHBondContact O-CD 3.43Å
492	D	74.4	Confident	77.8	Confident	21 Å²	21	77 Å²	77	11%	0.112	40%	0.4	C	S	.	.	S	Bend	trans	-82.2	116.6	171.7	-172.9	-25.3	0	0	0	109.3	R488 A489 E494 V495 Q496 K533	R488-D492 PolarHBondContact O-N 3.1Å; A489-D492 PolarHBondContact O-N 3.18Å; A489-D492 VanDerWaalsContact O-N 3.15Å; D492-E494 PolarHBondContact O-N 3.46Å; D492-E494 VanDerWaalsContact OD1-CB 3.29Å; D492-E494 WeakPolarHBondContact OD1-CB 3.37Å; D492-E494 PolarHBondContact OD1-N 2.89Å; D492-V495 HydrophobicContact CB-CB 4.01Å; D492-V495 HydrophobicContact CB-CG2 3.78Å; D492-V495 PolarHBondContact O-N 3.41Å; D492-V495 VanDerWaalsContact O-N 3.11Å; D492-Q496 PolarHBondContact O-N 3.39Å; D492-K533 WeakPolarHBondContact OD2-CE 3.49Å; D492-K533 IonicContact OD2-NZ 3.73Å; D492-K533 PolarHBondContact OD2-NZ 2.88Å
493	P	74.7	Confident	78.6	Confident	94 Å²	94	74 Å²	74	61%	0.61	39%	0.385	S	S	*	.	H	α-helix	trans	-58.4	-31.8	179.9	-24	34.3	0	0	0	113.5	A491 Q496 Q497	A491-P493 WeakPolarHBondContact O-CD 3.43Å; P493-Q496 PolarHBondContact O-N 2.86Å; P493-Q497 WeakPolarHBondContact O-CB 3.24Å; P493-Q497 PolarHBondContact O-N 3.27Å
494	E	80	Confident	79.5	Confident	101 Å²	101	66.6 Å²	66.6	47%	0.472	35%	0.35	S	S	.	.	H	α-helix	trans	-68	-42.9	177.6	-172.6	179	-158.5	0	0	110.5	D492 Q497 I498 K533	D492-E494 PolarHBondContact O-N 3.46Å; D492-E494 VanDerWaalsContact OD1-CB 3.29Å; D492-E494 WeakPolarHBondContact OD1-CB 3.37Å; D492-E494 PolarHBondContact OD1-N 2.89Å; E494-Q497 WeakPolarHBondContact O-CB 3.44Å; E494-Q497 PolarHBondContact O-N 3.28Å; E494-I498 HydrophobicContact CG-CD1 4.32Å; E494-I498 VanDerWaalsContact O-CG1 3.27Å; E494-I498 WeakPolarHBondContact O-CG1 3.37Å; E494-I498 PolarHBondContact O-N 3.01Å; E494-K533 WeakPolarHBondContact OE2-CE 3.45Å; E494-K533 IonicContact OE2-NZ 3.2Å; E494-K533 PolarHBondContact OE2-NZ 3.27Å
495	V	83.1	Confident	80.3	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-66.4	-40.7	175.5	173.8	0	0	0	0	111	A489 D492 Q497 I498 M499 K533 L534 V537 L539	A489-V495 HydrophobicContact CB-CG1 4.17Å; A489-V495 WeakPolarHBondContact O-CB 3.31Å; A489-V495 WeakPolarHBondContact O-CG1 3.4Å; D492-V495 HydrophobicContact CB-CB 4.01Å; D492-V495 HydrophobicContact CB-CG2 3.78Å; D492-V495 PolarHBondContact O-N 3.41Å; D492-V495 VanDerWaalsContact O-N 3.11Å; V495-Q497 VanDerWaalsContact C-N 3.27Å; V495-Q497 PolarHBondContact O-N 2.87Å; V495-I498 PolarHBondContact O-N 2.89Å; V495-M499 HydrophobicContact CG1-CG 4.15Å; V495-M499 WeakPolarHBondContact O-CB 3.43Å; V495-M499 VanDerWaalsContact O-CG 3.24Å; V495-M499 WeakPolarHBondContact O-CG 3.27Å; V495-M499 PolarHBondContact O-N 2.96Å; V495-K533 HydrophobicContact CG2-CG 4.38Å; V495-L534 HydrophobicContact CG1-CD2 3.89Å; V495-V537 HydrophobicContact CG2-CG1 4.13Å; V495-V537 HydrophobicContact CG2-CG2 4.18Å; V495-L539 HydrophobicContact CG1-CD1 3.6Å
496	Q	83	Confident	81	Confident	102 Å²	102	75 Å²	75	48%	0.477	38%	0.382	S	S	.	.	H	α-helix	trans	-57.8	-43.5	173.3	-70.8	-176.1	2.8	0	0	111.3	M490 D492 P493 M499 S500	M490-Q496 VanDerWaalsContact O-CG 3.29Å; M490-Q496 WeakPolarHBondContact O-CG 3.4Å; M490-Q496 PolarHBondContact O-NE2 2.96Å; D492-Q496 PolarHBondContact O-N 3.39Å; P493-Q496 PolarHBondContact O-N 2.86Å; Q496-M499 PolarHBondContact O-N 3.35Å; Q496-S500 VanDerWaalsContact O-CB 3.27Å; Q496-S500 WeakPolarHBondContact O-CB 3.47Å; Q496-S500 PolarHBondContact O-N 3.45Å; Q496-S500 PolarHBondContact O-OG 3.42Å
497	Q	86.4	Confident	81.6	Confident	139 Å²	139	69.3 Å²	69.3	65%	0.65	36%	0.358	S	S	*	.	H	α-helix	trans	-63.2	-46.7	178.6	-168.8	175.8	7.6	0	0	111.2	P493 E494 V495 M499 S500 D501	P493-Q497 WeakPolarHBondContact O-CB 3.24Å; P493-Q497 PolarHBondContact O-N 3.27Å; E494-Q497 WeakPolarHBondContact O-CB 3.44Å; E494-Q497 PolarHBondContact O-N 3.28Å; V495-Q497 VanDerWaalsContact C-N 3.27Å; V495-Q497 PolarHBondContact O-N 2.87Å; Q497-M499 VanDerWaalsContact C-N 3.34Å; Q497-M499 PolarHBondContact O-N 2.78Å; Q497-S500 WeakPolarHBondContact CA-OG 3.41Å; Q497-S500 PolarHBondContact O-N 3.23Å; Q497-S500 VanDerWaalsContact O-N 3.16Å; Q497-S500 PolarHBondContact O-OG 3.16Å; Q497-D501 PolarHBondContact O-N 3.15Å; Q497-D501 VanDerWaalsContact O-N 3.1Å
498	I	86.8	Confident	82	Confident	9 Å²	9	62.1 Å²	62.1	5%	0.046	33%	0.332	C	S	.	.	H	α-helix	trans	-59.3	-45	175.7	-65.4	166.4	0	0	0	110.8	E494 V495 S500 D501 M504 K530 K533 L534	E494-I498 HydrophobicContact CG-CD1 4.32Å; E494-I498 VanDerWaalsContact O-CG1 3.27Å; E494-I498 WeakPolarHBondContact O-CG1 3.37Å; E494-I498 PolarHBondContact O-N 3.01Å; V495-I498 PolarHBondContact O-N 2.89Å; I498-S500 VanDerWaalsContact C-N 3.27Å; I498-S500 PolarHBondContact O-N 3.45Å; I498-D501 WeakPolarHBondContact O-CB 3.38Å; I498-D501 PolarHBondContact O-N 2.91Å; I498-M504 HydrophobicContact CG2-CE 4.36Å; I498-M504 HydrophobicContact CG2-CG 4.28Å; I498-M504 WeakPolarHBondContact O-CB 3.19Å; I498-K530 HydrophobicContact CD1-CB 4.2Å; I498-K530 HydrophobicContact CD1-CG 4.16Å; I498-K530 HydrophobicContact CG1-CB 4.32Å; I498-K530 HydrophobicContact CG1-CD 4.35Å; I498-K530 HydrophobicContact CG1-CG 4.01Å; I498-K530 HydrophobicContact CG2-CB 4.1Å; I498-K533 HydrophobicContact CD1-CB 4.18Å; I498-K533 HydrophobicContact CD1-CG 3.96Å; I498-L534 HydrophobicContact CG2-CD1 3.78Å; I498-L534 HydrophobicContact CG2-CD2 4.17Å; I498-L534 HydrophobicContact CG2-CG 4.05Å
499	M	82.4	Confident	82.6	Confident	56 Å²	56	62.2 Å²	62.2	28%	0.276	34%	0.336	S	S	.	.	H	α-helix	trans	-73.7	-15.8	179.8	-66.7	-62.2	-68.4	0	0	113.4	M490 V495 Q496 Q497 R505 L508 L534	M490-M499 HydrophobicContact SD-CB 4.5Å; M490-M499 HydrophobicContact SD-CG 4.37Å; V495-M499 HydrophobicContact CG1-CG 4.15Å; V495-M499 WeakPolarHBondContact O-CB 3.43Å; V495-M499 VanDerWaalsContact O-CG 3.24Å; V495-M499 WeakPolarHBondContact O-CG 3.27Å; V495-M499 PolarHBondContact O-N 2.96Å; Q496-M499 PolarHBondContact O-N 3.35Å; Q497-M499 VanDerWaalsContact C-N 3.34Å; Q497-M499 PolarHBondContact O-N 2.78Å; M499-R505 PolarHBondContact O-NE 2.94Å; M499-R505 PolarHBondContact O-NH2 3.27Å; M499-R505 VanDerWaalsContact O-NH2 3.09Å; M499-L508 HydrophobicContact SD-CD1 3.9Å; M499-L534 HydrophobicContact CG-CD2 4.27Å; M499-L534 HydrophobicContact SD-CD1 4.22Å; M499-L534 HydrophobicContact SD-CD2 4.01Å
500	S	86.1	Confident	83	Confident	63 Å²	63	66.3 Å²	66.3	44%	0.441	36%	0.355	S	S	.	.	H	α-helix	trans	-90.4	-18.2	174.7	73.2	0	0	0	0	113.7	Q496 Q497 I498 P502	Q496-S500 VanDerWaalsContact O-CB 3.27Å; Q496-S500 WeakPolarHBondContact O-CB 3.47Å; Q496-S500 PolarHBondContact O-N 3.45Å; Q496-S500 PolarHBondContact O-OG 3.42Å; Q497-S500 WeakPolarHBondContact CA-OG 3.41Å; Q497-S500 PolarHBondContact O-N 3.23Å; Q497-S500 VanDerWaalsContact O-N 3.16Å; Q497-S500 PolarHBondContact O-OG 3.16Å; I498-S500 VanDerWaalsContact C-N 3.27Å; I498-S500 PolarHBondContact O-N 3.45Å; S500-P502 VanDerWaalsContact O-CD 3.31Å; S500-P502 WeakPolarHBondContact O-CD 3.3Å
501	D	90.3	Very high	83.2	Confident	42 Å²	42	64.1 Å²	64.1	23%	0.225	35%	0.345	C	S	.	.			trans	-67.4	116	179.3	-179	-13.5	0	0	0	110.4	Q497 I498 A503 M504 R505 K530	Q497-D501 PolarHBondContact O-N 3.15Å; Q497-D501 VanDerWaalsContact O-N 3.1Å; I498-D501 WeakPolarHBondContact O-CB 3.38Å; I498-D501 PolarHBondContact O-N 2.91Å; D501-A503 VanDerWaalsContact C-N 3.26Å; D501-A503 PolarHBondContact O-N 3.34Å; D501-A503 WeakPolarHBondContact OD1-CB 3.21Å; D501-A503 PolarHBondContact OD1-N 3.33Å; D501-M504 HydrophobicContact CB-CB 3.99Å; D501-M504 HydrophobicContact CB-CG 4.06Å; D501-M504 PolarHBondContact O-N 3.43Å; D501-R505 PolarHBondContact O-N 3.31Å; D501-K530 IonicContact OD2-NZ 2.95Å; D501-K530 PolarHBondContact OD2-NZ 2.94Å
502	P	86.5	Confident	83.5	Confident	92 Å²	92	68.8 Å²	68.8	60%	0.597	35%	0.354	S	S	*	.	H	α-helix	trans	-59.5	-34.5	-178.8	-24	34.3	0	0	0	113.5	S500 R505 L506	S500-P502 VanDerWaalsContact O-CD 3.31Å; S500-P502 WeakPolarHBondContact O-CD 3.3Å; P502-R505 PolarHBondContact O-N 3.41Å; P502-L506 WeakPolarHBondContact O-CG 3.29Å; P502-L506 PolarHBondContact O-N 3.5Å
503	A	86	Confident	83.8	Confident	52 Å²	52	75.2 Å²	75.2	43%	0.43	38%	0.381	S	S	.	.	H	α-helix	trans	-68.6	-42.9	178.1	0	0	0	0	0	110.5	D501 L506 I507	D501-A503 VanDerWaalsContact C-N 3.26Å; D501-A503 PolarHBondContact O-N 3.34Å; D501-A503 WeakPolarHBondContact OD1-CB 3.21Å; D501-A503 PolarHBondContact OD1-N 3.33Å; A503-L506 PolarHBondContact O-N 2.9Å; A503-I507 WeakPolarHBondContact O-CD1 3.31Å; A503-I507 VanDerWaalsContact O-CG1 3.26Å; A503-I507 WeakPolarHBondContact O-CG1 3.45Å; A503-I507 PolarHBondContact O-N 2.7Å
504	M	87.8	Confident	84.1	Confident	2 Å²	2	74.2 Å²	74.2	1%	0.01	37%	0.371	C	S	.	.	H	α-helix	trans	-65.1	-38.9	175.4	-73.2	-57	-54.7	0	0	112.3	I498 D501 L506 I507 L508 I527 K530 I531	I498-M504 HydrophobicContact CG2-CE 4.36Å; I498-M504 HydrophobicContact CG2-CG 4.28Å; I498-M504 WeakPolarHBondContact O-CB 3.19Å; D501-M504 HydrophobicContact CB-CB 3.99Å; D501-M504 HydrophobicContact CB-CG 4.06Å; D501-M504 PolarHBondContact O-N 3.43Å; M504-L506 VanDerWaalsContact C-N 3.32Å; M504-L506 PolarHBondContact O-N 3.36Å; M504-I507 PolarHBondContact O-N 2.95Å; M504-I507 HydrophobicContact SD-CD1 4.02Å; M504-L508 WeakPolarHBondContact O-CB 3.46Å; M504-L508 VanDerWaalsContact O-CG 3.23Å; M504-L508 WeakPolarHBondContact O-CG 3.45Å; M504-L508 PolarHBondContact O-N 3.26Å; M504-I527 HydrophobicContact CE-CG2 4.47Å; M504-I527 HydrophobicContact SD-CG1 4.47Å; M504-I527 HydrophobicContact SD-CG2 4.16Å; M504-K530 HydrophobicContact CE-CB 3.93Å; M504-K530 HydrophobicContact CE-CD 4.48Å; M504-K530 HydrophobicContact CG-CD 3.73Å; M504-K530 HydrophobicContact SD-CB 4.12Å; M504-K530 HydrophobicContact SD-CD 3.66Å; M504-I531 HydrophobicContact CE-CG1 3.98Å
505	R	85.8	Confident	83.5	Confident	150 Å²	150	74.1 Å²	74.1	57%	0.566	38%	0.379	S	S	*	.	H	α-helix	trans	-58.5	-44.1	174.9	-73.9	-178.5	-179.2	174.8	2.5	112.3	M499 D501 P502 L508 E509	M499-R505 PolarHBondContact O-NE 2.94Å; M499-R505 PolarHBondContact O-NH2 3.27Å; M499-R505 VanDerWaalsContact O-NH2 3.09Å; D501-R505 PolarHBondContact O-N 3.31Å; P502-R505 PolarHBondContact O-N 3.41Å; R505-L508 PolarHBondContact O-N 3.3Å; R505-E509 WeakPolarHBondContact O-CB 3.31Å; R505-E509 PolarHBondContact O-N 2.74Å
506	L	85.2	Confident	83.1	Confident	101 Å²	101	81.7 Å²	81.7	53%	0.529	41%	0.414	S	S	.	.	H	α-helix	trans	-63.4	-42.3	176.8	-72.1	167.7	0	0	0	111.6	P502 A503 M504 E509 Q510	P502-L506 WeakPolarHBondContact O-CG 3.29Å; P502-L506 PolarHBondContact O-N 3.5Å; A503-L506 PolarHBondContact O-N 2.9Å; M504-L506 VanDerWaalsContact C-N 3.32Å; M504-L506 PolarHBondContact O-N 3.36Å; L506-E509 PolarHBondContact O-N 3.23Å; L506-Q510 WeakPolarHBondContact O-CB 3.33Å; L506-Q510 VanDerWaalsContact O-CG 3.29Å; L506-Q510 WeakPolarHBondContact O-CG 3.35Å; L506-Q510 PolarHBondContact O-N 3Å
507	I	85.8	Confident	82.5	Confident	13 Å²	13	77.6 Å²	77.6	7%	0.067	40%	0.397	C	S	.	.	H	α-helix	trans	-63	-44	176.9	-67.4	160.9	0	0	0	110.9	A503 M504 E509 Q510 M511 H521 I527 I531	A503-I507 WeakPolarHBondContact O-CD1 3.31Å; A503-I507 VanDerWaalsContact O-CG1 3.26Å; A503-I507 WeakPolarHBondContact O-CG1 3.45Å; A503-I507 PolarHBondContact O-N 2.7Å; M504-I507 PolarHBondContact O-N 2.95Å; M504-I507 HydrophobicContact SD-CD1 4.02Å; I507-E509 VanDerWaalsContact C-N 3.34Å; I507-E509 PolarHBondContact O-N 3.2Å; I507-Q510 PolarHBondContact O-N 2.91Å; I507-M511 WeakPolarHBondContact O-CB 3.47Å; I507-M511 PolarHBondContact O-N 3.47Å; I507-H521 HydrophobicContact CG2-CB 4.11Å; I507-I527 HydrophobicContact CD1-CD1 3.71Å; I507-I527 HydrophobicContact CD1-CG1 4.22Å; I507-I527 HydrophobicContact CD1-CG2 4.07Å; I507-I527 HydrophobicContact CG2-CG2 4.42Å; I507-I531 HydrophobicContact CG2-CD1 4.38Å
508	L	83.7	Confident	81.8	Confident	23 Å²	23	71.6 Å²	71.6	12%	0.12	37%	0.37	C	S	.	.	H	α-helix	trans	-65.8	-36.2	177.7	-67.4	179.1	0	0	0	112.4	M499 M504 R505 M511 Q512 L534 I540	M499-L508 HydrophobicContact SD-CD1 3.9Å; M504-L508 WeakPolarHBondContact O-CB 3.46Å; M504-L508 VanDerWaalsContact O-CG 3.23Å; M504-L508 WeakPolarHBondContact O-CG 3.45Å; M504-L508 PolarHBondContact O-N 3.26Å; R505-L508 PolarHBondContact O-N 3.3Å; L508-M511 HydrophobicContact CD2-CE 3.88Å; L508-Q512 PolarHBondContact O-N 3.39Å; L508-L534 HydrophobicContact CD1-CD1 3.95Å; L508-L534 HydrophobicContact CD2-CD1 4.21Å; L508-I540 HydrophobicContact CD1-CD1 4.36Å; L508-I540 HydrophobicContact CD2-CD1 3.25Å; L508-I540 HydrophobicContact CG-CD1 4.42Å
509	E	84.2	Confident	81.3	Confident	92 Å²	92	75 Å²	75	43%	0.43	40%	0.395	S	S	.	.	H	α-helix	trans	-69.2	-41.2	174.4	-167.9	-172.2	160.8	0	0	111.8	R505 L506 I507 M511 Q512 K513	R505-E509 WeakPolarHBondContact O-CB 3.31Å; R505-E509 PolarHBondContact O-N 2.74Å; L506-E509 PolarHBondContact O-N 3.23Å; I507-E509 VanDerWaalsContact C-N 3.34Å; I507-E509 PolarHBondContact O-N 3.2Å; E509-M511 VanDerWaalsContact C-N 3.34Å; E509-Q512 PolarHBondContact O-N 3.41Å; E509-K513 PolarHBondContact O-N 3.41Å; E509-K513 IonicContact OE1-NZ 3.4Å; E509-K513 PolarHBondContact OE1-NZ 3.28Å
510	Q	82.7	Confident	81.2	Confident	89 Å²	89	78.8 Å²	78.8	42%	0.416	41%	0.411	S	S	.	.	H	α-helix	trans	-62.2	-42.7	173.7	-76	176	-1.1	0	0	111.1	L506 I507 Q512 K513 D514 H521	L506-Q510 WeakPolarHBondContact O-CB 3.33Å; L506-Q510 VanDerWaalsContact O-CG 3.29Å; L506-Q510 WeakPolarHBondContact O-CG 3.35Å; L506-Q510 PolarHBondContact O-N 3Å; I507-Q510 PolarHBondContact O-N 2.91Å; Q510-Q512 VanDerWaalsContact C-N 3.26Å; Q510-Q512 PolarHBondContact O-N 3.34Å; Q510-K513 CarbonylContact O-C 3.46Å; Q510-K513 PolarHBondContact O-N 3.48Å; Q510-D514 PolarHBondContact O-N 3.07Å; Q510-H521 PolarHBondContact OE1-NE2 3.23Å
511	M	80.3	Confident	80.9	Confident	34 Å²	34	78 Å²	78	17%	0.167	40%	0.401	C	S	.	.	H	α-helix	trans	-61.4	-31.7	177.7	-174.2	-173.1	70.9	0	0	112.8	I507 L508 E509 K513 L518 I540	I507-M511 WeakPolarHBondContact O-CB 3.47Å; I507-M511 PolarHBondContact O-N 3.47Å; L508-M511 HydrophobicContact CD2-CE 3.88Å; E509-M511 VanDerWaalsContact C-N 3.34Å; M511-K513 VanDerWaalsContact C-N 3.34Å; M511-L518 HydrophobicContact CG-CB 4.35Å; M511-L518 HydrophobicContact CG-CD1 4.06Å; M511-L518 HydrophobicContact CG-CD2 4.3Å; M511-L518 HydrophobicContact CG-CG 4.47Å; M511-L518 HydrophobicContact SD-CD1 3.71Å; M511-L518 HydrophobicContact SD-CD2 4.25Å; M511-I540 HydrophobicContact CE-CD1 4.15Å; M511-I540 HydrophobicContact CE-CG2 3.57Å; M511-I540 HydrophobicContact SD-CG2 4.3Å
512	Q	77.5	Confident	80.4	Confident	170 Å²	170	79.2 Å²	79.2	79%	0.794	41%	0.407	S	S	*	.	H	α-helix	trans	-71.6	-27.9	173.3	-78	-174.1	-11.3	0	0	113.3	L508 E509 Q510	L508-Q512 PolarHBondContact O-N 3.39Å; E509-Q512 PolarHBondContact O-N 3.41Å; Q510-Q512 VanDerWaalsContact C-N 3.26Å; Q510-Q512 PolarHBondContact O-N 3.34Å
513	K	81.4	Confident	80.4	Confident	156 Å²	156	82.4 Å²	82.4	68%	0.678	41%	0.411	S	S	*	.	H	α-helix	trans	-94.5	-32.7	-175.4	-69.7	173.1	176.2	171.6	0	112.6	E509 Q510 M511	E509-K513 PolarHBondContact O-N 3.41Å; E509-K513 IonicContact OE1-NZ 3.4Å; E509-K513 PolarHBondContact OE1-NZ 3.28Å; Q510-K513 CarbonylContact O-C 3.46Å; Q510-K513 PolarHBondContact O-N 3.48Å; M511-K513 VanDerWaalsContact C-N 3.34Å
514	D	80.8	Confident	80.4	Confident	73 Å²	73	83.2 Å²	83.2	39%	0.39	41%	0.408	S	S	.	.			trans	-142.3	103.6	-177.8	-177.1	5.5	0	0	0	111.5	Q510 Q516 A517	Q510-D514 PolarHBondContact O-N 3.07Å; D514-Q516 PolarHBondContact O-N 3.41Å; D514-Q516 WeakPolarHBondContact OD1-CB 3.21Å; D514-Q516 PolarHBondContact OD1-N 3.11Å; D514-A517 HydrophobicContact CB-CB 4.2Å; D514-A517 PolarHBondContact O-N 3.17Å
515	P	68.3	Low	80.2	Confident	99 Å²	99	87.6 Å²	87.6	64%	0.643	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-20.7	176.6	-23.1	33.9	0	0	0	114.6	L518	P515-L518 WeakPolarHBondContact O-CB 3.4Å
516	Q	74.9	Confident	80	Confident	159 Å²	159	84.3 Å²	84.3	74%	0.743	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-31.1	-179.8	-64.7	-175.4	-1.6	0	0	112.3	D514 L518 S519	D514-Q516 PolarHBondContact O-N 3.41Å; D514-Q516 WeakPolarHBondContact OD1-CB 3.21Å; D514-Q516 PolarHBondContact OD1-N 3.11Å; Q516-L518 PolarHBondContact O-N 2.89Å; Q516-S519 PolarHBondContact O-N 2.88Å; Q516-S519 VanDerWaalsContact O-N 3.11Å
517	A	70.8	Confident	80	Confident	15 Å²	15	80.8 Å²	80.8	12%	0.124	42%	0.415	C	S	.	.	H	α-helix	trans	-59.8	-25.4	175.1	0	0	0	0	0	112.8	D514 S519 E520 H521	D514-A517 HydrophobicContact CB-CB 4.2Å; D514-A517 PolarHBondContact O-N 3.17Å; A517-S519 VanDerWaalsContact C-N 3.31Å; A517-S519 PolarHBondContact O-N 3.38Å; A517-E520 PolarHBondContact O-N 2.87Å; A517-H521 PolarHBondContact O-CD2 3.16Å; A517-H521 PolarHBondContact O-N 3.49Å
518	L	70.4	Confident	79.9	Confident	14 Å²	14	81.4 Å²	81.4	7%	0.073	42%	0.422	C	S	.	.	H	α-helix	trans	-59.9	-40	175.4	-178.2	59.4	0	0	0	112.2	M511 P515 Q516 E520 H521 L522 I531 I542	M511-L518 HydrophobicContact CG-CB 4.35Å; M511-L518 HydrophobicContact CG-CD1 4.06Å; M511-L518 HydrophobicContact CG-CD2 4.3Å; M511-L518 HydrophobicContact CG-CG 4.47Å; M511-L518 HydrophobicContact SD-CD1 3.71Å; M511-L518 HydrophobicContact SD-CD2 4.25Å; P515-L518 WeakPolarHBondContact O-CB 3.4Å; Q516-L518 PolarHBondContact O-N 2.89Å; L518-E520 VanDerWaalsContact C-N 3.26Å; L518-E520 PolarHBondContact O-N 3.35Å; L518-H521 PolarHBondContact O-N 3.04Å; L518-L522 HydrophobicContact CD1-CD1 4.14Å; L518-L522 HydrophobicContact CD1-CD2 4.5Å; L518-L522 HydrophobicContact CD1-CG 4.05Å; L518-L522 HydrophobicContact CG-CD1 3.88Å; L518-L522 HydrophobicContact CG-CG 4.25Å; L518-L522 WeakPolarHBondContact O-CB 3.38Å; L518-L522 WeakPolarHBondContact O-CG 3.26Å; L518-L522 PolarHBondContact O-N 3.34Å; L518-I531 HydrophobicContact CD1-CD1 3.9Å; L518-I542 HydrophobicContact CD2-CD1 3.89Å; L518-I542 HydrophobicContact CD2-CG1 3.89Å; L518-I542 HydrophobicContact CD2-CG2 3.92Å
519	S	76.6	Confident	79.9	Confident	81 Å²	81	87.1 Å²	87.1	57%	0.566	45%	0.448	S	S	*	.	H	α-helix	trans	-64.7	-31.9	-179.1	-171.8	0	0	0	0	112.2	Q516 A517	Q516-S519 PolarHBondContact O-N 2.88Å; Q516-S519 VanDerWaalsContact O-N 3.11Å; A517-S519 VanDerWaalsContact C-N 3.31Å; A517-S519 PolarHBondContact O-N 3.38Å
520	E	79.8	Confident	80	Confident	135 Å²	135	85.4 Å²	85.4	63%	0.631	44%	0.439	S	S	*	.	H	α-helix	trans	-75.2	-42.5	177.2	-64.6	-164.6	148.3	0	0	112.3	A517 L518 L522 K523	A517-E520 PolarHBondContact O-N 2.87Å; L518-E520 VanDerWaalsContact C-N 3.26Å; L518-E520 PolarHBondContact O-N 3.35Å; E520-L522 VanDerWaalsContact C-N 3.33Å; E520-L522 PolarHBondContact O-N 3.17Å; E520-K523 WeakPolarHBondContact O-CB 3.34Å; E520-K523 PolarHBondContact O-N 3.41Å
521	H	80.8	Confident	80.1	Confident	46 Å²	46	81.2 Å²	81.2	21%	0.213	42%	0.419	C	S	.	.	H	α-helix	trans	-67.9	-32.3	177.8	-71.8	-56.4	0	0	0	112.9	I507 Q510 A517 L518 K523 N524 I527	I507-H521 HydrophobicContact CG2-CB 4.11Å; Q510-H521 PolarHBondContact OE1-NE2 3.23Å; A517-H521 PolarHBondContact O-CD2 3.16Å; A517-H521 PolarHBondContact O-N 3.49Å; L518-H521 PolarHBondContact O-N 3.04Å; H521-K523 PolarHBondContact O-N 3.46Å; H521-N524 PolarHBondContact O-N 2.95Å; H521-N524 VanDerWaalsContact O-N 3.16Å; H521-I527 HydrophobicContact CB-CG2 4.19Å
522	L	80	Confident	80.1	Confident	67 Å²	67	84 Å²	84	35%	0.351	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-14.4	174.9	-72.4	175.3	0	0	0	113.8	L518 E520 N524 A528 I531	L518-L522 HydrophobicContact CD1-CD1 4.14Å; L518-L522 HydrophobicContact CD1-CD2 4.5Å; L518-L522 HydrophobicContact CD1-CG 4.05Å; L518-L522 HydrophobicContact CG-CD1 3.88Å; L518-L522 HydrophobicContact CG-CG 4.25Å; L518-L522 WeakPolarHBondContact O-CB 3.38Å; L518-L522 WeakPolarHBondContact O-CG 3.26Å; L518-L522 PolarHBondContact O-N 3.34Å; E520-L522 VanDerWaalsContact C-N 3.33Å; E520-L522 PolarHBondContact O-N 3.17Å; L522-N524 PolarHBondContact O-N 2.74Å; L522-A528 HydrophobicContact CD2-CB 4.01Å; L522-I531 HydrophobicContact CD2-CB 4.4Å; L522-I531 HydrophobicContact CD2-CD1 4.03Å; L522-I531 HydrophobicContact CD2-CG2 4.38Å
523	K	85.2	Confident	80.2	Confident	159 Å²	159	78 Å²	78	69%	0.691	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-21.9	171.6	-65.2	173.4	-176	169.4	0	112.2	E520 H521 P525	E520-K523 WeakPolarHBondContact O-CB 3.34Å; E520-K523 PolarHBondContact O-N 3.41Å; H521-K523 PolarHBondContact O-N 3.46Å; K523-P525 WeakPolarHBondContact O-CD 3.26Å
524	N	86.3	Confident	80.3	Confident	70 Å²	70	70.6 Å²	70.6	37%	0.374	37%	0.371	S	S	.	.	S	Bend	trans	-85.6	115.8	173.3	-175.7	-36.7	0	0	0	109.5	H521 L522 V526 I527 A528	H521-N524 PolarHBondContact O-N 2.95Å; H521-N524 VanDerWaalsContact O-N 3.16Å; L522-N524 PolarHBondContact O-N 2.74Å; N524-V526 PolarHBondContact O-N 3.09Å; N524-V526 WeakPolarHBondContact OD1-CB 3.21Å; N524-V526 PolarHBondContact OD1-N 2.75Å; N524-I527 HydrophobicContact CB-CB 4.1Å; N524-I527 HydrophobicContact CB-CD1 3.85Å; N524-I527 HydrophobicContact CB-CG1 4.09Å; N524-I527 PolarHBondContact O-N 3.34Å; N524-I527 VanDerWaalsContact O-N 3.13Å; N524-I527 PolarHBondContact OD1-N 3.39Å; N524-A528 WeakPolarHBondContact O-CB 3.24Å; N524-A528 PolarHBondContact O-N 3.01Å
525	P	83.1	Confident	80.2	Confident	93 Å²	93	69.4 Å²	69.4	60%	0.604	36%	0.364	S	S	*	.	H	α-helix	trans	-63	-30.2	-174.2	24.1	-33.2	0	0	0	113.2	K523 Q529	K523-P525 WeakPolarHBondContact O-CD 3.26Å; P525-Q529 WeakPolarHBondContact O-CG 3.36Å; P525-Q529 PolarHBondContact O-N 3.07Å
526	V	82.9	Confident	80.3	Confident	81 Å²	81	68.6 Å²	68.6	49%	0.491	35%	0.354	S	S	.	.	H	α-helix	trans	-71.7	-41	178.2	-178.9	0	0	0	0	110.7	N524 K530	N524-V526 PolarHBondContact O-N 3.09Å; N524-V526 WeakPolarHBondContact OD1-CB 3.21Å; N524-V526 PolarHBondContact OD1-N 2.75Å; V526-K530 WeakPolarHBondContact O-CG 3.32Å; V526-K530 PolarHBondContact O-N 3.07Å
527	I	85.4	Confident	80.2	Confident	27 Å²	27	62.6 Å²	62.6	14%	0.138	33%	0.328	C	S	.	.	H	α-helix	trans	-70.5	-41.2	177.3	-64	171.7	0	0	0	109.8	M504 I507 H521 N524 Q529 K530 I531	M504-I527 HydrophobicContact CE-CG2 4.47Å; M504-I527 HydrophobicContact SD-CG1 4.47Å; M504-I527 HydrophobicContact SD-CG2 4.16Å; I507-I527 HydrophobicContact CD1-CD1 3.71Å; I507-I527 HydrophobicContact CD1-CG1 4.22Å; I507-I527 HydrophobicContact CD1-CG2 4.07Å; I507-I527 HydrophobicContact CG2-CG2 4.42Å; H521-I527 HydrophobicContact CB-CG2 4.19Å; N524-I527 HydrophobicContact CB-CB 4.1Å; N524-I527 HydrophobicContact CB-CD1 3.85Å; N524-I527 HydrophobicContact CB-CG1 4.09Å; N524-I527 PolarHBondContact O-N 3.34Å; N524-I527 VanDerWaalsContact O-N 3.13Å; N524-I527 PolarHBondContact OD1-N 3.39Å; I527-Q529 PolarHBondContact O-N 3.49Å; I527-K530 PolarHBondContact O-N 3.45Å; I527-I531 HydrophobicContact CG2-CD1 3.75Å; I527-I531 HydrophobicContact CG2-CG1 4.26Å; I527-I531 WeakPolarHBondContact O-CG1 3.41Å; I527-I531 PolarHBondContact O-N 3.4Å
528	A	83.1	Confident	80.2	Confident	27 Å²	27	64.1 Å²	64.1	22%	0.223	35%	0.345	C	S	.	.	H	α-helix	trans	-58.1	-44.9	176	0	0	0	0	0	112.4	L522 N524 K530 I531 Q532	L522-A528 HydrophobicContact CD2-CB 4.01Å; N524-A528 WeakPolarHBondContact O-CB 3.24Å; N524-A528 PolarHBondContact O-N 3.01Å; A528-K530 PolarHBondContact O-N 2.91Å; A528-I531 PolarHBondContact O-N 3.09Å; A528-Q532 WeakPolarHBondContact O-CB 3.37Å; A528-Q532 PolarHBondContact O-N 3.5Å
529	Q	83.6	Confident	80.5	Confident	143 Å²	143	65.9 Å²	65.9	67%	0.668	36%	0.355	S	S	*	.	H	α-helix	trans	-61.2	-42.9	174.8	-77.9	178.1	-5.9	0	0	112.6	P525 I527 Q532 K533	P525-Q529 WeakPolarHBondContact O-CG 3.36Å; P525-Q529 PolarHBondContact O-N 3.07Å; I527-Q529 PolarHBondContact O-N 3.49Å; Q529-Q532 PolarHBondContact O-N 2.85Å; Q529-K533 WeakPolarHBondContact O-CB 3.23Å; Q529-K533 PolarHBondContact O-N 3.25Å
530	K	85.9	Confident	80.5	Confident	56 Å²	56	63.3 Å²	63.3	24%	0.243	33%	0.334	C	S	.	.	H	α-helix	trans	-64	-41.8	177.1	-70.2	179.3	178.4	179.5	0	111.9	I498 D501 M504 V526 I527 A528 K533 L534	I498-K530 HydrophobicContact CD1-CB 4.2Å; I498-K530 HydrophobicContact CD1-CG 4.16Å; I498-K530 HydrophobicContact CG1-CB 4.32Å; I498-K530 HydrophobicContact CG1-CD 4.35Å; I498-K530 HydrophobicContact CG1-CG 4.01Å; I498-K530 HydrophobicContact CG2-CB 4.1Å; D501-K530 IonicContact OD2-NZ 2.95Å; D501-K530 PolarHBondContact OD2-NZ 2.94Å; M504-K530 HydrophobicContact CE-CB 3.93Å; M504-K530 HydrophobicContact CE-CD 4.48Å; M504-K530 HydrophobicContact CG-CD 3.73Å; M504-K530 HydrophobicContact SD-CB 4.12Å; M504-K530 HydrophobicContact SD-CD 3.66Å; V526-K530 WeakPolarHBondContact O-CG 3.32Å; V526-K530 PolarHBondContact O-N 3.07Å; I527-K530 PolarHBondContact O-N 3.45Å; A528-K530 PolarHBondContact O-N 2.91Å; K530-K533 PolarHBondContact O-N 2.72Å; K530-L534 WeakPolarHBondContact O-CG 3.46Å; K530-L534 PolarHBondContact O-N 3.34Å
531	I	85	Confident	79.9	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-66.5	-43.6	176.6	-66.8	174.2	0	0	0	110.3	M504 I507 L518 L522 I527 A528 K533 L534 M535	M504-I531 HydrophobicContact CE-CG1 3.98Å; I507-I531 HydrophobicContact CG2-CD1 4.38Å; L518-I531 HydrophobicContact CD1-CD1 3.9Å; L522-I531 HydrophobicContact CD2-CB 4.4Å; L522-I531 HydrophobicContact CD2-CD1 4.03Å; L522-I531 HydrophobicContact CD2-CG2 4.38Å; I527-I531 HydrophobicContact CG2-CD1 3.75Å; I527-I531 HydrophobicContact CG2-CG1 4.26Å; I527-I531 WeakPolarHBondContact O-CG1 3.41Å; I527-I531 PolarHBondContact O-N 3.4Å; A528-I531 PolarHBondContact O-N 3.09Å; I531-K533 VanDerWaalsContact C-N 3.35Å; I531-K533 PolarHBondContact O-N 3.23Å; I531-L534 PolarHBondContact O-N 3.23Å; I531-L534 VanDerWaalsContact O-N 3.13Å; I531-M535 HydrophobicContact CG2-CE 4.29Å; I531-M535 WeakPolarHBondContact O-CG 3.43Å; I531-M535 PolarHBondContact O-N 3.3Å
532	Q	79.9	Confident	79.1	Confident	93 Å²	93	62.8 Å²	62.8	44%	0.435	35%	0.348	S	S	.	.	H	α-helix	trans	-56.9	-48.1	175.4	-172.2	62.5	47.2	0	0	111.5	A528 Q529 L534 M535 D536	A528-Q532 WeakPolarHBondContact O-CB 3.37Å; A528-Q532 PolarHBondContact O-N 3.5Å; Q529-Q532 PolarHBondContact O-N 2.85Å; Q532-L534 VanDerWaalsContact C-N 3.27Å; Q532-L534 PolarHBondContact O-N 3.31Å; Q532-M535 HydrophobicContact CB-CE 4.36Å; Q532-M535 WeakPolarHBondContact O-CA 3.45Å; Q532-M535 WeakPolarHBondContact O-CB 3.42Å; Q532-M535 PolarHBondContact O-N 3.05Å; Q532-D536 PolarHBondContact NE2-OD1 2.99Å; Q532-D536 PolarHBondContact O-N 3.15Å
533	K	81	Confident	77.8	Confident	44 Å²	44	73.8 Å²	73.8	19%	0.191	39%	0.385	C	S	.	.	H	α-helix	trans	-56.7	-40.1	176.2	-179.7	70.8	-169.6	-145.6	0	112.5	D492 E494 V495 I498 Q529 K530 I531 M535 D536 V537	D492-K533 WeakPolarHBondContact OD2-CE 3.49Å; D492-K533 IonicContact OD2-NZ 3.73Å; D492-K533 PolarHBondContact OD2-NZ 2.88Å; E494-K533 WeakPolarHBondContact OE2-CE 3.45Å; E494-K533 IonicContact OE2-NZ 3.2Å; E494-K533 PolarHBondContact OE2-NZ 3.27Å; V495-K533 HydrophobicContact CG2-CG 4.38Å; I498-K533 HydrophobicContact CD1-CB 4.18Å; I498-K533 HydrophobicContact CD1-CG 3.96Å; Q529-K533 WeakPolarHBondContact O-CB 3.23Å; Q529-K533 PolarHBondContact O-N 3.25Å; K530-K533 PolarHBondContact O-N 2.72Å; I531-K533 VanDerWaalsContact C-N 3.35Å; I531-K533 PolarHBondContact O-N 3.23Å; K533-M535 VanDerWaalsContact C-N 3.35Å; K533-D536 PolarHBondContact O-N 2.62Å; K533-V537 WeakPolarHBondContact O-CG2 3.13Å; K533-V537 PolarHBondContact O-N 2.79Å
534	L	82.5	Confident	77.4	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-70.2	-29.8	177	-66.8	176.6	0	0	0	112.9	V495 I498 M499 L508 K530 I531 Q532 V537 G538 L539 I540	V495-L534 HydrophobicContact CG1-CD2 3.89Å; I498-L534 HydrophobicContact CG2-CD1 3.78Å; I498-L534 HydrophobicContact CG2-CD2 4.17Å; I498-L534 HydrophobicContact CG2-CG 4.05Å; M499-L534 HydrophobicContact CG-CD2 4.27Å; M499-L534 HydrophobicContact SD-CD1 4.22Å; M499-L534 HydrophobicContact SD-CD2 4.01Å; L508-L534 HydrophobicContact CD1-CD1 3.95Å; L508-L534 HydrophobicContact CD2-CD1 4.21Å; K530-L534 WeakPolarHBondContact O-CG 3.46Å; K530-L534 PolarHBondContact O-N 3.34Å; I531-L534 PolarHBondContact O-N 3.23Å; I531-L534 VanDerWaalsContact O-N 3.13Å; Q532-L534 VanDerWaalsContact C-N 3.27Å; Q532-L534 PolarHBondContact O-N 3.31Å; L534-V537 WeakPolarHBondContact O-CG2 3.36Å; L534-G538 PolarHBondContact O-N 3.36Å; L534-L539 HydrophobicContact CD2-CD1 3.81Å; L534-L539 PolarHBondContact O-N 3.35Å; L534-I540 HydrophobicContact CB-CD1 3.62Å; L534-I540 HydrophobicContact CB-CG1 4.12Å; L534-I540 HydrophobicContact CD1-CD1 3.5Å; L534-I540 HydrophobicContact CG-CD1 4.19Å; L534-I540 PolarHBondContact O-N 2.96Å
535	M	78.3	Confident	77	Confident	49 Å²	49	69.5 Å²	69.5	24%	0.241	37%	0.369	C	S	.	.	H	α-helix	trans	-72.4	-42.3	171.8	-66.4	-171.1	-66.2	0	0	111.8	I531 Q532 K533 V537 G538 I540 I542	I531-M535 HydrophobicContact CG2-CE 4.29Å; I531-M535 WeakPolarHBondContact O-CG 3.43Å; I531-M535 PolarHBondContact O-N 3.3Å; Q532-M535 HydrophobicContact CB-CE 4.36Å; Q532-M535 WeakPolarHBondContact O-CA 3.45Å; Q532-M535 WeakPolarHBondContact O-CB 3.42Å; Q532-M535 PolarHBondContact O-N 3.05Å; K533-M535 VanDerWaalsContact C-N 3.35Å; M535-V537 PolarHBondContact O-N 3.45Å; M535-G538 WeakPolarHBondContact O-CA 3.29Å; M535-G538 PolarHBondContact O-N 3.41Å; M535-I540 HydrophobicContact CG-CB 4.43Å; M535-I542 HydrophobicContact CE-CD1 4.05Å; M535-I542 HydrophobicContact SD-CD1 3.36Å; M535-I542 WeakPolarHBondContact SD-CD1 3.45Å; M535-I542 HydrophobicContact SD-CG1 3.62Å
536	D	71.3	Confident	76.6	Confident	81 Å²	81	68.2 Å²	68.2	43%	0.433	36%	0.356	S	S	.	.	H	α-helix	trans	-62.2	-32.5	-179.6	-61.5	-21.2	0	0	0	112	Q532 K533 G538	Q532-D536 PolarHBondContact NE2-OD1 2.99Å; Q532-D536 PolarHBondContact O-N 3.15Å; K533-D536 PolarHBondContact O-N 2.62Å; D536-G538 VanDerWaalsContact C-N 3.34Å
537	V	72.6	Confident	76.3	Confident	33 Å²	33	67.5 Å²	67.5	20%	0.2	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	0.6	174.1	-56.3	0	0	0	0	113.6	V485 A489 V495 K533 L534 M535 L539	V485-V537 WeakPolarHBondContact CG1-O 3.44Å; A489-V537 HydrophobicContact CB-CB 4.06Å; A489-V537 HydrophobicContact CB-CG2 3.76Å; V495-V537 HydrophobicContact CG2-CG1 4.13Å; V495-V537 HydrophobicContact CG2-CG2 4.18Å; K533-V537 WeakPolarHBondContact O-CG2 3.13Å; K533-V537 PolarHBondContact O-N 2.79Å; L534-V537 WeakPolarHBondContact O-CG2 3.36Å; M535-V537 PolarHBondContact O-N 3.45Å; V537-L539 VanDerWaalsContact C-N 3.34Å; V537-L539 HydrophobicContact CG2-CB 4.22Å; V537-L539 HydrophobicContact CG2-CD1 4.05Å; V537-L539 HydrophobicContact CG2-CG 4.03Å; V537-L539 PolarHBondContact O-N 2.67Å
538	G	70.6	Confident	75.7	Confident	47 Å²	47	70 Å²	70	49%	0.485	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.7	12.2	175.4	0	0	0	0	0	115.7	V485 L534 M535 D536 I540	V485-G538 WeakPolarHBondContact CG1-O 3.35Å; L534-G538 PolarHBondContact O-N 3.36Å; M535-G538 WeakPolarHBondContact O-CA 3.29Å; M535-G538 PolarHBondContact O-N 3.41Å; D536-G538 VanDerWaalsContact C-N 3.34Å; G538-I540 VanDerWaalsContact C-N 3.31Å
539	L	77.2	Confident	75.2	Confident	51 Å²	51	72.9 Å²	72.9	27%	0.267	37%	0.37	S	S	.	.	S	Bend	trans	-72.5	-26.8	178.1	-85.1	175.9	0	0	0	112.8	K486 A489 V495 L534 V537	K486-L539 HydrophobicContact CB-CD2 4.34Å; K486-L539 HydrophobicContact CG-CD2 4.34Å; A489-L539 HydrophobicContact CB-CD1 3.37Å; A489-L539 HydrophobicContact CB-CD2 3.92Å; A489-L539 HydrophobicContact CB-CG 3.4Å; A489-L539 VanDerWaalsContact CB-CG 3.4Å; V495-L539 HydrophobicContact CG1-CD1 3.6Å; L534-L539 HydrophobicContact CD2-CD1 3.81Å; L534-L539 PolarHBondContact O-N 3.35Å; V537-L539 VanDerWaalsContact C-N 3.34Å; V537-L539 HydrophobicContact CG2-CB 4.22Å; V537-L539 HydrophobicContact CG2-CD1 4.05Å; V537-L539 HydrophobicContact CG2-CG 4.03Å; V537-L539 PolarHBondContact O-N 2.67Å
540	I	75.7	Confident	74.6	Confident	28 Å²	28	67.9 Å²	67.9	14%	0.144	35%	0.349	C	S	.	.			trans	-133.2	139.7	-176.8	-59.1	173.7	0	0	0	108.3	L508 M511 L534 M535 G538	L508-I540 HydrophobicContact CD1-CD1 4.36Å; L508-I540 HydrophobicContact CD2-CD1 3.25Å; L508-I540 HydrophobicContact CG-CD1 4.42Å; M511-I540 HydrophobicContact CE-CD1 4.15Å; M511-I540 HydrophobicContact CE-CG2 3.57Å; M511-I540 HydrophobicContact SD-CG2 4.3Å; L534-I540 HydrophobicContact CB-CD1 3.62Å; L534-I540 HydrophobicContact CB-CG1 4.12Å; L534-I540 HydrophobicContact CD1-CD1 3.5Å; L534-I540 HydrophobicContact CG-CD1 4.19Å; L534-I540 PolarHBondContact O-N 2.96Å; M535-I540 HydrophobicContact CG-CB 4.43Å; G538-I540 VanDerWaalsContact C-N 3.31Å
541	A	67.1	Low	73.7	Confident	81 Å²	81	68.8 Å²	68.8	67%	0.669	36%	0.357	S	S	*	.			trans	-122.3	128.8	166	0	0	0	0	0	108.3
542	I	63.7	Low	72.8	Confident	88 Å²	88	74.5 Å²	74.5	45%	0.451	39%	0.387	S	S	.	.			trans	-79.3	121.3	167.5	-57.6	172.5	0	0	0	106.1	L518 M535	L518-I542 HydrophobicContact CD2-CD1 3.89Å; L518-I542 HydrophobicContact CD2-CG1 3.89Å; L518-I542 HydrophobicContact CD2-CG2 3.92Å; M535-I542 HydrophobicContact CE-CD1 4.05Å; M535-I542 HydrophobicContact SD-CD1 3.36Å; M535-I542 WeakPolarHBondContact SD-CD1 3.45Å; M535-I542 HydrophobicContact SD-CG1 3.62Å
543	R	53.6	Low	72.1	Confident	299 Å²	299	72.8 Å²	72.8	100%	1.128	38%	0.383	S	S	*	.			trans	-109.8	0	174.1	-77.7	-171.1	-178.4	-178.5	1.2	110.5

Retrieved 543 of 543 residues in 132 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).