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Deoxyhypusine hydroxylase

Catalyzes the hydroxylation of the N(6)-(4-aminobutyl)-L-lysine intermediate produced by deoxyhypusine synthase/DHPS on a critical lysine of the eukaryotic translation initiation factor 5A/eIF-5A. This is the second step of the post-translational modification of that lysine into an unusual amino acid residue named hypusine. Hypusination is unique to mature eIF-5A factor and is essential for its function. Catalyzes the hydroxylation of the N(6)-(4-aminobutyl)-L-lysine intermediate to form hypusine, an essential post-translational modification only found in mature eIF-5A factor.

AlphaFold DB , UniProt , Accession A0A077ZJP7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 316 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	51	Low	44.2	Very low	4 Å²	4	56.7 Å²	56.7	2%	0.02	35%	0.347	C	S	.	.				0	-39.7	0	-167.9	-175.5	-71.6	0	0	116.7	S3 G4 F232 G235 E262 E265 A266 S269	M1-S3 PolarHBondContact O-N 2.8Å; M1-G4 PolarHBondContact O-N 2.96Å; M1-F232 HydrophobicContact CB-CD2 4.08Å; M1-F232 HydrophobicContact CB-CE2 4.3Å; M1-F232 VanDerWaalsContact CE-CA 3.48Å; M1-F232 HydrophobicContact CE-CB 4.46Å; M1-F232 HydrophobicContact CG-CD2 4.14Å; M1-F232 HydrophobicContact CG-CE2 4.4Å; M1-G235 VanDerWaalsContact SD-CA 3.56Å; M1-E262 HydrophobicContact CE-CG 3.97Å; M1-E262 WeakPolarHBondContact CE-O 3.34Å; M1-E262 WeakPolarHBondContact CE-OE1 3.34Å; M1-E265 HydrophobicContact CB-CB 3.93Å; M1-E265 WeakPolarHBondContact CB-OE2 3.43Å; M1-E265 HydrophobicContact CE-CB 3.83Å; M1-E265 PolarHBondContact N-OE2 3.17Å; M1-E265 HydrophobicContact SD-CB 3.81Å; M1-A266 HydrophobicContact CE-CB 3.65Å; M1-A266 WeakPolarHBondContact SD-CA 3.32Å; M1-A266 HydrophobicContact SD-CB 4.01Å; M1-A266 PolarHBondContact SD-N 3.38Å; M1-S269 PolarHBondContact SD-OG 3.37Å
2	F	53	Low	43.6	Very low	0 Å²	0	64.8 Å²	64.8	0%	0	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-62.3	-19.1	-162	-59.3	-61.5	0	0	0	116.9	G4 I5 I6 F43 E265 I296 A297 I300	F2-G4 PolarHBondContact O-N 3.44Å; F2-I5 PolarHBondContact O-N 3.35Å; F2-I6 PolarHBondContact O-N 3.44Å; F2-F43 HydrophobicContact CB-CE2 4.17Å; F2-F43 HydrophobicContact CB-CZ 4.21Å; F2-E265 HydrophobicContact CD2-CG 4.48Å; F2-E265 HydrophobicContact CE1-CB 3.97Å; F2-E265 HydrophobicContact CE1-CG 4.34Å; F2-E265 HydrophobicContact CE2-CB 4.05Å; F2-E265 HydrophobicContact CE2-CG 3.53Å; F2-E265 WeakPolarHBondContact CE2-OE2 3.19Å; F2-E265 HydrophobicContact CZ-CB 3.59Å; F2-E265 HydrophobicContact CZ-CG 3.47Å; F2-E265 VanDerWaalsContact CZ-CG 3.47Å; F2-I296 HydrophobicContact CD2-CG2 3.98Å; F2-I296 HydrophobicContact CE2-CB 4.25Å; F2-I296 HydrophobicContact CE2-CG2 3.56Å; F2-I296 HydrophobicContact CZ-CG2 4.19Å; F2-A297 HydrophobicContact CE1-CB 4.29Å; F2-A297 HydrophobicContact CZ-CB 3.95Å; F2-I300 HydrophobicContact CB-CD1 3.46Å; F2-I300 VanDerWaalsContact CB-CD1 3.46Å; F2-I300 HydrophobicContact CD1-CB 4.42Å; F2-I300 HydrophobicContact CD1-CD1 3.08Å; F2-I300 HydrophobicContact CD1-CG1 4.3Å; F2-I300 HydrophobicContact CD1-CG2 4.18Å; F2-I300 HydrophobicContact CD2-CD1 3.44Å; F2-I300 VanDerWaalsContact CD2-CD1 3.44Å; F2-I300 HydrophobicContact CE1-CD1 3.49Å; F2-I300 VanDerWaalsContact CE1-CD1 3.49Å; F2-I300 HydrophobicContact CE2-CD1 3.83Å; F2-I300 HydrophobicContact CG-CD1 3.01Å; F2-I300 HydrophobicContact CG-CG1 4.45Å; F2-I300 HydrophobicContact CZ-CD1 3.82Å
3	S	46	Very low	43.1	Very low	3 Å²	3	68.2 Å²	68.2	2%	0.021	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-65.1	-21	179.1	78.4	0	0	0	0	114.4	M1 F8 Y74	M1-S3 PolarHBondContact O-N 2.8Å; S3-F8 VanDerWaalsContact O-CE2 3.3Å; S3-F8 WeakPolarHBondContact O-CE2 3.33Å; S3-Y74 PolarHBondContact OG-OH 2.73Å
4	G	45.9	Very low	43.2	Very low	36 Å²	36	70.8 Å²	70.8	37%	0.371	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-78.4	-24.6	177.2	0	0	0	0	0	114.2	M1 F2	M1-G4 PolarHBondContact O-N 2.96Å; F2-G4 PolarHBondContact O-N 3.44Å
5	I	46.8	Very low	43.3	Very low	35 Å²	35	77.4 Å²	77.4	18%	0.179	45%	0.451	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-32.1	-168.1	-67.7	167.7	0	0	0	112	F2 S7 S269 M304	F2-I5 PolarHBondContact O-N 3.35Å; I5-S7 PolarHBondContact O-N 2.94Å; I5-S269 VanDerWaalsContact CD1-CA 3.43Å; I5-S269 WeakPolarHBondContact CD1-OG 3.03Å; I5-M304 HydrophobicContact CG2-CE 3.95Å; I5-M304 HydrophobicContact CG2-SD 3.81Å
6	I	48	Very low	44.2	Very low	8 Å²	8	76.6 Å²	76.6	4%	0.041	44%	0.441	C	S	.	.	S	Bend	trans	-71.6	90.3	167.8	-55.7	156.2	0	0	0	105.7	F2 F8 F43 Y311	F2-I6 PolarHBondContact O-N 3.44Å; I6-F8 VanDerWaalsContact C-N 3.29Å; I6-F8 HydrophobicContact CB-CE1 3.89Å; I6-F8 HydrophobicContact CB-CE2 4.35Å; I6-F8 HydrophobicContact CB-CZ 3.8Å; I6-F8 HydrophobicContact CD1-CZ 4.42Å; I6-F8 HydrophobicContact CG2-CD1 3.78Å; I6-F8 HydrophobicContact CG2-CE1 3.37Å; I6-F8 HydrophobicContact CG2-CZ 3.85Å; I6-F8 WeakPolarHBondContact O-CD2 3.48Å; I6-F8 VanDerWaalsContact O-CE2 3.32Å; I6-F8 WeakPolarHBondContact O-CE2 3.49Å; I6-F8 WeakPolarHBondContact O-CG 3.38Å; I6-F8 PolarHBondContact O-N 2.9Å; I6-F43 HydrophobicContact CD1-CD2 4.27Å; I6-F43 HydrophobicContact CD1-CE2 4.49Å; I6-Y311 HydrophobicContact CD1-CD1 3.28Å; I6-Y311 HydrophobicContact CD1-CD2 4.35Å; I6-Y311 HydrophobicContact CD1-CE1 3.95Å; I6-Y311 HydrophobicContact CD1-CG 3.51Å; I6-Y311 HydrophobicContact CG1-CD1 4.39Å; I6-Y311 HydrophobicContact CG1-CG 4.17Å
7	S	42.5	Very low	45.6	Very low	114 Å²	114	76.5 Å²	76.5	80%	0.797	44%	0.442	S	S	*	.			trans	-56.9	97.9	170.1	-173.3	0	0	0	0	107.6	I5 C9	I5-S7 PolarHBondContact O-N 2.94Å; S7-C9 PolarHBondContact O-N 3.22Å
8	F	46.7	Very low	47.6	Very low	53 Å²	53	79.1 Å²	79.1	23%	0.232	45%	0.454	C	S	.	.			trans	-73.1	115.4	177.9	-61.1	-67.9	0	0	0	106.5	S3 I6 S10 N47 A312	S3-F8 VanDerWaalsContact O-CE2 3.3Å; S3-F8 WeakPolarHBondContact O-CE2 3.33Å; I6-F8 VanDerWaalsContact C-N 3.29Å; I6-F8 HydrophobicContact CB-CE1 3.89Å; I6-F8 HydrophobicContact CB-CE2 4.35Å; I6-F8 HydrophobicContact CB-CZ 3.8Å; I6-F8 HydrophobicContact CD1-CZ 4.42Å; I6-F8 HydrophobicContact CG2-CD1 3.78Å; I6-F8 HydrophobicContact CG2-CE1 3.37Å; I6-F8 HydrophobicContact CG2-CZ 3.85Å; I6-F8 WeakPolarHBondContact O-CD2 3.48Å; I6-F8 VanDerWaalsContact O-CE2 3.32Å; I6-F8 WeakPolarHBondContact O-CE2 3.49Å; I6-F8 WeakPolarHBondContact O-CG 3.38Å; I6-F8 PolarHBondContact O-N 2.9Å; F8-S10 VanDerWaalsContact C-N 3.31Å; F8-S10 PolarHBondContact O-N 2.94Å; F8-N47 WeakPolarHBondContact CD1-ND2 3.37Å; F8-N47 WeakPolarHBondContact CE1-ND2 3.32Å; F8-N47 WeakPolarHBondContact CZ-ND2 3.27Å; F8-A312 HydrophobicContact CE1-CB 4.13Å
9	C	35.6	Very low	49.7	Very low	92 Å²	92	78.6 Å²	78.6	62%	0.622	46%	0.46	S	S	*	.			trans	-51.8	104.4	164.2	-89.6	0	0	0	0	107.3	S7 F11	S7-C9 PolarHBondContact O-N 3.22Å; C9-F11 PolarHBondContact O-N 3.35Å
10	S	34.6	Very low	51.6	Low	120 Å²	120	78.3 Å²	78.3	84%	0.839	45%	0.454	S	S	*	.			trans	-74	48.4	170.2	53.7	0	0	0	0	109.2	F8 E12	F8-S10 VanDerWaalsContact C-N 3.31Å; F8-S10 PolarHBondContact O-N 2.94Å; S10-E12 PolarHBondContact O-N 2.91Å
11	F	36	Very low	53.6	Low	159 Å²	159	75 Å²	75	70%	0.697	44%	0.435	S	S	*	.			trans	-74.8	118.9	161.3	-99.8	-90	0	0	0	106.7	C9	C9-F11 PolarHBondContact O-N 3.35Å
12	E	37.1	Very low	55.7	Low	153 Å²	153	78 Å²	78	72%	0.715	45%	0.454	S	S	*	.			trans	27.9	111.8	141.4	-63.3	177.6	163.3	0	0	112.6	S10 V14	S10-E12 PolarHBondContact O-N 2.91Å; E12-V14 PolarHBondContact O-N 3.47Å
13	S	37.5	Very low	57.8	Low	110 Å²	110	80 Å²	80	77%	0.769	47%	0.465	S	S	*	.			trans	-2.6	63.1	137.4	168.5	0	0	0	0	114.8	M15	S13-M15 PolarHBondContact O-N 2.93Å
14	V	44.7	Very low	60.1	Low	104 Å²	104	79.9 Å²	79.9	63%	0.63	46%	0.464	S	S	*	.			trans	-59.6	109.9	150.6	178.2	0	0	0	0	98.5	E12 K16	E12-V14 PolarHBondContact O-N 3.47Å; V14-K16 PolarHBondContact O-N 3.35Å
15	M	45	Very low	62.6	Low	170 Å²	170	78.1 Å²	78.1	84%	0.837	45%	0.446	S	S	*	.			trans	-57.2	89.3	175.1	-72.7	-157.7	-158.3	0	0	105.6	S13 T17	S13-M15 PolarHBondContact O-N 2.93Å; M15-T17 PolarHBondContact O-N 3.46Å
16	K	57.6	Low	65.1	Low	64 Å²	64	80.1 Å²	80.1	28%	0.278	46%	0.46	S	S	.	.			trans	-68	124.4	-175.5	-81.4	-175.9	170.6	-178	0	105.3	V14 E20 L44 I48	V14-K16 PolarHBondContact O-N 3.35Å; K16-E20 WeakPolarHBondContact CA-OE2 3.49Å; K16-E20 WeakPolarHBondContact CB-OE2 3.49Å; K16-E20 WeakPolarHBondContact CG-OE2 3.44Å; K16-L44 HydrophobicContact CD-CD1 4.41Å; K16-I48 HydrophobicContact CB-CD1 4.39Å; K16-I48 HydrophobicContact CB-CG1 4.25Å; K16-I48 HydrophobicContact CD-CD1 3.91Å; K16-I48 HydrophobicContact CD-CG1 3.47Å; K16-I48 VanDerWaalsContact CD-CG1 3.47Å; K16-I48 HydrophobicContact CG-CG1 4.49Å
17	T	68	Low	67.4	Low	76 Å²	76	80.5 Å²	80.5	47%	0.466	46%	0.461	S	S	.	.			trans	-71	153	-165.5	61.9	0	0	0	0	109.3	M15 A19 E20 V21	M15-T17 PolarHBondContact O-N 3.46Å; T17-A19 PolarHBondContact O-N 3.26Å; T17-E20 PolarHBondContact N-OE2 2.88Å; T17-E20 PolarHBondContact O-N 2.99Å; T17-E20 PolarHBondContact OG1-N 2.73Å; T17-V21 PolarHBondContact O-N 3.1Å
18	N	80.7	Confident	70.1	Confident	123 Å²	123	75.1 Å²	75.1	66%	0.658	42%	0.423	S	S	*	.	H	α-helix	trans	-51.3	-24.1	169.3	-70.7	-8.3	0	0	0	112.1	T22	N18-T22 WeakPolarHBondContact O-CB 3.34Å; N18-T22 PolarHBondContact O-N 3.27Å; N18-T22 VanDerWaalsContact O-N 3.08Å; N18-T22 PolarHBondContact O-OG1 2.62Å
19	A	87.8	Confident	72.6	Confident	69 Å²	69	75.5 Å²	75.5	57%	0.57	43%	0.428	S	S	*	.	H	α-helix	trans	-69.5	-40.7	174.7	0	0	0	0	0	113.1	T17 T22 N23	T17-A19 PolarHBondContact O-N 3.26Å; A19-T22 PolarHBondContact O-N 3.03Å; A19-N23 WeakPolarHBondContact O-CB 2.98Å; A19-N23 PolarHBondContact O-N 3.36Å
20	E	87.8	Confident	75.5	Confident	72 Å²	72	74 Å²	74	34%	0.336	41%	0.413	S	S	.	.	H	α-helix	trans	-67.5	-42.6	177.4	-72.8	171.3	127.1	0	0	111.8	K16 T17 T22 N23 A24	K16-E20 WeakPolarHBondContact CA-OE2 3.49Å; K16-E20 WeakPolarHBondContact CB-OE2 3.49Å; K16-E20 WeakPolarHBondContact CG-OE2 3.44Å; T17-E20 PolarHBondContact N-OE2 2.88Å; T17-E20 PolarHBondContact O-N 2.99Å; T17-E20 PolarHBondContact OG1-N 2.73Å; E20-T22 VanDerWaalsContact C-N 3.3Å; E20-T22 PolarHBondContact O-N 3.08Å; E20-N23 PolarHBondContact O-N 2.88Å; E20-A24 WeakPolarHBondContact O-CB 3.32Å; E20-A24 PolarHBondContact O-N 2.84Å
21	V	93.8	Very high	78.5	Confident	10 Å²	10	74.7 Å²	74.7	6%	0.061	40%	0.398	C	S	.	.	H	α-helix	trans	-60.4	-43.9	174.1	174.9	0	0	0	0	110.5	T17 G25 L45 I48 D52	T17-V21 PolarHBondContact O-N 3.1Å; V21-G25 PolarHBondContact O-N 3.26Å; V21-L45 HydrophobicContact CG1-CD2 4.03Å; V21-I48 HydrophobicContact CG2-CB 4.47Å; V21-I48 HydrophobicContact CG2-CD1 3.83Å; V21-I48 HydrophobicContact CG2-CG2 3.67Å; V21-D52 HydrophobicContact CG1-CB 3.9Å
22	T	95.8	Very high	81.4	Confident	66 Å²	66	71.9 Å²	71.9	41%	0.405	40%	0.398	S	S	.	.	H	α-helix	trans	-64.1	-46	177.8	-60.7	0	0	0	0	111.5	N18 A19 E20 G25 V26 W56	N18-T22 WeakPolarHBondContact O-CB 3.34Å; N18-T22 PolarHBondContact O-N 3.27Å; N18-T22 VanDerWaalsContact O-N 3.08Å; N18-T22 PolarHBondContact O-OG1 2.62Å; A19-T22 PolarHBondContact O-N 3.03Å; E20-T22 VanDerWaalsContact C-N 3.3Å; E20-T22 PolarHBondContact O-N 3.08Å; T22-G25 PolarHBondContact O-N 3.34Å; T22-V26 HydrophobicContact CG2-CG2 4.48Å; T22-V26 WeakPolarHBondContact O-CG2 3.44Å; T22-V26 PolarHBondContact O-N 3.22Å; T22-W56 HydrophobicContact CG2-CZ2 4.26Å
23	N	95.6	Very high	84.2	Confident	43 Å²	43	66.9 Å²	66.9	23%	0.23	38%	0.376	C	S	.	.	H	α-helix	trans	-62	-45.9	179.3	-173.5	26.4	0	0	0	111.7	A19 E20 G25 V26 Q27 V314 H315	A19-N23 WeakPolarHBondContact O-CB 2.98Å; A19-N23 PolarHBondContact O-N 3.36Å; E20-N23 PolarHBondContact O-N 2.88Å; N23-G25 VanDerWaalsContact C-N 3.33Å; N23-G25 PolarHBondContact O-N 2.91Å; N23-V26 PolarHBondContact O-N 3.14Å; N23-Q27 PolarHBondContact ND2-NE2 2.91Å; N23-Q27 PolarHBondContact O-N 3.08Å; N23-Q27 PolarHBondContact OD1-NE2 3.46Å; N23-V314 HydrophobicContact CB-CG2 4.49Å; N23-V314 WeakPolarHBondContact ND2-CG2 3.34Å; N23-H315 PolarHBondContact ND2-O 2.65Å
24	A	95.7	Very high	87	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-63.2	-40.6	175.5	0	0	0	0	0	112.1	E20 V26 Q27 L28 A41 L44 L45 V314	E20-A24 WeakPolarHBondContact O-CB 3.32Å; E20-A24 PolarHBondContact O-N 2.84Å; A24-V26 PolarHBondContact O-N 3.01Å; A24-Q27 PolarHBondContact O-N 3.32Å; A24-L28 WeakPolarHBondContact O-CB 3.45Å; A24-L28 PolarHBondContact O-N 2.81Å; A24-A41 HydrophobicContact CB-CB 4.49Å; A24-A41 WeakPolarHBondContact O-CB 3.3Å; A24-L44 HydrophobicContact CB-CD2 3.97Å; A24-L44 HydrophobicContact CB-CG 4.3Å; A24-L45 HydrophobicContact CB-CD1 4.43Å; A24-L45 HydrophobicContact CB-CD2 3.85Å; A24-L45 HydrophobicContact CB-CG 3.83Å; A24-V314 HydrophobicContact CB-CG1 3.9Å
25	G	97.9	Very high	89.4	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-59.6	-43.9	173.4	0	0	0	0	0	113.5	V21 T22 N23 L28 L29	V21-G25 PolarHBondContact O-N 3.26Å; T22-G25 PolarHBondContact O-N 3.34Å; N23-G25 VanDerWaalsContact C-N 3.33Å; N23-G25 PolarHBondContact O-N 2.91Å; G25-L28 PolarHBondContact O-N 2.61Å; G25-L29 WeakPolarHBondContact O-CG 3.38Å; G25-L29 PolarHBondContact O-N 3.43Å
26	V	98.1	Very high	91.7	Very high	77 Å²	77	55.7 Å²	55.7	47%	0.467	31%	0.307	S	S	.	.	H	α-helix	trans	-62.2	-47.1	176.2	169.5	0	0	0	0	110.8	T22 N23 A24 L29 D30 W56	T22-V26 HydrophobicContact CG2-CG2 4.48Å; T22-V26 WeakPolarHBondContact O-CG2 3.44Å; T22-V26 PolarHBondContact O-N 3.22Å; N23-V26 PolarHBondContact O-N 3.14Å; A24-V26 PolarHBondContact O-N 3.01Å; V26-L29 PolarHBondContact O-N 2.82Å; V26-D30 WeakPolarHBondContact O-CB 3.38Å; V26-D30 PolarHBondContact O-N 2.99Å; V26-W56 HydrophobicContact CG2-CH2 4.23Å
27	Q	97.9	Very high	93.4	Very high	16 Å²	16	53.8 Å²	53.8	8%	0.075	30%	0.3	C	S	.	.	H	α-helix	trans	-66.5	-38.1	179.8	-70.4	-178.2	41.8	0	0	112.6	N23 A24 L29 D30 L33 A41 H315	N23-Q27 PolarHBondContact ND2-NE2 2.91Å; N23-Q27 PolarHBondContact O-N 3.08Å; N23-Q27 PolarHBondContact OD1-NE2 3.46Å; A24-Q27 PolarHBondContact O-N 3.32Å; Q27-L29 VanDerWaalsContact C-N 3.26Å; Q27-L29 PolarHBondContact O-N 3.27Å; Q27-D30 PolarHBondContact O-N 2.9Å; Q27-L33 HydrophobicContact CB-CD1 3.84Å; Q27-L33 HydrophobicContact CG-CD1 3.87Å; Q27-A41 HydrophobicContact CB-CB 3.99Å; Q27-H315 PolarHBondContact NE2-O 3.42Å
28	L	98.3	Very high	94.8	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-58.1	-39.8	175.2	177.6	58.5	0	0	0	112	A24 G25 R38 A41 L42 L45 I57 A60 L68 L72	A24-L28 WeakPolarHBondContact O-CB 3.45Å; A24-L28 PolarHBondContact O-N 2.81Å; G25-L28 PolarHBondContact O-N 2.61Å; L28-R38 WeakPolarHBondContact CD1-O 3.41Å; L28-R38 PolarHBondContact O-NE 2.5Å; L28-R38 PolarHBondContact O-NH2 3.02Å; L28-A41 HydrophobicContact CB-CB 4.23Å; L28-L42 HydrophobicContact CD1-CB 3.94Å; L28-L42 HydrophobicContact CD2-CD1 4.41Å; L28-L45 HydrophobicContact CB-CD1 4.29Å; L28-L45 HydrophobicContact CD2-CD1 3.64Å; L28-I57 HydrophobicContact CD2-CG1 4.34Å; L28-A60 HydrophobicContact CD1-CB 4.41Å; L28-A60 HydrophobicContact CD2-CB 3.89Å; L28-A60 HydrophobicContact CG-CB 3.89Å; L28-L68 HydrophobicContact CD1-CD1 4.19Å; L28-L72 HydrophobicContact CD1-CD2 4.23Å; L28-L72 HydrophobicContact CD2-CD2 4.08Å
29	L	98.4	Very high	95.4	Very high	62 Å²	62	44.9 Å²	44.9	33%	0.325	25%	0.248	S	C	.	.	H	α-helix	trans	-85.8	-10.8	-179.8	-60.4	-171.4	0	0	0	114.1	G25 V26 Q27 R31 W56 K59 A60	G25-L29 WeakPolarHBondContact O-CG 3.38Å; G25-L29 PolarHBondContact O-N 3.43Å; V26-L29 PolarHBondContact O-N 2.82Å; Q27-L29 VanDerWaalsContact C-N 3.26Å; Q27-L29 PolarHBondContact O-N 3.27Å; L29-R31 PolarHBondContact O-N 3.32Å; L29-R31 VanDerWaalsContact O-N 3.08Å; L29-W56 HydrophobicContact CD1-CE3 3.8Å; L29-W56 HydrophobicContact CD1-CZ3 3.63Å; L29-W56 HydrophobicContact CG-CE3 4.31Å; L29-W56 HydrophobicContact CG-CZ3 4.39Å; L29-K59 HydrophobicContact CD1-CB 4Å; L29-K59 HydrophobicContact CD1-CD 4.32Å; L29-K59 HydrophobicContact CD2-CB 4.15Å; L29-A60 HydrophobicContact CD2-CB 3.58Å
30	D	98.1	Very high	95.6	Very high	59 Å²	59	42.5 Å²	42.5	32%	0.316	23%	0.225	S	C	.	.			trans	-79.1	94.9	-178.8	-170.8	-8.3	0	0	0	111.1	V26 Q27 S32 L33 R38	V26-D30 WeakPolarHBondContact O-CB 3.38Å; V26-D30 PolarHBondContact O-N 2.99Å; Q27-D30 PolarHBondContact O-N 2.9Å; D30-S32 VanDerWaalsContact CG-OG 3.3Å; D30-S32 PolarHBondContact O-N 3.22Å; D30-S32 VanDerWaalsContact O-N 3.14Å; D30-S32 VanDerWaalsContact OD1-CB 3.27Å; D30-S32 WeakPolarHBondContact OD1-CB 3.47Å; D30-S32 PolarHBondContact OD1-N 3.03Å; D30-S32 PolarHBondContact OD1-OG 3.43Å; D30-S32 PolarHBondContact OD2-OG 3.35Å; D30-L33 HydrophobicContact CB-CD1 3.93Å; D30-L33 HydrophobicContact CB-CG 3.99Å; D30-L33 WeakPolarHBondContact O-CB 3.48Å; D30-L33 PolarHBondContact O-N 3.43Å; D30-L33 VanDerWaalsContact O-N 3.1Å; D30-R38 WeakPolarHBondContact O-CD 3.4Å
31	R	97.1	Very high	95.9	Very high	136 Å²	136	39.1 Å²	39.1	51%	0.513	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-6.2	177.6	-61.9	-173.8	-178.5	159.1	14.6	114	L29 L33 D62 D63	L29-R31 PolarHBondContact O-N 3.32Å; L29-R31 VanDerWaalsContact O-N 3.08Å; R31-L33 VanDerWaalsContact C-N 3.35Å; R31-D62 PolarHBondContact NH2-O 2.91Å; R31-D62 IonicContact NH2-OD2 2.99Å; R31-D62 PolarHBondContact NH2-OD2 2.98Å; R31-D63 IonicContact CZ-OD2 3.78Å; R31-D63 IonicContact NE-OD2 3.08Å; R31-D63 PolarHBondContact NE-OD2 3.44Å
32	S	96.7	Very high	96	Very high	100 Å²	100	38.6 Å²	38.6	70%	0.699	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-16.3	172.2	77.4	0	0	0	0	112.9	D30	D30-S32 VanDerWaalsContact CG-OG 3.3Å; D30-S32 PolarHBondContact O-N 3.22Å; D30-S32 VanDerWaalsContact O-N 3.14Å; D30-S32 VanDerWaalsContact OD1-CB 3.27Å; D30-S32 WeakPolarHBondContact OD1-CB 3.47Å; D30-S32 PolarHBondContact OD1-N 3.03Å; D30-S32 PolarHBondContact OD1-OG 3.43Å; D30-S32 PolarHBondContact OD2-OG 3.35Å
33	L	96.8	Very high	95.8	Very high	48 Å²	48	35.5 Å²	35.5	25%	0.251	19%	0.186	S	C	.	.	S	Bend	trans	-79.9	148.3	175.4	-63.6	178.7	0	0	0	111.6	Q27 D30 R31 D37 R38	Q27-L33 HydrophobicContact CB-CD1 3.84Å; Q27-L33 HydrophobicContact CG-CD1 3.87Å; D30-L33 HydrophobicContact CB-CD1 3.93Å; D30-L33 HydrophobicContact CB-CG 3.99Å; D30-L33 WeakPolarHBondContact O-CB 3.48Å; D30-L33 PolarHBondContact O-N 3.43Å; D30-L33 VanDerWaalsContact O-N 3.1Å; R31-L33 VanDerWaalsContact C-N 3.35Å; L33-D37 HydrophobicContact CB-CB 4.4Å; L33-R38 HydrophobicContact CB-CG 4.12Å
34	P	95.4	Very high	95.6	Very high	61 Å²	61	33.9 Å²	33.9	40%	0.396	18%	0.178	S	C	.	.			trans	-50.7	146.2	167.2	-25.3	33.6	0	0	0	112.2	K36 D37 R38	P34-K36 HydrophobicContact CB-CG 3.85Å; P34-K36 PolarHBondContact O-N 3.14Å; P34-D37 WeakPolarHBondContact CD-OD2 3.32Å; P34-D37 PolarHBondContact O-N 3.5Å; P34-R38 PolarHBondContact O-N 3.36Å
35	L	95.6	Very high	95.6	Very high	18 Å²	18	33.9 Å²	33.9	9%	0.094	18%	0.178	C	C	.	.	H	α-helix	trans	-57.1	-41.6	-176.1	-171.4	62.5	0	0	0	111.3	D37 R38 F39 L68 E292 I296	L35-D37 VanDerWaalsContact C-N 3.33Å; L35-D37 PolarHBondContact O-N 3.49Å; L35-R38 WeakPolarHBondContact O-CB 3.45Å; L35-R38 PolarHBondContact O-N 3.29Å; L35-R38 VanDerWaalsContact O-N 3.11Å; L35-F39 HydrophobicContact CD1-CD2 4.13Å; L35-F39 HydrophobicContact CD1-CE2 3.82Å; L35-F39 HydrophobicContact CD2-CE2 4.08Å; L35-F39 HydrophobicContact CG-CD2 3.87Å; L35-F39 HydrophobicContact CG-CE2 3.69Å; L35-F39 WeakPolarHBondContact O-CD2 3.26Å; L35-F39 PolarHBondContact O-N 3.06Å; L35-L68 HydrophobicContact CD1-CB 4.34Å; L35-L68 HydrophobicContact CD1-CD2 4.41Å; L35-E292 HydrophobicContact CD2-CB 3.74Å; L35-E292 HydrophobicContact CD2-CG 3.79Å; L35-I296 HydrophobicContact CB-CD1 4.28Å; L35-I296 HydrophobicContact CD2-CD1 4.26Å; L35-I296 HydrophobicContact CD2-CG1 4.42Å; L35-I296 HydrophobicContact CG-CD1 4.03Å
36	K	92.7	Very high	95.3	Very high	69 Å²	69	35.4 Å²	35.4	30%	0.3	18%	0.184	S	C	.	.	H	α-helix	trans	-54.3	-40.2	175.9	56.2	161	-175	178.9	0	115.2	P34 R38 F39 R40 I296 D299	P34-K36 HydrophobicContact CB-CG 3.85Å; P34-K36 PolarHBondContact O-N 3.14Å; K36-R38 VanDerWaalsContact C-N 3.29Å; K36-R38 PolarHBondContact O-N 2.99Å; K36-F39 WeakPolarHBondContact O-CB 3.48Å; K36-F39 PolarHBondContact O-N 2.94Å; K36-R40 WeakPolarHBondContact O-CG 3.27Å; K36-R40 PolarHBondContact O-N 3.23Å; K36-I296 VanDerWaalsContact CA-CD1 3.49Å; K36-I296 HydrophobicContact CB-CD1 3.94Å; K36-D299 HydrophobicContact CB-CB 4Å; K36-D299 HydrophobicContact CD-CB 3.93Å; K36-D299 VanDerWaalsContact CD-CG 3.4Å; K36-D299 WeakPolarHBondContact CD-OD1 3.39Å; K36-D299 IonicContact NZ-OD1 3.62Å; K36-D299 PolarHBondContact NZ-OD1 2.84Å
37	D	92.8	Very high	94.9	Very high	25 Å²	25	34 Å²	34	13%	0.134	17%	0.174	C	C	.	.	H	α-helix	trans	-69.4	-35.7	-178.9	-62.4	-18.3	0	0	0	110	L33 P34 L35 R40 A41	L33-D37 HydrophobicContact CB-CB 4.4Å; P34-D37 WeakPolarHBondContact CD-OD2 3.32Å; P34-D37 PolarHBondContact O-N 3.5Å; L35-D37 VanDerWaalsContact C-N 3.33Å; L35-D37 PolarHBondContact O-N 3.49Å; D37-R40 PolarHBondContact O-N 2.9Å; D37-A41 PolarHBondContact O-N 3.44Å
38	R	97.1	Very high	94.5	Very high	12 Å²	12	35.2 Å²	35.2	5%	0.045	18%	0.18	C	C	.	.	H	α-helix	trans	-67.3	-38.1	174.6	-53.5	174	62.9	-158.6	-1.2	111.4	L28 D30 L33 P34 L35 K36 A41 L42 D63 L68	L28-R38 WeakPolarHBondContact CD1-O 3.41Å; L28-R38 PolarHBondContact O-NE 2.5Å; L28-R38 PolarHBondContact O-NH2 3.02Å; D30-R38 WeakPolarHBondContact O-CD 3.4Å; L33-R38 HydrophobicContact CB-CG 4.12Å; P34-R38 PolarHBondContact O-N 3.36Å; L35-R38 WeakPolarHBondContact O-CB 3.45Å; L35-R38 PolarHBondContact O-N 3.29Å; L35-R38 VanDerWaalsContact O-N 3.11Å; K36-R38 VanDerWaalsContact C-N 3.29Å; K36-R38 PolarHBondContact O-N 2.99Å; R38-A41 WeakPolarHBondContact O-CB 3.45Å; R38-A41 PolarHBondContact O-N 3.26Å; R38-L42 PolarHBondContact O-N 3.48Å; R38-D63 IonicContact CZ-OD2 3.54Å; R38-D63 IonicContact NH1-OD1 3.47Å; R38-D63 PolarHBondContact NH1-OD1 3.4Å; R38-D63 IonicContact NH1-OD2 3.28Å; R38-D63 PolarHBondContact NH1-OD2 2.92Å; R38-D63 VanDerWaalsContact NH1-OD2 3.14Å; R38-D63 VanDerWaalsContact NH2-CG 3.29Å; R38-D63 IonicContact NH2-OD1 2.82Å; R38-D63 IonicContact NH2-OD2 2.75Å; R38-D63 PolarHBondContact NH2-OD2 3.43Å; R38-L68 VanDerWaalsContact NH2-CD2 3.29Å
39	F	94.7	Very high	94.1	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-63.8	-41.5	172.1	-90.9	-108.6	0	0	0	112.3	L35 K36 A41 L42 F43 L67 L68 E71 I296	L35-F39 HydrophobicContact CD1-CD2 4.13Å; L35-F39 HydrophobicContact CD1-CE2 3.82Å; L35-F39 HydrophobicContact CD2-CE2 4.08Å; L35-F39 HydrophobicContact CG-CD2 3.87Å; L35-F39 HydrophobicContact CG-CE2 3.69Å; L35-F39 WeakPolarHBondContact O-CD2 3.26Å; L35-F39 PolarHBondContact O-N 3.06Å; K36-F39 WeakPolarHBondContact O-CB 3.48Å; K36-F39 PolarHBondContact O-N 2.94Å; F39-A41 VanDerWaalsContact C-N 3.3Å; F39-A41 PolarHBondContact O-N 2.97Å; F39-L42 WeakPolarHBondContact O-CB 3.4Å; F39-L42 PolarHBondContact O-N 3.43Å; F39-F43 HydrophobicContact CD1-CE1 4.37Å; F39-F43 HydrophobicContact CD1-CE2 4.5Å; F39-F43 AromaticContact CD1-CZ 3.87Å; F39-F43 HydrophobicContact CD1-CZ 3.87Å; F39-F43 WeakPolarHBondContact O-CG 2.99Å; F39-F43 PolarHBondContact O-N 3.32Å; F39-L67 HydrophobicContact CZ-CD2 4.07Å; F39-L67 HydrophobicContact CZ-CG 3.94Å; F39-L68 HydrophobicContact CD2-CD1 3.91Å; F39-L68 HydrophobicContact CE2-CB 4.05Å; F39-L68 HydrophobicContact CE2-CD1 3.63Å; F39-L68 HydrophobicContact CE2-CG 4.42Å; F39-L68 HydrophobicContact CZ-CB 4.42Å; F39-L68 HydrophobicContact CZ-CD1 4.14Å; F39-E71 HydrophobicContact CD1-CG 4.17Å; F39-E71 HydrophobicContact CE1-CB 3.75Å; F39-E71 HydrophobicContact CE1-CG 3.7Å; F39-E71 HydrophobicContact CZ-CB 4.13Å; F39-I296 HydrophobicContact CB-CD1 4.3Å; F39-I296 HydrophobicContact CD1-CD1 4.46Å; F39-I296 HydrophobicContact CD1-CG1 4.35Å; F39-I296 HydrophobicContact CD1-CG2 3.96Å; F39-I296 HydrophobicContact CD2-CD1 3.73Å; F39-I296 HydrophobicContact CD2-CG1 4.17Å; F39-I296 HydrophobicContact CE1-CG1 4.35Å; F39-I296 HydrophobicContact CE1-CG2 4.36Å; F39-I296 HydrophobicContact CE2-CD1 4.15Å; F39-I296 HydrophobicContact CE2-CG1 4.17Å; F39-I296 HydrophobicContact CG-CD1 3.91Å; F39-I296 HydrophobicContact CG-CG1 4.26Å; F39-I296 HydrophobicContact CG-CG2 4.32Å; F39-I296 HydrophobicContact CZ-CG1 4.28Å
40	R	91.7	Very high	93.8	Very high	19 Å²	19	36.1 Å²	36.1	7%	0.072	19%	0.193	C	C	.	.	H	α-helix	trans	-61.9	-40.6	175.4	-65.8	173.5	90.1	107.9	-3.5	111.4	K36 D37 F43 L44 D299 D308 Y311	K36-R40 WeakPolarHBondContact O-CG 3.27Å; K36-R40 PolarHBondContact O-N 3.23Å; D37-R40 PolarHBondContact O-N 2.9Å; R40-F43 PolarHBondContact O-N 3.19Å; R40-L44 PolarHBondContact O-N 3.16Å; R40-D299 IonicContact NH1-OD2 3.85Å; R40-D299 PolarHBondContact NH1-OD2 3.39Å; R40-D308 IonicContact NH2-OD2 3.61Å; R40-Y311 HydrophobicContact CG-CD1 4.01Å; R40-Y311 HydrophobicContact CG-CE1 3.56Å; R40-Y311 HydrophobicContact CG-CE2 4.25Å; R40-Y311 WeakPolarHBondContact CG-O 3.4Å; R40-Y311 PolarHBondContact NE-O 3.49Å; R40-Y311 VanDerWaalsContact NH1-CD2 3.26Å; R40-Y311 PolarHBondContact NH2-O 3.09Å
41	A	94.8	Very high	93.7	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-63.2	-44	173.4	0	0	0	0	0	112.5	A24 Q27 L28 D37 R38 F39 F43 L44 L45 V314	A24-A41 HydrophobicContact CB-CB 4.49Å; A24-A41 WeakPolarHBondContact O-CB 3.3Å; Q27-A41 HydrophobicContact CB-CB 3.99Å; L28-A41 HydrophobicContact CB-CB 4.23Å; D37-A41 PolarHBondContact O-N 3.44Å; R38-A41 WeakPolarHBondContact O-CB 3.45Å; R38-A41 PolarHBondContact O-N 3.26Å; F39-A41 VanDerWaalsContact C-N 3.3Å; F39-A41 PolarHBondContact O-N 2.97Å; A41-F43 PolarHBondContact O-N 3.03Å; A41-L44 PolarHBondContact O-N 3.32Å; A41-L45 WeakPolarHBondContact O-CG 3.39Å; A41-L45 PolarHBondContact O-N 2.72Å; A41-V314 HydrophobicContact CB-CG1 3.78Å
42	L	95.9	Very high	93.7	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-57	-49.1	173.6	173.4	55.9	0	0	0	111.9	L28 R38 F39 L44 L45 R46 I57 L68 E71 L72 C75	L28-L42 HydrophobicContact CD1-CB 3.94Å; L28-L42 HydrophobicContact CD2-CD1 4.41Å; R38-L42 PolarHBondContact O-N 3.48Å; F39-L42 WeakPolarHBondContact O-CB 3.4Å; F39-L42 PolarHBondContact O-N 3.43Å; L42-L44 VanDerWaalsContact C-N 3.28Å; L42-L44 PolarHBondContact O-N 3.05Å; L42-L45 WeakPolarHBondContact O-CB 3.43Å; L42-L45 PolarHBondContact O-N 3.24Å; L42-L45 VanDerWaalsContact O-N 3.14Å; L42-R46 PolarHBondContact O-N 3.34Å; L42-I57 HydrophobicContact CD1-CD1 3.97Å; L42-I57 HydrophobicContact CD1-CG1 3.75Å; L42-I57 HydrophobicContact CD1-CG2 4.07Å; L42-L68 HydrophobicContact CD2-CD1 4.07Å; L42-E71 HydrophobicContact CD2-CB 3.97Å; L42-E71 HydrophobicContact CD2-CG 3.72Å; L42-L72 HydrophobicContact CD1-CD2 3.67Å; L42-L72 HydrophobicContact CD2-CD2 3.89Å; L42-L72 HydrophobicContact CG-CD2 4.34Å; L42-C75 HydrophobicContact CD1-CB 4.02Å; L42-C75 HydrophobicContact CG-CB 4.45Å
43	F	91.7	Very high	93.7	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-66	-32.2	-179.7	-62.5	-19.9	0	0	0	112.5	F2 I6 F39 R40 A41 N47 E71 Y311 A312	F2-F43 HydrophobicContact CB-CE2 4.17Å; F2-F43 HydrophobicContact CB-CZ 4.21Å; I6-F43 HydrophobicContact CD1-CD2 4.27Å; I6-F43 HydrophobicContact CD1-CE2 4.49Å; F39-F43 HydrophobicContact CD1-CE1 4.37Å; F39-F43 HydrophobicContact CD1-CE2 4.5Å; F39-F43 AromaticContact CD1-CZ 3.87Å; F39-F43 HydrophobicContact CD1-CZ 3.87Å; F39-F43 WeakPolarHBondContact O-CG 2.99Å; F39-F43 PolarHBondContact O-N 3.32Å; R40-F43 PolarHBondContact O-N 3.19Å; A41-F43 PolarHBondContact O-N 3.03Å; F43-N47 WeakPolarHBondContact O-CB 3.38Å; F43-N47 PolarHBondContact O-N 3.08Å; F43-N47 PolarHBondContact O-ND2 3.45Å; F43-E71 HydrophobicContact CE1-CG 3.73Å; F43-E71 VanDerWaalsContact CE1-OE1 3.26Å; F43-E71 WeakPolarHBondContact CE1-OE1 3.19Å; F43-E71 HydrophobicContact CZ-CG 4.27Å; F43-Y311 AromaticContact CD2-CD1 3.74Å; F43-Y311 HydrophobicContact CD2-CD1 3.74Å; F43-Y311 AromaticContact CD2-CE1 3.45Å; F43-Y311 HydrophobicContact CD2-CE1 3.45Å; F43-Y311 VanDerWaalsContact CD2-CE1 3.45Å; F43-Y311 HydrophobicContact CE2-CD1 4.27Å; F43-Y311 AromaticContact CE2-CE1 3.62Å; F43-Y311 HydrophobicContact CE2-CE1 3.62Å; F43-A312 HydrophobicContact CB-CB 3.95Å
44	L	91	Very high	93.8	Very high	9 Å²	9	28.6 Å²	28.6	5%	0.047	15%	0.15	C	C	.	.	H	α-helix	trans	-64.4	-46.4	171.6	178.1	55.8	0	0	0	111.1	K16 A24 R40 A41 L42 N47 I48 A312 V314	K16-L44 HydrophobicContact CD-CD1 4.41Å; A24-L44 HydrophobicContact CB-CD2 3.97Å; A24-L44 HydrophobicContact CB-CG 4.3Å; R40-L44 PolarHBondContact O-N 3.16Å; A41-L44 PolarHBondContact O-N 3.32Å; L42-L44 VanDerWaalsContact C-N 3.28Å; L42-L44 PolarHBondContact O-N 3.05Å; L44-N47 PolarHBondContact O-N 3.2Å; L44-I48 HydrophobicContact CD1-CD1 3.82Å; L44-I48 HydrophobicContact CD1-CG1 4.11Å; L44-I48 HydrophobicContact CG-CD1 3.86Å; L44-I48 VanDerWaalsContact O-CG1 3.3Å; L44-I48 WeakPolarHBondContact O-CG1 3.33Å; L44-I48 PolarHBondContact O-N 2.59Å; L44-A312 HydrophobicContact CB-CB 4.2Å; L44-V314 HydrophobicContact CD2-CB 4.29Å; L44-V314 HydrophobicContact CD2-CG1 3.79Å; L44-V314 HydrophobicContact CD2-CG2 3.65Å
45	L	94.6	Very high	93.9	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-61.7	-43.2	176.7	-68.3	167.6	0	0	0	112.1	V21 A24 L28 A41 L42 N47 I48 N49 S53 W56 I57	V21-L45 HydrophobicContact CG1-CD2 4.03Å; A24-L45 HydrophobicContact CB-CD1 4.43Å; A24-L45 HydrophobicContact CB-CD2 3.85Å; A24-L45 HydrophobicContact CB-CG 3.83Å; L28-L45 HydrophobicContact CB-CD1 4.29Å; L28-L45 HydrophobicContact CD2-CD1 3.64Å; A41-L45 WeakPolarHBondContact O-CG 3.39Å; A41-L45 PolarHBondContact O-N 2.72Å; L42-L45 WeakPolarHBondContact O-CB 3.43Å; L42-L45 PolarHBondContact O-N 3.24Å; L42-L45 VanDerWaalsContact O-N 3.14Å; L45-N47 VanDerWaalsContact C-N 3.3Å; L45-N47 PolarHBondContact O-N 3.2Å; L45-I48 PolarHBondContact O-N 2.73Å; L45-N49 PolarHBondContact O-N 3.22Å; L45-S53 WeakPolarHBondContact O-CB 3.27Å; L45-S53 PolarHBondContact O-OG 3.24Å; L45-W56 HydrophobicContact CD1-CB 3.97Å; L45-W56 HydrophobicContact CD2-CB 4.33Å; L45-I57 HydrophobicContact CB-CD1 3.9Å; L45-I57 HydrophobicContact CB-CG1 3.97Å; L45-I57 HydrophobicContact CD1-CG1 4.09Å
46	R	92.9	Very high	94.1	Very high	32 Å²	32	29.1 Å²	29.1	12%	0.121	15%	0.146	C	C	.	.	H	α-helix	trans	-54.5	-48.2	173.2	178.9	-158.2	173	-105.4	7	111.2	L42 N49 C75 M79	L42-R46 PolarHBondContact O-N 3.34Å; R46-N49 PolarHBondContact O-N 2.94Å; R46-C75 HydrophobicContact CB-CB 4.1Å; R46-C75 HydrophobicContact CG-CB 4.09Å; R46-M79 HydrophobicContact CB-SD 4.48Å; R46-M79 HydrophobicContact CG-CG 3.94Å; R46-M79 HydrophobicContact CG-SD 4.44Å
47	N	88	Confident	94.4	Very high	49 Å²	49	25.9 Å²	25.9	26%	0.262	13%	0.132	S	C	.	.	H	α-helix	trans	-70.2	-34.1	-176.6	-70.2	-15.6	0	0	0	112.8	F8 F43 L44 L45	F8-N47 WeakPolarHBondContact CD1-ND2 3.37Å; F8-N47 WeakPolarHBondContact CE1-ND2 3.32Å; F8-N47 WeakPolarHBondContact CZ-ND2 3.27Å; F43-N47 WeakPolarHBondContact O-CB 3.38Å; F43-N47 PolarHBondContact O-N 3.08Å; F43-N47 PolarHBondContact O-ND2 3.45Å; L44-N47 PolarHBondContact O-N 3.2Å; L45-N47 VanDerWaalsContact C-N 3.3Å; L45-N47 PolarHBondContact O-N 3.2Å
48	I	90.3	Very high	94.7	Very high	41 Å²	41	26.7 Å²	26.7	21%	0.21	14%	0.138	C	C	.	.	H	α-helix	trans	-68.8	-41.9	173.4	-65.5	164.5	0	0	0	110.3	K16 V21 L44 L45	K16-I48 HydrophobicContact CB-CD1 4.39Å; K16-I48 HydrophobicContact CB-CG1 4.25Å; K16-I48 HydrophobicContact CD-CD1 3.91Å; K16-I48 HydrophobicContact CD-CG1 3.47Å; K16-I48 VanDerWaalsContact CD-CG1 3.47Å; K16-I48 HydrophobicContact CG-CG1 4.49Å; V21-I48 HydrophobicContact CG2-CB 4.47Å; V21-I48 HydrophobicContact CG2-CD1 3.83Å; V21-I48 HydrophobicContact CG2-CG2 3.67Å; L44-I48 HydrophobicContact CD1-CD1 3.82Å; L44-I48 HydrophobicContact CD1-CG1 4.11Å; L44-I48 HydrophobicContact CG-CD1 3.86Å; L44-I48 VanDerWaalsContact O-CG1 3.3Å; L44-I48 WeakPolarHBondContact O-CG1 3.33Å; L44-I48 PolarHBondContact O-N 2.59Å; L45-I48 PolarHBondContact O-N 2.73Å
49	N	90	Very high	94.7	Very high	49 Å²	49	31.6 Å²	31.6	26%	0.262	16%	0.16	S	C	.	.			trans	57.8	-165.2	-175	-154.4	-30.3	0	0	0	111.8	L45 R46 S53 M79 N81	L45-N49 PolarHBondContact O-N 3.22Å; R46-N49 PolarHBondContact O-N 2.94Å; N49-S53 VanDerWaalsContact O-CB 3.31Å; N49-S53 WeakPolarHBondContact O-CB 3.42Å; N49-S53 PolarHBondContact O-OG 2.85Å; N49-M79 HydrophobicContact CB-CE 4.13Å; N49-M79 PolarHBondContact ND2-O 3.38Å; N49-M79 VanDerWaalsContact ND2-O 3.16Å; N49-N81 PolarHBondContact OD1-ND2 3.35Å
50	G	92.8	Very high	94.9	Very high	32 Å²	32	31.8 Å²	31.8	33%	0.33	16%	0.161	S	C	.	.	H	α-helix	trans	82.3	171.1	-176.2	0	0	0	0	0	113.4	D52 S53 I54	G50-D52 PolarHBondContact O-N 3.31Å; G50-S53 PolarHBondContact O-N 3.23Å; G50-I54 WeakPolarHBondContact O-CG1 3.39Å; G50-I54 PolarHBondContact O-N 2.89Å; G50-I54 VanDerWaalsContact O-N 3.12Å
51	K	96	Very high	95.2	Very high	106 Å²	106	31.7 Å²	31.7	46%	0.461	16%	0.161	S	C	.	.	H	α-helix	trans	-58.1	-48.5	-170.6	-170.9	-169.2	168.2	-65.9	0	112.5	I54 D55 Y83	K51-I54 PolarHBondContact O-N 2.79Å; K51-D55 IonicContact NZ-OD2 3.43Å; K51-D55 PolarHBondContact NZ-OD2 3.09Å; K51-D55 PolarHBondContact O-N 3.08Å; K51-Y83 HydrophobicContact CB-CE1 4.38Å; K51-Y83 HydrophobicContact CD-CE2 4.18Å; K51-Y83 WeakPolarHBondContact CE-OH 3.34Å; K51-Y83 HydrophobicContact CG-CD1 3.97Å; K51-Y83 HydrophobicContact CG-CD2 4.28Å; K51-Y83 HydrophobicContact CG-CE1 3.47Å; K51-Y83 VanDerWaalsContact CG-CE1 3.47Å; K51-Y83 HydrophobicContact CG-CE2 3.81Å; K51-Y83 HydrophobicContact CG-CG 4.36Å; K51-Y83 PolarHBondContact NZ-OH 3.46Å
52	D	96.2	Very high	95.3	Very high	75 Å²	75	37.8 Å²	37.8	40%	0.401	19%	0.194	S	C	.	.	H	α-helix	trans	-68.1	-39.1	-174.4	-64.9	-15.8	0	0	0	111.7	V21 G50 I54 D55 W56	V21-D52 HydrophobicContact CG1-CB 3.9Å; G50-D52 PolarHBondContact O-N 3.31Å; D52-I54 VanDerWaalsContact C-N 3.33Å; D52-I54 PolarHBondContact O-N 2.79Å; D52-D55 PolarHBondContact O-N 3.45Å; D52-W56 PolarHBondContact O-N 2.9Å
53	S	96.6	Very high	95.4	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.007	20%	0.196	C	C	.	.	H	α-helix	trans	-62.5	-41.4	173.5	-67.6	0	0	0	0	111.9	L45 N49 G50 W56 I57	L45-S53 WeakPolarHBondContact O-CB 3.27Å; L45-S53 PolarHBondContact O-OG 3.24Å; N49-S53 VanDerWaalsContact O-CB 3.31Å; N49-S53 WeakPolarHBondContact O-CB 3.42Å; N49-S53 PolarHBondContact O-OG 2.85Å; G50-S53 PolarHBondContact O-N 3.23Å; S53-W56 PolarHBondContact O-N 3.03Å; S53-I57 VanDerWaalsContact O-CG1 3.27Å; S53-I57 WeakPolarHBondContact O-CG1 3.36Å; S53-I57 PolarHBondContact O-N 3.29Å
54	I	98.5	Very high	95.6	Very high	2 Å²	2	43 Å²	43	1%	0.01	23%	0.23	C	C	.	.	H	α-helix	trans	-63.4	-45.4	175.3	-67.1	164.7	0	0	0	110.6	G50 K51 D52 W56 I57 V58 L76 M79 N81 Y83 A84	G50-I54 WeakPolarHBondContact O-CG1 3.39Å; G50-I54 PolarHBondContact O-N 2.89Å; G50-I54 VanDerWaalsContact O-N 3.12Å; K51-I54 PolarHBondContact O-N 2.79Å; D52-I54 VanDerWaalsContact C-N 3.33Å; D52-I54 PolarHBondContact O-N 2.79Å; I54-W56 PolarHBondContact O-N 3.5Å; I54-I57 PolarHBondContact O-N 3.01Å; I54-V58 HydrophobicContact CG2-CG2 3.96Å; I54-V58 WeakPolarHBondContact O-CB 3.5Å; I54-V58 VanDerWaalsContact O-CG2 3.25Å; I54-V58 WeakPolarHBondContact O-CG2 3.37Å; I54-V58 PolarHBondContact O-N 3.05Å; I54-L76 HydrophobicContact CB-CD2 4.33Å; I54-L76 HydrophobicContact CG1-CD2 4.07Å; I54-L76 HydrophobicContact CG2-CD2 3.93Å; I54-M79 HydrophobicContact CD1-CE 4.32Å; I54-M79 HydrophobicContact CG1-CE 3.55Å; I54-M79 HydrophobicContact CG1-SD 4.49Å; I54-N81 HydrophobicContact CD1-CB 3.57Å; I54-N81 VanDerWaalsContact CD1-ND2 3.32Å; I54-N81 WeakPolarHBondContact CD1-ND2 3.39Å; I54-Y83 HydrophobicContact CB-CD1 3.86Å; I54-Y83 HydrophobicContact CB-CE1 4.17Å; I54-Y83 HydrophobicContact CD1-CD1 3.88Å; I54-Y83 HydrophobicContact CG1-CD1 4.49Å; I54-Y83 HydrophobicContact CG2-CD1 3.61Å; I54-Y83 HydrophobicContact CG2-CE1 3.91Å; I54-A84 HydrophobicContact CD1-CB 4.42Å; I54-A84 HydrophobicContact CG2-CB 3.89Å
55	D	98.6	Very high	96	Very high	44 Å²	44	42.8 Å²	42.8	24%	0.235	23%	0.229	C	C	.	.	H	α-helix	trans	-59.2	-36.3	178.4	-72.4	-24.3	0	0	0	111.8	K51 D52 K59 Y83	K51-D55 IonicContact NZ-OD2 3.43Å; K51-D55 PolarHBondContact NZ-OD2 3.09Å; K51-D55 PolarHBondContact O-N 3.08Å; D52-D55 PolarHBondContact O-N 3.45Å; D55-K59 VanDerWaalsContact O-CG 3.26Å; D55-K59 WeakPolarHBondContact O-CG 3.34Å; D55-K59 PolarHBondContact O-N 3.27Å; D55-Y83 WeakPolarHBondContact OD1-CE1 3.25Å; D55-Y83 PolarHBondContact OD1-OH 3.2Å; D55-Y83 PolarHBondContact OD2-OH 3.32Å
56	W	98.6	Very high	96.2	Very high	47 Å²	47	45.8 Å²	45.8	18%	0.178	25%	0.245	C	C	.	.	H	α-helix	trans	-69.3	-45.1	174	-78.3	116.4	0	0	0	113.2	T22 V26 L29 L45 D52 S53 I54 V58 K59	T22-W56 HydrophobicContact CG2-CZ2 4.26Å; V26-W56 HydrophobicContact CG2-CH2 4.23Å; L29-W56 HydrophobicContact CD1-CE3 3.8Å; L29-W56 HydrophobicContact CD1-CZ3 3.63Å; L29-W56 HydrophobicContact CG-CE3 4.31Å; L29-W56 HydrophobicContact CG-CZ3 4.39Å; L45-W56 HydrophobicContact CD1-CB 3.97Å; L45-W56 HydrophobicContact CD2-CB 4.33Å; D52-W56 PolarHBondContact O-N 2.9Å; S53-W56 PolarHBondContact O-N 3.03Å; I54-W56 PolarHBondContact O-N 3.5Å; W56-V58 VanDerWaalsContact C-N 3.32Å; W56-V58 PolarHBondContact O-N 3.36Å; W56-K59 HydrophobicContact CE3-CD 4.13Å; W56-K59 HydrophobicContact CZ3-CD 4.43Å; W56-K59 PolarHBondContact O-N 2.92Å
57	I	98.8	Very high	96.4	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.5	-43.6	177	-65.8	169	0	0	0	110.1	L28 L42 L45 S53 I54 K59 A60 L72 L76 M79	L28-I57 HydrophobicContact CD2-CG1 4.34Å; L42-I57 HydrophobicContact CD1-CD1 3.97Å; L42-I57 HydrophobicContact CD1-CG1 3.75Å; L42-I57 HydrophobicContact CD1-CG2 4.07Å; L45-I57 HydrophobicContact CB-CD1 3.9Å; L45-I57 HydrophobicContact CB-CG1 3.97Å; L45-I57 HydrophobicContact CD1-CG1 4.09Å; S53-I57 VanDerWaalsContact O-CG1 3.27Å; S53-I57 WeakPolarHBondContact O-CG1 3.36Å; S53-I57 PolarHBondContact O-N 3.29Å; I54-I57 PolarHBondContact O-N 3.01Å; I57-K59 VanDerWaalsContact C-N 3.34Å; I57-K59 PolarHBondContact O-N 3.33Å; I57-A60 WeakPolarHBondContact O-CB 3.33Å; I57-A60 PolarHBondContact O-N 3.21Å; I57-L72 HydrophobicContact CG2-CB 3.96Å; I57-L72 HydrophobicContact CG2-CD2 3.83Å; I57-L72 HydrophobicContact CG2-CG 4.42Å; I57-L76 HydrophobicContact CB-CD2 4.07Å; I57-L76 HydrophobicContact CD1-CD2 4.22Å; I57-L76 HydrophobicContact CG2-CD1 3.99Å; I57-L76 HydrophobicContact CG2-CD2 3.75Å; I57-L76 HydrophobicContact CG2-CG 3.69Å; I57-M79 HydrophobicContact CD1-CE 4Å; I57-M79 HydrophobicContact CD1-SD 3.79Å
58	V	98.9	Very high	96.9	Very high	43 Å²	43	41.9 Å²	41.9	26%	0.261	23%	0.227	S	C	.	.	H	α-helix	trans	-62.9	-38.8	-180	169.7	0	0	0	0	112	I54 W56 A60 F61 L76 A87	I54-V58 HydrophobicContact CG2-CG2 3.96Å; I54-V58 WeakPolarHBondContact O-CB 3.5Å; I54-V58 VanDerWaalsContact O-CG2 3.25Å; I54-V58 WeakPolarHBondContact O-CG2 3.37Å; I54-V58 PolarHBondContact O-N 3.05Å; W56-V58 VanDerWaalsContact C-N 3.32Å; W56-V58 PolarHBondContact O-N 3.36Å; V58-A60 PolarHBondContact O-N 3.22Å; V58-F61 WeakPolarHBondContact O-CD2 3.48Å; V58-F61 PolarHBondContact O-N 3.11Å; V58-L76 HydrophobicContact CG2-CD1 4.16Å; V58-A87 HydrophobicContact CB-CB 4.3Å; V58-A87 HydrophobicContact CG1-CB 3.73Å; V58-A87 HydrophobicContact CG2-CB 3.49Å; V58-A87 VanDerWaalsContact CG2-CB 3.49Å
59	K	98.6	Very high	97.3	Very high	115 Å²	115	40.8 Å²	40.8	50%	0.5	22%	0.22	S	C	.	.	H	α-helix	trans	-61.1	-24.8	175.3	-74.6	167.9	-172.5	171.9	0	113.2	L29 D55 W56 I57 F61	L29-K59 HydrophobicContact CD1-CB 4Å; L29-K59 HydrophobicContact CD1-CD 4.32Å; L29-K59 HydrophobicContact CD2-CB 4.15Å; D55-K59 VanDerWaalsContact O-CG 3.26Å; D55-K59 WeakPolarHBondContact O-CG 3.34Å; D55-K59 PolarHBondContact O-N 3.27Å; W56-K59 HydrophobicContact CE3-CD 4.13Å; W56-K59 HydrophobicContact CZ3-CD 4.43Å; W56-K59 PolarHBondContact O-N 2.92Å; I57-K59 VanDerWaalsContact C-N 3.34Å; I57-K59 PolarHBondContact O-N 3.33Å; K59-F61 VanDerWaalsContact C-N 3.28Å; K59-F61 PolarHBondContact O-N 3.34Å
60	A	98.6	Very high	97.7	Very high	3 Å²	3	38.7 Å²	38.7	3%	0.025	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-79.2	-7	-177	0	0	0	0	0	113.6	L28 L29 I57 V58 D62 D63 L72	L28-A60 HydrophobicContact CD1-CB 4.41Å; L28-A60 HydrophobicContact CD2-CB 3.89Å; L28-A60 HydrophobicContact CG-CB 3.89Å; L29-A60 HydrophobicContact CD2-CB 3.58Å; I57-A60 WeakPolarHBondContact O-CB 3.33Å; I57-A60 PolarHBondContact O-N 3.21Å; V58-A60 PolarHBondContact O-N 3.22Å; A60-D62 PolarHBondContact O-N 3.21Å; A60-D62 VanDerWaalsContact O-N 3.13Å; A60-D63 VanDerWaalsContact O-CB 3.3Å; A60-D63 WeakPolarHBondContact O-CB 3.31Å; A60-D63 PolarHBondContact O-N 2.97Å; A60-L72 HydrophobicContact CB-CD1 3.51Å; A60-L72 HydrophobicContact CB-CD2 3.78Å; A60-L72 HydrophobicContact CB-CG 4.31Å; A60-L72 WeakPolarHBondContact O-CD1 3.42Å
61	F	98.7	Very high	97.9	Very high	17 Å²	17	37.1 Å²	37.1	8%	0.075	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-66	-11.1	176.8	-80.7	-69.4	0	0	0	114.6	V58 K59 D63 K69 L72 A73 L76 V91 V101	V58-F61 WeakPolarHBondContact O-CD2 3.48Å; V58-F61 PolarHBondContact O-N 3.11Å; K59-F61 VanDerWaalsContact C-N 3.28Å; K59-F61 PolarHBondContact O-N 3.34Å; F61-D63 PolarHBondContact O-N 3.33Å; F61-K69 HydrophobicContact CD1-CB 4.28Å; F61-K69 HydrophobicContact CD1-CG 4.36Å; F61-K69 WeakPolarHBondContact CE1-O 3.41Å; F61-K69 VanDerWaalsContact O-CD 3.26Å; F61-K69 WeakPolarHBondContact O-CD 3.42Å; F61-L72 HydrophobicContact CD1-CB 4.45Å; F61-L72 HydrophobicContact CD1-CD1 3.99Å; F61-L72 HydrophobicContact CD2-CD1 4.41Å; F61-L72 HydrophobicContact CE1-CB 3.84Å; F61-L72 HydrophobicContact CE1-CD1 4.23Å; F61-L72 HydrophobicContact CE2-CB 4.26Å; F61-L72 HydrophobicContact CG-CD1 4.07Å; F61-L72 HydrophobicContact CZ-CB 3.73Å; F61-A73 HydrophobicContact CE1-CB 4.19Å; F61-A73 HydrophobicContact CZ-CB 4.06Å; F61-L76 HydrophobicContact CE2-CD1 3.72Å; F61-L76 HydrophobicContact CZ-CD1 4.04Å; F61-V91 HydrophobicContact CB-CG2 4.47Å; F61-V91 HydrophobicContact CD1-CG1 4.3Å; F61-V91 HydrophobicContact CD1-CG2 3.77Å; F61-V91 HydrophobicContact CD2-CG2 3.91Å; F61-V91 HydrophobicContact CE1-CG1 4.09Å; F61-V91 HydrophobicContact CE1-CG2 3.88Å; F61-V91 HydrophobicContact CE2-CG2 4.03Å; F61-V91 HydrophobicContact CG-CG2 3.8Å; F61-V91 HydrophobicContact CZ-CG2 4.02Å; F61-V101 HydrophobicContact CE1-CG1 4.39Å
62	D	96.1	Very high	98.1	Very high	128 Å²	128	32.1 Å²	32.1	68%	0.684	17%	0.171	S	C	*	.	G	3₁₀ helix	trans	-76.8	-0.3	170.6	-174.1	66.9	0	0	0	113	R31 A60	R31-D62 PolarHBondContact NH2-O 2.91Å; R31-D62 IonicContact NH2-OD2 2.99Å; R31-D62 PolarHBondContact NH2-OD2 2.98Å; A60-D62 PolarHBondContact O-N 3.21Å; A60-D62 VanDerWaalsContact O-N 3.13Å
63	D	98.2	Very high	98.2	Very high	8 Å²	8	28.5 Å²	28.5	4%	0.043	15%	0.152	C	C	.	.			trans	-68.7	153.3	-178	-152.6	-100.6	0	0	0	114.4	R31 R38 A60 F61 S65 L68 K69	R31-D63 IonicContact CZ-OD2 3.78Å; R31-D63 IonicContact NE-OD2 3.08Å; R31-D63 PolarHBondContact NE-OD2 3.44Å; R38-D63 IonicContact CZ-OD2 3.54Å; R38-D63 IonicContact NH1-OD1 3.47Å; R38-D63 PolarHBondContact NH1-OD1 3.4Å; R38-D63 IonicContact NH1-OD2 3.28Å; R38-D63 PolarHBondContact NH1-OD2 2.92Å; R38-D63 VanDerWaalsContact NH1-OD2 3.14Å; R38-D63 VanDerWaalsContact NH2-CG 3.29Å; R38-D63 IonicContact NH2-OD1 2.82Å; R38-D63 IonicContact NH2-OD2 2.75Å; R38-D63 PolarHBondContact NH2-OD2 3.43Å; A60-D63 VanDerWaalsContact O-CB 3.3Å; A60-D63 WeakPolarHBondContact O-CB 3.31Å; A60-D63 PolarHBondContact O-N 2.97Å; F61-D63 PolarHBondContact O-N 3.33Å; D63-S65 PolarHBondContact OD1-N 2.87Å; D63-L68 HydrophobicContact CB-CD2 4.19Å; D63-K69 HydrophobicContact CB-CG 4.49Å; D63-K69 VanDerWaalsContact O-CD 3.3Å; D63-K69 WeakPolarHBondContact O-CD 3.19Å; D63-K69 VanDerWaalsContact O-CE 3.29Å; D63-K69 WeakPolarHBondContact O-CE 3.48Å
64	S	96.5	Very high	98.2	Very high	102 Å²	102	28.9 Å²	28.9	71%	0.713	15%	0.153	S	C	*	.	S	Bend	trans	-78.8	-23.1	177.5	52	0	0	0	0	113.6	D66	S64-D66 PolarHBondContact O-N 3.23Å
65	S	98.2	Very high	98.1	Very high	5 Å²	5	28.8 Å²	28.8	4%	0.035	15%	0.153	C	C	.	.			trans	-77.9	113.8	178	167.7	0	0	0	0	110.3	D63 L67 L68 K69 E292	D63-S65 PolarHBondContact OD1-N 2.87Å; S65-L67 PolarHBondContact O-N 3.33Å; S65-L67 PolarHBondContact OG-N 3Å; S65-L68 PolarHBondContact O-N 3.18Å; S65-L68 PolarHBondContact OG-N 2.68Å; S65-K69 WeakPolarHBondContact O-CG 3.25Å; S65-K69 PolarHBondContact O-N 3.02Å; S65-K69 VanDerWaalsContact O-N 3.08Å; S65-E292 PolarHBondContact OG-OE2 3.12Å
66	D	98.4	Very high	98.1	Very high	62 Å²	62	26.7 Å²	26.7	33%	0.332	14%	0.142	S	C	.	.	H	α-helix	trans	-65.7	-29.9	172.7	-72.9	-39.3	0	0	0	111.8	S64 K69 H70 A98 I100 V101	S64-D66 PolarHBondContact O-N 3.23Å; D66-K69 WeakPolarHBondContact OD1-CE 3.31Å; D66-K69 IonicContact OD1-NZ 3.5Å; D66-K69 PolarHBondContact OD1-NZ 3.49Å; D66-H70 VanDerWaalsContact O-CB 3.27Å; D66-H70 WeakPolarHBondContact O-CB 3.44Å; D66-H70 PolarHBondContact O-N 3.3Å; D66-A98 HydrophobicContact CB-CB 4.31Å; D66-A98 WeakPolarHBondContact OD1-CB 3.29Å; D66-I100 HydrophobicContact CB-CG2 4.15Å; D66-V101 HydrophobicContact CB-CG2 4.3Å
67	L	98	Very high	98.1	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-64	-48	173.2	-176.8	65.7	0	0	0	111.2	F39 S65 K69 H70 E71 L289 E292 S293 I296	F39-L67 HydrophobicContact CZ-CD2 4.07Å; F39-L67 HydrophobicContact CZ-CG 3.94Å; S65-L67 PolarHBondContact O-N 3.33Å; S65-L67 PolarHBondContact OG-N 3Å; L67-K69 PolarHBondContact O-N 3.4Å; L67-H70 WeakPolarHBondContact O-CB 3.37Å; L67-H70 PolarHBondContact O-N 3.06Å; L67-E71 PolarHBondContact O-N 2.65Å; L67-L289 HydrophobicContact CB-CD1 3.88Å; L67-L289 HydrophobicContact CD1-CD1 3.71Å; L67-L289 HydrophobicContact CG-CD1 4.37Å; L67-E292 HydrophobicContact CB-CB 4.37Å; L67-E292 WeakPolarHBondContact CB-OE2 3.27Å; L67-E292 HydrophobicContact CD2-CB 3.54Å; L67-S293 VanDerWaalsContact CD1-OG 3.26Å; L67-S293 WeakPolarHBondContact CD1-OG 3.48Å; L67-S293 WeakPolarHBondContact CD2-OG 3.3Å; L67-I296 HydrophobicContact CD2-CG1 4.36Å
68	L	98.3	Very high	97.8	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-60.5	-49	178	-179.2	59.9	0	0	0	109.9	L28 L35 R38 F39 L42 D63 S65 H70 E71 L72	L28-L68 HydrophobicContact CD1-CD1 4.19Å; L35-L68 HydrophobicContact CD1-CB 4.34Å; L35-L68 HydrophobicContact CD1-CD2 4.41Å; R38-L68 VanDerWaalsContact NH2-CD2 3.29Å; F39-L68 HydrophobicContact CD2-CD1 3.91Å; F39-L68 HydrophobicContact CE2-CB 4.05Å; F39-L68 HydrophobicContact CE2-CD1 3.63Å; F39-L68 HydrophobicContact CE2-CG 4.42Å; F39-L68 HydrophobicContact CZ-CB 4.42Å; F39-L68 HydrophobicContact CZ-CD1 4.14Å; L42-L68 HydrophobicContact CD2-CD1 4.07Å; D63-L68 HydrophobicContact CB-CD2 4.19Å; S65-L68 PolarHBondContact O-N 3.18Å; S65-L68 PolarHBondContact OG-N 2.68Å; L68-H70 VanDerWaalsContact C-N 3.31Å; L68-H70 PolarHBondContact O-N 3.14Å; L68-E71 CarbonylContact O-C 3.57Å; L68-E71 PolarHBondContact O-N 2.64Å; L68-L72 HydrophobicContact CD1-CD2 4.38Å; L68-L72 HydrophobicContact CG-CG 4.45Å; L68-L72 VanDerWaalsContact O-CG 3.3Å; L68-L72 WeakPolarHBondContact O-CG 3.19Å; L68-L72 PolarHBondContact O-N 3.36Å
69	K	98.8	Very high	97.6	Very high	18 Å²	18	24 Å²	24	8%	0.078	13%	0.129	C	C	.	.	H	α-helix	trans	-59.5	-39.4	179	-71.2	-176.4	-66.5	171	0	113.2	F61 D63 S65 D66 L67 L72 A73 V101	F61-K69 HydrophobicContact CD1-CB 4.28Å; F61-K69 HydrophobicContact CD1-CG 4.36Å; F61-K69 WeakPolarHBondContact CE1-O 3.41Å; F61-K69 VanDerWaalsContact O-CD 3.26Å; F61-K69 WeakPolarHBondContact O-CD 3.42Å; D63-K69 HydrophobicContact CB-CG 4.49Å; D63-K69 VanDerWaalsContact O-CD 3.3Å; D63-K69 WeakPolarHBondContact O-CD 3.19Å; D63-K69 VanDerWaalsContact O-CE 3.29Å; D63-K69 WeakPolarHBondContact O-CE 3.48Å; S65-K69 WeakPolarHBondContact O-CG 3.25Å; S65-K69 PolarHBondContact O-N 3.02Å; S65-K69 VanDerWaalsContact O-N 3.08Å; D66-K69 WeakPolarHBondContact OD1-CE 3.31Å; D66-K69 IonicContact OD1-NZ 3.5Å; D66-K69 PolarHBondContact OD1-NZ 3.49Å; L67-K69 PolarHBondContact O-N 3.4Å; K69-L72 HydrophobicContact CG-CD1 4.5Å; K69-L72 WeakPolarHBondContact O-CB 3.38Å; K69-L72 PolarHBondContact O-N 3.22Å; K69-A73 PolarHBondContact O-N 2.83Å; K69-V101 HydrophobicContact CB-CB 4.42Å; K69-V101 HydrophobicContact CB-CG1 3.87Å; K69-V101 HydrophobicContact CB-CG2 3.6Å
70	H	98.3	Very high	97.4	Very high	4 Å²	4	24.6 Å²	24.6	2%	0.019	13%	0.128	C	C	.	.	H	α-helix	trans	-56.3	-53.6	169.8	164.8	-89	0	0	0	110.5	D66 L67 L68 L72 A73 Y74 I100 H103 E104	D66-H70 VanDerWaalsContact O-CB 3.27Å; D66-H70 WeakPolarHBondContact O-CB 3.44Å; D66-H70 PolarHBondContact O-N 3.3Å; L67-H70 WeakPolarHBondContact O-CB 3.37Å; L67-H70 PolarHBondContact O-N 3.06Å; L68-H70 VanDerWaalsContact C-N 3.31Å; L68-H70 PolarHBondContact O-N 3.14Å; H70-L72 VanDerWaalsContact C-N 3.29Å; H70-L72 PolarHBondContact O-N 3.48Å; H70-A73 PolarHBondContact O-N 3.01Å; H70-A73 VanDerWaalsContact O-N 3.08Å; H70-Y74 PolarHBondContact O-N 3.28Å; H70-I100 HydrophobicContact CB-CD1 4.46Å; H70-I100 HydrophobicContact CB-CG1 4.13Å; H70-I100 VanDerWaalsContact CD2-CG1 3.42Å; H70-I100 WeakPolarHBondContact CD2-CG1 3.28Å; H70-H103 AromaticContact CD2-NE2 3.81Å; H70-H103 AromaticContact NE2-CE1 3.99Å; H70-E104 IonicContact CD2-OE2 3.33Å; H70-E104 IonicContact NE2-OE2 2.9Å; H70-E104 PolarHBondContact NE2-OE2 3.39Å; H70-E104 VanDerWaalsContact O-CG 3.27Å; H70-E104 WeakPolarHBondContact O-CG 2.89Å
71	E	97.9	Very high	97.3	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-65.6	-28.8	-178.8	-164.7	66.3	-166.2	0	0	113.2	F39 L42 F43 L67 L68 Y74 C75	F39-E71 HydrophobicContact CD1-CG 4.17Å; F39-E71 HydrophobicContact CE1-CB 3.75Å; F39-E71 HydrophobicContact CE1-CG 3.7Å; F39-E71 HydrophobicContact CZ-CB 4.13Å; L42-E71 HydrophobicContact CD2-CB 3.97Å; L42-E71 HydrophobicContact CD2-CG 3.72Å; F43-E71 HydrophobicContact CE1-CG 3.73Å; F43-E71 VanDerWaalsContact CE1-OE1 3.26Å; F43-E71 WeakPolarHBondContact CE1-OE1 3.19Å; F43-E71 HydrophobicContact CZ-CG 4.27Å; L67-E71 PolarHBondContact O-N 2.65Å; L68-E71 CarbonylContact O-C 3.57Å; L68-E71 PolarHBondContact O-N 2.64Å; E71-Y74 PolarHBondContact O-N 2.89Å; E71-Y74 VanDerWaalsContact OE1-CD1 3.31Å; E71-Y74 WeakPolarHBondContact OE1-CD1 3.26Å; E71-C75 VanDerWaalsContact O-CB 3.32Å; E71-C75 WeakPolarHBondContact O-CB 3.3Å; E71-C75 PolarHBondContact O-N 3.03Å; E71-C75 PolarHBondContact O-SG 3.02Å
72	L	98.7	Very high	97.2	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-59.1	-50.9	171	-62.6	176.2	0	0	0	110.3	L28 L42 I57 A60 F61 L68 K69 H70 C75 L76	L28-L72 HydrophobicContact CD1-CD2 4.23Å; L28-L72 HydrophobicContact CD2-CD2 4.08Å; L42-L72 HydrophobicContact CD1-CD2 3.67Å; L42-L72 HydrophobicContact CD2-CD2 3.89Å; L42-L72 HydrophobicContact CG-CD2 4.34Å; I57-L72 HydrophobicContact CG2-CB 3.96Å; I57-L72 HydrophobicContact CG2-CD2 3.83Å; I57-L72 HydrophobicContact CG2-CG 4.42Å; A60-L72 HydrophobicContact CB-CD1 3.51Å; A60-L72 HydrophobicContact CB-CD2 3.78Å; A60-L72 HydrophobicContact CB-CG 4.31Å; A60-L72 WeakPolarHBondContact O-CD1 3.42Å; F61-L72 HydrophobicContact CD1-CB 4.45Å; F61-L72 HydrophobicContact CD1-CD1 3.99Å; F61-L72 HydrophobicContact CD2-CD1 4.41Å; F61-L72 HydrophobicContact CE1-CB 3.84Å; F61-L72 HydrophobicContact CE1-CD1 4.23Å; F61-L72 HydrophobicContact CE2-CB 4.26Å; F61-L72 HydrophobicContact CG-CD1 4.07Å; F61-L72 HydrophobicContact CZ-CB 3.73Å; L68-L72 HydrophobicContact CD1-CD2 4.38Å; L68-L72 HydrophobicContact CG-CG 4.45Å; L68-L72 VanDerWaalsContact O-CG 3.3Å; L68-L72 WeakPolarHBondContact O-CG 3.19Å; L68-L72 PolarHBondContact O-N 3.36Å; K69-L72 HydrophobicContact CG-CD1 4.5Å; K69-L72 WeakPolarHBondContact O-CB 3.38Å; K69-L72 PolarHBondContact O-N 3.22Å; H70-L72 VanDerWaalsContact C-N 3.29Å; H70-L72 PolarHBondContact O-N 3.48Å; L72-C75 PolarHBondContact O-N 3.13Å; L72-L76 VanDerWaalsContact O-CG 3.32Å; L72-L76 WeakPolarHBondContact O-CG 3.13Å; L72-L76 PolarHBondContact O-N 3.48Å
73	A	98.8	Very high	97.3	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-62.7	-45.3	179.1	0	0	0	0	0	111.1	F61 K69 H70 C75 L76 G77 L88 E104 A105 A108	F61-A73 HydrophobicContact CE1-CB 4.19Å; F61-A73 HydrophobicContact CZ-CB 4.06Å; K69-A73 PolarHBondContact O-N 2.83Å; H70-A73 PolarHBondContact O-N 3.01Å; H70-A73 VanDerWaalsContact O-N 3.08Å; A73-C75 PolarHBondContact O-N 3.19Å; A73-L76 PolarHBondContact O-N 2.98Å; A73-G77 PolarHBondContact O-N 2.94Å; A73-L88 HydrophobicContact CB-CD2 4.14Å; A73-E104 HydrophobicContact CB-CB 4.04Å; A73-E104 HydrophobicContact CB-CG 3.84Å; A73-A105 HydrophobicContact CB-CB 4.41Å; A73-A108 VanDerWaalsContact O-CB 3.25Å; A73-A108 WeakPolarHBondContact O-CB 3.29Å
74	Y	97.1	Very high	97.3	Very high	9 Å²	9	27.7 Å²	27.7	4%	0.035	14%	0.141	C	C	.	.	H	α-helix	trans	-54.9	-51.8	175.2	175.1	-102.3	0	0	0	111	S3 H70 E71 L76 G77 Q78 E104 F232	S3-Y74 PolarHBondContact OG-OH 2.73Å; H70-Y74 PolarHBondContact O-N 3.28Å; E71-Y74 PolarHBondContact O-N 2.89Å; E71-Y74 VanDerWaalsContact OE1-CD1 3.31Å; E71-Y74 WeakPolarHBondContact OE1-CD1 3.26Å; Y74-L76 VanDerWaalsContact C-N 3.35Å; Y74-L76 PolarHBondContact O-N 3.44Å; Y74-G77 WeakPolarHBondContact O-CA 3.32Å; Y74-G77 PolarHBondContact O-N 3.26Å; Y74-G77 VanDerWaalsContact O-N 3.09Å; Y74-Q78 HydrophobicContact CD1-CG 4.04Å; Y74-Q78 HydrophobicContact CD2-CG 4.19Å; Y74-Q78 HydrophobicContact CE1-CG 3.65Å; Y74-Q78 HydrophobicContact CE2-CG 3.82Å; Y74-Q78 HydrophobicContact CG-CG 4.3Å; Y74-Q78 VanDerWaalsContact O-CG 3.31Å; Y74-Q78 WeakPolarHBondContact O-CG 3.47Å; Y74-Q78 PolarHBondContact O-N 3Å; Y74-E104 WeakPolarHBondContact CA-OE1 3.28Å; Y74-E104 VanDerWaalsContact CB-OE1 3.29Å; Y74-E104 WeakPolarHBondContact CB-OE1 3.3Å; Y74-E104 WeakPolarHBondContact CD2-OE1 3.33Å; Y74-F232 HydrophobicContact CE2-CE2 4.34Å
75	C	96.8	Very high	97.4	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-57.5	-45.3	179.1	-76.7	0	0	0	0	112.2	L42 R46 E71 L72 A73 G77 Q78 M79	L42-C75 HydrophobicContact CD1-CB 4.02Å; L42-C75 HydrophobicContact CG-CB 4.45Å; R46-C75 HydrophobicContact CB-CB 4.1Å; R46-C75 HydrophobicContact CG-CB 4.09Å; E71-C75 VanDerWaalsContact O-CB 3.32Å; E71-C75 WeakPolarHBondContact O-CB 3.3Å; E71-C75 PolarHBondContact O-N 3.03Å; E71-C75 PolarHBondContact O-SG 3.02Å; L72-C75 PolarHBondContact O-N 3.13Å; A73-C75 PolarHBondContact O-N 3.19Å; C75-G77 VanDerWaalsContact C-N 3.32Å; C75-G77 PolarHBondContact O-N 3.39Å; C75-Q78 PolarHBondContact O-N 2.81Å; C75-M79 WeakPolarHBondContact O-CG 3.08Å; C75-M79 PolarHBondContact O-N 3.01Å; C75-M79 VanDerWaalsContact O-SD 3.39Å
76	L	98.4	Very high	97.4	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-61.1	-40	176.4	-68.3	175.1	0	0	0	112.2	I54 I57 V58 F61 L72 A73 Y74 M79 R80 A84 L88	I54-L76 HydrophobicContact CB-CD2 4.33Å; I54-L76 HydrophobicContact CG1-CD2 4.07Å; I54-L76 HydrophobicContact CG2-CD2 3.93Å; I57-L76 HydrophobicContact CB-CD2 4.07Å; I57-L76 HydrophobicContact CD1-CD2 4.22Å; I57-L76 HydrophobicContact CG2-CD1 3.99Å; I57-L76 HydrophobicContact CG2-CD2 3.75Å; I57-L76 HydrophobicContact CG2-CG 3.69Å; V58-L76 HydrophobicContact CG2-CD1 4.16Å; F61-L76 HydrophobicContact CE2-CD1 3.72Å; F61-L76 HydrophobicContact CZ-CD1 4.04Å; L72-L76 VanDerWaalsContact O-CG 3.32Å; L72-L76 WeakPolarHBondContact O-CG 3.13Å; L72-L76 PolarHBondContact O-N 3.48Å; A73-L76 PolarHBondContact O-N 2.98Å; Y74-L76 VanDerWaalsContact C-N 3.35Å; Y74-L76 PolarHBondContact O-N 3.44Å; L76-M79 HydrophobicContact CD2-SD 4.03Å; L76-M79 PolarHBondContact O-N 2.98Å; L76-R80 PolarHBondContact O-N 3.2Å; L76-A84 HydrophobicContact CB-CB 4.15Å; L76-A84 HydrophobicContact CD1-CB 4.42Å; L76-A84 HydrophobicContact CD2-CB 3.91Å; L76-A84 HydrophobicContact CG-CB 4.38Å; L76-L88 HydrophobicContact CB-CD1 4.18Å; L76-L88 HydrophobicContact CB-CD2 4.1Å; L76-L88 HydrophobicContact CB-CG 4.4Å; L76-L88 HydrophobicContact CD1-CD2 3.92Å; L76-L88 HydrophobicContact CD1-CG 4.26Å
77	G	97.2	Very high	97.5	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.01	12%	0.124	C	C	.	.	H	α-helix	trans	-61.7	-48.6	173.8	0	0	0	0	0	112.3	A73 Y74 C75 M79 R80	A73-G77 PolarHBondContact O-N 2.94Å; Y74-G77 WeakPolarHBondContact O-CA 3.32Å; Y74-G77 PolarHBondContact O-N 3.26Å; Y74-G77 VanDerWaalsContact O-N 3.09Å; C75-G77 VanDerWaalsContact C-N 3.32Å; C75-G77 PolarHBondContact O-N 3.39Å; G77-M79 PolarHBondContact O-N 3.47Å; G77-R80 WeakPolarHBondContact O-CG 3.37Å; G77-R80 PolarHBondContact O-N 2.82Å
78	Q	93.7	Very high	97.5	Very high	17 Å²	17	25.7 Å²	25.7	8%	0.079	12%	0.124	C	C	.	.	H	α-helix	trans	-63.9	-29.2	178.6	-63.6	-52.8	-53	0	0	112.8	Y74 C75 R80 I163	Y74-Q78 HydrophobicContact CD1-CG 4.04Å; Y74-Q78 HydrophobicContact CD2-CG 4.19Å; Y74-Q78 HydrophobicContact CE1-CG 3.65Å; Y74-Q78 HydrophobicContact CE2-CG 3.82Å; Y74-Q78 HydrophobicContact CG-CG 4.3Å; Y74-Q78 VanDerWaalsContact O-CG 3.31Å; Y74-Q78 WeakPolarHBondContact O-CG 3.47Å; Y74-Q78 PolarHBondContact O-N 3Å; C75-Q78 PolarHBondContact O-N 2.81Å; Q78-R80 PolarHBondContact O-N 3.41Å; Q78-I163 PolarHBondContact NE2-O 3.16Å
79	M	94.5	Very high	97.5	Very high	15 Å²	15	27 Å²	27	7%	0.074	13%	0.13	C	C	.	.	H	α-helix	trans	-68.4	-20.9	174.4	-70.4	157.8	90.5	0	0	113	R46 N49 I54 I57 C75 L76 G77 N81	R46-M79 HydrophobicContact CB-SD 4.48Å; R46-M79 HydrophobicContact CG-CG 3.94Å; R46-M79 HydrophobicContact CG-SD 4.44Å; N49-M79 HydrophobicContact CB-CE 4.13Å; N49-M79 PolarHBondContact ND2-O 3.38Å; N49-M79 VanDerWaalsContact ND2-O 3.16Å; I54-M79 HydrophobicContact CD1-CE 4.32Å; I54-M79 HydrophobicContact CG1-CE 3.55Å; I54-M79 HydrophobicContact CG1-SD 4.49Å; I57-M79 HydrophobicContact CD1-CE 4Å; I57-M79 HydrophobicContact CD1-SD 3.79Å; C75-M79 WeakPolarHBondContact O-CG 3.08Å; C75-M79 PolarHBondContact O-N 3.01Å; C75-M79 VanDerWaalsContact O-SD 3.39Å; L76-M79 HydrophobicContact CD2-SD 4.03Å; L76-M79 PolarHBondContact O-N 2.98Å; G77-M79 PolarHBondContact O-N 3.47Å; M79-N81 PolarHBondContact O-N 3.4Å
80	R	93.9	Very high	97.5	Very high	127 Å²	127	32.7 Å²	32.7	48%	0.479	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	48	28.5	-178	-61.7	-175.4	-66.7	178.7	4.2	114.3	L76 G77 Q78 I163	L76-R80 PolarHBondContact O-N 3.2Å; G77-R80 WeakPolarHBondContact O-CG 3.37Å; G77-R80 PolarHBondContact O-N 2.82Å; Q78-R80 PolarHBondContact O-N 3.41Å; R80-I163 HydrophobicContact CG-CD1 4.35Å; R80-I163 HydrophobicContact CG-CG1 3.94Å
81	N	96.1	Very high	97.6	Very high	43 Å²	43	33 Å²	33	23%	0.23	16%	0.159	C	C	.	.			trans	-94.4	113.7	-177.3	-170.9	-27	0	0	0	109.1	N49 I54 M79 Y83 A84	N49-N81 PolarHBondContact OD1-ND2 3.35Å; I54-N81 HydrophobicContact CD1-CB 3.57Å; I54-N81 VanDerWaalsContact CD1-ND2 3.32Å; I54-N81 WeakPolarHBondContact CD1-ND2 3.39Å; M79-N81 PolarHBondContact O-N 3.4Å; N81-Y83 PolarHBondContact O-N 3.33Å; N81-Y83 VanDerWaalsContact OD1-CB 3.24Å; N81-Y83 WeakPolarHBondContact OD1-CB 3.4Å; N81-Y83 PolarHBondContact OD1-N 2.91Å; N81-A84 WeakPolarHBondContact O-CB 3.34Å; N81-A84 PolarHBondContact O-N 3.05Å
82	V	97.3	Very high	97.6	Very high	80 Å²	80	33 Å²	33	49%	0.485	16%	0.159	S	C	.	.	G	3₁₀ helix	trans	-56.9	-21	-178.4	71.8	0	0	0	0	113.3	A84 L85 I112 D114	V82-A84 PolarHBondContact O-N 3.48Å; V82-L85 HydrophobicContact CG2-CB 4.37Å; V82-L85 HydrophobicContact CG2-CD2 4.15Å; V82-L85 WeakPolarHBondContact O-CB 3.26Å; V82-L85 PolarHBondContact O-N 3.18Å; V82-I112 HydrophobicContact CB-CG2 4.37Å; V82-I112 HydrophobicContact CG2-CG2 4.46Å; V82-D114 HydrophobicContact CG2-CB 4.2Å; V82-D114 WeakPolarHBondContact CG2-OD2 3.31Å
83	Y	98.3	Very high	97.6	Very high	99 Å²	99	35.1 Å²	35.1	39%	0.388	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-58.6	-29.3	173.4	-177.5	-101.4	0	0	0	113	K51 I54 D55 N81 L85	K51-Y83 HydrophobicContact CB-CE1 4.38Å; K51-Y83 HydrophobicContact CD-CE2 4.18Å; K51-Y83 WeakPolarHBondContact CE-OH 3.34Å; K51-Y83 HydrophobicContact CG-CD1 3.97Å; K51-Y83 HydrophobicContact CG-CD2 4.28Å; K51-Y83 HydrophobicContact CG-CE1 3.47Å; K51-Y83 VanDerWaalsContact CG-CE1 3.47Å; K51-Y83 HydrophobicContact CG-CE2 3.81Å; K51-Y83 HydrophobicContact CG-CG 4.36Å; K51-Y83 PolarHBondContact NZ-OH 3.46Å; I54-Y83 HydrophobicContact CB-CD1 3.86Å; I54-Y83 HydrophobicContact CB-CE1 4.17Å; I54-Y83 HydrophobicContact CD1-CD1 3.88Å; I54-Y83 HydrophobicContact CG1-CD1 4.49Å; I54-Y83 HydrophobicContact CG2-CD1 3.61Å; I54-Y83 HydrophobicContact CG2-CE1 3.91Å; D55-Y83 WeakPolarHBondContact OD1-CE1 3.25Å; D55-Y83 PolarHBondContact OD1-OH 3.2Å; D55-Y83 PolarHBondContact OD2-OH 3.32Å; N81-Y83 PolarHBondContact O-N 3.33Å; N81-Y83 VanDerWaalsContact OD1-CB 3.24Å; N81-Y83 WeakPolarHBondContact OD1-CB 3.4Å; N81-Y83 PolarHBondContact OD1-N 2.91Å; Y83-L85 VanDerWaalsContact C-N 3.29Å; Y83-L85 PolarHBondContact O-N 3.24Å
84	A	98.6	Very high	97.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-76.4	-11.9	176.3	0	0	0	0	0	114	I54 L76 N81 V82 N86 A87 L88 I112	I54-A84 HydrophobicContact CD1-CB 4.42Å; I54-A84 HydrophobicContact CG2-CB 3.89Å; L76-A84 HydrophobicContact CB-CB 4.15Å; L76-A84 HydrophobicContact CD1-CB 4.42Å; L76-A84 HydrophobicContact CD2-CB 3.91Å; L76-A84 HydrophobicContact CG-CB 4.38Å; N81-A84 WeakPolarHBondContact O-CB 3.34Å; N81-A84 PolarHBondContact O-N 3.05Å; V82-A84 PolarHBondContact O-N 3.48Å; A84-N86 PolarHBondContact O-N 3.41Å; A84-A87 PolarHBondContact O-N 3.02Å; A84-L88 HydrophobicContact CB-CD1 4.27Å; A84-L88 WeakPolarHBondContact O-CG 3.13Å; A84-L88 PolarHBondContact O-N 3.05Å; A84-I112 HydrophobicContact CB-CD1 4.37Å
85	L	98.6	Very high	97.5	Very high	5 Å²	5	43.3 Å²	43.3	3%	0.026	22%	0.219	C	C	.	.	H	α-helix	trans	-59.1	-45.5	-168.1	-179.9	62	0	0	0	113.1	V82 Y83 A87 L88 I89 I109 I112 D114 L116	V82-L85 HydrophobicContact CG2-CB 4.37Å; V82-L85 HydrophobicContact CG2-CD2 4.15Å; V82-L85 WeakPolarHBondContact O-CB 3.26Å; V82-L85 PolarHBondContact O-N 3.18Å; Y83-L85 VanDerWaalsContact C-N 3.29Å; Y83-L85 PolarHBondContact O-N 3.24Å; L85-A87 PolarHBondContact O-N 3.25Å; L85-L88 PolarHBondContact O-N 3.24Å; L85-I89 HydrophobicContact CD1-CD1 4.05Å; L85-I89 HydrophobicContact CD1-CG1 4.39Å; L85-I89 HydrophobicContact CG-CD1 3.88Å; L85-I89 WeakPolarHBondContact O-CG1 3.32Å; L85-I89 PolarHBondContact O-N 3.29Å; L85-I109 HydrophobicContact CD1-CB 4.49Å; L85-I109 HydrophobicContact CD1-CG1 4.18Å; L85-I109 HydrophobicContact CD1-CG2 3.94Å; L85-I112 HydrophobicContact CB-CD1 4.46Å; L85-D114 HydrophobicContact CD2-CB 3.77Å; L85-L116 HydrophobicContact CD2-CB 4.2Å; L85-L116 HydrophobicContact CD2-CD2 4.21Å; L85-L116 HydrophobicContact CD2-CG 4.49Å
86	N	98.6	Very high	97.5	Very high	106 Å²	106	48 Å²	48	57%	0.567	25%	0.251	S	S	*	.	H	α-helix	trans	-64.3	-42.3	-178.9	-73.8	-18.4	0	0	0	111.7	A84 I89 E90	A84-N86 PolarHBondContact O-N 3.41Å; N86-I89 WeakPolarHBondContact O-CB 3.3Å; N86-I89 PolarHBondContact O-N 2.96Å; N86-E90 WeakPolarHBondContact O-CG 3.42Å; N86-E90 PolarHBondContact O-N 3.21Å
87	A	98.8	Very high	97.5	Very high	15 Å²	15	49.2 Å²	49.2	12%	0.124	26%	0.257	C	S	.	.	H	α-helix	trans	-64.3	-41.6	177.7	0	0	0	0	0	111.7	V58 A84 L85 I89 E90 V91	V58-A87 HydrophobicContact CB-CB 4.3Å; V58-A87 HydrophobicContact CG1-CB 3.73Å; V58-A87 HydrophobicContact CG2-CB 3.49Å; V58-A87 VanDerWaalsContact CG2-CB 3.49Å; A84-A87 PolarHBondContact O-N 3.02Å; L85-A87 PolarHBondContact O-N 3.25Å; A87-I89 VanDerWaalsContact C-N 3.33Å; A87-I89 PolarHBondContact O-N 3.02Å; A87-E90 WeakPolarHBondContact O-CB 3.42Å; A87-E90 PolarHBondContact O-N 3.04Å; A87-V91 WeakPolarHBondContact O-CG2 3.35Å; A87-V91 PolarHBondContact O-N 2.86Å
88	L	98.9	Very high	97.6	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-64.5	-37.2	175.3	-68.6	167.7	0	0	0	112.2	A73 L76 A84 L85 E90 V91 L92 A105 A108 I109 I112	A73-L88 HydrophobicContact CB-CD2 4.14Å; L76-L88 HydrophobicContact CB-CD1 4.18Å; L76-L88 HydrophobicContact CB-CD2 4.1Å; L76-L88 HydrophobicContact CB-CG 4.4Å; L76-L88 HydrophobicContact CD1-CD2 3.92Å; L76-L88 HydrophobicContact CD1-CG 4.26Å; A84-L88 HydrophobicContact CB-CD1 4.27Å; A84-L88 WeakPolarHBondContact O-CG 3.13Å; A84-L88 PolarHBondContact O-N 3.05Å; L85-L88 PolarHBondContact O-N 3.24Å; L88-E90 VanDerWaalsContact C-N 3.34Å; L88-V91 PolarHBondContact O-N 3.13Å; L88-L92 WeakPolarHBondContact O-CB 3.27Å; L88-L92 PolarHBondContact O-N 3.01Å; L88-A105 HydrophobicContact CD2-CB 4.39Å; L88-A108 HydrophobicContact CD1-CB 3.75Å; L88-A108 HydrophobicContact CD2-CB 3.82Å; L88-A108 HydrophobicContact CG-CB 4.41Å; L88-I109 HydrophobicContact CB-CD1 4.17Å; L88-I109 HydrophobicContact CB-CG1 3.71Å; L88-I109 HydrophobicContact CD1-CG1 4.45Å; L88-I112 HydrophobicContact CD1-CD1 3.48Å; L88-I112 VanDerWaalsContact CD1-CD1 3.48Å
89	I	98.8	Very high	97.8	Very high	27 Å²	27	51.6 Å²	51.6	14%	0.138	28%	0.28	C	S	.	.	H	α-helix	trans	-62.7	-41.6	174	-75.8	165.4	0	0	0	111.1	L85 N86 A87 S93 I109 V120	L85-I89 HydrophobicContact CD1-CD1 4.05Å; L85-I89 HydrophobicContact CD1-CG1 4.39Å; L85-I89 HydrophobicContact CG-CD1 3.88Å; L85-I89 WeakPolarHBondContact O-CG1 3.32Å; L85-I89 PolarHBondContact O-N 3.29Å; N86-I89 WeakPolarHBondContact O-CB 3.3Å; N86-I89 PolarHBondContact O-N 2.96Å; A87-I89 VanDerWaalsContact C-N 3.33Å; A87-I89 PolarHBondContact O-N 3.02Å; I89-S93 WeakPolarHBondContact O-CB 3.32Å; I89-S93 PolarHBondContact O-N 3.38Å; I89-S93 PolarHBondContact O-OG 3.4Å; I89-I109 HydrophobicContact CG1-CD1 3.99Å; I89-V120 HydrophobicContact CD1-CG2 3.92Å; I89-V120 HydrophobicContact CG1-CB 4.34Å; I89-V120 HydrophobicContact CG1-CG1 4.31Å; I89-V120 HydrophobicContact CG1-CG2 4.08Å; I89-V120 HydrophobicContact CG2-CG1 4.04Å; I89-V120 HydrophobicContact CG2-CG2 4.12Å
90	E	98.7	Very high	98	Very high	138 Å²	138	51.8 Å²	51.8	65%	0.645	28%	0.281	S	S	*	.	H	α-helix	trans	-60.9	-48.3	175.3	-72.6	174.1	-179.1	0	0	110.9	N86 A87 L88 L92 S93 D94	N86-E90 WeakPolarHBondContact O-CG 3.42Å; N86-E90 PolarHBondContact O-N 3.21Å; A87-E90 WeakPolarHBondContact O-CB 3.42Å; A87-E90 PolarHBondContact O-N 3.04Å; L88-E90 VanDerWaalsContact C-N 3.34Å; E90-L92 PolarHBondContact O-N 3.35Å; E90-S93 PolarHBondContact O-N 3.09Å; E90-D94 WeakPolarHBondContact O-CB 3.32Å; E90-D94 PolarHBondContact O-N 3.03Å
91	V	98.8	Very high	98.2	Very high	10 Å²	10	45.7 Å²	45.7	6%	0.061	26%	0.258	C	S	.	.	H	α-helix	trans	-61.8	-44.8	177.4	174.9	0	0	0	0	112.2	F61 A87 L88 S93 D94 Q97 V101 A105	F61-V91 HydrophobicContact CB-CG2 4.47Å; F61-V91 HydrophobicContact CD1-CG1 4.3Å; F61-V91 HydrophobicContact CD1-CG2 3.77Å; F61-V91 HydrophobicContact CD2-CG2 3.91Å; F61-V91 HydrophobicContact CE1-CG1 4.09Å; F61-V91 HydrophobicContact CE1-CG2 3.88Å; F61-V91 HydrophobicContact CE2-CG2 4.03Å; F61-V91 HydrophobicContact CG-CG2 3.8Å; F61-V91 HydrophobicContact CZ-CG2 4.02Å; A87-V91 WeakPolarHBondContact O-CG2 3.35Å; A87-V91 PolarHBondContact O-N 2.86Å; L88-V91 PolarHBondContact O-N 3.13Å; V91-S93 PolarHBondContact O-N 3.3Å; V91-D94 PolarHBondContact O-N 3.44Å; V91-Q97 HydrophobicContact CG1-CG 4.36Å; V91-V101 HydrophobicContact CG1-CG1 3.67Å; V91-A105 HydrophobicContact CB-CB 4.09Å; V91-A105 HydrophobicContact CG1-CB 3.75Å
92	L	98.8	Very high	98.3	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-58.9	-39.2	175.8	170.2	59.1	0	0	0	112	L88 E90 R102 A105 A106 I109 V120 L121 Y124 L132	L88-L92 WeakPolarHBondContact O-CB 3.27Å; L88-L92 PolarHBondContact O-N 3.01Å; E90-L92 PolarHBondContact O-N 3.35Å; L92-R102 PolarHBondContact O-NE 3.37Å; L92-R102 PolarHBondContact O-NH2 3.29Å; L92-A105 HydrophobicContact CB-CB 4.28Å; L92-A106 HydrophobicContact CD1-CB 3.99Å; L92-A106 HydrophobicContact CD2-CB 4.43Å; L92-I109 HydrophobicContact CB-CD1 4.23Å; L92-I109 HydrophobicContact CD2-CD1 3.66Å; L92-V120 HydrophobicContact CD2-CG1 4.04Å; L92-L121 HydrophobicContact CD2-CD2 3.83Å; L92-Y124 HydrophobicContact CD1-CD2 4.16Å; L92-Y124 HydrophobicContact CD1-CE2 4.45Å; L92-Y124 HydrophobicContact CD1-CG 4.39Å; L92-Y124 HydrophobicContact CD2-CD2 4.09Å; L92-Y124 HydrophobicContact CD2-CE2 4.27Å; L92-Y124 HydrophobicContact CG-CD2 4.06Å; L92-Y124 HydrophobicContact CG-CE2 4Å; L92-L132 HydrophobicContact CD1-CD1 3.66Å
93	S	98.2	Very high	98.4	Very high	45 Å²	45	40.4 Å²	40.4	32%	0.315	23%	0.226	S	C	.	.	H	α-helix	trans	-84.2	-13	-174.1	-58	0	0	0	0	113.5	I89 E90 V91 D95 Y124	I89-S93 WeakPolarHBondContact O-CB 3.32Å; I89-S93 PolarHBondContact O-N 3.38Å; I89-S93 PolarHBondContact O-OG 3.4Å; E90-S93 PolarHBondContact O-N 3.09Å; V91-S93 PolarHBondContact O-N 3.3Å; S93-D95 PolarHBondContact O-N 2.87Å; S93-Y124 WeakPolarHBondContact CA-OH 3.47Å
94	D	98.3	Very high	98.4	Very high	57 Å²	57	35.9 Å²	35.9	31%	0.305	21%	0.208	S	C	.	.			trans	-80.7	104	177.7	-177.3	2.9	0	0	0	111	E90 V91 S96 Q97 R102	E90-D94 WeakPolarHBondContact O-CB 3.32Å; E90-D94 PolarHBondContact O-N 3.03Å; V91-D94 PolarHBondContact O-N 3.44Å; D94-S96 PolarHBondContact O-N 3.14Å; D94-S96 VanDerWaalsContact OD1-CB 3.27Å; D94-S96 WeakPolarHBondContact OD1-CB 3.37Å; D94-S96 PolarHBondContact OD1-N 3.17Å; D94-S96 PolarHBondContact OD1-OG 3.19Å; D94-S96 PolarHBondContact OD2-OG 3.16Å; D94-S96 VanDerWaalsContact OD2-OG 3.07Å; D94-Q97 HydrophobicContact CB-CG 3.88Å; D94-Q97 PolarHBondContact O-N 3.01Å; D94-Q97 VanDerWaalsContact O-N 3.15Å; D94-Q97 PolarHBondContact OD2-NE2 2.95Å; D94-R102 WeakPolarHBondContact O-CD 3.24Å
95	D	96.7	Very high	98.4	Very high	125 Å²	125	35.9 Å²	35.9	67%	0.668	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-9.7	177.9	-72.3	-34.4	0	0	0	113.7	S93 R102	S93-D95 PolarHBondContact O-N 2.87Å; D95-R102 IonicContact OD1-CZ 3.87Å; D95-R102 IonicContact OD1-NH1 3.82Å; D95-R102 PolarHBondContact OD1-NH1 3.49Å; D95-R102 IonicContact OD1-NH2 3.02Å; D95-R102 PolarHBondContact OD1-NH2 2.84Å
96	S	97.1	Very high	98.4	Very high	97 Å²	97	35.7 Å²	35.7	68%	0.678	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-15.9	172.7	78.1	0	0	0	0	113.5	D94	D94-S96 PolarHBondContact O-N 3.14Å; D94-S96 VanDerWaalsContact OD1-CB 3.27Å; D94-S96 WeakPolarHBondContact OD1-CB 3.37Å; D94-S96 PolarHBondContact OD1-N 3.17Å; D94-S96 PolarHBondContact OD1-OG 3.19Å; D94-S96 PolarHBondContact OD2-OG 3.16Å; D94-S96 VanDerWaalsContact OD2-OG 3.07Å
97	Q	98	Very high	98.4	Very high	26 Å²	26	31.4 Å²	31.4	12%	0.121	18%	0.184	C	C	.	.	S	Bend	trans	-74.3	143.8	175.3	-64.6	-63.6	-20.4	0	0	111.5	V91 D94 V101 R102	V91-Q97 HydrophobicContact CG1-CG 4.36Å; D94-Q97 HydrophobicContact CB-CG 3.88Å; D94-Q97 PolarHBondContact O-N 3.01Å; D94-Q97 VanDerWaalsContact O-N 3.15Å; D94-Q97 PolarHBondContact OD2-NE2 2.95Å; Q97-V101 HydrophobicContact CB-CB 4.37Å; Q97-V101 HydrophobicContact CB-CG1 4.39Å; Q97-R102 HydrophobicContact CB-CG 3.68Å; Q97-R102 WeakPolarHBondContact O-CD 3.44Å
98	A	98.1	Very high	98.4	Very high	29 Å²	29	30.8 Å²	30.8	24%	0.24	18%	0.178	C	C	.	.			trans	-60.5	151.1	175.6	0	0	0	0	0	111.6	D66 I100 V101 R102	D66-A98 HydrophobicContact CB-CB 4.31Å; D66-A98 WeakPolarHBondContact OD1-CB 3.29Å; A98-I100 HydrophobicContact CB-CG2 4.08Å; A98-I100 PolarHBondContact O-N 3.31Å; A98-I100 VanDerWaalsContact O-N 3.17Å; A98-V101 HydrophobicContact CB-CG2 4.3Å; A98-V101 PolarHBondContact O-N 3.39Å; A98-R102 WeakPolarHBondContact O-CG 3.44Å; A98-R102 PolarHBondContact O-N 3.26Å
99	A	98.2	Very high	98.4	Very high	40 Å²	40	30.8 Å²	30.8	33%	0.331	18%	0.178	S	C	.	.	H	α-helix	trans	-54.3	-38	-179.9	0	0	0	0	0	112.6	R102 H103 I129	A99-R102 PolarHBondContact O-N 2.88Å; A99-H103 PolarHBondContact O-CD2 3.42Å; A99-H103 PolarHBondContact O-N 3.26Å; A99-I129 HydrophobicContact CB-CG2 3.86Å
100	I	98.2	Very high	98.4	Very high	18 Å²	18	29.5 Å²	29.5	9%	0.092	17%	0.172	C	C	.	.	H	α-helix	trans	-60.5	-45.3	175.6	-169.8	165.5	0	0	0	112.4	D66 H70 A98 R102 H103 E104 H261 L289	D66-I100 HydrophobicContact CB-CG2 4.15Å; H70-I100 HydrophobicContact CB-CD1 4.46Å; H70-I100 HydrophobicContact CB-CG1 4.13Å; H70-I100 VanDerWaalsContact CD2-CG1 3.42Å; H70-I100 WeakPolarHBondContact CD2-CG1 3.28Å; A98-I100 HydrophobicContact CB-CG2 4.08Å; A98-I100 PolarHBondContact O-N 3.31Å; A98-I100 VanDerWaalsContact O-N 3.17Å; I100-R102 VanDerWaalsContact C-N 3.33Å; I100-R102 PolarHBondContact O-N 3.42Å; I100-H103 VanDerWaalsContact C-CD2 3.44Å; I100-H103 WeakPolarHBondContact CA-CD2 3.28Å; I100-H103 PolarHBondContact O-CD2 3.04Å; I100-H103 PolarHBondContact O-NE2 2.97Å; I100-E104 PolarHBondContact O-N 3.37Å; I100-H261 VanDerWaalsContact CD1-NE2 3.26Å; I100-H261 WeakPolarHBondContact CD1-NE2 3.35Å; I100-L289 HydrophobicContact CD1-CD1 3.62Å; I100-L289 HydrophobicContact CD1-CD2 3.46Å; I100-L289 VanDerWaalsContact CD1-CD2 3.46Å; I100-L289 HydrophobicContact CD1-CG 4.13Å
101	V	98.8	Very high	98.3	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-67	-38.7	178.9	-178.2	0	0	0	0	110.9	F61 D66 K69 V91 Q97 A98 E104 A105	F61-V101 HydrophobicContact CE1-CG1 4.39Å; D66-V101 HydrophobicContact CB-CG2 4.3Å; K69-V101 HydrophobicContact CB-CB 4.42Å; K69-V101 HydrophobicContact CB-CG1 3.87Å; K69-V101 HydrophobicContact CB-CG2 3.6Å; V91-V101 HydrophobicContact CG1-CG1 3.67Å; Q97-V101 HydrophobicContact CB-CB 4.37Å; Q97-V101 HydrophobicContact CB-CG1 4.39Å; A98-V101 HydrophobicContact CB-CG2 4.3Å; A98-V101 PolarHBondContact O-N 3.39Å; V101-E104 PolarHBondContact O-N 3.28Å; V101-A105 WeakPolarHBondContact O-CB 3.08Å; V101-A105 PolarHBondContact O-N 3.44Å
102	R	98.8	Very high	98.2	Very high	11 Å²	11	23.7 Å²	23.7	4%	0.042	15%	0.145	C	C	.	.	H	α-helix	trans	-72.2	-40.3	-176.8	-66.3	-179.9	67.7	179.3	11.9	113.4	L92 D94 D95 Q97 A98 A99 I100 E104 A105 A106 L132	L92-R102 PolarHBondContact O-NE 3.37Å; L92-R102 PolarHBondContact O-NH2 3.29Å; D94-R102 WeakPolarHBondContact O-CD 3.24Å; D95-R102 IonicContact OD1-CZ 3.87Å; D95-R102 IonicContact OD1-NH1 3.82Å; D95-R102 PolarHBondContact OD1-NH1 3.49Å; D95-R102 IonicContact OD1-NH2 3.02Å; D95-R102 PolarHBondContact OD1-NH2 2.84Å; Q97-R102 HydrophobicContact CB-CG 3.68Å; Q97-R102 WeakPolarHBondContact O-CD 3.44Å; A98-R102 WeakPolarHBondContact O-CG 3.44Å; A98-R102 PolarHBondContact O-N 3.26Å; A99-R102 PolarHBondContact O-N 2.88Å; I100-R102 VanDerWaalsContact C-N 3.33Å; I100-R102 PolarHBondContact O-N 3.42Å; R102-E104 VanDerWaalsContact C-N 3.32Å; R102-A105 PolarHBondContact O-N 2.97Å; R102-A106 PolarHBondContact O-N 3.49Å; R102-L132 HydrophobicContact CB-CD1 4.08Å; R102-L132 HydrophobicContact CB-CD2 4.49Å
103	H	98.6	Very high	98	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-66.8	-39.7	175.3	86.9	78.1	0	0	0	110.1	H70 A99 I100 A105 A106 E107 T135 M258	H70-H103 AromaticContact CD2-NE2 3.81Å; H70-H103 AromaticContact NE2-CE1 3.99Å; A99-H103 PolarHBondContact O-CD2 3.42Å; A99-H103 PolarHBondContact O-N 3.26Å; I100-H103 VanDerWaalsContact C-CD2 3.44Å; I100-H103 WeakPolarHBondContact CA-CD2 3.28Å; I100-H103 PolarHBondContact O-CD2 3.04Å; I100-H103 PolarHBondContact O-NE2 2.97Å; H103-A105 VanDerWaalsContact C-N 3.29Å; H103-A105 PolarHBondContact O-N 3.36Å; H103-A106 CarbonylContact O-C 3.55Å; H103-A106 WeakPolarHBondContact O-CA 3.29Å; H103-A106 WeakPolarHBondContact O-CB 3.3Å; H103-A106 PolarHBondContact O-N 3.34Å; H103-E107 PolarHBondContact O-N 3.46Å; H103-T135 HydrophobicContact CB-CG2 4.19Å; H103-T135 WeakPolarHBondContact CB-OG1 3.35Å; H103-T135 VanDerWaalsContact O-CG2 3.28Å; H103-T135 WeakPolarHBondContact O-CG2 3.26Å; H103-M258 WeakPolarHBondContact CD2-CE 3.41Å; H103-M258 WeakPolarHBondContact CE1-CE 3.46Å; H103-M258 WeakPolarHBondContact NE2-CE 3.26Å
104	E	98.7	Very high	97.9	Very high	5 Å²	5	24.5 Å²	24.5	2%	0.023	15%	0.149	C	C	.	.	H	α-helix	trans	-66.3	-35.7	-179.5	-165.8	53.5	-137.3	0	0	111.4	H70 A73 Y74 I100 V101 R102 A106 E107 A108	H70-E104 IonicContact CD2-OE2 3.33Å; H70-E104 IonicContact NE2-OE2 2.9Å; H70-E104 PolarHBondContact NE2-OE2 3.39Å; H70-E104 VanDerWaalsContact O-CG 3.27Å; H70-E104 WeakPolarHBondContact O-CG 2.89Å; A73-E104 HydrophobicContact CB-CB 4.04Å; A73-E104 HydrophobicContact CB-CG 3.84Å; Y74-E104 WeakPolarHBondContact CA-OE1 3.28Å; Y74-E104 VanDerWaalsContact CB-OE1 3.29Å; Y74-E104 WeakPolarHBondContact CB-OE1 3.3Å; Y74-E104 WeakPolarHBondContact CD2-OE1 3.33Å; I100-E104 PolarHBondContact O-N 3.37Å; V101-E104 PolarHBondContact O-N 3.28Å; R102-E104 VanDerWaalsContact C-N 3.32Å; E104-A106 PolarHBondContact O-N 3.43Å; E104-E107 PolarHBondContact O-N 2.6Å; E104-A108 WeakPolarHBondContact O-CB 3.27Å; E104-A108 PolarHBondContact O-N 3.25Å
105	A	98.9	Very high	97.7	Very high	0 Å²	0	25 Å²	25	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-61.6	-41.4	168.9	0	0	0	0	0	112.4	A73 L88 V91 L92 V101 R102 H103 A108 I109	A73-A105 HydrophobicContact CB-CB 4.41Å; L88-A105 HydrophobicContact CD2-CB 4.39Å; V91-A105 HydrophobicContact CB-CB 4.09Å; V91-A105 HydrophobicContact CG1-CB 3.75Å; L92-A105 HydrophobicContact CB-CB 4.28Å; V101-A105 WeakPolarHBondContact O-CB 3.08Å; V101-A105 PolarHBondContact O-N 3.44Å; R102-A105 PolarHBondContact O-N 2.97Å; H103-A105 VanDerWaalsContact C-N 3.29Å; H103-A105 PolarHBondContact O-N 3.36Å; A105-A108 PolarHBondContact O-N 3.03Å; A105-I109 WeakPolarHBondContact O-CD1 3.37Å; A105-I109 WeakPolarHBondContact O-CG1 3.23Å; A105-I109 PolarHBondContact O-N 3.22Å
106	A	98.9	Very high	97.6	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-64.1	-42.9	175.4	0	0	0	0	0	112.5	L92 R102 H103 E104 I109 G110 L121 L132 T135 A139	L92-A106 HydrophobicContact CD1-CB 3.99Å; L92-A106 HydrophobicContact CD2-CB 4.43Å; R102-A106 PolarHBondContact O-N 3.49Å; H103-A106 CarbonylContact O-C 3.55Å; H103-A106 WeakPolarHBondContact O-CA 3.29Å; H103-A106 WeakPolarHBondContact O-CB 3.3Å; H103-A106 PolarHBondContact O-N 3.34Å; E104-A106 PolarHBondContact O-N 3.43Å; A106-I109 PolarHBondContact O-N 3.22Å; A106-G110 PolarHBondContact O-N 3.38Å; A106-L121 HydrophobicContact CB-CD2 3.61Å; A106-L132 HydrophobicContact CB-CD1 4.33Å; A106-T135 HydrophobicContact CB-CG2 3.98Å; A106-A139 WeakPolarHBondContact O-CB 3.43Å
107	E	98.8	Very high	97.5	Very high	17 Å²	17	18.5 Å²	18.5	8%	0.079	11%	0.112	C	C	.	.	H	α-helix	trans	-63.7	-45	175.9	-176.4	157.4	153.4	0	0	111.1	H103 E104 I109 G110 A111 T135	H103-E107 PolarHBondContact O-N 3.46Å; E104-E107 PolarHBondContact O-N 2.6Å; E107-I109 VanDerWaalsContact C-N 3.33Å; E107-I109 PolarHBondContact O-N 3.08Å; E107-G110 CarbonylContact O-C 3.41Å; E107-G110 VanDerWaalsContact O-CA 3.24Å; E107-G110 WeakPolarHBondContact O-CA 3.07Å; E107-G110 PolarHBondContact O-N 3.06Å; E107-A111 PolarHBondContact O-N 2.99Å; E107-T135 HydrophobicContact CB-CG2 3.76Å
108	A	98.7	Very high	97.4	Very high	1 Å²	1	18.4 Å²	18.4	1%	0.008	11%	0.114	C	C	.	.	H	α-helix	trans	-59.9	-40.1	176.6	0	0	0	0	0	112.8	A73 L88 E104 A105 G110 A111 I112	A73-A108 VanDerWaalsContact O-CB 3.25Å; A73-A108 WeakPolarHBondContact O-CB 3.29Å; L88-A108 HydrophobicContact CD1-CB 3.75Å; L88-A108 HydrophobicContact CD2-CB 3.82Å; L88-A108 HydrophobicContact CG-CB 4.41Å; E104-A108 WeakPolarHBondContact O-CB 3.27Å; E104-A108 PolarHBondContact O-N 3.25Å; A105-A108 PolarHBondContact O-N 3.03Å; A108-G110 VanDerWaalsContact C-N 3.32Å; A108-A111 WeakPolarHBondContact O-CB 3.37Å; A108-A111 PolarHBondContact O-N 3.22Å; A108-I112 WeakPolarHBondContact O-CG1 3.29Å; A108-I112 PolarHBondContact O-N 3.45Å
109	I	98.9	Very high	97.2	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-60.6	-45.5	170.9	-67.9	162	0	0	0	110.1	L85 L88 I89 L92 A105 A106 E107 A111 I112 G113 G117 L121	L85-I109 HydrophobicContact CD1-CB 4.49Å; L85-I109 HydrophobicContact CD1-CG1 4.18Å; L85-I109 HydrophobicContact CD1-CG2 3.94Å; L88-I109 HydrophobicContact CB-CD1 4.17Å; L88-I109 HydrophobicContact CB-CG1 3.71Å; L88-I109 HydrophobicContact CD1-CG1 4.45Å; I89-I109 HydrophobicContact CG1-CD1 3.99Å; L92-I109 HydrophobicContact CB-CD1 4.23Å; L92-I109 HydrophobicContact CD2-CD1 3.66Å; A105-I109 WeakPolarHBondContact O-CD1 3.37Å; A105-I109 WeakPolarHBondContact O-CG1 3.23Å; A105-I109 PolarHBondContact O-N 3.22Å; A106-I109 PolarHBondContact O-N 3.22Å; E107-I109 VanDerWaalsContact C-N 3.33Å; E107-I109 PolarHBondContact O-N 3.08Å; I109-A111 VanDerWaalsContact C-N 3.31Å; I109-A111 PolarHBondContact O-N 2.95Å; I109-I112 PolarHBondContact O-N 3.19Å; I109-G113 PolarHBondContact O-N 3.17Å; I109-G117 VanDerWaalsContact CG2-CA 3.41Å; I109-L121 HydrophobicContact CB-CD1 4.36Å; I109-L121 HydrophobicContact CB-CD2 4.42Å; I109-L121 HydrophobicContact CD1-CD2 4.47Å; I109-L121 HydrophobicContact CG2-CD1 3.71Å; I109-L121 HydrophobicContact CG2-CD2 4.39Å; I109-L121 HydrophobicContact CG2-CG 4.02Å
110	G	98.2	Very high	97.2	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-54.7	-46.4	172.4	0	0	0	0	0	112.1	A106 E107 A108 G113 R142	A106-G110 PolarHBondContact O-N 3.38Å; E107-G110 CarbonylContact O-C 3.41Å; E107-G110 VanDerWaalsContact O-CA 3.24Å; E107-G110 WeakPolarHBondContact O-CA 3.07Å; E107-G110 PolarHBondContact O-N 3.06Å; A108-G110 VanDerWaalsContact C-N 3.32Å; G110-G113 PolarHBondContact O-N 3.31Å; G110-R142 PolarHBondContact O-NH1 3.48Å
111	A	95.9	Very high	97.2	Very high	4 Å²	4	22.3 Å²	22.3	3%	0.033	12%	0.119	C	C	.	.	H	α-helix	trans	-61.9	-43.8	-179.2	0	0	0	0	0	112.5	E107 A108 I109 G113 R142 I163	E107-A111 PolarHBondContact O-N 2.99Å; A108-A111 WeakPolarHBondContact O-CB 3.37Å; A108-A111 PolarHBondContact O-N 3.22Å; I109-A111 VanDerWaalsContact C-N 3.31Å; I109-A111 PolarHBondContact O-N 2.95Å; A111-G113 VanDerWaalsContact C-N 3.28Å; A111-G113 PolarHBondContact O-N 2.86Å; A111-R142 VanDerWaalsContact CA-NH1 3.26Å; A111-R142 PolarHBondContact O-NH1 2.94Å; A111-I163 HydrophobicContact CB-CB 4.36Å; A111-I163 HydrophobicContact CB-CG2 3.76Å
112	I	96.9	Very high	97.2	Very high	23 Å²	23	27.3 Å²	27.3	12%	0.118	14%	0.142	C	C	.	.	H	α-helix	trans	-58.8	-40.4	173.9	-70.4	170.9	0	0	0	110.9	V82 A84 L85 L88 A108 I109 D114	V82-I112 HydrophobicContact CB-CG2 4.37Å; V82-I112 HydrophobicContact CG2-CG2 4.46Å; A84-I112 HydrophobicContact CB-CD1 4.37Å; L85-I112 HydrophobicContact CB-CD1 4.46Å; L88-I112 HydrophobicContact CD1-CD1 3.48Å; L88-I112 VanDerWaalsContact CD1-CD1 3.48Å; A108-I112 WeakPolarHBondContact O-CG1 3.29Å; A108-I112 PolarHBondContact O-N 3.45Å; I109-I112 PolarHBondContact O-N 3.19Å; I112-D114 HydrophobicContact CG2-CB 4.09Å
113	G	95.2	Very high	97.1	Very high	10 Å²	10	34 Å²	34	10%	0.103	17%	0.172	C	C	.	.			trans	82.9	7.6	172.4	0	0	0	0	0	115.4	I109 G110 A111 N147	I109-G113 PolarHBondContact O-N 3.17Å; G110-G113 PolarHBondContact O-N 3.31Å; A111-G113 VanDerWaalsContact C-N 3.28Å; A111-G113 PolarHBondContact O-N 2.86Å; G113-N147 PolarHBondContact O-ND2 2.92Å
114	D	95.1	Very high	97.1	Very high	52 Å²	52	35.9 Å²	35.9	28%	0.278	18%	0.179	S	C	.	.			trans	-73.8	129.7	-178.9	-169	-69	0	0	0	111.3	V82 L85 I112 L116 G117	V82-D114 HydrophobicContact CG2-CB 4.2Å; V82-D114 WeakPolarHBondContact CG2-OD2 3.31Å; L85-D114 HydrophobicContact CD2-CB 3.77Å; I112-D114 HydrophobicContact CG2-CB 4.09Å; D114-L116 PolarHBondContact O-N 3.09Å; D114-L116 VanDerWaalsContact O-N 3.13Å; D114-L116 WeakPolarHBondContact OD1-CB 3.43Å; D114-L116 PolarHBondContact OD1-N 3.41Å; D114-G117 PolarHBondContact O-N 3.02Å
115	P	94.2	Very high	97.1	Very high	68 Å²	68	36.7 Å²	36.7	44%	0.442	18%	0.184	S	C	.	.	H	α-helix	trans	-56.8	-25.8	179	-27.7	35.9	0	0	0	115.5	G117 S118	P115-G117 VanDerWaalsContact C-N 3.29Å; P115-S118 WeakPolarHBondContact O-CB 3.36Å; P115-S118 PolarHBondContact O-N 3.07Å
116	L	94.6	Very high	97.1	Very high	85 Å²	85	46 Å²	46	45%	0.445	23%	0.225	S	C	.	.	H	α-helix	trans	-63.3	-38.8	173.6	-180	62.6	0	0	0	111.2	L85 D114 S118 K119	L85-L116 HydrophobicContact CD2-CB 4.2Å; L85-L116 HydrophobicContact CD2-CD2 4.21Å; L85-L116 HydrophobicContact CD2-CG 4.49Å; D114-L116 PolarHBondContact O-N 3.09Å; D114-L116 VanDerWaalsContact O-N 3.13Å; D114-L116 WeakPolarHBondContact OD1-CB 3.43Å; D114-L116 PolarHBondContact OD1-N 3.41Å; L116-S118 VanDerWaalsContact C-N 3.3Å; L116-S118 PolarHBondContact O-N 3.26Å; L116-K119 PolarHBondContact O-N 3.42Å
117	G	95.7	Very high	97.1	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-57.7	-42.6	176.5	0	0	0	0	0	112.3	I109 D114 P115 K119 V120 L121	I109-G117 VanDerWaalsContact CG2-CA 3.41Å; D114-G117 PolarHBondContact O-N 3.02Å; P115-G117 VanDerWaalsContact C-N 3.29Å; G117-K119 VanDerWaalsContact C-N 3.27Å; G117-K119 PolarHBondContact O-N 2.81Å; G117-V120 PolarHBondContact O-N 2.97Å; G117-L121 WeakPolarHBondContact O-CG 3.38Å; G117-L121 PolarHBondContact O-N 3.28Å
118	S	95	Very high	97	Very high	23 Å²	23	52.6 Å²	52.6	16%	0.161	27%	0.269	C	S	.	.	H	α-helix	trans	-56	-39.5	178.6	-169	0	0	0	0	112.7	P115 L116 V120 L121 E122	P115-S118 WeakPolarHBondContact O-CB 3.36Å; P115-S118 PolarHBondContact O-N 3.07Å; L116-S118 VanDerWaalsContact C-N 3.3Å; L116-S118 PolarHBondContact O-N 3.26Å; S118-V120 VanDerWaalsContact C-N 3.26Å; S118-V120 PolarHBondContact O-N 2.88Å; S118-L121 PolarHBondContact O-N 2.78Å; S118-E122 VanDerWaalsContact O-CG 3.24Å; S118-E122 WeakPolarHBondContact O-CG 3.26Å; S118-E122 PolarHBondContact O-N 3.09Å; S118-E122 VanDerWaalsContact O-N 3.1Å
119	K	94.9	Very high	97	Very high	153 Å²	153	55 Å²	55	67%	0.665	28%	0.282	S	S	*	.	H	α-helix	trans	-65.2	-30	-179.8	-65.6	-179.6	-179.3	174.5	0	112.9	L116 G117	L116-K119 PolarHBondContact O-N 3.42Å; G117-K119 VanDerWaalsContact C-N 3.27Å; G117-K119 PolarHBondContact O-N 2.81Å
120	V	97.2	Very high	96.9	Very high	16 Å²	16	57.6 Å²	57.6	10%	0.097	30%	0.3	C	S	.	.	H	α-helix	trans	-79.8	-46.2	177.1	179.7	0	0	0	0	110.1	I89 L92 G117 S118 E122 K123 Y124	I89-V120 HydrophobicContact CD1-CG2 3.92Å; I89-V120 HydrophobicContact CG1-CB 4.34Å; I89-V120 HydrophobicContact CG1-CG1 4.31Å; I89-V120 HydrophobicContact CG1-CG2 4.08Å; I89-V120 HydrophobicContact CG2-CG1 4.04Å; I89-V120 HydrophobicContact CG2-CG2 4.12Å; L92-V120 HydrophobicContact CD2-CG1 4.04Å; G117-V120 PolarHBondContact O-N 2.97Å; S118-V120 VanDerWaalsContact C-N 3.26Å; S118-V120 PolarHBondContact O-N 2.88Å; V120-E122 VanDerWaalsContact C-N 3.25Å; V120-E122 PolarHBondContact O-N 3.35Å; V120-K123 VanDerWaalsContact O-CB 3.31Å; V120-K123 WeakPolarHBondContact O-CB 3.3Å; V120-K123 WeakPolarHBondContact O-CG 3.31Å; V120-K123 PolarHBondContact O-N 2.94Å; V120-Y124 HydrophobicContact CG1-CE2 4.4Å
121	L	98.8	Very high	96.9	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-56.2	-38.5	179.4	-68.1	165.9	0	0	0	112.5	L92 A106 I109 G117 S118 K123 Y124 V125 C136 A139 V140 I143	L92-L121 HydrophobicContact CD2-CD2 3.83Å; A106-L121 HydrophobicContact CB-CD2 3.61Å; I109-L121 HydrophobicContact CB-CD1 4.36Å; I109-L121 HydrophobicContact CB-CD2 4.42Å; I109-L121 HydrophobicContact CD1-CD2 4.47Å; I109-L121 HydrophobicContact CG2-CD1 3.71Å; I109-L121 HydrophobicContact CG2-CD2 4.39Å; I109-L121 HydrophobicContact CG2-CG 4.02Å; G117-L121 WeakPolarHBondContact O-CG 3.38Å; G117-L121 PolarHBondContact O-N 3.28Å; S118-L121 PolarHBondContact O-N 2.78Å; L121-K123 PolarHBondContact O-N 3.18Å; L121-Y124 PolarHBondContact O-N 3.01Å; L121-V125 PolarHBondContact O-N 3.43Å; L121-C136 HydrophobicContact CB-CB 4.48Å; L121-C136 HydrophobicContact CD2-CB 4.42Å; L121-A139 HydrophobicContact CD1-CB 3.6Å; L121-A139 HydrophobicContact CD2-CB 4.18Å; L121-V140 HydrophobicContact CB-CG2 3.58Å; L121-V140 HydrophobicContact CD1-CG2 4.34Å; L121-I143 HydrophobicContact CD1-CD1 3.64Å
122	E	98.3	Very high	97	Very high	105 Å²	105	59.6 Å²	59.6	49%	0.491	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-22.8	176.3	-76.5	-76	-170.8	0	0	114.2	S118 V120 Y124 V125 V140	S118-E122 VanDerWaalsContact O-CG 3.24Å; S118-E122 WeakPolarHBondContact O-CG 3.26Å; S118-E122 PolarHBondContact O-N 3.09Å; S118-E122 VanDerWaalsContact O-N 3.1Å; V120-E122 VanDerWaalsContact C-N 3.25Å; V120-E122 PolarHBondContact O-N 3.35Å; E122-Y124 PolarHBondContact O-N 3.22Å; E122-V125 WeakPolarHBondContact O-CG2 3.31Å; E122-V140 HydrophobicContact CG-CG2 4.15Å
123	K	98.1	Very high	97.1	Very high	152 Å²	152	58.9 Å²	58.9	66%	0.661	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-22.7	175	-59.4	176.1	-176.2	175	0	112.7	V120 L121	V120-K123 VanDerWaalsContact O-CB 3.31Å; V120-K123 WeakPolarHBondContact O-CB 3.3Å; V120-K123 WeakPolarHBondContact O-CG 3.31Å; V120-K123 PolarHBondContact O-N 2.94Å; L121-K123 PolarHBondContact O-N 3.18Å
124	Y	98.5	Very high	97.3	Very high	40 Å²	40	59.8 Å²	59.8	16%	0.157	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.8	-3.1	-170	-60.3	-80.4	0	0	0	113.7	L92 S93 V120 L121 E122 K126 S127 L132 A133 C136	L92-Y124 HydrophobicContact CD1-CD2 4.16Å; L92-Y124 HydrophobicContact CD1-CE2 4.45Å; L92-Y124 HydrophobicContact CD1-CG 4.39Å; L92-Y124 HydrophobicContact CD2-CD2 4.09Å; L92-Y124 HydrophobicContact CD2-CE2 4.27Å; L92-Y124 HydrophobicContact CG-CD2 4.06Å; L92-Y124 HydrophobicContact CG-CE2 4Å; S93-Y124 WeakPolarHBondContact CA-OH 3.47Å; V120-Y124 HydrophobicContact CG1-CE2 4.4Å; L121-Y124 PolarHBondContact O-N 3.01Å; E122-Y124 PolarHBondContact O-N 3.22Å; Y124-K126 PolarHBondContact O-N 2.87Å; Y124-S127 VanDerWaalsContact O-CB 3.23Å; Y124-S127 WeakPolarHBondContact O-CB 3.43Å; Y124-S127 PolarHBondContact O-N 3.35Å; Y124-L132 HydrophobicContact CD1-CD2 4.12Å; Y124-A133 WeakPolarHBondContact O-CA 3.29Å; Y124-C136 VanDerWaalsContact CB-SG 3.51Å
125	V	98.6	Very high	97.5	Very high	22 Å²	22	57.4 Å²	57.4	13%	0.133	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-14.6	178.2	-61.2	0	0	0	0	114.3	L121 E122 C136 Q137 V140	L121-V125 PolarHBondContact O-N 3.43Å; E122-V125 WeakPolarHBondContact O-CG2 3.31Å; V125-C136 HydrophobicContact CG1-CB 3.94Å; V125-Q137 HydrophobicContact CB-CG 3.95Å; V125-Q137 HydrophobicContact CG1-CG 4.3Å; V125-Q137 PolarHBondContact O-NE2 3.11Å; V125-V140 HydrophobicContact CG1-CG2 4.12Å
126	K	98.2	Very high	97.7	Very high	194 Å²	194	54.2 Å²	54.2	84%	0.843	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.8	26.8	173.4	-61.5	-179.4	-175.7	177.7	0	112.4	Y124	Y124-K126 PolarHBondContact O-N 2.87Å
127	S	98.4	Very high	97.9	Very high	21 Å²	21	54.6 Å²	54.6	15%	0.147	27%	0.274	C	S	.	.			trans	-53.2	143.3	175.1	178.9	0	0	0	0	110.6	Y124 I129	Y124-S127 VanDerWaalsContact O-CB 3.23Å; Y124-S127 WeakPolarHBondContact O-CB 3.43Å; Y124-S127 PolarHBondContact O-N 3.35Å; S127-I129 PolarHBondContact O-N 3.26Å; S127-I129 PolarHBondContact OG-N 3.39Å; S127-I129 VanDerWaalsContact OG-N 3.16Å
128	P	97.8	Very high	98.1	Very high	135 Å²	135	54.8 Å²	54.8	88%	0.877	28%	0.275	S	S	*	.	S	Bend	trans	-67.5	-15	170.8	29.5	-35.9	0	0	0	112.9
129	I	97.9	Very high	98.2	Very high	53 Å²	53	53.8 Å²	53.8	27%	0.272	27%	0.268	S	S	.	.	S	Bend	trans	-84.9	110.7	171.4	-56.4	171.1	0	0	0	107.2	A99 S127 E131 L132 A133	A99-I129 HydrophobicContact CB-CG2 3.86Å; S127-I129 PolarHBondContact O-N 3.26Å; S127-I129 PolarHBondContact OG-N 3.39Å; S127-I129 VanDerWaalsContact OG-N 3.16Å; I129-E131 PolarHBondContact O-N 3.46Å; I129-L132 HydrophobicContact CB-CB 3.99Å; I129-L132 HydrophobicContact CG2-CB 3.96Å; I129-L132 PolarHBondContact O-N 2.88Å; I129-A133 PolarHBondContact O-N 3.05Å
130	S	98.1	Very high	98.4	Very high	54 Å²	54	47.6 Å²	47.6	38%	0.378	24%	0.243	S	C	.	.	H	α-helix	trans	-57.9	-47.7	-171.2	-164.6	0	0	0	0	112	L132 A133 E134	S130-L132 VanDerWaalsContact C-N 3.29Å; S130-L132 PolarHBondContact O-N 3.44Å; S130-A133 PolarHBondContact O-N 3.32Å; S130-E134 WeakPolarHBondContact O-CB 3.21Å; S130-E134 VanDerWaalsContact O-CG 3.29Å; S130-E134 WeakPolarHBondContact O-CG 3.49Å; S130-E134 PolarHBondContact O-N 3.2Å
131	E	97.8	Very high	98.4	Very high	45 Å²	45	51 Å²	51	21%	0.21	26%	0.257	C	S	.	.	H	α-helix	trans	-61.3	-40.2	-178.3	-59.8	81.6	177.1	0	0	111.1	I129 T135 A224 L225 M258	I129-E131 PolarHBondContact O-N 3.46Å; E131-T135 VanDerWaalsContact O-CB 3.25Å; E131-T135 WeakPolarHBondContact O-CB 3.27Å; E131-T135 PolarHBondContact O-N 2.9Å; E131-T135 PolarHBondContact O-OG1 2.7Å; E131-A224 HydrophobicContact CG-CB 4.4Å; E131-L225 HydrophobicContact CB-CB 4.48Å; E131-L225 HydrophobicContact CG-CB 4.44Å; E131-M258 HydrophobicContact CB-SD 4.4Å; E131-M258 HydrophobicContact CG-SD 3.83Å
132	L	98.7	Very high	98.2	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-68.7	-43.8	176.8	-175.9	59.1	0	0	0	111.6	L92 R102 A106 Y124 I129 S130 C136	L92-L132 HydrophobicContact CD1-CD1 3.66Å; R102-L132 HydrophobicContact CB-CD1 4.08Å; R102-L132 HydrophobicContact CB-CD2 4.49Å; A106-L132 HydrophobicContact CB-CD1 4.33Å; Y124-L132 HydrophobicContact CD1-CD2 4.12Å; I129-L132 HydrophobicContact CB-CB 3.99Å; I129-L132 HydrophobicContact CG2-CB 3.96Å; I129-L132 PolarHBondContact O-N 2.88Å; S130-L132 VanDerWaalsContact C-N 3.29Å; S130-L132 PolarHBondContact O-N 3.44Å; L132-C136 WeakPolarHBondContact O-CB 3.32Å; L132-C136 PolarHBondContact O-N 3.28Å; L132-C136 PolarHBondContact O-SG 2.91Å
133	A	98.8	Very high	98.1	Very high	8 Å²	8	46.5 Å²	46.5	7%	0.066	24%	0.235	C	C	.	.	H	α-helix	trans	-62.8	-49.3	178.8	0	0	0	0	0	111.7	Y124 I129 S130 C136 Q137	Y124-A133 WeakPolarHBondContact O-CA 3.29Å; I129-A133 PolarHBondContact O-N 3.05Å; S130-A133 PolarHBondContact O-N 3.32Å; A133-C136 PolarHBondContact O-N 3.07Å; A133-Q137 VanDerWaalsContact O-CG 3.22Å; A133-Q137 WeakPolarHBondContact O-CG 3.48Å; A133-Q137 PolarHBondContact O-N 3.06Å
134	E	98.8	Very high	98	Very high	30 Å²	30	42.2 Å²	42.2	14%	0.14	23%	0.228	C	C	.	.	H	α-helix	trans	-60.6	-45.1	178.6	-73.1	178.1	163.4	0	0	111.2	S130 C136 Q137 L138 L192 S223 L225	S130-E134 WeakPolarHBondContact O-CB 3.21Å; S130-E134 VanDerWaalsContact O-CG 3.29Å; S130-E134 WeakPolarHBondContact O-CG 3.49Å; S130-E134 PolarHBondContact O-N 3.2Å; E134-C136 PolarHBondContact O-N 3.19Å; E134-Q137 WeakPolarHBondContact O-CB 3.21Å; E134-Q137 PolarHBondContact O-N 3.26Å; E134-L138 WeakPolarHBondContact O-CG 3.49Å; E134-L138 PolarHBondContact O-N 2.89Å; E134-L192 HydrophobicContact CB-CD2 3.63Å; E134-L192 HydrophobicContact CG-CD2 3.84Å; E134-S223 WeakPolarHBondContact OE1-CB 3.27Å; E134-S223 PolarHBondContact OE1-OG 2.99Å; E134-S223 WeakPolarHBondContact OE2-CB 3.42Å; E134-S223 PolarHBondContact OE2-OG 3.05Å; E134-L225 HydrophobicContact CB-CD2 3.48Å; E134-L225 VanDerWaalsContact CB-CD2 3.48Å; E134-L225 WeakPolarHBondContact OE2-CB 3.48Å
135	T	98.9	Very high	97.6	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.012	23%	0.226	C	C	.	.	H	α-helix	trans	-64.1	-42.9	177.9	-55.6	0	0	0	0	111.8	H103 A106 E107 E131 Q137 L138 A139 L225	H103-T135 HydrophobicContact CB-CG2 4.19Å; H103-T135 WeakPolarHBondContact CB-OG1 3.35Å; H103-T135 VanDerWaalsContact O-CG2 3.28Å; H103-T135 WeakPolarHBondContact O-CG2 3.26Å; A106-T135 HydrophobicContact CB-CG2 3.98Å; E107-T135 HydrophobicContact CB-CG2 3.76Å; E131-T135 VanDerWaalsContact O-CB 3.25Å; E131-T135 WeakPolarHBondContact O-CB 3.27Å; E131-T135 PolarHBondContact O-N 2.9Å; E131-T135 PolarHBondContact O-OG1 2.7Å; T135-Q137 VanDerWaalsContact C-N 3.32Å; T135-Q137 PolarHBondContact O-N 2.7Å; T135-L138 PolarHBondContact O-N 2.78Å; T135-A139 VanDerWaalsContact O-CB 3.28Å; T135-A139 WeakPolarHBondContact O-CB 3.39Å; T135-A139 PolarHBondContact O-N 3.38Å; T135-L225 VanDerWaalsContact OG1-CD1 3.31Å; T135-L225 WeakPolarHBondContact OG1-CD1 3.42Å; T135-L225 WeakPolarHBondContact OG1-CD2 3.46Å
136	C	98.9	Very high	97.2	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-63.5	-38.2	176.4	-67.3	0	0	0	0	112.1	L121 Y124 V125 L132 A133 E134 A139 V140	L121-C136 HydrophobicContact CB-CB 4.48Å; L121-C136 HydrophobicContact CD2-CB 4.42Å; Y124-C136 VanDerWaalsContact CB-SG 3.51Å; V125-C136 HydrophobicContact CG1-CB 3.94Å; L132-C136 WeakPolarHBondContact O-CB 3.32Å; L132-C136 PolarHBondContact O-N 3.28Å; L132-C136 PolarHBondContact O-SG 2.91Å; A133-C136 PolarHBondContact O-N 3.07Å; E134-C136 PolarHBondContact O-N 3.19Å; C136-A139 PolarHBondContact O-N 3.5Å; C136-V140 WeakPolarHBondContact O-CB 3.39Å; C136-V140 VanDerWaalsContact O-CG2 3.26Å; C136-V140 WeakPolarHBondContact O-CG2 3.25Å; C136-V140 PolarHBondContact O-N 2.88Å
137	Q	98.7	Very high	96.6	Very high	93 Å²	93	38.1 Å²	38.1	44%	0.435	22%	0.215	S	C	.	.	H	α-helix	trans	-62.9	-45.4	175.3	-69.7	164.1	30.3	0	0	111.5	V125 A133 E134 T135 K141	V125-Q137 HydrophobicContact CB-CG 3.95Å; V125-Q137 HydrophobicContact CG1-CG 4.3Å; V125-Q137 PolarHBondContact O-NE2 3.11Å; A133-Q137 VanDerWaalsContact O-CG 3.22Å; A133-Q137 WeakPolarHBondContact O-CG 3.48Å; A133-Q137 PolarHBondContact O-N 3.06Å; E134-Q137 WeakPolarHBondContact O-CB 3.21Å; E134-Q137 PolarHBondContact O-N 3.26Å; T135-Q137 VanDerWaalsContact C-N 3.32Å; T135-Q137 PolarHBondContact O-N 2.7Å; Q137-K141 WeakPolarHBondContact O-CB 3.11Å; Q137-K141 PolarHBondContact O-N 3.35Å; Q137-K141 VanDerWaalsContact O-N 3.09Å
138	L	98.7	Very high	96.1	Very high	4 Å²	4	40.9 Å²	40.9	2%	0.021	23%	0.228	C	C	.	.	H	α-helix	trans	-62.1	-48	175.5	-70.9	170.1	0	0	0	111.1	E134 T135 K141 R142 L192 W193 Y196 L225	E134-L138 WeakPolarHBondContact O-CG 3.49Å; E134-L138 PolarHBondContact O-N 2.89Å; T135-L138 PolarHBondContact O-N 2.78Å; L138-K141 PolarHBondContact O-N 3.09Å; L138-R142 VanDerWaalsContact O-CB 3.32Å; L138-R142 WeakPolarHBondContact O-CB 3.32Å; L138-R142 PolarHBondContact O-N 2.98Å; L138-L192 HydrophobicContact CD1-CD2 3.93Å; L138-L192 HydrophobicContact CD1-CG 4.35Å; L138-L192 HydrophobicContact CD2-CD2 4.42Å; L138-L192 HydrophobicContact CD2-CG 4.26Å; L138-L192 HydrophobicContact CG-CD2 4.11Å; L138-L192 HydrophobicContact CG-CG 4.47Å; L138-W193 HydrophobicContact CD2-CB 4.4Å; L138-W193 HydrophobicContact CD2-CE3 3.99Å; L138-Y196 HydrophobicContact CD1-CD1 3.88Å; L138-Y196 HydrophobicContact CD1-CD2 4.22Å; L138-Y196 HydrophobicContact CD1-CE1 3.52Å; L138-Y196 HydrophobicContact CD1-CE2 3.87Å; L138-Y196 HydrophobicContact CD1-CG 4.23Å; L138-Y196 HydrophobicContact CD2-CD1 4.28Å; L138-Y196 HydrophobicContact CD2-CD2 4.36Å; L138-Y196 HydrophobicContact CD2-CG 4.11Å; L138-L225 HydrophobicContact CD1-CD2 4.1Å
139	A	98.7	Very high	94.9	Very high	3 Å²	3	39.1 Å²	39.1	3%	0.025	22%	0.224	C	C	.	.	H	α-helix	trans	-63.3	-43.4	-178.9	0	0	0	0	0	112.8	A106 L121 T135 C136 R142 I143	A106-A139 WeakPolarHBondContact O-CB 3.43Å; L121-A139 HydrophobicContact CD1-CB 3.6Å; L121-A139 HydrophobicContact CD2-CB 4.18Å; T135-A139 VanDerWaalsContact O-CB 3.28Å; T135-A139 WeakPolarHBondContact O-CB 3.39Å; T135-A139 PolarHBondContact O-N 3.38Å; C136-A139 PolarHBondContact O-N 3.5Å; A139-R142 WeakPolarHBondContact O-CB 3.47Å; A139-R142 PolarHBondContact O-N 3.01Å; A139-I143 VanDerWaalsContact O-CG1 3.3Å; A139-I143 WeakPolarHBondContact O-CG1 3.37Å; A139-I143 PolarHBondContact O-N 3.01Å
140	V	98.6	Very high	93.7	Very high	22 Å²	22	42.8 Å²	42.8	13%	0.133	25%	0.245	C	C	.	.	H	α-helix	trans	-59.5	-48.3	173.4	167.1	0	0	0	0	110.4	L121 E122 V125 C136 R142 I143 A144	L121-V140 HydrophobicContact CB-CG2 3.58Å; L121-V140 HydrophobicContact CD1-CG2 4.34Å; E122-V140 HydrophobicContact CG-CG2 4.15Å; V125-V140 HydrophobicContact CG1-CG2 4.12Å; C136-V140 WeakPolarHBondContact O-CB 3.39Å; C136-V140 VanDerWaalsContact O-CG2 3.26Å; C136-V140 WeakPolarHBondContact O-CG2 3.25Å; C136-V140 PolarHBondContact O-N 2.88Å; V140-R142 VanDerWaalsContact C-N 3.3Å; V140-R142 PolarHBondContact O-N 3.42Å; V140-I143 PolarHBondContact O-N 3.5Å; V140-A144 WeakPolarHBondContact O-CB 3.46Å; V140-A144 PolarHBondContact O-N 2.75Å
141	K	96.9	Very high	92.3	Very high	89 Å²	89	44.9 Å²	44.9	39%	0.387	25%	0.247	S	C	.	.	H	α-helix	trans	-65.7	-35	-179.4	-167.9	163.7	177.8	-172.6	0	112	Q137 L138 A144 W145 W193	Q137-K141 WeakPolarHBondContact O-CB 3.11Å; Q137-K141 PolarHBondContact O-N 3.35Å; Q137-K141 VanDerWaalsContact O-N 3.09Å; L138-K141 PolarHBondContact O-N 3.09Å; K141-A144 PolarHBondContact O-N 3.01Å; K141-W145 VanDerWaalsContact O-CB 3.27Å; K141-W145 WeakPolarHBondContact O-CB 3.4Å; K141-W145 PolarHBondContact O-N 3.49Å; K141-W193 HydrophobicContact CB-CD2 4.27Å; K141-W193 HydrophobicContact CB-CE3 3.78Å; K141-W193 HydrophobicContact CB-CH2 4.46Å; K141-W193 HydrophobicContact CB-CZ3 3.9Å; K141-W193 HydrophobicContact CD-CB 3.8Å; K141-W193 HydrophobicContact CD-CD2 3.4Å; K141-W193 HydrophobicContact CD-CE3 3.77Å; K141-W193 HydrophobicContact CD-CG 3.43Å; K141-W193 VanDerWaalsContact CD-CG 3.43Å; K141-W193 HydrophobicContact CG-CD2 3.68Å; K141-W193 HydrophobicContact CG-CE3 3.7Å; K141-W193 HydrophobicContact CG-CG 4.26Å; K141-W193 HydrophobicContact CG-CH2 4.17Å; K141-W193 HydrophobicContact CG-CZ2 4.13Å; K141-W193 HydrophobicContact CG-CZ3 3.96Å
142	R	95.5	Very high	90.6	Very high	6 Å²	6	50.2 Å²	50.2	2%	0.023	28%	0.277	C	S	.	.	H	α-helix	trans	-63.7	-47.3	173.1	-170.4	-172.8	-176.8	-77.9	-11.2	112.3	G110 A111 L138 A139 V140 A144 W145 L146 D164 P165 W193	G110-R142 PolarHBondContact O-NH1 3.48Å; A111-R142 VanDerWaalsContact CA-NH1 3.26Å; A111-R142 PolarHBondContact O-NH1 2.94Å; L138-R142 VanDerWaalsContact O-CB 3.32Å; L138-R142 WeakPolarHBondContact O-CB 3.32Å; L138-R142 PolarHBondContact O-N 2.98Å; A139-R142 WeakPolarHBondContact O-CB 3.47Å; A139-R142 PolarHBondContact O-N 3.01Å; V140-R142 VanDerWaalsContact C-N 3.3Å; V140-R142 PolarHBondContact O-N 3.42Å; R142-A144 VanDerWaalsContact C-N 3.34Å; R142-W145 PolarHBondContact O-N 3.08Å; R142-L146 WeakPolarHBondContact O-CB 3.42Å; R142-L146 WeakPolarHBondContact O-CG 3.47Å; R142-L146 PolarHBondContact O-N 3.23Å; R142-D164 PolarHBondContact NE-O 3.18Å; R142-P165 WeakPolarHBondContact CB-O 3.49Å; R142-P165 WeakPolarHBondContact CD-O 3.27Å; R142-W193 HydrophobicContact CB-CH2 4.25Å; R142-W193 HydrophobicContact CB-CZ3 4.07Å
143	I	96	Very high	89	Confident	4 Å²	4	52.2 Å²	52.2	2%	0.021	29%	0.288	C	S	.	.	H	α-helix	trans	-61.7	-45.3	177	-66.9	165.1	0	0	0	109.9	L121 A139 V140 W145 L146 N147	L121-I143 HydrophobicContact CD1-CD1 3.64Å; A139-I143 VanDerWaalsContact O-CG1 3.3Å; A139-I143 WeakPolarHBondContact O-CG1 3.37Å; A139-I143 PolarHBondContact O-N 3.01Å; V140-I143 PolarHBondContact O-N 3.5Å; I143-W145 PolarHBondContact O-N 2.9Å; I143-L146 PolarHBondContact O-N 3.33Å; I143-N147 PolarHBondContact O-N 2.92Å; I143-N147 VanDerWaalsContact O-N 3.14Å; I143-N147 PolarHBondContact O-ND2 3.24Å
144	A	94.5	Very high	86.9	Confident	61 Å²	61	54.6 Å²	54.6	50%	0.504	30%	0.303	S	S	.	.	H	α-helix	trans	-58.4	-47.7	175.6	0	0	0	0	0	111.5	V140 K141 R142 L146 N147 D148	V140-A144 WeakPolarHBondContact O-CB 3.46Å; V140-A144 PolarHBondContact O-N 2.75Å; K141-A144 PolarHBondContact O-N 3.01Å; R142-A144 VanDerWaalsContact C-N 3.34Å; A144-L146 PolarHBondContact O-N 3.04Å; A144-N147 CarbonylContact O-C 3.56Å; A144-N147 PolarHBondContact O-N 3.39Å; A144-D148 PolarHBondContact O-N 3.46Å
145	W	91.8	Very high	84.8	Confident	29 Å²	29	55.7 Å²	55.7	11%	0.11	31%	0.308	C	S	.	.	H	α-helix	trans	-61.4	-39	177.1	174.6	82.5	0	0	0	113	K141 R142 I143 N147 D148 D153 F155 P167 W193	K141-W145 VanDerWaalsContact O-CB 3.27Å; K141-W145 WeakPolarHBondContact O-CB 3.4Å; K141-W145 PolarHBondContact O-N 3.49Å; R142-W145 PolarHBondContact O-N 3.08Å; I143-W145 PolarHBondContact O-N 2.9Å; W145-N147 VanDerWaalsContact C-N 3.31Å; W145-N147 PolarHBondContact O-N 2.96Å; W145-D148 PolarHBondContact O-N 3.37Å; W145-D153 HydrophobicContact CZ2-CB 4.5Å; W145-F155 HydrophobicContact CH2-CB 4.01Å; W145-F155 AromaticContact CH2-CD2 3.3Å; W145-F155 HydrophobicContact CH2-CD2 3.3Å; W145-F155 HydrophobicContact CH2-CE2 4.12Å; W145-F155 HydrophobicContact CH2-CG 4.05Å; W145-F155 HydrophobicContact CZ2-CD2 4.33Å; W145-F155 AromaticContact CZ3-CD2 3.43Å; W145-F155 HydrophobicContact CZ3-CD2 3.43Å; W145-F155 VanDerWaalsContact CZ3-CD2 3.43Å; W145-F155 AromaticContact CZ3-CE2 3.8Å; W145-F155 HydrophobicContact CZ3-CE2 3.8Å; W145-F155 HydrophobicContact CZ3-CG 4.37Å; W145-P167 HydrophobicContact CD2-CG 3.94Å; W145-P167 HydrophobicContact CE3-CG 4.42Å; W145-P167 HydrophobicContact CG-CG 4.38Å; W145-P167 HydrophobicContact CH2-CB 4.12Å; W145-P167 HydrophobicContact CZ2-CB 3.82Å; W145-P167 HydrophobicContact CZ2-CG 4.02Å; W145-W193 HydrophobicContact CB-CH2 4.24Å; W145-W193 HydrophobicContact CB-CZ2 4.22Å; W145-W193 HydrophobicContact CG-CZ2 4.3Å
146	L	89.5	Confident	82.5	Confident	48 Å²	48	60.8 Å²	60.8	25%	0.251	33%	0.334	S	S	.	.	H	α-helix	trans	-64.8	-36.6	178	-83.7	178.5	0	0	0	113.1	R142 I143 A144 K151	R142-L146 WeakPolarHBondContact O-CB 3.42Å; R142-L146 WeakPolarHBondContact O-CG 3.47Å; R142-L146 PolarHBondContact O-N 3.23Å; I143-L146 PolarHBondContact O-N 3.33Å; A144-L146 PolarHBondContact O-N 3.04Å; L146-K151 PolarHBondContact O-NZ 3.34Å; L146-K151 VanDerWaalsContact O-NZ 3.11Å
147	N	86.1	Confident	80.5	Confident	93 Å²	93	66.8 Å²	66.8	50%	0.497	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	1.2	-177.2	-69.5	-82.3	0	0	0	112.9	G113 I143 A144 W145	G113-N147 PolarHBondContact O-ND2 2.92Å; I143-N147 PolarHBondContact O-N 2.92Å; I143-N147 VanDerWaalsContact O-N 3.14Å; I143-N147 PolarHBondContact O-ND2 3.24Å; A144-N147 CarbonylContact O-C 3.56Å; A144-N147 PolarHBondContact O-N 3.39Å; W145-N147 VanDerWaalsContact C-N 3.31Å; W145-N147 PolarHBondContact O-N 2.96Å
148	D	86.6	Confident	78.3	Confident	80 Å²	80	65.6 Å²	65.6	43%	0.428	38%	0.375	S	S	.	.			trans	-73.2	124.3	172.4	-167.2	-16.4	0	0	0	110.1	A144 W145 D150	A144-D148 PolarHBondContact O-N 3.46Å; W145-D148 PolarHBondContact O-N 3.37Å; D148-D150 VanDerWaalsContact C-N 3.28Å; D148-D150 PolarHBondContact O-N 3.01Å; D148-D150 PolarHBondContact OD1-N 3.36Å
149	A	73.2	Confident	76.9	Confident	97 Å²	97	73.3 Å²	73.3	80%	0.802	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-25.3	-180	0	0	0	0	0	112.4
150	D	72.7	Confident	75.8	Confident	130 Å²	130	74.5 Å²	74.5	70%	0.695	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	18.4	-174	-65.4	-38.9	0	0	0	112.6	D148 N152	D148-D150 VanDerWaalsContact C-N 3.28Å; D148-D150 PolarHBondContact O-N 3.01Å; D148-D150 PolarHBondContact OD1-N 3.36Å; D150-N152 PolarHBondContact O-N 3.39Å; D150-N152 PolarHBondContact O-ND2 3.15Å
151	K	68	Low	74.6	Confident	99 Å²	99	76.9 Å²	76.9	43%	0.43	43%	0.431	S	S	.	.			trans	-63.1	113.8	-178.6	69.8	-172.2	178.3	-169.3	0	111.4	L146	L146-K151 PolarHBondContact O-NZ 3.34Å; L146-K151 VanDerWaalsContact O-NZ 3.11Å
152	N	62.7	Low	74	Confident	156 Å²	156	73 Å²	73	83%	0.834	42%	0.415	S	S	*	.			trans	-97.6	-10.5	176.3	-69.6	-45.5	0	0	0	113.1	D150	D150-N152 PolarHBondContact O-N 3.39Å; D150-N152 PolarHBondContact O-ND2 3.15Å
153	D	64.5	Low	73.8	Confident	42 Å²	42	73.2 Å²	73.2	23%	0.225	42%	0.416	C	S	.	.	S	Bend	trans	-85.7	133.6	-177.2	-63.4	-31.6	0	0	0	111.1	W145 F155 P170 R197	W145-D153 HydrophobicContact CZ2-CB 4.5Å; D153-F155 PolarHBondContact O-N 3.26Å; D153-P170 WeakPolarHBondContact OD1-CD 3.4Å; D153-P170 WeakPolarHBondContact OD1-CG 3.44Å; D153-R197 VanDerWaalsContact CG-NH2 3.27Å; D153-R197 IonicContact OD1-NH2 2.65Å; D153-R197 IonicContact OD2-CZ 3.56Å; D153-R197 IonicContact OD2-NH1 3.91Å; D153-R197 IonicContact OD2-NH2 3.81Å; D153-R197 PolarHBondContact OD2-NH2 2.99Å
154	C	55.4	Low	73.6	Confident	59 Å²	59	73.4 Å²	73.4	40%	0.399	42%	0.418	S	S	.	.			trans	-77	123.3	179.4	55.3	0	0	0	0	110.9	L156	C154-L156 HydrophobicContact CB-CD2 4.49Å; C154-L156 HydrophobicContact CB-CG 4.06Å; C154-L156 PolarHBondContact O-N 3Å
155	F	54.8	Low	73.6	Confident	52 Å²	52	70.8 Å²	70.8	23%	0.228	40%	0.395	C	S	.	.			trans	-77.7	79	156.3	-139.6	-98.7	0	0	0	106.5	W145 D153 Q157 D164 P167	W145-F155 HydrophobicContact CH2-CB 4.01Å; W145-F155 AromaticContact CH2-CD2 3.3Å; W145-F155 HydrophobicContact CH2-CD2 3.3Å; W145-F155 HydrophobicContact CH2-CE2 4.12Å; W145-F155 HydrophobicContact CH2-CG 4.05Å; W145-F155 HydrophobicContact CZ2-CD2 4.33Å; W145-F155 AromaticContact CZ3-CD2 3.43Å; W145-F155 HydrophobicContact CZ3-CD2 3.43Å; W145-F155 VanDerWaalsContact CZ3-CD2 3.43Å; W145-F155 AromaticContact CZ3-CE2 3.8Å; W145-F155 HydrophobicContact CZ3-CE2 3.8Å; W145-F155 HydrophobicContact CZ3-CG 4.37Å; D153-F155 PolarHBondContact O-N 3.26Å; F155-Q157 VanDerWaalsContact C-N 3.34Å; F155-Q157 HydrophobicContact CD1-CG 4.25Å; F155-Q157 PolarHBondContact O-N 3.18Å; F155-D164 HydrophobicContact CZ-CB 4.45Å; F155-P167 HydrophobicContact CD2-CB 4.09Å; F155-P167 HydrophobicContact CE2-CB 4.32Å
156	L	51.7	Low	73.8	Confident	110 Å²	110	69.4 Å²	69.4	58%	0.576	39%	0.39	S	S	*	.			trans	-63.9	99.9	171.4	-74.8	170.5	0	0	0	107.7	C154 G158	C154-L156 HydrophobicContact CB-CD2 4.49Å; C154-L156 HydrophobicContact CB-CG 4.06Å; C154-L156 PolarHBondContact O-N 3Å; L156-G158 PolarHBondContact O-N 3.07Å
157	Q	55	Low	73.9	Confident	125 Å²	125	67.1 Å²	67.1	58%	0.584	38%	0.378	S	S	*	.			trans	-69.9	23.1	166.5	-71.3	-171.1	-47	0	0	112.1	F155	F155-Q157 VanDerWaalsContact C-N 3.34Å; F155-Q157 HydrophobicContact CD1-CG 4.25Å; F155-Q157 PolarHBondContact O-N 3.18Å
158	G	54.2	Low	74.2	Confident	69 Å²	69	63 Å²	63	71%	0.711	36%	0.357	S	S	*	.	S	Bend	trans	-89.2	-10.2	-150.3	0	0	0	0	0	116.8	L156	L156-G158 PolarHBondContact O-N 3.07Å
159	R	68.2	Low	74.5	Confident	166 Å²	166	61.6 Å²	61.6	63%	0.626	35%	0.347	S	S	*	.	S	Bend	trans	-143.9	-34.9	-178	-174.4	175.5	-73.8	158.5	-4.4	113.8	N204	R159-N204 PolarHBondContact NH1-O 2.65Å
160	F	75.6	Confident	75.1	Confident	28 Å²	28	61 Å²	61	12%	0.123	34%	0.335	C	S	.	.			trans	-111.7	133.3	-178.8	-54	-80.1	0	0	0	109	S162 R203 Q236 L237	F160-S162 PolarHBondContact O-N 2.89Å; F160-R203 HydrophobicContact CD2-CG 4.14Å; F160-R203 HydrophobicContact CE1-CG 4.19Å; F160-R203 HydrophobicContact CE2-CG 3.62Å; F160-R203 HydrophobicContact CZ-CG 3.64Å; F160-Q236 HydrophobicContact CD1-CB 3.95Å; F160-Q236 HydrophobicContact CE1-CB 4.14Å; F160-L237 HydrophobicContact CE1-CD2 4.26Å; F160-L237 HydrophobicContact CZ-CD2 3.82Å
161	A	73.4	Confident	75.7	Confident	71 Å²	71	57.1 Å²	57.1	59%	0.587	32%	0.317	S	S	*	.			trans	-85.2	11.1	-175.8	0	0	0	0	0	113.5
162	S	85.3	Confident	76.6	Confident	9 Å²	9	59.8 Å²	59.8	6%	0.063	33%	0.331	C	S	.	.	S	Bend	trans	-86.8	150	177.9	55.1	0	0	0	0	112.3	F160 D164 Q236	F160-S162 PolarHBondContact O-N 2.89Å; S162-D164 PolarHBondContact OG-OD1 3.44Å; S162-Q236 VanDerWaalsContact CB-NE2 3.34Å; S162-Q236 PolarHBondContact OG-NE2 3.05Å
163	I	89.9	Confident	77.7	Confident	10 Å²	10	57.5 Å²	57.5	5%	0.051	32%	0.319	C	S	.	.			trans	-89.4	101.9	165.2	-56.5	-54.3	0	0	0	107.8	Q78 R80 A111	Q78-I163 PolarHBondContact NE2-O 3.16Å; R80-I163 HydrophobicContact CG-CD1 4.35Å; R80-I163 HydrophobicContact CG-CG1 3.94Å; A111-I163 HydrophobicContact CB-CB 4.36Å; A111-I163 HydrophobicContact CB-CG2 3.76Å
164	D	92.5	Very high	79.2	Confident	8 Å²	8	57.1 Å²	57.1	4%	0.043	32%	0.32	C	S	.	.			trans	-77.2	147.3	-174.7	-55.4	-29.2	0	0	0	112.2	R142 F155 S162 A166 F200 R203	R142-D164 PolarHBondContact NE-O 3.18Å; F155-D164 HydrophobicContact CZ-CB 4.45Å; S162-D164 PolarHBondContact OG-OD1 3.44Å; D164-A166 PolarHBondContact O-N 3.32Å; D164-F200 HydrophobicContact CB-CD1 4.14Å; D164-F200 HydrophobicContact CB-CD2 4.23Å; D164-F200 HydrophobicContact CB-CE1 3.84Å; D164-F200 HydrophobicContact CB-CE2 3.95Å; D164-F200 HydrophobicContact CB-CG 4.34Å; D164-F200 HydrophobicContact CB-CZ 3.76Å; D164-R203 IonicContact OD1-CZ 2.72Å; D164-R203 IonicContact OD1-NH1 2.68Å; D164-R203 PolarHBondContact OD1-NH1 2.97Å; D164-R203 IonicContact OD1-NH2 2.65Å; D164-R203 IonicContact OD2-CZ 2.59Å; D164-R203 VanDerWaalsContact OD2-CZ 3.28Å; D164-R203 IonicContact OD2-NH1 2.73Å; D164-R203 PolarHBondContact OD2-NH1 3.44Å; D164-R203 VanDerWaalsContact OD2-NH1 3.08Å; D164-R203 IonicContact OD2-NH2 3.3Å; D164-R203 PolarHBondContact OD2-NH2 3.22Å
165	P	95.3	Very high	81.1	Confident	5 Å²	5	59.8 Å²	59.8	3%	0.032	34%	0.336	C	S	.	.	S	Bend	trans	-66.2	-20.8	176.8	20.3	-31.3	0	0	0	114.1	R142 W193 Y196 F200	R142-P165 WeakPolarHBondContact CB-O 3.49Å; R142-P165 WeakPolarHBondContact CD-O 3.27Å; P165-W193 WeakPolarHBondContact O-CZ3 3.34Å; P165-Y196 HydrophobicContact CB-CD1 4.31Å; P165-Y196 HydrophobicContact CB-CE1 4.32Å; P165-Y196 HydrophobicContact CG-CD1 3.77Å; P165-Y196 HydrophobicContact CG-CE1 3.68Å; P165-F200 HydrophobicContact CG-CE2 3.98Å; P165-F200 HydrophobicContact CG-CZ 3.83Å
166	A	94.5	Very high	83.2	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	36%	0.358	C	S	.	.	S	Bend	trans	-142.3	149	174	0	0	0	0	0	111.5	D164 W193 R197 F200	D164-A166 PolarHBondContact O-N 3.32Å; A166-W193 HydrophobicContact CB-CD2 4.3Å; A166-W193 HydrophobicContact CB-CE3 3.92Å; A166-W193 HydrophobicContact CB-CH2 4.07Å; A166-W193 HydrophobicContact CB-CZ2 4.46Å; A166-W193 HydrophobicContact CB-CZ3 3.79Å; A166-R197 HydrophobicContact CB-CG 4.2Å; A166-F200 HydrophobicContact CB-CD2 4.34Å; A166-F200 HydrophobicContact CB-CE2 4.3Å; A166-F200 WeakPolarHBondContact O-CD2 3.4Å
167	P	92.2	Very high	85.3	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-72.6	150.7	174	32.7	-36.3	0	0	0	111.1	W145 F155 W193 R197	W145-P167 HydrophobicContact CD2-CG 3.94Å; W145-P167 HydrophobicContact CE3-CG 4.42Å; W145-P167 HydrophobicContact CG-CG 4.38Å; W145-P167 HydrophobicContact CH2-CB 4.12Å; W145-P167 HydrophobicContact CZ2-CB 3.82Å; W145-P167 HydrophobicContact CZ2-CG 4.02Å; F155-P167 HydrophobicContact CD2-CB 4.09Å; F155-P167 HydrophobicContact CE2-CB 4.32Å; P167-W193 VanDerWaalsContact CD-CH2 3.44Å; P167-W193 VanDerWaalsContact CD-CZ2 3.41Å; P167-W193 HydrophobicContact CG-CH2 4.43Å; P167-W193 HydrophobicContact CG-CZ2 4Å; P167-R197 WeakPolarHBondContact O-CA 3.43Å; P167-R197 WeakPolarHBondContact O-CB 3.46Å; P167-R197 WeakPolarHBondContact O-CG 3.24Å; P167-R197 PolarHBondContact O-NE 3.11Å
168	P	93.2	Very high	87.4	Confident	8 Å²	8	53.7 Å²	53.7	5%	0.052	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-63	165.3	168.8	31	-37.1	0	0	0	111.6	R197 F200	P168-R197 PolarHBondContact O-NH2 2.88Å; P168-R197 VanDerWaalsContact O-NH2 3.14Å; P168-F200 HydrophobicContact CB-CB 4.28Å
169	F	92.4	Very high	89.5	Confident	49 Å²	49	56.5 Å²	56.5	22%	0.215	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-74.4	146.5	162	-76.2	-74.8	0	0	0	110	C171 M181 L184 D194 R197 A198 S201	F169-C171 VanDerWaalsContact C-N 3.3Å; F169-C171 PolarHBondContact O-N 3.12Å; F169-M181 HydrophobicContact CB-SD 4.06Å; F169-M181 HydrophobicContact CD2-CE 4.16Å; F169-M181 HydrophobicContact CD2-SD 3.64Å; F169-M181 HydrophobicContact CE2-SD 4.5Å; F169-M181 HydrophobicContact CG-CE 4.49Å; F169-M181 HydrophobicContact CG-SD 4.19Å; F169-L184 HydrophobicContact CD2-CD2 4.48Å; F169-L184 HydrophobicContact CE2-CD2 3.53Å; F169-L184 HydrophobicContact CZ-CD2 3.89Å; F169-D194 HydrophobicContact CZ-CB 4.31Å; F169-R197 VanDerWaalsContact CD1-CZ 3.43Å; F169-R197 HydrophobicContact CD2-CB 3.55Å; F169-R197 VanDerWaalsContact CE1-CZ 3.46Å; F169-R197 HydrophobicContact CE2-CB 3.34Å; F169-R197 HydrophobicContact CE2-CG 4.35Å; F169-R197 HydrophobicContact CG-CB 4.28Å; F169-R197 HydrophobicContact CZ-CB 3.91Å; F169-R197 HydrophobicContact CZ-CG 4.48Å; F169-A198 HydrophobicContact CE2-CB 4.45Å; F169-S201 PolarHBondContact N-OG 3Å
170	P	86.4	Confident	90.9	Very high	85 Å²	85	50.7 Å²	50.7	55%	0.552	30%	0.297	S	S	*	.			trans	-75	84.8	170.5	32.8	-35.2	0	0	0	109.3	D153	D153-P170 WeakPolarHBondContact OD1-CD 3.4Å; D153-P170 WeakPolarHBondContact OD1-CG 3.44Å
171	C	85.1	Confident	92	Very high	48 Å²	48	50.4 Å²	50.4	32%	0.324	30%	0.296	S	S	.	.			trans	-124.1	147.8	177.1	64.5	0	0	0	0	112.2	F169	F169-C171 VanDerWaalsContact C-N 3.3Å; F169-C171 PolarHBondContact O-N 3.12Å
172	E	85.6	Confident	93.2	Very high	155 Å²	155	48.9 Å²	48.9	72%	0.724	28%	0.277	S	S	*	.			trans	-70.1	153	174.3	-60	-109.4	-170.9	0	0	110.9	S174 S177	E172-S174 VanDerWaalsContact C-N 3.28Å; E172-S174 PolarHBondContact O-N 3.3Å; E172-S177 WeakPolarHBondContact O-CB 3.3Å; E172-S177 PolarHBondContact O-OG 3.32Å
173	D	87.6	Confident	93.9	Very high	109 Å²	109	54.1 Å²	54.1	58%	0.583	30%	0.3	S	S	*	.	S	Bend	trans	-78.8	80.2	171.5	-170	12.5	0	0	0	109.7
174	S	94.5	Very high	94.3	Very high	34 Å²	34	55.8 Å²	55.8	24%	0.238	31%	0.309	C	S	.	.	S	Bend	trans	-133.1	153.1	-178.2	80.6	0	0	0	0	111.8	E172 T176 S177 L178	E172-S174 VanDerWaalsContact C-N 3.28Å; E172-S174 PolarHBondContact O-N 3.3Å; S174-T176 PolarHBondContact O-N 3.27Å; S174-S177 PolarHBondContact O-N 3.25Å; S174-S177 VanDerWaalsContact O-N 3.11Å; S174-S177 WeakPolarHBondContact OG-CB 3.24Å; S174-S177 PolarHBondContact OG-N 3.09Å; S174-S177 VanDerWaalsContact OG-N 3.1Å; S174-S177 PolarHBondContact OG-OG 3.36Å; S174-L178 PolarHBondContact O-N 2.99Å
175	P	96.1	Very high	94.6	Very high	114 Å²	114	55.4 Å²	55.4	74%	0.74	31%	0.307	S	S	*	.	H	α-helix	trans	-56.2	-33.6	175.4	-27.2	35.4	0	0	0	113.7	K179	P175-K179 WeakPolarHBondContact O-CB 3.49Å; P175-K179 PolarHBondContact O-N 3.39Å; P175-K179 VanDerWaalsContact O-N 3.1Å
176	T	97.6	Very high	94.8	Very high	114 Å²	114	57.7 Å²	57.7	70%	0.699	32%	0.319	S	S	*	.	H	α-helix	trans	-68	-45.5	176.9	-58.6	0	0	0	0	111.4	S174 K179 A180	S174-T176 PolarHBondContact O-N 3.27Å; T176-K179 PolarHBondContact O-N 3.24Å; T176-A180 PolarHBondContact O-N 2.88Å
177	S	97.2	Very high	94.9	Very high	23 Å²	23	61.1 Å²	61.1	16%	0.161	34%	0.337	C	S	.	.	H	α-helix	trans	-65.6	-43.1	177.5	-60.2	0	0	0	0	111.7	E172 S174 K179 A180 M181	E172-S177 WeakPolarHBondContact O-CB 3.3Å; E172-S177 PolarHBondContact O-OG 3.32Å; S174-S177 PolarHBondContact O-N 3.25Å; S174-S177 VanDerWaalsContact O-N 3.11Å; S174-S177 WeakPolarHBondContact OG-CB 3.24Å; S174-S177 PolarHBondContact OG-N 3.09Å; S174-S177 VanDerWaalsContact OG-N 3.1Å; S174-S177 PolarHBondContact OG-OG 3.36Å; S177-K179 VanDerWaalsContact C-N 3.34Å; S177-K179 PolarHBondContact O-N 3.44Å; S177-A180 PolarHBondContact O-N 3.1Å; S177-M181 WeakPolarHBondContact O-CB 3.46Å; S177-M181 VanDerWaalsContact O-CG 3.29Å; S177-M181 WeakPolarHBondContact O-CG 3.4Å; S177-M181 PolarHBondContact O-N 3.49Å
178	L	98.3	Very high	95.2	Very high	23 Å²	23	63.7 Å²	63.7	12%	0.12	35%	0.349	C	S	.	.	H	α-helix	trans	-56.6	-49.3	175.6	-175.3	157.3	0	0	0	110.9	S174 A180 M181 E182 L202 M205 A210	S174-L178 PolarHBondContact O-N 2.99Å; L178-A180 PolarHBondContact O-N 3.15Å; L178-M181 PolarHBondContact O-N 2.95Å; L178-E182 WeakPolarHBondContact O-CB 3.4Å; L178-E182 PolarHBondContact O-N 2.97Å; L178-L202 HydrophobicContact CG-CD2 4.23Å; L178-M205 HydrophobicContact CB-CE 4.41Å; L178-M205 HydrophobicContact CB-SD 3.87Å; L178-M205 HydrophobicContact CD1-SD 4.37Å; L178-M205 HydrophobicContact CG-SD 4.15Å; L178-A210 HydrophobicContact CD1-CB 4.22Å
179	K	98.4	Very high	95.4	Very high	128 Å²	128	70.2 Å²	70.2	56%	0.557	38%	0.379	S	S	*	.	H	α-helix	trans	-60.5	-45.7	178.6	-177.3	177.5	173.5	-177.6	0	112.2	P175 T176 S177 M181 E182 E183	P175-K179 WeakPolarHBondContact O-CB 3.49Å; P175-K179 PolarHBondContact O-N 3.39Å; P175-K179 VanDerWaalsContact O-N 3.1Å; T176-K179 PolarHBondContact O-N 3.24Å; S177-K179 VanDerWaalsContact C-N 3.34Å; S177-K179 PolarHBondContact O-N 3.44Å; K179-M181 VanDerWaalsContact C-N 3.34Å; K179-M181 PolarHBondContact O-N 3.28Å; K179-E182 PolarHBondContact O-N 2.89Å; K179-E183 WeakPolarHBondContact CE-OE1 3.28Å; K179-E183 IonicContact NZ-OE1 3.42Å; K179-E183 WeakPolarHBondContact O-CG 3.39Å; K179-E183 PolarHBondContact O-N 2.82Å
180	A	98.5	Very high	95.7	Very high	44 Å²	44	69 Å²	69	36%	0.364	38%	0.377	S	S	.	.	H	α-helix	trans	-63.4	-40	178.7	0	0	0	0	0	112.3	T176 S177 L178 L184	T176-A180 PolarHBondContact O-N 2.88Å; S177-A180 PolarHBondContact O-N 3.1Å; L178-A180 PolarHBondContact O-N 3.15Å; A180-L184 PolarHBondContact O-N 2.98Å; A180-L184 VanDerWaalsContact O-N 3.15Å
181	M	98.5	Very high	96.2	Very high	21 Å²	21	71.2 Å²	71.2	10%	0.103	38%	0.38	C	S	.	.	H	α-helix	trans	-68.3	-39.7	175.9	-66.5	-59.4	95.4	0	0	111.7	F169 S177 L178 K179 L184 F185 A198 L202 M205	F169-M181 HydrophobicContact CB-SD 4.06Å; F169-M181 HydrophobicContact CD2-CE 4.16Å; F169-M181 HydrophobicContact CD2-SD 3.64Å; F169-M181 HydrophobicContact CE2-SD 4.5Å; F169-M181 HydrophobicContact CG-CE 4.49Å; F169-M181 HydrophobicContact CG-SD 4.19Å; S177-M181 WeakPolarHBondContact O-CB 3.46Å; S177-M181 VanDerWaalsContact O-CG 3.29Å; S177-M181 WeakPolarHBondContact O-CG 3.4Å; S177-M181 PolarHBondContact O-N 3.49Å; L178-M181 PolarHBondContact O-N 2.95Å; K179-M181 VanDerWaalsContact C-N 3.34Å; K179-M181 PolarHBondContact O-N 3.28Å; M181-L184 PolarHBondContact O-N 3.42Å; M181-F185 WeakPolarHBondContact O-CB 3.38Å; M181-F185 PolarHBondContact O-N 2.9Å; M181-A198 HydrophobicContact SD-CB 4.19Å; M181-L202 HydrophobicContact CB-CD2 3.89Å; M181-L202 HydrophobicContact CB-CG 3.9Å; M181-M205 HydrophobicContact CG-CE 4.28Å
182	E	98.8	Very high	96.9	Very high	40 Å²	40	70.1 Å²	70.1	19%	0.187	37%	0.371	C	S	.	.	H	α-helix	trans	-61.3	-46.1	174.1	177.8	176.6	165.1	0	0	112	L178 K179 L184 F185 L186 S213 K216	L178-E182 WeakPolarHBondContact O-CB 3.4Å; L178-E182 PolarHBondContact O-N 2.97Å; K179-E182 PolarHBondContact O-N 2.89Å; E182-L184 PolarHBondContact O-N 3.36Å; E182-F185 PolarHBondContact O-N 2.93Å; E182-L186 HydrophobicContact CG-CD1 3.74Å; E182-L186 HydrophobicContact CG-CG 4.32Å; E182-L186 WeakPolarHBondContact O-CB 2.98Å; E182-L186 WeakPolarHBondContact O-CG 3.34Å; E182-L186 PolarHBondContact O-N 3.08Å; E182-S213 VanDerWaalsContact CD-OG 3.32Å; E182-S213 WeakPolarHBondContact OE2-CB 3.4Å; E182-S213 PolarHBondContact OE2-OG 2.76Å; E182-K216 IonicContact OE1-NZ 3.02Å; E182-K216 PolarHBondContact OE1-NZ 3.18Å; E182-K216 IonicContact OE2-NZ 2.66Å
183	E	98.8	Very high	97.4	Very high	119 Å²	119	63.6 Å²	63.6	56%	0.556	34%	0.34	S	S	*	.	H	α-helix	trans	-58.4	-47.1	178.4	-75.1	173.4	178.5	0	0	111.2	K179 D187	K179-E183 WeakPolarHBondContact CE-OE1 3.28Å; K179-E183 IonicContact NZ-OE1 3.42Å; K179-E183 WeakPolarHBondContact O-CG 3.39Å; K179-E183 PolarHBondContact O-N 2.82Å; E183-D187 WeakPolarHBondContact O-CB 3.45Å; E183-D187 PolarHBondContact O-N 2.71Å; E183-D187 VanDerWaalsContact O-N 3.16Å
184	L	98.8	Very high	97.9	Very high	45 Å²	45	60.6 Å²	60.6	24%	0.236	32%	0.324	C	S	.	.	H	α-helix	trans	-68.9	-39.8	177.4	180	58.5	0	0	0	112.9	F169 A180 M181 E182 L186 D187 A190 D194 A198	F169-L184 HydrophobicContact CD2-CD2 4.48Å; F169-L184 HydrophobicContact CE2-CD2 3.53Å; F169-L184 HydrophobicContact CZ-CD2 3.89Å; A180-L184 PolarHBondContact O-N 2.98Å; A180-L184 VanDerWaalsContact O-N 3.15Å; M181-L184 PolarHBondContact O-N 3.42Å; E182-L184 PolarHBondContact O-N 3.36Å; L184-L186 VanDerWaalsContact C-N 3.34Å; L184-L186 PolarHBondContact O-N 2.83Å; L184-D187 PolarHBondContact O-N 3.4Å; L184-A190 HydrophobicContact CD1-CB 3.77Å; L184-D194 HydrophobicContact CD1-CB 4.31Å; L184-D194 HydrophobicContact CD2-CB 4.3Å; L184-A198 HydrophobicContact CB-CB 4.25Å; L184-A198 HydrophobicContact CD2-CB 4.19Å; L184-A198 HydrophobicContact CG-CB 4.13Å
185	F	98.7	Very high	98.1	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-60.8	-42	178.6	167	-108.5	0	0	0	112.2	M181 E182 R195 A198 M199 L202 S213 L214 F226 V230	M181-F185 WeakPolarHBondContact O-CB 3.38Å; M181-F185 PolarHBondContact O-N 2.9Å; E182-F185 PolarHBondContact O-N 2.93Å; F185-R195 PolarHBondContact O-NE 2.91Å; F185-R195 VanDerWaalsContact O-NE 3.16Å; F185-R195 PolarHBondContact O-NH2 3.45Å; F185-A198 HydrophobicContact CB-CB 3.95Å; F185-M199 HydrophobicContact CD2-CB 3.77Å; F185-M199 HydrophobicContact CD2-CG 4.18Å; F185-M199 HydrophobicContact CE2-CB 3.79Å; F185-M199 HydrophobicContact CE2-CE 3.95Å; F185-M199 HydrophobicContact CE2-CG 3.67Å; F185-M199 HydrophobicContact CE2-SD 4.47Å; F185-L202 HydrophobicContact CB-CD1 3.93Å; F185-L202 HydrophobicContact CD1-CD1 3.94Å; F185-L202 HydrophobicContact CD2-CD1 4.44Å; F185-L202 HydrophobicContact CG-CD1 3.86Å; F185-S213 WeakPolarHBondContact CE1-O 3.45Å; F185-L214 HydrophobicContact CE2-CD2 4.06Å; F185-L214 HydrophobicContact CZ-CD2 3.98Å; F185-F226 HydrophobicContact CD2-CE2 4.04Å; F185-F226 AromaticContact CD2-CZ 3.53Å; F185-F226 HydrophobicContact CD2-CZ 3.53Å; F185-F226 HydrophobicContact CE2-CE1 4Å; F185-F226 AromaticContact CE2-CE2 3.9Å; F185-F226 HydrophobicContact CE2-CE2 3.9Å; F185-F226 AromaticContact CE2-CZ 3.22Å; F185-F226 HydrophobicContact CE2-CZ 3.22Å; F185-F226 HydrophobicContact CG-CZ 4.35Å; F185-F226 HydrophobicContact CZ-CE1 4.2Å; F185-F226 AromaticContact CZ-CZ 3.83Å; F185-F226 HydrophobicContact CZ-CZ 3.83Å; F185-F226 WeakPolarHBondContact O-CZ 3.24Å; F185-V230 HydrophobicContact CE2-CG2 3.71Å; F185-V230 HydrophobicContact CZ-CG1 4.42Å; F185-V230 HydrophobicContact CZ-CG2 3.57Å
186	L	98.7	Very high	98.2	Very high	53 Å²	53	54 Å²	54	28%	0.277	28%	0.279	S	S	.	.	H	α-helix	trans	-86.5	-8.9	-178.8	-63	178.6	0	0	0	114.2	E182 L184 E188 K216	E182-L186 HydrophobicContact CG-CD1 3.74Å; E182-L186 HydrophobicContact CG-CG 4.32Å; E182-L186 WeakPolarHBondContact O-CB 2.98Å; E182-L186 WeakPolarHBondContact O-CG 3.34Å; E182-L186 PolarHBondContact O-N 3.08Å; L184-L186 VanDerWaalsContact C-N 3.34Å; L184-L186 PolarHBondContact O-N 2.83Å; L186-E188 PolarHBondContact O-N 3.49Å; L186-K216 HydrophobicContact CD1-CB 4.2Å; L186-K216 HydrophobicContact CD1-CD 3.98Å; L186-K216 HydrophobicContact CD2-CB 3.89Å
187	D	98.6	Very high	98.2	Very high	72 Å²	72	49.8 Å²	49.8	39%	0.385	25%	0.25	S	S	.	.			trans	-72.6	98.3	177.1	-176.1	3.3	0	0	0	111	E183 L184 E189 A190 R195	E183-D187 WeakPolarHBondContact O-CB 3.45Å; E183-D187 PolarHBondContact O-N 2.71Å; E183-D187 VanDerWaalsContact O-N 3.16Å; L184-D187 PolarHBondContact O-N 3.4Å; D187-E189 PolarHBondContact O-N 3.05Å; D187-E189 WeakPolarHBondContact OD1-CB 3.41Å; D187-E189 PolarHBondContact OD1-N 3.25Å; D187-A190 HydrophobicContact CB-CB 3.91Å; D187-A190 WeakPolarHBondContact O-CB 3.35Å; D187-A190 PolarHBondContact O-N 3.3Å; D187-A190 VanDerWaalsContact O-N 3.09Å; D187-A190 PolarHBondContact OD1-N 2.91Å; D187-R195 VanDerWaalsContact O-CD 3.23Å; D187-R195 WeakPolarHBondContact O-CD 3.37Å; D187-R195 PolarHBondContact O-NE 3.43Å
188	E	97.5	Very high	98.2	Very high	53 Å²	53	48.7 Å²	48.7	25%	0.248	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-4.6	177.9	-64.2	-160.9	94	0	0	113.9	L186 C220 Q221 K222	L186-E188 PolarHBondContact O-N 3.49Å; E188-C220 HydrophobicContact CG-CB 4.34Å; E188-Q221 PolarHBondContact OE1-N 3.43Å; E188-K222 HydrophobicContact CB-CD 4Å; E188-K222 HydrophobicContact CB-CG 4.44Å; E188-K222 PolarHBondContact O-NZ 3.18Å; E188-K222 WeakPolarHBondContact OE1-CG 3.4Å; E188-K222 PolarHBondContact OE1-N 3.03Å
189	E	97.8	Very high	98.2	Very high	146 Å²	146	47.6 Å²	47.6	68%	0.682	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-14.4	170.6	-55.7	-54.9	137.3	0	0	112.7	D187 K222	D187-E189 PolarHBondContact O-N 3.05Å; D187-E189 WeakPolarHBondContact OD1-CB 3.41Å; D187-E189 PolarHBondContact OD1-N 3.25Å; E189-K222 IonicContact OE1-NZ 2.7Å; E189-K222 PolarHBondContact OE1-NZ 3.48Å; E189-K222 IonicContact OE2-NZ 3.6Å; E189-K222 PolarHBondContact OE2-NZ 2.87Å
190	A	98.1	Very high	98	Very high	22 Å²	22	41.5 Å²	41.5	18%	0.182	21%	0.21	C	C	.	.	S	Bend	trans	-70.2	157.4	176	0	0	0	0	0	112	L184 D187 L192 R195	L184-A190 HydrophobicContact CD1-CB 3.77Å; D187-A190 HydrophobicContact CB-CB 3.91Å; D187-A190 WeakPolarHBondContact O-CB 3.35Å; D187-A190 PolarHBondContact O-N 3.3Å; D187-A190 VanDerWaalsContact O-N 3.09Å; D187-A190 PolarHBondContact OD1-N 2.91Å; A190-L192 PolarHBondContact O-N 3.04Å; A190-R195 HydrophobicContact CB-CG 3.91Å
191	Q	97.7	Very high	97.8	Very high	133 Å²	133	39.6 Å²	39.6	62%	0.621	19%	0.194	S	C	*	.			trans	-64.4	136.6	177.1	-62.6	-60.8	-62.1	0	0	110.7	W193 D194 R195	Q191-W193 PolarHBondContact O-N 3.47Å; Q191-W193 VanDerWaalsContact O-N 3.16Å; Q191-D194 PolarHBondContact O-N 3.23Å; Q191-R195 WeakPolarHBondContact O-CG 3.26Å; Q191-R195 PolarHBondContact O-N 2.98Å; Q191-R195 VanDerWaalsContact O-N 3.1Å
192	L	98.1	Very high	97.8	Very high	25 Å²	25	38.6 Å²	38.6	13%	0.131	19%	0.189	C	C	.	.	H	α-helix	trans	-53.8	-41.7	-176.6	-172.8	64.2	0	0	0	112.6	E134 L138 A190 D194 R195 Y196 F226	E134-L192 HydrophobicContact CB-CD2 3.63Å; E134-L192 HydrophobicContact CG-CD2 3.84Å; L138-L192 HydrophobicContact CD1-CD2 3.93Å; L138-L192 HydrophobicContact CD1-CG 4.35Å; L138-L192 HydrophobicContact CD2-CD2 4.42Å; L138-L192 HydrophobicContact CD2-CG 4.26Å; L138-L192 HydrophobicContact CG-CD2 4.11Å; L138-L192 HydrophobicContact CG-CG 4.47Å; A190-L192 PolarHBondContact O-N 3.04Å; L192-D194 PolarHBondContact O-N 3.4Å; L192-R195 PolarHBondContact O-N 3.5Å; L192-Y196 HydrophobicContact CD1-CD2 3.88Å; L192-Y196 HydrophobicContact CD1-CE2 3.65Å; L192-Y196 HydrophobicContact CD2-CE2 4.43Å; L192-Y196 HydrophobicContact CG-CD2 3.95Å; L192-Y196 HydrophobicContact CG-CE2 3.91Å; L192-Y196 WeakPolarHBondContact O-CD2 3.41Å; L192-Y196 PolarHBondContact O-N 3.39Å; L192-F226 HydrophobicContact CD1-CB 4.3Å; L192-F226 HydrophobicContact CD1-CD2 4.14Å
193	W	97.6	Very high	97.6	Very high	17 Å²	17	36.9 Å²	36.9	6%	0.064	18%	0.181	C	C	.	.	H	α-helix	trans	-53.6	-51.2	174.3	177.7	-95.4	0	0	0	112.3	L138 K141 R142 W145 P165 A166 P167 Q191 R195 Y196 R197	L138-W193 HydrophobicContact CD2-CB 4.4Å; L138-W193 HydrophobicContact CD2-CE3 3.99Å; K141-W193 HydrophobicContact CB-CD2 4.27Å; K141-W193 HydrophobicContact CB-CE3 3.78Å; K141-W193 HydrophobicContact CB-CH2 4.46Å; K141-W193 HydrophobicContact CB-CZ3 3.9Å; K141-W193 HydrophobicContact CD-CB 3.8Å; K141-W193 HydrophobicContact CD-CD2 3.4Å; K141-W193 HydrophobicContact CD-CE3 3.77Å; K141-W193 HydrophobicContact CD-CG 3.43Å; K141-W193 VanDerWaalsContact CD-CG 3.43Å; K141-W193 HydrophobicContact CG-CD2 3.68Å; K141-W193 HydrophobicContact CG-CE3 3.7Å; K141-W193 HydrophobicContact CG-CG 4.26Å; K141-W193 HydrophobicContact CG-CH2 4.17Å; K141-W193 HydrophobicContact CG-CZ2 4.13Å; K141-W193 HydrophobicContact CG-CZ3 3.96Å; R142-W193 HydrophobicContact CB-CH2 4.25Å; R142-W193 HydrophobicContact CB-CZ3 4.07Å; W145-W193 HydrophobicContact CB-CH2 4.24Å; W145-W193 HydrophobicContact CB-CZ2 4.22Å; W145-W193 HydrophobicContact CG-CZ2 4.3Å; P165-W193 WeakPolarHBondContact O-CZ3 3.34Å; A166-W193 HydrophobicContact CB-CD2 4.3Å; A166-W193 HydrophobicContact CB-CE3 3.92Å; A166-W193 HydrophobicContact CB-CH2 4.07Å; A166-W193 HydrophobicContact CB-CZ2 4.46Å; A166-W193 HydrophobicContact CB-CZ3 3.79Å; P167-W193 VanDerWaalsContact CD-CH2 3.44Å; P167-W193 VanDerWaalsContact CD-CZ2 3.41Å; P167-W193 HydrophobicContact CG-CH2 4.43Å; P167-W193 HydrophobicContact CG-CZ2 4Å; Q191-W193 PolarHBondContact O-N 3.47Å; Q191-W193 VanDerWaalsContact O-N 3.16Å; W193-R195 VanDerWaalsContact C-N 3.29Å; W193-R195 PolarHBondContact O-N 3.26Å; W193-Y196 WeakPolarHBondContact O-CB 3.39Å; W193-Y196 PolarHBondContact O-N 3.03Å; W193-Y196 VanDerWaalsContact O-N 3.16Å; W193-R197 VanDerWaalsContact O-CG 3.28Å; W193-R197 WeakPolarHBondContact O-CG 3.25Å; W193-R197 PolarHBondContact O-N 2.81Å
194	D	98.1	Very high	97.3	Very high	47 Å²	47	33 Å²	33	25%	0.251	17%	0.165	S	C	.	.	H	α-helix	trans	-67.9	-33.3	-176.7	-62.4	-37.4	0	0	0	111.4	F169 L184 Q191 L192 R197 A198	F169-D194 HydrophobicContact CZ-CB 4.31Å; L184-D194 HydrophobicContact CD1-CB 4.31Å; L184-D194 HydrophobicContact CD2-CB 4.3Å; Q191-D194 PolarHBondContact O-N 3.23Å; L192-D194 PolarHBondContact O-N 3.4Å; D194-R197 PolarHBondContact O-N 3.36Å; D194-A198 WeakPolarHBondContact O-CB 3.41Å; D194-A198 PolarHBondContact O-N 3.05Å
195	R	98.6	Very high	97	Very high	8 Å²	8	31.6 Å²	31.6	3%	0.03	16%	0.157	C	C	.	.	H	α-helix	trans	-64.6	-40.6	172.1	-60.1	178.5	66.5	-159.6	-2.3	112.1	F185 D187 A190 Q191 L192 W193 A198 M199 F226	F185-R195 PolarHBondContact O-NE 2.91Å; F185-R195 VanDerWaalsContact O-NE 3.16Å; F185-R195 PolarHBondContact O-NH2 3.45Å; D187-R195 VanDerWaalsContact O-CD 3.23Å; D187-R195 WeakPolarHBondContact O-CD 3.37Å; D187-R195 PolarHBondContact O-NE 3.43Å; A190-R195 HydrophobicContact CB-CG 3.91Å; Q191-R195 WeakPolarHBondContact O-CG 3.26Å; Q191-R195 PolarHBondContact O-N 2.98Å; Q191-R195 VanDerWaalsContact O-N 3.1Å; L192-R195 PolarHBondContact O-N 3.5Å; W193-R195 VanDerWaalsContact C-N 3.29Å; W193-R195 PolarHBondContact O-N 3.26Å; R195-A198 PolarHBondContact O-N 3.49Å; R195-M199 WeakPolarHBondContact O-CB 3.24Å; R195-M199 PolarHBondContact O-N 3.34Å; R195-F226 HydrophobicContact CB-CD2 4.46Å; R195-F226 HydrophobicContact CB-CE2 3.82Å
196	Y	98.2	Very high	96.7	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64.5	-44.7	173.6	-92.8	-120.2	0	0	0	111.6	L138 P165 L192 W193 A198 M199 F200 L225 F226 E229	L138-Y196 HydrophobicContact CD1-CD1 3.88Å; L138-Y196 HydrophobicContact CD1-CD2 4.22Å; L138-Y196 HydrophobicContact CD1-CE1 3.52Å; L138-Y196 HydrophobicContact CD1-CE2 3.87Å; L138-Y196 HydrophobicContact CD1-CG 4.23Å; L138-Y196 HydrophobicContact CD2-CD1 4.28Å; L138-Y196 HydrophobicContact CD2-CD2 4.36Å; L138-Y196 HydrophobicContact CD2-CG 4.11Å; P165-Y196 HydrophobicContact CB-CD1 4.31Å; P165-Y196 HydrophobicContact CB-CE1 4.32Å; P165-Y196 HydrophobicContact CG-CD1 3.77Å; P165-Y196 HydrophobicContact CG-CE1 3.68Å; L192-Y196 HydrophobicContact CD1-CD2 3.88Å; L192-Y196 HydrophobicContact CD1-CE2 3.65Å; L192-Y196 HydrophobicContact CD2-CE2 4.43Å; L192-Y196 HydrophobicContact CG-CD2 3.95Å; L192-Y196 HydrophobicContact CG-CE2 3.91Å; L192-Y196 WeakPolarHBondContact O-CD2 3.41Å; L192-Y196 PolarHBondContact O-N 3.39Å; W193-Y196 WeakPolarHBondContact O-CB 3.39Å; W193-Y196 PolarHBondContact O-N 3.03Å; W193-Y196 VanDerWaalsContact O-N 3.16Å; Y196-A198 VanDerWaalsContact C-N 3.29Å; Y196-A198 PolarHBondContact O-N 2.94Å; Y196-M199 HydrophobicContact CD2-CE 4.32Å; Y196-M199 HydrophobicContact CE2-CE 4.33Å; Y196-M199 VanDerWaalsContact O-CB 3.32Å; Y196-M199 WeakPolarHBondContact O-CB 3.46Å; Y196-M199 PolarHBondContact O-N 3.07Å; Y196-M199 VanDerWaalsContact O-N 3.14Å; Y196-F200 AromaticContact CD1-CE2 3.93Å; Y196-F200 HydrophobicContact CD1-CE2 3.93Å; Y196-F200 HydrophobicContact CD1-CZ 4.47Å; Y196-F200 WeakPolarHBondContact O-CD2 3.43Å; Y196-F200 PolarHBondContact O-N 3.02Å; Y196-L225 WeakPolarHBondContact OH-CG 3Å; Y196-L225 PolarHBondContact OH-O 3.13Å; Y196-F226 HydrophobicContact CD2-CD2 4.09Å; Y196-F226 HydrophobicContact CE2-CB 4.46Å; Y196-F226 AromaticContact CE2-CD2 3.84Å; Y196-F226 HydrophobicContact CE2-CD2 3.84Å; Y196-E229 HydrophobicContact CD1-CG 4.27Å; Y196-E229 HydrophobicContact CE1-CB 4.01Å; Y196-E229 HydrophobicContact CE1-CG 3.58Å; Y196-E229 WeakPolarHBondContact OH-CB 3.41Å
197	R	96.2	Very high	96.5	Very high	27 Å²	27	33.2 Å²	33.2	10%	0.102	17%	0.173	C	C	.	.	H	α-helix	trans	-58.2	-43.2	174.4	-62.4	-169.8	66.6	178.2	3.7	111.7	D153 A166 P167 P168 F169 W193 D194 S201	D153-R197 VanDerWaalsContact CG-NH2 3.27Å; D153-R197 IonicContact OD1-NH2 2.65Å; D153-R197 IonicContact OD2-CZ 3.56Å; D153-R197 IonicContact OD2-NH1 3.91Å; D153-R197 IonicContact OD2-NH2 3.81Å; D153-R197 PolarHBondContact OD2-NH2 2.99Å; A166-R197 HydrophobicContact CB-CG 4.2Å; P167-R197 WeakPolarHBondContact O-CA 3.43Å; P167-R197 WeakPolarHBondContact O-CB 3.46Å; P167-R197 WeakPolarHBondContact O-CG 3.24Å; P167-R197 PolarHBondContact O-NE 3.11Å; P168-R197 PolarHBondContact O-NH2 2.88Å; P168-R197 VanDerWaalsContact O-NH2 3.14Å; F169-R197 VanDerWaalsContact CD1-CZ 3.43Å; F169-R197 HydrophobicContact CD2-CB 3.55Å; F169-R197 VanDerWaalsContact CE1-CZ 3.46Å; F169-R197 HydrophobicContact CE2-CB 3.34Å; F169-R197 HydrophobicContact CE2-CG 4.35Å; F169-R197 HydrophobicContact CG-CB 4.28Å; F169-R197 HydrophobicContact CZ-CB 3.91Å; F169-R197 HydrophobicContact CZ-CG 4.48Å; W193-R197 VanDerWaalsContact O-CG 3.28Å; W193-R197 WeakPolarHBondContact O-CG 3.25Å; W193-R197 PolarHBondContact O-N 2.81Å; D194-R197 PolarHBondContact O-N 3.36Å; R197-S201 WeakPolarHBondContact O-CB 3.22Å; R197-S201 PolarHBondContact O-N 2.65Å; R197-S201 PolarHBondContact O-OG 3.33Å
198	A	98.1	Very high	96.4	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-63.9	-41.7	175.5	0	0	0	0	0	111.9	F169 M181 L184 F185 D194 R195 Y196 S201 L202	F169-A198 HydrophobicContact CE2-CB 4.45Å; M181-A198 HydrophobicContact SD-CB 4.19Å; L184-A198 HydrophobicContact CB-CB 4.25Å; L184-A198 HydrophobicContact CD2-CB 4.19Å; L184-A198 HydrophobicContact CG-CB 4.13Å; F185-A198 HydrophobicContact CB-CB 3.95Å; D194-A198 WeakPolarHBondContact O-CB 3.41Å; D194-A198 PolarHBondContact O-N 3.05Å; R195-A198 PolarHBondContact O-N 3.49Å; Y196-A198 VanDerWaalsContact C-N 3.29Å; Y196-A198 PolarHBondContact O-N 2.94Å; A198-S201 WeakPolarHBondContact O-CB 3.35Å; A198-S201 PolarHBondContact O-N 2.87Å; A198-L202 WeakPolarHBondContact O-CG 3.28Å; A198-L202 PolarHBondContact O-N 3.42Å
199	M	98	Very high	96.5	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-56.4	-51.8	174.9	-170.3	-169.2	-51	0	0	112	F185 R195 Y196 S201 L202 R203 L214 F226 E229 V230 V233	F185-M199 HydrophobicContact CD2-CB 3.77Å; F185-M199 HydrophobicContact CD2-CG 4.18Å; F185-M199 HydrophobicContact CE2-CB 3.79Å; F185-M199 HydrophobicContact CE2-CE 3.95Å; F185-M199 HydrophobicContact CE2-CG 3.67Å; F185-M199 HydrophobicContact CE2-SD 4.47Å; R195-M199 WeakPolarHBondContact O-CB 3.24Å; R195-M199 PolarHBondContact O-N 3.34Å; Y196-M199 HydrophobicContact CD2-CE 4.32Å; Y196-M199 HydrophobicContact CE2-CE 4.33Å; Y196-M199 VanDerWaalsContact O-CB 3.32Å; Y196-M199 WeakPolarHBondContact O-CB 3.46Å; Y196-M199 PolarHBondContact O-N 3.07Å; Y196-M199 VanDerWaalsContact O-N 3.14Å; M199-S201 VanDerWaalsContact C-N 3.27Å; M199-S201 PolarHBondContact O-N 3.34Å; M199-L202 PolarHBondContact O-N 3.19Å; M199-R203 PolarHBondContact O-N 3.23Å; M199-L214 HydrophobicContact CB-CD2 4.46Å; M199-L214 HydrophobicContact CG-CD2 3.63Å; M199-F226 HydrophobicContact CE-CD2 3.59Å; M199-F226 HydrophobicContact CE-CE2 3.37Å; M199-F226 HydrophobicContact CE-CG 4.34Å; M199-F226 HydrophobicContact CE-CZ 3.99Å; M199-E229 HydrophobicContact CE-CB 3.98Å; M199-E229 HydrophobicContact CE-CG 4.01Å; M199-E229 HydrophobicContact SD-CB 3.98Å; M199-E229 HydrophobicContact SD-CG 3.55Å; M199-E229 VanDerWaalsContact SD-CG 3.55Å; M199-V230 HydrophobicContact CE-CG2 3.66Å; M199-V230 HydrophobicContact SD-CG2 4.05Å; M199-V233 HydrophobicContact CG-CG2 4.15Å; M199-V233 HydrophobicContact SD-CB 4.39Å; M199-V233 HydrophobicContact SD-CG2 3.81Å
200	F	95.2	Very high	96.5	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-68.9	-26.2	178.7	-65.5	-60.5	0	0	0	112.9	D164 P165 A166 P168 Y196 N204 E229 V233	D164-F200 HydrophobicContact CB-CD1 4.14Å; D164-F200 HydrophobicContact CB-CD2 4.23Å; D164-F200 HydrophobicContact CB-CE1 3.84Å; D164-F200 HydrophobicContact CB-CE2 3.95Å; D164-F200 HydrophobicContact CB-CG 4.34Å; D164-F200 HydrophobicContact CB-CZ 3.76Å; P165-F200 HydrophobicContact CG-CE2 3.98Å; P165-F200 HydrophobicContact CG-CZ 3.83Å; A166-F200 HydrophobicContact CB-CD2 4.34Å; A166-F200 HydrophobicContact CB-CE2 4.3Å; A166-F200 WeakPolarHBondContact O-CD2 3.4Å; P168-F200 HydrophobicContact CB-CB 4.28Å; Y196-F200 AromaticContact CD1-CE2 3.93Å; Y196-F200 HydrophobicContact CD1-CE2 3.93Å; Y196-F200 HydrophobicContact CD1-CZ 4.47Å; Y196-F200 WeakPolarHBondContact O-CD2 3.43Å; Y196-F200 PolarHBondContact O-N 3.02Å; F200-N204 VanDerWaalsContact O-CB 3.32Å; F200-N204 WeakPolarHBondContact O-CB 3.32Å; F200-N204 PolarHBondContact O-N 2.73Å; F200-N204 PolarHBondContact O-ND2 3.39Å; F200-N204 PolarHBondContact O-OD1 3.4Å; F200-E229 HydrophobicContact CZ-CG 4.21Å; F200-E229 VanDerWaalsContact CZ-OE1 3.28Å; F200-E229 WeakPolarHBondContact CZ-OE1 3.37Å; F200-V233 HydrophobicContact CD1-CG2 4.17Å; F200-V233 HydrophobicContact CE1-CG2 3.8Å
201	S	94.7	Very high	96.5	Very high	3 Å²	3	29.8 Å²	29.8	2%	0.021	16%	0.159	C	C	.	.	H	α-helix	trans	-66.8	-47.2	171.7	-52.2	0	0	0	0	111.1	F169 R197 A198 M199 R203 N204 M205	F169-S201 PolarHBondContact N-OG 3Å; R197-S201 WeakPolarHBondContact O-CB 3.22Å; R197-S201 PolarHBondContact O-N 2.65Å; R197-S201 PolarHBondContact O-OG 3.33Å; A198-S201 WeakPolarHBondContact O-CB 3.35Å; A198-S201 PolarHBondContact O-N 2.87Å; M199-S201 VanDerWaalsContact C-N 3.27Å; M199-S201 PolarHBondContact O-N 3.34Å; S201-R203 PolarHBondContact O-N 3.41Å; S201-N204 PolarHBondContact O-N 2.98Å; S201-M205 WeakPolarHBondContact O-CG 3.37Å; S201-M205 PolarHBondContact O-N 3.01Å; S201-M205 VanDerWaalsContact O-N 3.13Å
202	L	96.7	Very high	96.5	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-60.8	-43.5	174.1	-70.5	168.7	0	0	0	111.4	L178 M181 F185 A198 M199 N204 M205 A206 A210 L214	L178-L202 HydrophobicContact CG-CD2 4.23Å; M181-L202 HydrophobicContact CB-CD2 3.89Å; M181-L202 HydrophobicContact CB-CG 3.9Å; F185-L202 HydrophobicContact CB-CD1 3.93Å; F185-L202 HydrophobicContact CD1-CD1 3.94Å; F185-L202 HydrophobicContact CD2-CD1 4.44Å; F185-L202 HydrophobicContact CG-CD1 3.86Å; A198-L202 WeakPolarHBondContact O-CG 3.28Å; A198-L202 PolarHBondContact O-N 3.42Å; M199-L202 PolarHBondContact O-N 3.19Å; L202-N204 VanDerWaalsContact C-N 3.29Å; L202-N204 PolarHBondContact O-N 3.01Å; L202-M205 HydrophobicContact CD2-SD 4.29Å; L202-M205 WeakPolarHBondContact O-CB 3.16Å; L202-M205 PolarHBondContact O-N 3.46Å; L202-A206 PolarHBondContact O-N 3.37Å; L202-A210 HydrophobicContact CB-CB 4.44Å; L202-A210 HydrophobicContact CD2-CB 4.31Å; L202-A210 WeakPolarHBondContact O-CB 3.4Å; L202-L214 HydrophobicContact CB-CD1 4.08Å; L202-L214 HydrophobicContact CB-CD2 3.94Å; L202-L214 HydrophobicContact CB-CG 3.87Å; L202-L214 HydrophobicContact CD1-CD2 4.18Å; L202-L214 HydrophobicContact CD1-CG 4.31Å
203	R	94.6	Very high	96.6	Very high	4 Å²	4	24.8 Å²	24.8	2%	0.015	14%	0.141	C	C	.	.	H	α-helix	trans	-55.8	-47.3	173.7	-174.7	-164.9	64.6	-169.3	-4.7	111.3	F160 D164 M199 S201 M205 A206 V233 L237	F160-R203 HydrophobicContact CD2-CG 4.14Å; F160-R203 HydrophobicContact CE1-CG 4.19Å; F160-R203 HydrophobicContact CE2-CG 3.62Å; F160-R203 HydrophobicContact CZ-CG 3.64Å; D164-R203 IonicContact OD1-CZ 2.72Å; D164-R203 IonicContact OD1-NH1 2.68Å; D164-R203 PolarHBondContact OD1-NH1 2.97Å; D164-R203 IonicContact OD1-NH2 2.65Å; D164-R203 IonicContact OD2-CZ 2.59Å; D164-R203 VanDerWaalsContact OD2-CZ 3.28Å; D164-R203 IonicContact OD2-NH1 2.73Å; D164-R203 PolarHBondContact OD2-NH1 3.44Å; D164-R203 VanDerWaalsContact OD2-NH1 3.08Å; D164-R203 IonicContact OD2-NH2 3.3Å; D164-R203 PolarHBondContact OD2-NH2 3.22Å; M199-R203 PolarHBondContact O-N 3.23Å; S201-R203 PolarHBondContact O-N 3.41Å; R203-M205 VanDerWaalsContact C-N 3.27Å; R203-M205 PolarHBondContact O-N 2.84Å; R203-A206 WeakPolarHBondContact O-CA 3.48Å; R203-A206 PolarHBondContact O-N 2.81Å; R203-V233 HydrophobicContact CB-CG1 3.56Å; R203-V233 HydrophobicContact CG-CG1 3.67Å; R203-L237 HydrophobicContact CG-CD1 4.27Å; R203-L237 HydrophobicContact CG-CD2 4.17Å; R203-L237 HydrophobicContact CG-CG 4.11Å
204	N	92.5	Very high	96.6	Very high	39 Å²	39	24 Å²	24	21%	0.209	14%	0.138	C	C	.	.	H	α-helix	trans	-67.4	-27.1	-175.5	-70.2	-4.4	0	0	0	112.9	R159 F200 S201 L202 A206	R159-N204 PolarHBondContact NH1-O 2.65Å; F200-N204 VanDerWaalsContact O-CB 3.32Å; F200-N204 WeakPolarHBondContact O-CB 3.32Å; F200-N204 PolarHBondContact O-N 2.73Å; F200-N204 PolarHBondContact O-ND2 3.39Å; F200-N204 PolarHBondContact O-OD1 3.4Å; S201-N204 PolarHBondContact O-N 2.98Å; L202-N204 VanDerWaalsContact C-N 3.29Å; L202-N204 PolarHBondContact O-N 3.01Å; N204-A206 VanDerWaalsContact C-N 3.32Å
205	M	93.4	Very high	96.7	Very high	14 Å²	14	22 Å²	22	7%	0.069	13%	0.129	C	C	.	.	H	α-helix	trans	-62.7	-39.7	169.8	-66	170.4	-178	0	0	111.4	L178 M181 S201 L202 R203 T207 A210	L178-M205 HydrophobicContact CB-CE 4.41Å; L178-M205 HydrophobicContact CB-SD 3.87Å; L178-M205 HydrophobicContact CD1-SD 4.37Å; L178-M205 HydrophobicContact CG-SD 4.15Å; M181-M205 HydrophobicContact CG-CE 4.28Å; S201-M205 WeakPolarHBondContact O-CG 3.37Å; S201-M205 PolarHBondContact O-N 3.01Å; S201-M205 VanDerWaalsContact O-N 3.13Å; L202-M205 HydrophobicContact CD2-SD 4.29Å; L202-M205 WeakPolarHBondContact O-CB 3.16Å; L202-M205 PolarHBondContact O-N 3.46Å; R203-M205 VanDerWaalsContact C-N 3.27Å; R203-M205 PolarHBondContact O-N 2.84Å; M205-T207 PolarHBondContact O-N 3.49Å; M205-T207 VanDerWaalsContact O-N 3.15Å; M205-A210 HydrophobicContact CB-CB 4.09Å
206	A	91.9	Very high	96.7	Very high	42 Å²	42	26.5 Å²	26.5	35%	0.347	15%	0.148	S	C	.	.			trans	53.4	31.2	176.7	0	0	0	0	0	114.9	L202 R203 N204 L237	L202-A206 PolarHBondContact O-N 3.37Å; R203-A206 WeakPolarHBondContact O-CA 3.48Å; R203-A206 PolarHBondContact O-N 2.81Å; N204-A206 VanDerWaalsContact C-N 3.32Å; A206-L237 HydrophobicContact CB-CD2 3.76Å
207	T	95.2	Very high	96.7	Very high	46 Å²	46	26.5 Å²	26.5	28%	0.282	15%	0.148	S	C	.	.			trans	-93.2	156.6	172.6	63.9	0	0	0	0	110.8	M205 S209 A210 V211	M205-T207 PolarHBondContact O-N 3.49Å; M205-T207 VanDerWaalsContact O-N 3.15Å; T207-S209 PolarHBondContact O-N 2.85Å; T207-A210 PolarHBondContact O-N 3.05Å; T207-A210 WeakPolarHBondContact OG1-CB 3.48Å; T207-A210 PolarHBondContact OG1-N 2.98Å; T207-V211 WeakPolarHBondContact O-CG2 3.42Å; T207-V211 PolarHBondContact O-N 3.17Å
208	E	97.2	Very high	96.8	Very high	143 Å²	143	25.3 Å²	25.3	67%	0.668	14%	0.144	S	C	*	.	H	α-helix	trans	-58.4	-33.5	175.4	-68.9	-172.3	174.2	0	0	112.6	V211 S212 V241	E208-V211 PolarHBondContact O-N 3.37Å; E208-S212 WeakPolarHBondContact O-CB 3.22Å; E208-S212 PolarHBondContact O-N 3.5Å; E208-S212 PolarHBondContact O-OG 3.26Å; E208-V241 HydrophobicContact CB-CG2 4.34Å; E208-V241 HydrophobicContact CG-CG2 4.13Å
209	S	97.9	Very high	96.8	Very high	73 Å²	73	29 Å²	29	51%	0.51	16%	0.16	S	C	.	.	H	α-helix	trans	-64	-44.7	173.6	-59.4	0	0	0	0	111.2	T207 S212 S213	T207-S209 PolarHBondContact O-N 2.85Å; S209-S212 WeakPolarHBondContact O-CB 3.42Å; S209-S212 PolarHBondContact O-N 3.42Å; S209-S213 PolarHBondContact O-N 3Å; S209-S213 PolarHBondContact O-OG 3.41Å
210	A	97.7	Very high	96.9	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-65.5	-40.2	176.8	0	0	0	0	0	112.1	L178 L202 M205 T207 S212 S213 L214	L178-A210 HydrophobicContact CD1-CB 4.22Å; L202-A210 HydrophobicContact CB-CB 4.44Å; L202-A210 HydrophobicContact CD2-CB 4.31Å; L202-A210 WeakPolarHBondContact O-CB 3.4Å; M205-A210 HydrophobicContact CB-CB 4.09Å; T207-A210 PolarHBondContact O-N 3.05Å; T207-A210 WeakPolarHBondContact OG1-CB 3.48Å; T207-A210 PolarHBondContact OG1-N 2.98Å; A210-S212 VanDerWaalsContact C-N 3.3Å; A210-S212 PolarHBondContact O-N 3.06Å; A210-S213 PolarHBondContact O-N 3.35Å; A210-L214 WeakPolarHBondContact O-CB 3.46Å; A210-L214 WeakPolarHBondContact O-CG 3.5Å; A210-L214 PolarHBondContact O-N 3.01Å
211	V	98.5	Very high	96.9	Very high	4 Å²	4	36.6 Å²	36.6	2%	0.024	20%	0.197	C	C	.	.	H	α-helix	trans	-59.5	-43	172.6	177.1	0	0	0	0	110.7	T207 E208 S213 L214 A215 L234 L237 V241 A242	T207-V211 WeakPolarHBondContact O-CG2 3.42Å; T207-V211 PolarHBondContact O-N 3.17Å; E208-V211 PolarHBondContact O-N 3.37Å; V211-S213 VanDerWaalsContact C-N 3.34Å; V211-S213 PolarHBondContact O-N 2.79Å; V211-L214 PolarHBondContact O-N 3.13Å; V211-A215 WeakPolarHBondContact O-CB 3.44Å; V211-A215 PolarHBondContact O-N 2.94Å; V211-L234 HydrophobicContact CG1-CD2 3.93Å; V211-L237 HydrophobicContact CG2-CB 4.4Å; V211-L237 HydrophobicContact CG2-CD1 3.92Å; V211-V241 HydrophobicContact CB-CG1 4.46Å; V211-V241 HydrophobicContact CG1-CB 3.86Å; V211-V241 HydrophobicContact CG1-CG1 3.98Å; V211-A242 HydrophobicContact CG1-CB 4.17Å
212	S	98.7	Very high	96.9	Very high	51 Å²	51	41.7 Å²	41.7	36%	0.357	22%	0.218	S	C	.	.	H	α-helix	trans	-63.3	-39.9	177.4	-60	0	0	0	0	112	E208 S209 A210 K216 V241	E208-S212 WeakPolarHBondContact O-CB 3.22Å; E208-S212 PolarHBondContact O-N 3.5Å; E208-S212 PolarHBondContact O-OG 3.26Å; S209-S212 WeakPolarHBondContact O-CB 3.42Å; S209-S212 PolarHBondContact O-N 3.42Å; A210-S212 VanDerWaalsContact C-N 3.3Å; A210-S212 PolarHBondContact O-N 3.06Å; S212-K216 PolarHBondContact O-N 3.5Å; S212-V241 WeakPolarHBondContact OG-CG1 3.49Å
213	S	98.7	Very high	97	Very high	3 Å²	3	41.8 Å²	41.8	2%	0.021	22%	0.219	C	C	.	.	H	α-helix	trans	-64.5	-46.8	174.1	-53.7	0	0	0	0	111.2	E182 F185 S209 A210 V211 A215 K216	E182-S213 VanDerWaalsContact CD-OG 3.32Å; E182-S213 WeakPolarHBondContact OE2-CB 3.4Å; E182-S213 PolarHBondContact OE2-OG 2.76Å; F185-S213 WeakPolarHBondContact CE1-O 3.45Å; S209-S213 PolarHBondContact O-N 3Å; S209-S213 PolarHBondContact O-OG 3.41Å; A210-S213 PolarHBondContact O-N 3.35Å; V211-S213 VanDerWaalsContact C-N 3.34Å; V211-S213 PolarHBondContact O-N 2.79Å; S213-A215 VanDerWaalsContact C-N 3.35Å; S213-A215 PolarHBondContact O-N 3.35Å; S213-K216 WeakPolarHBondContact O-CB 3.33Å; S213-K216 PolarHBondContact O-N 3.03Å; S213-K216 VanDerWaalsContact O-N 3.17Å
214	L	98.9	Very high	97.2	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-58.6	-43.9	176.4	-74	163.3	0	0	0	111.9	F185 M199 L202 A210 V211 K216 G217 V230 V233 L234 L237	F185-L214 HydrophobicContact CE2-CD2 4.06Å; F185-L214 HydrophobicContact CZ-CD2 3.98Å; M199-L214 HydrophobicContact CB-CD2 4.46Å; M199-L214 HydrophobicContact CG-CD2 3.63Å; L202-L214 HydrophobicContact CB-CD1 4.08Å; L202-L214 HydrophobicContact CB-CD2 3.94Å; L202-L214 HydrophobicContact CB-CG 3.87Å; L202-L214 HydrophobicContact CD1-CD2 4.18Å; L202-L214 HydrophobicContact CD1-CG 4.31Å; A210-L214 WeakPolarHBondContact O-CB 3.46Å; A210-L214 WeakPolarHBondContact O-CG 3.5Å; A210-L214 PolarHBondContact O-N 3.01Å; V211-L214 PolarHBondContact O-N 3.13Å; L214-K216 PolarHBondContact O-N 3.02Å; L214-K216 VanDerWaalsContact O-N 3.14Å; L214-G217 WeakPolarHBondContact O-CA 3.32Å; L214-G217 PolarHBondContact O-N 3.47Å; L214-V230 WeakPolarHBondContact O-CG1 3.21Å; L214-V233 HydrophobicContact CD1-CG1 3.8Å; L214-V233 HydrophobicContact CD2-CG1 4.03Å; L214-L234 HydrophobicContact CB-CD2 3.72Å; L214-L234 HydrophobicContact CB-CG 4.39Å; L214-L237 HydrophobicContact CD1-CD1 3.48Å; L214-L237 VanDerWaalsContact CD1-CD1 3.48Å
215	A	98.9	Very high	97.4	Very high	6 Å²	6	40.3 Å²	40.3	5%	0.05	21%	0.213	C	C	.	.	H	α-helix	trans	-59.7	-26.2	178.7	0	0	0	0	0	113.6	V211 S213 G217 L218 L234 C245	V211-A215 WeakPolarHBondContact O-CB 3.44Å; V211-A215 PolarHBondContact O-N 2.94Å; S213-A215 VanDerWaalsContact C-N 3.35Å; S213-A215 PolarHBondContact O-N 3.35Å; A215-G217 VanDerWaalsContact C-N 3.28Å; A215-G217 PolarHBondContact O-N 2.8Å; A215-L218 WeakPolarHBondContact O-CB 3.41Å; A215-L218 PolarHBondContact O-N 2.99Å; A215-L234 HydrophobicContact CB-CD1 4.48Å; A215-C245 HydrophobicContact CB-CB 4.27Å
216	K	98.8	Very high	97.7	Very high	101 Å²	101	39.7 Å²	39.7	44%	0.439	21%	0.21	S	C	.	.	H	α-helix	trans	-66.3	-31.7	172.6	-62.4	169.4	-169.7	176.7	0	111.9	E182 L186 S212 S213 L214 L218 F219	E182-K216 IonicContact OE1-NZ 3.02Å; E182-K216 PolarHBondContact OE1-NZ 3.18Å; E182-K216 IonicContact OE2-NZ 2.66Å; L186-K216 HydrophobicContact CD1-CB 4.2Å; L186-K216 HydrophobicContact CD1-CD 3.98Å; L186-K216 HydrophobicContact CD2-CB 3.89Å; S212-K216 PolarHBondContact O-N 3.5Å; S213-K216 WeakPolarHBondContact O-CB 3.33Å; S213-K216 PolarHBondContact O-N 3.03Å; S213-K216 VanDerWaalsContact O-N 3.17Å; L214-K216 PolarHBondContact O-N 3.02Å; L214-K216 VanDerWaalsContact O-N 3.14Å; K216-L218 PolarHBondContact O-N 2.79Å; K216-F219 PolarHBondContact O-N 2.78Å
217	G	98.8	Very high	98	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-64.4	-24.4	-179.8	0	0	0	0	0	114	L214 A215 F219 C220	L214-G217 WeakPolarHBondContact O-CA 3.32Å; L214-G217 PolarHBondContact O-N 3.47Å; A215-G217 VanDerWaalsContact C-N 3.28Å; A215-G217 PolarHBondContact O-N 2.8Å; G217-F219 PolarHBondContact O-N 3.15Å; G217-C220 WeakPolarHBondContact O-CB 3.48Å; G217-C220 PolarHBondContact O-N 2.9Å; G217-C220 VanDerWaalsContact O-N 3.13Å
218	L	98.8	Very high	98.2	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.01	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-14.4	171.4	-71.7	176.6	0	0	0	113.3	A215 K216 R227 V230 A231 L234 C245 L246 V249	A215-L218 WeakPolarHBondContact O-CB 3.41Å; A215-L218 PolarHBondContact O-N 2.99Å; K216-L218 PolarHBondContact O-N 2.79Å; L218-R227 WeakPolarHBondContact O-CD 3.18Å; L218-V230 HydrophobicContact CD2-CB 4.22Å; L218-V230 HydrophobicContact CD2-CG1 3.82Å; L218-V230 HydrophobicContact CG-CG1 3.77Å; L218-A231 HydrophobicContact CD2-CB 3.97Å; L218-L234 HydrophobicContact CD1-CD1 3.63Å; L218-L234 HydrophobicContact CD2-CD1 4.32Å; L218-L234 HydrophobicContact CG-CD1 3.91Å; L218-C245 HydrophobicContact CD1-CB 3.77Å; L218-L246 HydrophobicContact CD1-CD2 3.95Å; L218-L246 HydrophobicContact CD1-CG 4.36Å; L218-V249 HydrophobicContact CB-CG2 4.07Å; L218-V249 HydrophobicContact CD1-CG2 4.39Å
219	F	98.6	Very high	98.2	Very high	79 Å²	79	30.2 Å²	30.2	35%	0.346	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.8	9.7	-178.8	-52.3	-74.5	0	0	0	113.2	K216 G217 Q221 C245 K248 V249	K216-F219 PolarHBondContact O-N 2.78Å; G217-F219 PolarHBondContact O-N 3.15Å; F219-Q221 PolarHBondContact O-NE2 2.93Å; F219-C245 HydrophobicContact CE2-CB 4.03Å; F219-C245 HydrophobicContact CZ-CB 4.05Å; F219-K248 HydrophobicContact CE1-CD 3.91Å; F219-K248 HydrophobicContact CE1-CG 4.41Å; F219-K248 HydrophobicContact CZ-CD 4.04Å; F219-V249 HydrophobicContact CE1-CG2 3.97Å; F219-V249 HydrophobicContact CZ-CG2 4.31Å
220	C	98.4	Very high	98.3	Very high	10 Å²	10	26.8 Å²	26.8	7%	0.068	13%	0.13	C	C	.	.			trans	-64.8	143.3	167.3	-70.9	0	0	0	0	110.6	E188 G217 F226 R227	E188-C220 HydrophobicContact CG-CB 4.34Å; G217-C220 WeakPolarHBondContact O-CB 3.48Å; G217-C220 PolarHBondContact O-N 2.9Å; G217-C220 VanDerWaalsContact O-N 3.13Å; C220-F226 HydrophobicContact CB-CD1 4.22Å; C220-F226 HydrophobicContact CB-CE1 4.2Å; C220-R227 VanDerWaalsContact O-CD 3.27Å; C220-R227 WeakPolarHBondContact O-CD 3.1Å; C220-R227 PolarHBondContact O-NH1 3.04Å
221	Q	95.8	Very high	98.3	Very high	148 Å²	148	26.8 Å²	26.8	69%	0.692	13%	0.13	S	C	*	.	S	Bend	trans	-93.4	-31.5	-166.7	-60.6	-60.7	-62.3	0	0	113.6	E188 F219 R227	E188-Q221 PolarHBondContact OE1-N 3.43Å; F219-Q221 PolarHBondContact O-NE2 2.93Å; Q221-R227 PolarHBondContact O-NH1 2.89Å
222	K	95.2	Very high	98.2	Very high	110 Å²	110	27.2 Å²	27.2	48%	0.478	13%	0.132	S	C	.	.	S	Bend	trans	-77.8	-39.7	-163.4	-68.1	-171.8	-172.9	175.5	0	115.8	E188 E189	E188-K222 HydrophobicContact CB-CD 4Å; E188-K222 HydrophobicContact CB-CG 4.44Å; E188-K222 PolarHBondContact O-NZ 3.18Å; E188-K222 WeakPolarHBondContact OE1-CG 3.4Å; E188-K222 PolarHBondContact OE1-N 3.03Å; E189-K222 IonicContact OE1-NZ 2.7Å; E189-K222 PolarHBondContact OE1-NZ 3.48Å; E189-K222 IonicContact OE2-NZ 3.6Å; E189-K222 PolarHBondContact OE2-NZ 2.87Å
223	S	98.1	Very high	98.1	Very high	3 Å²	3	24.8 Å²	24.8	2%	0.021	12%	0.115	C	C	.	.			trans	-125.9	118.1	-169.4	167.7	0	0	0	0	111.2	E134 L225 F226 R227	E134-S223 WeakPolarHBondContact OE1-CB 3.27Å; E134-S223 PolarHBondContact OE1-OG 2.99Å; E134-S223 WeakPolarHBondContact OE2-CB 3.42Å; E134-S223 PolarHBondContact OE2-OG 3.05Å; S223-L225 PolarHBondContact OG-N 3.27Å; S223-F226 WeakPolarHBondContact OG-CB 3.42Å; S223-F226 PolarHBondContact OG-N 2.96Å; S223-R227 PolarHBondContact O-N 3.5Å; S223-R227 PolarHBondContact O-NH1 3.31Å
224	A	98.4	Very high	98.1	Very high	12 Å²	12	24.7 Å²	24.7	10%	0.099	11%	0.114	C	C	.	.	H	α-helix	trans	-67.3	-38.8	172	0	0	0	0	0	111	E131 F226 R227 H228 V259	E131-A224 HydrophobicContact CG-CB 4.4Å; A224-F226 VanDerWaalsContact C-N 3.31Å; A224-F226 PolarHBondContact O-N 3.13Å; A224-R227 PolarHBondContact O-N 3.33Å; A224-R227 VanDerWaalsContact O-N 3.15Å; A224-H228 WeakPolarHBondContact O-CB 3.28Å; A224-H228 PolarHBondContact O-N 3.07Å; A224-V259 HydrophobicContact CB-CG2 4.11Å; A224-V259 VanDerWaalsContact O-CG2 3.27Å; A224-V259 WeakPolarHBondContact O-CG2 3.45Å
225	L	98.6	Very high	97.9	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-56.9	-44.8	174.7	-177.4	72.3	0	0	0	111.5	E131 E134 T135 L138 Y196 S223 R227 H228 E229 M258	E131-L225 HydrophobicContact CB-CB 4.48Å; E131-L225 HydrophobicContact CG-CB 4.44Å; E134-L225 HydrophobicContact CB-CD2 3.48Å; E134-L225 VanDerWaalsContact CB-CD2 3.48Å; E134-L225 WeakPolarHBondContact OE2-CB 3.48Å; T135-L225 VanDerWaalsContact OG1-CD1 3.31Å; T135-L225 WeakPolarHBondContact OG1-CD1 3.42Å; T135-L225 WeakPolarHBondContact OG1-CD2 3.46Å; L138-L225 HydrophobicContact CD1-CD2 4.1Å; Y196-L225 WeakPolarHBondContact OH-CG 3Å; Y196-L225 PolarHBondContact OH-O 3.13Å; S223-L225 PolarHBondContact OG-N 3.27Å; L225-R227 PolarHBondContact O-N 3.38Å; L225-H228 WeakPolarHBondContact O-CB 3.47Å; L225-H228 PolarHBondContact O-N 3.2Å; L225-E229 PolarHBondContact O-N 3.21Å; L225-M258 HydrophobicContact CD1-CE 3.73Å; L225-M258 HydrophobicContact CD1-SD 4.47Å
226	F	98.8	Very high	97.6	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-61.4	-44.8	176.6	179.4	-93.8	0	0	0	111.7	F185 L192 R195 Y196 M199 C220 S223 A224 H228 E229 V230	F185-F226 HydrophobicContact CD2-CE2 4.04Å; F185-F226 AromaticContact CD2-CZ 3.53Å; F185-F226 HydrophobicContact CD2-CZ 3.53Å; F185-F226 HydrophobicContact CE2-CE1 4Å; F185-F226 AromaticContact CE2-CE2 3.9Å; F185-F226 HydrophobicContact CE2-CE2 3.9Å; F185-F226 AromaticContact CE2-CZ 3.22Å; F185-F226 HydrophobicContact CE2-CZ 3.22Å; F185-F226 HydrophobicContact CG-CZ 4.35Å; F185-F226 HydrophobicContact CZ-CE1 4.2Å; F185-F226 AromaticContact CZ-CZ 3.83Å; F185-F226 HydrophobicContact CZ-CZ 3.83Å; F185-F226 WeakPolarHBondContact O-CZ 3.24Å; L192-F226 HydrophobicContact CD1-CB 4.3Å; L192-F226 HydrophobicContact CD1-CD2 4.14Å; R195-F226 HydrophobicContact CB-CD2 4.46Å; R195-F226 HydrophobicContact CB-CE2 3.82Å; Y196-F226 HydrophobicContact CD2-CD2 4.09Å; Y196-F226 HydrophobicContact CE2-CB 4.46Å; Y196-F226 AromaticContact CE2-CD2 3.84Å; Y196-F226 HydrophobicContact CE2-CD2 3.84Å; M199-F226 HydrophobicContact CE-CD2 3.59Å; M199-F226 HydrophobicContact CE-CE2 3.37Å; M199-F226 HydrophobicContact CE-CG 4.34Å; M199-F226 HydrophobicContact CE-CZ 3.99Å; C220-F226 HydrophobicContact CB-CD1 4.22Å; C220-F226 HydrophobicContact CB-CE1 4.2Å; S223-F226 WeakPolarHBondContact OG-CB 3.42Å; S223-F226 PolarHBondContact OG-N 2.96Å; A224-F226 VanDerWaalsContact C-N 3.31Å; A224-F226 PolarHBondContact O-N 3.13Å; F226-H228 VanDerWaalsContact C-N 3.34Å; F226-E229 PolarHBondContact O-N 3.43Å; F226-V230 HydrophobicContact CD1-CG2 4.11Å; F226-V230 HydrophobicContact CE1-CG2 3.78Å; F226-V230 HydrophobicContact CZ-CG2 4.1Å; F226-V230 VanDerWaalsContact O-CG2 3.29Å; F226-V230 WeakPolarHBondContact O-CG2 3.43Å; F226-V230 PolarHBondContact O-N 3.04Å
227	R	98.7	Very high	97.3	Very high	24 Å²	24	21.9 Å²	21.9	9%	0.091	10%	0.103	C	C	.	.	H	α-helix	trans	-65.4	-37.6	177.9	-69.3	-163.4	-65.4	-67	-6.2	112.5	L218 C220 Q221 S223 A224 L225 V230 A231 E255 V259	L218-R227 WeakPolarHBondContact O-CD 3.18Å; C220-R227 VanDerWaalsContact O-CD 3.27Å; C220-R227 WeakPolarHBondContact O-CD 3.1Å; C220-R227 PolarHBondContact O-NH1 3.04Å; Q221-R227 PolarHBondContact O-NH1 2.89Å; S223-R227 PolarHBondContact O-N 3.5Å; S223-R227 PolarHBondContact O-NH1 3.31Å; A224-R227 PolarHBondContact O-N 3.33Å; A224-R227 VanDerWaalsContact O-N 3.15Å; L225-R227 PolarHBondContact O-N 3.38Å; R227-V230 PolarHBondContact O-N 3.39Å; R227-A231 PolarHBondContact O-N 2.68Å; R227-E255 IonicContact CZ-OE1 3.9Å; R227-E255 IonicContact CZ-OE2 3.53Å; R227-E255 IonicContact NE-OE1 3.45Å; R227-E255 IonicContact NE-OE2 3.52Å; R227-E255 PolarHBondContact NE-OE2 3.05Å; R227-E255 IonicContact NH2-OE1 2.6Å; R227-E255 PolarHBondContact NH2-OE1 3.39Å; R227-E255 IonicContact NH2-OE2 2.72Å; R227-E255 PolarHBondContact NH2-OE2 3.23Å; R227-V259 HydrophobicContact CB-CB 4.47Å; R227-V259 HydrophobicContact CB-CG1 3.73Å; R227-V259 HydrophobicContact CB-CG2 3.81Å
228	H	98.5	Very high	97.1	Very high	6 Å²	6	23.9 Å²	23.9	3%	0.028	12%	0.117	C	C	.	.	H	α-helix	trans	-56.7	-53.4	171.3	161.1	-83.2	0	0	0	110	A224 L225 F226 V230 A231 F232 M258 V259 H261 E262	A224-H228 WeakPolarHBondContact O-CB 3.28Å; A224-H228 PolarHBondContact O-N 3.07Å; L225-H228 WeakPolarHBondContact O-CB 3.47Å; L225-H228 PolarHBondContact O-N 3.2Å; F226-H228 VanDerWaalsContact C-N 3.34Å; H228-V230 VanDerWaalsContact C-N 3.27Å; H228-V230 PolarHBondContact O-N 3.23Å; H228-A231 WeakPolarHBondContact O-CA 3.27Å; H228-A231 WeakPolarHBondContact O-CB 3.43Å; H228-A231 PolarHBondContact O-N 2.99Å; H228-F232 PolarHBondContact O-N 3.04Å; H228-M258 HydrophobicContact CB-CE 4.47Å; H228-M258 HydrophobicContact CB-CG 3.91Å; H228-M258 HydrophobicContact CB-SD 3.94Å; H228-V259 HydrophobicContact CB-CG2 4.39Å; H228-H261 AromaticContact CD2-NE2 3.76Å; H228-H261 AromaticContact NE2-NE2 3.94Å; H228-E262 IonicContact CD2-OE2 2.84Å; H228-E262 IonicContact NE2-OE2 3.45Å; H228-E262 PolarHBondContact NE2-OE2 3.22Å; H228-E262 WeakPolarHBondContact O-CG 3.39Å
229	E	98.4	Very high	96.8	Very high	3 Å²	3	24.7 Å²	24.7	1%	0.014	12%	0.122	C	C	.	.	H	α-helix	trans	-62.5	-34.8	-179.9	-166.1	66.2	-158	0	0	112.8	Y196 M199 F200 L225 F226 F232 V233	Y196-E229 HydrophobicContact CD1-CG 4.27Å; Y196-E229 HydrophobicContact CE1-CB 4.01Å; Y196-E229 HydrophobicContact CE1-CG 3.58Å; Y196-E229 WeakPolarHBondContact OH-CB 3.41Å; M199-E229 HydrophobicContact CE-CB 3.98Å; M199-E229 HydrophobicContact CE-CG 4.01Å; M199-E229 HydrophobicContact SD-CB 3.98Å; M199-E229 HydrophobicContact SD-CG 3.55Å; M199-E229 VanDerWaalsContact SD-CG 3.55Å; F200-E229 HydrophobicContact CZ-CG 4.21Å; F200-E229 VanDerWaalsContact CZ-OE1 3.28Å; F200-E229 WeakPolarHBondContact CZ-OE1 3.37Å; L225-E229 PolarHBondContact O-N 3.21Å; F226-E229 PolarHBondContact O-N 3.43Å; E229-F232 WeakPolarHBondContact O-CB 3.47Å; E229-F232 PolarHBondContact O-N 2.96Å; E229-F232 WeakPolarHBondContact OE1-CD1 3.45Å; E229-V233 WeakPolarHBondContact O-CB 3.32Å; E229-V233 WeakPolarHBondContact O-CG2 3.49Å; E229-V233 PolarHBondContact O-N 3.39Å
230	V	98.8	Very high	96.7	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-61.6	-45.2	172.8	172.2	0	0	0	0	111	F185 M199 L214 L218 F226 R227 H228 F232 V233 L234	F185-V230 HydrophobicContact CE2-CG2 3.71Å; F185-V230 HydrophobicContact CZ-CG1 4.42Å; F185-V230 HydrophobicContact CZ-CG2 3.57Å; M199-V230 HydrophobicContact CE-CG2 3.66Å; M199-V230 HydrophobicContact SD-CG2 4.05Å; L214-V230 WeakPolarHBondContact O-CG1 3.21Å; L218-V230 HydrophobicContact CD2-CB 4.22Å; L218-V230 HydrophobicContact CD2-CG1 3.82Å; L218-V230 HydrophobicContact CG-CG1 3.77Å; F226-V230 HydrophobicContact CD1-CG2 4.11Å; F226-V230 HydrophobicContact CE1-CG2 3.78Å; F226-V230 HydrophobicContact CZ-CG2 4.1Å; F226-V230 VanDerWaalsContact O-CG2 3.29Å; F226-V230 WeakPolarHBondContact O-CG2 3.43Å; F226-V230 PolarHBondContact O-N 3.04Å; R227-V230 PolarHBondContact O-N 3.39Å; H228-V230 VanDerWaalsContact C-N 3.27Å; H228-V230 PolarHBondContact O-N 3.23Å; V230-F232 VanDerWaalsContact C-N 3.31Å; V230-F232 PolarHBondContact O-N 3.25Å; V230-V233 PolarHBondContact O-N 2.99Å; V230-L234 HydrophobicContact CG1-CD1 3.89Å; V230-L234 HydrophobicContact CG1-CG 4.37Å; V230-L234 WeakPolarHBondContact O-CB 3.2Å; V230-L234 WeakPolarHBondContact O-CG 3.31Å; V230-L234 PolarHBondContact O-N 2.95Å
231	A	98.7	Very high	96.6	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-61.2	-42.3	175.2	0	0	0	0	0	111	L218 R227 H228 V233 L234 G235 L246 E262	L218-A231 HydrophobicContact CD2-CB 3.97Å; R227-A231 PolarHBondContact O-N 2.68Å; H228-A231 WeakPolarHBondContact O-CA 3.27Å; H228-A231 WeakPolarHBondContact O-CB 3.43Å; H228-A231 PolarHBondContact O-N 2.99Å; A231-V233 PolarHBondContact O-N 3.17Å; A231-L234 PolarHBondContact O-N 3.06Å; A231-G235 PolarHBondContact O-N 3.33Å; A231-L246 HydrophobicContact CB-CD2 4.17Å; A231-E262 HydrophobicContact CB-CB 3.91Å; A231-E262 HydrophobicContact CB-CG 3.84Å
232	F	96.8	Very high	96.7	Very high	13 Å²	13	20.1 Å²	20.1	6%	0.057	11%	0.112	C	C	.	.	H	α-helix	trans	-53	-55.1	174.6	175.4	-98.9	0	0	0	111.8	M1 Y74 H228 E229 V230 L234 G235 Q236 E262	M1-F232 HydrophobicContact CB-CD2 4.08Å; M1-F232 HydrophobicContact CB-CE2 4.3Å; M1-F232 VanDerWaalsContact CE-CA 3.48Å; M1-F232 HydrophobicContact CE-CB 4.46Å; M1-F232 HydrophobicContact CG-CD2 4.14Å; M1-F232 HydrophobicContact CG-CE2 4.4Å; Y74-F232 HydrophobicContact CE2-CE2 4.34Å; H228-F232 PolarHBondContact O-N 3.04Å; E229-F232 WeakPolarHBondContact O-CB 3.47Å; E229-F232 PolarHBondContact O-N 2.96Å; E229-F232 WeakPolarHBondContact OE1-CD1 3.45Å; V230-F232 VanDerWaalsContact C-N 3.31Å; V230-F232 PolarHBondContact O-N 3.25Å; F232-L234 VanDerWaalsContact C-N 3.34Å; F232-L234 PolarHBondContact O-N 3.49Å; F232-G235 PolarHBondContact O-N 2.93Å; F232-G235 VanDerWaalsContact O-N 3.15Å; F232-Q236 HydrophobicContact CD1-CG 4.34Å; F232-Q236 HydrophobicContact CE1-CG 3.98Å; F232-Q236 HydrophobicContact CZ-CG 4.11Å; F232-Q236 VanDerWaalsContact CZ-NE2 3.32Å; F232-Q236 WeakPolarHBondContact O-CG 3.42Å; F232-Q236 PolarHBondContact O-N 3.47Å; F232-E262 HydrophobicContact CB-CG 3.99Å; F232-E262 WeakPolarHBondContact CB-OE1 3.42Å; F232-E262 VanDerWaalsContact CD2-OE1 3.28Å; F232-E262 WeakPolarHBondContact CD2-OE1 3.46Å
233	V	96.3	Very high	96.9	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-61.9	-38.9	-179.9	165.5	0	0	0	0	112.5	M199 F200 R203 L214 E229 V230 A231 G235 Q236 L237	M199-V233 HydrophobicContact CG-CG2 4.15Å; M199-V233 HydrophobicContact SD-CB 4.39Å; M199-V233 HydrophobicContact SD-CG2 3.81Å; F200-V233 HydrophobicContact CD1-CG2 4.17Å; F200-V233 HydrophobicContact CE1-CG2 3.8Å; R203-V233 HydrophobicContact CB-CG1 3.56Å; R203-V233 HydrophobicContact CG-CG1 3.67Å; L214-V233 HydrophobicContact CD1-CG1 3.8Å; L214-V233 HydrophobicContact CD2-CG1 4.03Å; E229-V233 WeakPolarHBondContact O-CB 3.32Å; E229-V233 WeakPolarHBondContact O-CG2 3.49Å; E229-V233 PolarHBondContact O-N 3.39Å; V230-V233 PolarHBondContact O-N 2.99Å; A231-V233 PolarHBondContact O-N 3.17Å; V233-G235 VanDerWaalsContact C-N 3.33Å; V233-Q236 PolarHBondContact O-N 3.31Å; V233-L237 HydrophobicContact CG1-CD1 4.2Å; V233-L237 WeakPolarHBondContact O-CG 3.27Å; V233-L237 PolarHBondContact O-N 2.85Å; V233-L237 VanDerWaalsContact O-N 3.1Å
234	L	97.5	Very high	96.9	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.005	12%	0.123	C	C	.	.	H	α-helix	trans	-65.8	-37.7	176.1	-70.5	169.6	0	0	0	111.8	V211 L214 A215 L218 V230 A231 F232 L237 S238 A242 L246	V211-L234 HydrophobicContact CG1-CD2 3.93Å; L214-L234 HydrophobicContact CB-CD2 3.72Å; L214-L234 HydrophobicContact CB-CG 4.39Å; A215-L234 HydrophobicContact CB-CD1 4.48Å; L218-L234 HydrophobicContact CD1-CD1 3.63Å; L218-L234 HydrophobicContact CD2-CD1 4.32Å; L218-L234 HydrophobicContact CG-CD1 3.91Å; V230-L234 HydrophobicContact CG1-CD1 3.89Å; V230-L234 HydrophobicContact CG1-CG 4.37Å; V230-L234 WeakPolarHBondContact O-CB 3.2Å; V230-L234 WeakPolarHBondContact O-CG 3.31Å; V230-L234 PolarHBondContact O-N 2.95Å; A231-L234 PolarHBondContact O-N 3.06Å; F232-L234 VanDerWaalsContact C-N 3.34Å; F232-L234 PolarHBondContact O-N 3.49Å; L234-L237 PolarHBondContact O-N 3.15Å; L234-S238 PolarHBondContact O-N 3.19Å; L234-S238 VanDerWaalsContact O-N 3.09Å; L234-A242 HydrophobicContact CB-CB 4.18Å; L234-A242 HydrophobicContact CD1-CB 4.27Å; L234-A242 HydrophobicContact CD2-CB 3.87Å; L234-A242 HydrophobicContact CG-CB 4.33Å; L234-L246 HydrophobicContact CB-CD1 4.5Å; L234-L246 HydrophobicContact CB-CD2 4.45Å; L234-L246 HydrophobicContact CD1-CD2 4.14Å
235	G	94.6	Very high	96.9	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-63.5	-43.9	172.8	0	0	0	0	0	112.8	M1 A231 F232 V233 L237 S238	M1-G235 VanDerWaalsContact SD-CA 3.56Å; A231-G235 PolarHBondContact O-N 3.33Å; F232-G235 PolarHBondContact O-N 2.93Å; F232-G235 VanDerWaalsContact O-N 3.15Å; V233-G235 VanDerWaalsContact C-N 3.33Å; G235-L237 PolarHBondContact O-N 3.3Å; G235-S238 WeakPolarHBondContact O-CA 3.5Å; G235-S238 PolarHBondContact O-N 3.38Å; G235-S238 PolarHBondContact O-OG 3.45Å
236	Q	92.4	Very high	97	Very high	20 Å²	20	23 Å²	23	9%	0.093	13%	0.129	C	C	.	.	H	α-helix	trans	-58.4	-35.3	173.8	-66.2	-165.8	-47.9	0	0	113.2	F160 S162 F232 V233 S238	F160-Q236 HydrophobicContact CD1-CB 3.95Å; F160-Q236 HydrophobicContact CE1-CB 4.14Å; S162-Q236 VanDerWaalsContact CB-NE2 3.34Å; S162-Q236 PolarHBondContact OG-NE2 3.05Å; F232-Q236 HydrophobicContact CD1-CG 4.34Å; F232-Q236 HydrophobicContact CE1-CG 3.98Å; F232-Q236 HydrophobicContact CZ-CG 4.11Å; F232-Q236 VanDerWaalsContact CZ-NE2 3.32Å; F232-Q236 WeakPolarHBondContact O-CG 3.42Å; F232-Q236 PolarHBondContact O-N 3.47Å; V233-Q236 PolarHBondContact O-N 3.31Å; Q236-S238 VanDerWaalsContact C-N 3.31Å
237	L	93.7	Very high	97	Very high	29 Å²	29	24.8 Å²	24.8	15%	0.152	14%	0.137	C	C	.	.	H	α-helix	trans	-75.9	-21.8	176.6	-71.6	165.2	0	0	0	112.7	F160 R203 A206 V211 L214 V233 L234 G235 S239	F160-L237 HydrophobicContact CE1-CD2 4.26Å; F160-L237 HydrophobicContact CZ-CD2 3.82Å; R203-L237 HydrophobicContact CG-CD1 4.27Å; R203-L237 HydrophobicContact CG-CD2 4.17Å; R203-L237 HydrophobicContact CG-CG 4.11Å; A206-L237 HydrophobicContact CB-CD2 3.76Å; V211-L237 HydrophobicContact CG2-CB 4.4Å; V211-L237 HydrophobicContact CG2-CD1 3.92Å; L214-L237 HydrophobicContact CD1-CD1 3.48Å; L214-L237 VanDerWaalsContact CD1-CD1 3.48Å; V233-L237 HydrophobicContact CG1-CD1 4.2Å; V233-L237 WeakPolarHBondContact O-CG 3.27Å; V233-L237 PolarHBondContact O-N 2.85Å; V233-L237 VanDerWaalsContact O-N 3.1Å; L234-L237 PolarHBondContact O-N 3.15Å; G235-L237 PolarHBondContact O-N 3.3Å; L237-S239 PolarHBondContact O-N 3.39Å
238	S	93	Very high	97	Very high	42 Å²	42	30.3 Å²	30.3	29%	0.294	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.7	34.5	178.5	-52.6	0	0	0	0	113.2	L234 G235 Q236	L234-S238 PolarHBondContact O-N 3.19Å; L234-S238 VanDerWaalsContact O-N 3.09Å; G235-S238 WeakPolarHBondContact O-CA 3.5Å; G235-S238 PolarHBondContact O-N 3.38Å; G235-S238 PolarHBondContact O-OG 3.45Å; Q236-S238 VanDerWaalsContact C-N 3.31Å
239	S	94.5	Very high	97	Very high	19 Å²	19	30.3 Å²	30.3	13%	0.133	16%	0.162	C	C	.	.			trans	-90.8	128.9	-174.7	178.5	0	0	0	0	111.3	L237 V241 A242	L237-S239 PolarHBondContact O-N 3.39Å; S239-V241 PolarHBondContact O-N 2.82Å; S239-V241 PolarHBondContact OG-N 3.45Å; S239-A242 PolarHBondContact O-N 2.84Å; S239-A242 VanDerWaalsContact O-N 3.12Å
240	P	95.4	Very high	97	Very high	87 Å²	87	30.1 Å²	30.1	57%	0.565	16%	0.161	S	C	*	.	G	3₁₀ helix	trans	-57.6	-22	175.5	-27.4	36	0	0	0	114.6	A242 V243	P240-A242 PolarHBondContact O-N 2.72Å; P240-V243 WeakPolarHBondContact O-CB 3.3Å; P240-V243 WeakPolarHBondContact O-CG2 3.28Å; P240-V243 PolarHBondContact O-N 3.11Å; P240-V243 VanDerWaalsContact O-N 3.16Å
241	V	97.4	Very high	97	Very high	53 Å²	53	32.1 Å²	32.1	32%	0.321	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	-57.5	-30.3	177.3	174.8	0	0	0	0	111.9	E208 V211 S212 S239	E208-V241 HydrophobicContact CB-CG2 4.34Å; E208-V241 HydrophobicContact CG-CG2 4.13Å; V211-V241 HydrophobicContact CB-CG1 4.46Å; V211-V241 HydrophobicContact CG1-CB 3.86Å; V211-V241 HydrophobicContact CG1-CG1 3.98Å; S212-V241 WeakPolarHBondContact OG-CG1 3.49Å; S239-V241 PolarHBondContact O-N 2.82Å; S239-V241 PolarHBondContact OG-N 3.45Å
242	A	97.9	Very high	97	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-82.7	-16.9	-177.6	0	0	0	0	0	114.2	V211 L234 S239 P240 Q244 C245 L246 I270	V211-A242 HydrophobicContact CG1-CB 4.17Å; L234-A242 HydrophobicContact CB-CB 4.18Å; L234-A242 HydrophobicContact CD1-CB 4.27Å; L234-A242 HydrophobicContact CD2-CB 3.87Å; L234-A242 HydrophobicContact CG-CB 4.33Å; S239-A242 PolarHBondContact O-N 2.84Å; S239-A242 VanDerWaalsContact O-N 3.12Å; P240-A242 PolarHBondContact O-N 2.72Å; A242-Q244 PolarHBondContact O-N 2.86Å; A242-C245 PolarHBondContact O-N 2.8Å; A242-L246 HydrophobicContact CB-CD1 3.86Å; A242-L246 HydrophobicContact CB-CG 4.31Å; A242-L246 WeakPolarHBondContact O-CG 3.25Å; A242-L246 PolarHBondContact O-N 3.27Å; A242-I270 HydrophobicContact CB-CD1 4.46Å
243	V	98.5	Very high	97	Very high	5 Å²	5	39.9 Å²	39.9	3%	0.03	22%	0.223	C	C	.	.	H	α-helix	trans	-55.5	-50.2	-166.1	171.5	0	0	0	0	112.2	P240 C245 L246 Q247 L267 I270 E274	P240-V243 WeakPolarHBondContact O-CB 3.3Å; P240-V243 WeakPolarHBondContact O-CG2 3.28Å; P240-V243 PolarHBondContact O-N 3.11Å; P240-V243 VanDerWaalsContact O-N 3.16Å; V243-C245 VanDerWaalsContact C-N 3.27Å; V243-C245 PolarHBondContact O-N 3.14Å; V243-L246 PolarHBondContact O-N 3.43Å; V243-Q247 HydrophobicContact CG1-CG 4.16Å; V243-Q247 WeakPolarHBondContact O-CB 3.24Å; V243-Q247 VanDerWaalsContact O-CG 3.24Å; V243-Q247 WeakPolarHBondContact O-CG 3.31Å; V243-Q247 PolarHBondContact O-N 3.29Å; V243-L267 HydrophobicContact CG1-CD2 4.21Å; V243-I270 HydrophobicContact CG2-CD1 3.91Å; V243-I270 HydrophobicContact CG2-CG2 3.76Å; V243-E274 HydrophobicContact CG1-CG 4.25Å
244	Q	98.6	Very high	97.1	Very high	150 Å²	150	49 Å²	49	70%	0.701	26%	0.263	S	S	*	.	H	α-helix	trans	-61.3	-36.3	-178.3	-67	-175.6	10.5	0	0	112.7	A242 K248	A242-Q244 PolarHBondContact O-N 2.86Å; Q244-K248 WeakPolarHBondContact O-CB 3.41Å; Q244-K248 PolarHBondContact O-N 3.48Å; Q244-K248 VanDerWaalsContact O-N 3.13Å
245	C	98.8	Very high	97.1	Very high	32 Å²	32	50.4 Å²	50.4	22%	0.216	27%	0.27	C	S	.	.	H	α-helix	trans	-72.6	-45.4	178.8	-64.2	0	0	0	0	110.9	A215 L218 F219 A242 V243 Q247 K248 V249	A215-C245 HydrophobicContact CB-CB 4.27Å; L218-C245 HydrophobicContact CD1-CB 3.77Å; F219-C245 HydrophobicContact CE2-CB 4.03Å; F219-C245 HydrophobicContact CZ-CB 4.05Å; A242-C245 PolarHBondContact O-N 2.8Å; V243-C245 VanDerWaalsContact C-N 3.27Å; V243-C245 PolarHBondContact O-N 3.14Å; C245-Q247 PolarHBondContact O-N 3.33Å; C245-K248 WeakPolarHBondContact O-CB 3.46Å; C245-K248 PolarHBondContact O-N 3.49Å; C245-V249 WeakPolarHBondContact O-CG2 3.49Å; C245-V249 PolarHBondContact O-N 2.97Å
246	L	98.9	Very high	97.3	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-60.3	-45.1	177	-67.8	167.9	0	0	0	111.7	L218 A231 L234 A242 V243 K248 V249 L250 C263 A266 L267 I270	L218-L246 HydrophobicContact CD1-CD2 3.95Å; L218-L246 HydrophobicContact CD1-CG 4.36Å; A231-L246 HydrophobicContact CB-CD2 4.17Å; L234-L246 HydrophobicContact CB-CD1 4.5Å; L234-L246 HydrophobicContact CB-CD2 4.45Å; L234-L246 HydrophobicContact CD1-CD2 4.14Å; A242-L246 HydrophobicContact CB-CD1 3.86Å; A242-L246 HydrophobicContact CB-CG 4.31Å; A242-L246 WeakPolarHBondContact O-CG 3.25Å; A242-L246 PolarHBondContact O-N 3.27Å; V243-L246 PolarHBondContact O-N 3.43Å; L246-K248 VanDerWaalsContact C-N 3.33Å; L246-K248 PolarHBondContact O-N 3.28Å; L246-V249 PolarHBondContact O-N 2.93Å; L246-L250 WeakPolarHBondContact O-CB 3.38Å; L246-L250 PolarHBondContact O-N 3.3Å; L246-C263 HydrophobicContact CD2-CB 4.22Å; L246-A266 HydrophobicContact CD1-CB 3.72Å; L246-A266 HydrophobicContact CD2-CB 3.81Å; L246-A266 HydrophobicContact CG-CB 4.38Å; L246-L267 HydrophobicContact CB-CD1 4.44Å; L246-L267 HydrophobicContact CB-CD2 3.9Å; L246-L267 HydrophobicContact CB-CG 4Å; L246-L267 HydrophobicContact CD1-CD2 4.36Å; L246-I270 HydrophobicContact CD1-CD1 3.54Å
247	Q	98.8	Very high	97.6	Very high	36 Å²	36	52 Å²	52	17%	0.168	29%	0.285	C	S	.	.	H	α-helix	trans	-59.2	-43.8	174.9	-72.2	172.7	-41.4	0	0	112.2	V243 C245 V249 A251 L267 E274 T278	V243-Q247 HydrophobicContact CG1-CG 4.16Å; V243-Q247 WeakPolarHBondContact O-CB 3.24Å; V243-Q247 VanDerWaalsContact O-CG 3.24Å; V243-Q247 WeakPolarHBondContact O-CG 3.31Å; V243-Q247 PolarHBondContact O-N 3.29Å; C245-Q247 PolarHBondContact O-N 3.33Å; Q247-V249 VanDerWaalsContact C-N 3.3Å; Q247-V249 PolarHBondContact O-N 3.46Å; Q247-A251 VanDerWaalsContact O-CB 3.24Å; Q247-A251 WeakPolarHBondContact O-CB 3.44Å; Q247-A251 PolarHBondContact O-N 2.83Å; Q247-L267 HydrophobicContact CG-CD1 4.34Å; Q247-L267 HydrophobicContact CG-CD2 4.11Å; Q247-E274 PolarHBondContact NE2-OE1 3.28Å; Q247-E274 VanDerWaalsContact NE2-OE1 3.11Å; Q247-E274 PolarHBondContact OE1-OE1 3.28Å; Q247-T278 HydrophobicContact CB-CG2 4.41Å; Q247-T278 HydrophobicContact CG-CG2 3.9Å; Q247-T278 PolarHBondContact NE2-OG1 3.4Å
248	K	98.9	Very high	97.8	Very high	140 Å²	140	51.1 Å²	51.1	61%	0.609	28%	0.281	S	S	*	.	H	α-helix	trans	-62.2	-39.5	180	-177.7	178.5	176.4	-172.4	0	111.6	F219 Q244 C245 L246 N252	F219-K248 HydrophobicContact CE1-CD 3.91Å; F219-K248 HydrophobicContact CE1-CG 4.41Å; F219-K248 HydrophobicContact CZ-CD 4.04Å; Q244-K248 WeakPolarHBondContact O-CB 3.41Å; Q244-K248 PolarHBondContact O-N 3.48Å; Q244-K248 VanDerWaalsContact O-N 3.13Å; C245-K248 WeakPolarHBondContact O-CB 3.46Å; C245-K248 PolarHBondContact O-N 3.49Å; L246-K248 VanDerWaalsContact C-N 3.33Å; L246-K248 PolarHBondContact O-N 3.28Å; K248-N252 PolarHBondContact O-N 3.34Å
249	V	98.9	Very high	98	Very high	6 Å²	6	49.1 Å²	49.1	4%	0.036	27%	0.267	C	S	.	.	H	α-helix	trans	-73.8	-46.9	178.4	177.8	0	0	0	0	111.3	L218 F219 C245 L246 Q247 A251 N252 E255 V259 C263	L218-V249 HydrophobicContact CB-CG2 4.07Å; L218-V249 HydrophobicContact CD1-CG2 4.39Å; F219-V249 HydrophobicContact CE1-CG2 3.97Å; F219-V249 HydrophobicContact CZ-CG2 4.31Å; C245-V249 WeakPolarHBondContact O-CG2 3.49Å; C245-V249 PolarHBondContact O-N 2.97Å; L246-V249 PolarHBondContact O-N 2.93Å; Q247-V249 VanDerWaalsContact C-N 3.3Å; Q247-V249 PolarHBondContact O-N 3.46Å; V249-A251 PolarHBondContact O-N 3.12Å; V249-N252 WeakPolarHBondContact O-CB 3.48Å; V249-N252 PolarHBondContact O-N 3.29Å; V249-E255 HydrophobicContact CG1-CG 4.02Å; V249-V259 HydrophobicContact CG1-CG1 3.66Å; V249-C263 VanDerWaalsContact CG1-SG 3.55Å
250	L	98.8	Very high	98.2	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-55.1	-39.5	175.2	174.5	57.4	0	0	0	112	L246 N252 R260 C263 A264 L267 T278 F282 V290	L246-L250 WeakPolarHBondContact O-CB 3.38Å; L246-L250 PolarHBondContact O-N 3.3Å; L250-N252 VanDerWaalsContact C-N 3.29Å; L250-N252 PolarHBondContact O-N 3.42Å; L250-R260 HydrophobicContact CD1-CB 4.36Å; L250-R260 WeakPolarHBondContact CD1-O 3.48Å; L250-R260 PolarHBondContact O-NE 2.66Å; L250-R260 PolarHBondContact O-NH2 3.27Å; L250-C263 HydrophobicContact CB-CB 4.1Å; L250-A264 HydrophobicContact CD1-CB 4.18Å; L250-A264 HydrophobicContact CD2-CB 4.24Å; L250-L267 HydrophobicContact CD2-CD1 3.63Å; L250-T278 HydrophobicContact CD2-CG2 3.92Å; L250-F282 HydrophobicContact CD1-CD2 4.42Å; L250-F282 HydrophobicContact CD1-CG 4.36Å; L250-F282 HydrophobicContact CD2-CD2 3.71Å; L250-F282 HydrophobicContact CD2-CE2 4.24Å; L250-F282 HydrophobicContact CD2-CG 4.35Å; L250-F282 HydrophobicContact CG-CD2 3.74Å; L250-F282 HydrophobicContact CG-CE2 3.99Å; L250-F282 HydrophobicContact CG-CG 4.16Å; L250-V290 HydrophobicContact CD1-CG1 3.62Å
251	A	98.7	Very high	98.4	Very high	42 Å²	42	44.6 Å²	44.6	35%	0.347	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-11.2	178.9	0	0	0	0	0	115	Q247 V249 T253 F282	Q247-A251 VanDerWaalsContact O-CB 3.24Å; Q247-A251 WeakPolarHBondContact O-CB 3.44Å; Q247-A251 PolarHBondContact O-N 2.83Å; V249-A251 PolarHBondContact O-N 3.12Å; A251-T253 PolarHBondContact O-N 3.36Å; A251-F282 VanDerWaalsContact CA-CZ 3.48Å; A251-F282 HydrophobicContact CB-CE2 4.3Å; A251-F282 HydrophobicContact CB-CZ 3.7Å
252	N	98.5	Very high	98.4	Very high	70 Å²	70	42.2 Å²	42.2	37%	0.374	22%	0.221	S	C	.	.			trans	-83.9	96.3	179.4	-178.8	16.1	0	0	0	110.7	K248 V249 L250 K254 E255 R260	K248-N252 PolarHBondContact O-N 3.34Å; V249-N252 WeakPolarHBondContact O-CB 3.48Å; V249-N252 PolarHBondContact O-N 3.29Å; L250-N252 VanDerWaalsContact C-N 3.29Å; L250-N252 PolarHBondContact O-N 3.42Å; N252-K254 PolarHBondContact O-N 3.21Å; N252-K254 WeakPolarHBondContact OD1-CB 3.48Å; N252-K254 PolarHBondContact OD1-N 3.4Å; N252-E255 HydrophobicContact CB-CB 4.09Å; N252-E255 VanDerWaalsContact O-CB 3.24Å; N252-E255 WeakPolarHBondContact O-CB 3.39Å; N252-E255 PolarHBondContact O-N 2.99Å; N252-R260 WeakPolarHBondContact O-CD 3.32Å
253	T	97.5	Very high	98.5	Very high	105 Å²	105	42.2 Å²	42.2	64%	0.644	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-6.6	179	58.4	0	0	0	0	114.7	A251	A251-T253 PolarHBondContact O-N 3.36Å
254	K	97.6	Very high	98.5	Very high	191 Å²	191	42 Å²	42	83%	0.83	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-10	171.2	-59.2	-176.4	179.1	-178	0	113	N252	N252-K254 PolarHBondContact O-N 3.21Å; N252-K254 WeakPolarHBondContact OD1-CB 3.48Å; N252-K254 PolarHBondContact OD1-N 3.4Å
255	E	98.1	Very high	98.4	Very high	32 Å²	32	34.8 Å²	34.8	15%	0.15	19%	0.186	C	C	.	.	S	Bend	trans	-76.4	153.2	175.1	-177.6	58.1	-86.5	0	0	110.5	R227 V249 N252 V259 R260	R227-E255 IonicContact CZ-OE1 3.9Å; R227-E255 IonicContact CZ-OE2 3.53Å; R227-E255 IonicContact NE-OE1 3.45Å; R227-E255 IonicContact NE-OE2 3.52Å; R227-E255 PolarHBondContact NE-OE2 3.05Å; R227-E255 IonicContact NH2-OE1 2.6Å; R227-E255 PolarHBondContact NH2-OE1 3.39Å; R227-E255 IonicContact NH2-OE2 2.72Å; R227-E255 PolarHBondContact NH2-OE2 3.23Å; V249-E255 HydrophobicContact CG1-CG 4.02Å; N252-E255 HydrophobicContact CB-CB 4.09Å; N252-E255 VanDerWaalsContact O-CB 3.24Å; N252-E255 WeakPolarHBondContact O-CB 3.39Å; N252-E255 PolarHBondContact O-N 2.99Å; E255-V259 HydrophobicContact CG-CB 3.81Å; E255-V259 HydrophobicContact CG-CG1 4.09Å; E255-V259 HydrophobicContact CG-CG2 4.47Å; E255-R260 HydrophobicContact CB-CG 3.95Å; E255-R260 HydrophobicContact CG-CG 4.01Å
256	S	98	Very high	98.3	Very high	37 Å²	37	33.3 Å²	33.3	26%	0.259	18%	0.176	S	C	.	.			trans	-54.9	136.1	173.9	177.9	0	0	0	0	111.6	M258 V259 R260	S256-M258 PolarHBondContact O-N 3.04Å; S256-M258 WeakPolarHBondContact OG-CB 3.34Å; S256-M258 PolarHBondContact OG-N 3.33Å; S256-V259 PolarHBondContact O-N 3.22Å; S256-R260 WeakPolarHBondContact O-CG 3.47Å; S256-R260 PolarHBondContact O-N 3.38Å
257	G	98.2	Very high	98.2	Very high	16 Å²	16	33.3 Å²	33.3	17%	0.165	18%	0.176	C	C	.	.	H	α-helix	trans	-53.3	-36.1	173.5	0	0	0	0	0	112.4	V259 R260 H261	G257-V259 PolarHBondContact O-N 3.1Å; G257-R260 PolarHBondContact O-N 3.03Å; G257-H261 PolarHBondContact O-CD2 3.24Å; G257-H261 PolarHBondContact O-N 3.2Å
258	M	98.1	Very high	98	Very high	11 Å²	11	31.6 Å²	31.6	5%	0.054	17%	0.168	C	C	.	.	H	α-helix	trans	-53.3	-52	173	-172.7	-169.6	-143.8	0	0	112.4	H103 E131 L225 H228 S256 H261 E262	H103-M258 WeakPolarHBondContact CD2-CE 3.41Å; H103-M258 WeakPolarHBondContact CE1-CE 3.46Å; H103-M258 WeakPolarHBondContact NE2-CE 3.26Å; E131-M258 HydrophobicContact CB-SD 4.4Å; E131-M258 HydrophobicContact CG-SD 3.83Å; L225-M258 HydrophobicContact CD1-CE 3.73Å; L225-M258 HydrophobicContact CD1-SD 4.47Å; H228-M258 HydrophobicContact CB-CE 4.47Å; H228-M258 HydrophobicContact CB-CG 3.91Å; H228-M258 HydrophobicContact CB-SD 3.94Å; S256-M258 PolarHBondContact O-N 3.04Å; S256-M258 WeakPolarHBondContact OG-CB 3.34Å; S256-M258 PolarHBondContact OG-N 3.33Å; M258-H261 VanDerWaalsContact C-CD2 3.41Å; M258-H261 WeakPolarHBondContact CA-CD2 3.38Å; M258-H261 PolarHBondContact O-CD2 3.44Å; M258-H261 PolarHBondContact O-NE2 3.04Å; M258-E262 PolarHBondContact O-N 2.95Å
259	V	98.8	Very high	97.6	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-72.7	-37.1	-177.1	-175.9	0	0	0	0	110.6	A224 R227 H228 V249 E255 S256 G257 C263	A224-V259 HydrophobicContact CB-CG2 4.11Å; A224-V259 VanDerWaalsContact O-CG2 3.27Å; A224-V259 WeakPolarHBondContact O-CG2 3.45Å; R227-V259 HydrophobicContact CB-CB 4.47Å; R227-V259 HydrophobicContact CB-CG1 3.73Å; R227-V259 HydrophobicContact CB-CG2 3.81Å; H228-V259 HydrophobicContact CB-CG2 4.39Å; V249-V259 HydrophobicContact CG1-CG1 3.66Å; E255-V259 HydrophobicContact CG-CB 3.81Å; E255-V259 HydrophobicContact CG-CG1 4.09Å; E255-V259 HydrophobicContact CG-CG2 4.47Å; S256-V259 PolarHBondContact O-N 3.22Å; G257-V259 PolarHBondContact O-N 3.1Å; V259-C263 PolarHBondContact O-N 3.48Å; V259-C263 PolarHBondContact O-SG 3.25Å
260	R	98.8	Very high	97.3	Very high	10 Å²	10	25.5 Å²	25.5	4%	0.038	14%	0.141	C	C	.	.	H	α-helix	trans	-65.6	-43.5	-178.7	-67.4	178.2	71.2	-139.6	-4.3	111.9	L250 N252 E255 S256 G257 C263 A264 D285 V290	L250-R260 HydrophobicContact CD1-CB 4.36Å; L250-R260 WeakPolarHBondContact CD1-O 3.48Å; L250-R260 PolarHBondContact O-NE 2.66Å; L250-R260 PolarHBondContact O-NH2 3.27Å; N252-R260 WeakPolarHBondContact O-CD 3.32Å; E255-R260 HydrophobicContact CB-CG 3.95Å; E255-R260 HydrophobicContact CG-CG 4.01Å; S256-R260 WeakPolarHBondContact O-CG 3.47Å; S256-R260 PolarHBondContact O-N 3.38Å; G257-R260 PolarHBondContact O-N 3.03Å; R260-C263 WeakPolarHBondContact O-CB 3.47Å; R260-C263 PolarHBondContact O-N 2.92Å; R260-A264 PolarHBondContact O-N 2.87Å; R260-D285 IonicContact CZ-OD1 2.68Å; R260-D285 IonicContact CZ-OD2 3.14Å; R260-D285 IonicContact NH1-OD1 3.89Å; R260-D285 PolarHBondContact NH1-OD1 3.33Å; R260-D285 IonicContact NH1-OD2 2.79Å; R260-D285 VanDerWaalsContact NH2-CG 3.34Å; R260-D285 IonicContact NH2-OD1 3.14Å; R260-D285 PolarHBondContact NH2-OD1 3.23Å; R260-D285 IonicContact NH2-OD2 3.86Å; R260-D285 PolarHBondContact NH2-OD2 2.87Å; R260-V290 HydrophobicContact CB-CG2 3.57Å
261	H	98.3	Very high	97	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-66.8	-40.8	179.8	91	76.5	0	0	0	111.3	I100 H228 G257 M258 C263 A264 E265 L289 S293	I100-H261 VanDerWaalsContact CD1-NE2 3.26Å; I100-H261 WeakPolarHBondContact CD1-NE2 3.35Å; H228-H261 AromaticContact CD2-NE2 3.76Å; H228-H261 AromaticContact NE2-NE2 3.94Å; G257-H261 PolarHBondContact O-CD2 3.24Å; G257-H261 PolarHBondContact O-N 3.2Å; M258-H261 VanDerWaalsContact C-CD2 3.41Å; M258-H261 WeakPolarHBondContact CA-CD2 3.38Å; M258-H261 PolarHBondContact O-CD2 3.44Å; M258-H261 PolarHBondContact O-NE2 3.04Å; H261-C263 PolarHBondContact O-N 2.88Å; H261-A264 CarbonylContact O-C 3.57Å; H261-A264 WeakPolarHBondContact O-CA 3.45Å; H261-A264 VanDerWaalsContact O-CB 3.29Å; H261-A264 WeakPolarHBondContact O-CB 3.12Å; H261-A264 PolarHBondContact O-N 3.47Å; H261-E265 IonicContact ND1-OE1 2.78Å; H261-E265 PolarHBondContact O-N 3.43Å; H261-L289 HydrophobicContact CB-CD1 4.31Å; H261-L289 HydrophobicContact CB-CD2 4.4Å; H261-L289 HydrophobicContact CB-CG 3.79Å; H261-S293 WeakPolarHBondContact CB-OG 3.43Å
262	E	98.4	Very high	96.7	Very high	3 Å²	3	26.7 Å²	26.7	1%	0.014	15%	0.147	C	C	.	.	H	α-helix	trans	-65.4	-32.6	177.6	-157.6	60.3	-151.3	0	0	111.4	M1 H228 A231 F232 M258 E265 A266	M1-E262 HydrophobicContact CE-CG 3.97Å; M1-E262 WeakPolarHBondContact CE-O 3.34Å; M1-E262 WeakPolarHBondContact CE-OE1 3.34Å; H228-E262 IonicContact CD2-OE2 2.84Å; H228-E262 IonicContact NE2-OE2 3.45Å; H228-E262 PolarHBondContact NE2-OE2 3.22Å; H228-E262 WeakPolarHBondContact O-CG 3.39Å; A231-E262 HydrophobicContact CB-CB 3.91Å; A231-E262 HydrophobicContact CB-CG 3.84Å; F232-E262 HydrophobicContact CB-CG 3.99Å; F232-E262 WeakPolarHBondContact CB-OE1 3.42Å; F232-E262 VanDerWaalsContact CD2-OE1 3.28Å; F232-E262 WeakPolarHBondContact CD2-OE1 3.46Å; M258-E262 PolarHBondContact O-N 2.95Å; E262-E265 PolarHBondContact O-N 3.14Å; E262-A266 VanDerWaalsContact O-CB 3.3Å; E262-A266 WeakPolarHBondContact O-CB 3.29Å; E262-A266 PolarHBondContact O-N 3.06Å
263	C	98.8	Very high	96.4	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-65.6	-36.3	169.1	-68	0	0	0	0	112.8	L246 V249 L250 V259 R260 H261 A266 L267	L246-C263 HydrophobicContact CD2-CB 4.22Å; V249-C263 VanDerWaalsContact CG1-SG 3.55Å; L250-C263 HydrophobicContact CB-CB 4.1Å; V259-C263 PolarHBondContact O-N 3.48Å; V259-C263 PolarHBondContact O-SG 3.25Å; R260-C263 WeakPolarHBondContact O-CB 3.47Å; R260-C263 PolarHBondContact O-N 2.92Å; H261-C263 PolarHBondContact O-N 2.88Å; C263-A266 PolarHBondContact O-N 3.29Å; C263-L267 VanDerWaalsContact O-CG 3.23Å; C263-L267 WeakPolarHBondContact O-CG 3.44Å; C263-L267 PolarHBondContact O-N 2.83Å
264	A	98.6	Very high	96.4	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-65.9	-45.3	174	0	0	0	0	0	111.1	L250 R260 H261 A266 L267 G268 L279	L250-A264 HydrophobicContact CD1-CB 4.18Å; L250-A264 HydrophobicContact CD2-CB 4.24Å; R260-A264 PolarHBondContact O-N 2.87Å; H261-A264 CarbonylContact O-C 3.57Å; H261-A264 WeakPolarHBondContact O-CA 3.45Å; H261-A264 VanDerWaalsContact O-CB 3.29Å; H261-A264 WeakPolarHBondContact O-CB 3.12Å; H261-A264 PolarHBondContact O-N 3.47Å; A264-A266 VanDerWaalsContact C-N 3.3Å; A264-A266 PolarHBondContact O-N 3.47Å; A264-L267 PolarHBondContact O-N 3.14Å; A264-G268 PolarHBondContact O-N 3.19Å; A264-L279 HydrophobicContact CB-CD2 3.93Å; A264-L279 WeakPolarHBondContact O-CD2 3.48Å
265	E	96.5	Very high	96.3	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-59.9	-41.4	174.3	-61.5	-159.5	-171.1	0	0	111.7	M1 F2 H261 E262 L267 G268 S269	M1-E265 HydrophobicContact CB-CB 3.93Å; M1-E265 WeakPolarHBondContact CB-OE2 3.43Å; M1-E265 HydrophobicContact CE-CB 3.83Å; M1-E265 PolarHBondContact N-OE2 3.17Å; M1-E265 HydrophobicContact SD-CB 3.81Å; F2-E265 HydrophobicContact CD2-CG 4.48Å; F2-E265 HydrophobicContact CE1-CB 3.97Å; F2-E265 HydrophobicContact CE1-CG 4.34Å; F2-E265 HydrophobicContact CE2-CB 4.05Å; F2-E265 HydrophobicContact CE2-CG 3.53Å; F2-E265 WeakPolarHBondContact CE2-OE2 3.19Å; F2-E265 HydrophobicContact CZ-CB 3.59Å; F2-E265 HydrophobicContact CZ-CG 3.47Å; F2-E265 VanDerWaalsContact CZ-CG 3.47Å; H261-E265 IonicContact ND1-OE1 2.78Å; H261-E265 PolarHBondContact O-N 3.43Å; E262-E265 PolarHBondContact O-N 3.14Å; E265-L267 VanDerWaalsContact C-N 3.33Å; E265-L267 PolarHBondContact O-N 2.64Å; E265-G268 PolarHBondContact O-N 3.02Å; E265-S269 VanDerWaalsContact O-CB 3.3Å; E265-S269 WeakPolarHBondContact O-CB 3.1Å; E265-S269 PolarHBondContact O-N 2.97Å; E265-S269 PolarHBondContact O-OG 2.88Å
266	A	96.6	Very high	96.2	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-63.6	-37.2	177.5	0	0	0	0	0	112.7	M1 L246 E262 C263 A264 S269 I270	M1-A266 HydrophobicContact CE-CB 3.65Å; M1-A266 WeakPolarHBondContact SD-CA 3.32Å; M1-A266 HydrophobicContact SD-CB 4.01Å; M1-A266 PolarHBondContact SD-N 3.38Å; L246-A266 HydrophobicContact CD1-CB 3.72Å; L246-A266 HydrophobicContact CD2-CB 3.81Å; L246-A266 HydrophobicContact CG-CB 4.38Å; E262-A266 VanDerWaalsContact O-CB 3.3Å; E262-A266 WeakPolarHBondContact O-CB 3.29Å; E262-A266 PolarHBondContact O-N 3.06Å; C263-A266 PolarHBondContact O-N 3.29Å; A264-A266 VanDerWaalsContact C-N 3.3Å; A264-A266 PolarHBondContact O-N 3.47Å; A266-S269 VanDerWaalsContact O-CB 3.28Å; A266-S269 WeakPolarHBondContact O-CB 3.27Å; A266-S269 PolarHBondContact O-N 2.92Å; A266-I270 WeakPolarHBondContact O-CD1 3.14Å; A266-I270 VanDerWaalsContact O-CG1 3.28Å; A266-I270 WeakPolarHBondContact O-CG1 3.49Å; A266-I270 PolarHBondContact O-N 3.14Å
267	L	97.3	Very high	96.2	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-69.7	-39.9	173.8	-70.7	167.2	0	0	0	111.3	V243 L246 Q247 L250 C263 A264 E265 S269 I270 A271 C275 T278 L279	V243-L267 HydrophobicContact CG1-CD2 4.21Å; L246-L267 HydrophobicContact CB-CD1 4.44Å; L246-L267 HydrophobicContact CB-CD2 3.9Å; L246-L267 HydrophobicContact CB-CG 4Å; L246-L267 HydrophobicContact CD1-CD2 4.36Å; Q247-L267 HydrophobicContact CG-CD1 4.34Å; Q247-L267 HydrophobicContact CG-CD2 4.11Å; L250-L267 HydrophobicContact CD2-CD1 3.63Å; C263-L267 VanDerWaalsContact O-CG 3.23Å; C263-L267 WeakPolarHBondContact O-CG 3.44Å; C263-L267 PolarHBondContact O-N 2.83Å; A264-L267 PolarHBondContact O-N 3.14Å; E265-L267 VanDerWaalsContact C-N 3.33Å; E265-L267 PolarHBondContact O-N 2.64Å; L267-S269 PolarHBondContact O-N 3.37Å; L267-I270 PolarHBondContact O-N 3.03Å; L267-A271 PolarHBondContact O-N 3.13Å; L267-C275 HydrophobicContact CB-CB 4.06Å; L267-C275 HydrophobicContact CD2-CB 4.19Å; L267-C275 VanDerWaalsContact CD2-SG 3.51Å; L267-C275 VanDerWaalsContact O-CB 3.26Å; L267-C275 WeakPolarHBondContact O-CB 3.42Å; L267-T278 HydrophobicContact CD1-CG2 3.97Å; L267-L279 HydrophobicContact CB-CD2 4.11Å; L267-L279 HydrophobicContact CB-CG 4.32Å
268	G	94	Very high	96.2	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-59.8	-36.3	173.4	0	0	0	0	0	112.6	A264 E265 A271 C301	A264-G268 PolarHBondContact O-N 3.19Å; E265-G268 PolarHBondContact O-N 3.02Å; G268-A271 WeakPolarHBondContact O-CB 3.33Å; G268-A271 PolarHBondContact O-N 3.07Å; G268-C301 PolarHBondContact O-SG 3.37Å; G268-C301 VanDerWaalsContact O-SG 3.35Å
269	S	91.4	Very high	96.2	Very high	2 Å²	2	20.5 Å²	20.5	1%	0.014	10%	0.104	C	C	.	.	H	α-helix	trans	-67.6	-40.1	176.6	-68.3	0	0	0	0	113.8	M1 I5 E265 A266 L267	M1-S269 PolarHBondContact SD-OG 3.37Å; I5-S269 VanDerWaalsContact CD1-CA 3.43Å; I5-S269 WeakPolarHBondContact CD1-OG 3.03Å; E265-S269 VanDerWaalsContact O-CB 3.3Å; E265-S269 WeakPolarHBondContact O-CB 3.1Å; E265-S269 PolarHBondContact O-N 2.97Å; E265-S269 PolarHBondContact O-OG 2.88Å; A266-S269 VanDerWaalsContact O-CB 3.28Å; A266-S269 WeakPolarHBondContact O-CB 3.27Å; A266-S269 PolarHBondContact O-N 2.92Å; L267-S269 PolarHBondContact O-N 3.37Å
270	I	93.1	Very high	96.2	Very high	16 Å²	16	26.3 Å²	26.3	8%	0.082	13%	0.126	C	C	.	.	H	α-helix	trans	-74.2	-31.6	176.4	-66.2	162.1	0	0	0	111.4	A242 V243 L246 A266 L267 T272	A242-I270 HydrophobicContact CB-CD1 4.46Å; V243-I270 HydrophobicContact CG2-CD1 3.91Å; V243-I270 HydrophobicContact CG2-CG2 3.76Å; L246-I270 HydrophobicContact CD1-CD1 3.54Å; A266-I270 WeakPolarHBondContact O-CD1 3.14Å; A266-I270 VanDerWaalsContact O-CG1 3.28Å; A266-I270 WeakPolarHBondContact O-CG1 3.49Å; A266-I270 PolarHBondContact O-N 3.14Å; L267-I270 PolarHBondContact O-N 3.03Å; I270-T272 HydrophobicContact CG2-CG2 3.91Å; I270-T272 PolarHBondContact O-N 3.4Å
271	A	91.3	Very high	96.2	Very high	22 Å²	22	35 Å²	35	18%	0.182	16%	0.158	C	C	.	.			trans	56.3	20.2	169	0	0	0	0	0	117	L267 G268 M304	L267-A271 PolarHBondContact O-N 3.13Å; G268-A271 WeakPolarHBondContact O-CB 3.33Å; G268-A271 PolarHBondContact O-N 3.07Å; A271-M304 HydrophobicContact CB-CE 4.41Å; A271-M304 HydrophobicContact CB-SD 4.13Å
272	T	91.9	Very high	96.2	Very high	45 Å²	45	35.7 Å²	35.7	28%	0.276	16%	0.162	S	C	.	.			trans	-70.7	158.6	171.6	65.9	0	0	0	0	111.2	I270 E274 C275 K276	I270-T272 HydrophobicContact CG2-CG2 3.91Å; I270-T272 PolarHBondContact O-N 3.4Å; T272-E274 PolarHBondContact O-N 2.94Å; T272-C275 WeakPolarHBondContact O-CA 3.39Å; T272-C275 VanDerWaalsContact O-CB 3.31Å; T272-C275 WeakPolarHBondContact O-CB 3.28Å; T272-C275 PolarHBondContact O-N 3.38Å; T272-C275 PolarHBondContact OG1-N 2.92Å; T272-C275 PolarHBondContact OG1-SG 2.93Å; T272-K276 PolarHBondContact O-N 2.9Å
273	E	93.4	Very high	96.2	Very high	98 Å²	98	37.9 Å²	37.9	46%	0.458	17%	0.173	S	C	.	.	H	α-helix	trans	-55.9	-35.3	175.1	-80.9	-56.1	121.9	0	0	113	K276 Q277	E273-K276 PolarHBondContact O-N 3.48Å; E273-K276 WeakPolarHBondContact OE1-CE 3.39Å; E273-K276 IonicContact OE1-NZ 3.42Å; E273-K276 PolarHBondContact OE1-NZ 3.16Å; E273-Q277 VanDerWaalsContact O-CG 3.28Å; E273-Q277 WeakPolarHBondContact O-CG 3.33Å; E273-Q277 PolarHBondContact O-N 3.4Å
274	E	96.4	Very high	96.1	Very high	94 Å²	94	47.5 Å²	47.5	44%	0.439	21%	0.211	S	C	.	.	H	α-helix	trans	-64.3	-40.6	173.8	-179.9	176.6	-170.3	0	0	112.2	V243 Q247 T272 Q277 T278	V243-E274 HydrophobicContact CG1-CG 4.25Å; Q247-E274 PolarHBondContact NE2-OE1 3.28Å; Q247-E274 VanDerWaalsContact NE2-OE1 3.11Å; Q247-E274 PolarHBondContact OE1-OE1 3.28Å; T272-E274 PolarHBondContact O-N 2.94Å; E274-Q277 PolarHBondContact O-N 3.44Å; E274-T278 PolarHBondContact O-N 3.01Å; E274-T278 VanDerWaalsContact O-N 3.09Å; E274-T278 PolarHBondContact O-OG1 2.8Å
275	C	96.4	Very high	96.1	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.6	-48.4	174	-65.7	0	0	0	0	110.7	L267 T272 Q277 T278 L279	L267-C275 HydrophobicContact CB-CB 4.06Å; L267-C275 HydrophobicContact CD2-CB 4.19Å; L267-C275 VanDerWaalsContact CD2-SG 3.51Å; L267-C275 VanDerWaalsContact O-CB 3.26Å; L267-C275 WeakPolarHBondContact O-CB 3.42Å; T272-C275 WeakPolarHBondContact O-CA 3.39Å; T272-C275 VanDerWaalsContact O-CB 3.31Å; T272-C275 WeakPolarHBondContact O-CB 3.28Å; T272-C275 PolarHBondContact O-N 3.38Å; T272-C275 PolarHBondContact OG1-N 2.92Å; T272-C275 PolarHBondContact OG1-SG 2.93Å; C275-Q277 VanDerWaalsContact C-N 3.35Å; C275-Q277 PolarHBondContact O-N 2.6Å; C275-T278 CarbonylContact O-C 3.59Å; C275-T278 WeakPolarHBondContact O-CA 3.42Å; C275-T278 VanDerWaalsContact O-CB 3.29Å; C275-T278 WeakPolarHBondContact O-CB 3.46Å; C275-T278 PolarHBondContact O-N 2.87Å; C275-L279 WeakPolarHBondContact O-CG 3.41Å; C275-L279 PolarHBondContact O-N 3.25Å
276	K	96.1	Very high	96.2	Very high	1 Å²	1	54.1 Å²	54.1	0%	0.004	25%	0.253	C	S	.	.	H	α-helix	trans	-61.5	-40.3	179.1	-61.8	-177.6	-154.1	163.6	0	112.9	T272 E273 T278 L279 R280 L298 C301 E305	T272-K276 PolarHBondContact O-N 2.9Å; E273-K276 PolarHBondContact O-N 3.48Å; E273-K276 WeakPolarHBondContact OE1-CE 3.39Å; E273-K276 IonicContact OE1-NZ 3.42Å; E273-K276 PolarHBondContact OE1-NZ 3.16Å; K276-T278 VanDerWaalsContact C-N 3.25Å; K276-T278 PolarHBondContact O-N 3.48Å; K276-L279 PolarHBondContact O-N 2.96Å; K276-R280 WeakPolarHBondContact O-CB 3.27Å; K276-R280 VanDerWaalsContact O-CG 3.27Å; K276-R280 WeakPolarHBondContact O-CG 3.39Å; K276-R280 PolarHBondContact O-N 3.49Å; K276-L298 HydrophobicContact CB-CD2 4.26Å; K276-L298 HydrophobicContact CG-CD2 4.49Å; K276-C301 HydrophobicContact CD-CB 4.2Å; K276-C301 HydrophobicContact CG-CB 4.12Å; K276-E305 IonicContact NZ-OE1 2.89Å; K276-E305 PolarHBondContact NZ-OE1 3.15Å; K276-E305 IonicContact NZ-OE2 3.89Å; K276-E305 PolarHBondContact NZ-OE2 2.96Å
277	Q	97.8	Very high	96.2	Very high	124 Å²	124	57.9 Å²	57.9	58%	0.579	27%	0.271	S	S	*	.	H	α-helix	trans	-60.2	-39.2	174	-73.5	172.9	21	0	0	111.5	E273 E274 C275 R281	E273-Q277 VanDerWaalsContact O-CG 3.28Å; E273-Q277 WeakPolarHBondContact O-CG 3.33Å; E273-Q277 PolarHBondContact O-N 3.4Å; E274-Q277 PolarHBondContact O-N 3.44Å; C275-Q277 VanDerWaalsContact C-N 3.35Å; C275-Q277 PolarHBondContact O-N 2.6Å; Q277-R281 PolarHBondContact O-N 3.41Å
278	T	98.6	Very high	96.3	Very high	16 Å²	16	61.2 Å²	61.2	10%	0.098	29%	0.292	C	S	.	.	H	α-helix	trans	-65.8	-49.2	175.3	-51.2	0	0	0	0	111.1	Q247 L250 L267 E274 C275 K276 R280 R281 F282	Q247-T278 HydrophobicContact CB-CG2 4.41Å; Q247-T278 HydrophobicContact CG-CG2 3.9Å; Q247-T278 PolarHBondContact NE2-OG1 3.4Å; L250-T278 HydrophobicContact CD2-CG2 3.92Å; L267-T278 HydrophobicContact CD1-CG2 3.97Å; E274-T278 PolarHBondContact O-N 3.01Å; E274-T278 VanDerWaalsContact O-N 3.09Å; E274-T278 PolarHBondContact O-OG1 2.8Å; C275-T278 CarbonylContact O-C 3.59Å; C275-T278 WeakPolarHBondContact O-CA 3.42Å; C275-T278 VanDerWaalsContact O-CB 3.29Å; C275-T278 WeakPolarHBondContact O-CB 3.46Å; C275-T278 PolarHBondContact O-N 2.87Å; K276-T278 VanDerWaalsContact C-N 3.25Å; K276-T278 PolarHBondContact O-N 3.48Å; T278-R280 VanDerWaalsContact C-N 3.35Å; T278-R280 PolarHBondContact O-N 2.99Å; T278-R281 VanDerWaalsContact O-CB 3.27Å; T278-R281 WeakPolarHBondContact O-CB 3.22Å; T278-R281 PolarHBondContact O-N 2.99Å; T278-F282 HydrophobicContact CG2-CD2 4.1Å; T278-F282 HydrophobicContact CG2-CE2 4.02Å; T278-F282 VanDerWaalsContact O-CD2 3.29Å; T278-F282 WeakPolarHBondContact O-CD2 3.26Å; T278-F282 PolarHBondContact O-N 2.93Å
279	L	98.5	Very high	96.4	Very high	0 Å²	0	62 Å²	62	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-59.4	-44.6	179.2	-65.3	170.4	0	0	0	111.8	A264 L267 C275 K276 R281 F282 L283 C294 A297 L298	A264-L279 HydrophobicContact CB-CD2 3.93Å; A264-L279 WeakPolarHBondContact O-CD2 3.48Å; L267-L279 HydrophobicContact CB-CD2 4.11Å; L267-L279 HydrophobicContact CB-CG 4.32Å; C275-L279 WeakPolarHBondContact O-CG 3.41Å; C275-L279 PolarHBondContact O-N 3.25Å; K276-L279 PolarHBondContact O-N 2.96Å; L279-R281 PolarHBondContact O-N 2.87Å; L279-F282 CarbonylContact O-C 3.52Å; L279-F282 PolarHBondContact O-N 3.09Å; L279-L283 PolarHBondContact O-N 2.91Å; L279-C294 HydrophobicContact CD2-CB 4.44Å; L279-A297 HydrophobicContact CD1-CB 3.73Å; L279-A297 HydrophobicContact CD2-CB 3.88Å; L279-A297 HydrophobicContact CG-CB 4.42Å; L279-L298 HydrophobicContact CB-CD1 4.22Å; L279-L298 HydrophobicContact CB-CD2 3.86Å; L279-L298 HydrophobicContact CB-CG 3.83Å; L279-L298 HydrophobicContact CD1-CD2 4.18Å; L279-L298 HydrophobicContact CD1-CG 4.29Å
280	R	98.5	Very high	96.8	Very high	121 Å²	121	61.9 Å²	61.9	46%	0.457	30%	0.296	S	S	.	.	H	α-helix	trans	-59.2	-32.9	175.2	-72.1	173.5	-172.1	134.1	2	112.6	K276 T278 F282 L298	K276-R280 WeakPolarHBondContact O-CB 3.27Å; K276-R280 VanDerWaalsContact O-CG 3.27Å; K276-R280 WeakPolarHBondContact O-CG 3.39Å; K276-R280 PolarHBondContact O-N 3.49Å; T278-R280 VanDerWaalsContact C-N 3.35Å; T278-R280 PolarHBondContact O-N 2.99Å; R280-F282 VanDerWaalsContact C-N 3.3Å; R280-F282 PolarHBondContact O-N 3.25Å; R280-L298 HydrophobicContact CG-CD1 3.95Å; R280-L298 HydrophobicContact CG-CD2 4.07Å
281	R	98.5	Very high	97.1	Very high	192 Å²	192	62.1 Å²	62.1	73%	0.725	30%	0.299	S	S	*	.	H	α-helix	trans	-66.8	-30.9	176.4	179.2	-177.1	174	-176.4	-1.9	112.4	Q277 T278 L279	Q277-R281 PolarHBondContact O-N 3.41Å; T278-R281 VanDerWaalsContact O-CB 3.27Å; T278-R281 WeakPolarHBondContact O-CB 3.22Å; T278-R281 PolarHBondContact O-N 2.99Å; L279-R281 PolarHBondContact O-N 2.87Å
282	F	98.5	Very high	97.4	Very high	16 Å²	16	63.2 Å²	63.2	7%	0.07	30%	0.3	C	S	.	.	H	α-helix	trans	-105.5	8.6	-177.3	-66.5	-75.1	0	0	0	113.9	L250 A251 T278 L279 R280 Y284 D285 V290	L250-F282 HydrophobicContact CD1-CD2 4.42Å; L250-F282 HydrophobicContact CD1-CG 4.36Å; L250-F282 HydrophobicContact CD2-CD2 3.71Å; L250-F282 HydrophobicContact CD2-CE2 4.24Å; L250-F282 HydrophobicContact CD2-CG 4.35Å; L250-F282 HydrophobicContact CG-CD2 3.74Å; L250-F282 HydrophobicContact CG-CE2 3.99Å; L250-F282 HydrophobicContact CG-CG 4.16Å; A251-F282 VanDerWaalsContact CA-CZ 3.48Å; A251-F282 HydrophobicContact CB-CE2 4.3Å; A251-F282 HydrophobicContact CB-CZ 3.7Å; T278-F282 HydrophobicContact CG2-CD2 4.1Å; T278-F282 HydrophobicContact CG2-CE2 4.02Å; T278-F282 VanDerWaalsContact O-CD2 3.29Å; T278-F282 WeakPolarHBondContact O-CD2 3.26Å; T278-F282 PolarHBondContact O-N 2.93Å; L279-F282 CarbonylContact O-C 3.52Å; L279-F282 PolarHBondContact O-N 3.09Å; R280-F282 VanDerWaalsContact C-N 3.3Å; R280-F282 PolarHBondContact O-N 3.25Å; F282-Y284 PolarHBondContact O-N 2.97Å; F282-Y284 VanDerWaalsContact O-N 3.09Å; F282-D285 WeakPolarHBondContact CD1-OD2 3.29Å; F282-D285 WeakPolarHBondContact O-CB 3.47Å; F282-D285 PolarHBondContact O-N 3.19Å; F282-V290 HydrophobicContact CB-CG1 4.46Å
283	L	97.8	Very high	97.7	Very high	48 Å²	48	61.1 Å²	61.1	25%	0.251	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-23.9	177.6	-170.1	62.5	0	0	0	113.7	L279 S291 C294 E295 L298	L279-L283 PolarHBondContact O-N 2.91Å; L283-S291 WeakPolarHBondContact O-CB 3.41Å; L283-C294 HydrophobicContact CD1-CB 4.46Å; L283-E295 HydrophobicContact CD1-CB 3.97Å; L283-L298 HydrophobicContact CD1-CD1 4.15Å
284	Y	97.5	Very high	97.9	Very high	203 Å²	203	56.4 Å²	56.4	80%	0.796	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.2	31.2	177.3	-51	-68.3	0	0	0	111.8	F282	F282-Y284 PolarHBondContact O-N 2.97Å; F282-Y284 VanDerWaalsContact O-N 3.09Å
285	D	98.6	Very high	98	Very high	14 Å²	14	55.3 Å²	55.3	8%	0.075	26%	0.26	C	S	.	.			trans	-55.9	138.7	173.1	-159.6	-90.1	0	0	0	110.3	R260 F282 E287 V290 S291	R260-D285 IonicContact CZ-OD1 2.68Å; R260-D285 IonicContact CZ-OD2 3.14Å; R260-D285 IonicContact NH1-OD1 3.89Å; R260-D285 PolarHBondContact NH1-OD1 3.33Å; R260-D285 IonicContact NH1-OD2 2.79Å; R260-D285 VanDerWaalsContact NH2-CG 3.34Å; R260-D285 IonicContact NH2-OD1 3.14Å; R260-D285 PolarHBondContact NH2-OD1 3.23Å; R260-D285 IonicContact NH2-OD2 3.86Å; R260-D285 PolarHBondContact NH2-OD2 2.87Å; F282-D285 WeakPolarHBondContact CD1-OD2 3.29Å; F282-D285 WeakPolarHBondContact O-CB 3.47Å; F282-D285 PolarHBondContact O-N 3.19Å; D285-E287 PolarHBondContact O-N 3.39Å; D285-E287 VanDerWaalsContact OD1-CB 3.31Å; D285-E287 WeakPolarHBondContact OD1-CB 3.35Å; D285-E287 PolarHBondContact OD1-N 3.03Å; D285-E287 VanDerWaalsContact OD1-N 3.11Å; D285-V290 HydrophobicContact CB-CB 4.13Å; D285-V290 HydrophobicContact CB-CG1 3.88Å; D285-S291 PolarHBondContact O-OG 3.19Å
286	P	97.6	Very high	97.9	Very high	124 Å²	124	55.3 Å²	55.3	81%	0.805	26%	0.26	S	S	*	.	S	Bend	trans	-65.1	-17	179.1	26.9	-36.8	0	0	0	113.6	P288	P286-P288 WeakPolarHBondContact O-CD 3.4Å
287	E	97.8	Very high	97.8	Very high	79 Å²	79	55.2 Å²	55.2	37%	0.369	26%	0.26	S	S	.	.	S	Bend	trans	-83.3	112	170.1	179.2	55	-114.4	0	0	109.7	D285 L289 V290 S291	D285-E287 PolarHBondContact O-N 3.39Å; D285-E287 VanDerWaalsContact OD1-CB 3.31Å; D285-E287 WeakPolarHBondContact OD1-CB 3.35Å; D285-E287 PolarHBondContact OD1-N 3.03Å; D285-E287 VanDerWaalsContact OD1-N 3.11Å; E287-L289 VanDerWaalsContact C-N 3.25Å; E287-L289 HydrophobicContact CG-CB 4.13Å; E287-L289 PolarHBondContact O-N 2.87Å; E287-L289 PolarHBondContact OE1-N 2.97Å; E287-V290 HydrophobicContact CB-CB 4.22Å; E287-V290 HydrophobicContact CB-CG2 4.09Å; E287-V290 HydrophobicContact CG-CB 4.28Å; E287-V290 HydrophobicContact CG-CG2 3.79Å; E287-V290 PolarHBondContact O-N 3.16Å; E287-S291 PolarHBondContact O-N 3.41Å; E287-S291 PolarHBondContact O-OG 3.1Å
288	P	98	Very high	97.7	Very high	71 Å²	71	50.1 Å²	50.1	46%	0.461	24%	0.236	S	C	.	.	H	α-helix	trans	-55.2	-40.9	-179.3	-27.9	37.3	0	0	0	112.8	P286 V290 S291 E292	P286-P288 WeakPolarHBondContact O-CD 3.4Å; P288-V290 PolarHBondContact O-N 3.3Å; P288-S291 WeakPolarHBondContact CA-OG 3.42Å; P288-S291 PolarHBondContact O-N 2.97Å; P288-S291 PolarHBondContact O-OG 3.11Å; P288-E292 VanDerWaalsContact O-CB 3.25Å; P288-E292 WeakPolarHBondContact O-CB 3.23Å; P288-E292 VanDerWaalsContact O-CG 3.27Å; P288-E292 WeakPolarHBondContact O-CG 3.44Å; P288-E292 PolarHBondContact O-N 2.96Å
289	L	97.8	Very high	97.4	Very high	16 Å²	16	50 Å²	50	8%	0.084	24%	0.235	C	C	.	.	H	α-helix	trans	-57.6	-36.1	179.6	-178.3	62	0	0	0	112.4	L67 I100 H261 E287 S293	L67-L289 HydrophobicContact CB-CD1 3.88Å; L67-L289 HydrophobicContact CD1-CD1 3.71Å; L67-L289 HydrophobicContact CG-CD1 4.37Å; I100-L289 HydrophobicContact CD1-CD1 3.62Å; I100-L289 HydrophobicContact CD1-CD2 3.46Å; I100-L289 VanDerWaalsContact CD1-CD2 3.46Å; I100-L289 HydrophobicContact CD1-CG 4.13Å; H261-L289 HydrophobicContact CB-CD1 4.31Å; H261-L289 HydrophobicContact CB-CD2 4.4Å; H261-L289 HydrophobicContact CB-CG 3.79Å; E287-L289 VanDerWaalsContact C-N 3.25Å; E287-L289 HydrophobicContact CG-CB 4.13Å; E287-L289 PolarHBondContact O-N 2.87Å; E287-L289 PolarHBondContact OE1-N 2.97Å; L289-S293 VanDerWaalsContact O-CB 3.3Å; L289-S293 WeakPolarHBondContact O-CB 3.05Å; L289-S293 PolarHBondContact O-N 3.1Å; L289-S293 PolarHBondContact O-OG 3.47Å
290	V	98.7	Very high	96.7	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-80.6	-44.2	179.3	175.8	0	0	0	0	111.8	L250 R260 F282 D285 E287 P288 S293 C294	L250-V290 HydrophobicContact CD1-CG1 3.62Å; R260-V290 HydrophobicContact CB-CG2 3.57Å; F282-V290 HydrophobicContact CB-CG1 4.46Å; D285-V290 HydrophobicContact CB-CB 4.13Å; D285-V290 HydrophobicContact CB-CG1 3.88Å; E287-V290 HydrophobicContact CB-CB 4.22Å; E287-V290 HydrophobicContact CB-CG2 4.09Å; E287-V290 HydrophobicContact CG-CB 4.28Å; E287-V290 HydrophobicContact CG-CG2 3.79Å; E287-V290 PolarHBondContact O-N 3.16Å; P288-V290 PolarHBondContact O-N 3.3Å; V290-S293 PolarHBondContact O-N 3.45Å; V290-C294 PolarHBondContact O-N 3.31Å; V290-C294 PolarHBondContact O-SG 3.18Å
291	S	98.6	Very high	96.1	Very high	21 Å²	21	44.3 Å²	44.3	15%	0.147	21%	0.214	C	C	.	.	H	α-helix	trans	-65.8	-45.1	-179.8	46.5	0	0	0	0	111.9	L283 D285 E287 P288 S293 C294 E295	L283-S291 WeakPolarHBondContact O-CB 3.41Å; D285-S291 PolarHBondContact O-OG 3.19Å; E287-S291 PolarHBondContact O-N 3.41Å; E287-S291 PolarHBondContact O-OG 3.1Å; P288-S291 WeakPolarHBondContact CA-OG 3.42Å; P288-S291 PolarHBondContact O-N 2.97Å; P288-S291 PolarHBondContact O-OG 3.11Å; S291-S293 VanDerWaalsContact C-N 3.32Å; S291-S293 PolarHBondContact O-N 3.44Å; S291-C294 PolarHBondContact O-N 2.87Å; S291-E295 PolarHBondContact O-N 2.58Å
292	E	98.4	Very high	95.4	Very high	45 Å²	45	39 Å²	39	21%	0.21	20%	0.2	C	C	.	.	H	α-helix	trans	-59.9	-42.6	173.5	-69.1	179.7	174.3	0	0	110.7	L35 S65 L67 P288 C294 E295 I296	L35-E292 HydrophobicContact CD2-CB 3.74Å; L35-E292 HydrophobicContact CD2-CG 3.79Å; S65-E292 PolarHBondContact OG-OE2 3.12Å; L67-E292 HydrophobicContact CB-CB 4.37Å; L67-E292 WeakPolarHBondContact CB-OE2 3.27Å; L67-E292 HydrophobicContact CD2-CB 3.54Å; P288-E292 VanDerWaalsContact O-CB 3.25Å; P288-E292 WeakPolarHBondContact O-CB 3.23Å; P288-E292 VanDerWaalsContact O-CG 3.27Å; P288-E292 WeakPolarHBondContact O-CG 3.44Å; P288-E292 PolarHBondContact O-N 2.96Å; E292-C294 VanDerWaalsContact C-N 3.32Å; E292-C294 PolarHBondContact O-N 2.89Å; E292-E295 WeakPolarHBondContact O-CB 3.29Å; E292-E295 PolarHBondContact O-N 2.6Å; E292-E295 VanDerWaalsContact O-N 3.13Å; E292-I296 WeakPolarHBondContact O-CG1 3.49Å; E292-I296 PolarHBondContact O-N 2.9Å
293	S	98.4	Very high	94.4	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-65	-35.7	177.7	-64.3	0	0	0	0	112.8	L67 H261 L289 V290 S291 I296 A297	L67-S293 VanDerWaalsContact CD1-OG 3.26Å; L67-S293 WeakPolarHBondContact CD1-OG 3.48Å; L67-S293 WeakPolarHBondContact CD2-OG 3.3Å; H261-S293 WeakPolarHBondContact CB-OG 3.43Å; L289-S293 VanDerWaalsContact O-CB 3.3Å; L289-S293 WeakPolarHBondContact O-CB 3.05Å; L289-S293 PolarHBondContact O-N 3.1Å; L289-S293 PolarHBondContact O-OG 3.47Å; V290-S293 PolarHBondContact O-N 3.45Å; S291-S293 VanDerWaalsContact C-N 3.32Å; S291-S293 PolarHBondContact O-N 3.44Å; S293-I296 PolarHBondContact O-N 3.48Å; S293-A297 WeakPolarHBondContact O-CB 3.39Å; S293-A297 PolarHBondContact O-N 3.46Å
294	C	98.4	Very high	93.1	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-66.5	-37.5	173.4	-67.6	0	0	0	0	112.1	L279 L283 V290 S291 E292 L298	L279-C294 HydrophobicContact CD2-CB 4.44Å; L283-C294 HydrophobicContact CD1-CB 4.46Å; V290-C294 PolarHBondContact O-N 3.31Å; V290-C294 PolarHBondContact O-SG 3.18Å; S291-C294 PolarHBondContact O-N 2.87Å; E292-C294 VanDerWaalsContact C-N 3.32Å; E292-C294 PolarHBondContact O-N 2.89Å; C294-L298 WeakPolarHBondContact O-CB 3.45Å; C294-L298 VanDerWaalsContact O-CG 3.26Å; C294-L298 WeakPolarHBondContact O-CG 3.04Å; C294-L298 PolarHBondContact O-N 3.33Å
295	E	96.9	Very high	91.8	Very high	70 Å²	70	38.5 Å²	38.5	33%	0.327	20%	0.203	S	C	.	.	H	α-helix	trans	-60.3	-50.9	173.9	-176.7	-174.6	157.9	0	0	111	L283 S291 E292 L298 D299	L283-E295 HydrophobicContact CD1-CB 3.97Å; S291-E295 PolarHBondContact O-N 2.58Å; E292-E295 WeakPolarHBondContact O-CB 3.29Å; E292-E295 PolarHBondContact O-N 2.6Å; E292-E295 VanDerWaalsContact O-N 3.13Å; E295-L298 PolarHBondContact O-N 2.96Å; E295-D299 PolarHBondContact O-N 3.32Å; E295-D299 VanDerWaalsContact O-N 3.09Å
296	I	95	Very high	90.3	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-66.3	-43.2	-179.8	-56.7	-54.1	0	0	0	111.5	F2 L35 K36 F39 L67 E292 S293 L298 D299 I300	F2-I296 HydrophobicContact CD2-CG2 3.98Å; F2-I296 HydrophobicContact CE2-CB 4.25Å; F2-I296 HydrophobicContact CE2-CG2 3.56Å; F2-I296 HydrophobicContact CZ-CG2 4.19Å; L35-I296 HydrophobicContact CB-CD1 4.28Å; L35-I296 HydrophobicContact CD2-CD1 4.26Å; L35-I296 HydrophobicContact CD2-CG1 4.42Å; L35-I296 HydrophobicContact CG-CD1 4.03Å; K36-I296 VanDerWaalsContact CA-CD1 3.49Å; K36-I296 HydrophobicContact CB-CD1 3.94Å; F39-I296 HydrophobicContact CB-CD1 4.3Å; F39-I296 HydrophobicContact CD1-CD1 4.46Å; F39-I296 HydrophobicContact CD1-CG1 4.35Å; F39-I296 HydrophobicContact CD1-CG2 3.96Å; F39-I296 HydrophobicContact CD2-CD1 3.73Å; F39-I296 HydrophobicContact CD2-CG1 4.17Å; F39-I296 HydrophobicContact CE1-CG1 4.35Å; F39-I296 HydrophobicContact CE1-CG2 4.36Å; F39-I296 HydrophobicContact CE2-CD1 4.15Å; F39-I296 HydrophobicContact CE2-CG1 4.17Å; F39-I296 HydrophobicContact CG-CD1 3.91Å; F39-I296 HydrophobicContact CG-CG1 4.26Å; F39-I296 HydrophobicContact CG-CG2 4.32Å; F39-I296 HydrophobicContact CZ-CG1 4.28Å; L67-I296 HydrophobicContact CD2-CG1 4.36Å; E292-I296 WeakPolarHBondContact O-CG1 3.49Å; E292-I296 PolarHBondContact O-N 2.9Å; S293-I296 PolarHBondContact O-N 3.48Å; I296-L298 VanDerWaalsContact C-N 3.26Å; I296-L298 PolarHBondContact O-N 3.28Å; I296-D299 PolarHBondContact O-N 3.47Å; I296-I300 HydrophobicContact CG2-CD1 3.91Å; I296-I300 WeakPolarHBondContact O-CG1 3.43Å; I296-I300 PolarHBondContact O-N 3.36Å; I296-I300 VanDerWaalsContact O-N 3.08Å
297	A	94.8	Very high	88.5	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-59.1	-37	176.9	0	0	0	0	0	112.5	F2 L279 S293 C301	F2-A297 HydrophobicContact CE1-CB 4.29Å; F2-A297 HydrophobicContact CZ-CB 3.95Å; L279-A297 HydrophobicContact CD1-CB 3.73Å; L279-A297 HydrophobicContact CD2-CB 3.88Å; L279-A297 HydrophobicContact CG-CB 4.42Å; S293-A297 WeakPolarHBondContact O-CB 3.39Å; S293-A297 PolarHBondContact O-N 3.46Å; A297-C301 PolarHBondContact O-N 2.8Å; A297-C301 PolarHBondContact O-SG 2.95Å
298	L	94.9	Very high	86.6	Confident	17 Å²	17	40.4 Å²	40.4	9%	0.089	23%	0.229	C	C	.	.	H	α-helix	trans	-71.6	-40.5	175.8	-76.2	168.5	0	0	0	112.3	K276 L279 R280 L283 C294 E295 I296 I300 C301 D302	K276-L298 HydrophobicContact CB-CD2 4.26Å; K276-L298 HydrophobicContact CG-CD2 4.49Å; L279-L298 HydrophobicContact CB-CD1 4.22Å; L279-L298 HydrophobicContact CB-CD2 3.86Å; L279-L298 HydrophobicContact CB-CG 3.83Å; L279-L298 HydrophobicContact CD1-CD2 4.18Å; L279-L298 HydrophobicContact CD1-CG 4.29Å; R280-L298 HydrophobicContact CG-CD1 3.95Å; R280-L298 HydrophobicContact CG-CD2 4.07Å; L283-L298 HydrophobicContact CD1-CD1 4.15Å; C294-L298 WeakPolarHBondContact O-CB 3.45Å; C294-L298 VanDerWaalsContact O-CG 3.26Å; C294-L298 WeakPolarHBondContact O-CG 3.04Å; C294-L298 PolarHBondContact O-N 3.33Å; E295-L298 PolarHBondContact O-N 2.96Å; I296-L298 VanDerWaalsContact C-N 3.26Å; I296-L298 PolarHBondContact O-N 3.28Å; L298-I300 PolarHBondContact O-N 2.98Å; L298-C301 WeakPolarHBondContact O-CB 3.49Å; L298-C301 PolarHBondContact O-N 3.47Å; L298-D302 WeakPolarHBondContact O-CB 3.23Å; L298-D302 VanDerWaalsContact O-CG 3.3Å; L298-D302 PolarHBondContact O-N 3.4Å
299	D	91.4	Very high	84.7	Confident	14 Å²	14	45.8 Å²	45.8	8%	0.075	25%	0.245	C	C	.	.	H	α-helix	trans	-59.4	-35.9	174.8	-168.6	69.4	0	0	0	111.7	K36 R40 E295 I296 D302 Y303 Y311	K36-D299 HydrophobicContact CB-CB 4Å; K36-D299 HydrophobicContact CD-CB 3.93Å; K36-D299 VanDerWaalsContact CD-CG 3.4Å; K36-D299 WeakPolarHBondContact CD-OD1 3.39Å; K36-D299 IonicContact NZ-OD1 3.62Å; K36-D299 PolarHBondContact NZ-OD1 2.84Å; R40-D299 IonicContact NH1-OD2 3.85Å; R40-D299 PolarHBondContact NH1-OD2 3.39Å; E295-D299 PolarHBondContact O-N 3.32Å; E295-D299 VanDerWaalsContact O-N 3.09Å; I296-D299 PolarHBondContact O-N 3.47Å; D299-D302 PolarHBondContact O-N 3.26Å; D299-Y303 WeakPolarHBondContact O-CB 3.46Å; D299-Y303 PolarHBondContact O-N 3.1Å; D299-Y311 WeakPolarHBondContact OD2-CE2 3.35Å; D299-Y311 PolarHBondContact OD2-OH 3.47Å
300	I	84.7	Confident	83.1	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-73.1	-41.6	178.4	-68.9	168.1	0	0	0	111.5	F2 I296 L298 D302 Y303 M304 Y311	F2-I300 HydrophobicContact CB-CD1 3.46Å; F2-I300 VanDerWaalsContact CB-CD1 3.46Å; F2-I300 HydrophobicContact CD1-CB 4.42Å; F2-I300 HydrophobicContact CD1-CD1 3.08Å; F2-I300 HydrophobicContact CD1-CG1 4.3Å; F2-I300 HydrophobicContact CD1-CG2 4.18Å; F2-I300 HydrophobicContact CD2-CD1 3.44Å; F2-I300 VanDerWaalsContact CD2-CD1 3.44Å; F2-I300 HydrophobicContact CE1-CD1 3.49Å; F2-I300 VanDerWaalsContact CE1-CD1 3.49Å; F2-I300 HydrophobicContact CE2-CD1 3.83Å; F2-I300 HydrophobicContact CG-CD1 3.01Å; F2-I300 HydrophobicContact CG-CG1 4.45Å; F2-I300 HydrophobicContact CZ-CD1 3.82Å; I296-I300 HydrophobicContact CG2-CD1 3.91Å; I296-I300 WeakPolarHBondContact O-CG1 3.43Å; I296-I300 PolarHBondContact O-N 3.36Å; I296-I300 VanDerWaalsContact O-N 3.08Å; L298-I300 PolarHBondContact O-N 2.98Å; I300-D302 VanDerWaalsContact C-N 3.31Å; I300-D302 PolarHBondContact O-N 3.16Å; I300-Y303 PolarHBondContact O-N 3.16Å; I300-M304 HydrophobicContact CG2-SD 4.32Å; I300-M304 WeakPolarHBondContact O-CG 3.39Å; I300-M304 PolarHBondContact O-N 2.89Å; I300-Y311 HydrophobicContact CB-CE2 4.44Å; I300-Y311 HydrophobicContact CG1-CD2 4.38Å; I300-Y311 HydrophobicContact CG1-CE1 4.31Å; I300-Y311 HydrophobicContact CG1-CE2 3.49Å; I300-Y311 VanDerWaalsContact CG1-CE2 3.49Å; I300-Y311 VanDerWaalsContact CG1-CZ 3.44Å; I300-Y311 VanDerWaalsContact CG1-OH 3.27Å; I300-Y311 WeakPolarHBondContact CG1-OH 3.38Å
301	C	86.2	Confident	81.6	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-54.7	-49.6	170.1	-71.8	0	0	0	0	111	G268 K276 A297 L298 Y303 M304 E305	G268-C301 PolarHBondContact O-SG 3.37Å; G268-C301 VanDerWaalsContact O-SG 3.35Å; K276-C301 HydrophobicContact CD-CB 4.2Å; K276-C301 HydrophobicContact CG-CB 4.12Å; A297-C301 PolarHBondContact O-N 2.8Å; A297-C301 PolarHBondContact O-SG 2.95Å; L298-C301 WeakPolarHBondContact O-CB 3.49Å; L298-C301 PolarHBondContact O-N 3.47Å; C301-Y303 VanDerWaalsContact C-N 3.32Å; C301-Y303 PolarHBondContact O-N 2.66Å; C301-M304 PolarHBondContact O-N 3.42Å; C301-E305 PolarHBondContact O-N 2.82Å
302	D	83.8	Confident	80.3	Confident	81 Å²	81	47.3 Å²	47.3	43%	0.433	25%	0.25	S	C	.	.	H	α-helix	trans	-65	-37.3	-178	-69.5	-10.9	0	0	0	111.1	L298 D299 I300 E305 G306	L298-D302 WeakPolarHBondContact O-CB 3.23Å; L298-D302 VanDerWaalsContact O-CG 3.3Å; L298-D302 PolarHBondContact O-N 3.4Å; D299-D302 PolarHBondContact O-N 3.26Å; I300-D302 VanDerWaalsContact C-N 3.31Å; I300-D302 PolarHBondContact O-N 3.16Å; D302-E305 PolarHBondContact O-N 2.84Å; D302-G306 PolarHBondContact O-N 3.16Å
303	Y	76.4	Confident	79.1	Confident	38 Å²	38	47.6 Å²	47.6	15%	0.149	26%	0.257	C	S	.	.	H	α-helix	trans	-63.1	-43.2	172.2	167.4	-97.9	0	0	0	112.8	D299 I300 C301 E305 G306 D308 Q310 Y311	D299-Y303 WeakPolarHBondContact O-CB 3.46Å; D299-Y303 PolarHBondContact O-N 3.1Å; I300-Y303 PolarHBondContact O-N 3.16Å; C301-Y303 VanDerWaalsContact C-N 3.32Å; C301-Y303 PolarHBondContact O-N 2.66Å; Y303-E305 PolarHBondContact O-N 3.05Å; Y303-G306 PolarHBondContact O-N 3.46Å; Y303-G306 VanDerWaalsContact O-N 3.08Å; Y303-D308 HydrophobicContact CD2-CB 3.63Å; Y303-D308 HydrophobicContact CE2-CB 3.54Å; Y303-D308 WeakPolarHBondContact CE2-O 3.44Å; Y303-Q310 VanDerWaalsContact CE2-C 3.43Å; Y303-Q310 WeakPolarHBondContact OH-CA 2.97Å; Y303-Y311 AromaticContact CD1-CD2 3.75Å; Y303-Y311 HydrophobicContact CD1-CD2 3.75Å; Y303-Y311 HydrophobicContact CD1-CG 4.28Å; Y303-Y311 AromaticContact CD2-CD2 3.85Å; Y303-Y311 HydrophobicContact CD2-CD2 3.85Å; Y303-Y311 HydrophobicContact CD2-CG 4.44Å; Y303-Y311 HydrophobicContact CE1-CD2 4.39Å; Y303-Y311 VanDerWaalsContact CE2-CA 3.41Å; Y303-Y311 HydrophobicContact CE2-CD2 4.46Å; Y303-Y311 AromaticContact CG-CD2 3.46Å; Y303-Y311 HydrophobicContact CG-CD2 3.46Å; Y303-Y311 VanDerWaalsContact CG-CD2 3.46Å; Y303-Y311 HydrophobicContact CG-CE2 4.37Å; Y303-Y311 HydrophobicContact CG-CG 4.27Å; Y303-Y311 PolarHBondContact OH-N 3.33Å
304	M	71.5	Confident	77.7	Confident	93 Å²	93	49 Å²	49	46%	0.458	27%	0.266	S	S	.	.	H	α-helix	trans	-63.8	-23.8	179.3	-72.5	178.2	72.2	0	0	112.5	I5 A271 I300 C301	I5-M304 HydrophobicContact CG2-CE 3.95Å; I5-M304 HydrophobicContact CG2-SD 3.81Å; A271-M304 HydrophobicContact CB-CE 4.41Å; A271-M304 HydrophobicContact CB-SD 4.13Å; I300-M304 HydrophobicContact CG2-SD 4.32Å; I300-M304 WeakPolarHBondContact O-CG 3.39Å; I300-M304 PolarHBondContact O-N 2.89Å; C301-M304 PolarHBondContact O-N 3.42Å
305	E	69.3	Low	76.3	Confident	126 Å²	126	55 Å²	55	59%	0.589	29%	0.293	S	S	*	.	H	α-helix	trans	-91.6	-22.3	172.8	-64	-168.8	139.9	0	0	114	K276 C301 D302 Y303	K276-E305 IonicContact NZ-OE1 2.89Å; K276-E305 PolarHBondContact NZ-OE1 3.15Å; K276-E305 IonicContact NZ-OE2 3.89Å; K276-E305 PolarHBondContact NZ-OE2 2.96Å; C301-E305 PolarHBondContact O-N 2.82Å; D302-E305 PolarHBondContact O-N 2.84Å; Y303-E305 PolarHBondContact O-N 3.05Å
306	G	66.8	Low	74.5	Confident	43 Å²	43	60 Å²	60	44%	0.443	34%	0.336	S	S	.	.	S	Bend	trans	-70.5	174	-178.2	0	0	0	0	0	113.5	D302 Y303 D308	D302-G306 PolarHBondContact O-N 3.16Å; Y303-G306 PolarHBondContact O-N 3.46Å; Y303-G306 VanDerWaalsContact O-N 3.08Å; G306-D308 VanDerWaalsContact C-N 3.35Å
307	S	60.7	Low	73.5	Confident	121 Å²	121	63 Å²	63	85%	0.846	35%	0.353	S	S	*	.			trans	-93	5.3	172.8	61.2	0	0	0	0	113.2	F309	S307-F309 PolarHBondContact O-N 2.93Å
308	D	58.8	Low	72.4	Confident	92 Å²	92	66.3 Å²	66.3	49%	0.492	37%	0.371	S	S	.	.			trans	-63.7	127.9	-176.6	-77.7	-10.8	0	0	0	110.3	R40 Y303 G306 Q310	R40-D308 IonicContact NH2-OD2 3.61Å; Y303-D308 HydrophobicContact CD2-CB 3.63Å; Y303-D308 HydrophobicContact CE2-CB 3.54Å; Y303-D308 WeakPolarHBondContact CE2-O 3.44Å; G306-D308 VanDerWaalsContact C-N 3.35Å; D308-Q310 VanDerWaalsContact C-N 3.33Å; D308-Q310 PolarHBondContact O-N 3.07Å
309	F	56.7	Low	71.1	Confident	184 Å²	184	69.1 Å²	69.1	81%	0.807	39%	0.387	S	S	*	.	S	Bend	trans	-70.8	-29.9	-176.5	-178.1	-100.3	0	0	0	113	S307	S307-F309 PolarHBondContact O-N 2.93Å
310	Q	63.7	Low	69.9	Low	69 Å²	69	72.3 Å²	72.3	32%	0.322	41%	0.405	S	S	.	.			trans	-148.4	129.1	-177.5	179.2	166.8	27.4	0	0	111.1	Y303 D308 A312 S313	Y303-Q310 VanDerWaalsContact CE2-C 3.43Å; Y303-Q310 WeakPolarHBondContact OH-CA 2.97Å; D308-Q310 VanDerWaalsContact C-N 3.33Å; D308-Q310 PolarHBondContact O-N 3.07Å; Q310-A312 HydrophobicContact CG-CB 4.37Å; Q310-S313 PolarHBondContact O-OG 2.8Å
311	Y	67.3	Low	69	Low	0 Å²	0	76.8 Å²	76.8	0%	0	43%	0.431	C	S	.	.	S	Bend	trans	-68.1	-47	176.9	-176.2	-94.8	0	0	0	111.7	I6 R40 F43 D299 I300 Y303 S313	I6-Y311 HydrophobicContact CD1-CD1 3.28Å; I6-Y311 HydrophobicContact CD1-CD2 4.35Å; I6-Y311 HydrophobicContact CD1-CE1 3.95Å; I6-Y311 HydrophobicContact CD1-CG 3.51Å; I6-Y311 HydrophobicContact CG1-CD1 4.39Å; I6-Y311 HydrophobicContact CG1-CG 4.17Å; R40-Y311 HydrophobicContact CG-CD1 4.01Å; R40-Y311 HydrophobicContact CG-CE1 3.56Å; R40-Y311 HydrophobicContact CG-CE2 4.25Å; R40-Y311 WeakPolarHBondContact CG-O 3.4Å; R40-Y311 PolarHBondContact NE-O 3.49Å; R40-Y311 VanDerWaalsContact NH1-CD2 3.26Å; R40-Y311 PolarHBondContact NH2-O 3.09Å; F43-Y311 AromaticContact CD2-CD1 3.74Å; F43-Y311 HydrophobicContact CD2-CD1 3.74Å; F43-Y311 AromaticContact CD2-CE1 3.45Å; F43-Y311 HydrophobicContact CD2-CE1 3.45Å; F43-Y311 VanDerWaalsContact CD2-CE1 3.45Å; F43-Y311 HydrophobicContact CE2-CD1 4.27Å; F43-Y311 AromaticContact CE2-CE1 3.62Å; F43-Y311 HydrophobicContact CE2-CE1 3.62Å; D299-Y311 WeakPolarHBondContact OD2-CE2 3.35Å; D299-Y311 PolarHBondContact OD2-OH 3.47Å; I300-Y311 HydrophobicContact CB-CE2 4.44Å; I300-Y311 HydrophobicContact CG1-CD2 4.38Å; I300-Y311 HydrophobicContact CG1-CE1 4.31Å; I300-Y311 HydrophobicContact CG1-CE2 3.49Å; I300-Y311 VanDerWaalsContact CG1-CE2 3.49Å; I300-Y311 VanDerWaalsContact CG1-CZ 3.44Å; I300-Y311 VanDerWaalsContact CG1-OH 3.27Å; I300-Y311 WeakPolarHBondContact CG1-OH 3.38Å; Y303-Y311 AromaticContact CD1-CD2 3.75Å; Y303-Y311 HydrophobicContact CD1-CD2 3.75Å; Y303-Y311 HydrophobicContact CD1-CG 4.28Å; Y303-Y311 AromaticContact CD2-CD2 3.85Å; Y303-Y311 HydrophobicContact CD2-CD2 3.85Å; Y303-Y311 HydrophobicContact CD2-CG 4.44Å; Y303-Y311 HydrophobicContact CE1-CD2 4.39Å; Y303-Y311 VanDerWaalsContact CE2-CA 3.41Å; Y303-Y311 HydrophobicContact CE2-CD2 4.46Å; Y303-Y311 AromaticContact CG-CD2 3.46Å; Y303-Y311 HydrophobicContact CG-CD2 3.46Å; Y303-Y311 VanDerWaalsContact CG-CD2 3.46Å; Y303-Y311 HydrophobicContact CG-CE2 4.37Å; Y303-Y311 HydrophobicContact CG-CG 4.27Å; Y303-Y311 PolarHBondContact OH-N 3.33Å; Y311-S313 PolarHBondContact O-N 3.18Å
312	A	73	Confident	67.9	Low	1 Å²	1	81.9 Å²	81.9	1%	0.008	46%	0.459	C	S	.	.	S	Bend	trans	-75.1	69.9	-179.9	0	0	0	0	0	111.3	F8 F43 L44 Q310	F8-A312 HydrophobicContact CE1-CB 4.13Å; F43-A312 HydrophobicContact CB-CB 3.95Å; L44-A312 HydrophobicContact CB-CB 4.2Å; Q310-A312 HydrophobicContact CG-CB 4.37Å
313	S	71.5	Confident	66.7	Low	50 Å²	50	82 Å²	82	35%	0.35	46%	0.461	S	S	.	.			trans	-127.3	148.6	-179.1	62.7	0	0	0	0	110.2	Q310 Y311	Q310-S313 PolarHBondContact O-OG 2.8Å; Y311-S313 PolarHBondContact O-N 3.18Å
314	V	69.1	Low	66	Low	31 Å²	31	85.4 Å²	85.4	19%	0.188	49%	0.485	C	S	.	.			trans	-122.1	145.8	178.2	-68.3	0	0	0	0	109.5	N23 A24 A41 L44	N23-V314 HydrophobicContact CB-CG2 4.49Å; N23-V314 WeakPolarHBondContact ND2-CG2 3.34Å; A24-V314 HydrophobicContact CB-CG1 3.9Å; A41-V314 HydrophobicContact CB-CG1 3.78Å; L44-V314 HydrophobicContact CD2-CB 4.29Å; L44-V314 HydrophobicContact CD2-CG1 3.79Å; L44-V314 HydrophobicContact CD2-CG2 3.65Å
315	H	70.1	Confident	65.5	Low	125 Å²	125	84.8 Å²	84.8	58%	0.579	49%	0.487	S	S	*	.			trans	-69.5	144.9	178.4	-62	-61.6	0	0	0	110.5	N23 Q27	N23-H315 PolarHBondContact ND2-O 2.65Å; Q27-H315 PolarHBondContact NE2-O 3.42Å
316	S	59.5	Low	65.2	Low	175 Å²	175	81 Å²	81	100%	1.224	48%	0.478	S	S	*	.			trans	-71.1	0	178.2	59.9	0	0	0	0	112.8

Retrieved 316 of 316 residues in 700.1 ms (Link to these results)

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