A0A087WTN9_HUMAN Loading...

Annexin

AlphaFold DB , UniProt , Accession A0A087WTN9, Species HUMAN (Homo sapiens, Human), Gene ANXA8, Length 365 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.8	Very low	31.7	Very low	221 Å²	221	135.4 Å²	135.4	100%	1.089	64%	0.635	S	S	*	*				0	-4.4	0	-72.4	-153.5	-84.5	0	0	115.4	W4	M1-W4 PolarHBondContact O-NE1 3.1Å
2	A	33.3	Very low	32.2	Very low	82 Å²	82	127.1 Å²	127.1	68%	0.678	61%	0.613	S	S	*	*			trans	-96.8	-20.5	179.3	0	0	0	0	0	115.1
3	W	27.6	Very low	32.9	Very low	212 Å²	212	123.2 Å²	123.2	80%	0.803	60%	0.602	S	S	*	*	H	α-helix	trans	-76.3	-33.3	-172.9	-151.2	68.4	0	0	0	113.7	S6 W7	W3-S6 PolarHBondContact O-N 2.79Å; W3-W7 PolarHBondContact O-N 2.88Å
4	W	28.8	Very low	33.9	Very low	163 Å²	163	119.2 Å²	119.2	62%	0.617	59%	0.588	S	S	*	*	H	α-helix	trans	-70.5	-33.8	178.1	82.1	-48.8	0	0	0	113.7	M1 W7 I8	M1-W4 PolarHBondContact O-NE1 3.1Å; W4-W7 PolarHBondContact O-N 2.75Å; W4-I8 HydrophobicContact CD2-CD1 4.36Å; W4-I8 HydrophobicContact CE3-CD1 3.9Å; W4-I8 HydrophobicContact CZ3-CD1 4.26Å; W4-I8 VanDerWaalsContact O-CG1 3.26Å; W4-I8 WeakPolarHBondContact O-CG1 3.26Å; W4-I8 PolarHBondContact O-N 3.35Å
5	K	27.7	Very low	35.1	Very low	135 Å²	135	112.1 Å²	112.1	59%	0.587	55%	0.554	S	S	*	*	H	α-helix	trans	-65	-42.5	173.7	-81	-171.5	174.2	-172.7	0	111.1	W7 I8 E9	K5-W7 VanDerWaalsContact C-N 3.28Å; K5-W7 PolarHBondContact O-N 3.33Å; K5-I8 PolarHBondContact O-N 2.87Å; K5-E9 PolarHBondContact O-N 2.86Å; K5-E9 VanDerWaalsContact O-N 3.14Å
6	S	26.2	Very low	35.9	Very low	59 Å²	59	116.9 Å²	116.9	41%	0.413	57%	0.571	S	S	.	*	H	α-helix	trans	-67	-28.3	175.8	-172.3	0	0	0	0	113.2	W3 Q10	W3-S6 PolarHBondContact O-N 2.79Å; S6-Q10 PolarHBondContact O-N 3.2Å
7	W	29	Very low	36.7	Very low	121 Å²	121	115.9 Å²	115.9	46%	0.458	58%	0.578	S	S	.	*	H	α-helix	trans	-79.4	-38.5	177.8	-163.4	72.5	0	0	0	112	W3 W4 K5 E9 Q10 E11	W3-W7 PolarHBondContact O-N 2.88Å; W4-W7 PolarHBondContact O-N 2.75Å; K5-W7 VanDerWaalsContact C-N 3.28Å; K5-W7 PolarHBondContact O-N 3.33Å; W7-E9 VanDerWaalsContact C-N 3.28Å; W7-E9 PolarHBondContact O-N 2.96Å; W7-Q10 PolarHBondContact O-N 2.96Å; W7-E11 PolarHBondContact O-N 3.04Å
8	I	33.5	Very low	37.8	Very low	57 Å²	57	113.4 Å²	113.4	29%	0.292	57%	0.574	S	S	.	*	H	α-helix	trans	-62.3	-34.6	172.1	-69.9	166.9	0	0	0	111.6	W4 K5	W4-I8 HydrophobicContact CD2-CD1 4.36Å; W4-I8 HydrophobicContact CE3-CD1 3.9Å; W4-I8 HydrophobicContact CZ3-CD1 4.26Å; W4-I8 VanDerWaalsContact O-CG1 3.26Å; W4-I8 WeakPolarHBondContact O-CG1 3.26Å; W4-I8 PolarHBondContact O-N 3.35Å; K5-I8 PolarHBondContact O-N 2.87Å
9	E	34.4	Very low	39.2	Very low	159 Å²	159	113.6 Å²	113.6	74%	0.743	59%	0.587	S	S	*	*	H	α-helix	trans	-77.7	-23	176.5	-76.6	173	174.6	0	0	113.9	K5 W7	K5-E9 PolarHBondContact O-N 2.86Å; K5-E9 VanDerWaalsContact O-N 3.14Å; W7-E9 VanDerWaalsContact C-N 3.28Å; W7-E9 PolarHBondContact O-N 2.96Å
10	Q	33.7	Very low	41.3	Very low	154 Å²	154	116.4 Å²	116.4	72%	0.72	60%	0.597	S	S	*	*	H	α-helix	trans	-83.9	-29.6	177.5	-91.7	-174.3	-23.8	0	0	113.5	S6 W7	S6-Q10 PolarHBondContact O-N 3.2Å; W7-Q10 PolarHBondContact O-N 2.96Å
11	E	36.7	Very low	43.7	Very low	126 Å²	126	113 Å²	113	59%	0.589	58%	0.578	S	S	*	*	S	Bend	trans	-141	90.2	-178.4	-64.9	-172.4	179.9	0	0	111.4	W7 N327	W7-E11 PolarHBondContact O-N 3.04Å; E11-N327 PolarHBondContact O-ND2 3.03Å
12	G	38.1	Very low	46.4	Very low	36 Å²	36	107 Å²	107	37%	0.371	55%	0.55	S	S	.	.			trans	150.6	-3.7	158.1	0	0	0	0	0	120.2	T14	G12-T14 PolarHBondContact O-N 2.95Å
13	V	41.4	Very low	49.5	Very low	76 Å²	76	104.2 Å²	104.2	46%	0.461	53%	0.525	S	S	.	.			trans	-90.7	101.8	166.3	-162.4	0	0	0	0	107.8	V15	V13-V15 WeakPolarHBondContact CG1-O 3.45Å; V13-V15 PolarHBondContact O-N 3.46Å; V13-V15 VanDerWaalsContact O-N 3.14Å
14	T	46.1	Very low	52.8	Low	68 Å²	68	97.6 Å²	97.6	42%	0.417	51%	0.505	S	S	.	.	S	Bend	trans	-60.5	-17.9	172.4	21.9	0	0	0	0	112	G12 L360	G12-T14 PolarHBondContact O-N 2.95Å; T14-L360 PolarHBondContact OG1-O 2.88Å
15	V	51.5	Low	56.1	Low	13 Å²	13	93 Å²	93	8%	0.079	50%	0.496	C	S	.	.	S	Bend	trans	-116.6	101.9	178.2	-165.8	0	0	0	0	113.5	V13 S17	V13-V15 WeakPolarHBondContact CG1-O 3.45Å; V13-V15 PolarHBondContact O-N 3.46Å; V13-V15 VanDerWaalsContact O-N 3.14Å; V15-S17 PolarHBondContact O-N 3.19Å
16	K	48.3	Very low	59.4	Low	189 Å²	189	87.3 Å²	87.3	82%	0.822	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-75	118.8	171.5	-67.7	-176.7	177.5	-178.5	0	110.9	S18	K16-S18 PolarHBondContact O-N 3.48Å
17	S	50.5	Low	62.8	Low	99 Å²	99	84.5 Å²	84.5	69%	0.692	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-77.9	116.6	166.4	60.5	0	0	0	0	110.2	V15	V15-S17 PolarHBondContact O-N 3.19Å
18	S	56.5	Low	66	Low	71 Å²	71	82.8 Å²	82.8	50%	0.497	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-79.4	143.9	168	174.3	0	0	0	0	110.3	K16 H20	K16-S18 PolarHBondContact O-N 3.48Å; S18-H20 PolarHBondContact O-N 3.04Å; S18-H20 PolarHBondContact OG-N 2.88Å; S18-H20 PolarHBondContact OG-O 3.29Å
19	S	64.4	Low	69.1	Low	118 Å²	118	82.7 Å²	82.7	83%	0.825	45%	0.452	S	S	*	.	S	Bend	trans	-65.1	-18.7	174	52.7	0	0	0	0	113.5
20	H	80.3	Confident	72.1	Confident	169 Å²	169	75.1 Å²	75.1	78%	0.782	42%	0.417	S	S	*	.	S	Bend	trans	-127.2	100.9	169.3	-76.1	-77.3	0	0	0	108.9	S18	S18-H20 PolarHBondContact O-N 3.04Å; S18-H20 PolarHBondContact OG-N 2.88Å; S18-H20 PolarHBondContact OG-O 3.29Å
21	F	91.9	Very high	75	Confident	46 Å²	46	71 Å²	71	20%	0.202	40%	0.395	C	S	.	.			trans	-110.1	124.2	173.8	176.4	-106	0	0	0	109.5	P23 D26 Q93 Q96 I97	F21-P23 HydrophobicContact CD1-CB 4.43Å; F21-P23 HydrophobicContact CE1-CB 3.8Å; F21-P23 HydrophobicContact CZ-CB 4.49Å; F21-D26 WeakPolarHBondContact CE2-OD2 3.46Å; F21-D26 WeakPolarHBondContact CZ-OD2 3.32Å; F21-Q93 HydrophobicContact CD1-CB 4.16Å; F21-Q93 HydrophobicContact CD1-CG 3.79Å; F21-Q93 HydrophobicContact CD2-CG 4.15Å; F21-Q93 HydrophobicContact CE1-CB 3.77Å; F21-Q93 HydrophobicContact CE1-CG 3.92Å; F21-Q93 HydrophobicContact CE2-CG 4.32Å; F21-Q93 HydrophobicContact CG-CG 3.89Å; F21-Q93 HydrophobicContact CZ-CB 3.99Å; F21-Q93 HydrophobicContact CZ-CG 4.2Å; F21-Q96 HydrophobicContact CD1-CB 4.48Å; F21-Q96 HydrophobicContact CE1-CB 4.31Å; F21-I97 HydrophobicContact CE1-CD1 4.44Å; F21-I97 HydrophobicContact CE1-CG1 4.03Å; F21-I97 HydrophobicContact CZ-CD1 3.94Å; F21-I97 HydrophobicContact CZ-CG1 3.89Å
22	N	95.3	Very high	77.7	Confident	94 Å²	94	70.2 Å²	70.2	50%	0.503	39%	0.39	S	S	.	.			trans	-98.7	112.9	171.4	-177.9	2.3	0	0	0	109	D24 P25	N22-D24 VanDerWaalsContact C-N 3.33Å; N22-D24 WeakPolarHBondContact OD1-CB 3.46Å; N22-D24 PolarHBondContact OD1-N 2.99Å; N22-D24 PolarHBondContact OD1-OD2 2.84Å; N22-P25 WeakPolarHBondContact O-CD 3.24Å
23	P	96.8	Very high	80.4	Confident	23 Å²	23	68.7 Å²	68.7	15%	0.149	37%	0.374	C	S	.	.			trans	-75.2	-17.8	-179.5	30.1	-35	0	0	0	114.3	F21 D26 A27 Q96 I97	F21-P23 HydrophobicContact CD1-CB 4.43Å; F21-P23 HydrophobicContact CE1-CB 3.8Å; F21-P23 HydrophobicContact CZ-CB 4.49Å; P23-D26 PolarHBondContact O-N 2.72Å; P23-A27 PolarHBondContact O-N 3.36Å; P23-Q96 HydrophobicContact CB-CB 4.03Å; P23-Q96 HydrophobicContact CG-CB 4.29Å; P23-I97 HydrophobicContact CB-CG1 4.1Å
24	D	97.4	Very high	82.9	Confident	74 Å²	74	65.7 Å²	65.7	40%	0.396	36%	0.355	S	S	.	.	H	α-helix	trans	-64.3	-43	-167.6	-58.8	-19.5	0	0	0	114.1	N22 D26 A27 E28 S100	N22-D24 VanDerWaalsContact C-N 3.33Å; N22-D24 WeakPolarHBondContact OD1-CB 3.46Å; N22-D24 PolarHBondContact OD1-N 2.99Å; N22-D24 PolarHBondContact OD1-OD2 2.84Å; D24-D26 VanDerWaalsContact C-N 3.33Å; D24-D26 PolarHBondContact O-N 3.02Å; D24-A27 PolarHBondContact O-N 3.46Å; D24-E28 PolarHBondContact O-N 2.91Å; D24-S100 WeakPolarHBondContact OD1-CB 3.46Å; D24-S100 PolarHBondContact OD1-OG 3.32Å
25	P	97.8	Very high	84.6	Confident	66 Å²	66	68.7 Å²	68.7	43%	0.429	36%	0.362	S	S	.	.	H	α-helix	trans	-66.1	-34.2	178.4	-21.4	34.4	0	0	0	113.2	N22 E28 T29	N22-P25 WeakPolarHBondContact O-CD 3.24Å; P25-E28 PolarHBondContact O-N 3.49Å; P25-T29 WeakPolarHBondContact O-CB 3.41Å; P25-T29 PolarHBondContact O-N 3.13Å; P25-T29 PolarHBondContact O-OG1 3.33Å
26	D	97.8	Very high	85	Confident	16 Å²	16	68.6 Å²	68.6	9%	0.086	36%	0.364	C	S	.	.	H	α-helix	trans	-71.2	-40.7	176.9	-75	-20.7	0	0	0	110.3	F21 P23 D24 E28 T29 L30 V85 R89 I97	F21-D26 WeakPolarHBondContact CE2-OD2 3.46Å; F21-D26 WeakPolarHBondContact CZ-OD2 3.32Å; P23-D26 PolarHBondContact O-N 2.72Å; D24-D26 VanDerWaalsContact C-N 3.33Å; D24-D26 PolarHBondContact O-N 3.02Å; D26-E28 VanDerWaalsContact C-N 3.33Å; D26-E28 PolarHBondContact O-N 3.13Å; D26-T29 WeakPolarHBondContact O-CB 3.49Å; D26-T29 PolarHBondContact O-N 2.66Å; D26-L30 WeakPolarHBondContact O-CG 3.38Å; D26-L30 PolarHBondContact O-N 2.9Å; D26-V85 HydrophobicContact CB-CG1 3.86Å; D26-R89 VanDerWaalsContact CG-NH2 3.3Å; D26-R89 IonicContact OD1-CZ 3.61Å; D26-R89 IonicContact OD1-NE 3.55Å; D26-R89 IonicContact OD1-NH2 3.69Å; D26-R89 PolarHBondContact OD1-NH2 2.95Å; D26-R89 IonicContact OD2-CZ 2.74Å; D26-R89 VanDerWaalsContact OD2-CZ 3.24Å; D26-R89 IonicContact OD2-NE 2.93Å; D26-R89 PolarHBondContact OD2-NE 3.01Å; D26-R89 IonicContact OD2-NH2 2.74Å; D26-R89 PolarHBondContact OD2-NH2 3.06Å; D26-I97 HydrophobicContact CB-CD1 3.75Å; D26-I97 HydrophobicContact CB-CG1 3.88Å; D26-I97 HydrophobicContact CB-CG2 4.39Å
27	A	97.6	Very high	84.7	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-60.3	-42.7	173.4	0	0	0	0	0	111.8	P23 D24 L30 Y31 I97 F101 F105	P23-A27 PolarHBondContact O-N 3.36Å; D24-A27 PolarHBondContact O-N 3.46Å; A27-L30 PolarHBondContact O-N 2.92Å; A27-Y31 WeakPolarHBondContact O-CB 3.28Å; A27-Y31 PolarHBondContact O-N 3.43Å; A27-I97 HydrophobicContact CB-CG2 4.27Å; A27-F101 HydrophobicContact CB-CB 4.02Å; A27-F101 HydrophobicContact CB-CD2 4.44Å; A27-F101 WeakPolarHBondContact O-CD2 3.38Å; A27-F105 HydrophobicContact CB-CE2 4.41Å
28	E	96.9	Very high	83.9	Confident	84 Å²	84	65.6 Å²	65.6	39%	0.393	36%	0.363	S	S	.	.	H	α-helix	trans	-66.5	-40.6	176.9	-165.6	-172.2	175.7	0	0	111.9	D24 P25 D26 L30 Y31 K32 F105	D24-E28 PolarHBondContact O-N 2.91Å; P25-E28 PolarHBondContact O-N 3.49Å; D26-E28 VanDerWaalsContact C-N 3.33Å; D26-E28 PolarHBondContact O-N 3.13Å; E28-L30 PolarHBondContact O-N 3.09Å; E28-Y31 PolarHBondContact O-N 3.33Å; E28-K32 HydrophobicContact CG-CD 4.36Å; E28-K32 WeakPolarHBondContact O-CG 3.48Å; E28-K32 PolarHBondContact O-N 3.38Å; E28-K32 WeakPolarHBondContact OE1-CE 3.18Å; E28-K32 IonicContact OE1-NZ 3.98Å; E28-K32 PolarHBondContact OE1-NZ 3.02Å; E28-K32 IonicContact OE2-NZ 3.84Å; E28-F105 HydrophobicContact CB-CZ 4.46Å
29	T	97.3	Very high	83	Confident	56 Å²	56	68.7 Å²	68.7	34%	0.344	38%	0.378	S	S	.	.	H	α-helix	trans	-55.7	-50.4	173.1	-60.6	0	0	0	0	111.3	P25 D26 Y31 K32 A33 A81 V85	P25-T29 WeakPolarHBondContact O-CB 3.41Å; P25-T29 PolarHBondContact O-N 3.13Å; P25-T29 PolarHBondContact O-OG1 3.33Å; D26-T29 WeakPolarHBondContact O-CB 3.49Å; D26-T29 PolarHBondContact O-N 2.66Å; T29-Y31 VanDerWaalsContact C-N 3.35Å; T29-Y31 PolarHBondContact O-N 2.99Å; T29-K32 PolarHBondContact O-N 3.14Å; T29-A33 WeakPolarHBondContact O-CB 3.27Å; T29-A33 PolarHBondContact O-N 2.68Å; T29-A81 HydrophobicContact CG2-CB 4.46Å; T29-V85 HydrophobicContact CG2-CG2 3.73Å
30	L	96.9	Very high	81.7	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-63.5	-40.3	179.3	-69.5	175.6	0	0	0	111.9	D26 A27 E28 A33 M34 I82 V85 L86 I97 F101 L109	D26-L30 WeakPolarHBondContact O-CG 3.38Å; D26-L30 PolarHBondContact O-N 2.9Å; A27-L30 PolarHBondContact O-N 2.92Å; E28-L30 PolarHBondContact O-N 3.09Å; L30-A33 PolarHBondContact O-N 3.42Å; L30-M34 HydrophobicContact CB-CE 4.23Å; L30-M34 VanDerWaalsContact O-CE 3.28Å; L30-M34 WeakPolarHBondContact O-CE 3.4Å; L30-M34 PolarHBondContact O-N 3.46Å; L30-M34 VanDerWaalsContact O-N 3.14Å; L30-I82 HydrophobicContact CD2-CB 4.38Å; L30-I82 HydrophobicContact CD2-CG1 4.16Å; L30-I82 HydrophobicContact CD2-CG2 4.43Å; L30-V85 HydrophobicContact CD1-CG1 4.08Å; L30-V85 HydrophobicContact CD2-CB 4.02Å; L30-V85 HydrophobicContact CD2-CG1 4.18Å; L30-V85 HydrophobicContact CD2-CG2 4.41Å; L30-V85 HydrophobicContact CG-CB 4.39Å; L30-V85 HydrophobicContact CG-CG1 4.08Å; L30-L86 HydrophobicContact CD1-CD2 3.84Å; L30-L86 HydrophobicContact CD1-CG 4.37Å; L30-L86 HydrophobicContact CD2-CD1 4.39Å; L30-L86 HydrophobicContact CD2-CD2 4.49Å; L30-L86 HydrophobicContact CD2-CG 4.14Å; L30-I97 HydrophobicContact CD1-CG2 3.68Å; L30-F101 HydrophobicContact CB-CD2 4.46Å; L30-F101 HydrophobicContact CB-CE2 4.37Å; L30-L109 HydrophobicContact CD1-CD1 4.17Å; L30-L109 HydrophobicContact CD1-CD2 3.91Å
31	Y	95.3	Very high	79.4	Confident	66 Å²	66	62.8 Å²	62.8	26%	0.259	37%	0.368	S	S	.	.	H	α-helix	trans	-62.3	-46.2	176.6	178.8	-101.7	0	0	0	111.9	A27 E28 T29 A33 M34 K35 F101 F105	A27-Y31 WeakPolarHBondContact O-CB 3.28Å; A27-Y31 PolarHBondContact O-N 3.43Å; E28-Y31 PolarHBondContact O-N 3.33Å; T29-Y31 VanDerWaalsContact C-N 3.35Å; T29-Y31 PolarHBondContact O-N 2.99Å; Y31-A33 VanDerWaalsContact C-N 3.31Å; Y31-A33 PolarHBondContact O-N 3.01Å; Y31-M34 PolarHBondContact O-N 3.32Å; Y31-K35 HydrophobicContact CD1-CD 4.41Å; Y31-K35 HydrophobicContact CE1-CD 3.54Å; Y31-K35 WeakPolarHBondContact O-CB 3.39Å; Y31-K35 PolarHBondContact O-N 3.3Å; Y31-K35 WeakPolarHBondContact OH-CD 3.46Å; Y31-K35 WeakPolarHBondContact OH-CE 3.41Å; Y31-K35 PolarHBondContact OH-NZ 3.46Å; Y31-F101 HydrophobicContact CD2-CE2 4.29Å; Y31-F101 HydrophobicContact CD2-CZ 4.24Å; Y31-F105 VanDerWaalsContact CB-CE2 3.5Å; Y31-F105 AromaticContact CD1-CD1 3.96Å; Y31-F105 HydrophobicContact CD1-CD1 3.96Å; Y31-F105 AromaticContact CD1-CE1 3.68Å; Y31-F105 HydrophobicContact CD1-CE1 3.68Å; Y31-F105 HydrophobicContact CD1-CZ 4.06Å; Y31-F105 HydrophobicContact CD2-CB 3.94Å; Y31-F105 AromaticContact CD2-CD1 3.63Å; Y31-F105 HydrophobicContact CD2-CD1 3.63Å; Y31-F105 AromaticContact CD2-CD2 3.82Å; Y31-F105 HydrophobicContact CD2-CD2 3.82Å; Y31-F105 HydrophobicContact CD2-CE1 4.1Å; Y31-F105 HydrophobicContact CD2-CE2 4.28Å; Y31-F105 AromaticContact CD2-CG 3.49Å; Y31-F105 HydrophobicContact CD2-CG 3.49Å; Y31-F105 VanDerWaalsContact CD2-CG 3.49Å; Y31-F105 HydrophobicContact CD2-CZ 4.41Å; Y31-F105 HydrophobicContact CE1-CD1 4.07Å; Y31-F105 HydrophobicContact CE1-CE1 4.07Å; Y31-F105 HydrophobicContact CE2-CB 4Å; Y31-F105 AromaticContact CE2-CD1 3.76Å; Y31-F105 HydrophobicContact CE2-CD1 3.76Å; Y31-F105 HydrophobicContact CE2-CE1 4.46Å; Y31-F105 AromaticContact CE2-CG 3.86Å; Y31-F105 HydrophobicContact CE2-CG 3.86Å; Y31-F105 AromaticContact CG-CD1 3.73Å; Y31-F105 HydrophobicContact CG-CD1 3.73Å; Y31-F105 AromaticContact CG-CD2 3.95Å; Y31-F105 HydrophobicContact CG-CD2 3.95Å; Y31-F105 AromaticContact CG-CE1 3.69Å; Y31-F105 HydrophobicContact CG-CE1 3.69Å; Y31-F105 AromaticContact CG-CE2 3.92Å; Y31-F105 HydrophobicContact CG-CE2 3.92Å; Y31-F105 AromaticContact CG-CG 3.87Å; Y31-F105 HydrophobicContact CG-CG 3.87Å; Y31-F105 AromaticContact CG-CZ 3.8Å; Y31-F105 HydrophobicContact CG-CZ 3.8Å; Y31-F105 AromaticContact CZ-CD1 3.97Å
32	K	94.5	Very high	76.7	Confident	110 Å²	110	69 Å²	69	48%	0.478	40%	0.398	S	S	.	.	H	α-helix	trans	-63.4	-37.2	176.2	-72.7	172.4	-177.9	164.4	0	112	E28 T29 M34	E28-K32 HydrophobicContact CG-CD 4.36Å; E28-K32 WeakPolarHBondContact O-CG 3.48Å; E28-K32 PolarHBondContact O-N 3.38Å; E28-K32 WeakPolarHBondContact OE1-CE 3.18Å; E28-K32 IonicContact OE1-NZ 3.98Å; E28-K32 PolarHBondContact OE1-NZ 3.02Å; E28-K32 IonicContact OE2-NZ 3.84Å; T29-K32 PolarHBondContact O-N 3.14Å; K32-M34 VanDerWaalsContact C-N 3.31Å; K32-M34 PolarHBondContact O-N 3.14Å
33	A	94.4	Very high	73.8	Confident	5 Å²	5	73 Å²	73	4%	0.041	42%	0.418	C	S	.	.	H	α-helix	trans	-64.8	-33.6	178.5	0	0	0	0	0	112.9	T29 L30 Y31 T77 N78 A81 I82	T29-A33 WeakPolarHBondContact O-CB 3.27Å; T29-A33 PolarHBondContact O-N 2.68Å; L30-A33 PolarHBondContact O-N 3.42Å; Y31-A33 VanDerWaalsContact C-N 3.31Å; Y31-A33 PolarHBondContact O-N 3.01Å; A33-T77 CarbonylContact O-C 3.52Å; A33-T77 WeakPolarHBondContact O-CA 3.5Å; A33-N78 HydrophobicContact CB-CB 4.1Å; A33-N78 PolarHBondContact O-N 3.03Å; A33-A81 HydrophobicContact CB-CB 3.89Å; A33-I82 HydrophobicContact CB-CG1 4.07Å
34	M	92.9	Very high	70.9	Confident	12 Å²	12	79.4 Å²	79.4	6%	0.059	45%	0.45	C	S	.	.	H	α-helix	trans	-94.4	-21.6	-177.9	-69.2	-177.6	-70.2	0	0	114	L30 Y31 K32 G36 I82 F101 L109 T112 L113 E116	L30-M34 HydrophobicContact CB-CE 4.23Å; L30-M34 VanDerWaalsContact O-CE 3.28Å; L30-M34 WeakPolarHBondContact O-CE 3.4Å; L30-M34 PolarHBondContact O-N 3.46Å; L30-M34 VanDerWaalsContact O-N 3.14Å; Y31-M34 PolarHBondContact O-N 3.32Å; K32-M34 VanDerWaalsContact C-N 3.31Å; K32-M34 PolarHBondContact O-N 3.14Å; M34-G36 PolarHBondContact O-N 3.45Å; M34-I82 HydrophobicContact CG-CD1 4.06Å; M34-F101 HydrophobicContact CE-CE2 3.68Å; M34-F101 HydrophobicContact CE-CZ 3.66Å; M34-L109 HydrophobicContact CE-CD1 3.8Å; M34-T112 HydrophobicContact CE-CG2 3.93Å; M34-T112 HydrophobicContact SD-CG2 3.71Å; M34-L113 HydrophobicContact CE-CD2 4.49Å; M34-L113 HydrophobicContact SD-CD2 3.72Å; M34-L113 HydrophobicContact SD-CG 4.18Å; M34-E116 HydrophobicContact CB-CG 4.1Å; M34-E116 HydrophobicContact CG-CB 4.3Å; M34-E116 HydrophobicContact CG-CG 4.21Å; M34-E116 HydrophobicContact SD-CB 4.36Å; M34-E116 HydrophobicContact SD-CG 4.2Å
35	K	82.4	Confident	67.8	Low	131 Å²	131	80.9 Å²	80.9	57%	0.57	47%	0.466	S	S	*	.	S	Bend	trans	-75.2	-9.1	-178	-168.7	174.1	-176.7	172.6	0	114	Y31	Y31-K35 HydrophobicContact CD1-CD 4.41Å; Y31-K35 HydrophobicContact CE1-CD 3.54Å; Y31-K35 WeakPolarHBondContact O-CB 3.39Å; Y31-K35 PolarHBondContact O-N 3.3Å; Y31-K35 WeakPolarHBondContact OH-CD 3.46Å; Y31-K35 WeakPolarHBondContact OH-CE 3.41Å; Y31-K35 PolarHBondContact OH-NZ 3.46Å
36	G	60.5	Low	64.7	Low	12 Å²	12	87.2 Å²	87.2	12%	0.124	49%	0.49	C	S	.	.			trans	78.1	138.7	-167.4	0	0	0	0	0	111.6	M34 G38 G76	M34-G36 PolarHBondContact O-N 3.45Å; G36-G38 VanDerWaalsContact C-N 3.31Å; G36-G38 PolarHBondContact O-N 2.93Å; G36-G76 WeakPolarHBondContact CA-O 3.28Å
37	I	40.9	Very low	61.6	Low	159 Å²	159	95.5 Å²	95.5	82%	0.815	53%	0.528	S	S	*	.	S	Bend	trans	-68.7	91.2	176	-58.8	174	0	0	0	108.3
38	G	34.7	Very low	58.4	Low	65 Å²	65	100.7 Å²	100.7	67%	0.67	57%	0.571	S	S	*	*			trans	-169	51	-179.1	0	0	0	0	0	111.6	G36 G40	G36-G38 VanDerWaalsContact C-N 3.31Å; G36-G38 PolarHBondContact O-N 2.93Å; G38-G40 VanDerWaalsContact C-N 3.27Å; G38-G40 PolarHBondContact O-N 2.95Å
39	V	36.4	Very low	55.3	Low	136 Å²	136	101.4 Å²	101.4	82%	0.824	59%	0.591	S	S	*	*			trans	-78.9	87.5	166.6	-169.8	0	0	0	0	108.1
40	G	37.6	Very low	52.3	Low	72 Å²	72	103.1 Å²	103.1	74%	0.742	61%	0.611	S	S	*	*			trans	-133	79.3	161.6	0	0	0	0	0	109.1	G38	G38-G40 VanDerWaalsContact C-N 3.27Å; G38-G40 PolarHBondContact O-N 2.95Å
41	S	32.3	Very low	49.1	Very low	92 Å²	92	113.6 Å²	113.6	64%	0.643	66%	0.657	S	S	*	*	S	Bend	trans	-172.7	118.7	136.1	-150	0	0	0	0	113.1
42	Q	35.6	Very low	46	Very low	177 Å²	177	114.3 Å²	114.3	83%	0.827	68%	0.676	S	S	*	*			trans	59.6	85.8	134.4	-67.4	169.1	-22	0	0	119.4
43	L	34.6	Very low	42.9	Very low	177 Å²	177	118.6 Å²	118.6	93%	0.927	70%	0.695	S	S	*	*				-100.8	104.2	127.2	-91	154.3	0	0	0	106
44	L	34.8	Very low	40.4	Very low	158 Å²	158	123.8 Å²	123.8	83%	0.827	73%	0.729	S	S	*	*			trans	-176.4	118.1	151.9	-96.6	170.6	0	0	0	110.9
45	S	33.5	Very low	37.5	Very low	105 Å²	105	128.6 Å²	128.6	73%	0.734	76%	0.763	S	S	*	*			trans	51.8	109.7	151.5	60.6	0	0	0	0	120.6	Q47	S45-Q47 PolarHBondContact O-N 3.34Å
46	H	32.7	Very low	35.1	Very low	198 Å²	198	127.8 Å²	127.8	92%	0.917	77%	0.774	S	S	*	*			trans	-63.8	113.4	145.9	-87.3	-71.8	0	0	0	109.9
47	Q	31.9	Very low	33.9	Very low	190 Å²	190	132 Å²	132	89%	0.888	81%	0.808	S	S	*	*			trans	-151.7	110.3	143.3	-109	172.9	15.3	0	0	108.1	S45	S45-Q47 PolarHBondContact O-N 3.34Å
48	A	30.1	Very low	33.6	Very low	109 Å²	109	132.7 Å²	132.7	90%	0.901	81%	0.812	S	S	*	*			trans	-79.8	128.7	173.8	0	0	0	0	0	109.2
49	A	32.4	Very low	33.5	Very low	99 Å²	99	136.4 Å²	136.4	82%	0.818	82%	0.822	S	S	*	*			trans	-131.7	113.2	160.1	0	0	0	0	0	108
50	A	32.9	Very low	33.5	Very low	92 Å²	92	135.4 Å²	135.4	76%	0.76	82%	0.821	S	S	*	*			trans	-81.5	134	173.2	0	0	0	0	0	109.7
51	F	30.5	Very low	33.3	Very low	220 Å²	220	139.1 Å²	139.1	97%	0.965	83%	0.829	S	S	*	*			trans	-146.8	141.4	154	-95	-77.1	0	0	0	110.5
52	A	30.9	Very low	33.4	Very low	81 Å²	81	139.8 Å²	139.8	67%	0.669	83%	0.834	S	S	*	*			trans	-102.9	138.7	-168.6	0	0	0	0	0	112.5
53	F	29.2	Very low	33.9	Very low	200 Å²	200	136.1 Å²	136.1	88%	0.877	83%	0.826	S	S	*	*			trans	47.1	167.1	145.9	-78.3	-80.9	0	0	0	121.3
54	P	41.3	Very low	33.9	Very low	114 Å²	114	139.7 Å²	139.7	74%	0.74	83%	0.827	S	S	*	*			cis	-135.9	165.1	-2.4	25.1	0.1	0	0	0	118.3
55	S	33.3	Very low	33.6	Very low	113 Å²	113	135.4 Å²	135.4	79%	0.79	82%	0.821	S	S	*	*			trans	3.3	130.9	145.4	-176.2	0	0	0	0	122
56	S	31.8	Very low	33.6	Very low	114 Å²	114	139.8 Å²	139.8	80%	0.797	83%	0.83	S	S	*	*				-175.4	147.5	124	52.9	0	0	0	0	114.5
57	A	34.2	Very low	33.6	Very low	101 Å²	101	139 Å²	139	84%	0.835	83%	0.827	S	S	*	*			trans	98.5	113.9	149.5	0	0	0	0	0	120.2
58	L	33.9	Very low	33.5	Very low	173 Å²	173	132.7 Å²	132.7	91%	0.906	81%	0.812	S	S	*	*			trans	-72.3	137.3	163.9	-74.8	148.7	0	0	0	111.2
59	T	34.5	Very low	33.7	Very low	144 Å²	144	135.3 Å²	135.3	88%	0.883	81%	0.805	S	S	*	*			trans	-151.6	129	142.2	42.3	0	0	0	0	110.5
60	S	35.1	Very low	33.7	Very low	114 Å²	114	138.2 Å²	138.2	80%	0.797	81%	0.807	S	S	*	*			trans	-76.1	129.8	174.4	52.1	0	0	0	0	112.7
61	V	34.2	Very low	33.7	Very low	150 Å²	150	138.8 Å²	138.8	91%	0.909	80%	0.804	S	S	*	*			trans	-159.3	129.6	143	-171.3	0	0	0	0	108.9
62	S	34.8	Very low	33.8	Very low	106 Å²	106	133.8 Å²	133.8	74%	0.741	80%	0.795	S	S	*	*			trans	-113.2	167.7	163.1	45.1	0	0	0	0	108.5
63	P	45.8	Very low	34.1	Very low	101 Å²	101	136.8 Å²	136.8	66%	0.656	80%	0.8	S	S	*	*			cis	-135	-167.5	11.9	35.1	-12.2	0	0	0	113.1
64	W	33.9	Very low	34.8	Very low	251 Å²	251	132.9 Å²	132.9	95%	0.951	79%	0.794	S	S	*	*			trans	88.6	76.2	-178.1	-47.5	100.1	0	0	0	115.2
65	G	29.4	Very low	35.6	Very low	68 Å²	68	132.3 Å²	132.3	70%	0.701	80%	0.799	S	S	*	*			trans	-136.7	112.2	161.4	0	0	0	0	0	107.7	Q67	G65-Q67 PolarHBondContact O-N 3.31Å; G65-Q67 VanDerWaalsContact O-N 3.1Å
66	Q	33.6	Very low	37.4	Very low	198 Å²	198	129 Å²	129	93%	0.925	78%	0.782	S	S	*	*			trans	-48.3	118.4	172.7	-69.6	178.6	-13.7	0	0	108.8	G68	Q66-G68 PolarHBondContact O-N 3.47Å
67	Q	31.9	Very low	40.1	Very low	181 Å²	181	124.8 Å²	124.8	85%	0.846	75%	0.752	S	S	*	*			trans	-67.3	84	161.4	-155.1	90.5	22.4	0	0	105.4	G65 H69	G65-Q67 PolarHBondContact O-N 3.31Å; G65-Q67 VanDerWaalsContact O-N 3.1Å; Q67-H69 PolarHBondContact O-N 3.49Å
68	G	29.6	Very low	43	Very low	57 Å²	57	123 Å²	123	59%	0.588	73%	0.729	S	S	*	*			trans	-59.4	96.3	159.9	0	0	0	0	0	105.6	Q66 L70	Q66-G68 PolarHBondContact O-N 3.47Å; G68-L70 PolarHBondContact O-N 2.65Å
69	H	33.4	Very low	46	Very low	164 Å²	164	117.6 Å²	117.6	76%	0.759	70%	0.699	S	S	*	*			trans	-47.5	106.6	148.4	-88.4	-60.3	0	0	0	104.7	Q67 C71	Q67-H69 PolarHBondContact O-N 3.49Å; H69-C71 PolarHBondContact O-N 3.31Å
70	L	33.8	Very low	48.9	Very low	161 Å²	161	114.7 Å²	114.7	84%	0.843	68%	0.675	S	S	*	*			trans	-57.2	91.4	152	-89.1	96.5	0	0	0	104	G68 C72	G68-L70 PolarHBondContact O-N 2.65Å; L70-C72 PolarHBondContact O-N 2.88Å
71	C	31.3	Very low	51.9	Low	104 Å²	104	110.1 Å²	110.1	70%	0.703	64%	0.644	S	S	*	*			trans	-60.7	96.9	158.9	-67.3	0	0	0	0	104	H69 N73	H69-C71 PolarHBondContact O-N 3.31Å; C71-N73 PolarHBondContact O-N 3.33Å
72	C	33.3	Very low	54.9	Low	115 Å²	115	103 Å²	103	78%	0.777	60%	0.601	S	S	*	*			trans	-46.2	112.1	153.5	-62.5	0	0	0	0	105.3	L70 P74	L70-C72 PolarHBondContact O-N 2.88Å; C72-P74 VanDerWaalsContact O-N 3.14Å
73	N	36.9	Very low	57.9	Low	144 Å²	144	98 Å²	98	77%	0.77	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-52.8	125.2	164.4	-90.1	-7.1	0	0	0	105.6	C71 A75	C71-N73 PolarHBondContact O-N 3.33Å; N73-A75 PolarHBondContact O-N 2.95Å
74	P	43.6	Very low	60.3	Low	117 Å²	117	96.1 Å²	96.1	76%	0.76	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-58.5	138.7	179.1	15	-17.1	0	0	0	108.1	C72 G76	C72-P74 VanDerWaalsContact O-N 3.14Å; P74-G76 PolarHBondContact O-N 2.63Å
75	A	58.7	Low	63.3	Low	103 Å²	103	84.5 Å²	84.5	85%	0.851	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-46.4	116.1	164.7	0	0	0	0	0	107.7	N73	N73-A75 PolarHBondContact O-N 2.95Å
76	G	71.8	Confident	66.6	Low	42 Å²	42	81.3 Å²	81.3	43%	0.433	47%	0.474	S	S	.	.			trans	-135.1	135.2	-174	0	0	0	0	0	109.9	G36 P74	G36-G76 WeakPolarHBondContact CA-O 3.28Å; P74-G76 PolarHBondContact O-N 2.63Å
77	T	89.2	Confident	69.6	Low	26 Å²	26	71.9 Å²	71.9	16%	0.16	43%	0.43	C	S	.	.			trans	-73.1	145.3	172.8	-57.7	0	0	0	0	109.1	A33 I82 L117	A33-T77 CarbonylContact O-C 3.52Å; A33-T77 WeakPolarHBondContact O-CA 3.5Å; T77-I82 HydrophobicContact CG2-CD1 3.59Å; T77-L117 HydrophobicContact CG2-CD2 3.95Å
78	N	94.6	Very high	72.6	Confident	64 Å²	64	67.9 Å²	67.9	34%	0.342	41%	0.41	S	S	.	.			trans	-99.7	87.5	170.5	-176.6	-16.5	0	0	0	109.3	A33 Q80 A81 I82	A33-N78 HydrophobicContact CB-CB 4.1Å; A33-N78 PolarHBondContact O-N 3.03Å; N78-Q80 VanDerWaalsContact C-N 3.28Å; N78-Q80 PolarHBondContact O-N 2.89Å; N78-Q80 PolarHBondContact OD1-N 2.64Å; N78-A81 HydrophobicContact CB-CB 4.23Å; N78-A81 PolarHBondContact O-N 3.25Å; N78-A81 PolarHBondContact OD1-N 3.05Å; N78-I82 PolarHBondContact O-N 3.14Å
79	E	95.9	Very high	75.7	Confident	60 Å²	60	68 Å²	68	28%	0.28	39%	0.393	S	S	.	.	H	α-helix	trans	-62.2	-36.2	-177	-64.8	79.6	-172.7	0	0	111.8	A81 I82 I83 F121 D352	E79-A81 PolarHBondContact O-N 2.85Å; E79-I82 WeakPolarHBondContact O-CB 3.33Å; E79-I82 PolarHBondContact O-N 3.38Å; E79-I82 VanDerWaalsContact O-N 3.13Å; E79-I83 WeakPolarHBondContact O-CG1 3.5Å; E79-I83 PolarHBondContact O-N 3.44Å; E79-F121 HydrophobicContact CB-CE1 3.7Å; E79-F121 HydrophobicContact CB-CZ 3.91Å; E79-F121 HydrophobicContact CG-CD1 4.12Å; E79-F121 HydrophobicContact CG-CE1 3.54Å; E79-F121 HydrophobicContact CG-CZ 4.28Å; E79-D352 HydrophobicContact CB-CB 4.15Å
80	Q	96.8	Very high	78.6	Confident	82 Å²	82	60.7 Å²	60.7	38%	0.383	36%	0.36	S	S	.	.	H	α-helix	trans	-63.3	-41	179.5	-174.3	56.6	53.3	0	0	111.8	N78 I82 I83 D84	N78-Q80 VanDerWaalsContact C-N 3.28Å; N78-Q80 PolarHBondContact O-N 2.89Å; N78-Q80 PolarHBondContact OD1-N 2.64Å; Q80-I82 VanDerWaalsContact C-N 3.31Å; Q80-I82 PolarHBondContact O-N 3.08Å; Q80-I83 PolarHBondContact O-N 3.39Å; Q80-D84 VanDerWaalsContact NE2-CG 3.33Å; Q80-D84 PolarHBondContact NE2-OD1 2.88Å; Q80-D84 PolarHBondContact NE2-OD2 3.09Å; Q80-D84 WeakPolarHBondContact O-CB 3.49Å; Q80-D84 PolarHBondContact O-N 3.44Å
81	A	96.8	Very high	81.6	Confident	18 Å²	18	53.8 Å²	53.8	15%	0.149	32%	0.324	C	S	.	.	H	α-helix	trans	-64.4	-36.7	174.6	0	0	0	0	0	112.2	T29 A33 N78 E79 V85	T29-A81 HydrophobicContact CG2-CB 4.46Å; A33-A81 HydrophobicContact CB-CB 3.89Å; N78-A81 HydrophobicContact CB-CB 4.23Å; N78-A81 PolarHBondContact O-N 3.25Å; N78-A81 PolarHBondContact OD1-N 3.05Å; E79-A81 PolarHBondContact O-N 2.85Å; A81-V85 WeakPolarHBondContact O-CG2 3.09Å; A81-V85 PolarHBondContact O-N 3.24Å
82	I	98	Very high	84.7	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-64.4	-44.8	174.6	-64	171.8	0	0	0	110.3	L30 A33 M34 T77 N78 E79 Q80 V85 L86 L113 L117 F121 I125	L30-I82 HydrophobicContact CD2-CB 4.38Å; L30-I82 HydrophobicContact CD2-CG1 4.16Å; L30-I82 HydrophobicContact CD2-CG2 4.43Å; A33-I82 HydrophobicContact CB-CG1 4.07Å; M34-I82 HydrophobicContact CG-CD1 4.06Å; T77-I82 HydrophobicContact CG2-CD1 3.59Å; N78-I82 PolarHBondContact O-N 3.14Å; E79-I82 WeakPolarHBondContact O-CB 3.33Å; E79-I82 PolarHBondContact O-N 3.38Å; E79-I82 VanDerWaalsContact O-N 3.13Å; Q80-I82 VanDerWaalsContact C-N 3.31Å; Q80-I82 PolarHBondContact O-N 3.08Å; I82-V85 PolarHBondContact O-N 3.2Å; I82-L86 HydrophobicContact CG2-CD1 3.71Å; I82-L86 HydrophobicContact CG2-CG 4.37Å; I82-L86 WeakPolarHBondContact O-CB 3.43Å; I82-L86 PolarHBondContact O-N 2.98Å; I82-L113 HydrophobicContact CD1-CD2 4.3Å; I82-L113 HydrophobicContact CG2-CD2 4.12Å; I82-L117 HydrophobicContact CD1-CD2 3.94Å; I82-F121 HydrophobicContact CG2-CZ 4.44Å; I82-I125 HydrophobicContact CG2-CD1 4.24Å; I82-I125 HydrophobicContact CG2-CG1 4.39Å; I82-I125 HydrophobicContact CG2-CG2 4.13Å
83	I	97.8	Very high	87.7	Confident	3 Å²	3	48.3 Å²	48.3	2%	0.015	28%	0.283	C	S	.	.	H	α-helix	trans	-58.8	-55	175.8	-67.9	168.3	0	0	0	109.9	E79 Q80 V85 L86 T87 F121 D352 N355 A356	E79-I83 WeakPolarHBondContact O-CG1 3.5Å; E79-I83 PolarHBondContact O-N 3.44Å; Q80-I83 PolarHBondContact O-N 3.39Å; I83-V85 PolarHBondContact O-N 2.84Å; I83-V85 VanDerWaalsContact O-N 3.08Å; I83-L86 PolarHBondContact O-N 2.65Å; I83-T87 HydrophobicContact CG2-CG2 4.07Å; I83-T87 PolarHBondContact O-N 2.82Å; I83-T87 PolarHBondContact O-OG1 3.49Å; I83-F121 HydrophobicContact CD1-CE2 3.86Å; I83-F121 HydrophobicContact CD1-CZ 4.19Å; I83-F121 HydrophobicContact CG1-CE2 3.62Å; I83-F121 HydrophobicContact CG1-CZ 3.84Å; I83-D352 HydrophobicContact CD1-CB 4.16Å; I83-N355 HydrophobicContact CD1-CB 4.01Å; I83-A356 HydrophobicContact CD1-CB 4.18Å; I83-A356 HydrophobicContact CG1-CB 3.99Å
84	D	95.9	Very high	90.6	Very high	61 Å²	61	41.6 Å²	41.6	33%	0.326	25%	0.247	S	C	.	.	H	α-helix	trans	-60.2	-25.4	-174.4	-77.5	-39.8	0	0	0	114	Q80 K88	Q80-D84 VanDerWaalsContact NE2-CG 3.33Å; Q80-D84 PolarHBondContact NE2-OD1 2.88Å; Q80-D84 PolarHBondContact NE2-OD2 3.09Å; Q80-D84 WeakPolarHBondContact O-CB 3.49Å; Q80-D84 PolarHBondContact O-N 3.44Å; D84-K88 WeakPolarHBondContact O-CB 3.26Å; D84-K88 WeakPolarHBondContact O-CD 3.28Å; D84-K88 IonicContact OD1-NZ 2.9Å; D84-K88 PolarHBondContact OD1-NZ 2.81Å
85	V	97.3	Very high	93.2	Very high	7 Å²	7	39 Å²	39	4%	0.042	23%	0.225	C	C	.	.	H	α-helix	trans	-85.2	-61.4	171	177.1	0	0	0	0	110.5	D26 T29 L30 A81 I82 I83 T87 K88 R89 I97	D26-V85 HydrophobicContact CB-CG1 3.86Å; T29-V85 HydrophobicContact CG2-CG2 3.73Å; L30-V85 HydrophobicContact CD1-CG1 4.08Å; L30-V85 HydrophobicContact CD2-CB 4.02Å; L30-V85 HydrophobicContact CD2-CG1 4.18Å; L30-V85 HydrophobicContact CD2-CG2 4.41Å; L30-V85 HydrophobicContact CG-CB 4.39Å; L30-V85 HydrophobicContact CG-CG1 4.08Å; A81-V85 WeakPolarHBondContact O-CG2 3.09Å; A81-V85 PolarHBondContact O-N 3.24Å; I82-V85 PolarHBondContact O-N 3.2Å; I83-V85 PolarHBondContact O-N 2.84Å; I83-V85 VanDerWaalsContact O-N 3.08Å; V85-T87 PolarHBondContact O-N 3.46Å; V85-K88 PolarHBondContact O-N 2.55Å; V85-R89 WeakPolarHBondContact O-CG 3.4Å; V85-R89 PolarHBondContact O-N 2.98Å; V85-I97 HydrophobicContact CG1-CD1 4.17Å
86	L	97.6	Very high	95.1	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-75.6	-28	-162.5	-64	-178.8	0	0	0	114.2	L30 I82 I83 R94 L113 I125 M129	L30-L86 HydrophobicContact CD1-CD2 3.84Å; L30-L86 HydrophobicContact CD1-CG 4.37Å; L30-L86 HydrophobicContact CD2-CD1 4.39Å; L30-L86 HydrophobicContact CD2-CD2 4.49Å; L30-L86 HydrophobicContact CD2-CG 4.14Å; I82-L86 HydrophobicContact CG2-CD1 3.71Å; I82-L86 HydrophobicContact CG2-CG 4.37Å; I82-L86 WeakPolarHBondContact O-CB 3.43Å; I82-L86 PolarHBondContact O-N 2.98Å; I83-L86 PolarHBondContact O-N 2.65Å; L86-R94 HydrophobicContact CD2-CG 4.16Å; L86-R94 PolarHBondContact O-NE 3.26Å; L86-L113 HydrophobicContact CD1-CD1 3.93Å; L86-L113 HydrophobicContact CD1-CD2 4.36Å; L86-I125 HydrophobicContact CD1-CG2 3.55Å; L86-M129 HydrophobicContact CD1-SD 4.15Å; L86-M129 HydrophobicContact CD2-SD 3.87Å
87	T	96.6	Very high	96.3	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.006	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-12	177.3	67.7	0	0	0	0	112.9	I83 V85 L128 A356 S359 L360	I83-T87 HydrophobicContact CG2-CG2 4.07Å; I83-T87 PolarHBondContact O-N 2.82Å; I83-T87 PolarHBondContact O-OG1 3.49Å; V85-T87 PolarHBondContact O-N 3.46Å; T87-L128 HydrophobicContact CG2-CD1 4.14Å; T87-A356 HydrophobicContact CG2-CB 4.26Å; T87-S359 WeakPolarHBondContact OG1-CB 3.33Å; T87-S359 PolarHBondContact OG1-OG 3.05Å; T87-L360 HydrophobicContact CG2-CD2 4.2Å; T87-L360 HydrophobicContact CG2-CG 3.93Å
88	K	95.4	Very high	96.7	Very high	97 Å²	97	35.6 Å²	35.6	42%	0.422	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.1	16.9	-179.8	-60.1	179.7	-177.7	158.2	0	112.6	D84 V85	D84-K88 WeakPolarHBondContact O-CB 3.26Å; D84-K88 WeakPolarHBondContact O-CD 3.28Å; D84-K88 IonicContact OD1-NZ 2.9Å; D84-K88 PolarHBondContact OD1-NZ 2.81Å; V85-K88 PolarHBondContact O-N 2.55Å
89	R	94.4	Very high	96.9	Very high	59 Å²	59	40.6 Å²	40.6	22%	0.223	20%	0.199	C	C	.	.	S	Bend	trans	-126.2	142.8	176.6	-67	-64.7	-178	-75.5	-13.1	110.7	D26 V85 Q93 R94 I97	D26-R89 VanDerWaalsContact CG-NH2 3.3Å; D26-R89 IonicContact OD1-CZ 3.61Å; D26-R89 IonicContact OD1-NE 3.55Å; D26-R89 IonicContact OD1-NH2 3.69Å; D26-R89 PolarHBondContact OD1-NH2 2.95Å; D26-R89 IonicContact OD2-CZ 2.74Å; D26-R89 VanDerWaalsContact OD2-CZ 3.24Å; D26-R89 IonicContact OD2-NE 2.93Å; D26-R89 PolarHBondContact OD2-NE 3.01Å; D26-R89 IonicContact OD2-NH2 2.74Å; D26-R89 PolarHBondContact OD2-NH2 3.06Å; V85-R89 WeakPolarHBondContact O-CG 3.4Å; V85-R89 PolarHBondContact O-N 2.98Å; R89-Q93 HydrophobicContact CB-CB 4.04Å; R89-R94 HydrophobicContact CB-CG 4.13Å; R89-R94 PolarHBondContact O-NE 3.25Å; R89-R94 PolarHBondContact O-NH2 3.42Å; R89-I97 HydrophobicContact CB-CD1 4.31Å; R89-I97 HydrophobicContact CG-CD1 3.94Å
90	S	95.9	Very high	97	Very high	11 Å²	11	38.3 Å²	38.3	8%	0.077	19%	0.19	C	C	.	.			trans	-69.8	161.4	179.4	63.4	0	0	0	0	108	T92 Q93 R94 E323	S90-T92 PolarHBondContact O-N 3Å; S90-Q93 PolarHBondContact O-N 3.32Å; S90-Q93 VanDerWaalsContact O-N 3.08Å; S90-Q93 WeakPolarHBondContact OG-CG 3.42Å; S90-Q93 PolarHBondContact OG-N 3.43Å; S90-Q93 PolarHBondContact OG-OE1 3.02Å; S90-R94 PolarHBondContact O-N 2.82Å; S90-E323 WeakPolarHBondContact CA-OE1 3.33Å
91	N	96.5	Very high	97.1	Very high	15 Å²	15	34.5 Å²	34.5	8%	0.08	17%	0.172	C	C	.	.	H	α-helix	trans	-57.1	-43	177.8	-169.1	-83.8	0	0	0	111	Q93 R94 Q95 L128 Y130 P131 E323	N91-Q93 VanDerWaalsContact C-N 3.35Å; N91-Q93 PolarHBondContact O-N 3.41Å; N91-R94 PolarHBondContact ND2-NH1 3.11Å; N91-R94 WeakPolarHBondContact O-CB 3.3Å; N91-R94 PolarHBondContact O-N 2.98Å; N91-R94 VanDerWaalsContact O-N 3.11Å; N91-Q95 WeakPolarHBondContact O-CG 3.46Å; N91-Q95 PolarHBondContact O-N 3.17Å; N91-Q95 PolarHBondContact OD1-NE2 3.3Å; N91-L128 PolarHBondContact ND2-O 3.47Å; N91-Y130 PolarHBondContact ND2-O 3.1Å; N91-P131 WeakPolarHBondContact OD1-CA 3.43Å; N91-E323 PolarHBondContact N-OE1 3.49Å; N91-E323 PolarHBondContact N-OE2 2.97Å
92	T	95.5	Very high	97.1	Very high	92 Å²	92	39.4 Å²	39.4	56%	0.564	19%	0.19	S	C	*	.	H	α-helix	trans	-57.8	-43.8	175	-54.5	0	0	0	0	112.6	S90 Q95 Q96	S90-T92 PolarHBondContact O-N 3Å; T92-Q95 WeakPolarHBondContact O-CB 3.28Å; T92-Q95 PolarHBondContact O-N 3.21Å; T92-Q96 PolarHBondContact O-N 2.77Å; T92-Q96 VanDerWaalsContact O-N 3.14Å
93	Q	96.5	Very high	97.1	Very high	12 Å²	12	43.6 Å²	43.6	6%	0.056	22%	0.224	C	C	.	.	H	α-helix	trans	-65.3	-40.2	175.7	-73.1	170.4	-27.5	0	0	111.4	F21 R89 S90 N91 Q95 Q96 I97	F21-Q93 HydrophobicContact CD1-CB 4.16Å; F21-Q93 HydrophobicContact CD1-CG 3.79Å; F21-Q93 HydrophobicContact CD2-CG 4.15Å; F21-Q93 HydrophobicContact CE1-CB 3.77Å; F21-Q93 HydrophobicContact CE1-CG 3.92Å; F21-Q93 HydrophobicContact CE2-CG 4.32Å; F21-Q93 HydrophobicContact CG-CG 3.89Å; F21-Q93 HydrophobicContact CZ-CB 3.99Å; F21-Q93 HydrophobicContact CZ-CG 4.2Å; R89-Q93 HydrophobicContact CB-CB 4.04Å; S90-Q93 PolarHBondContact O-N 3.32Å; S90-Q93 VanDerWaalsContact O-N 3.08Å; S90-Q93 WeakPolarHBondContact OG-CG 3.42Å; S90-Q93 PolarHBondContact OG-N 3.43Å; S90-Q93 PolarHBondContact OG-OE1 3.02Å; N91-Q93 VanDerWaalsContact C-N 3.35Å; N91-Q93 PolarHBondContact O-N 3.41Å; Q93-Q95 VanDerWaalsContact C-N 3.28Å; Q93-Q95 PolarHBondContact O-N 2.97Å; Q93-Q96 WeakPolarHBondContact O-CB 3.36Å; Q93-Q96 PolarHBondContact O-N 3.45Å; Q93-Q96 VanDerWaalsContact O-N 3.1Å; Q93-I97 VanDerWaalsContact O-CG1 3.26Å; Q93-I97 WeakPolarHBondContact O-CG1 3.38Å; Q93-I97 PolarHBondContact O-N 3.13Å
94	R	98.3	Very high	97.1	Very high	3 Å²	3	47.5 Å²	47.5	1%	0.011	24%	0.243	C	C	.	.	H	α-helix	trans	-58.6	-39	173.4	-73	177.1	-112.3	136.1	3	111.9	L86 R89 S90 N91 I97 A98 L128 M129 E323	L86-R94 HydrophobicContact CD2-CG 4.16Å; L86-R94 PolarHBondContact O-NE 3.26Å; R89-R94 HydrophobicContact CB-CG 4.13Å; R89-R94 PolarHBondContact O-NE 3.25Å; R89-R94 PolarHBondContact O-NH2 3.42Å; S90-R94 PolarHBondContact O-N 2.82Å; N91-R94 PolarHBondContact ND2-NH1 3.11Å; N91-R94 WeakPolarHBondContact O-CB 3.3Å; N91-R94 PolarHBondContact O-N 2.98Å; N91-R94 VanDerWaalsContact O-N 3.11Å; R94-I97 PolarHBondContact O-N 3.32Å; R94-A98 WeakPolarHBondContact O-CB 3.31Å; R94-A98 PolarHBondContact O-N 3.44Å; R94-L128 WeakPolarHBondContact CD-O 2.96Å; R94-L128 PolarHBondContact NH1-O 3.05Å; R94-M129 HydrophobicContact CB-CE 4.25Å; R94-M129 HydrophobicContact CB-SD 4.3Å; R94-M129 HydrophobicContact CG-SD 4.47Å; R94-E323 IonicContact CZ-OE1 3.2Å; R94-E323 IonicContact NH2-OE1 3.44Å; R94-E323 PolarHBondContact NH2-OE1 3.48Å
95	Q	98.2	Very high	97	Very high	63 Å²	63	47 Å²	47	29%	0.294	24%	0.238	S	C	.	.	H	α-helix	trans	-64	-40.2	174.1	-57.5	-45.1	-51.5	0	0	112.2	N91 T92 Q93 A98 K99 M129	N91-Q95 WeakPolarHBondContact O-CG 3.46Å; N91-Q95 PolarHBondContact O-N 3.17Å; N91-Q95 PolarHBondContact OD1-NE2 3.3Å; T92-Q95 WeakPolarHBondContact O-CB 3.28Å; T92-Q95 PolarHBondContact O-N 3.21Å; Q93-Q95 VanDerWaalsContact C-N 3.28Å; Q93-Q95 PolarHBondContact O-N 2.97Å; Q95-A98 PolarHBondContact O-N 3.3Å; Q95-K99 PolarHBondContact O-N 2.89Å; Q95-K99 VanDerWaalsContact O-N 3.08Å; Q95-M129 PolarHBondContact NE2-O 2.93Å
96	Q	97.7	Very high	97	Very high	85 Å²	85	50 Å²	50	40%	0.397	27%	0.27	S	S	.	.	H	α-helix	trans	-65.9	-41.6	175.6	-68.1	171.9	-33.6	0	0	111.7	F21 P23 T92 Q93 K99 S100	F21-Q96 HydrophobicContact CD1-CB 4.48Å; F21-Q96 HydrophobicContact CE1-CB 4.31Å; P23-Q96 HydrophobicContact CB-CB 4.03Å; P23-Q96 HydrophobicContact CG-CB 4.29Å; T92-Q96 PolarHBondContact O-N 2.77Å; T92-Q96 VanDerWaalsContact O-N 3.14Å; Q93-Q96 WeakPolarHBondContact O-CB 3.36Å; Q93-Q96 PolarHBondContact O-N 3.45Å; Q93-Q96 VanDerWaalsContact O-N 3.1Å; Q96-K99 PolarHBondContact O-N 3.38Å; Q96-S100 PolarHBondContact O-N 2.83Å
97	I	98.2	Very high	96.8	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-60.5	-47.9	174.3	-65.5	164.1	0	0	0	110.4	F21 P23 D26 A27 L30 V85 R89 Q93 R94 K99 S100 F101 L109	F21-I97 HydrophobicContact CE1-CD1 4.44Å; F21-I97 HydrophobicContact CE1-CG1 4.03Å; F21-I97 HydrophobicContact CZ-CD1 3.94Å; F21-I97 HydrophobicContact CZ-CG1 3.89Å; P23-I97 HydrophobicContact CB-CG1 4.1Å; D26-I97 HydrophobicContact CB-CD1 3.75Å; D26-I97 HydrophobicContact CB-CG1 3.88Å; D26-I97 HydrophobicContact CB-CG2 4.39Å; A27-I97 HydrophobicContact CB-CG2 4.27Å; L30-I97 HydrophobicContact CD1-CG2 3.68Å; V85-I97 HydrophobicContact CG1-CD1 4.17Å; R89-I97 HydrophobicContact CB-CD1 4.31Å; R89-I97 HydrophobicContact CG-CD1 3.94Å; Q93-I97 VanDerWaalsContact O-CG1 3.26Å; Q93-I97 WeakPolarHBondContact O-CG1 3.38Å; Q93-I97 PolarHBondContact O-N 3.13Å; R94-I97 PolarHBondContact O-N 3.32Å; I97-K99 VanDerWaalsContact C-N 3.32Å; I97-K99 PolarHBondContact O-N 2.75Å; I97-S100 PolarHBondContact O-N 3.46Å; I97-F101 WeakPolarHBondContact O-CB 3.39Å; I97-F101 PolarHBondContact O-N 3.21Å; I97-L109 HydrophobicContact CG2-CD2 4.05Å
98	A	97.8	Very high	96.9	Very high	15 Å²	15	58.8 Å²	58.8	12%	0.124	31%	0.311	C	S	.	.	H	α-helix	trans	-59.2	-42.5	178.9	0	0	0	0	0	112.3	R94 Q95 F101 K102 L109 M129	R94-A98 WeakPolarHBondContact O-CB 3.31Å; R94-A98 PolarHBondContact O-N 3.44Å; Q95-A98 PolarHBondContact O-N 3.3Å; A98-F101 PolarHBondContact O-N 3.06Å; A98-K102 PolarHBondContact O-N 3.41Å; A98-L109 HydrophobicContact CB-CB 4.16Å; A98-L109 HydrophobicContact CB-CD2 4.06Å; A98-M129 HydrophobicContact CB-CE 3.98Å
99	K	98	Very high	96.9	Very high	169 Å²	169	54.1 Å²	54.1	74%	0.735	29%	0.29	S	S	*	.	H	α-helix	trans	-63.4	-45.2	175.6	-173.7	178.5	179.2	-179.9	0	112	Q95 Q96 I97 K102 A103	Q95-K99 PolarHBondContact O-N 2.89Å; Q95-K99 VanDerWaalsContact O-N 3.08Å; Q96-K99 PolarHBondContact O-N 3.38Å; I97-K99 VanDerWaalsContact C-N 3.32Å; I97-K99 PolarHBondContact O-N 2.75Å; K99-K102 PolarHBondContact O-N 3.46Å; K99-A103 PolarHBondContact O-N 3Å; K99-A103 VanDerWaalsContact O-N 3.09Å
100	S	98.1	Very high	97	Very high	11 Å²	11	52.4 Å²	52.4	8%	0.077	29%	0.287	C	S	.	.	H	α-helix	trans	-63.8	-44.9	177.3	177	0	0	0	0	111.8	D24 Q96 I97 K102 A103 Q104	D24-S100 WeakPolarHBondContact OD1-CB 3.46Å; D24-S100 PolarHBondContact OD1-OG 3.32Å; Q96-S100 PolarHBondContact O-N 2.83Å; I97-S100 PolarHBondContact O-N 3.46Å; S100-K102 VanDerWaalsContact C-N 3.33Å; S100-K102 PolarHBondContact O-N 2.89Å; S100-A103 PolarHBondContact O-N 3.45Å; S100-A103 VanDerWaalsContact O-N 3.13Å; S100-Q104 WeakPolarHBondContact O-CG 3.39Å; S100-Q104 PolarHBondContact O-N 3.4Å; S100-Q104 PolarHBondContact OG-NE2 3.26Å
101	F	98.1	Very high	97	Very high	2 Å²	2	56.9 Å²	56.9	1%	0.009	31%	0.306	C	S	.	.	H	α-helix	trans	-56	-46.1	176.4	-173.4	-84.2	0	0	0	111.9	A27 L30 Y31 M34 I97 A98 A103 Q104 F105 K107 L109 T112	A27-F101 HydrophobicContact CB-CB 4.02Å; A27-F101 HydrophobicContact CB-CD2 4.44Å; A27-F101 WeakPolarHBondContact O-CD2 3.38Å; L30-F101 HydrophobicContact CB-CD2 4.46Å; L30-F101 HydrophobicContact CB-CE2 4.37Å; Y31-F101 HydrophobicContact CD2-CE2 4.29Å; Y31-F101 HydrophobicContact CD2-CZ 4.24Å; M34-F101 HydrophobicContact CE-CE2 3.68Å; M34-F101 HydrophobicContact CE-CZ 3.66Å; I97-F101 WeakPolarHBondContact O-CB 3.39Å; I97-F101 PolarHBondContact O-N 3.21Å; A98-F101 PolarHBondContact O-N 3.06Å; F101-A103 PolarHBondContact O-N 3.41Å; F101-Q104 PolarHBondContact O-N 3.44Å; F101-F105 HydrophobicContact CB-CD2 4.44Å; F101-F105 HydrophobicContact CD1-CD2 4.27Å; F101-F105 AromaticContact CD2-CD2 3.62Å; F101-F105 HydrophobicContact CD2-CD2 3.62Å; F101-F105 AromaticContact CD2-CE2 3.91Å; F101-F105 HydrophobicContact CD2-CE2 3.91Å; F101-F105 HydrophobicContact CE1-CD2 4.46Å; F101-F105 AromaticContact CE2-CD2 3.85Å; F101-F105 HydrophobicContact CE2-CD2 3.85Å; F101-F105 HydrophobicContact CE2-CE2 4.28Å; F101-F105 AromaticContact CG-CD2 3.85Å; F101-F105 HydrophobicContact CG-CD2 3.85Å; F101-F105 HydrophobicContact CG-CE2 4.43Å; F101-F105 HydrophobicContact CZ-CD2 4.26Å; F101-F105 WeakPolarHBondContact O-CB 3.16Å; F101-F105 VanDerWaalsContact O-CD2 3.28Å; F101-F105 WeakPolarHBondContact O-CD2 3.36Å; F101-F105 PolarHBondContact O-N 3.37Å; F101-K107 WeakPolarHBondContact CD1-O 3.38Å; F101-K107 HydrophobicContact CE1-CB 4.15Å; F101-L109 HydrophobicContact CB-CB 4.24Å; F101-L109 HydrophobicContact CB-CD2 4.46Å; F101-L109 HydrophobicContact CD1-CB 3.81Å; F101-L109 HydrophobicContact CD1-CD1 4.17Å; F101-L109 HydrophobicContact CD2-CD1 3.9Å; F101-L109 HydrophobicContact CE1-CB 4.36Å; F101-L109 HydrophobicContact CE1-CD1 4.22Å; F101-L109 HydrophobicContact CE2-CD1 3.93Å; F101-L109 HydrophobicContact CG-CB 4.04Å; F101-L109 HydrophobicContact CG-CD1 4.02Å; F101-L109 HydrophobicContact CG-CG 4.44Å; F101-L109 HydrophobicContact CZ-CD1 4.1Å; F101-T112 HydrophobicContact CZ-CG2 4.43Å
102	K	97.3	Very high	97	Very high	122 Å²	122	56.8 Å²	56.8	53%	0.53	31%	0.306	S	S	.	.	H	α-helix	trans	-64.4	-39.9	177	-171.6	171.9	-175.7	169.5	0	112.7	A98 K99 S100 G106 K107	A98-K102 PolarHBondContact O-N 3.41Å; K99-K102 PolarHBondContact O-N 3.46Å; S100-K102 VanDerWaalsContact C-N 3.33Å; S100-K102 PolarHBondContact O-N 2.89Å; K102-G106 VanDerWaalsContact O-CA 3.26Å; K102-G106 WeakPolarHBondContact O-CA 3.46Å; K102-G106 PolarHBondContact O-N 2.87Å; K102-K107 VanDerWaalsContact CA-O 3.27Å; K102-K107 WeakPolarHBondContact CA-O 3.44Å
103	A	97.8	Very high	97.1	Very high	87 Å²	87	52.4 Å²	52.4	72%	0.719	28%	0.279	S	S	*	.	H	α-helix	trans	-67.3	-40	178.2	0	0	0	0	0	112.6	K99 S100 F101	K99-A103 PolarHBondContact O-N 3Å; K99-A103 VanDerWaalsContact O-N 3.09Å; S100-A103 PolarHBondContact O-N 3.45Å; S100-A103 VanDerWaalsContact O-N 3.13Å; F101-A103 PolarHBondContact O-N 3.41Å
104	Q	97.1	Very high	97	Very high	86 Å²	86	55 Å²	55	40%	0.402	29%	0.29	S	S	.	.	H	α-helix	trans	-80.2	-38.3	-177.5	-68	-173.4	62.6	0	0	113.2	S100 F101	S100-Q104 WeakPolarHBondContact O-CG 3.39Å; S100-Q104 PolarHBondContact O-N 3.4Å; S100-Q104 PolarHBondContact OG-NE2 3.26Å; F101-Q104 PolarHBondContact O-N 3.44Å
105	F	95.8	Very high	96.8	Very high	51 Å²	51	59 Å²	59	22%	0.224	32%	0.319	C	S	.	.	H	α-helix	trans	-116.9	-3.3	-168.7	-49.4	-60.6	0	0	0	114.1	A27 E28 Y31 F101 K107	A27-F105 HydrophobicContact CB-CE2 4.41Å; E28-F105 HydrophobicContact CB-CZ 4.46Å; Y31-F105 VanDerWaalsContact CB-CE2 3.5Å; Y31-F105 AromaticContact CD1-CD1 3.96Å; Y31-F105 HydrophobicContact CD1-CD1 3.96Å; Y31-F105 AromaticContact CD1-CE1 3.68Å; Y31-F105 HydrophobicContact CD1-CE1 3.68Å; Y31-F105 HydrophobicContact CD1-CZ 4.06Å; Y31-F105 HydrophobicContact CD2-CB 3.94Å; Y31-F105 AromaticContact CD2-CD1 3.63Å; Y31-F105 HydrophobicContact CD2-CD1 3.63Å; Y31-F105 AromaticContact CD2-CD2 3.82Å; Y31-F105 HydrophobicContact CD2-CD2 3.82Å; Y31-F105 HydrophobicContact CD2-CE1 4.1Å; Y31-F105 HydrophobicContact CD2-CE2 4.28Å; Y31-F105 AromaticContact CD2-CG 3.49Å; Y31-F105 HydrophobicContact CD2-CG 3.49Å; Y31-F105 VanDerWaalsContact CD2-CG 3.49Å; Y31-F105 HydrophobicContact CD2-CZ 4.41Å; Y31-F105 HydrophobicContact CE1-CD1 4.07Å; Y31-F105 HydrophobicContact CE1-CE1 4.07Å; Y31-F105 HydrophobicContact CE2-CB 4Å; Y31-F105 AromaticContact CE2-CD1 3.76Å; Y31-F105 HydrophobicContact CE2-CD1 3.76Å; Y31-F105 HydrophobicContact CE2-CE1 4.46Å; Y31-F105 AromaticContact CE2-CG 3.86Å; Y31-F105 HydrophobicContact CE2-CG 3.86Å; Y31-F105 AromaticContact CG-CD1 3.73Å; Y31-F105 HydrophobicContact CG-CD1 3.73Å; Y31-F105 AromaticContact CG-CD2 3.95Å; Y31-F105 HydrophobicContact CG-CD2 3.95Å; Y31-F105 AromaticContact CG-CE1 3.69Å; Y31-F105 HydrophobicContact CG-CE1 3.69Å; Y31-F105 AromaticContact CG-CE2 3.92Å; Y31-F105 HydrophobicContact CG-CE2 3.92Å; Y31-F105 AromaticContact CG-CG 3.87Å; Y31-F105 HydrophobicContact CG-CG 3.87Å; Y31-F105 AromaticContact CG-CZ 3.8Å; Y31-F105 HydrophobicContact CG-CZ 3.8Å; Y31-F105 AromaticContact CZ-CD1 3.97Å; F101-F105 HydrophobicContact CB-CD2 4.44Å; F101-F105 HydrophobicContact CD1-CD2 4.27Å; F101-F105 AromaticContact CD2-CD2 3.62Å; F101-F105 HydrophobicContact CD2-CD2 3.62Å; F101-F105 AromaticContact CD2-CE2 3.91Å; F101-F105 HydrophobicContact CD2-CE2 3.91Å; F101-F105 HydrophobicContact CE1-CD2 4.46Å; F101-F105 AromaticContact CE2-CD2 3.85Å; F101-F105 HydrophobicContact CE2-CD2 3.85Å; F101-F105 HydrophobicContact CE2-CE2 4.28Å; F101-F105 AromaticContact CG-CD2 3.85Å; F101-F105 HydrophobicContact CG-CD2 3.85Å; F101-F105 HydrophobicContact CG-CE2 4.43Å; F101-F105 HydrophobicContact CZ-CD2 4.26Å; F101-F105 WeakPolarHBondContact O-CB 3.16Å; F101-F105 VanDerWaalsContact O-CD2 3.28Å; F101-F105 WeakPolarHBondContact O-CD2 3.36Å; F101-F105 PolarHBondContact O-N 3.37Å; F105-K107 PolarHBondContact O-N 3.23Å
106	G	95.6	Very high	96.5	Very high	69 Å²	69	59.8 Å²	59.8	71%	0.711	32%	0.323	S	S	*	.	S	Bend	trans	69	10.5	176.4	0	0	0	0	0	115.2	K102	K102-G106 VanDerWaalsContact O-CA 3.26Å; K102-G106 WeakPolarHBondContact O-CA 3.46Å; K102-G106 PolarHBondContact O-N 2.87Å
107	K	94.4	Very high	96.4	Very high	123 Å²	123	56.3 Å²	56.3	54%	0.535	31%	0.307	S	S	.	.	S	Bend	trans	-119.5	147.4	-179.3	-66.5	-173.5	177.2	-171.4	0	111.2	F101 K102 F105	F101-K107 WeakPolarHBondContact CD1-O 3.38Å; F101-K107 HydrophobicContact CE1-CB 4.15Å; K102-K107 VanDerWaalsContact CA-O 3.27Å; K102-K107 WeakPolarHBondContact CA-O 3.44Å; F105-K107 PolarHBondContact O-N 3.23Å
108	D	97.3	Very high	96.3	Very high	62 Å²	62	60.7 Å²	60.7	33%	0.332	34%	0.338	S	S	.	.			trans	-73.1	129.8	171	-174.5	-90.2	0	0	0	110.5	T110 E111 T112	D108-T110 WeakPolarHBondContact OD1-CA 3.32Å; D108-T110 WeakPolarHBondContact OD1-CB 3.42Å; D108-T110 PolarHBondContact OD1-N 3.49Å; D108-E111 HydrophobicContact CB-CB 4.15Å; D108-E111 HydrophobicContact CB-CG 4.16Å; D108-E111 PolarHBondContact OD1-N 3.35Å; D108-T112 WeakPolarHBondContact O-CB 3.49Å; D108-T112 PolarHBondContact O-N 3Å; D108-T112 PolarHBondContact O-OG1 2.95Å
109	L	97.4	Very high	96.3	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-65.6	-42.6	-176	176.7	57.3	0	0	0	111.8	L30 M34 I97 A98 F101 T112 L113 M129	L30-L109 HydrophobicContact CD1-CD1 4.17Å; L30-L109 HydrophobicContact CD1-CD2 3.91Å; M34-L109 HydrophobicContact CE-CD1 3.8Å; I97-L109 HydrophobicContact CG2-CD2 4.05Å; A98-L109 HydrophobicContact CB-CB 4.16Å; A98-L109 HydrophobicContact CB-CD2 4.06Å; F101-L109 HydrophobicContact CB-CB 4.24Å; F101-L109 HydrophobicContact CB-CD2 4.46Å; F101-L109 HydrophobicContact CD1-CB 3.81Å; F101-L109 HydrophobicContact CD1-CD1 4.17Å; F101-L109 HydrophobicContact CD2-CD1 3.9Å; F101-L109 HydrophobicContact CE1-CB 4.36Å; F101-L109 HydrophobicContact CE1-CD1 4.22Å; F101-L109 HydrophobicContact CE2-CD1 3.93Å; F101-L109 HydrophobicContact CG-CB 4.04Å; F101-L109 HydrophobicContact CG-CD1 4.02Å; F101-L109 HydrophobicContact CG-CG 4.44Å; F101-L109 HydrophobicContact CZ-CD1 4.1Å; L109-T112 PolarHBondContact O-N 3.27Å; L109-L113 HydrophobicContact CD1-CD1 3.94Å; L109-L113 HydrophobicContact CD1-CG 4.07Å; L109-L113 HydrophobicContact CG-CD1 3.9Å; L109-L113 HydrophobicContact CG-CG 4.48Å; L109-L113 VanDerWaalsContact O-CG 3.28Å; L109-L113 WeakPolarHBondContact O-CG 3.46Å; L109-L113 PolarHBondContact O-N 2.84Å; L109-M129 HydrophobicContact CD2-CE 3.64Å; L109-M129 HydrophobicContact CG-CE 4.17Å
110	T	96.1	Very high	96.3	Very high	23 Å²	23	58.2 Å²	58.2	14%	0.141	34%	0.336	C	S	.	.	H	α-helix	trans	-67.7	-42.8	-177.5	-55.7	0	0	0	0	110.8	D108 T112 L113 K114 V126 M129	D108-T110 WeakPolarHBondContact OD1-CA 3.32Å; D108-T110 WeakPolarHBondContact OD1-CB 3.42Å; D108-T110 PolarHBondContact OD1-N 3.49Å; T110-T112 VanDerWaalsContact C-N 3.34Å; T110-L113 PolarHBondContact O-N 3.31Å; T110-K114 WeakPolarHBondContact O-CG 3.28Å; T110-K114 PolarHBondContact O-N 3.11Å; T110-V126 HydrophobicContact CG2-CG1 4.25Å; T110-M129 HydrophobicContact CG2-CB 4.23Å; T110-M129 WeakPolarHBondContact OG1-CB 3.3Å
111	E	96.1	Very high	96.3	Very high	104 Å²	104	58.5 Å²	58.5	49%	0.486	34%	0.336	S	S	.	.	H	α-helix	trans	-66.3	-36.4	175.5	-63.7	-53.9	122.2	0	0	112.3	D108 K114 S115	D108-E111 HydrophobicContact CB-CB 4.15Å; D108-E111 HydrophobicContact CB-CG 4.16Å; D108-E111 PolarHBondContact OD1-N 3.35Å; E111-K114 PolarHBondContact O-N 2.99Å; E111-K114 IonicContact OE1-NZ 2.74Å; E111-K114 PolarHBondContact OE1-NZ 3.22Å; E111-K114 IonicContact OE2-NZ 2.66Å; E111-S115 PolarHBondContact O-N 3.01Å; E111-S115 VanDerWaalsContact O-N 3.14Å; E111-S115 PolarHBondContact O-OG 3.14Å
112	T	96.1	Very high	96.3	Very high	14 Å²	14	60.9 Å²	60.9	9%	0.086	35%	0.347	C	S	.	.	H	α-helix	trans	-64.8	-43	174.1	-52.5	0	0	0	0	111	M34 F101 D108 L109 T110 K114 S115 E116	M34-T112 HydrophobicContact CE-CG2 3.93Å; M34-T112 HydrophobicContact SD-CG2 3.71Å; F101-T112 HydrophobicContact CZ-CG2 4.43Å; D108-T112 WeakPolarHBondContact O-CB 3.49Å; D108-T112 PolarHBondContact O-N 3Å; D108-T112 PolarHBondContact O-OG1 2.95Å; L109-T112 PolarHBondContact O-N 3.27Å; T110-T112 VanDerWaalsContact C-N 3.34Å; T112-K114 VanDerWaalsContact C-N 3.33Å; T112-K114 PolarHBondContact O-N 2.97Å; T112-S115 PolarHBondContact O-N 3.22Å; T112-S115 PolarHBondContact O-OG 2.66Å; T112-E116 HydrophobicContact CG2-CG 4.14Å; T112-E116 WeakPolarHBondContact O-CB 3.31Å; T112-E116 VanDerWaalsContact O-CG 3.24Å; T112-E116 WeakPolarHBondContact O-CG 3.33Å; T112-E116 PolarHBondContact O-N 2.6Å
113	L	96.2	Very high	96.3	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-62.9	-38.5	176.8	-72.5	163.6	0	0	0	112.1	M34 I82 L86 L109 T110 S115 E116 L117 I125 M129	M34-L113 HydrophobicContact CE-CD2 4.49Å; M34-L113 HydrophobicContact SD-CD2 3.72Å; M34-L113 HydrophobicContact SD-CG 4.18Å; I82-L113 HydrophobicContact CD1-CD2 4.3Å; I82-L113 HydrophobicContact CG2-CD2 4.12Å; L86-L113 HydrophobicContact CD1-CD1 3.93Å; L86-L113 HydrophobicContact CD1-CD2 4.36Å; L109-L113 HydrophobicContact CD1-CD1 3.94Å; L109-L113 HydrophobicContact CD1-CG 4.07Å; L109-L113 HydrophobicContact CG-CD1 3.9Å; L109-L113 HydrophobicContact CG-CG 4.48Å; L109-L113 VanDerWaalsContact O-CG 3.28Å; L109-L113 WeakPolarHBondContact O-CG 3.46Å; L109-L113 PolarHBondContact O-N 2.84Å; T110-L113 PolarHBondContact O-N 3.31Å; L113-S115 VanDerWaalsContact C-N 3.31Å; L113-S115 PolarHBondContact O-N 3.42Å; L113-E116 PolarHBondContact O-N 3.09Å; L113-L117 HydrophobicContact CD2-CD1 4Å; L113-L117 VanDerWaalsContact O-CB 3.26Å; L113-L117 WeakPolarHBondContact O-CB 3.4Å; L113-L117 WeakPolarHBondContact O-CG 3.21Å; L113-L117 PolarHBondContact O-N 3.29Å; L113-I125 HydrophobicContact CD1-CG2 3.97Å; L113-I125 HydrophobicContact CD2-CG2 3.98Å; L113-I125 HydrophobicContact CG-CG2 4.41Å; L113-M129 HydrophobicContact CD1-CG 3.86Å; L113-M129 HydrophobicContact CD1-SD 4.23Å
114	K	94.9	Very high	96.4	Very high	65 Å²	65	56.7 Å²	56.7	28%	0.283	31%	0.31	S	S	.	.	H	α-helix	trans	-63.7	-33.9	174.7	-73.2	173.2	-175.8	167.5	0	113	T110 E111 T112 V126	T110-K114 WeakPolarHBondContact O-CG 3.28Å; T110-K114 PolarHBondContact O-N 3.11Å; E111-K114 PolarHBondContact O-N 2.99Å; E111-K114 IonicContact OE1-NZ 2.74Å; E111-K114 PolarHBondContact OE1-NZ 3.22Å; E111-K114 IonicContact OE2-NZ 2.66Å; T112-K114 VanDerWaalsContact C-N 3.33Å; T112-K114 PolarHBondContact O-N 2.97Å; K114-V126 HydrophobicContact CG-CG1 4.41Å; K114-V126 HydrophobicContact CG-CG2 3.63Å
115	S	93.8	Very high	96.4	Very high	87 Å²	87	52.6 Å²	52.6	61%	0.608	29%	0.29	S	S	*	.	H	α-helix	trans	-80.6	-30.1	179.3	60.7	0	0	0	0	113.6	E111 T112 L113	E111-S115 PolarHBondContact O-N 3.01Å; E111-S115 VanDerWaalsContact O-N 3.14Å; E111-S115 PolarHBondContact O-OG 3.14Å; T112-S115 PolarHBondContact O-N 3.22Å; T112-S115 PolarHBondContact O-OG 2.66Å; L113-S115 VanDerWaalsContact C-N 3.31Å; L113-S115 PolarHBondContact O-N 3.42Å
116	E	93.8	Very high	96.6	Very high	81 Å²	81	50.7 Å²	50.7	38%	0.379	28%	0.283	S	S	.	.	H	α-helix	trans	-93.8	-22.1	-174.2	-63.6	-64	153.6	0	0	113.5	M34 T112 L113	M34-E116 HydrophobicContact CB-CG 4.1Å; M34-E116 HydrophobicContact CG-CB 4.3Å; M34-E116 HydrophobicContact CG-CG 4.21Å; M34-E116 HydrophobicContact SD-CB 4.36Å; M34-E116 HydrophobicContact SD-CG 4.2Å; T112-E116 HydrophobicContact CG2-CG 4.14Å; T112-E116 WeakPolarHBondContact O-CB 3.31Å; T112-E116 VanDerWaalsContact O-CG 3.24Å; T112-E116 WeakPolarHBondContact O-CG 3.33Å; T112-E116 PolarHBondContact O-N 2.6Å; L113-E116 PolarHBondContact O-N 3.09Å
117	L	95.3	Very high	96.7	Very high	11 Å²	11	47.7 Å²	47.7	6%	0.058	25%	0.251	C	S	.	.			trans	-107.6	161.4	-180	-54.5	-177.2	0	0	0	110.7	T77 I82 L113 F121 E122 I125	T77-L117 HydrophobicContact CG2-CD2 3.95Å; I82-L117 HydrophobicContact CD1-CD2 3.94Å; L113-L117 HydrophobicContact CD2-CD1 4Å; L113-L117 VanDerWaalsContact O-CB 3.26Å; L113-L117 WeakPolarHBondContact O-CB 3.4Å; L113-L117 WeakPolarHBondContact O-CG 3.21Å; L113-L117 PolarHBondContact O-N 3.29Å; L117-F121 HydrophobicContact CD1-CD1 4.1Å; L117-F121 HydrophobicContact CD1-CE1 3.82Å; L117-F121 HydrophobicContact CD1-CZ 4.5Å; L117-F121 HydrophobicContact CD2-CD1 3.95Å; L117-F121 HydrophobicContact CD2-CE1 3.6Å; L117-F121 HydrophobicContact CG-CD1 4.42Å; L117-F121 HydrophobicContact CG-CE1 4.28Å; L117-E122 HydrophobicContact CB-CB 3.7Å; L117-E122 HydrophobicContact CB-CG 3.97Å; L117-I125 HydrophobicContact CD1-CB 3.89Å; L117-I125 HydrophobicContact CD1-CG1 4.05Å; L117-I125 HydrophobicContact CD1-CG2 3.83Å
118	S	94.8	Very high	96.9	Very high	93 Å²	93	41.8 Å²	41.8	65%	0.65	23%	0.226	S	C	*	.			trans	-139.2	162.7	172.6	64.3	0	0	0	0	113.3	E122	S118-E122 VanDerWaalsContact C-CB 3.48Å; S118-E122 WeakPolarHBondContact CA-OE2 3.45Å; S118-E122 PolarHBondContact O-N 3.45Å
119	G	97.6	Very high	96.9	Very high	44 Å²	44	39.1 Å²	39.1	45%	0.454	21%	0.211	S	C	.	.	H	α-helix	trans	68	-143.3	167.2	0	0	0	0	0	114.1	F121 R123	G119-F121 VanDerWaalsContact C-N 3.31Å; G119-F121 PolarHBondContact O-N 2.93Å; G119-R123 WeakPolarHBondContact O-CG 3.33Å; G119-R123 PolarHBondContact O-N 3.29Å; G119-R123 VanDerWaalsContact O-N 3.17Å
120	K	98.1	Very high	96.9	Very high	87 Å²	87	41.3 Å²	41.3	38%	0.378	22%	0.22	S	C	.	.	H	α-helix	trans	-68	-32.9	-175.5	-59.1	179.6	-180	-159.4	0	112.5	R123 L124 D311 Y353	K120-R123 PolarHBondContact O-N 2.97Å; K120-L124 PolarHBondContact O-N 2.87Å; K120-L124 VanDerWaalsContact O-N 3.11Å; K120-D311 HydrophobicContact CD-CB 4.48Å; K120-D311 WeakPolarHBondContact CD-OD1 3.44Å; K120-D311 VanDerWaalsContact CE-CG 3.41Å; K120-D311 WeakPolarHBondContact CE-OD1 3.45Å; K120-D311 WeakPolarHBondContact CE-OD2 3.23Å; K120-D311 IonicContact NZ-OD1 2.65Å; K120-D311 PolarHBondContact NZ-OD1 3.31Å; K120-D311 IonicContact NZ-OD2 3.6Å; K120-D311 PolarHBondContact NZ-OD2 3.25Å; K120-Y353 HydrophobicContact CB-CD1 3.81Å; K120-Y353 HydrophobicContact CB-CD2 3.86Å; K120-Y353 HydrophobicContact CB-CE1 4.13Å; K120-Y353 HydrophobicContact CB-CE2 4.2Å; K120-Y353 HydrophobicContact CB-CG 3.65Å; K120-Y353 HydrophobicContact CD-CD1 3.84Å; K120-Y353 HydrophobicContact CD-CE1 3.88Å; K120-Y353 HydrophobicContact CG-CD1 4.5Å; K120-Y353 WeakPolarHBondContact O-CD2 3.39Å
121	F	98.3	Very high	97	Very high	18 Å²	18	42.2 Å²	42.2	8%	0.079	23%	0.226	C	C	.	.	H	α-helix	trans	-66.1	-48.4	177.9	-180	-122.5	0	0	0	111.1	E79 I82 I83 L117 G119 R123 L124 I125 D352 A356	E79-F121 HydrophobicContact CB-CE1 3.7Å; E79-F121 HydrophobicContact CB-CZ 3.91Å; E79-F121 HydrophobicContact CG-CD1 4.12Å; E79-F121 HydrophobicContact CG-CE1 3.54Å; E79-F121 HydrophobicContact CG-CZ 4.28Å; I82-F121 HydrophobicContact CG2-CZ 4.44Å; I83-F121 HydrophobicContact CD1-CE2 3.86Å; I83-F121 HydrophobicContact CD1-CZ 4.19Å; I83-F121 HydrophobicContact CG1-CE2 3.62Å; I83-F121 HydrophobicContact CG1-CZ 3.84Å; L117-F121 HydrophobicContact CD1-CD1 4.1Å; L117-F121 HydrophobicContact CD1-CE1 3.82Å; L117-F121 HydrophobicContact CD1-CZ 4.5Å; L117-F121 HydrophobicContact CD2-CD1 3.95Å; L117-F121 HydrophobicContact CD2-CE1 3.6Å; L117-F121 HydrophobicContact CG-CD1 4.42Å; L117-F121 HydrophobicContact CG-CE1 4.28Å; G119-F121 VanDerWaalsContact C-N 3.31Å; G119-F121 PolarHBondContact O-N 2.93Å; F121-R123 PolarHBondContact O-N 3.4Å; F121-L124 PolarHBondContact O-N 3.35Å; F121-I125 HydrophobicContact CD2-CG1 3.97Å; F121-I125 HydrophobicContact CE1-CG1 4.32Å; F121-I125 HydrophobicContact CE2-CD1 3.81Å; F121-I125 HydrophobicContact CE2-CG1 3.54Å; F121-I125 HydrophobicContact CZ-CD1 4.15Å; F121-I125 HydrophobicContact CZ-CG1 3.74Å; F121-I125 WeakPolarHBondContact O-CG1 3.41Å; F121-I125 PolarHBondContact O-N 3.34Å; F121-D352 HydrophobicContact CD1-CB 4.22Å; F121-D352 HydrophobicContact CD2-CB 3.84Å; F121-D352 HydrophobicContact CE1-CB 4.36Å; F121-D352 HydrophobicContact CE2-CB 4Å; F121-D352 HydrophobicContact CG-CB 3.96Å; F121-D352 HydrophobicContact CZ-CB 4.26Å; F121-A356 HydrophobicContact CD2-CB 4.24Å; F121-A356 HydrophobicContact CE2-CB 3.99Å
122	E	98.3	Very high	96.8	Very high	52 Å²	52	40.7 Å²	40.7	24%	0.243	23%	0.226	C	C	.	.	H	α-helix	trans	-53.4	-51.6	172.5	-176.6	-153.2	155.2	0	0	111.4	L117 S118 L124 I125 V126	L117-E122 HydrophobicContact CB-CB 3.7Å; L117-E122 HydrophobicContact CB-CG 3.97Å; S118-E122 VanDerWaalsContact C-CB 3.48Å; S118-E122 WeakPolarHBondContact CA-OE2 3.45Å; S118-E122 PolarHBondContact O-N 3.45Å; E122-L124 VanDerWaalsContact C-N 3.28Å; E122-L124 PolarHBondContact O-N 2.85Å; E122-I125 PolarHBondContact O-N 3.42Å; E122-V126 HydrophobicContact CG-CG2 4.14Å; E122-V126 VanDerWaalsContact O-CB 3.31Å; E122-V126 WeakPolarHBondContact O-CB 3.4Å; E122-V126 VanDerWaalsContact O-CG2 3.28Å; E122-V126 WeakPolarHBondContact O-CG2 3.48Å; E122-V126 PolarHBondContact O-N 2.86Å
123	R	98.4	Very high	96.8	Very high	120 Å²	120	44.3 Å²	44.3	45%	0.453	24%	0.238	S	C	.	.	H	α-helix	trans	-56.6	-41.6	-178.9	-72.6	178.1	64.1	-163.3	-1.1	112.6	G119 K120 F121 A127 I315	G119-R123 WeakPolarHBondContact O-CG 3.33Å; G119-R123 PolarHBondContact O-N 3.29Å; G119-R123 VanDerWaalsContact O-N 3.17Å; K120-R123 PolarHBondContact O-N 2.97Å; F121-R123 PolarHBondContact O-N 3.4Å; R123-A127 WeakPolarHBondContact O-CB 3.42Å; R123-A127 PolarHBondContact O-N 3.34Å; R123-I315 HydrophobicContact CB-CD1 4.02Å
124	L	98.6	Very high	96.9	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-68.3	-48.2	177.7	174.9	60.6	0	0	0	111.9	K120 F121 E122 A127 L128 I315 V319 Y353 A356 L357 L360	K120-L124 PolarHBondContact O-N 2.87Å; K120-L124 VanDerWaalsContact O-N 3.11Å; F121-L124 PolarHBondContact O-N 3.35Å; E122-L124 VanDerWaalsContact C-N 3.28Å; E122-L124 PolarHBondContact O-N 2.85Å; L124-A127 WeakPolarHBondContact O-CB 3.44Å; L124-A127 PolarHBondContact O-N 3.1Å; L124-L128 WeakPolarHBondContact O-CG 3.33Å; L124-L128 PolarHBondContact O-N 3.37Å; L124-L128 VanDerWaalsContact O-N 3.09Å; L124-I315 HydrophobicContact CB-CD1 4.29Å; L124-I315 HydrophobicContact CB-CG1 4.33Å; L124-I315 HydrophobicContact CD1-CG1 4.34Å; L124-I315 HydrophobicContact CD1-CG2 4Å; L124-V319 HydrophobicContact CD1-CG2 3.72Å; L124-Y353 HydrophobicContact CB-CD2 4.14Å; L124-Y353 HydrophobicContact CB-CE2 4.12Å; L124-Y353 HydrophobicContact CD2-CD2 3.89Å; L124-Y353 HydrophobicContact CD2-CE2 4.01Å; L124-A356 HydrophobicContact CD2-CB 3.5Å; L124-L357 HydrophobicContact CD1-CD2 4Å; L124-L357 HydrophobicContact CD2-CD2 3.7Å; L124-L357 HydrophobicContact CD2-CG 3.85Å; L124-L360 HydrophobicContact CD1-CD1 3.84Å; L124-L360 HydrophobicContact CD2-CD1 4.49Å; L124-L360 HydrophobicContact CG-CD1 4.46Å
125	I	98.4	Very high	97	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-65.2	-42.8	-178.4	-67.2	-58.8	0	0	0	111	I82 L86 L113 L117 F121 E122 A127 L128 M129	I82-I125 HydrophobicContact CG2-CD1 4.24Å; I82-I125 HydrophobicContact CG2-CG1 4.39Å; I82-I125 HydrophobicContact CG2-CG2 4.13Å; L86-I125 HydrophobicContact CD1-CG2 3.55Å; L113-I125 HydrophobicContact CD1-CG2 3.97Å; L113-I125 HydrophobicContact CD2-CG2 3.98Å; L113-I125 HydrophobicContact CG-CG2 4.41Å; L117-I125 HydrophobicContact CD1-CB 3.89Å; L117-I125 HydrophobicContact CD1-CG1 4.05Å; L117-I125 HydrophobicContact CD1-CG2 3.83Å; F121-I125 HydrophobicContact CD2-CG1 3.97Å; F121-I125 HydrophobicContact CE1-CG1 4.32Å; F121-I125 HydrophobicContact CE2-CD1 3.81Å; F121-I125 HydrophobicContact CE2-CG1 3.54Å; F121-I125 HydrophobicContact CZ-CD1 4.15Å; F121-I125 HydrophobicContact CZ-CG1 3.74Å; F121-I125 WeakPolarHBondContact O-CG1 3.41Å; F121-I125 PolarHBondContact O-N 3.34Å; E122-I125 PolarHBondContact O-N 3.42Å; I125-A127 VanDerWaalsContact C-N 3.35Å; I125-A127 PolarHBondContact O-N 3.27Å; I125-L128 HydrophobicContact CD1-CD1 4.26Å; I125-L128 WeakPolarHBondContact O-CB 2.96Å; I125-L128 PolarHBondContact O-N 2.96Å; I125-M129 PolarHBondContact O-N 3.11Å
126	V	98.3	Very high	97.3	Very high	12 Å²	12	41.9 Å²	41.9	7%	0.073	21%	0.214	C	C	.	.	H	α-helix	trans	-63.4	-41.2	175.1	170.7	0	0	0	0	110.8	T110 K114 E122 L128 M129 Y130	T110-V126 HydrophobicContact CG2-CG1 4.25Å; K114-V126 HydrophobicContact CG-CG1 4.41Å; K114-V126 HydrophobicContact CG-CG2 3.63Å; E122-V126 HydrophobicContact CG-CG2 4.14Å; E122-V126 VanDerWaalsContact O-CB 3.31Å; E122-V126 WeakPolarHBondContact O-CB 3.4Å; E122-V126 VanDerWaalsContact O-CG2 3.28Å; E122-V126 WeakPolarHBondContact O-CG2 3.48Å; E122-V126 PolarHBondContact O-N 2.86Å; V126-L128 VanDerWaalsContact C-N 3.27Å; V126-L128 PolarHBondContact O-N 3.14Å; V126-M129 WeakPolarHBondContact O-CB 3.36Å; V126-M129 PolarHBondContact O-N 3.13Å; V126-Y130 HydrophobicContact CG1-CE2 3.81Å; V126-Y130 VanDerWaalsContact O-CD2 3.27Å; V126-Y130 WeakPolarHBondContact O-CD2 3.45Å
127	A	98.3	Very high	97.5	Very high	5 Å²	5	38 Å²	38	4%	0.041	20%	0.196	C	C	.	.	H	α-helix	trans	-57.6	-38.7	174.6	0	0	0	0	0	112.5	R123 L124 I125 M129 Y130 Y135 I315 V319	R123-A127 WeakPolarHBondContact O-CB 3.42Å; R123-A127 PolarHBondContact O-N 3.34Å; L124-A127 WeakPolarHBondContact O-CB 3.44Å; L124-A127 PolarHBondContact O-N 3.1Å; I125-A127 VanDerWaalsContact C-N 3.35Å; I125-A127 PolarHBondContact O-N 3.27Å; A127-M129 PolarHBondContact O-N 2.89Å; A127-Y130 PolarHBondContact O-N 2.9Å; A127-Y135 HydrophobicContact CB-CD2 4.25Å; A127-Y135 HydrophobicContact CB-CE2 3.4Å; A127-I315 HydrophobicContact CB-CG2 3.86Å; A127-V319 HydrophobicContact CB-CG1 4.36Å; A127-V319 HydrophobicContact CB-CG2 4.12Å
128	L	98.2	Very high	97.6	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-64.2	-23.9	174.3	-66.6	172.6	0	0	0	113	T87 N91 R94 L124 I125 V126 V319 L360	T87-L128 HydrophobicContact CG2-CD1 4.14Å; N91-L128 PolarHBondContact ND2-O 3.47Å; R94-L128 WeakPolarHBondContact CD-O 2.96Å; R94-L128 PolarHBondContact NH1-O 3.05Å; L124-L128 WeakPolarHBondContact O-CG 3.33Å; L124-L128 PolarHBondContact O-N 3.37Å; L124-L128 VanDerWaalsContact O-N 3.09Å; I125-L128 HydrophobicContact CD1-CD1 4.26Å; I125-L128 WeakPolarHBondContact O-CB 2.96Å; I125-L128 PolarHBondContact O-N 2.96Å; V126-L128 VanDerWaalsContact C-N 3.27Å; V126-L128 PolarHBondContact O-N 3.14Å; L128-V319 HydrophobicContact CD2-CG1 4.27Å; L128-V319 HydrophobicContact CD2-CG2 3.99Å; L128-V319 HydrophobicContact CG-CG2 4.45Å; L128-L360 HydrophobicContact CD1-CD1 4.13Å; L128-L360 HydrophobicContact CD1-CD2 4.19Å; L128-L360 HydrophobicContact CD2-CD1 3.91Å; L128-L360 HydrophobicContact CD2-CD2 3.75Å; L128-L360 HydrophobicContact CD2-CG 4.48Å; L128-L360 HydrophobicContact CG-CD1 4.4Å
129	M	98.2	Very high	97.8	Very high	5 Å²	5	36 Å²	36	3%	0.025	18%	0.176	C	C	.	.	H	α-helix	trans	-80.2	-16.3	-177.4	-63.3	-50.9	-58.9	0	0	113.8	L86 R94 Q95 A98 L109 T110 L113 I125 V126 A127	L86-M129 HydrophobicContact CD1-SD 4.15Å; L86-M129 HydrophobicContact CD2-SD 3.87Å; R94-M129 HydrophobicContact CB-CE 4.25Å; R94-M129 HydrophobicContact CB-SD 4.3Å; R94-M129 HydrophobicContact CG-SD 4.47Å; Q95-M129 PolarHBondContact NE2-O 2.93Å; A98-M129 HydrophobicContact CB-CE 3.98Å; L109-M129 HydrophobicContact CD2-CE 3.64Å; L109-M129 HydrophobicContact CG-CE 4.17Å; T110-M129 HydrophobicContact CG2-CB 4.23Å; T110-M129 WeakPolarHBondContact OG1-CB 3.3Å; L113-M129 HydrophobicContact CD1-CG 3.86Å; L113-M129 HydrophobicContact CD1-SD 4.23Å; I125-M129 PolarHBondContact O-N 3.11Å; V126-M129 WeakPolarHBondContact O-CB 3.36Å; V126-M129 PolarHBondContact O-N 3.13Å; A127-M129 PolarHBondContact O-N 2.89Å
130	Y	97.3	Very high	97.9	Very high	46 Å²	46	33.9 Å²	33.9	18%	0.18	15%	0.154	C	C	.	.	S	Bend	trans	-77	136	179.3	-79	-93.9	0	0	0	111.8	N91 V126 A127 R134 Y135 K138	N91-Y130 PolarHBondContact ND2-O 3.1Å; V126-Y130 HydrophobicContact CG1-CE2 3.81Å; V126-Y130 VanDerWaalsContact O-CD2 3.27Å; V126-Y130 WeakPolarHBondContact O-CD2 3.45Å; A127-Y130 PolarHBondContact O-N 2.9Å; Y130-R134 HydrophobicContact CD1-CB 4.41Å; Y130-Y135 HydrophobicContact CD2-CD2 4.28Å; Y130-Y135 HydrophobicContact CG-CD2 4.22Å; Y130-K138 HydrophobicContact CD1-CD 4.26Å; Y130-K138 HydrophobicContact CD2-CD 4.34Å; Y130-K138 HydrophobicContact CE1-CB 4.39Å; Y130-K138 HydrophobicContact CE1-CD 3.59Å; Y130-K138 HydrophobicContact CE2-CD 3.69Å; Y130-K138 WeakPolarHBondContact OH-CD 3.29Å
131	P	97.4	Very high	97.9	Very high	42 Å²	42	32 Å²	32	27%	0.273	15%	0.146	S	C	.	.			trans	-54.8	148.3	163.4	-25.5	35.6	0	0	0	111.3	N91 Y133 R134 Y135	N91-P131 WeakPolarHBondContact OD1-CA 3.43Å; P131-Y133 PolarHBondContact O-N 3.44Å; P131-R134 HydrophobicContact CB-CB 4.3Å; P131-R134 PolarHBondContact O-N 2.92Å; P131-R134 VanDerWaalsContact O-N 3.1Å; P131-Y135 PolarHBondContact O-N 3.41Å
132	P	91.9	Very high	97.9	Very high	73 Å²	73	32.5 Å²	32.5	47%	0.474	15%	0.15	S	C	.	.	H	α-helix	trans	-50.6	-52.4	-167.2	-29.4	35.3	0	0	0	114.6	Y135 E136	P132-Y135 WeakPolarHBondContact O-CB 3.44Å; P132-Y135 PolarHBondContact O-N 3.29Å; P132-E136 PolarHBondContact O-N 2.95Å
133	Y	96.8	Very high	97.8	Very high	89 Å²	89	30 Å²	30	35%	0.349	14%	0.139	S	C	.	.	H	α-helix	trans	-76.4	-29	-177	-49.8	-51.1	0	0	0	113.4	P131 Y135 E136 A137 Q165 E168 I169	P131-Y133 PolarHBondContact O-N 3.44Å; Y133-Y135 VanDerWaalsContact C-N 3.33Å; Y133-E136 WeakPolarHBondContact CD1-OE2 3.44Å; Y133-E136 PolarHBondContact O-N 3.39Å; Y133-A137 WeakPolarHBondContact O-CB 3.07Å; Y133-A137 PolarHBondContact O-N 3.28Å; Y133-Q165 HydrophobicContact CE1-CB 4.19Å; Y133-Q165 HydrophobicContact CE1-CG 4.01Å; Y133-E168 HydrophobicContact CD1-CB 4.04Å; Y133-E168 HydrophobicContact CD2-CB 3.3Å; Y133-E168 HydrophobicContact CD2-CG 3.89Å; Y133-E168 HydrophobicContact CE1-CB 4.34Å; Y133-E168 HydrophobicContact CE2-CB 3.63Å; Y133-E168 HydrophobicContact CE2-CG 3.71Å; Y133-E168 HydrophobicContact CG-CB 3.51Å; Y133-E168 HydrophobicContact CG-CG 4.49Å; Y133-I169 HydrophobicContact CD1-CG1 4.13Å
134	R	98	Very high	97.8	Very high	86 Å²	86	25 Å²	25	33%	0.325	12%	0.12	S	C	.	.	H	α-helix	trans	-69.6	-32.6	172.1	-75.5	179.4	173.1	-115.8	-7.9	111.7	Y130 P131 K138 A172 E175 D176	Y130-R134 HydrophobicContact CD1-CB 4.41Å; P131-R134 HydrophobicContact CB-CB 4.3Å; P131-R134 PolarHBondContact O-N 2.92Å; P131-R134 VanDerWaalsContact O-N 3.1Å; R134-K138 WeakPolarHBondContact O-CB 3.27Å; R134-K138 PolarHBondContact O-N 2.69Å; R134-A172 HydrophobicContact CG-CB 3.82Å; R134-E175 IonicContact CZ-OE2 3.3Å; R134-E175 IonicContact NH2-OE2 2.71Å; R134-E175 PolarHBondContact NH2-OE2 2.8Å; R134-D176 IonicContact CZ-OD1 3.48Å; R134-D176 IonicContact CZ-OD2 3.67Å; R134-D176 IonicContact NH1-OD1 2.86Å; R134-D176 PolarHBondContact NH1-OD1 3.08Å; R134-D176 IonicContact NH1-OD2 3.24Å; R134-D176 PolarHBondContact NH1-OD2 2.48Å; R134-D176 IonicContact NH2-OD1 3.23Å; R134-D176 PolarHBondContact NH2-OD1 3.22Å
135	Y	98.4	Very high	97.5	Very high	9 Å²	9	31.3 Å²	31.3	4%	0.035	15%	0.148	C	C	.	.	H	α-helix	trans	-62.8	-46.9	173.4	-177.5	-122.2	0	0	0	111.2	A127 Y130 P131 P132 Y133 K138 E139 R316 V319	A127-Y135 HydrophobicContact CB-CD2 4.25Å; A127-Y135 HydrophobicContact CB-CE2 3.4Å; Y130-Y135 HydrophobicContact CD2-CD2 4.28Å; Y130-Y135 HydrophobicContact CG-CD2 4.22Å; P131-Y135 PolarHBondContact O-N 3.41Å; P132-Y135 WeakPolarHBondContact O-CB 3.44Å; P132-Y135 PolarHBondContact O-N 3.29Å; Y133-Y135 VanDerWaalsContact C-N 3.33Å; Y135-K138 WeakPolarHBondContact O-CB 3.26Å; Y135-K138 PolarHBondContact O-N 3.33Å; Y135-E139 HydrophobicContact CD2-CG 4.47Å; Y135-E139 HydrophobicContact CE1-CG 4.2Å; Y135-E139 HydrophobicContact CE2-CG 4.02Å; Y135-E139 WeakPolarHBondContact O-CG 3.48Å; Y135-E139 PolarHBondContact O-N 2.82Å; Y135-R316 HydrophobicContact CE1-CB 4.35Å; Y135-R316 HydrophobicContact CE1-CG 3.98Å; Y135-R316 WeakPolarHBondContact OH-CA 3.33Å; Y135-V319 HydrophobicContact CD1-CG1 4.15Å; Y135-V319 HydrophobicContact CE1-CB 4.17Å; Y135-V319 HydrophobicContact CE1-CG1 3.9Å
136	E	98.2	Very high	96.9	Very high	7 Å²	7	33.4 Å²	33.4	3%	0.033	17%	0.169	C	C	.	.	H	α-helix	trans	-68.3	-40.4	179.7	-67.4	160.7	142.4	0	0	111.6	P132 Y133 K138 E139 L140 I157 R161 I169	P132-E136 PolarHBondContact O-N 2.95Å; Y133-E136 WeakPolarHBondContact CD1-OE2 3.44Å; Y133-E136 PolarHBondContact O-N 3.39Å; E136-K138 VanDerWaalsContact C-N 3.3Å; E136-K138 PolarHBondContact O-N 2.99Å; E136-E139 PolarHBondContact O-N 3.33Å; E136-L140 WeakPolarHBondContact O-CG 3.4Å; E136-L140 PolarHBondContact O-N 2.65Å; E136-I157 HydrophobicContact CB-CG2 4.47Å; E136-R161 IonicContact OE1-CZ 3.91Å; E136-R161 IonicContact OE1-NE 3.99Å; E136-R161 PolarHBondContact OE1-NE 2.85Å; E136-R161 IonicContact OE1-NH2 2.89Å; E136-R161 PolarHBondContact OE1-NH2 3.25Å; E136-I169 HydrophobicContact CB-CD1 3.87Å; E136-I169 HydrophobicContact CB-CG1 3.93Å; E136-I169 HydrophobicContact CB-CG2 4.38Å; E136-I169 HydrophobicContact CG-CD1 4.38Å; E136-I169 WeakPolarHBondContact OE2-CD1 3.42Å; E136-I169 WeakPolarHBondContact OE2-CG1 3.16Å
137	A	98.6	Very high	96.3	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-57.6	-43.5	171.6	0	0	0	0	0	111.8	Y133 L140 H141 I169 A172 Y173 Y177	Y133-A137 WeakPolarHBondContact O-CB 3.07Å; Y133-A137 PolarHBondContact O-N 3.28Å; A137-L140 PolarHBondContact O-N 2.97Å; A137-H141 WeakPolarHBondContact O-CB 3.48Å; A137-H141 PolarHBondContact O-N 3.44Å; A137-I169 HydrophobicContact CB-CG2 4.42Å; A137-A172 HydrophobicContact CB-CB 4.12Å; A137-Y173 HydrophobicContact CB-CD2 4.09Å; A137-Y173 HydrophobicContact CB-CG 4.48Å; A137-Y173 WeakPolarHBondContact O-CD2 3.27Å; A137-Y177 HydrophobicContact CB-CE2 4.39Å
138	K	98.4	Very high	96	Very high	39 Å²	39	44.2 Å²	44.2	17%	0.17	24%	0.237	C	C	.	.	H	α-helix	trans	-62.6	-44	173.3	176.3	-177.9	174.4	-55.3	0	113.2	Y130 R134 Y135 E136 L140 H141 D142 Y177	Y130-K138 HydrophobicContact CD1-CD 4.26Å; Y130-K138 HydrophobicContact CD2-CD 4.34Å; Y130-K138 HydrophobicContact CE1-CB 4.39Å; Y130-K138 HydrophobicContact CE1-CD 3.59Å; Y130-K138 HydrophobicContact CE2-CD 3.69Å; Y130-K138 WeakPolarHBondContact OH-CD 3.29Å; R134-K138 WeakPolarHBondContact O-CB 3.27Å; R134-K138 PolarHBondContact O-N 2.69Å; Y135-K138 WeakPolarHBondContact O-CB 3.26Å; Y135-K138 PolarHBondContact O-N 3.33Å; E136-K138 VanDerWaalsContact C-N 3.3Å; E136-K138 PolarHBondContact O-N 2.99Å; K138-L140 VanDerWaalsContact C-N 3.28Å; K138-L140 PolarHBondContact O-N 3.09Å; K138-H141 PolarHBondContact O-N 3.01Å; K138-D142 IonicContact NZ-OD2 2.85Å; K138-D142 PolarHBondContact NZ-OD2 2.84Å; K138-D142 VanDerWaalsContact O-CB 3.3Å; K138-D142 WeakPolarHBondContact O-CB 3.45Å; K138-D142 VanDerWaalsContact O-CG 3.3Å; K138-D142 PolarHBondContact O-N 3.39Å; K138-Y177 WeakPolarHBondContact CA-OH 3.24Å; K138-Y177 WeakPolarHBondContact CB-OH 3.43Å
139	E	98.6	Very high	95.9	Very high	22 Å²	22	46 Å²	46	10%	0.103	25%	0.249	C	C	.	.	H	α-helix	trans	-64.1	-35.7	178.9	-73	-71.9	120.6	0	0	111.8	Y135 E136 A143 V153 I157 R316	Y135-E139 HydrophobicContact CD2-CG 4.47Å; Y135-E139 HydrophobicContact CE1-CG 4.2Å; Y135-E139 HydrophobicContact CE2-CG 4.02Å; Y135-E139 WeakPolarHBondContact O-CG 3.48Å; Y135-E139 PolarHBondContact O-N 2.82Å; E136-E139 PolarHBondContact O-N 3.33Å; E139-A143 WeakPolarHBondContact O-CB 3.2Å; E139-A143 PolarHBondContact O-N 2.96Å; E139-A143 VanDerWaalsContact O-N 3.1Å; E139-V153 HydrophobicContact CB-CG1 4.37Å; E139-I157 HydrophobicContact CB-CD1 3.89Å; E139-R316 HydrophobicContact CG-CG 4.14Å; E139-R316 WeakPolarHBondContact OE2-CD 3.34Å; E139-R316 IonicContact OE2-CZ 2.65Å; E139-R316 IonicContact OE2-NE 3.9Å; E139-R316 IonicContact OE2-NH1 2.88Å; E139-R316 PolarHBondContact OE2-NH1 3.2Å
140	L	98.7	Very high	95.9	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-66.7	-46.8	172.2	-71.1	167.8	0	0	0	111.7	E136 A137 K138 D142 A143 M144 I154 I157 L158 I169 Y173 L181	E136-L140 WeakPolarHBondContact O-CG 3.4Å; E136-L140 PolarHBondContact O-N 2.65Å; A137-L140 PolarHBondContact O-N 2.97Å; K138-L140 VanDerWaalsContact C-N 3.28Å; K138-L140 PolarHBondContact O-N 3.09Å; L140-D142 PolarHBondContact O-N 3.49Å; L140-A143 WeakPolarHBondContact O-CB 3.39Å; L140-A143 PolarHBondContact O-N 3.27Å; L140-A143 VanDerWaalsContact O-N 3.09Å; L140-M144 WeakPolarHBondContact O-CE 3.49Å; L140-M144 PolarHBondContact O-N 2.98Å; L140-I154 HydrophobicContact CD2-CB 4.26Å; L140-I154 HydrophobicContact CD2-CG1 4.28Å; L140-I154 HydrophobicContact CD2-CG2 4.06Å; L140-I157 HydrophobicContact CD1-CG2 4.09Å; L140-I157 HydrophobicContact CD2-CB 4.17Å; L140-I157 HydrophobicContact CD2-CD1 3.96Å; L140-I157 HydrophobicContact CD2-CG2 4.33Å; L140-I157 HydrophobicContact CG-CD1 3.83Å; L140-I157 HydrophobicContact CG-CG2 4.31Å; L140-L158 HydrophobicContact CD1-CD1 4.32Å; L140-L158 HydrophobicContact CD2-CD1 3.9Å; L140-I169 HydrophobicContact CD1-CG2 3.66Å; L140-Y173 HydrophobicContact CB-CD2 4.34Å; L140-Y173 HydrophobicContact CB-CE2 4.08Å; L140-L181 HydrophobicContact CB-CD1 4.13Å; L140-L181 HydrophobicContact CD1-CD1 3.96Å; L140-L181 HydrophobicContact CD1-CD2 3.64Å; L140-L181 HydrophobicContact CD1-CG 4.48Å
141	H	98.5	Very high	95.9	Very high	46 Å²	46	52.3 Å²	52.3	21%	0.213	28%	0.278	C	S	.	.	H	α-helix	trans	-62.5	-42.7	177	175.2	-99.7	0	0	0	111.5	A137 K138 A143 M144 K145 Y173 Y177	A137-H141 WeakPolarHBondContact O-CB 3.48Å; A137-H141 PolarHBondContact O-N 3.44Å; K138-H141 PolarHBondContact O-N 3.01Å; H141-A143 PolarHBondContact O-N 3.26Å; H141-M144 PolarHBondContact O-N 2.89Å; H141-M144 VanDerWaalsContact O-N 3.14Å; H141-K145 WeakPolarHBondContact CE1-CD 3.49Å; H141-K145 VanDerWaalsContact O-CB 3.31Å; H141-K145 WeakPolarHBondContact O-CB 3.39Å; H141-K145 WeakPolarHBondContact O-CG 3.37Å; H141-K145 PolarHBondContact O-N 3.35Å; H141-Y173 HydrophobicContact CB-CE2 3.7Å; H141-Y177 HydrophobicContact CB-CD1 4.31Å; H141-Y177 HydrophobicContact CB-CD2 3.94Å; H141-Y177 HydrophobicContact CB-CE1 3.96Å; H141-Y177 HydrophobicContact CB-CE2 3.57Å; H141-Y177 HydrophobicContact CB-CG 4.32Å; H141-Y177 AromaticContact CD2-CD1 3.5Å; H141-Y177 AromaticContact CD2-CE1 3.85Å; H141-Y177 AromaticContact CD2-CG 3.71Å; H141-Y177 AromaticContact CE1-CD1 3.78Å; H141-Y177 AromaticContact CE1-CE1 3.69Å; H141-Y177 AromaticContact CG-CD1 3.64Å; H141-Y177 AromaticContact CG-CE1 3.47Å; H141-Y177 VanDerWaalsContact CG-CE1 3.47Å; H141-Y177 AromaticContact CG-CE2 3.98Å; H141-Y177 AromaticContact CG-CG 3.97Å; H141-Y177 AromaticContact CG-CZ 3.68Å; H141-Y177 AromaticContact ND1-CD1 3.82Å; H141-Y177 AromaticContact ND1-CE1 3.38Å; H141-Y177 WeakPolarHBondContact ND1-CE1 3.43Å; H141-Y177 AromaticContact ND1-CZ 3.84Å; H141-Y177 AromaticContact NE2-CD1 3.63Å
142	D	97.5	Very high	95.9	Very high	29 Å²	29	51.2 Å²	51.2	16%	0.155	27%	0.274	C	S	.	.	H	α-helix	trans	-67.6	-16.5	175.7	-74.2	-8.4	0	0	0	113.9	K138 L140 K145 K150	K138-D142 IonicContact NZ-OD2 2.85Å; K138-D142 PolarHBondContact NZ-OD2 2.84Å; K138-D142 VanDerWaalsContact O-CB 3.3Å; K138-D142 WeakPolarHBondContact O-CB 3.45Å; K138-D142 VanDerWaalsContact O-CG 3.3Å; K138-D142 PolarHBondContact O-N 3.39Å; L140-D142 PolarHBondContact O-N 3.49Å; D142-K145 WeakPolarHBondContact OD1-CE 3.43Å; D142-K145 IonicContact OD1-NZ 2.72Å; D142-K145 PolarHBondContact OD1-NZ 2.83Å; D142-K150 PolarHBondContact O-NZ 3.31Å
143	A	97.9	Very high	96.2	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.008	26%	0.256	C	S	.	.	H	α-helix	trans	-81.7	-27	173.5	0	0	0	0	0	112.8	E139 L140 H141 T149 K150 V153 I154	E139-A143 WeakPolarHBondContact O-CB 3.2Å; E139-A143 PolarHBondContact O-N 2.96Å; E139-A143 VanDerWaalsContact O-N 3.1Å; L140-A143 WeakPolarHBondContact O-CB 3.39Å; L140-A143 PolarHBondContact O-N 3.27Å; L140-A143 VanDerWaalsContact O-N 3.09Å; H141-A143 PolarHBondContact O-N 3.26Å; A143-T149 WeakPolarHBondContact O-CA 3.27Å; A143-K150 HydrophobicContact CB-CB 3.95Å; A143-K150 PolarHBondContact O-N 3.07Å; A143-V153 HydrophobicContact CB-CB 3.96Å; A143-V153 HydrophobicContact CB-CG1 4.08Å; A143-I154 HydrophobicContact CB-CD1 4.5Å; A143-I154 HydrophobicContact CB-CG1 3.99Å
144	M	97.8	Very high	96.3	Very high	14 Å²	14	44.2 Å²	44.2	7%	0.069	24%	0.239	C	C	.	.	H	α-helix	trans	-108	-29.4	-175	-62	-179.5	-65.9	0	0	113.7	L140 H141 G146 I154 Y173 L181 D184 I185 D188	L140-M144 WeakPolarHBondContact O-CE 3.49Å; L140-M144 PolarHBondContact O-N 2.98Å; H141-M144 PolarHBondContact O-N 2.89Å; H141-M144 VanDerWaalsContact O-N 3.14Å; M144-G146 PolarHBondContact O-N 3.09Å; M144-I154 HydrophobicContact CG-CD1 3.73Å; M144-I154 HydrophobicContact SD-CD1 4.08Å; M144-Y173 HydrophobicContact CE-CE2 4.04Å; M144-Y173 VanDerWaalsContact CE-OH 3.26Å; M144-Y173 WeakPolarHBondContact CE-OH 3.41Å; M144-L181 HydrophobicContact CE-CD1 3.79Å; M144-D184 HydrophobicContact CE-CB 3.93Å; M144-D184 HydrophobicContact SD-CB 4.22Å; M144-I185 HydrophobicContact CE-CG1 4.43Å; M144-I185 HydrophobicContact SD-CG1 3.8Å; M144-D188 WeakPolarHBondContact CA-OD2 3.38Å; M144-D188 HydrophobicContact CB-CB 4.33Å; M144-D188 HydrophobicContact CG-CB 4.26Å; M144-D188 HydrophobicContact SD-CB 4.43Å
145	K	92.6	Very high	96.3	Very high	133 Å²	133	40.2 Å²	40.2	58%	0.578	22%	0.224	S	C	*	.	S	Bend	trans	-67.9	-10.2	-175.6	79.6	-174	-166.8	-173.2	0	115.7	H141 D142	H141-K145 WeakPolarHBondContact CE1-CD 3.49Å; H141-K145 VanDerWaalsContact O-CB 3.31Å; H141-K145 WeakPolarHBondContact O-CB 3.39Å; H141-K145 WeakPolarHBondContact O-CG 3.37Å; H141-K145 PolarHBondContact O-N 3.35Å; D142-K145 WeakPolarHBondContact OD1-CE 3.43Å; D142-K145 IonicContact OD1-NZ 2.72Å; D142-K145 PolarHBondContact OD1-NZ 2.83Å
146	G	85.8	Confident	96.3	Very high	43 Å²	43	39.8 Å²	39.8	44%	0.443	22%	0.222	S	C	.	.	S	Bend	trans	-96.5	-178.4	-166.5	0	0	0	0	0	113.9	M144 G148	M144-G146 PolarHBondContact O-N 3.09Å; G146-G148 PolarHBondContact O-N 3.07Å; G146-G148 VanDerWaalsContact O-N 3.13Å
147	L	86.1	Confident	96.3	Very high	190 Å²	190	39.4 Å²	39.4	100%	0.995	22%	0.221	S	C	*	.	S	Bend	trans	-69.9	108.1	166.3	-72.1	178	0	0	0	109.3
148	G	92.1	Very high	96.3	Very high	54 Å²	54	39.4 Å²	39.4	56%	0.557	22%	0.221	S	C	*	.	S	Bend	trans	73.9	166.7	-173.8	0	0	0	0	0	112.8	G146	G146-G148 PolarHBondContact O-N 3.07Å; G146-G148 VanDerWaalsContact O-N 3.13Å
149	T	95.8	Very high	96.2	Very high	39 Å²	39	37.7 Å²	37.7	24%	0.239	21%	0.213	C	C	.	.			trans	-102	133.6	-171	-45.5	0	0	0	0	111.1	A143 E151 I154 D188 T189	A143-T149 WeakPolarHBondContact O-CA 3.27Å; T149-E151 HydrophobicContact CG2-CG 3.85Å; T149-E151 PolarHBondContact O-N 2.68Å; T149-E151 VanDerWaalsContact O-N 3.11Å; T149-I154 HydrophobicContact CG2-CD1 3.59Å; T149-D188 VanDerWaalsContact CB-OD2 3.27Å; T149-D188 WeakPolarHBondContact CB-OD2 3.37Å; T149-D188 WeakPolarHBondContact CG2-OD2 3.46Å; T149-D188 PolarHBondContact OG1-O 3Å; T149-D188 PolarHBondContact OG1-OD2 3.46Å; T149-T189 HydrophobicContact CG2-CG2 4.44Å
150	K	97	Very high	96	Very high	124 Å²	124	36.9 Å²	36.9	54%	0.539	21%	0.21	S	C	.	.			trans	-86.7	67.6	170.7	-59.5	176.7	-166.8	136.4	0	109.9	D142 A143 G152 V153	D142-K150 PolarHBondContact O-NZ 3.31Å; A143-K150 HydrophobicContact CB-CB 3.95Å; A143-K150 PolarHBondContact O-N 3.07Å; K150-G152 PolarHBondContact O-N 3.08Å; K150-G152 VanDerWaalsContact O-N 3.13Å; K150-V153 HydrophobicContact CB-CB 4.44Å; K150-V153 HydrophobicContact CB-CG2 3.98Å; K150-V153 WeakPolarHBondContact O-CB 3.49Å; K150-V153 PolarHBondContact O-N 3.47Å
151	E	97.4	Very high	95.8	Very high	59 Å²	59	37 Å²	37	28%	0.276	21%	0.211	S	C	.	.	H	α-helix	trans	-51.4	-40.6	-172.9	-63.2	173.1	150.6	0	0	113	T149 V153 I154 I155 L193 S277	T149-E151 HydrophobicContact CG2-CG 3.85Å; T149-E151 PolarHBondContact O-N 2.68Å; T149-E151 VanDerWaalsContact O-N 3.11Å; E151-V153 PolarHBondContact O-N 3.33Å; E151-V153 VanDerWaalsContact O-N 3.14Å; E151-I154 WeakPolarHBondContact O-CB 3.48Å; E151-I154 PolarHBondContact O-N 2.88Å; E151-I155 HydrophobicContact CB-CD1 4.48Å; E151-I155 WeakPolarHBondContact O-CG1 3.44Å; E151-I155 PolarHBondContact O-N 3.47Å; E151-L193 HydrophobicContact CB-CD2 4.16Å; E151-L193 HydrophobicContact CG-CD2 3.81Å; E151-L193 WeakPolarHBondContact OE1-CD2 3.37Å; E151-S277 WeakPolarHBondContact OE2-CB 3.22Å; E151-S277 PolarHBondContact OE2-OG 3.46Å
152	G	97.8	Very high	95.5	Very high	18 Å²	18	38.1 Å²	38.1	19%	0.186	22%	0.221	C	C	.	.	H	α-helix	trans	-62.5	-19	177.7	0	0	0	0	0	115.4	K150 E156	K150-G152 PolarHBondContact O-N 3.08Å; K150-G152 VanDerWaalsContact O-N 3.13Å; G152-E156 VanDerWaalsContact O-CB 3.26Å; G152-E156 WeakPolarHBondContact O-CB 3.26Å; G152-E156 PolarHBondContact O-N 3.21Å
153	V	98.4	Very high	95.2	Very high	16 Å²	16	40.1 Å²	40.1	10%	0.097	23%	0.228	C	C	.	.	H	α-helix	trans	-77.3	-44.7	170.9	177.5	0	0	0	0	110.2	E139 A143 K150 E151 E156 I157	E139-V153 HydrophobicContact CB-CG1 4.37Å; A143-V153 HydrophobicContact CB-CB 3.96Å; A143-V153 HydrophobicContact CB-CG1 4.08Å; K150-V153 HydrophobicContact CB-CB 4.44Å; K150-V153 HydrophobicContact CB-CG2 3.98Å; K150-V153 WeakPolarHBondContact O-CB 3.49Å; K150-V153 PolarHBondContact O-N 3.47Å; E151-V153 PolarHBondContact O-N 3.33Å; E151-V153 VanDerWaalsContact O-N 3.14Å; V153-E156 PolarHBondContact O-N 2.78Å; V153-I157 HydrophobicContact CG1-CD1 3.91Å; V153-I157 WeakPolarHBondContact O-CG1 3.35Å; V153-I157 PolarHBondContact O-N 3.28Å
154	I	98.6	Very high	94.8	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-63	-48.5	179.4	-50.1	174.4	0	0	0	109.4	L140 A143 M144 T149 E151 E156 I157 L158 I185 L197	L140-I154 HydrophobicContact CD2-CB 4.26Å; L140-I154 HydrophobicContact CD2-CG1 4.28Å; L140-I154 HydrophobicContact CD2-CG2 4.06Å; A143-I154 HydrophobicContact CB-CD1 4.5Å; A143-I154 HydrophobicContact CB-CG1 3.99Å; M144-I154 HydrophobicContact CG-CD1 3.73Å; M144-I154 HydrophobicContact SD-CD1 4.08Å; T149-I154 HydrophobicContact CG2-CD1 3.59Å; E151-I154 WeakPolarHBondContact O-CB 3.48Å; E151-I154 PolarHBondContact O-N 2.88Å; I154-E156 PolarHBondContact O-N 2.8Å; I154-I157 PolarHBondContact O-N 3.46Å; I154-L158 HydrophobicContact CG2-CD1 4.15Å; I154-L158 HydrophobicContact CG2-CD2 4.18Å; I154-L158 WeakPolarHBondContact O-CB 3.36Å; I154-L158 PolarHBondContact O-N 3.16Å; I154-I185 HydrophobicContact CG2-CD1 4.04Å; I154-I185 HydrophobicContact CG2-CG1 4.32Å; I154-L197 HydrophobicContact CG2-CD1 3.92Å; I154-L197 HydrophobicContact CG2-CD2 4.09Å
155	I	98.6	Very high	94.7	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-56.3	-50.9	175.9	-68.6	166.3	0	0	0	111.2	E151 I157 A159 L193 L197 S277 E280 A281 T284	E151-I155 HydrophobicContact CB-CD1 4.48Å; E151-I155 WeakPolarHBondContact O-CG1 3.44Å; E151-I155 PolarHBondContact O-N 3.47Å; I155-I157 PolarHBondContact O-N 3.38Å; I155-A159 VanDerWaalsContact O-CB 3.25Å; I155-A159 WeakPolarHBondContact O-CB 3.49Å; I155-A159 PolarHBondContact O-N 3.24Å; I155-L193 HydrophobicContact CD1-CD1 4Å; I155-L193 HydrophobicContact CG1-CD1 4.18Å; I155-L197 HydrophobicContact CG1-CD2 4.01Å; I155-S277 WeakPolarHBondContact CD1-O 3.24Å; I155-E280 HydrophobicContact CD1-CB 4.2Å; I155-E280 HydrophobicContact CD1-CG 4.2Å; I155-E280 HydrophobicContact CG2-CG 4.41Å; I155-A281 HydrophobicContact CD1-CB 4.05Å; I155-A281 HydrophobicContact CG1-CB 4.01Å; I155-A281 HydrophobicContact CG2-CB 4.25Å; I155-T284 HydrophobicContact CG2-CG2 3.99Å
156	E	98.6	Very high	94.8	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-57.7	-47.5	-179.3	177.8	-175.4	98.9	0	0	111.2	G152 V153 I154 S160 Y295 R299 R316 N317	G152-E156 VanDerWaalsContact O-CB 3.26Å; G152-E156 WeakPolarHBondContact O-CB 3.26Å; G152-E156 PolarHBondContact O-N 3.21Å; V153-E156 PolarHBondContact O-N 2.78Å; I154-E156 PolarHBondContact O-N 2.8Å; E156-S160 WeakPolarHBondContact O-CB 3.25Å; E156-S160 PolarHBondContact O-N 2.66Å; E156-S160 PolarHBondContact O-OG 2.88Å; E156-Y295 HydrophobicContact CG-CE1 4.32Å; E156-Y295 WeakPolarHBondContact CG-OH 3.45Å; E156-R299 IonicContact OE2-CZ 3.78Å; E156-R299 VanDerWaalsContact OE2-CZ 3.23Å; E156-R299 IonicContact OE2-NE 3.31Å; E156-R299 PolarHBondContact OE2-NE 3.32Å; E156-R299 IonicContact OE2-NH2 2.64Å; E156-R299 PolarHBondContact OE2-NH2 2.88Å; E156-R316 IonicContact OE1-CZ 2.65Å; E156-R316 VanDerWaalsContact OE1-CZ 3.27Å; E156-R316 IonicContact OE1-NE 2.83Å; E156-R316 PolarHBondContact OE1-NE 3.41Å; E156-R316 IonicContact OE1-NH2 3.82Å; E156-R316 PolarHBondContact OE1-NH2 2.98Å; E156-R316 IonicContact OE2-NH2 2.75Å; E156-R316 PolarHBondContact OE2-NH2 3.34Å; E156-N317 PolarHBondContact OE1-ND2 3.36Å; E156-N317 PolarHBondContact OE1-OD1 3.3Å; E156-N317 PolarHBondContact OE2-ND2 2.98Å
157	I	98.2	Very high	95.3	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-70.5	-48.4	-177.4	-64.7	170.1	0	0	0	110.9	E136 E139 L140 V153 I154 I155 A159 R161 I169	E136-I157 HydrophobicContact CB-CG2 4.47Å; E139-I157 HydrophobicContact CB-CD1 3.89Å; L140-I157 HydrophobicContact CD1-CG2 4.09Å; L140-I157 HydrophobicContact CD2-CB 4.17Å; L140-I157 HydrophobicContact CD2-CD1 3.96Å; L140-I157 HydrophobicContact CD2-CG2 4.33Å; L140-I157 HydrophobicContact CG-CD1 3.83Å; L140-I157 HydrophobicContact CG-CG2 4.31Å; V153-I157 HydrophobicContact CG1-CD1 3.91Å; V153-I157 WeakPolarHBondContact O-CG1 3.35Å; V153-I157 PolarHBondContact O-N 3.28Å; I154-I157 PolarHBondContact O-N 3.46Å; I155-I157 PolarHBondContact O-N 3.38Å; I157-A159 PolarHBondContact O-N 3.44Å; I157-R161 WeakPolarHBondContact O-CB 3.37Å; I157-R161 VanDerWaalsContact O-CD 3.23Å; I157-R161 WeakPolarHBondContact O-CD 3.47Å; I157-R161 PolarHBondContact O-N 3.02Å; I157-I169 HydrophobicContact CG2-CD1 4.23Å
158	L	97.3	Very high	95.8	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-67.3	-40.3	-175	-91.4	59.9	0	0	0	112.7	L140 I154 L166 I185 L197 L200 L201	L140-L158 HydrophobicContact CD1-CD1 4.32Å; L140-L158 HydrophobicContact CD2-CD1 3.9Å; I154-L158 HydrophobicContact CG2-CD1 4.15Å; I154-L158 HydrophobicContact CG2-CD2 4.18Å; I154-L158 WeakPolarHBondContact O-CB 3.36Å; I154-L158 PolarHBondContact O-N 3.16Å; L158-L166 HydrophobicContact CG-CD2 4.44Å; L158-I185 HydrophobicContact CD2-CD1 3.82Å; L158-L197 HydrophobicContact CD2-CB 3.98Å; L158-L197 HydrophobicContact CD2-CD2 4.04Å; L158-L197 WeakPolarHBondContact CD2-O 3.31Å; L158-L200 HydrophobicContact CB-CB 4.2Å; L158-L200 HydrophobicContact CB-CD1 4.26Å; L158-L201 HydrophobicContact CD2-CB 4.23Å
159	A	96.4	Very high	96	Very high	2 Å²	2	35.2 Å²	35.2	2%	0.017	17%	0.174	C	C	.	.	H	α-helix	trans	-77.2	-28.8	-176.4	0	0	0	0	0	113.5	I155 I157 L200 T284 V285	I155-A159 VanDerWaalsContact O-CB 3.25Å; I155-A159 WeakPolarHBondContact O-CB 3.49Å; I155-A159 PolarHBondContact O-N 3.24Å; I157-A159 PolarHBondContact O-N 3.44Å; A159-L200 HydrophobicContact CB-CD1 4.21Å; A159-T284 HydrophobicContact CB-CG2 3.52Å; A159-V285 HydrophobicContact CB-CG2 3.87Å
160	S	96.1	Very high	96.1	Very high	6 Å²	6	36 Å²	36	4%	0.042	18%	0.175	C	C	.	.	H	α-helix	trans	-95	-8.1	-174.3	68.2	0	0	0	0	114.7	E156	E156-S160 WeakPolarHBondContact O-CB 3.25Å; E156-S160 PolarHBondContact O-N 2.66Å; E156-S160 PolarHBondContact O-OG 2.88Å
161	R	94.4	Very high	96.2	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.008	17%	0.172	C	C	.	.	S	Bend	trans	-94.3	149.6	179.7	-84.5	46.4	175.5	-170.1	3.9	111.3	E136 I157 Q165 L166 I169 R205 S320	E136-R161 IonicContact OE1-CZ 3.91Å; E136-R161 IonicContact OE1-NE 3.99Å; E136-R161 PolarHBondContact OE1-NE 2.85Å; E136-R161 IonicContact OE1-NH2 2.89Å; E136-R161 PolarHBondContact OE1-NH2 3.25Å; I157-R161 WeakPolarHBondContact O-CB 3.37Å; I157-R161 VanDerWaalsContact O-CD 3.23Å; I157-R161 WeakPolarHBondContact O-CD 3.47Å; I157-R161 PolarHBondContact O-N 3.02Å; R161-Q165 HydrophobicContact CB-CB 4.1Å; R161-Q165 HydrophobicContact CG-CB 4.11Å; R161-L166 HydrophobicContact CB-CD2 3.76Å; R161-L166 HydrophobicContact CB-CG 3.87Å; R161-I169 HydrophobicContact CG-CD1 3.86Å; R161-R205 PolarHBondContact O-NH2 3.1Å; R161-S320 PolarHBondContact NH2-OG 2.93Å
162	T	91.4	Very high	96.2	Very high	70 Å²	70	32.8 Å²	32.8	43%	0.429	16%	0.162	S	C	.	.			trans	-77.4	161.9	171.8	64.3	0	0	0	0	110.5	N164 Q165 L166	T162-N164 VanDerWaalsContact C-N 3.25Å; T162-N164 PolarHBondContact O-N 2.95Å; T162-Q165 PolarHBondContact O-N 3.43Å; T162-Q165 VanDerWaalsContact O-N 3.09Å; T162-Q165 VanDerWaalsContact OG1-CG 3.27Å; T162-Q165 WeakPolarHBondContact OG1-CG 3.41Å; T162-Q165 PolarHBondContact OG1-N 3.43Å; T162-Q165 PolarHBondContact OG1-OE1 2.94Å; T162-L166 PolarHBondContact O-N 3.19Å
163	K	90.3	Very high	96.3	Very high	71 Å²	71	32 Å²	32	31%	0.309	15%	0.153	S	C	.	.	H	α-helix	trans	-53.5	-41.9	176.7	179.6	175.4	-174.8	156.7	0	112.9	L166 R167 G203	K163-L166 PolarHBondContact O-N 3.45Å; K163-R167 PolarHBondContact O-N 3.1Å; K163-R167 VanDerWaalsContact O-N 3.08Å; K163-G203 WeakPolarHBondContact CD-O 3.34Å; K163-G203 WeakPolarHBondContact CE-O 3.43Å; K163-G203 PolarHBondContact NZ-O 3.22Å
164	N	91	Very high	96.3	Very high	95 Å²	95	37.2 Å²	37.2	51%	0.508	18%	0.177	S	C	.	.	H	α-helix	trans	-68.9	-38.8	179.1	-69.2	-26.5	0	0	0	112.1	T162 R167 E168	T162-N164 VanDerWaalsContact C-N 3.25Å; T162-N164 PolarHBondContact O-N 2.95Å; N164-R167 PolarHBondContact O-N 3.22Å; N164-R167 PolarHBondContact OD1-NH1 2.87Å; N164-E168 PolarHBondContact O-N 3.14Å
165	Q	94.1	Very high	96.3	Very high	32 Å²	32	42.3 Å²	42.3	15%	0.15	20%	0.2	C	C	.	.	H	α-helix	trans	-65.1	-44.8	174.9	-69.1	169	-52	0	0	111.1	Y133 R161 T162 R167 E168 I169	Y133-Q165 HydrophobicContact CE1-CB 4.19Å; Y133-Q165 HydrophobicContact CE1-CG 4.01Å; R161-Q165 HydrophobicContact CB-CB 4.1Å; R161-Q165 HydrophobicContact CG-CB 4.11Å; T162-Q165 PolarHBondContact O-N 3.43Å; T162-Q165 VanDerWaalsContact O-N 3.09Å; T162-Q165 VanDerWaalsContact OG1-CG 3.27Å; T162-Q165 WeakPolarHBondContact OG1-CG 3.41Å; T162-Q165 PolarHBondContact OG1-N 3.43Å; T162-Q165 PolarHBondContact OG1-OE1 2.94Å; Q165-R167 VanDerWaalsContact C-N 3.3Å; Q165-R167 PolarHBondContact O-N 3.29Å; Q165-E168 PolarHBondContact O-N 2.96Å; Q165-E168 VanDerWaalsContact O-N 3.16Å; Q165-I169 VanDerWaalsContact O-CG1 3.27Å; Q165-I169 WeakPolarHBondContact O-CG1 3.41Å; Q165-I169 PolarHBondContact O-N 3.02Å
166	L	95.6	Very high	96.2	Very high	3 Å²	3	45 Å²	45	2%	0.016	22%	0.215	C	C	.	.	H	α-helix	trans	-59.5	-39.8	177.5	-69.9	175.1	0	0	0	112.2	L158 R161 T162 K163 E168 I169 M170 L200	L158-L166 HydrophobicContact CG-CD2 4.44Å; R161-L166 HydrophobicContact CB-CD2 3.76Å; R161-L166 HydrophobicContact CB-CG 3.87Å; T162-L166 PolarHBondContact O-N 3.19Å; K163-L166 PolarHBondContact O-N 3.45Å; L166-E168 VanDerWaalsContact C-N 3.34Å; L166-E168 PolarHBondContact O-N 3.32Å; L166-I169 HydrophobicContact CD2-CD1 4.36Å; L166-I169 PolarHBondContact O-N 2.91Å; L166-M170 VanDerWaalsContact O-CG 3.26Å; L166-M170 WeakPolarHBondContact O-CG 3.48Å; L166-M170 PolarHBondContact O-N 3.47Å; L166-L200 WeakPolarHBondContact CD1-O 3.43Å
167	R	95.4	Very high	96.2	Very high	125 Å²	125	48.3 Å²	48.3	47%	0.472	23%	0.228	S	C	.	.	H	α-helix	trans	-58.9	-44.3	175.2	-169.8	-175.1	-59.5	111.7	1.8	112.4	K163 N164 Q165 K171	K163-R167 PolarHBondContact O-N 3.1Å; K163-R167 VanDerWaalsContact O-N 3.08Å; N164-R167 PolarHBondContact O-N 3.22Å; N164-R167 PolarHBondContact OD1-NH1 2.87Å; Q165-R167 VanDerWaalsContact C-N 3.3Å; Q165-R167 PolarHBondContact O-N 3.29Å; R167-K171 WeakPolarHBondContact O-CB 3.17Å; R167-K171 PolarHBondContact O-N 3.05Å; R167-K171 VanDerWaalsContact O-N 3.1Å
168	E	96.8	Very high	96.2	Very high	77 Å²	77	51.6 Å²	51.6	36%	0.36	26%	0.262	S	S	.	.	H	α-helix	trans	-70.1	-34.4	178.1	-62.5	-58.6	127.2	0	0	112.1	Y133 N164 Q165 L166 A172	Y133-E168 HydrophobicContact CD1-CB 4.04Å; Y133-E168 HydrophobicContact CD2-CB 3.3Å; Y133-E168 HydrophobicContact CD2-CG 3.89Å; Y133-E168 HydrophobicContact CE1-CB 4.34Å; Y133-E168 HydrophobicContact CE2-CB 3.63Å; Y133-E168 HydrophobicContact CE2-CG 3.71Å; Y133-E168 HydrophobicContact CG-CB 3.51Å; Y133-E168 HydrophobicContact CG-CG 4.49Å; N164-E168 PolarHBondContact O-N 3.14Å; Q165-E168 PolarHBondContact O-N 2.96Å; Q165-E168 VanDerWaalsContact O-N 3.16Å; L166-E168 VanDerWaalsContact C-N 3.34Å; L166-E168 PolarHBondContact O-N 3.32Å; E168-A172 VanDerWaalsContact O-CB 3.3Å; E168-A172 WeakPolarHBondContact O-CB 3.29Å; E168-A172 PolarHBondContact O-N 2.94Å
169	I	98	Very high	96.1	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-65.2	-47.1	174.5	-66.2	164.7	0	0	0	110.5	Y133 E136 A137 L140 I157 R161 Q165 L166 K171 A172 Y173 L181	Y133-I169 HydrophobicContact CD1-CG1 4.13Å; E136-I169 HydrophobicContact CB-CD1 3.87Å; E136-I169 HydrophobicContact CB-CG1 3.93Å; E136-I169 HydrophobicContact CB-CG2 4.38Å; E136-I169 HydrophobicContact CG-CD1 4.38Å; E136-I169 WeakPolarHBondContact OE2-CD1 3.42Å; E136-I169 WeakPolarHBondContact OE2-CG1 3.16Å; A137-I169 HydrophobicContact CB-CG2 4.42Å; L140-I169 HydrophobicContact CD1-CG2 3.66Å; I157-I169 HydrophobicContact CG2-CD1 4.23Å; R161-I169 HydrophobicContact CG-CD1 3.86Å; Q165-I169 VanDerWaalsContact O-CG1 3.27Å; Q165-I169 WeakPolarHBondContact O-CG1 3.41Å; Q165-I169 PolarHBondContact O-N 3.02Å; L166-I169 HydrophobicContact CD2-CD1 4.36Å; L166-I169 PolarHBondContact O-N 2.91Å; I169-K171 VanDerWaalsContact C-N 3.33Å; I169-K171 PolarHBondContact O-N 3.4Å; I169-A172 PolarHBondContact O-N 3.34Å; I169-Y173 WeakPolarHBondContact O-CB 3.48Å; I169-Y173 PolarHBondContact O-N 3.26Å; I169-L181 HydrophobicContact CG2-CD2 4.21Å
170	M	97.9	Very high	96.2	Very high	54 Å²	54	54.6 Å²	54.6	27%	0.266	28%	0.283	S	S	.	.	H	α-helix	trans	-58	-46.7	177.4	-71.4	168.9	74	0	0	111.2	L166 Y173 E174 L181 L201	L166-M170 VanDerWaalsContact O-CG 3.26Å; L166-M170 WeakPolarHBondContact O-CG 3.48Å; L166-M170 PolarHBondContact O-N 3.47Å; M170-Y173 WeakPolarHBondContact O-CB 3.43Å; M170-Y173 PolarHBondContact O-N 3.28Å; M170-E174 PolarHBondContact O-N 2.97Å; M170-L181 HydrophobicContact CG-CD2 4.11Å; M170-L201 HydrophobicContact CE-CD2 4.38Å; M170-L201 HydrophobicContact CE-CG 4.22Å; M170-L201 HydrophobicContact CG-CD1 3.67Å; M170-L201 HydrophobicContact CG-CG 4.25Å; M170-L201 HydrophobicContact SD-CD1 3.75Å; M170-L201 HydrophobicContact SD-CG 3.86Å
171	K	98.1	Very high	96.3	Very high	110 Å²	110	54.4 Å²	54.4	48%	0.478	28%	0.281	S	S	.	.	H	α-helix	trans	-60.4	-47.7	176.2	179.2	-179.2	170.3	-175.4	0	111.9	R167 I169 Y173 E174 E175	R167-K171 WeakPolarHBondContact O-CB 3.17Å; R167-K171 PolarHBondContact O-N 3.05Å; R167-K171 VanDerWaalsContact O-N 3.1Å; I169-K171 VanDerWaalsContact C-N 3.33Å; I169-K171 PolarHBondContact O-N 3.4Å; K171-Y173 VanDerWaalsContact C-N 3.27Å; K171-Y173 PolarHBondContact O-N 2.75Å; K171-E174 PolarHBondContact O-N 2.86Å; K171-E175 WeakPolarHBondContact CE-OE1 3.36Å; K171-E175 IonicContact NZ-OE1 3.11Å; K171-E175 WeakPolarHBondContact O-CB 3.5Å; K171-E175 WeakPolarHBondContact O-CG 3.45Å; K171-E175 PolarHBondContact O-N 3.38Å
172	A	98.3	Very high	96.5	Very high	7 Å²	7	56.3 Å²	56.3	6%	0.058	29%	0.29	C	S	.	.	H	α-helix	trans	-62.4	-36.3	178.2	0	0	0	0	0	112.3	R134 A137 E168 I169 D176	R134-A172 HydrophobicContact CG-CB 3.82Å; A137-A172 HydrophobicContact CB-CB 4.12Å; E168-A172 VanDerWaalsContact O-CB 3.3Å; E168-A172 WeakPolarHBondContact O-CB 3.29Å; E168-A172 PolarHBondContact O-N 2.94Å; I169-A172 PolarHBondContact O-N 3.34Å; A172-D176 WeakPolarHBondContact O-CB 3.38Å; A172-D176 PolarHBondContact O-N 2.87Å; A172-D176 VanDerWaalsContact O-N 3.09Å
173	Y	98.7	Very high	96.7	Very high	2 Å²	2	58.9 Å²	58.9	1%	0.008	30%	0.297	C	S	.	.	H	α-helix	trans	-64.3	-50.6	177	-166	-77.3	0	0	0	111.4	A137 L140 H141 M144 I169 M170 K171 E175 D176 Y177 S179 L181 D184	A137-Y173 HydrophobicContact CB-CD2 4.09Å; A137-Y173 HydrophobicContact CB-CG 4.48Å; A137-Y173 WeakPolarHBondContact O-CD2 3.27Å; L140-Y173 HydrophobicContact CB-CD2 4.34Å; L140-Y173 HydrophobicContact CB-CE2 4.08Å; H141-Y173 HydrophobicContact CB-CE2 3.7Å; M144-Y173 HydrophobicContact CE-CE2 4.04Å; M144-Y173 VanDerWaalsContact CE-OH 3.26Å; M144-Y173 WeakPolarHBondContact CE-OH 3.41Å; I169-Y173 WeakPolarHBondContact O-CB 3.48Å; I169-Y173 PolarHBondContact O-N 3.26Å; M170-Y173 WeakPolarHBondContact O-CB 3.43Å; M170-Y173 PolarHBondContact O-N 3.28Å; K171-Y173 VanDerWaalsContact C-N 3.27Å; K171-Y173 PolarHBondContact O-N 2.75Å; Y173-E175 VanDerWaalsContact C-N 3.34Å; Y173-E175 PolarHBondContact O-N 3.34Å; Y173-D176 PolarHBondContact O-N 3.47Å; Y173-Y177 AromaticContact CD1-CD2 3.92Å; Y173-Y177 HydrophobicContact CD1-CD2 3.92Å; Y173-Y177 AromaticContact CD2-CD2 3.84Å; Y173-Y177 HydrophobicContact CD2-CD2 3.84Å; Y173-Y177 HydrophobicContact CD2-CE2 4.1Å; Y173-Y177 AromaticContact CE1-CD2 3.99Å; Y173-Y177 HydrophobicContact CE1-CD2 3.99Å; Y173-Y177 HydrophobicContact CE1-CG 4.41Å; Y173-Y177 AromaticContact CE2-CD2 3.93Å; Y173-Y177 HydrophobicContact CE2-CD2 3.93Å; Y173-Y177 HydrophobicContact CE2-CE2 4.27Å; Y173-Y177 AromaticContact CG-CD2 3.83Å; Y173-Y177 HydrophobicContact CG-CD2 3.83Å; Y173-Y177 HydrophobicContact CG-CE2 4.43Å; Y173-Y177 AromaticContact CZ-CD2 3.99Å; Y173-Y177 WeakPolarHBondContact O-CB 3.43Å; Y173-Y177 VanDerWaalsContact O-CD2 3.28Å; Y173-Y177 WeakPolarHBondContact O-CD2 3.47Å; Y173-Y177 PolarHBondContact O-N 2.74Å; Y173-S179 WeakPolarHBondContact CD1-O 3.39Å; Y173-L181 HydrophobicContact CD1-CB 3.88Å; Y173-L181 HydrophobicContact CD2-CB 4.27Å; Y173-L181 HydrophobicContact CD2-CD1 3.81Å; Y173-L181 HydrophobicContact CD2-CG 4.43Å; Y173-L181 HydrophobicContact CE1-CB 4.36Å; Y173-L181 HydrophobicContact CE2-CD1 3.72Å; Y173-L181 HydrophobicContact CG-CB 3.85Å; Y173-L181 HydrophobicContact CG-CD1 4.28Å; Y173-L181 HydrophobicContact CG-CG 4.49Å; Y173-D184 VanDerWaalsContact CE1-OD2 3.3Å; Y173-D184 WeakPolarHBondContact CE1-OD2 3.49Å; Y173-D184 PolarHBondContact OH-OD2 3.32Å
174	E	98.3	Very high	97.1	Very high	125 Å²	125	57.5 Å²	57.5	58%	0.584	29%	0.293	S	S	*	.	H	α-helix	trans	-63	-40.6	179	-169.4	179.7	178.4	0	0	111.7	M170 K171 D176 G178 S179	M170-E174 PolarHBondContact O-N 2.97Å; K171-E174 PolarHBondContact O-N 2.86Å; E174-D176 PolarHBondContact O-N 3.11Å; E174-G178 WeakPolarHBondContact O-CA 3.45Å; E174-G178 PolarHBondContact O-N 2.92Å; E174-S179 WeakPolarHBondContact CA-O 3.46Å
175	E	98.4	Very high	97.4	Very high	107 Å²	107	53 Å²	53	50%	0.5	27%	0.269	S	S	.	.	H	α-helix	trans	-61.1	-40.1	175.2	-77.1	178	-173.4	0	0	113.2	R134 K171 Y173	R134-E175 IonicContact CZ-OE2 3.3Å; R134-E175 IonicContact NH2-OE2 2.71Å; R134-E175 PolarHBondContact NH2-OE2 2.8Å; K171-E175 WeakPolarHBondContact CE-OE1 3.36Å; K171-E175 IonicContact NZ-OE1 3.11Å; K171-E175 WeakPolarHBondContact O-CB 3.5Å; K171-E175 WeakPolarHBondContact O-CG 3.45Å; K171-E175 PolarHBondContact O-N 3.38Å; Y173-E175 VanDerWaalsContact C-N 3.34Å; Y173-E175 PolarHBondContact O-N 3.34Å
176	D	97.8	Very high	97.6	Very high	58 Å²	58	55.4 Å²	55.4	31%	0.31	28%	0.28	S	S	.	.	H	α-helix	trans	-92	-26.4	-172	-74.4	-11.8	0	0	0	113.4	R134 A172 Y173 E174	R134-D176 IonicContact CZ-OD1 3.48Å; R134-D176 IonicContact CZ-OD2 3.67Å; R134-D176 IonicContact NH1-OD1 2.86Å; R134-D176 PolarHBondContact NH1-OD1 3.08Å; R134-D176 IonicContact NH1-OD2 3.24Å; R134-D176 PolarHBondContact NH1-OD2 2.48Å; R134-D176 IonicContact NH2-OD1 3.23Å; R134-D176 PolarHBondContact NH2-OD1 3.22Å; A172-D176 WeakPolarHBondContact O-CB 3.38Å; A172-D176 PolarHBondContact O-N 2.87Å; A172-D176 VanDerWaalsContact O-N 3.09Å; Y173-D176 PolarHBondContact O-N 3.47Å; E174-D176 PolarHBondContact O-N 3.11Å
177	Y	97.9	Very high	97.6	Very high	68 Å²	68	59.3 Å²	59.3	27%	0.267	31%	0.314	S	S	.	.	H	α-helix	trans	-119	-13.7	-174.1	-54.6	-63.3	0	0	0	114.5	A137 K138 H141 Y173 S179	A137-Y177 HydrophobicContact CB-CE2 4.39Å; K138-Y177 WeakPolarHBondContact CA-OH 3.24Å; K138-Y177 WeakPolarHBondContact CB-OH 3.43Å; H141-Y177 HydrophobicContact CB-CD1 4.31Å; H141-Y177 HydrophobicContact CB-CD2 3.94Å; H141-Y177 HydrophobicContact CB-CE1 3.96Å; H141-Y177 HydrophobicContact CB-CE2 3.57Å; H141-Y177 HydrophobicContact CB-CG 4.32Å; H141-Y177 AromaticContact CD2-CD1 3.5Å; H141-Y177 AromaticContact CD2-CE1 3.85Å; H141-Y177 AromaticContact CD2-CG 3.71Å; H141-Y177 AromaticContact CE1-CD1 3.78Å; H141-Y177 AromaticContact CE1-CE1 3.69Å; H141-Y177 AromaticContact CG-CD1 3.64Å; H141-Y177 AromaticContact CG-CE1 3.47Å; H141-Y177 VanDerWaalsContact CG-CE1 3.47Å; H141-Y177 AromaticContact CG-CE2 3.98Å; H141-Y177 AromaticContact CG-CG 3.97Å; H141-Y177 AromaticContact CG-CZ 3.68Å; H141-Y177 AromaticContact ND1-CD1 3.82Å; H141-Y177 AromaticContact ND1-CE1 3.38Å; H141-Y177 WeakPolarHBondContact ND1-CE1 3.43Å; H141-Y177 AromaticContact ND1-CZ 3.84Å; H141-Y177 AromaticContact NE2-CD1 3.63Å; Y173-Y177 AromaticContact CD1-CD2 3.92Å; Y173-Y177 HydrophobicContact CD1-CD2 3.92Å; Y173-Y177 AromaticContact CD2-CD2 3.84Å; Y173-Y177 HydrophobicContact CD2-CD2 3.84Å; Y173-Y177 HydrophobicContact CD2-CE2 4.1Å; Y173-Y177 AromaticContact CE1-CD2 3.99Å; Y173-Y177 HydrophobicContact CE1-CD2 3.99Å; Y173-Y177 HydrophobicContact CE1-CG 4.41Å; Y173-Y177 AromaticContact CE2-CD2 3.93Å; Y173-Y177 HydrophobicContact CE2-CD2 3.93Å; Y173-Y177 HydrophobicContact CE2-CE2 4.27Å; Y173-Y177 AromaticContact CG-CD2 3.83Å; Y173-Y177 HydrophobicContact CG-CD2 3.83Å; Y173-Y177 HydrophobicContact CG-CE2 4.43Å; Y173-Y177 AromaticContact CZ-CD2 3.99Å; Y173-Y177 WeakPolarHBondContact O-CB 3.43Å; Y173-Y177 VanDerWaalsContact O-CD2 3.28Å; Y173-Y177 WeakPolarHBondContact O-CD2 3.47Å; Y173-Y177 PolarHBondContact O-N 2.74Å; Y177-S179 PolarHBondContact O-N 3.47Å
178	G	97.4	Very high	97.7	Very high	70 Å²	70	56 Å²	56	72%	0.722	31%	0.305	S	S	*	.	S	Bend	trans	70.7	14.1	176.7	0	0	0	0	0	114.8	E174	E174-G178 WeakPolarHBondContact O-CA 3.45Å; E174-G178 PolarHBondContact O-N 2.92Å
179	S	96.7	Very high	97.7	Very high	31 Å²	31	52.8 Å²	52.8	22%	0.217	29%	0.291	C	S	.	.	S	Bend	trans	-127.7	156.1	174.8	53.5	0	0	0	0	110.6	Y173 E174 Y177 D184	Y173-S179 WeakPolarHBondContact CD1-O 3.39Å; E174-S179 WeakPolarHBondContact CA-O 3.46Å; Y177-S179 PolarHBondContact O-N 3.47Å; S179-D184 WeakPolarHBondContact CB-OD2 3.26Å; S179-D184 PolarHBondContact OG-OD2 3.05Å
180	S	97.8	Very high	97.5	Very high	34 Å²	34	57.2 Å²	57.2	24%	0.238	32%	0.322	C	S	.	.			trans	-74.4	130.3	172.2	171.7	0	0	0	0	110.1	E182 E183 D184	S180-E182 PolarHBondContact O-N 2.71Å; S180-E182 PolarHBondContact OG-N 3.31Å; S180-E183 PolarHBondContact O-N 3.25Å; S180-E183 VanDerWaalsContact O-N 3.14Å; S180-D184 PolarHBondContact O-N 2.89Å
181	L	98.1	Very high	97.5	Very high	2 Å²	2	56.7 Å²	56.7	1%	0.01	33%	0.331	C	S	.	.	H	α-helix	trans	-57.2	-32.8	172.9	174.5	59.2	0	0	0	112.2	L140 M144 I169 M170 Y173 I185 L201	L140-L181 HydrophobicContact CB-CD1 4.13Å; L140-L181 HydrophobicContact CD1-CD1 3.96Å; L140-L181 HydrophobicContact CD1-CD2 3.64Å; L140-L181 HydrophobicContact CD1-CG 4.48Å; M144-L181 HydrophobicContact CE-CD1 3.79Å; I169-L181 HydrophobicContact CG2-CD2 4.21Å; M170-L181 HydrophobicContact CG-CD2 4.11Å; Y173-L181 HydrophobicContact CD1-CB 3.88Å; Y173-L181 HydrophobicContact CD2-CB 4.27Å; Y173-L181 HydrophobicContact CD2-CD1 3.81Å; Y173-L181 HydrophobicContact CD2-CG 4.43Å; Y173-L181 HydrophobicContact CE1-CB 4.36Å; Y173-L181 HydrophobicContact CE2-CD1 3.72Å; Y173-L181 HydrophobicContact CG-CB 3.85Å; Y173-L181 HydrophobicContact CG-CD1 4.28Å; Y173-L181 HydrophobicContact CG-CG 4.49Å; L181-I185 HydrophobicContact CD1-CD1 3.94Å; L181-I185 HydrophobicContact CD1-CG1 4.2Å; L181-I185 HydrophobicContact CG-CD1 4.09Å; L181-I185 WeakPolarHBondContact O-CB 3.49Å; L181-I185 VanDerWaalsContact O-CG1 3.27Å; L181-I185 WeakPolarHBondContact O-CG1 3.3Å; L181-I185 PolarHBondContact O-N 3.36Å; L181-I185 VanDerWaalsContact O-N 3.11Å; L181-L201 HydrophobicContact CD2-CD1 3.77Å; L181-L201 HydrophobicContact CD2-CD2 4.45Å; L181-L201 HydrophobicContact CG-CD1 4.33Å; L181-L201 HydrophobicContact CG-CD2 4.11Å
182	E	97.6	Very high	97.4	Very high	42 Å²	42	55.3 Å²	55.3	20%	0.196	32%	0.323	C	S	.	.	H	α-helix	trans	-68.5	-44.1	177.6	-171.7	173	174.7	0	0	111.5	S180 I185 Q186 V198 L201 Q202	S180-E182 PolarHBondContact O-N 2.71Å; S180-E182 PolarHBondContact OG-N 3.31Å; E182-I185 PolarHBondContact O-N 3.06Å; E182-Q186 VanDerWaalsContact O-CG 3.31Å; E182-Q186 WeakPolarHBondContact O-CG 3.4Å; E182-Q186 PolarHBondContact O-N 3.33Å; E182-V198 HydrophobicContact CG-CG1 4.33Å; E182-V198 HydrophobicContact CG-CG2 4.48Å; E182-V198 WeakPolarHBondContact OE1-CG1 3.31Å; E182-L201 HydrophobicContact CB-CD2 3.64Å; E182-L201 HydrophobicContact CG-CD2 4.16Å; E182-Q202 PolarHBondContact OE1-NE2 3.41Å
183	E	97.6	Very high	97.3	Very high	123 Å²	123	55.5 Å²	55.5	58%	0.575	32%	0.323	S	S	*	.	H	α-helix	trans	-65.4	-41.5	179.4	-67.7	175.8	176.2	0	0	111	S180 I185 Q186 A187	S180-E183 PolarHBondContact O-N 3.25Å; S180-E183 VanDerWaalsContact O-N 3.14Å; E183-I185 PolarHBondContact O-N 2.68Å; E183-Q186 PolarHBondContact O-N 2.92Å; E183-A187 WeakPolarHBondContact O-CB 3.3Å; E183-A187 PolarHBondContact O-N 3.41Å
184	D	98	Very high	97.3	Very high	43 Å²	43	58.1 Å²	58.1	23%	0.23	34%	0.335	C	S	.	.	H	α-helix	trans	-66.6	-37.3	177.8	-72.8	-12.8	0	0	0	111.7	M144 Y173 S179 S180 A187 D188	M144-D184 HydrophobicContact CE-CB 3.93Å; M144-D184 HydrophobicContact SD-CB 4.22Å; Y173-D184 VanDerWaalsContact CE1-OD2 3.3Å; Y173-D184 WeakPolarHBondContact CE1-OD2 3.49Å; Y173-D184 PolarHBondContact OH-OD2 3.32Å; S179-D184 WeakPolarHBondContact CB-OD2 3.26Å; S179-D184 PolarHBondContact OG-OD2 3.05Å; S180-D184 PolarHBondContact O-N 2.89Å; D184-A187 PolarHBondContact O-N 3.16Å; D184-D188 VanDerWaalsContact O-CB 3.29Å; D184-D188 WeakPolarHBondContact O-CB 3.27Å; D184-D188 PolarHBondContact O-N 2.86Å
185	I	97.8	Very high	97.2	Very high	0 Å²	0	58 Å²	58	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-64.5	-43.1	172.3	-73.5	171.3	0	0	0	111	M144 I154 L158 L181 E182 E183 A187 D188 T189 L197 V198 L201	M144-I185 HydrophobicContact CE-CG1 4.43Å; M144-I185 HydrophobicContact SD-CG1 3.8Å; I154-I185 HydrophobicContact CG2-CD1 4.04Å; I154-I185 HydrophobicContact CG2-CG1 4.32Å; L158-I185 HydrophobicContact CD2-CD1 3.82Å; L181-I185 HydrophobicContact CD1-CD1 3.94Å; L181-I185 HydrophobicContact CD1-CG1 4.2Å; L181-I185 HydrophobicContact CG-CD1 4.09Å; L181-I185 WeakPolarHBondContact O-CB 3.49Å; L181-I185 VanDerWaalsContact O-CG1 3.27Å; L181-I185 WeakPolarHBondContact O-CG1 3.3Å; L181-I185 PolarHBondContact O-N 3.36Å; L181-I185 VanDerWaalsContact O-N 3.11Å; E182-I185 PolarHBondContact O-N 3.06Å; E183-I185 PolarHBondContact O-N 2.68Å; I185-A187 VanDerWaalsContact C-N 3.28Å; I185-A187 PolarHBondContact O-N 3.21Å; I185-D188 PolarHBondContact O-N 3.04Å; I185-T189 WeakPolarHBondContact O-CB 3.3Å; I185-T189 PolarHBondContact O-N 3.29Å; I185-T189 PolarHBondContact O-OG1 3.1Å; I185-L197 HydrophobicContact CG2-CB 3.87Å; I185-L197 HydrophobicContact CG2-CD1 4.24Å; I185-V198 HydrophobicContact CG2-CG2 4.32Å; I185-L201 HydrophobicContact CD1-CD2 4.27Å
186	Q	97.4	Very high	97.1	Very high	82 Å²	82	53 Å²	53	38%	0.383	31%	0.306	S	S	.	.	H	α-helix	trans	-65	-32.6	177.8	-74.7	172	-7.6	0	0	112.4	E182 E183 E194 V198	E182-Q186 VanDerWaalsContact O-CG 3.31Å; E182-Q186 WeakPolarHBondContact O-CG 3.4Å; E182-Q186 PolarHBondContact O-N 3.33Å; E183-Q186 PolarHBondContact O-N 2.92Å; Q186-E194 HydrophobicContact CG-CG 4.47Å; Q186-V198 HydrophobicContact CG-CG2 3.7Å
187	A	96.6	Very high	97.1	Very high	86 Å²	86	50.2 Å²	50.2	71%	0.711	29%	0.291	S	S	*	.	H	α-helix	trans	-77.5	-33.9	178.3	0	0	0	0	0	113	E183 D184 I185	E183-A187 WeakPolarHBondContact O-CB 3.3Å; E183-A187 PolarHBondContact O-N 3.41Å; D184-A187 PolarHBondContact O-N 3.16Å; I185-A187 VanDerWaalsContact C-N 3.28Å; I185-A187 PolarHBondContact O-N 3.21Å
188	D	96.1	Very high	97.1	Very high	54 Å²	54	47.7 Å²	47.7	29%	0.289	28%	0.282	S	S	.	.	H	α-helix	trans	-100.2	-10	-171.8	-153.9	55.1	0	0	0	113.7	M144 T149 D184 I185	M144-D188 WeakPolarHBondContact CA-OD2 3.38Å; M144-D188 HydrophobicContact CB-CB 4.33Å; M144-D188 HydrophobicContact CG-CB 4.26Å; M144-D188 HydrophobicContact SD-CB 4.43Å; T149-D188 VanDerWaalsContact CB-OD2 3.27Å; T149-D188 WeakPolarHBondContact CB-OD2 3.37Å; T149-D188 WeakPolarHBondContact CG2-OD2 3.46Å; T149-D188 PolarHBondContact OG1-O 3Å; T149-D188 PolarHBondContact OG1-OD2 3.46Å; D184-D188 VanDerWaalsContact O-CB 3.29Å; D184-D188 WeakPolarHBondContact O-CB 3.27Å; D184-D188 PolarHBondContact O-N 2.86Å; I185-D188 PolarHBondContact O-N 3.04Å
189	T	96.5	Very high	96.9	Very high	10 Å²	10	45.4 Å²	45.4	6%	0.061	26%	0.255	C	S	.	.			trans	-123.1	166.2	175.5	68.4	0	0	0	0	111.5	T149 I185 L193 E194 L197	T149-T189 HydrophobicContact CG2-CG2 4.44Å; I185-T189 WeakPolarHBondContact O-CB 3.3Å; I185-T189 PolarHBondContact O-N 3.29Å; I185-T189 PolarHBondContact O-OG1 3.1Å; T189-L193 HydrophobicContact CG2-CD2 4.44Å; T189-E194 VanDerWaalsContact OG1-CA 3.3Å; T189-E194 WeakPolarHBondContact OG1-CA 3.35Å; T189-E194 WeakPolarHBondContact OG1-CB 3.4Å; T189-L197 HydrophobicContact CG2-CD1 4.02Å
190	S	95.4	Very high	96.8	Very high	93 Å²	93	44.3 Å²	44.3	65%	0.65	25%	0.247	S	C	*	.			trans	-148.3	168.9	178	62.7	0	0	0	0	112.5	E194	S190-E194 PolarHBondContact O-N 2.77Å
191	G	96.4	Very high	96.5	Very high	44 Å²	44	42.9 Å²	42.9	45%	0.454	24%	0.237	S	C	.	.	H	α-helix	trans	68	-143.3	173.6	0	0	0	0	0	112.7	L193 R195	G191-L193 VanDerWaalsContact C-N 3.34Å; G191-R195 WeakPolarHBondContact O-CG 3.46Å; G191-R195 PolarHBondContact O-N 2.76Å
192	Y	96.5	Very high	96	Very high	80 Å²	80	47.8 Å²	47.8	31%	0.314	26%	0.259	S	S	.	.	H	α-helix	trans	-75	-23.2	-178.7	-69.6	-57.8	0	0	0	113.8	R195 I196 E236 M237 I240 L278	Y192-R195 PolarHBondContact O-N 3.4Å; Y192-I196 PolarHBondContact O-N 3.48Å; Y192-E236 HydrophobicContact CD1-CB 4.05Å; Y192-E236 HydrophobicContact CD2-CB 3.85Å; Y192-E236 HydrophobicContact CD2-CG 3.87Å; Y192-E236 HydrophobicContact CE1-CB 4.11Å; Y192-E236 HydrophobicContact CE2-CB 3.85Å; Y192-E236 HydrophobicContact CE2-CG 3.8Å; Y192-E236 WeakPolarHBondContact CE2-OE2 3.39Å; Y192-E236 HydrophobicContact CG-CB 3.93Å; Y192-E236 HydrophobicContact CG-CG 4.42Å; Y192-E236 PolarHBondContact OH-OE2 3.29Å; Y192-M237 HydrophobicContact CD1-CG 4.42Å; Y192-M237 HydrophobicContact CD1-SD 3.89Å; Y192-M237 HydrophobicContact CE1-CG 3.72Å; Y192-M237 HydrophobicContact CE1-SD 3.72Å; Y192-I240 HydrophobicContact CD1-CD1 3.96Å; Y192-I240 HydrophobicContact CG-CD1 4.4Å; Y192-L278 HydrophobicContact CD2-CD2 4.31Å; Y192-L278 HydrophobicContact CG-CD2 4.32Å
193	L	97.3	Very high	94.6	Very high	11 Å²	11	46.1 Å²	46.1	6%	0.058	25%	0.254	C	S	.	.	H	α-helix	trans	-63.6	-47.6	173.5	178.7	64.7	0	0	0	110.5	E151 I155 T189 G191 R195 I196 L197 A281	E151-L193 HydrophobicContact CB-CD2 4.16Å; E151-L193 HydrophobicContact CG-CD2 3.81Å; E151-L193 WeakPolarHBondContact OE1-CD2 3.37Å; I155-L193 HydrophobicContact CD1-CD1 4Å; I155-L193 HydrophobicContact CG1-CD1 4.18Å; T189-L193 HydrophobicContact CG2-CD2 4.44Å; G191-L193 VanDerWaalsContact C-N 3.34Å; L193-R195 VanDerWaalsContact C-N 3.29Å; L193-R195 PolarHBondContact O-N 2.91Å; L193-I196 HydrophobicContact CD1-CG2 4.27Å; L193-I196 WeakPolarHBondContact O-CG2 3.26Å; L193-I196 PolarHBondContact O-N 3.03Å; L193-L197 HydrophobicContact CD1-CD1 3.93Å; L193-L197 HydrophobicContact CD1-CD2 4.49Å; L193-L197 HydrophobicContact CD1-CG 4.05Å; L193-L197 HydrophobicContact CD2-CD1 4.46Å; L193-L197 HydrophobicContact CG-CD1 3.85Å; L193-L197 HydrophobicContact CG-CG 4.34Å; L193-L197 WeakPolarHBondContact O-CB 3.49Å; L193-L197 VanDerWaalsContact O-CG 3.23Å; L193-L197 WeakPolarHBondContact O-CG 3.5Å; L193-L197 PolarHBondContact O-N 3.28Å; L193-A281 HydrophobicContact CD1-CB 4.14Å
194	E	97.7	Very high	93	Very high	57 Å²	57	42.9 Å²	42.9	27%	0.266	25%	0.245	S	C	.	.	H	α-helix	trans	-53.4	-49.3	174.7	-175.1	-153.3	137.1	0	0	110.9	Q186 T189 S190 I196 L197 V198	Q186-E194 HydrophobicContact CG-CG 4.47Å; T189-E194 VanDerWaalsContact OG1-CA 3.3Å; T189-E194 WeakPolarHBondContact OG1-CA 3.35Å; T189-E194 WeakPolarHBondContact OG1-CB 3.4Å; S190-E194 PolarHBondContact O-N 2.77Å; E194-I196 PolarHBondContact O-N 3.49Å; E194-L197 PolarHBondContact O-N 3.08Å; E194-V198 HydrophobicContact CG-CG2 4.49Å; E194-V198 WeakPolarHBondContact O-CB 3.36Å; E194-V198 VanDerWaalsContact O-CG2 3.3Å; E194-V198 WeakPolarHBondContact O-CG2 3.48Å; E194-V198 PolarHBondContact O-N 3.4Å
195	R	96.5	Very high	91.5	Very high	124 Å²	124	43.4 Å²	43.4	47%	0.468	24%	0.243	S	C	.	.	H	α-helix	trans	-61.7	-43.3	-177.9	-66	-176.1	-175.4	-173.6	1.4	113.2	G191 Y192 L193 C199 M237 I240	G191-R195 WeakPolarHBondContact O-CG 3.46Å; G191-R195 PolarHBondContact O-N 2.76Å; Y192-R195 PolarHBondContact O-N 3.4Å; L193-R195 VanDerWaalsContact C-N 3.29Å; L193-R195 PolarHBondContact O-N 2.91Å; R195-C199 VanDerWaalsContact O-CB 3.23Å; R195-C199 WeakPolarHBondContact O-CB 3.33Å; R195-C199 PolarHBondContact O-N 2.95Å; R195-M237 WeakPolarHBondContact CD-SD 3.18Å; R195-M237 PolarHBondContact NH1-SD 3.38Å; R195-I240 HydrophobicContact CB-CD1 4.24Å
196	I	96.9	Very high	89.9	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-68.8	-40.2	179	-164	174.2	0	0	0	111.3	Y192 L193 E194 C199 L200 I240 C244 L278 A281 M282	Y192-I196 PolarHBondContact O-N 3.48Å; L193-I196 HydrophobicContact CD1-CG2 4.27Å; L193-I196 WeakPolarHBondContact O-CG2 3.26Å; L193-I196 PolarHBondContact O-N 3.03Å; E194-I196 PolarHBondContact O-N 3.49Å; I196-C199 PolarHBondContact O-N 3.23Å; I196-L200 HydrophobicContact CG1-CD1 4.47Å; I196-L200 VanDerWaalsContact O-CG 3.31Å; I196-L200 WeakPolarHBondContact O-CG 3.26Å; I196-L200 PolarHBondContact O-N 3.22Å; I196-I240 HydrophobicContact CB-CD1 4.24Å; I196-I240 HydrophobicContact CB-CG1 4Å; I196-I240 HydrophobicContact CB-CG2 4.12Å; I196-I240 HydrophobicContact CD1-CG1 4.36Å; I196-I240 HydrophobicContact CG1-CG1 4.24Å; I196-I240 HydrophobicContact CG1-CG2 4.21Å; I196-C244 VanDerWaalsContact CG1-SG 3.5Å; I196-L278 HydrophobicContact CG2-CD1 4.21Å; I196-A281 HydrophobicContact CD1-CB 4.07Å; I196-A281 HydrophobicContact CG2-CB 3.84Å; I196-M282 HydrophobicContact CD1-CG 3.92Å
197	L	97.5	Very high	88.4	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-65.8	-46.6	179.1	-65.9	176.5	0	0	0	111.5	I154 I155 L158 I185 T189 L193 E194 C199 L200 L201	I154-L197 HydrophobicContact CG2-CD1 3.92Å; I154-L197 HydrophobicContact CG2-CD2 4.09Å; I155-L197 HydrophobicContact CG1-CD2 4.01Å; L158-L197 HydrophobicContact CD2-CB 3.98Å; L158-L197 HydrophobicContact CD2-CD2 4.04Å; L158-L197 WeakPolarHBondContact CD2-O 3.31Å; I185-L197 HydrophobicContact CG2-CB 3.87Å; I185-L197 HydrophobicContact CG2-CD1 4.24Å; T189-L197 HydrophobicContact CG2-CD1 4.02Å; L193-L197 HydrophobicContact CD1-CD1 3.93Å; L193-L197 HydrophobicContact CD1-CD2 4.49Å; L193-L197 HydrophobicContact CD1-CG 4.05Å; L193-L197 HydrophobicContact CD2-CD1 4.46Å; L193-L197 HydrophobicContact CG-CD1 3.85Å; L193-L197 HydrophobicContact CG-CG 4.34Å; L193-L197 WeakPolarHBondContact O-CB 3.49Å; L193-L197 VanDerWaalsContact O-CG 3.23Å; L193-L197 WeakPolarHBondContact O-CG 3.5Å; L193-L197 PolarHBondContact O-N 3.28Å; E194-L197 PolarHBondContact O-N 3.08Å; L197-C199 VanDerWaalsContact C-N 3.3Å; L197-C199 PolarHBondContact O-N 2.77Å; L197-L200 PolarHBondContact O-N 3.1Å; L197-L201 WeakPolarHBondContact O-CB 3.41Å; L197-L201 PolarHBondContact O-N 3.18Å
198	V	96.3	Very high	86.9	Confident	15 Å²	15	51.4 Å²	51.4	9%	0.091	28%	0.281	C	S	.	.	H	α-helix	trans	-59.7	-42.6	174.7	171.5	0	0	0	0	110.8	E182 I185 Q186 E194 L200 L201 Q202	E182-V198 HydrophobicContact CG-CG1 4.33Å; E182-V198 HydrophobicContact CG-CG2 4.48Å; E182-V198 WeakPolarHBondContact OE1-CG1 3.31Å; I185-V198 HydrophobicContact CG2-CG2 4.32Å; Q186-V198 HydrophobicContact CG-CG2 3.7Å; E194-V198 HydrophobicContact CG-CG2 4.49Å; E194-V198 WeakPolarHBondContact O-CB 3.36Å; E194-V198 VanDerWaalsContact O-CG2 3.3Å; E194-V198 WeakPolarHBondContact O-CG2 3.48Å; E194-V198 PolarHBondContact O-N 3.4Å; V198-L200 PolarHBondContact O-N 3.41Å; V198-L201 PolarHBondContact O-N 3.02Å; V198-Q202 HydrophobicContact CG1-CG 4.31Å; V198-Q202 WeakPolarHBondContact O-CG 3.33Å; V198-Q202 PolarHBondContact O-N 2.98Å
199	C	94.4	Very high	85.5	Confident	22 Å²	22	51.5 Å²	51.5	15%	0.149	29%	0.286	C	S	.	.	H	α-helix	trans	-63.7	-40.6	178.9	-164	0	0	0	0	112.8	R195 I196 L197 I240 C244	R195-C199 VanDerWaalsContact O-CB 3.23Å; R195-C199 WeakPolarHBondContact O-CB 3.33Å; R195-C199 PolarHBondContact O-N 2.95Å; I196-C199 PolarHBondContact O-N 3.23Å; L197-C199 VanDerWaalsContact C-N 3.3Å; L197-C199 PolarHBondContact O-N 2.77Å; C199-I240 HydrophobicContact CB-CG2 4.33Å; C199-C244 HydrophobicContact CB-CB 3.85Å; C199-C244 WeakPolarHBondContact SG-CB 3.47Å
200	L	93.8	Very high	84	Confident	9 Å²	9	57.2 Å²	57.2	5%	0.047	33%	0.326	C	S	.	.	H	α-helix	trans	-64.1	-41.5	174.2	-70.8	171.1	0	0	0	111.6	L158 A159 L166 I196 L197 V198 G203 C244 V285	L158-L200 HydrophobicContact CB-CB 4.2Å; L158-L200 HydrophobicContact CB-CD1 4.26Å; A159-L200 HydrophobicContact CB-CD1 4.21Å; L166-L200 WeakPolarHBondContact CD1-O 3.43Å; I196-L200 HydrophobicContact CG1-CD1 4.47Å; I196-L200 VanDerWaalsContact O-CG 3.31Å; I196-L200 WeakPolarHBondContact O-CG 3.26Å; I196-L200 PolarHBondContact O-N 3.22Å; L197-L200 PolarHBondContact O-N 3.1Å; V198-L200 PolarHBondContact O-N 3.41Å; L200-G203 PolarHBondContact O-N 3.33Å; L200-C244 HydrophobicContact CD2-CB 4.29Å; L200-V285 HydrophobicContact CD1-CG2 3.98Å; L200-V285 HydrophobicContact CD2-CG2 3.97Å
201	L	92.6	Very high	83.4	Confident	4 Å²	4	60 Å²	60	2%	0.021	33%	0.327	C	S	.	.	H	α-helix	trans	-67.2	-44.3	-177.7	-171.1	67.7	0	0	0	112.7	L158 M170 L181 E182 I185 L197 V198 G203	L158-L201 HydrophobicContact CD2-CB 4.23Å; M170-L201 HydrophobicContact CE-CD2 4.38Å; M170-L201 HydrophobicContact CE-CG 4.22Å; M170-L201 HydrophobicContact CG-CD1 3.67Å; M170-L201 HydrophobicContact CG-CG 4.25Å; M170-L201 HydrophobicContact SD-CD1 3.75Å; M170-L201 HydrophobicContact SD-CG 3.86Å; L181-L201 HydrophobicContact CD2-CD1 3.77Å; L181-L201 HydrophobicContact CD2-CD2 4.45Å; L181-L201 HydrophobicContact CG-CD1 4.33Å; L181-L201 HydrophobicContact CG-CD2 4.11Å; E182-L201 HydrophobicContact CB-CD2 3.64Å; E182-L201 HydrophobicContact CG-CD2 4.16Å; I185-L201 HydrophobicContact CD1-CD2 4.27Å; L197-L201 WeakPolarHBondContact O-CB 3.41Å; L197-L201 PolarHBondContact O-N 3.18Å; V198-L201 PolarHBondContact O-N 3.02Å; L201-G203 PolarHBondContact O-N 3.22Å
202	Q	86.6	Confident	83.1	Confident	104 Å²	104	59.9 Å²	59.9	49%	0.486	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-13.8	178.3	-71.7	176.8	-6.7	0	0	112.7	E182 V198 S204	E182-Q202 PolarHBondContact OE1-NE2 3.41Å; V198-Q202 HydrophobicContact CG1-CG 4.31Å; V198-Q202 WeakPolarHBondContact O-CG 3.33Å; V198-Q202 PolarHBondContact O-N 2.98Å; Q202-S204 VanDerWaalsContact C-N 3.28Å; Q202-S204 PolarHBondContact O-N 2.98Å
203	G	68.8	Low	82.9	Confident	7 Å²	7	59.8 Å²	59.8	7%	0.072	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.5	33.2	168.5	0	0	0	0	0	112.6	K163 L200 L201 R205	K163-G203 WeakPolarHBondContact CD-O 3.34Å; K163-G203 WeakPolarHBondContact CE-O 3.43Å; K163-G203 PolarHBondContact NZ-O 3.22Å; L200-G203 PolarHBondContact O-N 3.33Å; L201-G203 PolarHBondContact O-N 3.22Å; G203-R205 PolarHBondContact O-N 3.45Å
204	S	63.1	Low	82.8	Confident	56 Å²	56	63 Å²	63	39%	0.392	34%	0.344	S	S	.	.			trans	-72	-3.8	176.2	-58.9	0	0	0	0	113.1	Q202 D206	Q202-S204 VanDerWaalsContact C-N 3.28Å; Q202-S204 PolarHBondContact O-N 2.98Å; S204-D206 PolarHBondContact O-N 2.98Å
205	R	68.5	Low	82.7	Confident	53 Å²	53	62.4 Å²	62.4	20%	0.2	35%	0.353	C	S	.	.	S	Bend	trans	-58.5	121.8	169.2	-79.7	-159.7	-46.1	-128.4	-8.9	109.3	R161 G203 D207 C244 T245	R161-R205 PolarHBondContact O-NH2 3.1Å; G203-R205 PolarHBondContact O-N 3.45Å; R205-D207 PolarHBondContact O-N 2.91Å; R205-C244 WeakPolarHBondContact CG-O 3.48Å; R205-C244 PolarHBondContact N-O 3.37Å; R205-T245 WeakPolarHBondContact CA-O 3.22Å
206	D	63.3	Low	82.7	Confident	104 Å²	104	59.8 Å²	59.8	56%	0.556	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-52	136.1	170	-70.6	-35.9	0	0	0	110	S204 T245 S247	S204-D206 PolarHBondContact O-N 2.98Å; D206-T245 PolarHBondContact N-O 3.25Å; D206-S247 WeakPolarHBondContact O-CB 3.36Å
207	D	66.6	Low	82.7	Confident	122 Å²	122	59.8 Å²	59.8	65%	0.652	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-55	149.9	170.1	-74.8	-36	0	0	0	109	R205 S209	R205-D207 PolarHBondContact O-N 2.91Å; D207-S209 VanDerWaalsContact C-N 3.32Å; D207-S209 PolarHBondContact O-N 2.99Å
208	V	64.8	Low	82.7	Confident	110 Å²	110	63.1 Å²	63.1	67%	0.667	37%	0.365	S	S	*	.			trans	-61.2	95.3	-176.1	-177.9	0	0	0	0	109.5	T249	V208-T249 HydrophobicContact CG1-CG2 3.77Å
209	S	66.9	Low	82.8	Confident	57 Å²	57	66.7 Å²	66.7	40%	0.399	38%	0.381	S	S	.	.			trans	-75.4	134.3	166.1	177.2	0	0	0	0	108.2	D207 F211 T249	D207-S209 VanDerWaalsContact C-N 3.32Å; D207-S209 PolarHBondContact O-N 2.99Å; S209-F211 PolarHBondContact O-N 3.08Å; S209-F211 PolarHBondContact OG-N 3.36Å; S209-F211 VanDerWaalsContact OG-N 3.09Å; S209-F211 PolarHBondContact OG-O 3.46Å; S209-T249 PolarHBondContact O-OG1 3.26Å; S209-T249 VanDerWaalsContact O-OG1 3.12Å
210	S	65	Low	83	Confident	129 Å²	129	65.9 Å²	65.9	90%	0.902	38%	0.375	S	S	*	.	S	Bend	trans	-68.5	-12.5	170	55.2	0	0	0	0	112.6
211	F	82.2	Confident	83.2	Confident	152 Å²	152	65.4 Å²	65.4	67%	0.667	37%	0.373	S	S	*	.			trans	-101.9	122.8	179.1	-171.1	-94.5	0	0	0	110.2	S209 D213	S209-F211 PolarHBondContact O-N 3.08Å; S209-F211 PolarHBondContact OG-N 3.36Å; S209-F211 VanDerWaalsContact OG-N 3.09Å; S209-F211 PolarHBondContact OG-O 3.46Å; F211-D213 HydrophobicContact CE1-CB 4.42Å
212	V	89.3	Confident	83.4	Confident	42 Å²	42	69.2 Å²	69.2	26%	0.255	39%	0.39	S	S	.	.			trans	-105.5	125.3	171.5	177.3	0	0	0	0	107.3	P214 A217 R253	V212-P214 VanDerWaalsContact O-CD 3.26Å; V212-P214 WeakPolarHBondContact O-CD 3.2Å; V212-A217 HydrophobicContact CG1-CB 4.4Å; V212-R253 HydrophobicContact CG1-CB 3.8Å; V212-R253 HydrophobicContact CG1-CG 4.01Å
213	D	92.4	Very high	83.9	Confident	77 Å²	77	66.5 Å²	66.5	41%	0.412	38%	0.379	S	S	.	.			trans	-77.1	110.8	172.6	-177.5	-29.7	0	0	0	108.9	F211 G215 L216 A217	F211-D213 HydrophobicContact CE1-CB 4.42Å; D213-G215 VanDerWaalsContact C-N 3.31Å; D213-G215 PolarHBondContact O-N 3.48Å; D213-G215 WeakPolarHBondContact OD1-CA 3.23Å; D213-G215 PolarHBondContact OD1-N 3.42Å; D213-L216 HydrophobicContact CB-CB 3.94Å; D213-L216 PolarHBondContact O-N 2.92Å; D213-L216 PolarHBondContact OD1-N 3.16Å; D213-A217 WeakPolarHBondContact O-CB 3.39Å; D213-A217 PolarHBondContact O-N 3.41Å
214	P	94.9	Very high	85.1	Confident	79 Å²	79	66.2 Å²	66.2	51%	0.513	38%	0.376	S	S	.	.	H	α-helix	trans	-68.9	-29.8	-176.2	29.2	-35	0	0	0	112.7	V212 L218	V212-P214 VanDerWaalsContact O-CD 3.26Å; V212-P214 WeakPolarHBondContact O-CD 3.2Å; P214-L218 WeakPolarHBondContact O-CB 3.43Å; P214-L218 PolarHBondContact O-N 3.04Å
215	G	97	Very high	86.6	Confident	45 Å²	45	66.4 Å²	66.4	46%	0.464	37%	0.368	S	S	.	.	H	α-helix	trans	-70.3	-45.1	178.2	0	0	0	0	0	110.8	D213 L218 Q219	D213-G215 VanDerWaalsContact C-N 3.31Å; D213-G215 PolarHBondContact O-N 3.48Å; D213-G215 WeakPolarHBondContact OD1-CA 3.23Å; D213-G215 PolarHBondContact OD1-N 3.42Å; G215-L218 PolarHBondContact O-N 3.35Å; G215-Q219 PolarHBondContact O-N 3.29Å
216	L	96.1	Very high	87.8	Confident	69 Å²	69	65.4 Å²	65.4	36%	0.361	37%	0.371	S	S	.	.	H	α-helix	trans	-65.4	-40.1	174.4	-177.7	61.8	0	0	0	111.9	D213 L218 Q219 D220	D213-L216 HydrophobicContact CB-CB 3.94Å; D213-L216 PolarHBondContact O-N 2.92Å; D213-L216 PolarHBondContact OD1-N 3.16Å; L216-L218 VanDerWaalsContact C-N 3.33Å; L216-L218 PolarHBondContact O-N 3.31Å; L216-Q219 PolarHBondContact O-N 2.91Å; L216-D220 PolarHBondContact O-N 3.29Å
217	A	97.2	Very high	89.1	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-63.6	-40.2	178	0	0	0	0	0	112.1	V212 D213 A221 H250 R253 V254	V212-A217 HydrophobicContact CG1-CB 4.4Å; D213-A217 WeakPolarHBondContact O-CB 3.39Å; D213-A217 PolarHBondContact O-N 3.41Å; A217-A221 WeakPolarHBondContact O-CB 3.33Å; A217-A221 PolarHBondContact O-N 2.96Å; A217-H250 PolarHBondContact N-CE1 3.34Å; A217-R253 HydrophobicContact CB-CB 4.15Å; A217-R253 HydrophobicContact CB-CG 3.65Å; A217-V254 HydrophobicContact CB-CG2 4.06Å
218	L	97.9	Very high	90	Very high	69 Å²	69	54.9 Å²	54.9	36%	0.361	32%	0.316	S	S	.	.	H	α-helix	trans	-64	-41.6	173.3	-178.6	64	0	0	0	111.5	P214 G215 L216 A221 Q222 E257 I261	P214-L218 WeakPolarHBondContact O-CB 3.43Å; P214-L218 PolarHBondContact O-N 3.04Å; G215-L218 PolarHBondContact O-N 3.35Å; L216-L218 VanDerWaalsContact C-N 3.33Å; L216-L218 PolarHBondContact O-N 3.31Å; L218-A221 PolarHBondContact O-N 3.27Å; L218-Q222 VanDerWaalsContact O-CG 3.31Å; L218-Q222 WeakPolarHBondContact O-CG 3.35Å; L218-Q222 PolarHBondContact O-N 3.39Å; L218-E257 HydrophobicContact CD1-CB 4.38Å; L218-E257 HydrophobicContact CD1-CG 4.49Å; L218-I261 HydrophobicContact CD1-CD1 3.9Å
219	Q	98.1	Very high	90.7	Very high	91 Å²	91	53.1 Å²	53.1	43%	0.425	30%	0.301	S	S	.	.	H	α-helix	trans	-63.6	-47.7	177	-174.8	62.8	59.2	0	0	111.6	G215 L216 A221 Q222 D223	G215-Q219 PolarHBondContact O-N 3.29Å; L216-Q219 PolarHBondContact O-N 2.91Å; Q219-A221 VanDerWaalsContact C-N 3.27Å; Q219-A221 PolarHBondContact O-N 3.41Å; Q219-Q222 WeakPolarHBondContact O-CB 3.36Å; Q219-Q222 PolarHBondContact O-N 3.05Å; Q219-Q222 VanDerWaalsContact O-N 3.14Å; Q219-D223 PolarHBondContact NE2-OD1 3.48Å; Q219-D223 WeakPolarHBondContact O-CB 3.4Å; Q219-D223 PolarHBondContact O-N 2.94Å
220	D	97.9	Very high	91.1	Very high	4 Å²	4	57.2 Å²	57.2	2%	0.021	31%	0.311	C	S	.	.	H	α-helix	trans	-60.3	-39	177.5	-75.7	-26.6	0	0	0	110.8	L216 D223 L224 I242 R246 H250 V254	L216-D220 PolarHBondContact O-N 3.29Å; D220-D223 PolarHBondContact O-N 2.96Å; D220-L224 WeakPolarHBondContact O-CG 3.49Å; D220-L224 PolarHBondContact O-N 3.27Å; D220-I242 HydrophobicContact CB-CD1 4.17Å; D220-I242 HydrophobicContact CB-CG2 4.24Å; D220-R246 IonicContact OD1-CZ 2.86Å; D220-R246 IonicContact OD1-NE 3.47Å; D220-R246 IonicContact OD1-NH2 3.27Å; D220-R246 PolarHBondContact OD1-NH2 2.94Å; D220-R246 IonicContact OD2-CZ 3.91Å; D220-R246 IonicContact OD2-NE 2.92Å; D220-R246 PolarHBondContact OD2-NE 3.44Å; D220-R246 IonicContact OD2-NH2 2.74Å; D220-H250 IonicContact OD2-CD2 2.65Å; D220-H250 IonicContact OD2-CE1 2.88Å; D220-H250 IonicContact OD2-NE2 3Å; D220-H250 PolarHBondContact OD2-NE2 3.26Å; D220-V254 HydrophobicContact CB-CG1 4.15Å; D220-V254 HydrophobicContact CB-CG2 3.79Å
221	A	97.8	Very high	91.4	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-64.5	-41.4	174.8	0	0	0	0	0	112.6	A217 L218 Q219 L224 Y225 V254 E257 I261	A217-A221 WeakPolarHBondContact O-CB 3.33Å; A217-A221 PolarHBondContact O-N 2.96Å; L218-A221 PolarHBondContact O-N 3.27Å; Q219-A221 VanDerWaalsContact C-N 3.27Å; Q219-A221 PolarHBondContact O-N 3.41Å; A221-L224 PolarHBondContact O-N 3.41Å; A221-Y225 WeakPolarHBondContact O-CB 3.49Å; A221-Y225 PolarHBondContact O-N 3.34Å; A221-V254 HydrophobicContact CB-CG1 4.22Å; A221-E257 HydrophobicContact CB-CB 3.72Å; A221-I261 HydrophobicContact CB-CD1 4.1Å
222	Q	96.9	Very high	90.9	Very high	84 Å²	84	61.1 Å²	61.1	39%	0.393	31%	0.308	S	S	.	.	H	α-helix	trans	-65.1	-39.7	174.6	-73.1	175.3	-0.6	0	0	112.1	L218 Q219 Y225 A226 I261	L218-Q222 VanDerWaalsContact O-CG 3.31Å; L218-Q222 WeakPolarHBondContact O-CG 3.35Å; L218-Q222 PolarHBondContact O-N 3.39Å; Q219-Q222 WeakPolarHBondContact O-CB 3.36Å; Q219-Q222 PolarHBondContact O-N 3.05Å; Q219-Q222 VanDerWaalsContact O-N 3.14Å; Q222-Y225 PolarHBondContact O-N 2.54Å; Q222-A226 WeakPolarHBondContact O-CB 3.23Å; Q222-A226 PolarHBondContact O-N 3.25Å; Q222-I261 HydrophobicContact CG-CD1 3.8Å
223	D	96.4	Very high	89.9	Confident	47 Å²	47	61.3 Å²	61.3	25%	0.251	32%	0.319	S	S	.	.	H	α-helix	trans	-64.1	-44.8	176.9	-82.9	19.8	0	0	0	111	Q219 D220 A226 A227 K238 I242	Q219-D223 PolarHBondContact NE2-OD1 3.48Å; Q219-D223 WeakPolarHBondContact O-CB 3.4Å; Q219-D223 PolarHBondContact O-N 2.94Å; D220-D223 PolarHBondContact O-N 2.96Å; D223-A226 PolarHBondContact O-N 3.48Å; D223-A227 WeakPolarHBondContact O-CB 3.39Å; D223-A227 PolarHBondContact O-N 3.04Å; D223-K238 HydrophobicContact CB-CD 4.21Å; D223-K238 HydrophobicContact CB-CG 4.32Å; D223-K238 IonicContact OD2-NZ 2.68Å; D223-I242 HydrophobicContact CB-CD1 4.12Å
224	L	95.8	Very high	89.4	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-61.5	-44.1	174.2	-71.7	174.8	0	0	0	111.6	D220 A221 A226 A227 G228 F239 I242 V254 Y258 I266	D220-L224 WeakPolarHBondContact O-CG 3.49Å; D220-L224 PolarHBondContact O-N 3.27Å; A221-L224 PolarHBondContact O-N 3.41Å; L224-A226 VanDerWaalsContact C-N 3.33Å; L224-A226 PolarHBondContact O-N 2.69Å; L224-A227 PolarHBondContact O-N 2.74Å; L224-G228 PolarHBondContact O-N 3.32Å; L224-G228 VanDerWaalsContact O-N 3.09Å; L224-F239 HydrophobicContact CD2-CB 4.4Å; L224-F239 HydrophobicContact CD2-CD1 3.76Å; L224-F239 HydrophobicContact CD2-CD2 4.13Å; L224-F239 HydrophobicContact CD2-CE1 3.98Å; L224-F239 HydrophobicContact CD2-CE2 4.32Å; L224-F239 HydrophobicContact CD2-CG 3.83Å; L224-F239 HydrophobicContact CD2-CZ 4.25Å; L224-I242 HydrophobicContact CD1-CG2 4.19Å; L224-I242 HydrophobicContact CD2-CB 4.31Å; L224-I242 HydrophobicContact CD2-CD1 3.84Å; L224-I242 HydrophobicContact CG-CD1 3.78Å; L224-I242 HydrophobicContact CG-CG2 4.46Å; L224-V254 HydrophobicContact CD1-CG1 3.7Å; L224-Y258 HydrophobicContact CB-CD2 3.77Å; L224-Y258 HydrophobicContact CB-CE2 3.8Å; L224-I266 HydrophobicContact CD1-CD1 4.15Å
225	Y	94.6	Very high	89.2	Confident	60 Å²	60	57.9 Å²	57.9	24%	0.235	30%	0.297	C	S	.	.	H	α-helix	trans	-64.1	-39.8	178.3	179	-113.8	0	0	0	111.7	A221 Q222 E229 K230 I261 A262	A221-Y225 WeakPolarHBondContact O-CB 3.49Å; A221-Y225 PolarHBondContact O-N 3.34Å; Q222-Y225 PolarHBondContact O-N 2.54Å; Y225-E229 HydrophobicContact CD2-CB 3.75Å; Y225-E229 HydrophobicContact CD2-CG 3.91Å; Y225-E229 HydrophobicContact CE2-CB 3.47Å; Y225-E229 VanDerWaalsContact CE2-CB 3.47Å; Y225-E229 HydrophobicContact CE2-CG 3.86Å; Y225-E229 PolarHBondContact O-N 3.27Å; Y225-K230 HydrophobicContact CD1-CD 4.43Å; Y225-K230 HydrophobicContact CD1-CG 4.33Å; Y225-K230 HydrophobicContact CE1-CD 4.3Å; Y225-K230 HydrophobicContact CE1-CG 4.05Å; Y225-K230 PolarHBondContact O-N 3.49Å; Y225-I261 HydrophobicContact CD1-CG2 3.74Å; Y225-I261 HydrophobicContact CE1-CG2 4.18Å; Y225-I261 HydrophobicContact CG-CG2 3.97Å; Y225-A262 HydrophobicContact CD2-CB 3.57Å; Y225-A262 HydrophobicContact CE2-CB 3.83Å
226	A	93.6	Very high	88.9	Confident	32 Å²	32	58 Å²	58	26%	0.264	29%	0.285	S	S	.	.	H	α-helix	trans	-68.3	-36.1	175.1	0	0	0	0	0	112.6	Q222 D223 L224 K230 I231	Q222-A226 WeakPolarHBondContact O-CB 3.23Å; Q222-A226 PolarHBondContact O-N 3.25Å; D223-A226 PolarHBondContact O-N 3.48Å; L224-A226 VanDerWaalsContact C-N 3.33Å; L224-A226 PolarHBondContact O-N 2.69Å; A226-K230 HydrophobicContact CB-CD 4.29Å; A226-I231 WeakPolarHBondContact O-CD1 3.46Å; A226-I231 WeakPolarHBondContact O-CG1 3.45Å
227	A	90.5	Very high	88.8	Confident	4 Å²	4	57.6 Å²	57.6	3%	0.033	28%	0.282	C	S	.	.	H	α-helix	trans	-71.5	-28.2	-179.2	0	0	0	0	0	113.9	D223 L224 T234 D235 K238 F239	D223-A227 WeakPolarHBondContact O-CB 3.39Å; D223-A227 PolarHBondContact O-N 3.04Å; L224-A227 PolarHBondContact O-N 2.74Å; A227-T234 CarbonylContact O-C 3.37Å; A227-T234 WeakPolarHBondContact O-CA 3.27Å; A227-D235 HydrophobicContact CB-CB 3.87Å; A227-D235 PolarHBondContact O-N 2.68Å; A227-K238 HydrophobicContact CB-CB 3.82Å; A227-K238 HydrophobicContact CB-CG 3.96Å; A227-F239 HydrophobicContact CB-CD2 4.12Å; A227-F239 HydrophobicContact CB-CE2 3.87Å
228	G	85.4	Confident	88.7	Confident	1 Å²	1	61.1 Å²	61.1	1%	0.01	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	-74.5	175.8	0	0	0	0	0	112.3	L224 K230	L224-G228 PolarHBondContact O-N 3.32Å; L224-G228 VanDerWaalsContact O-N 3.09Å; G228-K230 VanDerWaalsContact C-N 3.33Å; G228-K230 PolarHBondContact O-N 2.96Å
229	E	79.6	Confident	88.5	Confident	74 Å²	74	58 Å²	58	35%	0.346	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-13.6	-162.5	-60.8	-76.7	161.7	0	0	114.6	Y225 K264	Y225-E229 HydrophobicContact CD2-CB 3.75Å; Y225-E229 HydrophobicContact CD2-CG 3.91Å; Y225-E229 HydrophobicContact CE2-CB 3.47Å; Y225-E229 VanDerWaalsContact CE2-CB 3.47Å; Y225-E229 HydrophobicContact CE2-CG 3.86Å; Y225-E229 PolarHBondContact O-N 3.27Å; E229-K264 IonicContact OE1-NZ 3.6Å; E229-K264 PolarHBondContact OE1-NZ 3.41Å
230	K	74.3	Confident	88.3	Confident	143 Å²	143	53.8 Å²	53.8	62%	0.622	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-9.8	-178.8	-71.3	-167	177.5	177	0	115.2	Y225 A226 G228	Y225-K230 HydrophobicContact CD1-CD 4.43Å; Y225-K230 HydrophobicContact CD1-CG 4.33Å; Y225-K230 HydrophobicContact CE1-CD 4.3Å; Y225-K230 HydrophobicContact CE1-CG 4.05Å; Y225-K230 PolarHBondContact O-N 3.49Å; A226-K230 HydrophobicContact CB-CD 4.29Å; G228-K230 VanDerWaalsContact C-N 3.33Å; G228-K230 PolarHBondContact O-N 2.96Å
231	I	72.5	Confident	88.1	Confident	107 Å²	107	56.6 Å²	56.6	55%	0.549	28%	0.279	S	S	.	.	S	Bend	trans	-123.6	155.1	-171.8	-57	171.8	0	0	0	109.2	A226 G233	A226-I231 WeakPolarHBondContact O-CD1 3.46Å; A226-I231 WeakPolarHBondContact O-CG1 3.45Å; I231-G233 CarbonylContact C-O 3.55Å; I231-G233 PolarHBondContact O-N 3.37Å
232	R	70.2	Confident	88	Confident	255 Å²	255	56.7 Å²	56.7	96%	0.962	28%	0.28	S	S	*	.	S	Bend	trans	-79.1	101.7	169.2	-173.6	179.4	-178.6	178.4	0.4	108.5
233	G	69.2	Low	87.9	Confident	46 Å²	46	52.7 Å²	52.7	47%	0.474	26%	0.261	S	S	.	.	S	Bend	trans	94.3	168	-169.1	0	0	0	0	0	111.2	I231	I231-G233 CarbonylContact C-O 3.55Å; I231-G233 PolarHBondContact O-N 3.37Å
234	T	82.6	Confident	87.6	Confident	18 Å²	18	50.4 Å²	50.4	11%	0.11	25%	0.249	C	C	.	.			trans	-107.2	141.2	-168.9	-40.1	0	0	0	0	110.8	A227 E236 F239 E273	A227-T234 CarbonylContact O-C 3.37Å; A227-T234 WeakPolarHBondContact O-CA 3.27Å; T234-E236 PolarHBondContact O-N 3.06Å; T234-F239 HydrophobicContact CG2-CD2 4.03Å; T234-F239 HydrophobicContact CG2-CE2 3.84Å; T234-E273 HydrophobicContact CG2-CB 3.89Å; T234-E273 HydrophobicContact CG2-CG 4.41Å; T234-E273 VanDerWaalsContact OG1-CB 3.29Å; T234-E273 WeakPolarHBondContact OG1-CB 3.05Å; T234-E273 PolarHBondContact OG1-O 3.08Å; T234-E273 VanDerWaalsContact OG1-O 3.13Å; T234-E273 PolarHBondContact OG1-OE2 3.24Å
235	D	89.3	Confident	87.4	Confident	67 Å²	67	51.8 Å²	51.8	36%	0.358	26%	0.257	S	S	.	.			trans	-84	85	163.7	179.9	-9.6	0	0	0	108.8	A227 M237 K238 F239	A227-D235 HydrophobicContact CB-CB 3.87Å; A227-D235 PolarHBondContact O-N 2.68Å; D235-M237 PolarHBondContact O-N 3.06Å; D235-M237 PolarHBondContact OD1-N 3.14Å; D235-K238 HydrophobicContact CB-CB 4.26Å; D235-K238 WeakPolarHBondContact O-CB 3.21Å; D235-K238 PolarHBondContact O-N 3.48Å; D235-K238 PolarHBondContact OD1-N 2.86Å; D235-K238 VanDerWaalsContact OD1-N 3.08Å; D235-F239 PolarHBondContact O-N 2.93Å
236	E	91.5	Very high	87.3	Confident	46 Å²	46	51.4 Å²	51.4	22%	0.215	26%	0.255	C	S	.	.	H	α-helix	trans	-63.5	-29.8	-175.1	-53.9	90.5	160.4	0	0	111.9	Y192 T234 K238 F239 I240 L278 M282	Y192-E236 HydrophobicContact CD1-CB 4.05Å; Y192-E236 HydrophobicContact CD2-CB 3.85Å; Y192-E236 HydrophobicContact CD2-CG 3.87Å; Y192-E236 HydrophobicContact CE1-CB 4.11Å; Y192-E236 HydrophobicContact CE2-CB 3.85Å; Y192-E236 HydrophobicContact CE2-CG 3.8Å; Y192-E236 WeakPolarHBondContact CE2-OE2 3.39Å; Y192-E236 HydrophobicContact CG-CB 3.93Å; Y192-E236 HydrophobicContact CG-CG 4.42Å; Y192-E236 PolarHBondContact OH-OE2 3.29Å; T234-E236 PolarHBondContact O-N 3.06Å; E236-K238 VanDerWaalsContact C-N 3.33Å; E236-K238 PolarHBondContact O-N 2.8Å; E236-F239 PolarHBondContact O-N 3.33Å; E236-I240 VanDerWaalsContact O-CG1 3.22Å; E236-I240 WeakPolarHBondContact O-CG1 3.23Å; E236-I240 PolarHBondContact O-N 3.14Å; E236-L278 HydrophobicContact CB-CD2 4.22Å; E236-L278 HydrophobicContact CG-CD2 3.98Å; E236-M282 HydrophobicContact CB-CE 4.47Å
237	M	93.5	Very high	87.1	Confident	61 Å²	61	50.2 Å²	50.2	30%	0.3	25%	0.245	S	C	.	.	H	α-helix	trans	-66.4	-35.7	177.9	-74.9	-54.3	-58	0	0	112.5	Y192 R195 D235 I240 T241	Y192-M237 HydrophobicContact CD1-CG 4.42Å; Y192-M237 HydrophobicContact CD1-SD 3.89Å; Y192-M237 HydrophobicContact CE1-CG 3.72Å; Y192-M237 HydrophobicContact CE1-SD 3.72Å; R195-M237 WeakPolarHBondContact CD-SD 3.18Å; R195-M237 PolarHBondContact NH1-SD 3.38Å; D235-M237 PolarHBondContact O-N 3.06Å; D235-M237 PolarHBondContact OD1-N 3.14Å; M237-I240 PolarHBondContact O-N 2.94Å; M237-I240 HydrophobicContact SD-CD1 4.17Å; M237-T241 WeakPolarHBondContact O-CB 3.31Å; M237-T241 PolarHBondContact O-N 2.95Å; M237-T241 PolarHBondContact O-OG1 2.89Å
238	K	94.4	Very high	87.1	Confident	75 Å²	75	51.7 Å²	51.7	33%	0.326	26%	0.257	S	S	.	.	H	α-helix	trans	-63.3	-45.2	175.3	-168.8	63.3	58	165.1	0	111.2	D223 A227 D235 E236 T241 I242	D223-K238 HydrophobicContact CB-CD 4.21Å; D223-K238 HydrophobicContact CB-CG 4.32Å; D223-K238 IonicContact OD2-NZ 2.68Å; A227-K238 HydrophobicContact CB-CB 3.82Å; A227-K238 HydrophobicContact CB-CG 3.96Å; D235-K238 HydrophobicContact CB-CB 4.26Å; D235-K238 WeakPolarHBondContact O-CB 3.21Å; D235-K238 PolarHBondContact O-N 3.48Å; D235-K238 PolarHBondContact OD1-N 2.86Å; D235-K238 VanDerWaalsContact OD1-N 3.08Å; E236-K238 VanDerWaalsContact C-N 3.33Å; E236-K238 PolarHBondContact O-N 2.8Å; K238-T241 PolarHBondContact O-N 3.21Å; K238-I242 HydrophobicContact CD-CD1 4.12Å; K238-I242 HydrophobicContact CG-CD1 4.11Å; K238-I242 WeakPolarHBondContact O-CG1 3.5Å; K238-I242 PolarHBondContact O-N 3.47Å; K238-I242 VanDerWaalsContact O-N 3.11Å
239	F	94.7	Very high	87.4	Confident	2 Å²	2	53.9 Å²	53.9	1%	0.009	27%	0.271	C	S	.	.	H	α-helix	trans	-58.4	-51.6	174.1	-84.3	-100.3	0	0	0	111.5	L224 A227 T234 D235 E236 T241 I242 L243 I266 I270 M282	L224-F239 HydrophobicContact CD2-CB 4.4Å; L224-F239 HydrophobicContact CD2-CD1 3.76Å; L224-F239 HydrophobicContact CD2-CD2 4.13Å; L224-F239 HydrophobicContact CD2-CE1 3.98Å; L224-F239 HydrophobicContact CD2-CE2 4.32Å; L224-F239 HydrophobicContact CD2-CG 3.83Å; L224-F239 HydrophobicContact CD2-CZ 4.25Å; A227-F239 HydrophobicContact CB-CD2 4.12Å; A227-F239 HydrophobicContact CB-CE2 3.87Å; T234-F239 HydrophobicContact CG2-CD2 4.03Å; T234-F239 HydrophobicContact CG2-CE2 3.84Å; D235-F239 PolarHBondContact O-N 2.93Å; E236-F239 PolarHBondContact O-N 3.33Å; F239-T241 VanDerWaalsContact C-N 3.33Å; F239-T241 PolarHBondContact O-N 2.98Å; F239-I242 PolarHBondContact O-N 3.37Å; F239-L243 VanDerWaalsContact O-CB 3.29Å; F239-L243 WeakPolarHBondContact O-CB 3.36Å; F239-L243 VanDerWaalsContact O-CG 3.27Å; F239-L243 WeakPolarHBondContact O-CG 3.33Å; F239-L243 PolarHBondContact O-N 3.45Å; F239-I266 HydrophobicContact CE1-CD1 3.88Å; F239-I270 HydrophobicContact CD1-CG1 4.31Å; F239-I270 HydrophobicContact CE1-CG1 4.1Å; F239-M282 HydrophobicContact CB-CE 3.54Å; F239-M282 HydrophobicContact CB-SD 4.02Å; F239-M282 HydrophobicContact CD1-SD 4.22Å; F239-M282 HydrophobicContact CG-CE 4.35Å; F239-M282 HydrophobicContact CG-SD 4.36Å
240	I	94.3	Very high	88.2	Confident	4 Å²	4	50.9 Å²	50.9	2%	0.021	26%	0.256	C	S	.	.	H	α-helix	trans	-57.4	-47.6	-179.6	-67.8	168.3	0	0	0	111	Y192 R195 I196 C199 E236 M237 I242 C244 L278 M282	Y192-I240 HydrophobicContact CD1-CD1 3.96Å; Y192-I240 HydrophobicContact CG-CD1 4.4Å; R195-I240 HydrophobicContact CB-CD1 4.24Å; I196-I240 HydrophobicContact CB-CD1 4.24Å; I196-I240 HydrophobicContact CB-CG1 4Å; I196-I240 HydrophobicContact CB-CG2 4.12Å; I196-I240 HydrophobicContact CD1-CG1 4.36Å; I196-I240 HydrophobicContact CG1-CG1 4.24Å; I196-I240 HydrophobicContact CG1-CG2 4.21Å; C199-I240 HydrophobicContact CB-CG2 4.33Å; E236-I240 VanDerWaalsContact O-CG1 3.22Å; E236-I240 WeakPolarHBondContact O-CG1 3.23Å; E236-I240 PolarHBondContact O-N 3.14Å; M237-I240 PolarHBondContact O-N 2.94Å; M237-I240 HydrophobicContact SD-CD1 4.17Å; I240-I242 PolarHBondContact O-N 2.92Å; I240-C244 VanDerWaalsContact O-CB 3.24Å; I240-C244 WeakPolarHBondContact O-CB 3.44Å; I240-C244 PolarHBondContact O-N 3.46Å; I240-C244 PolarHBondContact O-SG 3.01Å; I240-L278 HydrophobicContact CD1-CD1 4.41Å; I240-M282 HydrophobicContact CG1-CE 3.98Å
241	T	93.8	Very high	89.2	Confident	62 Å²	62	44.1 Å²	44.1	38%	0.38	23%	0.227	S	C	.	.	H	α-helix	trans	-60.3	-49.6	-177.8	-57	0	0	0	0	111.1	M237 K238 F239 T245	M237-T241 WeakPolarHBondContact O-CB 3.31Å; M237-T241 PolarHBondContact O-N 2.95Å; M237-T241 PolarHBondContact O-OG1 2.89Å; K238-T241 PolarHBondContact O-N 3.21Å; F239-T241 VanDerWaalsContact C-N 3.33Å; F239-T241 PolarHBondContact O-N 2.98Å; T241-T245 WeakPolarHBondContact O-CB 3.44Å; T241-T245 VanDerWaalsContact O-CG2 3.29Å; T241-T245 WeakPolarHBondContact O-CG2 3.33Å; T241-T245 PolarHBondContact O-N 3.31Å; T241-T245 VanDerWaalsContact O-N 3.15Å; T241-T245 PolarHBondContact O-OG1 3.02Å
242	I	94.9	Very high	90.3	Very high	2 Å²	2	42.2 Å²	42.2	1%	0.01	22%	0.217	C	C	.	.	H	α-helix	trans	-66.9	-49.3	-178	-67.4	170.4	0	0	0	110.3	D220 D223 L224 K238 F239 I240 C244 R246 L251	D220-I242 HydrophobicContact CB-CD1 4.17Å; D220-I242 HydrophobicContact CB-CG2 4.24Å; D223-I242 HydrophobicContact CB-CD1 4.12Å; L224-I242 HydrophobicContact CD1-CG2 4.19Å; L224-I242 HydrophobicContact CD2-CB 4.31Å; L224-I242 HydrophobicContact CD2-CD1 3.84Å; L224-I242 HydrophobicContact CG-CD1 3.78Å; L224-I242 HydrophobicContact CG-CG2 4.46Å; K238-I242 HydrophobicContact CD-CD1 4.12Å; K238-I242 HydrophobicContact CG-CD1 4.11Å; K238-I242 WeakPolarHBondContact O-CG1 3.5Å; K238-I242 PolarHBondContact O-N 3.47Å; K238-I242 VanDerWaalsContact O-N 3.11Å; F239-I242 PolarHBondContact O-N 3.37Å; I240-I242 PolarHBondContact O-N 2.92Å; I242-C244 VanDerWaalsContact C-N 3.31Å; I242-C244 PolarHBondContact O-N 2.86Å; I242-R246 HydrophobicContact CG2-CG 4.23Å; I242-R246 WeakPolarHBondContact O-CB 3.4Å; I242-R246 VanDerWaalsContact O-CG 3.3Å; I242-R246 WeakPolarHBondContact O-CG 3.5Å; I242-R246 PolarHBondContact O-N 3.41Å; I242-L251 HydrophobicContact CG2-CD2 3.96Å
243	L	94.6	Very high	91.5	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-64.5	-30.5	-176.3	-70.2	175.5	0	0	0	113.7	F239 L251 F255 M282 V285 V286	F239-L243 VanDerWaalsContact O-CB 3.29Å; F239-L243 WeakPolarHBondContact O-CB 3.36Å; F239-L243 VanDerWaalsContact O-CG 3.27Å; F239-L243 WeakPolarHBondContact O-CG 3.33Å; F239-L243 PolarHBondContact O-N 3.45Å; L243-L251 HydrophobicContact CD2-CD2 4.43Å; L243-F255 HydrophobicContact CD2-CE1 3.88Å; L243-F255 HydrophobicContact CD2-CZ 3.9Å; L243-M282 HydrophobicContact CD1-CB 4.11Å; L243-M282 HydrophobicContact CD1-CG 4.03Å; L243-M282 HydrophobicContact CD1-SD 4.49Å; L243-V285 HydrophobicContact CB-CG1 4.14Å; L243-V286 HydrophobicContact CD2-CG2 4.06Å
244	C	91.7	Very high	92.9	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-100.7	-16	-173.9	-59.1	0	0	0	0	114.5	I196 C199 L200 R205 I240 I242	I196-C244 VanDerWaalsContact CG1-SG 3.5Å; C199-C244 HydrophobicContact CB-CB 3.85Å; C199-C244 WeakPolarHBondContact SG-CB 3.47Å; L200-C244 HydrophobicContact CD2-CB 4.29Å; R205-C244 WeakPolarHBondContact CG-O 3.48Å; R205-C244 PolarHBondContact N-O 3.37Å; I240-C244 VanDerWaalsContact O-CB 3.24Å; I240-C244 WeakPolarHBondContact O-CB 3.44Å; I240-C244 PolarHBondContact O-N 3.46Å; I240-C244 PolarHBondContact O-SG 3.01Å; I242-C244 VanDerWaalsContact C-N 3.31Å; I242-C244 PolarHBondContact O-N 2.86Å
245	T	90.1	Very high	93.6	Very high	28 Å²	28	31.8 Å²	31.8	17%	0.172	16%	0.162	C	C	.	.	H	α-helix	trans	-107.3	-26.4	-177.3	66.6	0	0	0	0	113.6	R205 D206 T241	R205-T245 WeakPolarHBondContact CA-O 3.22Å; D206-T245 PolarHBondContact N-O 3.25Å; T241-T245 WeakPolarHBondContact O-CB 3.44Å; T241-T245 VanDerWaalsContact O-CG2 3.29Å; T241-T245 WeakPolarHBondContact O-CG2 3.33Å; T241-T245 PolarHBondContact O-N 3.31Å; T241-T245 VanDerWaalsContact O-N 3.15Å; T241-T245 PolarHBondContact O-OG1 3.02Å
246	R	92.6	Very high	94	Very high	53 Å²	53	33.1 Å²	33.1	20%	0.2	17%	0.166	C	C	.	.	S	Bend	trans	-78.1	149.5	179.5	-61.5	-61.4	-175.6	-96.3	-6	111.6	D220 I242 H250 L251	D220-R246 IonicContact OD1-CZ 2.86Å; D220-R246 IonicContact OD1-NE 3.47Å; D220-R246 IonicContact OD1-NH2 3.27Å; D220-R246 PolarHBondContact OD1-NH2 2.94Å; D220-R246 IonicContact OD2-CZ 3.91Å; D220-R246 IonicContact OD2-NE 2.92Å; D220-R246 PolarHBondContact OD2-NE 3.44Å; D220-R246 IonicContact OD2-NH2 2.74Å; I242-R246 HydrophobicContact CG2-CG 4.23Å; I242-R246 WeakPolarHBondContact O-CB 3.4Å; I242-R246 VanDerWaalsContact O-CG 3.3Å; I242-R246 WeakPolarHBondContact O-CG 3.5Å; I242-R246 PolarHBondContact O-N 3.41Å; R246-H250 HydrophobicContact CB-CB 4.46Å; R246-L251 HydrophobicContact CB-CD1 4.45Å; R246-L251 HydrophobicContact CB-CD2 3.77Å; R246-L251 HydrophobicContact CB-CG 3.76Å; R246-L251 HydrophobicContact CG-CD2 4.33Å
247	S	90.7	Very high	94.3	Very high	7 Å²	7	32 Å²	32	5%	0.049	16%	0.161	C	C	.	.			trans	-65.5	155.3	172.6	72.8	0	0	0	0	111	D206 T249 H250 L251	D206-S247 WeakPolarHBondContact O-CB 3.36Å; S247-T249 VanDerWaalsContact C-N 3.3Å; S247-T249 PolarHBondContact O-N 3.49Å; S247-T249 PolarHBondContact OG-OG1 3.28Å; S247-H250 PolarHBondContact O-N 3.49Å; S247-H250 WeakPolarHBondContact OG-CB 3.25Å; S247-H250 PolarHBondContact OG-N 3.29Å; S247-L251 WeakPolarHBondContact O-CG 3.4Å; S247-L251 PolarHBondContact O-N 2.82Å
248	A	90.2	Very high	94.5	Very high	35 Å²	35	29.1 Å²	29.1	29%	0.289	15%	0.147	S	C	.	.	H	α-helix	trans	-60	-39.4	179.5	0	0	0	0	0	112.6	H250 L251 L252 T289	A248-H250 VanDerWaalsContact C-N 3.34Å; A248-H250 PolarHBondContact O-N 3.13Å; A248-L251 PolarHBondContact O-N 3.29Å; A248-L252 WeakPolarHBondContact O-CG 3.36Å; A248-L252 PolarHBondContact O-N 3.09Å; A248-T289 HydrophobicContact CB-CG2 4.11Å
249	T	91.8	Very high	94.6	Very high	47 Å²	47	31.1 Å²	31.1	29%	0.288	16%	0.158	S	C	.	.	H	α-helix	trans	-65	-37.7	177.5	44.6	0	0	0	0	112.1	V208 S209 S247	V208-T249 HydrophobicContact CG1-CG2 3.77Å; S209-T249 PolarHBondContact O-OG1 3.26Å; S209-T249 VanDerWaalsContact O-OG1 3.12Å; S247-T249 VanDerWaalsContact C-N 3.3Å; S247-T249 PolarHBondContact O-N 3.49Å; S247-T249 PolarHBondContact OG-OG1 3.28Å
250	H	94.8	Very high	94.8	Very high	11 Å²	11	36.6 Å²	36.6	5%	0.051	18%	0.181	C	C	.	.	H	α-helix	trans	-67.2	-47	173.9	-174.6	89.8	0	0	0	111.6	A217 D220 R246 S247 A248 L252 R253 V254	A217-H250 PolarHBondContact N-CE1 3.34Å; D220-H250 IonicContact OD2-CD2 2.65Å; D220-H250 IonicContact OD2-CE1 2.88Å; D220-H250 IonicContact OD2-NE2 3Å; D220-H250 PolarHBondContact OD2-NE2 3.26Å; R246-H250 HydrophobicContact CB-CB 4.46Å; S247-H250 PolarHBondContact O-N 3.49Å; S247-H250 WeakPolarHBondContact OG-CB 3.25Å; S247-H250 PolarHBondContact OG-N 3.29Å; A248-H250 VanDerWaalsContact C-N 3.34Å; A248-H250 PolarHBondContact O-N 3.13Å; H250-L252 VanDerWaalsContact C-N 3.33Å; H250-L252 PolarHBondContact O-N 2.85Å; H250-R253 WeakPolarHBondContact O-CA 3.23Å; H250-R253 WeakPolarHBondContact O-CB 3.36Å; H250-R253 PolarHBondContact O-N 3.18Å; H250-V254 WeakPolarHBondContact O-CG2 3.37Å; H250-V254 PolarHBondContact O-N 3.31Å
251	L	95.4	Very high	94.8	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-60.2	-39.1	179.5	-75.2	177.1	0	0	0	113.1	I242 L243 R246 S247 A248 R253 V254 F255 T289	I242-L251 HydrophobicContact CG2-CD2 3.96Å; L243-L251 HydrophobicContact CD2-CD2 4.43Å; R246-L251 HydrophobicContact CB-CD1 4.45Å; R246-L251 HydrophobicContact CB-CD2 3.77Å; R246-L251 HydrophobicContact CB-CG 3.76Å; R246-L251 HydrophobicContact CG-CD2 4.33Å; S247-L251 WeakPolarHBondContact O-CG 3.4Å; S247-L251 PolarHBondContact O-N 2.82Å; A248-L251 PolarHBondContact O-N 3.29Å; L251-R253 VanDerWaalsContact C-N 3.25Å; L251-R253 PolarHBondContact O-N 3.3Å; L251-V254 WeakPolarHBondContact O-CB 3.22Å; L251-V254 PolarHBondContact O-N 3.25Å; L251-V254 VanDerWaalsContact O-N 3.12Å; L251-F255 HydrophobicContact CB-CE1 4.43Å; L251-F255 HydrophobicContact CB-CE2 4.14Å; L251-F255 HydrophobicContact CB-CZ 3.92Å; L251-F255 HydrophobicContact CD2-CE1 4.35Å; L251-F255 HydrophobicContact CD2-CZ 4.37Å; L251-F255 WeakPolarHBondContact O-CD1 3.1Å; L251-F255 VanDerWaalsContact O-CD2 3.31Å; L251-F255 WeakPolarHBondContact O-CD2 3.3Å; L251-F255 WeakPolarHBondContact O-CG 3.09Å; L251-F255 PolarHBondContact O-N 3.37Å; L251-T289 HydrophobicContact CB-CG2 3.75Å; L251-T289 HydrophobicContact CD1-CG2 4.29Å
252	L	95.6	Very high	94.8	Very high	67 Å²	67	36.7 Å²	36.7	35%	0.351	18%	0.181	S	C	.	.	H	α-helix	trans	-55.5	-43.8	173	-72.9	173.1	0	0	0	111.5	A248 H250 F255 E256 T289 Q290	A248-L252 WeakPolarHBondContact O-CG 3.36Å; A248-L252 PolarHBondContact O-N 3.09Å; H250-L252 VanDerWaalsContact C-N 3.33Å; H250-L252 PolarHBondContact O-N 2.85Å; L252-F255 PolarHBondContact O-N 3.32Å; L252-E256 WeakPolarHBondContact O-CG 3.38Å; L252-E256 PolarHBondContact O-N 3.26Å; L252-E256 VanDerWaalsContact O-N 3.16Å; L252-T289 HydrophobicContact CD2-CG2 4.34Å; L252-T289 HydrophobicContact CG-CG2 4.25Å; L252-Q290 HydrophobicContact CD2-CG 4.27Å
253	R	96.7	Very high	94.8	Very high	86 Å²	86	43.5 Å²	43.5	33%	0.325	22%	0.218	S	C	.	.	H	α-helix	trans	-67.9	-39.5	176.4	-176	55.5	177.1	-166.1	-2.8	112.3	V212 A217 H250 L251 F255 E256 E257	V212-R253 HydrophobicContact CG1-CB 3.8Å; V212-R253 HydrophobicContact CG1-CG 4.01Å; A217-R253 HydrophobicContact CB-CB 4.15Å; A217-R253 HydrophobicContact CB-CG 3.65Å; H250-R253 WeakPolarHBondContact O-CA 3.23Å; H250-R253 WeakPolarHBondContact O-CB 3.36Å; H250-R253 PolarHBondContact O-N 3.18Å; L251-R253 VanDerWaalsContact C-N 3.25Å; L251-R253 PolarHBondContact O-N 3.3Å; R253-F255 VanDerWaalsContact C-N 3.3Å; R253-F255 PolarHBondContact O-N 3.46Å; R253-E256 WeakPolarHBondContact CD-OE2 3.2Å; R253-E256 IonicContact CZ-OE2 2.71Å; R253-E256 IonicContact NE-OE2 2.69Å; R253-E256 IonicContact NH1-OE2 3.14Å; R253-E256 PolarHBondContact NH1-OE2 3.27Å; R253-E256 PolarHBondContact O-N 3.33Å; R253-E257 IonicContact CZ-OE1 3.77Å; R253-E257 IonicContact NE-OE1 4Å; R253-E257 PolarHBondContact NE-OE1 3.27Å; R253-E257 IonicContact NH1-OE1 2.83Å; R253-E257 IonicContact NH2-OE1 3Å; R253-E257 PolarHBondContact NH2-OE1 3Å; R253-E257 WeakPolarHBondContact O-CG 3.35Å; R253-E257 PolarHBondContact O-N 2.94Å
254	V	97.8	Very high	94.8	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-58.7	-43.5	174.7	173.4	0	0	0	0	110.5	A217 D220 A221 L224 H250 L251 E257 Y258	A217-V254 HydrophobicContact CB-CG2 4.06Å; D220-V254 HydrophobicContact CB-CG1 4.15Å; D220-V254 HydrophobicContact CB-CG2 3.79Å; A221-V254 HydrophobicContact CB-CG1 4.22Å; L224-V254 HydrophobicContact CD1-CG1 3.7Å; H250-V254 WeakPolarHBondContact O-CG2 3.37Å; H250-V254 PolarHBondContact O-N 3.31Å; L251-V254 WeakPolarHBondContact O-CB 3.22Å; L251-V254 PolarHBondContact O-N 3.25Å; L251-V254 VanDerWaalsContact O-N 3.12Å; V254-E257 PolarHBondContact O-N 3.45Å; V254-Y258 VanDerWaalsContact O-CB 3.23Å; V254-Y258 WeakPolarHBondContact O-CB 3.48Å; V254-Y258 PolarHBondContact O-N 3.13Å
255	F	97.9	Very high	95	Very high	14 Å²	14	47.3 Å²	47.3	6%	0.061	24%	0.238	C	C	.	.	H	α-helix	trans	-65	-40.4	179.1	-56	-25.7	0	0	0	112.2	L243 L251 L252 R253 Y258 E259 I266 V286 T289 Q290	L243-F255 HydrophobicContact CD2-CE1 3.88Å; L243-F255 HydrophobicContact CD2-CZ 3.9Å; L251-F255 HydrophobicContact CB-CE1 4.43Å; L251-F255 HydrophobicContact CB-CE2 4.14Å; L251-F255 HydrophobicContact CB-CZ 3.92Å; L251-F255 HydrophobicContact CD2-CE1 4.35Å; L251-F255 HydrophobicContact CD2-CZ 4.37Å; L251-F255 WeakPolarHBondContact O-CD1 3.1Å; L251-F255 VanDerWaalsContact O-CD2 3.31Å; L251-F255 WeakPolarHBondContact O-CD2 3.3Å; L251-F255 WeakPolarHBondContact O-CG 3.09Å; L251-F255 PolarHBondContact O-N 3.37Å; L252-F255 PolarHBondContact O-N 3.32Å; R253-F255 VanDerWaalsContact C-N 3.3Å; R253-F255 PolarHBondContact O-N 3.46Å; F255-Y258 PolarHBondContact O-N 3.38Å; F255-E259 PolarHBondContact O-N 3.05Å; F255-I266 HydrophobicContact CB-CG2 4.26Å; F255-I266 HydrophobicContact CD1-CB 4.15Å; F255-I266 HydrophobicContact CD1-CG1 4.1Å; F255-I266 HydrophobicContact CD1-CG2 3.75Å; F255-I266 HydrophobicContact CD2-CG2 4.45Å; F255-I266 HydrophobicContact CE1-CG1 4.2Å; F255-I266 HydrophobicContact CE1-CG2 4.19Å; F255-I266 HydrophobicContact CG-CG2 3.9Å; F255-V286 HydrophobicContact CE1-CG2 4.35Å; F255-V286 HydrophobicContact CE2-CG1 4.05Å; F255-V286 HydrophobicContact CE2-CG2 4.45Å; F255-V286 HydrophobicContact CZ-CB 4.43Å; F255-V286 HydrophobicContact CZ-CG1 4.31Å; F255-V286 HydrophobicContact CZ-CG2 3.9Å; F255-T289 HydrophobicContact CE2-CG2 3.9Å; F255-Q290 HydrophobicContact CD2-CG 4.41Å
256	E	97.3	Very high	95.3	Very high	95 Å²	95	46.1 Å²	46.1	44%	0.444	23%	0.23	S	C	.	.	H	α-helix	trans	-61.2	-44.3	173.3	-70.8	175.2	-175	0	0	112.5	L252 R253 K260	L252-E256 WeakPolarHBondContact O-CG 3.38Å; L252-E256 PolarHBondContact O-N 3.26Å; L252-E256 VanDerWaalsContact O-N 3.16Å; R253-E256 WeakPolarHBondContact CD-OE2 3.2Å; R253-E256 IonicContact CZ-OE2 2.71Å; R253-E256 IonicContact NE-OE2 2.69Å; R253-E256 IonicContact NH1-OE2 3.14Å; R253-E256 PolarHBondContact NH1-OE2 3.27Å; R253-E256 PolarHBondContact O-N 3.33Å; E256-K260 WeakPolarHBondContact O-CE 3.08Å; E256-K260 WeakPolarHBondContact O-CG 3.34Å; E256-K260 PolarHBondContact O-N 2.71Å
257	E	98.2	Very high	95.5	Very high	24 Å²	24	45.3 Å²	45.3	11%	0.112	23%	0.229	C	C	.	.	H	α-helix	trans	-71.2	-36.5	178.2	-64.7	-53.8	157	0	0	111.9	L218 A221 R253 V254 E259 K260 I261	L218-E257 HydrophobicContact CD1-CB 4.38Å; L218-E257 HydrophobicContact CD1-CG 4.49Å; A221-E257 HydrophobicContact CB-CB 3.72Å; R253-E257 IonicContact CZ-OE1 3.77Å; R253-E257 IonicContact NE-OE1 4Å; R253-E257 PolarHBondContact NE-OE1 3.27Å; R253-E257 IonicContact NH1-OE1 2.83Å; R253-E257 IonicContact NH2-OE1 3Å; R253-E257 PolarHBondContact NH2-OE1 3Å; R253-E257 WeakPolarHBondContact O-CG 3.35Å; R253-E257 PolarHBondContact O-N 2.94Å; V254-E257 PolarHBondContact O-N 3.45Å; E257-E259 PolarHBondContact O-N 3.35Å; E257-K260 PolarHBondContact O-N 3.11Å; E257-K260 IonicContact OE1-NZ 3.77Å; E257-K260 PolarHBondContact OE1-NZ 2.92Å; E257-K260 WeakPolarHBondContact OE2-CD 3.37Å; E257-K260 IonicContact OE2-NZ 2.92Å; E257-K260 PolarHBondContact OE2-NZ 2.79Å; E257-I261 WeakPolarHBondContact O-CD1 3.39Å; E257-I261 WeakPolarHBondContact O-CG1 3.41Å; E257-I261 PolarHBondContact O-N 3.08Å; E257-I261 VanDerWaalsContact O-N 3.16Å
258	Y	97.8	Very high	95.7	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-58.8	-47.7	176.4	-178.3	-87.1	0	0	0	111	L224 V254 F255 K260 I261 A262 K264 I266 S269	L224-Y258 HydrophobicContact CB-CD2 3.77Å; L224-Y258 HydrophobicContact CB-CE2 3.8Å; V254-Y258 VanDerWaalsContact O-CB 3.23Å; V254-Y258 WeakPolarHBondContact O-CB 3.48Å; V254-Y258 PolarHBondContact O-N 3.13Å; F255-Y258 PolarHBondContact O-N 3.38Å; Y258-K260 VanDerWaalsContact C-N 3.28Å; Y258-K260 PolarHBondContact O-N 3.22Å; Y258-I261 PolarHBondContact O-N 3.03Å; Y258-I261 VanDerWaalsContact O-N 3.11Å; Y258-A262 HydrophobicContact CD1-CB 4.12Å; Y258-A262 HydrophobicContact CE1-CB 3.68Å; Y258-A262 HydrophobicContact CE2-CB 4.47Å; Y258-A262 VanDerWaalsContact O-CB 3.31Å; Y258-A262 WeakPolarHBondContact O-CB 3.28Å; Y258-A262 PolarHBondContact O-N 3.26Å; Y258-K264 WeakPolarHBondContact CE1-O 3.16Å; Y258-I266 HydrophobicContact CD1-CB 4.07Å; Y258-I266 HydrophobicContact CD1-CD1 4.07Å; Y258-I266 HydrophobicContact CD2-CD1 4.09Å; Y258-I266 HydrophobicContact CE1-CB 4.37Å; Y258-I266 HydrophobicContact CE1-CD1 3.97Å; Y258-I266 HydrophobicContact CE2-CD1 3.96Å; Y258-I266 HydrophobicContact CG-CD1 4.14Å; Y258-S269 VanDerWaalsContact CE1-OG 3.26Å; Y258-S269 WeakPolarHBondContact CE1-OG 3.29Å; Y258-S269 WeakPolarHBondContact OH-CB 3.35Å; Y258-S269 PolarHBondContact OH-OG 3.24Å
259	E	96.9	Very high	95.9	Very high	117 Å²	117	46.9 Å²	46.9	55%	0.547	23%	0.231	S	C	.	.	H	α-helix	trans	-60.1	-38.3	-179.9	-172	173.9	-158.7	0	0	112.2	F255 E257 I261 N263	F255-E259 PolarHBondContact O-N 3.05Å; E257-E259 PolarHBondContact O-N 3.35Å; E259-I261 PolarHBondContact O-N 3.25Å; E259-N263 VanDerWaalsContact O-CA 3.27Å; E259-N263 WeakPolarHBondContact O-CA 3.28Å; E259-N263 PolarHBondContact O-N 3.19Å
260	K	97.1	Very high	96	Very high	116 Å²	116	44.6 Å²	44.6	50%	0.504	22%	0.218	S	C	.	.	H	α-helix	trans	-66.8	-35	176.6	-64.4	171.2	-154.8	162.5	0	113.2	E256 E257 Y258	E256-K260 WeakPolarHBondContact O-CE 3.08Å; E256-K260 WeakPolarHBondContact O-CG 3.34Å; E256-K260 PolarHBondContact O-N 2.71Å; E257-K260 PolarHBondContact O-N 3.11Å; E257-K260 IonicContact OE1-NZ 3.77Å; E257-K260 PolarHBondContact OE1-NZ 2.92Å; E257-K260 WeakPolarHBondContact OE2-CD 3.37Å; E257-K260 IonicContact OE2-NZ 2.92Å; E257-K260 PolarHBondContact OE2-NZ 2.79Å; Y258-K260 VanDerWaalsContact C-N 3.28Å; Y258-K260 PolarHBondContact O-N 3.22Å
261	I	95.9	Very high	96	Very high	51 Å²	51	49.1 Å²	49.1	26%	0.262	24%	0.237	S	C	.	.	H	α-helix	trans	-82.5	-44.3	-177.6	-62.6	162.7	0	0	0	110.6	L218 A221 Q222 Y225 E257 Y258 E259	L218-I261 HydrophobicContact CD1-CD1 3.9Å; A221-I261 HydrophobicContact CB-CD1 4.1Å; Q222-I261 HydrophobicContact CG-CD1 3.8Å; Y225-I261 HydrophobicContact CD1-CG2 3.74Å; Y225-I261 HydrophobicContact CE1-CG2 4.18Å; Y225-I261 HydrophobicContact CG-CG2 3.97Å; E257-I261 WeakPolarHBondContact O-CD1 3.39Å; E257-I261 WeakPolarHBondContact O-CG1 3.41Å; E257-I261 PolarHBondContact O-N 3.08Å; E257-I261 VanDerWaalsContact O-N 3.16Å; Y258-I261 PolarHBondContact O-N 3.03Å; Y258-I261 VanDerWaalsContact O-N 3.11Å; E259-I261 PolarHBondContact O-N 3.25Å
262	A	93.7	Very high	95.8	Very high	17 Å²	17	52.2 Å²	52.2	14%	0.14	26%	0.259	C	S	.	.	H	α-helix	trans	-86.5	-18.4	-173.4	0	0	0	0	0	113.4	Y225 Y258 K264	Y225-A262 HydrophobicContact CD2-CB 3.57Å; Y225-A262 HydrophobicContact CE2-CB 3.83Å; Y258-A262 HydrophobicContact CD1-CB 4.12Å; Y258-A262 HydrophobicContact CE1-CB 3.68Å; Y258-A262 HydrophobicContact CE2-CB 4.47Å; Y258-A262 VanDerWaalsContact O-CB 3.31Å; Y258-A262 WeakPolarHBondContact O-CB 3.28Å; Y258-A262 PolarHBondContact O-N 3.26Å; A262-K264 HydrophobicContact CB-CB 4.31Å; A262-K264 PolarHBondContact O-N 3.03Å
263	N	94.5	Very high	95.6	Very high	146 Å²	146	51.3 Å²	51.3	78%	0.781	25%	0.253	S	S	*	.	S	Bend	trans	52.5	32.9	-166.9	-59.6	-71.3	0	0	0	112.6	E259	E259-N263 VanDerWaalsContact O-CA 3.27Å; E259-N263 WeakPolarHBondContact O-CA 3.28Å; E259-N263 PolarHBondContact O-N 3.19Å
264	K	93.3	Very high	95.4	Very high	55 Å²	55	47.7 Å²	47.7	24%	0.239	24%	0.24	C	C	.	.	S	Bend	trans	-154.7	142.6	-175.4	-172.3	177.2	173.1	-165.1	0	108.9	E229 Y258 A262 D268 S272	E229-K264 IonicContact OE1-NZ 3.6Å; E229-K264 PolarHBondContact OE1-NZ 3.41Å; Y258-K264 WeakPolarHBondContact CE1-O 3.16Å; A262-K264 HydrophobicContact CB-CB 4.31Å; A262-K264 PolarHBondContact O-N 3.03Å; K264-D268 WeakPolarHBondContact CE-O 3.3Å; K264-D268 HydrophobicContact CG-CB 4.04Å; K264-D268 PolarHBondContact NZ-O 2.94Å; K264-S272 PolarHBondContact NZ-OG 3.46Å
265	S	96.1	Very high	95.1	Very high	25 Å²	25	55.2 Å²	55.2	18%	0.175	28%	0.275	C	S	.	.			trans	-64.9	155.7	176.1	72.5	0	0	0	0	111.2	E267 D268 S269	S265-E267 WeakPolarHBondContact CB-OE2 3.31Å; S265-E267 PolarHBondContact O-N 3.42Å; S265-D268 PolarHBondContact O-N 3.41Å; S265-D268 VanDerWaalsContact OG-CB 3.31Å; S265-D268 WeakPolarHBondContact OG-CB 3.49Å; S265-D268 PolarHBondContact OG-N 2.92Å; S265-D268 PolarHBondContact OG-OD2 2.91Å; S265-S269 PolarHBondContact O-N 2.71Å; S265-S269 VanDerWaalsContact O-N 3.13Å; S265-S269 PolarHBondContact O-OG 2.74Å
266	I	96.3	Very high	95	Very high	2 Å²	2	56.8 Å²	56.8	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-65.6	-33.7	175.5	-171.8	60.7	0	0	0	110.7	L224 F239 F255 Y258 S269 I270 V286	L224-I266 HydrophobicContact CD1-CD1 4.15Å; F239-I266 HydrophobicContact CE1-CD1 3.88Å; F255-I266 HydrophobicContact CB-CG2 4.26Å; F255-I266 HydrophobicContact CD1-CB 4.15Å; F255-I266 HydrophobicContact CD1-CG1 4.1Å; F255-I266 HydrophobicContact CD1-CG2 3.75Å; F255-I266 HydrophobicContact CD2-CG2 4.45Å; F255-I266 HydrophobicContact CE1-CG1 4.2Å; F255-I266 HydrophobicContact CE1-CG2 4.19Å; F255-I266 HydrophobicContact CG-CG2 3.9Å; Y258-I266 HydrophobicContact CD1-CB 4.07Å; Y258-I266 HydrophobicContact CD1-CD1 4.07Å; Y258-I266 HydrophobicContact CD2-CD1 4.09Å; Y258-I266 HydrophobicContact CE1-CB 4.37Å; Y258-I266 HydrophobicContact CE1-CD1 3.97Å; Y258-I266 HydrophobicContact CE2-CD1 3.96Å; Y258-I266 HydrophobicContact CG-CD1 4.14Å; I266-S269 PolarHBondContact O-N 2.87Å; I266-I270 HydrophobicContact CG1-CD1 4.07Å; I266-I270 WeakPolarHBondContact O-CD1 3.42Å; I266-I270 VanDerWaalsContact O-CG1 3.28Å; I266-I270 WeakPolarHBondContact O-CG1 3.29Å; I266-I270 PolarHBondContact O-N 2.74Å; I266-V286 HydrophobicContact CG2-CG1 3.86Å; I266-V286 HydrophobicContact CG2-CG2 4.31Å
267	E	96.8	Very high	95	Very high	37 Å²	37	53.9 Å²	53.9	17%	0.173	29%	0.285	C	S	.	.	H	α-helix	trans	-64.4	-46.4	177.7	-61.8	92.2	142.3	0	0	111.8	S265 S269 I270 K271 L283 V286 Q290	S265-E267 WeakPolarHBondContact CB-OE2 3.31Å; S265-E267 PolarHBondContact O-N 3.42Å; E267-S269 PolarHBondContact O-N 3.42Å; E267-I270 PolarHBondContact O-N 3.2Å; E267-K271 VanDerWaalsContact O-CG 3.31Å; E267-K271 WeakPolarHBondContact O-CG 3.36Å; E267-K271 PolarHBondContact O-N 3.15Å; E267-L283 HydrophobicContact CB-CD2 3.91Å; E267-L283 HydrophobicContact CG-CD2 4.23Å; E267-V286 HydrophobicContact CG-CG1 3.88Å; E267-Q290 PolarHBondContact OE1-NE2 3.48Å; E267-Q290 PolarHBondContact OE1-OE1 3.37Å
268	D	95.1	Very high	94.9	Very high	74 Å²	74	53.8 Å²	53.8	40%	0.396	29%	0.286	S	S	.	.	H	α-helix	trans	-71.3	-26	179.7	-62.4	-33.4	0	0	0	111.6	K264 S265 K271 S272	K264-D268 WeakPolarHBondContact CE-O 3.3Å; K264-D268 HydrophobicContact CG-CB 4.04Å; K264-D268 PolarHBondContact NZ-O 2.94Å; S265-D268 PolarHBondContact O-N 3.41Å; S265-D268 VanDerWaalsContact OG-CB 3.31Å; S265-D268 WeakPolarHBondContact OG-CB 3.49Å; S265-D268 PolarHBondContact OG-N 2.92Å; S265-D268 PolarHBondContact OG-OD2 2.91Å; D268-K271 IonicContact OD1-NZ 3.99Å; D268-K271 PolarHBondContact OD1-NZ 2.99Å; D268-S272 PolarHBondContact O-N 3.23Å; D268-S272 PolarHBondContact O-OG 3.22Å
269	S	94.4	Very high	94.9	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-69.5	-47.3	171.6	-53.3	0	0	0	0	110.6	Y258 S265 I266 E267 K271 S272 E273	Y258-S269 VanDerWaalsContact CE1-OG 3.26Å; Y258-S269 WeakPolarHBondContact CE1-OG 3.29Å; Y258-S269 WeakPolarHBondContact OH-CB 3.35Å; Y258-S269 PolarHBondContact OH-OG 3.24Å; S265-S269 PolarHBondContact O-N 2.71Å; S265-S269 VanDerWaalsContact O-N 3.13Å; S265-S269 PolarHBondContact O-OG 2.74Å; I266-S269 PolarHBondContact O-N 2.87Å; E267-S269 PolarHBondContact O-N 3.42Å; S269-K271 VanDerWaalsContact C-N 3.3Å; S269-K271 PolarHBondContact O-N 3.12Å; S269-S272 PolarHBondContact O-N 3.4Å; S269-S272 VanDerWaalsContact O-N 3.14Å; S269-S272 PolarHBondContact O-OG 3.38Å; S269-E273 VanDerWaalsContact O-CB 3.25Å; S269-E273 WeakPolarHBondContact O-CB 3.17Å; S269-E273 VanDerWaalsContact O-CG 3.23Å; S269-E273 WeakPolarHBondContact O-CG 3.27Å; S269-E273 PolarHBondContact O-N 3Å
270	I	94.8	Very high	95	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-56.8	-43.8	175.1	-70.3	161.1	0	0	0	111.2	F239 I266 E267 S272 E273 T274 E279 M282 L283 V286	F239-I270 HydrophobicContact CD1-CG1 4.31Å; F239-I270 HydrophobicContact CE1-CG1 4.1Å; I266-I270 HydrophobicContact CG1-CD1 4.07Å; I266-I270 WeakPolarHBondContact O-CD1 3.42Å; I266-I270 VanDerWaalsContact O-CG1 3.28Å; I266-I270 WeakPolarHBondContact O-CG1 3.29Å; I266-I270 PolarHBondContact O-N 2.74Å; E267-I270 PolarHBondContact O-N 3.2Å; I270-S272 VanDerWaalsContact C-N 3.33Å; I270-S272 PolarHBondContact O-N 2.97Å; I270-E273 PolarHBondContact O-N 2.93Å; I270-T274 WeakPolarHBondContact CG2-OG1 3.33Å; I270-T274 PolarHBondContact O-N 2.65Å; I270-T274 PolarHBondContact O-OG1 3.46Å; I270-E279 HydrophobicContact CG2-CG 4.13Å; I270-M282 HydrophobicContact CD1-CB 4.02Å; I270-M282 HydrophobicContact CG1-CB 4.32Å; I270-M282 HydrophobicContact CG1-SD 4.44Å; I270-M282 HydrophobicContact CG2-CB 3.74Å; I270-M282 HydrophobicContact CG2-SD 4.34Å; I270-L283 HydrophobicContact CB-CD2 4.04Å; I270-L283 HydrophobicContact CD1-CD2 4.37Å; I270-L283 HydrophobicContact CG2-CD2 3.88Å; I270-L283 HydrophobicContact CG2-CG 3.82Å; I270-V286 HydrophobicContact CD1-CG2 3.72Å
271	K	95	Very high	95	Very high	105 Å²	105	48.3 Å²	48.3	46%	0.457	26%	0.262	S	S	.	.	H	α-helix	trans	-65.7	-29.5	178.7	-69.2	171.2	-160.3	153.7	0	114.3	E267 D268 S269 L283	E267-K271 VanDerWaalsContact O-CG 3.31Å; E267-K271 WeakPolarHBondContact O-CG 3.36Å; E267-K271 PolarHBondContact O-N 3.15Å; D268-K271 IonicContact OD1-NZ 3.99Å; D268-K271 PolarHBondContact OD1-NZ 2.99Å; S269-K271 VanDerWaalsContact C-N 3.3Å; S269-K271 PolarHBondContact O-N 3.12Å; K271-L283 HydrophobicContact CG-CD1 4.04Å; K271-L283 HydrophobicContact CG-CD2 4.45Å
272	S	91.4	Very high	95.1	Very high	66 Å²	66	45.9 Å²	45.9	46%	0.462	25%	0.25	S	C	.	.	H	α-helix	trans	-84.9	-27.9	178.6	63.3	0	0	0	0	112.7	K264 D268 S269 I270	K264-S272 PolarHBondContact NZ-OG 3.46Å; D268-S272 PolarHBondContact O-N 3.23Å; D268-S272 PolarHBondContact O-OG 3.22Å; S269-S272 PolarHBondContact O-N 3.4Å; S269-S272 VanDerWaalsContact O-N 3.14Å; S269-S272 PolarHBondContact O-OG 3.38Å; I270-S272 VanDerWaalsContact C-N 3.33Å; I270-S272 PolarHBondContact O-N 2.97Å
273	E	90.3	Very high	95.3	Very high	48 Å²	48	46 Å²	46	22%	0.224	25%	0.248	C	C	.	.	H	α-helix	trans	-96.5	-31.3	-171.9	-70	-48	123.8	0	0	113.2	T234 S269 I270	T234-E273 HydrophobicContact CG2-CB 3.89Å; T234-E273 HydrophobicContact CG2-CG 4.41Å; T234-E273 VanDerWaalsContact OG1-CB 3.29Å; T234-E273 WeakPolarHBondContact OG1-CB 3.05Å; T234-E273 PolarHBondContact OG1-O 3.08Å; T234-E273 VanDerWaalsContact OG1-O 3.13Å; T234-E273 PolarHBondContact OG1-OE2 3.24Å; S269-E273 VanDerWaalsContact O-CB 3.25Å; S269-E273 WeakPolarHBondContact O-CB 3.17Å; S269-E273 VanDerWaalsContact O-CG 3.23Å; S269-E273 WeakPolarHBondContact O-CG 3.27Å; S269-E273 PolarHBondContact O-N 3Å; I270-E273 PolarHBondContact O-N 2.93Å
274	T	91.8	Very high	95.5	Very high	10 Å²	10	39.4 Å²	39.4	6%	0.061	21%	0.213	C	C	.	.			trans	-121.1	165.3	-177.2	67.3	0	0	0	0	111.5	I270 L278 E279 M282	I270-T274 WeakPolarHBondContact CG2-OG1 3.33Å; I270-T274 PolarHBondContact O-N 2.65Å; I270-T274 PolarHBondContact O-OG1 3.46Å; T274-L278 HydrophobicContact CG2-CD2 4.2Å; T274-E279 WeakPolarHBondContact OG1-CA 3.29Å; T274-E279 WeakPolarHBondContact OG1-CB 3.34Å; T274-M282 HydrophobicContact CG2-CE 4.36Å; T274-M282 HydrophobicContact CG2-SD 3.97Å
275	H	93.1	Very high	95.7	Very high	157 Å²	157	36.8 Å²	36.8	73%	0.727	20%	0.201	S	C	*	.			trans	-144.6	165.5	177.4	60.8	-80.3	0	0	0	111.3	E279	H275-E279 WeakPolarHBondContact CA-OE2 3.42Å
276	G	95.9	Very high	95.8	Very high	48 Å²	48	35.6 Å²	35.6	50%	0.495	19%	0.193	S	C	.	.	H	α-helix	trans	63.2	-141.3	173.2	0	0	0	0	0	112.6	L278 E279 E280	G276-L278 VanDerWaalsContact C-N 3.33Å; G276-L278 PolarHBondContact O-N 3.37Å; G276-E279 WeakPolarHBondContact O-CB 3.45Å; G276-E279 PolarHBondContact O-N 2.98Å; G276-E280 PolarHBondContact O-N 2.84Å; G276-E280 VanDerWaalsContact O-N 3.08Å
277	S	96.4	Very high	95.9	Very high	33 Å²	33	38.1 Å²	38.1	23%	0.231	20%	0.204	C	C	.	.	H	α-helix	trans	-73.7	-24.3	-170.8	-51.5	0	0	0	0	113.7	E151 I155 E280 A281	E151-S277 WeakPolarHBondContact OE2-CB 3.22Å; E151-S277 PolarHBondContact OE2-OG 3.46Å; I155-S277 WeakPolarHBondContact CD1-O 3.24Å; S277-E280 PolarHBondContact O-N 3.19Å; S277-A281 WeakPolarHBondContact O-CB 3.43Å; S277-A281 PolarHBondContact O-N 2.94Å
278	L	96.6	Very high	95.9	Very high	22 Å²	22	37.2 Å²	37.2	12%	0.115	20%	0.201	C	C	.	.	H	α-helix	trans	-66	-44.2	171.1	-177	64.3	0	0	0	110.9	Y192 I196 E236 I240 T274 G276 A281 M282	Y192-L278 HydrophobicContact CD2-CD2 4.31Å; Y192-L278 HydrophobicContact CG-CD2 4.32Å; I196-L278 HydrophobicContact CG2-CD1 4.21Å; E236-L278 HydrophobicContact CB-CD2 4.22Å; E236-L278 HydrophobicContact CG-CD2 3.98Å; I240-L278 HydrophobicContact CD1-CD1 4.41Å; T274-L278 HydrophobicContact CG2-CD2 4.2Å; G276-L278 VanDerWaalsContact C-N 3.33Å; G276-L278 PolarHBondContact O-N 3.37Å; L278-A281 PolarHBondContact O-N 2.96Å; L278-M282 HydrophobicContact CD1-CE 3.89Å; L278-M282 HydrophobicContact CD2-CE 4.15Å; L278-M282 HydrophobicContact CG-CE 3.97Å; L278-M282 WeakPolarHBondContact O-CG 3.27Å; L278-M282 PolarHBondContact O-N 3.45Å
279	E	97.4	Very high	95.8	Very high	50 Å²	50	34.5 Å²	34.5	23%	0.234	19%	0.187	C	C	.	.	H	α-helix	trans	-59.7	-47.3	174.4	-172.2	-162.9	152.5	0	0	110.5	I270 T274 H275 G276 A281 M282 L283	I270-E279 HydrophobicContact CG2-CG 4.13Å; T274-E279 WeakPolarHBondContact OG1-CA 3.29Å; T274-E279 WeakPolarHBondContact OG1-CB 3.34Å; H275-E279 WeakPolarHBondContact CA-OE2 3.42Å; G276-E279 WeakPolarHBondContact O-CB 3.45Å; G276-E279 PolarHBondContact O-N 2.98Å; E279-A281 VanDerWaalsContact C-N 3.31Å; E279-A281 PolarHBondContact O-N 3.42Å; E279-M282 PolarHBondContact O-N 3.32Å; E279-L283 HydrophobicContact CG-CD1 3.95Å; E279-L283 HydrophobicContact CG-CG 4.39Å; E279-L283 WeakPolarHBondContact O-CB 3.44Å; E279-L283 VanDerWaalsContact O-CG 3.31Å; E279-L283 WeakPolarHBondContact O-CG 3.42Å; E279-L283 PolarHBondContact O-N 2.95Å
280	E	98.3	Very high	95.9	Very high	68 Å²	68	38.4 Å²	38.4	32%	0.318	21%	0.206	S	C	.	.	H	α-helix	trans	-58.8	-42.1	176.7	-175.1	173.6	-178.8	0	0	111.5	I155 G276 S277 T284 R299	I155-E280 HydrophobicContact CD1-CB 4.2Å; I155-E280 HydrophobicContact CD1-CG 4.2Å; I155-E280 HydrophobicContact CG2-CG 4.41Å; G276-E280 PolarHBondContact O-N 2.84Å; G276-E280 VanDerWaalsContact O-N 3.08Å; S277-E280 PolarHBondContact O-N 3.19Å; E280-T284 WeakPolarHBondContact O-CB 3.34Å; E280-T284 PolarHBondContact O-N 3.29Å; E280-T284 PolarHBondContact O-OG1 2.61Å; E280-R299 IonicContact OE1-NH1 2.78Å; E280-R299 PolarHBondContact OE1-NH1 3.45Å
281	A	98.1	Very high	96	Very high	1 Å²	1	41 Å²	41	1%	0.008	22%	0.219	C	C	.	.	H	α-helix	trans	-64.2	-50.3	178.6	0	0	0	0	0	112.3	I155 L193 I196 S277 L278 E279 T284 V285	I155-A281 HydrophobicContact CD1-CB 4.05Å; I155-A281 HydrophobicContact CG1-CB 4.01Å; I155-A281 HydrophobicContact CG2-CB 4.25Å; L193-A281 HydrophobicContact CD1-CB 4.14Å; I196-A281 HydrophobicContact CD1-CB 4.07Å; I196-A281 HydrophobicContact CG2-CB 3.84Å; S277-A281 WeakPolarHBondContact O-CB 3.43Å; S277-A281 PolarHBondContact O-N 2.94Å; L278-A281 PolarHBondContact O-N 2.96Å; E279-A281 VanDerWaalsContact C-N 3.31Å; E279-A281 PolarHBondContact O-N 3.42Å; A281-T284 PolarHBondContact O-N 2.68Å; A281-V285 WeakPolarHBondContact O-CG2 3.24Å; A281-V285 PolarHBondContact O-N 3.15Å
282	M	97.9	Very high	96.1	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-62.7	-47.3	179.4	-70.2	-172.3	179.9	0	0	111.8	I196 E236 F239 I240 L243 I270 T274 L278 E279 T284 V285 V286	I196-M282 HydrophobicContact CD1-CG 3.92Å; E236-M282 HydrophobicContact CB-CE 4.47Å; F239-M282 HydrophobicContact CB-CE 3.54Å; F239-M282 HydrophobicContact CB-SD 4.02Å; F239-M282 HydrophobicContact CD1-SD 4.22Å; F239-M282 HydrophobicContact CG-CE 4.35Å; F239-M282 HydrophobicContact CG-SD 4.36Å; I240-M282 HydrophobicContact CG1-CE 3.98Å; L243-M282 HydrophobicContact CD1-CB 4.11Å; L243-M282 HydrophobicContact CD1-CG 4.03Å; L243-M282 HydrophobicContact CD1-SD 4.49Å; I270-M282 HydrophobicContact CD1-CB 4.02Å; I270-M282 HydrophobicContact CG1-CB 4.32Å; I270-M282 HydrophobicContact CG1-SD 4.44Å; I270-M282 HydrophobicContact CG2-CB 3.74Å; I270-M282 HydrophobicContact CG2-SD 4.34Å; T274-M282 HydrophobicContact CG2-CE 4.36Å; T274-M282 HydrophobicContact CG2-SD 3.97Å; L278-M282 HydrophobicContact CD1-CE 3.89Å; L278-M282 HydrophobicContact CD2-CE 4.15Å; L278-M282 HydrophobicContact CG-CE 3.97Å; L278-M282 WeakPolarHBondContact O-CG 3.27Å; L278-M282 PolarHBondContact O-N 3.45Å; E279-M282 PolarHBondContact O-N 3.32Å; M282-T284 VanDerWaalsContact C-N 3.26Å; M282-T284 PolarHBondContact O-N 2.97Å; M282-V285 PolarHBondContact O-N 3.26Å; M282-V286 WeakPolarHBondContact O-CG2 3.31Å; M282-V286 PolarHBondContact O-N 3.45Å
283	L	98.4	Very high	96.4	Very high	19 Å²	19	37.4 Å²	37.4	10%	0.099	20%	0.198	C	C	.	.	H	α-helix	trans	-61.7	-36.4	176.7	-71.1	178.5	0	0	0	111.8	E267 I270 K271 E279 V286 K287	E267-L283 HydrophobicContact CB-CD2 3.91Å; E267-L283 HydrophobicContact CG-CD2 4.23Å; I270-L283 HydrophobicContact CB-CD2 4.04Å; I270-L283 HydrophobicContact CD1-CD2 4.37Å; I270-L283 HydrophobicContact CG2-CD2 3.88Å; I270-L283 HydrophobicContact CG2-CG 3.82Å; K271-L283 HydrophobicContact CG-CD1 4.04Å; K271-L283 HydrophobicContact CG-CD2 4.45Å; E279-L283 HydrophobicContact CG-CD1 3.95Å; E279-L283 HydrophobicContact CG-CG 4.39Å; E279-L283 WeakPolarHBondContact O-CB 3.44Å; E279-L283 VanDerWaalsContact O-CG 3.31Å; E279-L283 WeakPolarHBondContact O-CG 3.42Å; E279-L283 PolarHBondContact O-N 2.95Å; L283-V286 PolarHBondContact O-N 3.43Å; L283-K287 WeakPolarHBondContact O-CB 3.35Å; L283-K287 VanDerWaalsContact O-CG 3.26Å; L283-K287 WeakPolarHBondContact O-CG 3.26Å; L283-K287 PolarHBondContact O-N 3.09Å
284	T	98.4	Very high	96.8	Very high	7 Å²	7	36.6 Å²	36.6	4%	0.043	20%	0.198	C	C	.	.	H	α-helix	trans	-65.1	-43.7	177	-64.2	0	0	0	0	111.4	I155 A159 E280 A281 M282 K287 C288 Y295	I155-T284 HydrophobicContact CG2-CG2 3.99Å; A159-T284 HydrophobicContact CB-CG2 3.52Å; E280-T284 WeakPolarHBondContact O-CB 3.34Å; E280-T284 PolarHBondContact O-N 3.29Å; E280-T284 PolarHBondContact O-OG1 2.61Å; A281-T284 PolarHBondContact O-N 2.68Å; M282-T284 VanDerWaalsContact C-N 3.26Å; M282-T284 PolarHBondContact O-N 2.97Å; T284-K287 PolarHBondContact O-N 2.89Å; T284-C288 WeakPolarHBondContact O-CB 3.46Å; T284-C288 PolarHBondContact O-N 2.74Å; T284-C288 PolarHBondContact O-SG 2.92Å; T284-Y295 HydrophobicContact CG2-CE1 4.48Å; T284-Y295 HydrophobicContact CG2-CE2 3.62Å; T284-Y295 WeakPolarHBondContact CG2-OH 3.47Å
285	V	97.2	Very high	97.1	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-61.4	-45.3	176.4	174	0	0	0	0	111	A159 L200 L243 A281 M282 C288 T289	A159-V285 HydrophobicContact CB-CG2 3.87Å; L200-V285 HydrophobicContact CD1-CG2 3.98Å; L200-V285 HydrophobicContact CD2-CG2 3.97Å; L243-V285 HydrophobicContact CB-CG1 4.14Å; A281-V285 WeakPolarHBondContact O-CG2 3.24Å; A281-V285 PolarHBondContact O-N 3.15Å; M282-V285 PolarHBondContact O-N 3.26Å; V285-C288 PolarHBondContact O-N 3.18Å; V285-T289 WeakPolarHBondContact O-CB 3.46Å; V285-T289 PolarHBondContact O-N 3.42Å; V285-T289 PolarHBondContact O-OG1 3.17Å
286	V	97.8	Very high	97.4	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-59.5	-51.4	177.1	173.5	0	0	0	0	110.9	L243 F255 I266 E267 I270 M282 L283 C288 T289 Q290	L243-V286 HydrophobicContact CD2-CG2 4.06Å; F255-V286 HydrophobicContact CE1-CG2 4.35Å; F255-V286 HydrophobicContact CE2-CG1 4.05Å; F255-V286 HydrophobicContact CE2-CG2 4.45Å; F255-V286 HydrophobicContact CZ-CB 4.43Å; F255-V286 HydrophobicContact CZ-CG1 4.31Å; F255-V286 HydrophobicContact CZ-CG2 3.9Å; I266-V286 HydrophobicContact CG2-CG1 3.86Å; I266-V286 HydrophobicContact CG2-CG2 4.31Å; E267-V286 HydrophobicContact CG-CG1 3.88Å; I270-V286 HydrophobicContact CD1-CG2 3.72Å; M282-V286 WeakPolarHBondContact O-CG2 3.31Å; M282-V286 PolarHBondContact O-N 3.45Å; L283-V286 PolarHBondContact O-N 3.43Å; V286-C288 PolarHBondContact O-N 3.44Å; V286-T289 WeakPolarHBondContact O-CB 3.44Å; V286-T289 PolarHBondContact O-N 2.93Å; V286-T289 VanDerWaalsContact O-N 3.12Å; V286-Q290 HydrophobicContact CG1-CG 4.41Å; V286-Q290 WeakPolarHBondContact O-CG 3.45Å; V286-Q290 PolarHBondContact O-N 3.08Å
287	K	98	Very high	97.5	Very high	56 Å²	56	26.7 Å²	26.7	24%	0.243	14%	0.138	C	C	.	.	H	α-helix	trans	-61.2	-42.9	-180	-72.5	177.4	-179	-171.9	0	112.7	L283 T284 T289 Q290 N291 Y295 E298	L283-K287 WeakPolarHBondContact O-CB 3.35Å; L283-K287 VanDerWaalsContact O-CG 3.26Å; L283-K287 WeakPolarHBondContact O-CG 3.26Å; L283-K287 PolarHBondContact O-N 3.09Å; T284-K287 PolarHBondContact O-N 2.89Å; K287-T289 VanDerWaalsContact C-N 3.28Å; K287-T289 PolarHBondContact O-N 3.31Å; K287-Q290 PolarHBondContact O-N 3.5Å; K287-N291 CarbonylContact O-C 3.54Å; K287-N291 PolarHBondContact O-N 3.38Å; K287-Y295 HydrophobicContact CB-CD2 3.93Å; K287-Y295 HydrophobicContact CD-CD2 4.25Å; K287-E298 IonicContact NZ-OE1 2.84Å; K287-E298 PolarHBondContact NZ-OE1 3.18Å; K287-E298 IonicContact NZ-OE2 3.8Å; K287-E298 PolarHBondContact NZ-OE2 3.11Å
288	C	96.6	Very high	97.6	Very high	17 Å²	17	27.1 Å²	27.1	12%	0.115	14%	0.136	C	C	.	.	H	α-helix	trans	-64.5	-34.6	176.9	-69.9	0	0	0	0	112	T284 V285 V286 L292	T284-C288 WeakPolarHBondContact O-CB 3.46Å; T284-C288 PolarHBondContact O-N 2.74Å; T284-C288 PolarHBondContact O-SG 2.92Å; V285-C288 PolarHBondContact O-N 3.18Å; V286-C288 PolarHBondContact O-N 3.44Å; C288-L292 HydrophobicContact CB-CD1 4.07Å
289	T	94.9	Very high	97.7	Very high	17 Å²	17	27.8 Å²	27.8	10%	0.104	14%	0.137	C	C	.	.	H	α-helix	trans	-69.8	-42.8	176.7	-60.4	0	0	0	0	111.8	A248 L251 L252 F255 V285 V286 K287	A248-T289 HydrophobicContact CB-CG2 4.11Å; L251-T289 HydrophobicContact CB-CG2 3.75Å; L251-T289 HydrophobicContact CD1-CG2 4.29Å; L252-T289 HydrophobicContact CD2-CG2 4.34Å; L252-T289 HydrophobicContact CG-CG2 4.25Å; F255-T289 HydrophobicContact CE2-CG2 3.9Å; V285-T289 WeakPolarHBondContact O-CB 3.46Å; V285-T289 PolarHBondContact O-N 3.42Å; V285-T289 PolarHBondContact O-OG1 3.17Å; V286-T289 WeakPolarHBondContact O-CB 3.44Å; V286-T289 PolarHBondContact O-N 2.93Å; V286-T289 VanDerWaalsContact O-N 3.12Å; K287-T289 VanDerWaalsContact C-N 3.28Å; K287-T289 PolarHBondContact O-N 3.31Å
290	Q	95.8	Very high	97.8	Very high	82 Å²	82	25.5 Å²	25.5	38%	0.383	13%	0.127	S	C	.	.	H	α-helix	trans	-70	-52.9	179.1	-72.4	171.9	-27.4	0	0	112.6	L252 F255 E267 V286 K287	L252-Q290 HydrophobicContact CD2-CG 4.27Å; F255-Q290 HydrophobicContact CD2-CG 4.41Å; E267-Q290 PolarHBondContact OE1-NE2 3.48Å; E267-Q290 PolarHBondContact OE1-OE1 3.37Å; V286-Q290 HydrophobicContact CG1-CG 4.41Å; V286-Q290 WeakPolarHBondContact O-CG 3.45Å; V286-Q290 PolarHBondContact O-N 3.08Å; K287-Q290 PolarHBondContact O-N 3.5Å
291	N	96.6	Very high	97.8	Very high	54 Å²	54	24.2 Å²	24.2	29%	0.289	12%	0.119	S	C	.	.	H	α-helix	trans	-161.1	100	179.4	-167.1	-47.8	0	0	0	111.4	K287 H293 S294 Y295 H332	K287-N291 CarbonylContact O-C 3.54Å; K287-N291 PolarHBondContact O-N 3.38Å; N291-H293 VanDerWaalsContact C-N 3.31Å; N291-H293 PolarHBondContact O-N 3.45Å; N291-H293 PolarHBondContact OD1-N 2.75Å; N291-H293 VanDerWaalsContact OD1-N 3.11Å; N291-S294 PolarHBondContact O-N 2.99Å; N291-S294 WeakPolarHBondContact OD1-CB 3.31Å; N291-S294 PolarHBondContact OD1-N 3.09Å; N291-Y295 PolarHBondContact O-N 2.82Å; N291-H332 PolarHBondContact ND2-CE1 3.13Å
292	L	96.8	Very high	97.8	Very high	45 Å²	45	29.8 Å²	29.8	24%	0.236	14%	0.141	C	C	.	.	H	α-helix	trans	-57.7	-39.5	179	-172.2	63.8	0	0	0	113.4	C288 Y295 F296	C288-L292 HydrophobicContact CB-CD1 4.07Å; L292-Y295 WeakPolarHBondContact O-CB 3.44Å; L292-Y295 PolarHBondContact O-N 3.45Å; L292-F296 HydrophobicContact CD1-CD2 4.18Å; L292-F296 HydrophobicContact CD1-CE2 3.61Å; L292-F296 HydrophobicContact CD1-CZ 4.38Å; L292-F296 HydrophobicContact CD2-CE2 4.34Å; L292-F296 HydrophobicContact CG-CD2 4.06Å; L292-F296 HydrophobicContact CG-CE2 3.76Å; L292-F296 VanDerWaalsContact O-CD2 3.24Å; L292-F296 WeakPolarHBondContact O-CD2 3.29Å; L292-F296 PolarHBondContact O-N 3.43Å; L292-F296 VanDerWaalsContact O-N 3.12Å
293	H	98.3	Very high	97.8	Very high	52 Å²	52	29.9 Å²	29.9	24%	0.241	14%	0.142	C	C	.	.	H	α-helix	trans	-69.7	-39.7	-178.7	-45.1	-52.4	0	0	0	111.3	N291 F296 A297 D325 L328 I329	N291-H293 VanDerWaalsContact C-N 3.31Å; N291-H293 PolarHBondContact O-N 3.45Å; N291-H293 PolarHBondContact OD1-N 2.75Å; N291-H293 VanDerWaalsContact OD1-N 3.11Å; H293-F296 PolarHBondContact O-N 3.12Å; H293-A297 WeakPolarHBondContact O-CB 3.47Å; H293-A297 PolarHBondContact O-N 3.33Å; H293-D325 IonicContact CE1-OD2 2.74Å; H293-D325 PolarHBondContact CE1-OD2 3.06Å; H293-D325 VanDerWaalsContact CE1-OD2 3.24Å; H293-D325 IonicContact ND1-OD2 2.75Å; H293-D325 PolarHBondContact ND1-OD2 3.47Å; H293-L328 HydrophobicContact CB-CB 4.25Å; H293-I329 HydrophobicContact CB-CG1 4.3Å
294	S	98.4	Very high	97.8	Very high	30 Å²	30	29.1 Å²	29.1	21%	0.21	14%	0.138	C	C	.	.	H	α-helix	trans	-65	-38.9	174.4	-161.9	0	0	0	0	111.7	N291 A297 E298 M336	N291-S294 PolarHBondContact O-N 2.99Å; N291-S294 WeakPolarHBondContact OD1-CB 3.31Å; N291-S294 PolarHBondContact OD1-N 3.09Å; S294-A297 PolarHBondContact O-N 2.9Å; S294-E298 WeakPolarHBondContact O-CB 3.21Å; S294-E298 PolarHBondContact O-N 3.32Å; S294-M336 PolarHBondContact OG-SD 2.97Å
295	Y	98.7	Very high	97.7	Very high	7 Å²	7	33.8 Å²	33.8	3%	0.027	16%	0.157	C	C	.	.	H	α-helix	trans	-58.8	-49.7	173.5	167.6	-100.5	0	0	0	111.6	E156 T284 K287 N291 L292 A297 E298 R299	E156-Y295 HydrophobicContact CG-CE1 4.32Å; E156-Y295 WeakPolarHBondContact CG-OH 3.45Å; T284-Y295 HydrophobicContact CG2-CE1 4.48Å; T284-Y295 HydrophobicContact CG2-CE2 3.62Å; T284-Y295 WeakPolarHBondContact CG2-OH 3.47Å; K287-Y295 HydrophobicContact CB-CD2 3.93Å; K287-Y295 HydrophobicContact CD-CD2 4.25Å; N291-Y295 PolarHBondContact O-N 2.82Å; L292-Y295 WeakPolarHBondContact O-CB 3.44Å; L292-Y295 PolarHBondContact O-N 3.45Å; Y295-A297 VanDerWaalsContact C-N 3.34Å; Y295-A297 PolarHBondContact O-N 3.14Å; Y295-E298 WeakPolarHBondContact O-CB 3.35Å; Y295-E298 PolarHBondContact O-N 3.04Å; Y295-R299 HydrophobicContact CD1-CG 4.31Å; Y295-R299 HydrophobicContact CD2-CG 4.27Å; Y295-R299 HydrophobicContact CE1-CG 3.8Å; Y295-R299 HydrophobicContact CE2-CG 3.76Å; Y295-R299 WeakPolarHBondContact O-CG 3.33Å; Y295-R299 PolarHBondContact O-N 3.39Å
296	F	98.8	Very high	97.5	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-66.5	-35.9	178.5	-76.1	-60.8	0	0	0	112.7	L292 H293 E298 R299 L300 N317 R321 I329	L292-F296 HydrophobicContact CD1-CD2 4.18Å; L292-F296 HydrophobicContact CD1-CE2 3.61Å; L292-F296 HydrophobicContact CD1-CZ 4.38Å; L292-F296 HydrophobicContact CD2-CE2 4.34Å; L292-F296 HydrophobicContact CG-CD2 4.06Å; L292-F296 HydrophobicContact CG-CE2 3.76Å; L292-F296 VanDerWaalsContact O-CD2 3.24Å; L292-F296 WeakPolarHBondContact O-CD2 3.29Å; L292-F296 PolarHBondContact O-N 3.43Å; L292-F296 VanDerWaalsContact O-N 3.12Å; H293-F296 PolarHBondContact O-N 3.12Å; F296-E298 VanDerWaalsContact C-N 3.3Å; F296-E298 PolarHBondContact O-N 3.44Å; F296-R299 PolarHBondContact O-N 2.92Å; F296-L300 VanDerWaalsContact O-CG 3.28Å; F296-L300 WeakPolarHBondContact O-CG 3.29Å; F296-L300 PolarHBondContact O-N 2.97Å; F296-N317 HydrophobicContact CD1-CB 4.46Å; F296-N317 WeakPolarHBondContact CD1-OD1 3.2Å; F296-N317 WeakPolarHBondContact CE1-OD1 3.31Å; F296-R321 HydrophobicContact CD1-CG 4.33Å; F296-R321 HydrophobicContact CD2-CG 4.29Å; F296-R321 HydrophobicContact CE1-CG 4.39Å; F296-R321 HydrophobicContact CE2-CG 4.34Å; F296-R321 VanDerWaalsContact CE2-CZ 3.46Å; F296-R321 HydrophobicContact CG-CG 4.29Å; F296-R321 HydrophobicContact CZ-CG 4.39Å; F296-I329 HydrophobicContact CB-CD1 3.59Å; F296-I329 HydrophobicContact CB-CG1 3.9Å; F296-I329 HydrophobicContact CB-CG2 4.24Å; F296-I329 HydrophobicContact CD2-CD1 4.13Å; F296-I329 HydrophobicContact CG-CD1 4.07Å
297	A	98.8	Very high	97.2	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59.4	-43.5	172.2	0	0	0	0	0	111.3	H293 S294 Y295 L300 Y301 I329 H332 F333 M336	H293-A297 WeakPolarHBondContact O-CB 3.47Å; H293-A297 PolarHBondContact O-N 3.33Å; S294-A297 PolarHBondContact O-N 2.9Å; Y295-A297 VanDerWaalsContact C-N 3.34Å; Y295-A297 PolarHBondContact O-N 3.14Å; A297-L300 PolarHBondContact O-N 3.26Å; A297-Y301 WeakPolarHBondContact O-CB 3.33Å; A297-Y301 PolarHBondContact O-N 3Å; A297-I329 HydrophobicContact CB-CG2 4.23Å; A297-H332 HydrophobicContact CB-CB 4.01Å; A297-F333 HydrophobicContact CB-CB 3.98Å; A297-F333 HydrophobicContact CB-CD2 4.23Å; A297-F333 WeakPolarHBondContact O-CD2 3.33Å; A297-M336 HydrophobicContact CB-SD 4.15Å
298	E	98.6	Very high	96.9	Very high	43 Å²	43	42.2 Å²	42.2	20%	0.201	25%	0.249	C	C	.	.	H	α-helix	trans	-64.1	-43.6	175.8	-170.7	-169.9	148.6	0	0	112.5	K287 S294 Y295 F296 L300 Y301 Y302 M336 Y337	K287-E298 IonicContact NZ-OE1 2.84Å; K287-E298 PolarHBondContact NZ-OE1 3.18Å; K287-E298 IonicContact NZ-OE2 3.8Å; K287-E298 PolarHBondContact NZ-OE2 3.11Å; S294-E298 WeakPolarHBondContact O-CB 3.21Å; S294-E298 PolarHBondContact O-N 3.32Å; Y295-E298 WeakPolarHBondContact O-CB 3.35Å; Y295-E298 PolarHBondContact O-N 3.04Å; F296-E298 VanDerWaalsContact C-N 3.3Å; F296-E298 PolarHBondContact O-N 3.44Å; E298-L300 PolarHBondContact O-N 3.33Å; E298-Y301 PolarHBondContact O-N 2.91Å; E298-Y302 HydrophobicContact CG-CD2 3.68Å; E298-Y302 HydrophobicContact CG-CE2 3.58Å; E298-Y302 WeakPolarHBondContact O-CD2 3.33Å; E298-Y302 PolarHBondContact O-N 3.41Å; E298-Y302 WeakPolarHBondContact OE1-CE2 3.44Å; E298-M336 HydrophobicContact CB-CE 4.29Å; E298-Y337 VanDerWaalsContact CA-OH 3.29Å; E298-Y337 WeakPolarHBondContact CA-OH 3.3Å
299	R	98.6	Very high	96.9	Very high	36 Å²	36	42.8 Å²	42.8	14%	0.136	25%	0.252	C	S	.	.	H	α-helix	trans	-61.1	-43.1	176.7	-71.9	-65.9	-66.8	-175.1	-10.9	112.3	E156 E280 Y295 F296 Y301 A303	E156-R299 IonicContact OE2-CZ 3.78Å; E156-R299 VanDerWaalsContact OE2-CZ 3.23Å; E156-R299 IonicContact OE2-NE 3.31Å; E156-R299 PolarHBondContact OE2-NE 3.32Å; E156-R299 IonicContact OE2-NH2 2.64Å; E156-R299 PolarHBondContact OE2-NH2 2.88Å; E280-R299 IonicContact OE1-NH1 2.78Å; E280-R299 PolarHBondContact OE1-NH1 3.45Å; Y295-R299 HydrophobicContact CD1-CG 4.31Å; Y295-R299 HydrophobicContact CD2-CG 4.27Å; Y295-R299 HydrophobicContact CE1-CG 3.8Å; Y295-R299 HydrophobicContact CE2-CG 3.76Å; Y295-R299 WeakPolarHBondContact O-CG 3.33Å; Y295-R299 PolarHBondContact O-N 3.39Å; F296-R299 PolarHBondContact O-N 2.92Å; R299-Y301 VanDerWaalsContact C-N 3.33Å; R299-A303 WeakPolarHBondContact O-CB 3.41Å; R299-A303 PolarHBondContact O-N 3.11Å
300	L	98.7	Very high	97.1	Very high	1 Å²	1	50 Å²	50	1%	0.005	28%	0.278	C	S	.	.	H	α-helix	trans	-63.7	-41	175.5	-70	170.6	0	0	0	111.3	F296 A297 E298 A303 M304 L314 N317 I318 I329 F333 L341	F296-L300 VanDerWaalsContact O-CG 3.28Å; F296-L300 WeakPolarHBondContact O-CG 3.29Å; F296-L300 PolarHBondContact O-N 2.97Å; A297-L300 PolarHBondContact O-N 3.26Å; E298-L300 PolarHBondContact O-N 3.33Å; L300-A303 WeakPolarHBondContact O-CB 3.04Å; L300-A303 PolarHBondContact O-N 3.31Å; L300-M304 VanDerWaalsContact O-CE 3.3Å; L300-M304 WeakPolarHBondContact O-CE 3.05Å; L300-M304 PolarHBondContact O-N 3.4Å; L300-L314 HydrophobicContact CD2-CD1 3.72Å; L300-N317 HydrophobicContact CD2-CB 3.77Å; L300-N317 HydrophobicContact CG-CB 4.3Å; L300-I318 HydrophobicContact CD2-CD1 4.36Å; L300-I318 HydrophobicContact CD2-CG1 3.85Å; L300-I329 HydrophobicContact CD1-CG2 3.64Å; L300-F333 HydrophobicContact CB-CD2 4.34Å; L300-F333 HydrophobicContact CB-CE2 4.07Å; L300-L341 HydrophobicContact CB-CD1 4.13Å; L300-L341 HydrophobicContact CD1-CD1 4.04Å; L300-L341 HydrophobicContact CD1-CD2 3.91Å
301	Y	98.6	Very high	97.2	Very high	42 Å²	42	47 Å²	47	17%	0.165	26%	0.264	C	S	.	.	H	α-helix	trans	-63.2	-50.8	178.5	175.8	-103.3	0	0	0	111.2	A297 E298 R299 A303 M304 K305 F333 Y337 M344	A297-Y301 WeakPolarHBondContact O-CB 3.33Å; A297-Y301 PolarHBondContact O-N 3Å; E298-Y301 PolarHBondContact O-N 2.91Å; R299-Y301 VanDerWaalsContact C-N 3.33Å; Y301-A303 PolarHBondContact O-N 3.22Å; Y301-M304 CarbonylContact O-C 3.59Å; Y301-M304 PolarHBondContact O-N 3.38Å; Y301-M304 VanDerWaalsContact O-N 3.08Å; Y301-K305 HydrophobicContact CD1-CB 4.4Å; Y301-K305 HydrophobicContact CD1-CD 4.32Å; Y301-K305 HydrophobicContact CE1-CB 4.17Å; Y301-K305 HydrophobicContact CE1-CD 3.48Å; Y301-K305 VanDerWaalsContact CE1-CD 3.48Å; Y301-K305 HydrophobicContact CE1-CG 4.08Å; Y301-K305 VanDerWaalsContact O-CB 3.31Å; Y301-K305 WeakPolarHBondContact O-CB 3.35Å; Y301-K305 PolarHBondContact O-N 2.78Å; Y301-K305 VanDerWaalsContact OH-CE 3.29Å; Y301-K305 WeakPolarHBondContact OH-CE 3.29Å; Y301-F333 HydrophobicContact CD2-CZ 4.21Å; Y301-Y337 VanDerWaalsContact CB-CZ 3.49Å; Y301-Y337 HydrophobicContact CD1-CD1 4.06Å; Y301-Y337 AromaticContact CD1-CE1 3.44Å; Y301-Y337 HydrophobicContact CD1-CE1 3.44Å; Y301-Y337 VanDerWaalsContact CD1-CE1 3.44Å; Y301-Y337 HydrophobicContact CD1-CE2 4.25Å; Y301-Y337 AromaticContact CD1-CZ 3.55Å; Y301-Y337 AromaticContact CD2-CD1 3.67Å; Y301-Y337 HydrophobicContact CD2-CD1 3.67Å; Y301-Y337 AromaticContact CD2-CD2 3.81Å; Y301-Y337 HydrophobicContact CD2-CD2 3.81Å; Y301-Y337 AromaticContact CD2-CE1 3.88Å; Y301-Y337 HydrophobicContact CD2-CE1 3.88Å; Y301-Y337 HydrophobicContact CD2-CE2 4.02Å; Y301-Y337 AromaticContact CD2-CG 3.64Å; Y301-Y337 HydrophobicContact CD2-CG 3.64Å; Y301-Y337 HydrophobicContact CE1-CD1 4.02Å; Y301-Y337 AromaticContact CE1-CE1 3.64Å; Y301-Y337 HydrophobicContact CE1-CE1 3.64Å; Y301-Y337 AromaticContact CE2-CD1 3.69Å; Y301-Y337 HydrophobicContact CE2-CD1 3.69Å; Y301-Y337 HydrophobicContact CE2-CE1 4.11Å; Y301-Y337 AromaticContact CE2-CG 3.96Å; Y301-Y337 HydrophobicContact CE2-CG 3.96Å; Y301-Y337 AromaticContact CG-CD1 3.87Å; Y301-Y337 HydrophobicContact CG-CD1 3.87Å; Y301-Y337 AromaticContact CG-CD2 3.94Å; Y301-Y337 HydrophobicContact CG-CD2 3.94Å; Y301-Y337 AromaticContact CG-CE1 3.56Å; Y301-Y337 HydrophobicContact CG-CE1 3.56Å; Y301-Y337 AromaticContact CG-CE2 3.64Å; Y301-Y337 HydrophobicContact CG-CE2 3.64Å; Y301-Y337 HydrophobicContact CG-CG 4.06Å; Y301-Y337 AromaticContact CG-CZ 3.43Å; Y301-Y337 VanDerWaalsContact CG-CZ 3.43Å; Y301-Y337 AromaticContact CZ-CD1 3.88Å; Y301-M344 HydrophobicContact CD2-CE 3.79Å; Y301-M344 HydrophobicContact CD2-SD 3.64Å; Y301-M344 HydrophobicContact CE2-CE 3.93Å; Y301-M344 HydrophobicContact CE2-SD 4.06Å
302	Y	98.3	Very high	97.2	Very high	117 Å²	117	45.2 Å²	45.2	46%	0.459	26%	0.259	S	S	.	.	H	α-helix	trans	-71.2	-14.9	177.8	-74.1	-65.9	0	0	0	114.2	E298 M304 K305	E298-Y302 HydrophobicContact CG-CD2 3.68Å; E298-Y302 HydrophobicContact CG-CE2 3.58Å; E298-Y302 WeakPolarHBondContact O-CD2 3.33Å; E298-Y302 PolarHBondContact O-N 3.41Å; E298-Y302 WeakPolarHBondContact OE1-CE2 3.44Å; Y302-M304 VanDerWaalsContact C-N 3.28Å; Y302-K305 HydrophobicContact CD1-CB 4.35Å; Y302-K305 HydrophobicContact CD1-CD 3.88Å; Y302-K305 HydrophobicContact CE1-CD 3.77Å
303	A	98.1	Very high	97.3	Very high	3 Å²	3	44 Å²	44	3%	0.025	25%	0.254	C	S	.	.	H	α-helix	trans	-70.8	-26.8	169.6	0	0	0	0	0	112.4	R299 L300 Y301 T309 R310 T313 L314	R299-A303 WeakPolarHBondContact O-CB 3.41Å; R299-A303 PolarHBondContact O-N 3.11Å; L300-A303 WeakPolarHBondContact O-CB 3.04Å; L300-A303 PolarHBondContact O-N 3.31Å; Y301-A303 PolarHBondContact O-N 3.22Å; A303-T309 CarbonylContact O-C 3.57Å; A303-T309 WeakPolarHBondContact O-CA 3.3Å; A303-T309 WeakPolarHBondContact O-CG2 3.4Å; A303-R310 HydrophobicContact CB-CB 4.33Å; A303-R310 PolarHBondContact O-N 3.02Å; A303-T313 HydrophobicContact CB-CG2 4Å; A303-L314 HydrophobicContact CB-CB 4.26Å
304	M	98.3	Very high	97.3	Very high	2 Å²	2	41.5 Å²	41.5	1%	0.01	24%	0.242	C	C	.	.	H	α-helix	trans	-109.7	-15.4	-179.3	-68.1	179.4	-67.4	0	0	112.6	L300 Y301 Y302 G306 T309 L314 F333 L341 M344 I345 D348	L300-M304 VanDerWaalsContact O-CE 3.3Å; L300-M304 WeakPolarHBondContact O-CE 3.05Å; L300-M304 PolarHBondContact O-N 3.4Å; Y301-M304 CarbonylContact O-C 3.59Å; Y301-M304 PolarHBondContact O-N 3.38Å; Y301-M304 VanDerWaalsContact O-N 3.08Å; Y302-M304 VanDerWaalsContact C-N 3.28Å; M304-G306 PolarHBondContact O-N 3.43Å; M304-T309 HydrophobicContact CG-CG2 4.09Å; M304-L314 HydrophobicContact CE-CD1 4.22Å; M304-L314 HydrophobicContact CG-CD1 4.38Å; M304-L314 HydrophobicContact CG-CD2 4.08Å; M304-L314 HydrophobicContact SD-CD1 4.05Å; M304-L314 HydrophobicContact SD-CD2 4.09Å; M304-F333 HydrophobicContact CE-CE2 4.38Å; M304-F333 HydrophobicContact CE-CZ 4.2Å; M304-L341 HydrophobicContact CE-CD1 3.76Å; M304-M344 HydrophobicContact CB-CE 3.43Å; M304-M344 VanDerWaalsContact CB-CE 3.43Å; M304-M344 HydrophobicContact CB-CG 3.95Å; M304-M344 HydrophobicContact CB-SD 4.15Å; M304-M344 HydrophobicContact CE-CB 3.95Å; M304-M344 HydrophobicContact CE-CG 3.79Å; M304-M344 HydrophobicContact CE-SD 4.08Å; M304-M344 HydrophobicContact SD-CB 4.23Å; M304-M344 HydrophobicContact SD-CG 3.92Å; M304-I345 HydrophobicContact CE-CG1 4.32Å; M304-I345 HydrophobicContact SD-CG1 3.78Å; M304-D348 VanDerWaalsContact C-OD2 3.31Å; M304-D348 WeakPolarHBondContact CA-OD2 3.5Å; M304-D348 HydrophobicContact CB-CB 4.32Å; M304-D348 VanDerWaalsContact CB-OD2 3.23Å; M304-D348 WeakPolarHBondContact CB-OD2 3.48Å; M304-D348 HydrophobicContact CG-CB 4.2Å; M304-D348 HydrophobicContact SD-CB 4.43Å
305	K	96.2	Very high	97.3	Very high	105 Å²	105	40.3 Å²	40.3	46%	0.457	23%	0.233	S	C	.	.	S	Bend	trans	-76.1	125.4	179.8	-168.5	-163	-165.8	164.1	0	110.8	Y301 Y302 M344	Y301-K305 HydrophobicContact CD1-CB 4.4Å; Y301-K305 HydrophobicContact CD1-CD 4.32Å; Y301-K305 HydrophobicContact CE1-CB 4.17Å; Y301-K305 HydrophobicContact CE1-CD 3.48Å; Y301-K305 VanDerWaalsContact CE1-CD 3.48Å; Y301-K305 HydrophobicContact CE1-CG 4.08Å; Y301-K305 VanDerWaalsContact O-CB 3.31Å; Y301-K305 WeakPolarHBondContact O-CB 3.35Å; Y301-K305 PolarHBondContact O-N 2.78Å; Y301-K305 VanDerWaalsContact OH-CE 3.29Å; Y301-K305 WeakPolarHBondContact OH-CE 3.29Å; Y302-K305 HydrophobicContact CD1-CB 4.35Å; Y302-K305 HydrophobicContact CD1-CD 3.88Å; Y302-K305 HydrophobicContact CE1-CD 3.77Å; K305-M344 HydrophobicContact CB-CE 4.28Å
306	G	93.4	Very high	97.3	Very high	63 Å²	63	40.1 Å²	40.1	65%	0.649	23%	0.232	S	C	*	.	S	Bend	trans	111.9	-150.4	166.7	0	0	0	0	0	112.7	M304 G308	M304-G306 PolarHBondContact O-N 3.43Å; G306-G308 PolarHBondContact O-N 3.45Å
307	A	90.3	Very high	97.3	Very high	115 Å²	115	40.2 Å²	40.2	95%	0.95	23%	0.233	S	C	*	.	S	Bend	trans	-81.9	109	179.4	0	0	0	0	0	110.5
308	G	93.3	Very high	97.3	Very high	56 Å²	56	40.2 Å²	40.2	58%	0.577	23%	0.233	S	C	*	.	S	Bend	trans	76.1	-170	-178.4	0	0	0	0	0	113.2	G306	G306-G308 PolarHBondContact O-N 3.45Å
309	T	96.4	Very high	97.3	Very high	29 Å²	29	38.8 Å²	38.8	18%	0.178	23%	0.227	C	C	.	.			trans	-130	136	-171.8	-46.3	0	0	0	0	110.5	A303 M304 D311 L314 D348	A303-T309 CarbonylContact O-C 3.57Å; A303-T309 WeakPolarHBondContact O-CA 3.3Å; A303-T309 WeakPolarHBondContact O-CG2 3.4Å; M304-T309 HydrophobicContact CG-CG2 4.09Å; T309-D311 VanDerWaalsContact C-N 3.26Å; T309-D311 PolarHBondContact O-N 3.41Å; T309-L314 HydrophobicContact CG2-CD2 3.96Å; T309-D348 PolarHBondContact OG1-OD2 2.88Å
310	R	97.4	Very high	97.2	Very high	167 Å²	167	37.9 Å²	37.9	63%	0.63	23%	0.226	S	C	*	.			trans	-82.6	71.7	169.5	-64.1	-178	176.1	-177	-1.6	109.5	A303 G312 T313 L314	A303-R310 HydrophobicContact CB-CB 4.33Å; A303-R310 PolarHBondContact O-N 3.02Å; R310-G312 PolarHBondContact O-N 2.88Å; R310-G312 VanDerWaalsContact O-N 3.09Å; R310-T313 WeakPolarHBondContact O-CB 3.27Å; R310-T313 PolarHBondContact O-N 3.43Å; R310-L314 PolarHBondContact O-N 3.16Å
311	D	97.9	Very high	97.2	Very high	19 Å²	19	38.2 Å²	38.2	10%	0.102	23%	0.227	C	C	.	.	H	α-helix	trans	-57	-32.1	-170.8	-55.7	-78.7	0	0	0	113.4	K120 T309 L314 I315 Y353	K120-D311 HydrophobicContact CD-CB 4.48Å; K120-D311 WeakPolarHBondContact CD-OD1 3.44Å; K120-D311 VanDerWaalsContact CE-CG 3.41Å; K120-D311 WeakPolarHBondContact CE-OD1 3.45Å; K120-D311 WeakPolarHBondContact CE-OD2 3.23Å; K120-D311 IonicContact NZ-OD1 2.65Å; K120-D311 PolarHBondContact NZ-OD1 3.31Å; K120-D311 IonicContact NZ-OD2 3.6Å; K120-D311 PolarHBondContact NZ-OD2 3.25Å; T309-D311 VanDerWaalsContact C-N 3.26Å; T309-D311 PolarHBondContact O-N 3.41Å; D311-L314 PolarHBondContact O-N 3Å; D311-I315 HydrophobicContact CB-CD1 4.44Å; D311-I315 VanDerWaalsContact O-CB 3.29Å; D311-I315 WeakPolarHBondContact O-CB 3.38Å; D311-I315 WeakPolarHBondContact O-CD1 3.39Å; D311-I315 WeakPolarHBondContact O-CG1 3.33Å; D311-I315 PolarHBondContact O-N 3.24Å; D311-Y353 WeakPolarHBondContact OD1-CE1 3.45Å
312	G	98	Very high	97	Very high	18 Å²	18	36.8 Å²	36.8	19%	0.186	22%	0.224	C	C	.	.	H	α-helix	trans	-61.1	-44.3	175.4	0	0	0	0	0	112.6	R310 R316	R310-G312 PolarHBondContact O-N 2.88Å; R310-G312 VanDerWaalsContact O-N 3.09Å; G312-R316 VanDerWaalsContact O-CB 3.25Å; G312-R316 WeakPolarHBondContact O-CB 3.25Å; G312-R316 PolarHBondContact O-N 3.22Å
313	T	98.4	Very high	96.8	Very high	19 Å²	19	35.1 Å²	35.1	12%	0.117	22%	0.22	C	C	.	.	H	α-helix	trans	-67.5	-42.9	175.4	-59.2	0	0	0	0	111	A303 R310 N317	A303-T313 HydrophobicContact CB-CG2 4Å; R310-T313 WeakPolarHBondContact O-CB 3.27Å; R310-T313 PolarHBondContact O-N 3.43Å; T313-N317 VanDerWaalsContact CG2-ND2 3.3Å; T313-N317 WeakPolarHBondContact CG2-ND2 3.49Å; T313-N317 WeakPolarHBondContact O-CB 3.44Å; T313-N317 PolarHBondContact O-N 2.95Å; T313-N317 PolarHBondContact O-ND2 2.77Å
314	L	98.7	Very high	96.6	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-60.9	-50.6	178.1	-178.5	57.9	0	0	0	111.6	L300 A303 M304 T309 R310 D311 I318 T349 L357	L300-L314 HydrophobicContact CD2-CD1 3.72Å; A303-L314 HydrophobicContact CB-CB 4.26Å; M304-L314 HydrophobicContact CE-CD1 4.22Å; M304-L314 HydrophobicContact CG-CD1 4.38Å; M304-L314 HydrophobicContact CG-CD2 4.08Å; M304-L314 HydrophobicContact SD-CD1 4.05Å; M304-L314 HydrophobicContact SD-CD2 4.09Å; T309-L314 HydrophobicContact CG2-CD2 3.96Å; R310-L314 PolarHBondContact O-N 3.16Å; D311-L314 PolarHBondContact O-N 3Å; L314-I318 HydrophobicContact CD1-CD1 3.52Å; L314-I318 HydrophobicContact CD1-CG1 4.3Å; L314-I318 HydrophobicContact CG-CD1 4.1Å; L314-I318 WeakPolarHBondContact O-CB 3.45Å; L314-I318 WeakPolarHBondContact O-CG1 3.07Å; L314-I318 PolarHBondContact O-N 2.9Å; L314-T349 HydrophobicContact CD2-CG2 4.1Å; L314-L357 HydrophobicContact CD2-CD1 3.83Å; L314-L357 HydrophobicContact CG-CD1 4.29Å
315	I	98.8	Very high	96.5	Very high	4 Å²	4	39.4 Å²	39.4	2%	0.021	24%	0.242	C	C	.	.	H	α-helix	trans	-60.9	-53.3	178.9	-69.1	167	0	0	0	110.2	R123 L124 A127 D311 N317 I318 V319 Y353	R123-I315 HydrophobicContact CB-CD1 4.02Å; L124-I315 HydrophobicContact CB-CD1 4.29Å; L124-I315 HydrophobicContact CB-CG1 4.33Å; L124-I315 HydrophobicContact CD1-CG1 4.34Å; L124-I315 HydrophobicContact CD1-CG2 4Å; A127-I315 HydrophobicContact CB-CG2 3.86Å; D311-I315 HydrophobicContact CB-CD1 4.44Å; D311-I315 VanDerWaalsContact O-CB 3.29Å; D311-I315 WeakPolarHBondContact O-CB 3.38Å; D311-I315 WeakPolarHBondContact O-CD1 3.39Å; D311-I315 WeakPolarHBondContact O-CG1 3.33Å; D311-I315 PolarHBondContact O-N 3.24Å; I315-N317 VanDerWaalsContact C-N 3.34Å; I315-N317 PolarHBondContact O-N 2.66Å; I315-I318 PolarHBondContact O-N 2.78Å; I315-V319 HydrophobicContact CG2-CG2 4.07Å; I315-V319 VanDerWaalsContact O-CB 3.31Å; I315-V319 WeakPolarHBondContact O-CB 3.48Å; I315-V319 VanDerWaalsContact O-CG2 3.26Å; I315-V319 WeakPolarHBondContact O-CG2 3.28Å; I315-V319 PolarHBondContact O-N 2.71Å; I315-Y353 HydrophobicContact CD1-CE2 3.8Å; I315-Y353 HydrophobicContact CG1-CE2 3.74Å; I315-Y353 WeakPolarHBondContact CG1-OH 3.23Å
316	R	98.7	Very high	96.6	Very high	4 Å²	4	34.8 Å²	34.8	2%	0.015	22%	0.222	C	C	.	.	H	α-helix	trans	-60.5	-42.7	-175.8	-179	177.5	56.9	-99.2	-5.9	112.5	Y135 E139 E156 G312 S320	Y135-R316 HydrophobicContact CE1-CB 4.35Å; Y135-R316 HydrophobicContact CE1-CG 3.98Å; Y135-R316 WeakPolarHBondContact OH-CA 3.33Å; E139-R316 HydrophobicContact CG-CG 4.14Å; E139-R316 WeakPolarHBondContact OE2-CD 3.34Å; E139-R316 IonicContact OE2-CZ 2.65Å; E139-R316 IonicContact OE2-NE 3.9Å; E139-R316 IonicContact OE2-NH1 2.88Å; E139-R316 PolarHBondContact OE2-NH1 3.2Å; E156-R316 IonicContact OE1-CZ 2.65Å; E156-R316 VanDerWaalsContact OE1-CZ 3.27Å; E156-R316 IonicContact OE1-NE 2.83Å; E156-R316 PolarHBondContact OE1-NE 3.41Å; E156-R316 IonicContact OE1-NH2 3.82Å; E156-R316 PolarHBondContact OE1-NH2 2.98Å; E156-R316 IonicContact OE2-NH2 2.75Å; E156-R316 PolarHBondContact OE2-NH2 3.34Å; G312-R316 VanDerWaalsContact O-CB 3.25Å; G312-R316 WeakPolarHBondContact O-CB 3.25Å; G312-R316 PolarHBondContact O-N 3.22Å; R316-S320 WeakPolarHBondContact O-CB 3.2Å; R316-S320 PolarHBondContact O-N 3.36Å; R316-S320 PolarHBondContact O-OG 3.04Å
317	N	98.6	Very high	96.6	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-72.9	-37.4	-179.4	-72.2	-65.5	0	0	0	112.3	E156 F296 L300 T313 I315 R321	E156-N317 PolarHBondContact OE1-ND2 3.36Å; E156-N317 PolarHBondContact OE1-OD1 3.3Å; E156-N317 PolarHBondContact OE2-ND2 2.98Å; F296-N317 HydrophobicContact CD1-CB 4.46Å; F296-N317 WeakPolarHBondContact CD1-OD1 3.2Å; F296-N317 WeakPolarHBondContact CE1-OD1 3.31Å; L300-N317 HydrophobicContact CD2-CB 3.77Å; L300-N317 HydrophobicContact CG-CB 4.3Å; T313-N317 VanDerWaalsContact CG2-ND2 3.3Å; T313-N317 WeakPolarHBondContact CG2-ND2 3.49Å; T313-N317 WeakPolarHBondContact O-CB 3.44Å; T313-N317 PolarHBondContact O-N 2.95Å; T313-N317 PolarHBondContact O-ND2 2.77Å; I315-N317 VanDerWaalsContact C-N 3.34Å; I315-N317 PolarHBondContact O-N 2.66Å; N317-R321 VanDerWaalsContact O-CB 3.28Å; N317-R321 WeakPolarHBondContact O-CB 3.43Å; N317-R321 WeakPolarHBondContact O-CG 3.49Å; N317-R321 PolarHBondContact O-N 2.94Å
318	I	98.4	Very high	97	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-67.1	-47.3	174.2	-71.2	173.5	0	0	0	110.9	L300 L314 I315 S322 I345 L357 L360 V361	L300-I318 HydrophobicContact CD2-CD1 4.36Å; L300-I318 HydrophobicContact CD2-CG1 3.85Å; L314-I318 HydrophobicContact CD1-CD1 3.52Å; L314-I318 HydrophobicContact CD1-CG1 4.3Å; L314-I318 HydrophobicContact CG-CD1 4.1Å; L314-I318 WeakPolarHBondContact O-CB 3.45Å; L314-I318 WeakPolarHBondContact O-CG1 3.07Å; L314-I318 PolarHBondContact O-N 2.9Å; I315-I318 PolarHBondContact O-N 2.78Å; I318-S322 WeakPolarHBondContact O-CB 3.37Å; I318-S322 PolarHBondContact O-N 3.34Å; I318-I345 HydrophobicContact CD1-CD1 3.84Å; I318-L357 HydrophobicContact CD1-CD2 3.78Å; I318-L357 HydrophobicContact CG2-CD2 4.38Å; I318-L360 HydrophobicContact CG2-CB 4.16Å; I318-L360 HydrophobicContact CG2-CD1 4.2Å; I318-V361 HydrophobicContact CD1-CG2 4.18Å; I318-V361 HydrophobicContact CG2-CG2 4.46Å
319	V	98.2	Very high	97.2	Very high	14 Å²	14	27.8 Å²	27.8	9%	0.085	14%	0.14	C	C	.	.	H	α-helix	trans	-66.7	-47.3	-177.4	171.7	0	0	0	0	111.8	L124 A127 L128 Y135 I315 R321 S322	L124-V319 HydrophobicContact CD1-CG2 3.72Å; A127-V319 HydrophobicContact CB-CG1 4.36Å; A127-V319 HydrophobicContact CB-CG2 4.12Å; L128-V319 HydrophobicContact CD2-CG1 4.27Å; L128-V319 HydrophobicContact CD2-CG2 3.99Å; L128-V319 HydrophobicContact CG-CG2 4.45Å; Y135-V319 HydrophobicContact CD1-CG1 4.15Å; Y135-V319 HydrophobicContact CE1-CB 4.17Å; Y135-V319 HydrophobicContact CE1-CG1 3.9Å; I315-V319 HydrophobicContact CG2-CG2 4.07Å; I315-V319 VanDerWaalsContact O-CB 3.31Å; I315-V319 WeakPolarHBondContact O-CB 3.48Å; I315-V319 VanDerWaalsContact O-CG2 3.26Å; I315-V319 WeakPolarHBondContact O-CG2 3.28Å; I315-V319 PolarHBondContact O-N 2.71Å; V319-R321 VanDerWaalsContact C-N 3.27Å; V319-R321 PolarHBondContact O-N 2.85Å; V319-S322 PolarHBondContact O-OG 3.35Å; V319-S322 VanDerWaalsContact O-OG 3.1Å
320	S	97.3	Very high	97.3	Very high	17 Å²	17	27.5 Å²	27.5	12%	0.119	14%	0.137	C	C	.	.	H	α-helix	trans	-71.4	-21	-176.3	63	0	0	0	0	113.7	R161 R316 I324	R161-S320 PolarHBondContact NH2-OG 2.93Å; R316-S320 WeakPolarHBondContact O-CB 3.2Å; R316-S320 PolarHBondContact O-N 3.36Å; R316-S320 PolarHBondContact O-OG 3.04Å; S320-I324 WeakPolarHBondContact O-CD1 3.39Å
321	R	97.8	Very high	97.4	Very high	7 Å²	7	23.6 Å²	23.6	3%	0.026	13%	0.134	C	C	.	.	H	α-helix	trans	-104.8	-7.4	-178	-52.6	-49.4	-64.4	-168.4	-8.8	114	F296 N317 V319 E323 I324 D325 L326 I329	F296-R321 HydrophobicContact CD1-CG 4.33Å; F296-R321 HydrophobicContact CD2-CG 4.29Å; F296-R321 HydrophobicContact CE1-CG 4.39Å; F296-R321 HydrophobicContact CE2-CG 4.34Å; F296-R321 VanDerWaalsContact CE2-CZ 3.46Å; F296-R321 HydrophobicContact CG-CG 4.29Å; F296-R321 HydrophobicContact CZ-CG 4.39Å; N317-R321 VanDerWaalsContact O-CB 3.28Å; N317-R321 WeakPolarHBondContact O-CB 3.43Å; N317-R321 WeakPolarHBondContact O-CG 3.49Å; N317-R321 PolarHBondContact O-N 2.94Å; V319-R321 VanDerWaalsContact C-N 3.27Å; V319-R321 PolarHBondContact O-N 2.85Å; R321-E323 PolarHBondContact O-N 3.28Å; R321-E323 VanDerWaalsContact O-N 3.14Å; R321-I324 PolarHBondContact O-N 3.24Å; R321-I324 VanDerWaalsContact O-N 3.08Å; R321-D325 IonicContact CZ-OD1 3.78Å; R321-D325 VanDerWaalsContact CZ-OD1 3.3Å; R321-D325 IonicContact CZ-OD2 2.69Å; R321-D325 IonicContact NE-OD1 3.76Å; R321-D325 PolarHBondContact NE-OD1 2.87Å; R321-D325 IonicContact NE-OD2 3.62Å; R321-D325 IonicContact NH2-OD1 3.96Å; R321-D325 PolarHBondContact NH2-OD1 3.36Å; R321-D325 VanDerWaalsContact NH2-OD1 3.11Å; R321-D325 IonicContact NH2-OD2 2.82Å; R321-D325 PolarHBondContact NH2-OD2 2.93Å; R321-D325 PolarHBondContact O-N 3.18Å; R321-L326 WeakPolarHBondContact O-CB 3.18Å; R321-L326 PolarHBondContact O-N 3.01Å; R321-I329 HydrophobicContact CB-CD1 3.68Å; R321-I329 HydrophobicContact CG-CD1 3.79Å
322	S	94.6	Very high	97.4	Very high	13 Å²	13	24.8 Å²	24.8	9%	0.091	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-31.6	-172.2	62.6	0	0	0	0	114.4	I318 V319	I318-S322 WeakPolarHBondContact O-CB 3.37Å; I318-S322 PolarHBondContact O-N 3.34Å; V319-S322 PolarHBondContact O-OG 3.35Å; V319-S322 VanDerWaalsContact O-OG 3.1Å
323	E	94.2	Very high	97.4	Very high	81 Å²	81	24 Å²	24	38%	0.379	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.6	16.7	-177.5	-64.6	175.6	-143.8	0	0	112.3	S90 N91 R94 R321	S90-E323 WeakPolarHBondContact CA-OE1 3.33Å; N91-E323 PolarHBondContact N-OE1 3.49Å; N91-E323 PolarHBondContact N-OE2 2.97Å; R94-E323 IonicContact CZ-OE1 3.2Å; R94-E323 IonicContact NH2-OE1 3.44Å; R94-E323 PolarHBondContact NH2-OE1 3.48Å; R321-E323 PolarHBondContact O-N 3.28Å; R321-E323 VanDerWaalsContact O-N 3.14Å
324	I	93.9	Very high	97.4	Very high	90 Å²	90	27.1 Å²	27.1	46%	0.462	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121	-67.4	-177.6	-54.1	178.7	0	0	0	110.9	S320 R321	S320-I324 WeakPolarHBondContact O-CD1 3.39Å; R321-I324 PolarHBondContact O-N 3.24Å; R321-I324 VanDerWaalsContact O-N 3.08Å
325	D	96.3	Very high	97.4	Very high	6 Å²	6	35.5 Å²	35.5	3%	0.032	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-153	19.6	-166.9	64.6	-17	0	0	0	113.6	H293 R321 N327 L328 I329	H293-D325 IonicContact CE1-OD2 2.74Å; H293-D325 PolarHBondContact CE1-OD2 3.06Å; H293-D325 VanDerWaalsContact CE1-OD2 3.24Å; H293-D325 IonicContact ND1-OD2 2.75Å; H293-D325 PolarHBondContact ND1-OD2 3.47Å; R321-D325 IonicContact CZ-OD1 3.78Å; R321-D325 VanDerWaalsContact CZ-OD1 3.3Å; R321-D325 IonicContact CZ-OD2 2.69Å; R321-D325 IonicContact NE-OD1 3.76Å; R321-D325 PolarHBondContact NE-OD1 2.87Å; R321-D325 IonicContact NE-OD2 3.62Å; R321-D325 IonicContact NH2-OD1 3.96Å; R321-D325 PolarHBondContact NH2-OD1 3.36Å; R321-D325 VanDerWaalsContact NH2-OD1 3.11Å; R321-D325 IonicContact NH2-OD2 2.82Å; R321-D325 PolarHBondContact NH2-OD2 2.93Å; R321-D325 PolarHBondContact O-N 3.18Å; D325-N327 PolarHBondContact O-N 3.24Å; D325-N327 VanDerWaalsContact O-N 3.15Å; D325-L328 HydrophobicContact CB-CB 4.5Å; D325-L328 HydrophobicContact CB-CD1 4.35Å; D325-L328 PolarHBondContact O-N 3.46Å; D325-I329 WeakPolarHBondContact O-CG1 3.49Å; D325-I329 PolarHBondContact O-N 3.25Å; D325-I329 WeakPolarHBondContact OD1-CD1 3.49Å
326	L	97.1	Very high	97.3	Very high	7 Å²	7	38.9 Å²	38.9	4%	0.037	20%	0.195	C	C	.	.	H	α-helix	trans	-56.7	-31.5	179.2	-172.6	60.5	0	0	0	112.6	R321 I329 K330 L341	R321-L326 WeakPolarHBondContact O-CB 3.18Å; R321-L326 PolarHBondContact O-N 3.01Å; L326-I329 PolarHBondContact O-N 3.38Å; L326-K330 HydrophobicContact CG-CD 4.29Å; L326-K330 VanDerWaalsContact O-CD 3.3Å; L326-K330 WeakPolarHBondContact O-CD 3.47Å; L326-K330 WeakPolarHBondContact O-CG 3.35Å; L326-K330 PolarHBondContact O-N 3.14Å; L326-L341 HydrophobicContact CD1-CD2 4.37Å
327	N	95.2	Very high	97.3	Very high	34 Å²	34	41.2 Å²	41.2	18%	0.182	20%	0.204	C	C	.	.	H	α-helix	trans	-61.8	-43.2	172.8	62.7	-27.1	0	0	0	112.8	E11 D325 C331	E11-N327 PolarHBondContact O-ND2 3.03Å; D325-N327 PolarHBondContact O-N 3.24Å; D325-N327 VanDerWaalsContact O-N 3.15Å; N327-C331 PolarHBondContact O-N 3.49Å
328	L	97.8	Very high	97.2	Very high	53 Å²	53	44.7 Å²	44.7	28%	0.277	24%	0.24	S	C	.	.	H	α-helix	trans	-69.6	-39.5	176.2	-62.3	177.1	0	0	0	111.3	H293 D325 K330 C331 H332	H293-L328 HydrophobicContact CB-CB 4.25Å; D325-L328 HydrophobicContact CB-CB 4.5Å; D325-L328 HydrophobicContact CB-CD1 4.35Å; D325-L328 PolarHBondContact O-N 3.46Å; L328-K330 VanDerWaalsContact C-N 3.33Å; L328-K330 PolarHBondContact O-N 3.41Å; L328-C331 WeakPolarHBondContact O-CB 3.47Å; L328-C331 PolarHBondContact O-N 2.87Å; L328-H332 PolarHBondContact O-CD2 3.46Å; L328-H332 PolarHBondContact O-N 3.12Å
329	I	98.6	Very high	97.2	Very high	1 Å²	1	48 Å²	48	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-59.2	-45	175.9	-66.6	167.5	0	0	0	110.6	H293 F296 A297 L300 R321 D325 L326 C331 H332 F333	H293-I329 HydrophobicContact CB-CG1 4.3Å; F296-I329 HydrophobicContact CB-CD1 3.59Å; F296-I329 HydrophobicContact CB-CG1 3.9Å; F296-I329 HydrophobicContact CB-CG2 4.24Å; F296-I329 HydrophobicContact CD2-CD1 4.13Å; F296-I329 HydrophobicContact CG-CD1 4.07Å; A297-I329 HydrophobicContact CB-CG2 4.23Å; L300-I329 HydrophobicContact CD1-CG2 3.64Å; R321-I329 HydrophobicContact CB-CD1 3.68Å; R321-I329 HydrophobicContact CG-CD1 3.79Å; D325-I329 WeakPolarHBondContact O-CG1 3.49Å; D325-I329 PolarHBondContact O-N 3.25Å; D325-I329 WeakPolarHBondContact OD1-CD1 3.49Å; L326-I329 PolarHBondContact O-N 3.38Å; I329-C331 PolarHBondContact O-N 3.34Å; I329-H332 PolarHBondContact O-N 3.46Å; I329-F333 WeakPolarHBondContact O-CB 3.34Å; I329-F333 PolarHBondContact O-N 3.41Å
330	K	98.3	Very high	97.2	Very high	23 Å²	23	48.6 Å²	48.6	10%	0.1	26%	0.258	C	S	.	.	H	α-helix	trans	-59.5	-43.3	176.2	-72	158.3	63	-179.1	0	112.5	L326 L328 F333 K334 L341 V361 S363 D364	L326-K330 HydrophobicContact CG-CD 4.29Å; L326-K330 VanDerWaalsContact O-CD 3.3Å; L326-K330 WeakPolarHBondContact O-CD 3.47Å; L326-K330 WeakPolarHBondContact O-CG 3.35Å; L326-K330 PolarHBondContact O-N 3.14Å; L328-K330 VanDerWaalsContact C-N 3.33Å; L328-K330 PolarHBondContact O-N 3.41Å; K330-F333 PolarHBondContact O-N 3.16Å; K330-K334 PolarHBondContact O-N 3.29Å; K330-L341 HydrophobicContact CG-CB 4.31Å; K330-L341 HydrophobicContact CG-CD2 3.98Å; K330-V361 HydrophobicContact CD-CG1 3.96Å; K330-V361 HydrophobicContact CG-CG1 4.38Å; K330-V361 PolarHBondContact NZ-O 3Å; K330-S363 PolarHBondContact NZ-O 2.74Å; K330-D364 VanDerWaalsContact CE-CG 3.43Å; K330-D364 WeakPolarHBondContact CE-OD1 3.46Å
331	C	97.6	Very high	97.2	Very high	84 Å²	84	47.8 Å²	47.8	57%	0.568	25%	0.253	S	S	*	.	H	α-helix	trans	-60.5	-48.1	176.2	-177.6	0	0	0	0	111.7	N327 L328 I329 K334 K335	N327-C331 PolarHBondContact O-N 3.49Å; L328-C331 WeakPolarHBondContact O-CB 3.47Å; L328-C331 PolarHBondContact O-N 2.87Å; I329-C331 PolarHBondContact O-N 3.34Å; C331-K334 PolarHBondContact O-N 3.07Å; C331-K335 WeakPolarHBondContact O-CB 3.34Å; C331-K335 PolarHBondContact O-N 3.19Å
332	H	98.3	Very high	97.2	Very high	45 Å²	45	48.1 Å²	48.1	21%	0.208	26%	0.256	C	S	.	.	H	α-helix	trans	-62	-43.6	176	-87.4	-84	0	0	0	112.2	N291 A297 L328 I329 K334 K335 M336	N291-H332 PolarHBondContact ND2-CE1 3.13Å; A297-H332 HydrophobicContact CB-CB 4.01Å; L328-H332 PolarHBondContact O-CD2 3.46Å; L328-H332 PolarHBondContact O-N 3.12Å; I329-H332 PolarHBondContact O-N 3.46Å; H332-K334 PolarHBondContact O-N 2.76Å; H332-K335 PolarHBondContact O-N 2.81Å; H332-M336 WeakPolarHBondContact O-CB 3.12Å; H332-M336 WeakPolarHBondContact O-CG 3.44Å; H332-M336 PolarHBondContact O-N 3.18Å
333	F	98.6	Very high	97.4	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-56.9	-49.1	177.5	-166.4	-80.2	0	0	0	111.6	A297 L300 Y301 M304 I329 K330 K335 M336 Y337 K339 L341 M344	A297-F333 HydrophobicContact CB-CB 3.98Å; A297-F333 HydrophobicContact CB-CD2 4.23Å; A297-F333 WeakPolarHBondContact O-CD2 3.33Å; L300-F333 HydrophobicContact CB-CD2 4.34Å; L300-F333 HydrophobicContact CB-CE2 4.07Å; Y301-F333 HydrophobicContact CD2-CZ 4.21Å; M304-F333 HydrophobicContact CE-CE2 4.38Å; M304-F333 HydrophobicContact CE-CZ 4.2Å; I329-F333 WeakPolarHBondContact O-CB 3.34Å; I329-F333 PolarHBondContact O-N 3.41Å; K330-F333 PolarHBondContact O-N 3.16Å; F333-K335 PolarHBondContact O-N 2.73Å; F333-M336 PolarHBondContact O-N 2.96Å; F333-Y337 HydrophobicContact CD1-CD2 4.08Å; F333-Y337 AromaticContact CD2-CD2 3.96Å; F333-Y337 HydrophobicContact CD2-CD2 3.96Å; F333-Y337 HydrophobicContact CD2-CE2 4.14Å; F333-Y337 HydrophobicContact CE1-CD2 4.17Å; F333-Y337 HydrophobicContact CE2-CD2 4.07Å; F333-Y337 HydrophobicContact CE2-CE2 4.29Å; F333-Y337 AromaticContact CG-CD2 3.98Å; F333-Y337 HydrophobicContact CG-CD2 3.98Å; F333-Y337 HydrophobicContact CZ-CD2 4.17Å; F333-Y337 WeakPolarHBondContact O-CD2 3.35Å; F333-Y337 PolarHBondContact O-N 3.19Å; F333-K339 WeakPolarHBondContact CD1-O 3.31Å; F333-K339 HydrophobicContact CE1-CG 4.42Å; F333-L341 HydrophobicContact CD1-CB 4.13Å; F333-L341 HydrophobicContact CD2-CD1 4.02Å; F333-L341 HydrophobicContact CE1-CB 4.43Å; F333-L341 HydrophobicContact CE1-CD1 4.48Å; F333-L341 HydrophobicContact CE2-CD1 3.79Å; F333-L341 HydrophobicContact CG-CB 4.22Å; F333-L341 HydrophobicContact CG-CD1 4.44Å; F333-L341 HydrophobicContact CZ-CD1 4.04Å; F333-M344 HydrophobicContact CE1-CB 4.4Å; F333-M344 HydrophobicContact CE1-SD 4.33Å; F333-M344 HydrophobicContact CZ-CB 4.23Å; F333-M344 HydrophobicContact CZ-SD 3.65Å
334	K	98.2	Very high	97.6	Very high	86 Å²	86	45.5 Å²	45.5	37%	0.374	25%	0.246	S	C	.	.	H	α-helix	trans	-61.2	-43.5	177.8	-168.1	179.3	-172.9	175.4	0	111.9	K330 C331 H332 G338 K339 T340 P365	K330-K334 PolarHBondContact O-N 3.29Å; C331-K334 PolarHBondContact O-N 3.07Å; H332-K334 PolarHBondContact O-N 2.76Å; K334-G338 WeakPolarHBondContact O-CA 3.26Å; K334-G338 PolarHBondContact O-N 2.83Å; K334-K339 WeakPolarHBondContact CA-O 3.39Å; K334-T340 HydrophobicContact CD-CG2 4.16Å; K334-T340 HydrophobicContact CG-CG2 4.45Å; K334-P365 PolarHBondContact NZ-O 3.49Å; K334-P365 PolarHBondContact NZ-OXT 2.79Å
335	K	98.2	Very high	97.8	Very high	176 Å²	176	41.2 Å²	41.2	77%	0.765	22%	0.224	S	C	*	.	H	α-helix	trans	-64.2	-40.7	178.3	-175.3	179	177.9	-177.4	0	112.5	C331 H332 F333	C331-K335 WeakPolarHBondContact O-CB 3.34Å; C331-K335 PolarHBondContact O-N 3.19Å; H332-K335 PolarHBondContact O-N 2.81Å; F333-K335 PolarHBondContact O-N 2.73Å
336	M	98.1	Very high	97.8	Very high	74 Å²	74	45.8 Å²	45.8	37%	0.365	25%	0.247	S	C	.	.	H	α-helix	trans	-78.2	-35.6	-175.7	-69.2	169.9	73.1	0	0	113.1	S294 A297 E298 H332 F333	S294-M336 PolarHBondContact OG-SD 2.97Å; A297-M336 HydrophobicContact CB-SD 4.15Å; E298-M336 HydrophobicContact CB-CE 4.29Å; H332-M336 WeakPolarHBondContact O-CB 3.12Å; H332-M336 WeakPolarHBondContact O-CG 3.44Å; H332-M336 PolarHBondContact O-N 3.18Å; F333-M336 PolarHBondContact O-N 2.96Å
337	Y	98	Very high	97.8	Very high	53 Å²	53	50.9 Å²	50.9	21%	0.208	27%	0.27	C	S	.	.	H	α-helix	trans	-117.9	-3.5	-168.4	-56.1	-59.9	0	0	0	114.6	E298 Y301 F333 K339	E298-Y337 VanDerWaalsContact CA-OH 3.29Å; E298-Y337 WeakPolarHBondContact CA-OH 3.3Å; Y301-Y337 VanDerWaalsContact CB-CZ 3.49Å; Y301-Y337 HydrophobicContact CD1-CD1 4.06Å; Y301-Y337 AromaticContact CD1-CE1 3.44Å; Y301-Y337 HydrophobicContact CD1-CE1 3.44Å; Y301-Y337 VanDerWaalsContact CD1-CE1 3.44Å; Y301-Y337 HydrophobicContact CD1-CE2 4.25Å; Y301-Y337 AromaticContact CD1-CZ 3.55Å; Y301-Y337 AromaticContact CD2-CD1 3.67Å; Y301-Y337 HydrophobicContact CD2-CD1 3.67Å; Y301-Y337 AromaticContact CD2-CD2 3.81Å; Y301-Y337 HydrophobicContact CD2-CD2 3.81Å; Y301-Y337 AromaticContact CD2-CE1 3.88Å; Y301-Y337 HydrophobicContact CD2-CE1 3.88Å; Y301-Y337 HydrophobicContact CD2-CE2 4.02Å; Y301-Y337 AromaticContact CD2-CG 3.64Å; Y301-Y337 HydrophobicContact CD2-CG 3.64Å; Y301-Y337 HydrophobicContact CE1-CD1 4.02Å; Y301-Y337 AromaticContact CE1-CE1 3.64Å; Y301-Y337 HydrophobicContact CE1-CE1 3.64Å; Y301-Y337 AromaticContact CE2-CD1 3.69Å; Y301-Y337 HydrophobicContact CE2-CD1 3.69Å; Y301-Y337 HydrophobicContact CE2-CE1 4.11Å; Y301-Y337 AromaticContact CE2-CG 3.96Å; Y301-Y337 HydrophobicContact CE2-CG 3.96Å; Y301-Y337 AromaticContact CG-CD1 3.87Å; Y301-Y337 HydrophobicContact CG-CD1 3.87Å; Y301-Y337 AromaticContact CG-CD2 3.94Å; Y301-Y337 HydrophobicContact CG-CD2 3.94Å; Y301-Y337 AromaticContact CG-CE1 3.56Å; Y301-Y337 HydrophobicContact CG-CE1 3.56Å; Y301-Y337 AromaticContact CG-CE2 3.64Å; Y301-Y337 HydrophobicContact CG-CE2 3.64Å; Y301-Y337 HydrophobicContact CG-CG 4.06Å; Y301-Y337 AromaticContact CG-CZ 3.43Å; Y301-Y337 VanDerWaalsContact CG-CZ 3.43Å; Y301-Y337 AromaticContact CZ-CD1 3.88Å; F333-Y337 HydrophobicContact CD1-CD2 4.08Å; F333-Y337 AromaticContact CD2-CD2 3.96Å; F333-Y337 HydrophobicContact CD2-CD2 3.96Å; F333-Y337 HydrophobicContact CD2-CE2 4.14Å; F333-Y337 HydrophobicContact CE1-CD2 4.17Å; F333-Y337 HydrophobicContact CE2-CD2 4.07Å; F333-Y337 HydrophobicContact CE2-CE2 4.29Å; F333-Y337 AromaticContact CG-CD2 3.98Å; F333-Y337 HydrophobicContact CG-CD2 3.98Å; F333-Y337 HydrophobicContact CZ-CD2 4.17Å; F333-Y337 WeakPolarHBondContact O-CD2 3.35Å; F333-Y337 PolarHBondContact O-N 3.19Å; Y337-K339 PolarHBondContact O-N 3.09Å; Y337-K339 VanDerWaalsContact O-N 3.09Å
338	G	97.3	Very high	97.8	Very high	74 Å²	74	51.6 Å²	51.6	76%	0.763	27%	0.274	S	S	*	.	S	Bend	trans	68.2	6	176.6	0	0	0	0	0	115	K334	K334-G338 WeakPolarHBondContact O-CA 3.26Å; K334-G338 PolarHBondContact O-N 2.83Å
339	K	96.6	Very high	97.8	Very high	70 Å²	70	49.5 Å²	49.5	30%	0.304	26%	0.264	S	S	.	.	S	Bend	trans	-134.1	154.9	175.4	62.5	167	77.8	-173	0	109.7	F333 K334 Y337 M344 E347	F333-K339 WeakPolarHBondContact CD1-O 3.31Å; F333-K339 HydrophobicContact CE1-CG 4.42Å; K334-K339 WeakPolarHBondContact CA-O 3.39Å; Y337-K339 PolarHBondContact O-N 3.09Å; Y337-K339 VanDerWaalsContact O-N 3.09Å; K339-M344 HydrophobicContact CD-CB 4.16Å; K339-M344 HydrophobicContact CD-CG 4.47Å; K339-M344 HydrophobicContact CD-SD 4.27Å; K339-E347 IonicContact NZ-OE1 2.97Å; K339-E347 IonicContact NZ-OE2 3.24Å; K339-E347 PolarHBondContact NZ-OE2 2.84Å
340	T	98.3	Very high	97.8	Very high	26 Å²	26	53.8 Å²	53.8	16%	0.16	29%	0.294	C	S	.	.			trans	-76.3	157.3	179.8	65.2	0	0	0	0	111.2	K334 S342 S343 M344 D364	K334-T340 HydrophobicContact CD-CG2 4.16Å; K334-T340 HydrophobicContact CG-CG2 4.45Å; T340-S342 VanDerWaalsContact C-N 3.29Å; T340-S342 PolarHBondContact O-N 2.98Å; T340-S343 PolarHBondContact O-N 3.36Å; T340-S343 WeakPolarHBondContact OG1-CB 3.45Å; T340-S343 PolarHBondContact OG1-N 3.47Å; T340-S343 VanDerWaalsContact OG1-N 3.13Å; T340-M344 PolarHBondContact O-N 3.46Å; T340-D364 WeakPolarHBondContact CB-OD2 3.4Å
341	L	98.4	Very high	97.8	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-62.9	-42.1	176.4	176	62.4	0	0	0	109.8	L300 M304 L326 K330 F333 S343 M344 I345 V361 D364	L300-L341 HydrophobicContact CB-CD1 4.13Å; L300-L341 HydrophobicContact CD1-CD1 4.04Å; L300-L341 HydrophobicContact CD1-CD2 3.91Å; M304-L341 HydrophobicContact CE-CD1 3.76Å; L326-L341 HydrophobicContact CD1-CD2 4.37Å; K330-L341 HydrophobicContact CG-CB 4.31Å; K330-L341 HydrophobicContact CG-CD2 3.98Å; F333-L341 HydrophobicContact CD1-CB 4.13Å; F333-L341 HydrophobicContact CD2-CD1 4.02Å; F333-L341 HydrophobicContact CE1-CB 4.43Å; F333-L341 HydrophobicContact CE1-CD1 4.48Å; F333-L341 HydrophobicContact CE2-CD1 3.79Å; F333-L341 HydrophobicContact CG-CB 4.22Å; F333-L341 HydrophobicContact CG-CD1 4.44Å; F333-L341 HydrophobicContact CZ-CD1 4.04Å; L341-S343 VanDerWaalsContact C-N 3.33Å; L341-S343 PolarHBondContact O-N 3.02Å; L341-M344 PolarHBondContact O-N 2.83Å; L341-I345 HydrophobicContact CD1-CD1 4.21Å; L341-I345 HydrophobicContact CD1-CG1 4.48Å; L341-I345 HydrophobicContact CG-CD1 3.93Å; L341-I345 WeakPolarHBondContact O-CG1 3.48Å; L341-I345 PolarHBondContact O-N 3.14Å; L341-V361 HydrophobicContact CD2-CG1 4.25Å; L341-V361 HydrophobicContact CD2-CG2 4.13Å; L341-D364 PolarHBondContact N-OD2 3.39Å
342	S	98.2	Very high	97.8	Very high	15 Å²	15	53.5 Å²	53.5	11%	0.105	30%	0.298	C	S	.	.	H	α-helix	trans	-59.2	-39.7	175.1	-69.6	0	0	0	0	112.9	T340 M344 I345 M346 V361 D364	T340-S342 VanDerWaalsContact C-N 3.29Å; T340-S342 PolarHBondContact O-N 2.98Å; S342-M344 PolarHBondContact O-N 3.2Å; S342-I345 PolarHBondContact O-N 3.03Å; S342-M346 WeakPolarHBondContact O-CG 3.43Å; S342-M346 PolarHBondContact O-N 3.36Å; S342-V361 WeakPolarHBondContact OG-CG1 3.44Å; S342-D364 PolarHBondContact N-OD2 2.75Å; S342-D364 VanDerWaalsContact OG-CB 3.29Å; S342-D364 WeakPolarHBondContact OG-CB 3.46Å; S342-D364 PolarHBondContact OG-OD2 2.95Å
343	S	98.1	Very high	97.8	Very high	31 Å²	31	51.8 Å²	51.8	22%	0.217	29%	0.289	C	S	.	.	H	α-helix	trans	-60.2	-46.3	176.3	-169.1	0	0	0	0	111.6	T340 L341 M346 E347	T340-S343 PolarHBondContact O-N 3.36Å; T340-S343 WeakPolarHBondContact OG1-CB 3.45Å; T340-S343 PolarHBondContact OG1-N 3.47Å; T340-S343 VanDerWaalsContact OG1-N 3.13Å; L341-S343 VanDerWaalsContact C-N 3.33Å; L341-S343 PolarHBondContact O-N 3.02Å; S343-M346 WeakPolarHBondContact O-CB 3.31Å; S343-M346 PolarHBondContact O-N 3.48Å; S343-E347 WeakPolarHBondContact O-CG 3.26Å; S343-E347 PolarHBondContact O-N 3.12Å; S343-E347 VanDerWaalsContact O-N 3.1Å; S343-E347 PolarHBondContact OG-OE1 3.31Å
344	M	98.1	Very high	97.8	Very high	8 Å²	8	54.6 Å²	54.6	4%	0.039	30%	0.302	C	S	.	.	H	α-helix	trans	-68.4	-37.7	-179.3	-163.6	160.6	179.5	0	0	111.8	Y301 M304 K305 F333 K339 T340 L341 S342 M346 E347 D348	Y301-M344 HydrophobicContact CD2-CE 3.79Å; Y301-M344 HydrophobicContact CD2-SD 3.64Å; Y301-M344 HydrophobicContact CE2-CE 3.93Å; Y301-M344 HydrophobicContact CE2-SD 4.06Å; M304-M344 HydrophobicContact CB-CE 3.43Å; M304-M344 VanDerWaalsContact CB-CE 3.43Å; M304-M344 HydrophobicContact CB-CG 3.95Å; M304-M344 HydrophobicContact CB-SD 4.15Å; M304-M344 HydrophobicContact CE-CB 3.95Å; M304-M344 HydrophobicContact CE-CG 3.79Å; M304-M344 HydrophobicContact CE-SD 4.08Å; M304-M344 HydrophobicContact SD-CB 4.23Å; M304-M344 HydrophobicContact SD-CG 3.92Å; K305-M344 HydrophobicContact CB-CE 4.28Å; F333-M344 HydrophobicContact CE1-CB 4.4Å; F333-M344 HydrophobicContact CE1-SD 4.33Å; F333-M344 HydrophobicContact CZ-CB 4.23Å; F333-M344 HydrophobicContact CZ-SD 3.65Å; K339-M344 HydrophobicContact CD-CB 4.16Å; K339-M344 HydrophobicContact CD-CG 4.47Å; K339-M344 HydrophobicContact CD-SD 4.27Å; T340-M344 PolarHBondContact O-N 3.46Å; L341-M344 PolarHBondContact O-N 2.83Å; S342-M344 PolarHBondContact O-N 3.2Å; M344-M346 VanDerWaalsContact C-N 3.3Å; M344-M346 PolarHBondContact O-N 2.93Å; M344-E347 PolarHBondContact O-N 2.81Å; M344-D348 WeakPolarHBondContact O-CB 3.41Å; M344-D348 PolarHBondContact O-N 3.01Å
345	I	98.3	Very high	97.8	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-61.4	-39.8	172.9	-68.9	167.7	0	0	0	111.2	M304 I318 L341 S342 E347 D348 T349 K354 L357 L358 V361	M304-I345 HydrophobicContact CE-CG1 4.32Å; M304-I345 HydrophobicContact SD-CG1 3.78Å; I318-I345 HydrophobicContact CD1-CD1 3.84Å; L341-I345 HydrophobicContact CD1-CD1 4.21Å; L341-I345 HydrophobicContact CD1-CG1 4.48Å; L341-I345 HydrophobicContact CG-CD1 3.93Å; L341-I345 WeakPolarHBondContact O-CG1 3.48Å; L341-I345 PolarHBondContact O-N 3.14Å; S342-I345 PolarHBondContact O-N 3.03Å; I345-E347 VanDerWaalsContact C-N 3.32Å; I345-E347 PolarHBondContact O-N 3.41Å; I345-D348 PolarHBondContact O-N 3.45Å; I345-T349 WeakPolarHBondContact CG2-OG1 3.49Å; I345-T349 WeakPolarHBondContact O-CB 3.41Å; I345-T349 PolarHBondContact O-N 3.37Å; I345-T349 PolarHBondContact O-OG1 3.32Å; I345-K354 HydrophobicContact CG2-CG 4.46Å; I345-L357 HydrophobicContact CG2-CB 3.87Å; I345-L357 HydrophobicContact CG2-CD1 3.94Å; I345-L358 HydrophobicContact CB-CD2 4.1Å; I345-L358 HydrophobicContact CG2-CD2 3.83Å; I345-L358 HydrophobicContact CG2-CG 4.08Å; I345-V361 HydrophobicContact CD1-CG2 3.75Å
346	M	97.5	Very high	97.8	Very high	102 Å²	102	45 Å²	45	50%	0.502	26%	0.263	S	S	.	.	H	α-helix	trans	-65.3	-33.9	176.9	-75.2	-172.9	-63.1	0	0	113.2	S342 S343 M344 K354 L358	S342-M346 WeakPolarHBondContact O-CG 3.43Å; S342-M346 PolarHBondContact O-N 3.36Å; S343-M346 WeakPolarHBondContact O-CB 3.31Å; S343-M346 PolarHBondContact O-N 3.48Å; M344-M346 VanDerWaalsContact C-N 3.3Å; M344-M346 PolarHBondContact O-N 2.93Å; M346-K354 HydrophobicContact CG-CD 4.49Å; M346-L358 HydrophobicContact CG-CD1 3.71Å; M346-L358 HydrophobicContact CG-CD2 4.04Å; M346-L358 HydrophobicContact CG-CG 4.49Å; M346-L358 HydrophobicContact SD-CD1 4.44Å
347	E	96.4	Very high	97.8	Very high	113 Å²	113	41.5 Å²	41.5	53%	0.528	25%	0.246	S	C	.	.	H	α-helix	trans	-72.1	-41.1	177.6	-72.6	162.9	-150	0	0	111.6	K339 S343 M344 I345	K339-E347 IonicContact NZ-OE1 2.97Å; K339-E347 IonicContact NZ-OE2 3.24Å; K339-E347 PolarHBondContact NZ-OE2 2.84Å; S343-E347 WeakPolarHBondContact O-CG 3.26Å; S343-E347 PolarHBondContact O-N 3.12Å; S343-E347 VanDerWaalsContact O-N 3.1Å; S343-E347 PolarHBondContact OG-OE1 3.31Å; M344-E347 PolarHBondContact O-N 2.81Å; I345-E347 VanDerWaalsContact C-N 3.32Å; I345-E347 PolarHBondContact O-N 3.41Å
348	D	95.7	Very high	97.8	Very high	49 Å²	49	40.9 Å²	40.9	26%	0.262	25%	0.246	S	C	.	.	H	α-helix	trans	-96.5	-21.1	-167.5	-92.1	51.3	0	0	0	115.4	M304 T309 M344 I345	M304-D348 VanDerWaalsContact C-OD2 3.31Å; M304-D348 WeakPolarHBondContact CA-OD2 3.5Å; M304-D348 HydrophobicContact CB-CB 4.32Å; M304-D348 VanDerWaalsContact CB-OD2 3.23Å; M304-D348 WeakPolarHBondContact CB-OD2 3.48Å; M304-D348 HydrophobicContact CG-CB 4.2Å; M304-D348 HydrophobicContact SD-CB 4.43Å; T309-D348 PolarHBondContact OG1-OD2 2.88Å; M344-D348 WeakPolarHBondContact O-CB 3.41Å; M344-D348 PolarHBondContact O-N 3.01Å; I345-D348 PolarHBondContact O-N 3.45Å
349	T	97.8	Very high	97.8	Very high	10 Å²	10	38.7 Å²	38.7	6%	0.061	22%	0.219	C	C	.	.			trans	-122.3	160.3	-173.4	71.9	0	0	0	0	111.7	L314 I345 Y353 K354 L357	L314-T349 HydrophobicContact CD2-CG2 4.1Å; I345-T349 WeakPolarHBondContact CG2-OG1 3.49Å; I345-T349 WeakPolarHBondContact O-CB 3.41Å; I345-T349 PolarHBondContact O-N 3.37Å; I345-T349 PolarHBondContact O-OG1 3.32Å; T349-Y353 HydrophobicContact CG2-CD1 4.13Å; T349-Y353 HydrophobicContact CG2-CE1 3.66Å; T349-K354 WeakPolarHBondContact O-CD 3.27Å; T349-K354 WeakPolarHBondContact OG1-CA 3.49Å; T349-K354 VanDerWaalsContact OG1-CB 3.24Å; T349-K354 WeakPolarHBondContact OG1-CB 3.49Å; T349-K354 WeakPolarHBondContact OG1-CG 3.4Å; T349-L357 HydrophobicContact CG2-CD1 4.09Å
350	S	97.7	Very high	97.7	Very high	91 Å²	91	35.6 Å²	35.6	64%	0.636	21%	0.205	S	C	*	.			trans	-143.2	170.8	-177.8	64	0	0	0	0	112.3	K354	S350-K354 PolarHBondContact O-N 3.16Å
351	G	97.8	Very high	97.6	Very high	44 Å²	44	34.4 Å²	34.4	45%	0.454	20%	0.198	S	C	.	.	H	α-helix	trans	60.8	-154.9	177.9	0	0	0	0	0	114.5	Y353 K354 N355	G351-Y353 PolarHBondContact O-N 2.84Å; G351-K354 WeakPolarHBondContact O-CB 3.31Å; G351-K354 PolarHBondContact O-N 2.93Å; G351-K354 VanDerWaalsContact O-N 3.16Å; G351-N355 PolarHBondContact O-N 3.3Å
352	D	97.9	Very high	97.4	Very high	56 Å²	56	35.5 Å²	35.5	30%	0.299	21%	0.209	S	C	.	.	H	α-helix	trans	-65	-27.9	-178.3	-58.7	-56	0	0	0	112.9	E79 I83 F121 N355 A356	E79-D352 HydrophobicContact CB-CB 4.15Å; I83-D352 HydrophobicContact CD1-CB 4.16Å; F121-D352 HydrophobicContact CD1-CB 4.22Å; F121-D352 HydrophobicContact CD2-CB 3.84Å; F121-D352 HydrophobicContact CE1-CB 4.36Å; F121-D352 HydrophobicContact CE2-CB 4Å; F121-D352 HydrophobicContact CG-CB 3.96Å; F121-D352 HydrophobicContact CZ-CB 4.26Å; D352-N355 PolarHBondContact O-N 3.11Å; D352-A356 VanDerWaalsContact O-CB 3.27Å; D352-A356 WeakPolarHBondContact O-CB 3.46Å; D352-A356 PolarHBondContact O-N 3.31Å
353	Y	98.6	Very high	97.1	Very high	9 Å²	9	39.6 Å²	39.6	4%	0.035	24%	0.238	C	C	.	.	H	α-helix	trans	-58.6	-48.8	171.7	175.2	-124.3	0	0	0	111.9	K120 L124 D311 I315 T349 G351 A356 L357	K120-Y353 HydrophobicContact CB-CD1 3.81Å; K120-Y353 HydrophobicContact CB-CD2 3.86Å; K120-Y353 HydrophobicContact CB-CE1 4.13Å; K120-Y353 HydrophobicContact CB-CE2 4.2Å; K120-Y353 HydrophobicContact CB-CG 3.65Å; K120-Y353 HydrophobicContact CD-CD1 3.84Å; K120-Y353 HydrophobicContact CD-CE1 3.88Å; K120-Y353 HydrophobicContact CG-CD1 4.5Å; K120-Y353 WeakPolarHBondContact O-CD2 3.39Å; L124-Y353 HydrophobicContact CB-CD2 4.14Å; L124-Y353 HydrophobicContact CB-CE2 4.12Å; L124-Y353 HydrophobicContact CD2-CD2 3.89Å; L124-Y353 HydrophobicContact CD2-CE2 4.01Å; D311-Y353 WeakPolarHBondContact OD1-CE1 3.45Å; I315-Y353 HydrophobicContact CD1-CE2 3.8Å; I315-Y353 HydrophobicContact CG1-CE2 3.74Å; I315-Y353 WeakPolarHBondContact CG1-OH 3.23Å; T349-Y353 HydrophobicContact CG2-CD1 4.13Å; T349-Y353 HydrophobicContact CG2-CE1 3.66Å; G351-Y353 PolarHBondContact O-N 2.84Å; Y353-A356 PolarHBondContact O-N 3.5Å; Y353-L357 HydrophobicContact CD1-CD1 4.43Å; Y353-L357 HydrophobicContact CD2-CD1 4.37Å; Y353-L357 HydrophobicContact CD2-CG 4.29Å; Y353-L357 HydrophobicContact CE1-CD1 3.87Å; Y353-L357 HydrophobicContact CE2-CD1 3.78Å; Y353-L357 HydrophobicContact CE2-CD2 4.19Å; Y353-L357 HydrophobicContact CE2-CG 3.88Å; Y353-L357 WeakPolarHBondContact O-CG 3.26Å; Y353-L357 PolarHBondContact O-N 3.27Å
354	K	98.6	Very high	96.7	Very high	60 Å²	60	39.3 Å²	39.3	26%	0.261	23%	0.234	S	C	.	.	H	α-helix	trans	-59	-49.4	174.1	178.2	-173.3	61.6	177.9	0	111.1	I345 M346 T349 S350 G351 A356 L357 L358	I345-K354 HydrophobicContact CG2-CG 4.46Å; M346-K354 HydrophobicContact CG-CD 4.49Å; T349-K354 WeakPolarHBondContact O-CD 3.27Å; T349-K354 WeakPolarHBondContact OG1-CA 3.49Å; T349-K354 VanDerWaalsContact OG1-CB 3.24Å; T349-K354 WeakPolarHBondContact OG1-CB 3.49Å; T349-K354 WeakPolarHBondContact OG1-CG 3.4Å; S350-K354 PolarHBondContact O-N 3.16Å; G351-K354 WeakPolarHBondContact O-CB 3.31Å; G351-K354 PolarHBondContact O-N 2.93Å; G351-K354 VanDerWaalsContact O-N 3.16Å; K354-A356 VanDerWaalsContact C-N 3.29Å; K354-A356 PolarHBondContact O-N 3.06Å; K354-L357 PolarHBondContact O-N 3.46Å; K354-L358 HydrophobicContact CD-CD1 4.19Å; K354-L358 HydrophobicContact CG-CD1 3.74Å; K354-L358 HydrophobicContact CG-CG 4.21Å; K354-L358 WeakPolarHBondContact O-CG 3.48Å; K354-L358 PolarHBondContact O-N 2.99Å
355	N	98.3	Very high	95.6	Very high	61 Å²	61	45.3 Å²	45.3	33%	0.326	27%	0.273	S	S	.	.	H	α-helix	trans	-61.3	-40.6	-175.4	-63.9	-18	0	0	0	111.3	I83 G351 D352 S359	I83-N355 HydrophobicContact CD1-CB 4.01Å; G351-N355 PolarHBondContact O-N 3.3Å; D352-N355 PolarHBondContact O-N 3.11Å; N355-S359 WeakPolarHBondContact O-CB 3.44Å; N355-S359 PolarHBondContact O-N 3.43Å
356	A	98.1	Very high	95.5	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-64.7	-45.9	175	0	0	0	0	0	112.6	I83 T87 F121 L124 D352 Y353 K354 S359 L360	I83-A356 HydrophobicContact CD1-CB 4.18Å; I83-A356 HydrophobicContact CG1-CB 3.99Å; T87-A356 HydrophobicContact CG2-CB 4.26Å; F121-A356 HydrophobicContact CD2-CB 4.24Å; F121-A356 HydrophobicContact CE2-CB 3.99Å; L124-A356 HydrophobicContact CD2-CB 3.5Å; D352-A356 VanDerWaalsContact O-CB 3.27Å; D352-A356 WeakPolarHBondContact O-CB 3.46Å; D352-A356 PolarHBondContact O-N 3.31Å; Y353-A356 PolarHBondContact O-N 3.5Å; K354-A356 VanDerWaalsContact C-N 3.29Å; K354-A356 PolarHBondContact O-N 3.06Å; A356-S359 PolarHBondContact O-N 3.48Å; A356-L360 PolarHBondContact O-N 3.42Å
357	L	98.4	Very high	95.4	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-59.5	-48.3	175.9	-75.1	-179.4	0	0	0	111.8	L124 L314 I318 I345 T349 Y353 K354 S359 L360 V361	L124-L357 HydrophobicContact CD1-CD2 4Å; L124-L357 HydrophobicContact CD2-CD2 3.7Å; L124-L357 HydrophobicContact CD2-CG 3.85Å; L314-L357 HydrophobicContact CD2-CD1 3.83Å; L314-L357 HydrophobicContact CG-CD1 4.29Å; I318-L357 HydrophobicContact CD1-CD2 3.78Å; I318-L357 HydrophobicContact CG2-CD2 4.38Å; I345-L357 HydrophobicContact CG2-CB 3.87Å; I345-L357 HydrophobicContact CG2-CD1 3.94Å; T349-L357 HydrophobicContact CG2-CD1 4.09Å; Y353-L357 HydrophobicContact CD1-CD1 4.43Å; Y353-L357 HydrophobicContact CD2-CD1 4.37Å; Y353-L357 HydrophobicContact CD2-CG 4.29Å; Y353-L357 HydrophobicContact CE1-CD1 3.87Å; Y353-L357 HydrophobicContact CE2-CD1 3.78Å; Y353-L357 HydrophobicContact CE2-CD2 4.19Å; Y353-L357 HydrophobicContact CE2-CG 3.88Å; Y353-L357 WeakPolarHBondContact O-CG 3.26Å; Y353-L357 PolarHBondContact O-N 3.27Å; K354-L357 PolarHBondContact O-N 3.46Å; L357-S359 VanDerWaalsContact C-N 3.29Å; L357-S359 PolarHBondContact O-N 3.04Å; L357-L360 PolarHBondContact O-N 2.87Å; L357-L360 VanDerWaalsContact O-N 3.16Å; L357-V361 WeakPolarHBondContact O-CG2 3.41Å; L357-V361 PolarHBondContact O-N 3.3Å
358	L	98.3	Very high	95.3	Very high	39 Å²	39	40.9 Å²	40.9	20%	0.204	26%	0.262	C	S	.	.	H	α-helix	trans	-62.8	-38.3	178.5	-67.1	174.8	0	0	0	111.5	I345 M346 K354 L360 V361 G362	I345-L358 HydrophobicContact CB-CD2 4.1Å; I345-L358 HydrophobicContact CG2-CD2 3.83Å; I345-L358 HydrophobicContact CG2-CG 4.08Å; M346-L358 HydrophobicContact CG-CD1 3.71Å; M346-L358 HydrophobicContact CG-CD2 4.04Å; M346-L358 HydrophobicContact CG-CG 4.49Å; M346-L358 HydrophobicContact SD-CD1 4.44Å; K354-L358 HydrophobicContact CD-CD1 4.19Å; K354-L358 HydrophobicContact CG-CD1 3.74Å; K354-L358 HydrophobicContact CG-CG 4.21Å; K354-L358 WeakPolarHBondContact O-CG 3.48Å; K354-L358 PolarHBondContact O-N 2.99Å; L358-L360 VanDerWaalsContact C-N 3.32Å; L358-L360 PolarHBondContact O-N 3Å; L358-V361 PolarHBondContact O-N 2.65Å; L358-G362 PolarHBondContact O-N 2.83Å
359	S	97.3	Very high	95.3	Very high	29 Å²	29	40.4 Å²	40.4	20%	0.203	26%	0.262	C	S	.	.	H	α-helix	trans	-65.1	-34.5	175.7	-170.7	0	0	0	0	112.8	T87 N355 A356 L357	T87-S359 WeakPolarHBondContact OG1-CB 3.33Å; T87-S359 PolarHBondContact OG1-OG 3.05Å; N355-S359 WeakPolarHBondContact O-CB 3.44Å; N355-S359 PolarHBondContact O-N 3.43Å; A356-S359 PolarHBondContact O-N 3.48Å; L357-S359 VanDerWaalsContact C-N 3.29Å; L357-S359 PolarHBondContact O-N 3.04Å
360	L	94.4	Very high	95.1	Very high	4 Å²	4	42.3 Å²	42.3	2%	0.021	27%	0.274	C	S	.	.	H	α-helix	trans	-72	-45.1	174.8	-75.4	169.2	0	0	0	112.2	T14 T87 L124 L128 I318 A356 L357 L358 G362	T14-L360 PolarHBondContact OG1-O 2.88Å; T87-L360 HydrophobicContact CG2-CD2 4.2Å; T87-L360 HydrophobicContact CG2-CG 3.93Å; L124-L360 HydrophobicContact CD1-CD1 3.84Å; L124-L360 HydrophobicContact CD2-CD1 4.49Å; L124-L360 HydrophobicContact CG-CD1 4.46Å; L128-L360 HydrophobicContact CD1-CD1 4.13Å; L128-L360 HydrophobicContact CD1-CD2 4.19Å; L128-L360 HydrophobicContact CD2-CD1 3.91Å; L128-L360 HydrophobicContact CD2-CD2 3.75Å; L128-L360 HydrophobicContact CD2-CG 4.48Å; L128-L360 HydrophobicContact CG-CD1 4.4Å; I318-L360 HydrophobicContact CG2-CB 4.16Å; I318-L360 HydrophobicContact CG2-CD1 4.2Å; A356-L360 PolarHBondContact O-N 3.42Å; L357-L360 PolarHBondContact O-N 2.87Å; L357-L360 VanDerWaalsContact O-N 3.16Å; L358-L360 VanDerWaalsContact C-N 3.32Å; L358-L360 PolarHBondContact O-N 3Å; L360-G362 PolarHBondContact O-N 3.16Å
361	V	96.6	Very high	95	Very high	2 Å²	2	39.1 Å²	39.1	1%	0.012	25%	0.25	C	S	.	.	H	α-helix	trans	-63.1	-32.9	178.6	172.2	0	0	0	0	111.2	I318 K330 L341 S342 I345 L357 L358 D364	I318-V361 HydrophobicContact CD1-CG2 4.18Å; I318-V361 HydrophobicContact CG2-CG2 4.46Å; K330-V361 HydrophobicContact CD-CG1 3.96Å; K330-V361 HydrophobicContact CG-CG1 4.38Å; K330-V361 PolarHBondContact NZ-O 3Å; L341-V361 HydrophobicContact CD2-CG1 4.25Å; L341-V361 HydrophobicContact CD2-CG2 4.13Å; S342-V361 WeakPolarHBondContact OG-CG1 3.44Å; I345-V361 HydrophobicContact CD1-CG2 3.75Å; L357-V361 WeakPolarHBondContact O-CG2 3.41Å; L357-V361 PolarHBondContact O-N 3.3Å; L358-V361 PolarHBondContact O-N 2.65Å; V361-D364 HydrophobicContact CG1-CB 4.49Å
362	G	93.3	Very high	94.8	Very high	22 Å²	22	38.7 Å²	38.7	23%	0.227	24%	0.236	C	C	.	.			trans	69.1	-158.7	178.1	0	0	0	0	0	113.4	L358 L360 D364	L358-G362 PolarHBondContact O-N 2.83Å; L360-G362 PolarHBondContact O-N 3.16Å; G362-D364 PolarHBondContact O-N 3.28Å
363	S	91.6	Very high	94.5	Very high	102 Å²	102	37.4 Å²	37.4	71%	0.713	23%	0.231	S	C	*	.			trans	-60.2	123.1	179.4	-174.1	0	0	0	0	111.1	K330	K330-S363 PolarHBondContact NZ-O 2.74Å
364	D	89.3	Confident	94.2	Very high	25 Å²	25	39.8 Å²	39.8	13%	0.134	25%	0.247	C	C	.	.			trans	-129.7	74.6	-176.4	-162	20.5	0	0	0	110.1	K330 T340 L341 S342 V361 G362	K330-D364 VanDerWaalsContact CE-CG 3.43Å; K330-D364 WeakPolarHBondContact CE-OD1 3.46Å; T340-D364 WeakPolarHBondContact CB-OD2 3.4Å; L341-D364 PolarHBondContact N-OD2 3.39Å; S342-D364 PolarHBondContact N-OD2 2.75Å; S342-D364 VanDerWaalsContact OG-CB 3.29Å; S342-D364 WeakPolarHBondContact OG-CB 3.46Å; S342-D364 PolarHBondContact OG-OD2 2.95Å; V361-D364 HydrophobicContact CG1-CB 4.49Å; G362-D364 PolarHBondContact O-N 3.28Å
365	P	75.9	Confident	93.8	Very high	133 Å²	133	37.9 Å²	37.9	86%	0.864	25%	0.246	S	C	*	.			trans	-72.7	0	-172.5	31.2	-35.8	0	0	0	113.5	K334	K334-P365 PolarHBondContact NZ-O 3.49Å; K334-P365 PolarHBondContact NZ-OXT 2.79Å

Retrieved 365 of 365 residues in 359.3 ms (Link to these results)

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